#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fy4 s VAL 17 N 0.00 4.84 -0.38 1.39 1.01 0.52 -3.90 120.40 123.87 1fy4 s VAL 17 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1fy4 s VAL 17 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.23 1fy4 s VAL 17 CO 0.00 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.22 1fy4 n GLY 18 N 3.09 0.64 2.32 4.51 0.00 -1.24 -1.77 105.19 112.75 1fy4 n GLY 18 Ca -0.17 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.81 1fy4 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fy4 n GLY 19 N -2.50 0.90 3.27 -0.02 0.00 -1.26 -4.88 105.19 100.70 1fy4 n GLY 19 Ca -0.04 -2.03 -0.15 0.00 0.00 0.00 0.00 46.02 43.80 1fy4 n GLY 19 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1fy4 s THR 20 N -1.65 1.00 0.22 2.61 -1.32 0.20 -4.93 115.64 111.77 1fy4 s THR 20 Ca 0.39 -2.03 -0.31 0.00 -1.21 0.00 0.00 61.69 58.53 1fy4 s THR 20 Cb -0.02 -2.06 -0.10 0.00 -1.51 0.00 0.00 72.50 68.81 1fy4 s THR 20 CO 0.26 -0.56 1.50 -0.44 -2.21 0.00 0.00 174.62 173.17 1fy4 s SER 21 N -3.21 6.60 0.53 8.08 0.01 -1.26 -0.94 113.70 123.52 1fy4 s SER 21 Ca 0.22 2.67 -0.20 0.00 1.31 0.00 0.00 55.95 59.95 1fy4 s SER 21 Cb 0.04 -2.61 -0.06 0.00 0.21 0.00 0.00 66.02 63.60 1fy4 s SER 21 CO 0.04 -0.77 1.12 0.00 0.41 0.00 0.00 173.24 174.04 1fy4 s ALA 22 N 0.44 2.72 0.26 1.44 0.00 -0.43 -4.81 121.76 121.40 1fy4 s ALA 22 Ca 0.64 0.81 -0.02 0.00 0.00 0.00 0.00 51.96 53.39 1fy4 s ALA 22 Cb -0.43 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 1fy4 s ALA 22 CO 0.39 -0.72 0.49 -1.12 0.00 0.00 0.00 175.76 174.79 1fy4 s SER 23 N -1.77 6.39 0.03 0.00 0.01 -1.26 -4.91 113.70 112.19 1fy4 s SER 23 Ca 0.72 0.53 -0.34 0.00 1.31 0.00 0.00 55.95 58.17 1fy4 s SER 23 Cb -0.23 -2.06 -0.13 0.00 0.21 0.00 0.00 66.02 63.81 1fy4 s SER 23 CO 0.27 -0.15 1.74 0.00 0.41 0.00 0.00 173.24 175.50 1fy4 n ALA 24 N -1.00 1.12 -0.58 1.44 0.00 -1.26 -1.98 120.51 118.25 1fy4 n ALA 24 Ca -0.04 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1fy4 n ALA 24 Cb 0.54 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.56 1fy4 n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fy4 n GLY 25 N 3.93 0.75 0.34 0.00 0.00 -1.26 -4.97 105.19 103.98 1fy4 n GLY 25 Ca 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.18 1fy4 n GLY 25 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1fy4 h ASP 26 N 0.00 1.00 -1.71 1.61 3.32 -1.79 -3.35 116.42 115.50 1fy4 h ASP 26 Ca 0.00 -0.13 -0.50 0.00 0.02 0.00 0.00 57.03 56.41 1fy4 h ASP 26 Cb 0.00 -0.26 -0.35 0.00 0.22 0.00 0.00 39.33 38.95 1fy4 h ASP 26 CO 0.00 0.87 -0.99 0.49 -1.72 0.00 0.00 179.24 177.89 1fy4 n PHE 27 N -4.30 -0.96 0.34 4.55 3.72 -1.26 -4.99 117.46 114.55 1fy4 n PHE 27 Ca 0.07 -3.21 0.21 0.00 -0.05 0.00 0.00 57.45 54.47 1fy4 n PHE 27 Cb 0.16 0.05 1.13 0.00 -0.94 0.00 0.00 39.48 39.88 1fy4 n PHE 27 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1fy4 h PRO 28 N 4.19 0.00 -0.01 -1.08 0.11 -1.81 0.27 132.00 133.67 1fy4 h PRO 28 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1fy4 h PRO 28 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1fy4 h PRO 28 CO 0.42 0.00 -0.22 1.97 -0.21 0.00 0.00 178.00 179.96 1fy4 n PHE 29 N -3.05 0.00 -2.47 0.65 1.16 -1.21 -1.52 117.46 111.03 1fy4 n PHE 29 Ca -0.03 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.17 1fy4 n PHE 29 Cb 0.15 -0.11 -0.04 0.00 -1.61 0.00 0.00 39.48 37.87 1fy4 n PHE 29 CO 0.00 0.00 0.00 -1.50 -1.87 0.00 0.00 176.76 173.39 1fy4 s ILE 30 N -2.43 3.52 0.07 1.97 2.07 0.94 -0.08 121.20 127.26 1fy4 s ILE 30 Ca 0.26 1.28 0.08 0.00 -1.41 0.00 0.00 60.65 60.86 1fy4 s ILE 30 Cb 0.19 -3.72 -0.03 0.00 0.13 0.00 0.00 42.46 39.04 1fy4 s ILE 30 CO 0.49 0.12 -0.21 0.68 -1.91 0.00 0.00 174.94 174.12 1fy4 s VAL 31 N -1.47 1.68 0.11 4.00 -7.23 -0.31 -4.25 120.40 112.92 1fy4 s VAL 31 Ca 0.54 -1.35 -0.10 0.00 -1.81 0.00 0.00 61.98 59.27 1fy4 s VAL 31 Cb -0.27 -1.49 -0.06 0.00 0.56 0.00 0.00 36.38 35.12 1fy4 s VAL 31 CO 0.34 0.08 0.43 -0.94 -0.31 0.00 0.00 175.10 174.70 1fy4 s SER 32 N -1.50 6.64 -0.20 4.85 1.04 -0.41 -1.18 113.70 122.94 1fy4 s SER 32 Ca 0.07 0.81 0.01 0.00 0.48 0.00 0.00 55.95 57.31 1fy4 s SER 32 Cb -0.09 -2.18 0.04 0.00 0.10 0.00 0.00 66.02 63.89 1fy4 s SER 32 CO 0.03 0.13 -0.09 -0.63 0.98 0.00 0.00 173.24 173.65 1fy4 s ILE 33 N -1.47 1.57 0.30 -1.02 1.01 0.17 -0.98 121.20 120.77 1fy4 s ILE 33 Ca 0.36 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 60.03 1fy4 s ILE 33 Cb -0.14 -1.67 -0.04 0.00 0.01 0.00 0.00 42.46 40.63 1fy4 s ILE 33 CO 0.19 0.14 0.49 -0.94 0.00 0.00 0.00 174.94 174.82 1fy4 s SER 34 N 1.42 6.33 -0.04 3.58 1.04 -0.11 -1.14 113.70 124.78 1fy4 s SER 34 Ca -0.01 0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.83 1fy4 s SER 34 Cb -0.16 -2.01 0.03 0.00 0.10 0.00 0.00 66.02 63.97 1fy4 s SER 34 CO -0.08 -0.20 -0.02 -0.60 0.98 0.00 0.00 173.24 173.32 1fy4 s ARG 35 N -4.00 0.56 -1.37 4.02 3.52 0.09 -1.84 118.95 119.93 1fy4 s ARG 35 Ca 0.39 0.02 -0.02 0.00 -0.13 0.00 0.00 55.73 55.99 1fy4 s ARG 35 Cb -0.10 -0.72 0.01 0.00 -1.56 0.00 0.00 34.95 32.58 1fy4 s ARG 35 CO 0.33 -0.15 0.17 0.09 -0.81 0.00 0.00 175.30 174.93 1fy4 n ASN 37 N 4.35 -4.79 0.00 -2.12 3.02 0.27 -1.65 115.26 114.34 1fy4 n ASN 37 Ca -0.21 -0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.31 1fy4 n ASN 37 Cb 0.50 -3.99 0.00 0.00 -0.61 0.00 0.00 39.78 35.68 1fy4 n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fy4 n GLY 38 N -1.04 0.94 3.59 7.41 0.00 -1.26 -5.02 105.19 109.82 1fy4 n GLY 38 Ca -0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1fy4 n GLY 38 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fy4 s GLY 39 N -1.90 2.14 0.57 -0.02 0.00 -0.66 -5.06 107.32 102.39 1fy4 s GLY 39 Ca 0.00 -2.03 -0.20 0.00 0.00 0.00 0.00 44.72 42.49 1fy4 s GLY 39 CO 0.00 -1.96 1.26 2.56 0.00 0.00 0.00 173.10 174.96 1fy4 s PRO 40 N -3.67 3.07 0.35 2.90 0.04 -1.26 -0.73 135.00 135.69 1fy4 s PRO 40 Ca 0.34 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1fy4 s PRO 40 Cb 0.01 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1fy4 s PRO 40 CO 0.18 -1.17 0.00 1.87 0.04 0.00 0.00 177.00 177.92 1fy4 n TRP 41 N -1.30 -3.25 -3.25 0.56 -0.00 -1.06 -4.62 117.44 104.52 1fy4 n TRP 41 Ca 0.12 0.83 -0.03 0.00 -0.00 0.00 0.00 57.50 58.42 1fy4 n TRP 41 Cb 0.48 1.69 0.01 0.00 -0.00 0.00 0.00 31.31 33.49 1fy4 n TRP 41 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1fy4 s GLY 43 N -1.60 2.92 0.20 0.00 0.00 0.13 -0.66 107.32 108.32 1fy4 s GLY 43 Ca 0.05 -0.73 -0.15 0.00 0.00 0.00 0.00 44.72 43.88 1fy4 s GLY 43 CO 0.04 -2.18 0.76 0.61 0.00 0.00 0.00 173.10 172.33 1fy4 n GLY 44 N -1.22 0.89 2.94 0.20 0.00 -0.32 -3.13 105.19 104.54 1fy4 n GLY 44 Ca -0.16 -1.14 -0.23 0.00 0.00 0.00 0.00 46.02 44.49 1fy4 n GLY 44 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fy4 s SER 45 N -2.84 1.51 -0.29 1.61 0.01 0.01 -1.16 113.70 112.55 1fy4 s SER 45 Ca 0.16 -0.22 -0.29 0.00 1.31 0.00 0.00 55.95 56.91 1fy4 s SER 45 Cb -0.03 -0.66 0.01 0.00 0.21 0.00 0.00 66.02 65.55 1fy4 s SER 45 CO 0.06 -0.04 1.07 -0.22 0.41 0.00 0.00 173.24 174.53 1fy4 s LEU 46 N 0.99 3.99 -0.06 2.44 2.96 0.89 -0.47 118.68 129.43 1fy4 s LEU 46 Ca -0.09 1.18 0.09 0.00 -0.22 0.00 0.00 54.13 55.08 1fy4 s LEU 46 Cb -0.15 -3.54 -0.24 0.00 0.50 0.00 0.00 46.19 42.77 1fy4 s LEU 46 CO 0.00 -0.81 0.61 0.18 -1.32 0.00 0.00 176.35 175.01 1fy4 n LEU 47 N 6.69 1.22 0.00 -0.68 4.77 0.11 -1.28 117.00 127.83 1fy4 n LEU 47 Ca 0.12 0.38 -0.03 0.00 -0.03 0.00 0.00 56.01 56.45 1fy4 n LEU 47 Cb 0.47 -0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.49 1fy4 n LEU 47 CO 0.57 0.48 0.57 -0.46 -1.33 0.00 0.00 177.39 177.21 1fy4 n ASN 48 N -3.13 -1.35 0.28 -1.43 0.23 -1.22 -4.44 115.26 104.20 1fy4 n ASN 48 Ca -0.20 -1.75 0.13 0.00 -0.53 0.00 0.00 54.58 52.23 1fy4 n ASN 48 Cb 1.05 2.20 0.79 0.00 -2.08 0.00 0.00 39.78 41.73 1fy4 n ASN 48 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1fy4 h ALA 49 N 2.00 1.52 0.00 -2.53 0.00 -1.96 -2.89 119.26 115.40 1fy4 h ALA 49 Ca -0.21 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1fy4 h ALA 49 Cb 0.89 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1fy4 h ALA 49 CO 0.28 0.07 -0.15 0.27 0.00 0.00 0.00 179.25 179.72 1fy4 n ASN 50 N -3.91 1.90 -3.78 0.00 6.94 -1.26 -0.41 115.26 114.74 1fy4 n ASN 50 Ca -0.03 -2.99 -0.14 0.00 -0.02 0.00 0.00 54.58 51.40 1fy4 n ASN 50 Cb 0.15 -0.40 -0.16 0.00 -2.36 0.00 0.00 39.78 37.01 1fy4 n ASN 50 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1fy4 s THR 51 N -2.42 -0.05 -0.03 5.53 2.01 -1.09 -0.83 115.64 118.76 1fy4 s THR 51 Ca 0.28 0.18 0.07 0.00 0.31 0.00 0.00 61.69 62.54 1fy4 s THR 51 Cb 0.25 -0.09 -0.02 0.00 0.01 0.00 0.00 72.50 72.66 1fy4 s THR 51 CO 0.01 0.07 -0.26 -0.69 -0.69 0.00 0.00 174.62 173.07 1fy4 s VAL 52 N 0.92 2.07 -0.19 3.82 1.01 -0.20 -0.72 120.40 127.12 1fy4 s VAL 52 Ca -0.08 -1.09 -0.11 0.00 0.00 0.00 0.00 61.98 60.70 1fy4 s VAL 52 Cb -0.11 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.51 1fy4 s VAL 52 CO -0.03 0.58 0.19 -0.22 0.00 0.00 0.00 175.10 175.62 1fy4 s LEU 53 N -0.51 4.21 0.00 3.92 2.96 0.38 -0.39 118.68 129.25 1fy4 s LEU 53 Ca 0.07 0.31 0.04 0.00 -0.22 0.00 0.00 54.13 54.32 1fy4 s LEU 53 Cb -0.11 -2.18 -0.01 0.00 0.50 0.00 0.00 46.19 44.38 1fy4 s LEU 53 CO 0.00 0.14 0.20 1.07 -1.32 0.00 0.00 176.35 176.44 1fy4 n THR 54 N 3.61 0.00 -2.71 3.68 5.66 -0.55 -0.81 114.28 123.16 1fy4 n THR 54 Ca -0.15 -1.44 -0.39 0.00 -3.05 0.00 0.00 64.05 59.03 1fy4 n THR 54 Cb 0.52 0.74 -0.06 0.00 -1.55 0.00 0.00 70.33 69.98 1fy4 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1fy4 s ALA 55 N -2.75 3.30 0.28 1.79 0.00 -1.26 -0.90 121.76 122.22 1fy4 s ALA 55 Ca 0.24 0.63 -0.01 0.00 0.00 0.00 0.00 51.96 52.82 1fy4 s ALA 55 Cb 0.01 -3.22 0.45 0.00 0.00 0.00 0.00 23.12 20.36 1fy4 s ALA 55 CO 0.17 0.13 1.90 0.00 0.00 0.00 0.00 175.76 177.95 1fy4 h ALA 56 N 3.73 1.44 0.00 0.00 0.00 -1.66 -2.00 119.26 120.77 1fy4 h ALA 56 Ca -0.46 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1fy4 h ALA 56 Cb 1.20 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1fy4 h ALA 56 CO 0.67 0.42 0.00 1.12 0.00 0.00 0.00 179.25 181.46 1fy4 h HIS 57 N 1.13 0.00 0.00 0.00 2.07 -1.93 0.20 115.15 116.62 1fy4 h HIS 57 Ca 0.41 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.87 1fy4 h HIS 57 Cb 0.16 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.13 1fy4 h HIS 57 CO -0.00 0.00 -0.27 0.00 -3.07 0.00 0.00 177.93 174.59 1fy4 n VAL 59 N -3.63 0.00 -2.24 0.00 0.24 -0.62 -4.97 118.33 107.11 1fy4 n VAL 59 Ca -0.01 -0.03 -0.41 0.00 -2.04 0.00 0.00 64.34 61.85 1fy4 n VAL 59 Cb 0.40 0.40 -0.03 0.00 -1.47 0.00 0.00 33.84 33.14 1fy4 n VAL 59 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1fy4 s SER 59 N -1.30 6.92 0.00 -1.34 0.15 0.61 -2.51 113.70 116.23 1fy4 s SER 59 Ca 0.00 2.37 0.00 0.00 0.70 0.00 0.00 55.95 59.02 1fy4 s SER 59 Cb 0.00 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1fy4 s SER 59 CO 0.00 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.54 1fy4 n GLY 59 N 2.35 0.82 3.59 9.45 0.00 -1.26 -4.95 105.19 115.19 1fy4 n GLY 59 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 1fy4 n GLY 59 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fy4 s TYR 59 N -3.25 2.66 0.12 1.61 2.02 -1.04 -5.08 117.35 114.38 1fy4 s TYR 59 Ca 0.00 -0.21 -0.31 0.00 -0.37 0.00 0.00 57.07 56.18 1fy4 s TYR 59 Cb 0.00 -1.30 -0.10 0.00 -0.40 0.00 0.00 41.96 40.16 1fy4 s TYR 59 CO 0.00 0.52 1.84 0.00 -1.57 0.00 0.00 175.55 176.34 1fy4 s ALA 59 N -1.73 3.75 0.30 3.71 0.00 -1.26 -4.86 121.76 121.66 1fy4 s ALA 59 Ca 0.25 1.44 0.24 0.00 0.00 0.00 0.00 51.96 53.89 1fy4 s ALA 59 Cb -0.09 -3.77 1.11 0.00 0.00 0.00 0.00 23.12 20.38 1fy4 s ALA 59 CO 0.16 -1.25 1.93 -0.56 0.00 0.00 0.00 175.76 176.04 1fy4 h GLN 60 N 8.74 0.00 0.00 0.00 3.07 -1.98 -2.29 115.11 122.65 1fy4 h GLN 60 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.28 1fy4 h GLN 60 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.78 1fy4 h GLN 60 CO 0.95 0.21 0.00 1.03 0.09 0.00 0.00 178.83 181.11 1fy4 h SER 61 N 0.00 0.00 0.91 0.06 0.87 -1.91 -2.50 113.55 110.98 1fy4 h SER 61 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1fy4 h SER 61 Cb 0.56 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 1fy4 h SER 61 CO 0.03 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.94 1fy4 n GLY 62 N -0.64 -1.36 3.88 5.77 0.00 -0.86 -4.85 105.19 107.12 1fy4 n GLY 62 Ca -0.01 0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1fy4 n GLY 62 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fy4 s PHE 63 N -3.16 3.58 -0.01 1.61 0.08 -0.94 -0.56 117.98 118.57 1fy4 s PHE 63 Ca 0.08 0.62 0.01 0.00 0.12 0.00 0.00 56.93 57.75 1fy4 s PHE 63 Cb 0.11 -2.03 0.01 0.00 -0.57 0.00 0.00 43.02 40.54 1fy4 s PHE 63 CO 0.44 0.59 -0.02 -1.14 -0.10 0.00 0.00 175.22 174.99 1fy4 s GLN 64 N -1.79 0.24 -0.02 0.44 0.74 -0.77 -4.22 119.66 114.27 1fy4 s GLN 64 Ca 0.29 -0.05 -0.02 0.00 0.05 0.00 0.00 55.36 55.63 1fy4 s GLN 64 Cb -0.13 -0.28 -0.04 0.00 1.10 0.00 0.00 33.01 33.65 1fy4 s GLN 64 CO 0.17 0.00 0.12 0.96 -0.55 0.00 0.00 175.29 175.99 1fy4 s ILE 65 N 0.25 5.05 -0.06 -2.34 -5.25 0.01 -0.93 121.20 117.93 1fy4 s ILE 65 Ca -0.02 -0.24 0.02 0.00 -0.99 0.00 0.00 60.65 59.41 1fy4 s ILE 65 Cb -0.05 -3.31 0.02 0.00 2.95 0.00 0.00 42.46 42.07 1fy4 s ILE 65 CO -0.01 0.38 -0.09 -0.60 -1.79 0.00 0.00 174.94 172.83 1fy4 s ARG 65 N -1.70 1.43 0.21 0.37 3.52 -0.15 -1.31 118.95 121.31 1fy4 s ARG 65 Ca 0.23 -0.30 0.11 0.00 -0.13 0.00 0.00 55.73 55.64 1fy4 s ARG 65 Cb -0.12 -1.27 -0.05 0.00 -1.56 0.00 0.00 34.95 31.96 1fy4 s ARG 65 CO 0.14 -0.04 -0.23 0.00 -0.81 0.00 0.00 175.30 174.36 1fy4 s ALA 66 N 0.87 2.55 -0.21 6.12 0.00 -0.00 -1.29 121.76 129.80 1fy4 s ALA 66 Ca -0.11 -1.68 0.00 0.00 0.00 0.00 0.00 51.96 50.17 1fy4 s ALA 66 Cb -0.15 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.66 1fy4 s ALA 66 CO 0.01 0.40 0.00 0.41 0.00 0.00 0.00 175.76 176.58 1fy4 n GLY 69 N 0.11 0.51 2.96 0.00 0.00 -1.26 -0.99 105.19 106.52 1fy4 n GLY 69 Ca -0.11 -0.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.81 1fy4 n GLY 69 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fy4 s SER 70 N -2.97 0.02 0.41 1.61 0.15 -1.26 -4.17 113.70 107.49 1fy4 s SER 70 Ca 0.00 -0.06 0.21 0.00 0.70 0.00 0.00 55.95 56.80 1fy4 s SER 70 Cb 0.00 0.12 0.86 0.00 -1.71 0.00 0.00 66.02 65.29 1fy4 s SER 70 CO 0.00 -0.12 1.81 -0.07 1.20 0.00 0.00 173.24 176.07 1fy4 h LEU 71 N 5.57 0.00 -9.78 3.45 3.38 -1.95 -3.44 115.31 112.54 1fy4 h LEU 71 Ca -0.27 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.16 1fy4 h LEU 71 Cb 1.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 1fy4 h LEU 71 CO 0.45 0.30 0.07 -0.55 0.09 0.00 0.00 178.44 178.80 1fy4 s SER 72 N -6.37 7.12 0.01 -0.43 0.15 -1.26 -0.99 113.70 111.94 1fy4 s SER 72 Ca -0.00 1.40 0.27 0.00 0.70 0.00 0.00 55.95 58.31 1fy4 s SER 72 Cb 0.11 -2.41 0.80 0.00 -1.71 0.00 0.00 66.02 62.81 1fy4 s SER 72 CO 0.66 0.15 1.62 -2.11 1.20 0.00 0.00 173.24 174.77 1fy4 n ARG 73 N 1.22 0.02 -0.03 5.44 1.85 -0.54 -4.23 116.66 120.40 1fy4 n ARG 73 Ca -0.06 0.01 0.05 0.00 -1.00 0.00 0.00 57.85 56.85 1fy4 n ARG 73 Cb 0.50 -1.52 -0.13 0.00 -1.05 0.00 0.00 32.46 30.26 1fy4 n ARG 73 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1fy4 n THR 74 N -1.55 0.28 -3.70 8.89 -2.24 -1.26 -4.96 114.28 109.74 1fy4 n THR 74 Ca 0.06 -0.47 -0.12 0.00 -2.27 0.00 0.00 64.05 61.25 1fy4 n THR 74 Cb 0.34 -0.07 -0.07 0.00 -2.10 0.00 0.00 70.33 68.44 1fy4 n THR 74 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1fy4 s SER 75 N -4.26 -0.22 0.00 3.42 0.01 -1.26 -5.14 113.70 106.25 1fy4 s SER 75 Ca -0.07 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.09 1fy4 s SER 75 Cb 0.10 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.73 1fy4 s SER 75 CO 0.71 -0.66 0.00 0.61 0.41 0.00 0.00 173.24 174.31 1fy4 n GLY 76 N 0.48 -0.96 7.00 3.44 0.00 -1.26 -4.39 105.19 109.50 1fy4 n GLY 76 Ca -0.18 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1fy4 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fy4 n GLY 80 N -1.09 0.24 3.13 -0.02 0.00 -1.26 -4.76 105.19 101.44 1fy4 n GLY 80 Ca 0.00 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 1fy4 n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fy4 s ILE 81 N 0.00 1.45 0.25 -0.61 1.01 -0.17 -4.95 121.20 118.18 1fy4 s ILE 81 Ca 0.00 -0.72 0.09 0.00 0.00 0.00 0.00 60.65 60.02 1fy4 s ILE 81 Cb 0.00 -1.26 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 1fy4 s ILE 81 CO 0.00 0.42 0.02 0.42 0.00 0.00 0.00 174.94 175.80 1fy4 s THR 82 N 0.09 3.59 -0.05 2.92 -4.23 -1.26 -0.82 115.64 115.88 1fy4 s THR 82 Ca -0.05 -1.79 -0.15 0.00 -1.18 0.00 0.00 61.69 58.52 1fy4 s THR 82 Cb -0.12 -2.90 0.03 0.00 1.34 0.00 0.00 72.50 70.84 1fy4 s THR 82 CO 0.03 -0.33 0.34 -0.55 -0.54 0.00 0.00 174.62 173.56 1fy4 s SER 83 N -3.58 -0.26 0.91 3.99 0.15 -0.43 -4.87 113.70 109.61 1fy4 s SER 83 Ca 0.31 0.28 -0.14 0.00 0.70 0.00 0.00 55.95 57.10 1fy4 s SER 83 Cb -0.07 0.43 0.17 0.00 -1.71 0.00 0.00 66.02 64.85 1fy4 s SER 83 CO 0.20 -0.37 1.26 -0.44 1.20 0.00 0.00 173.24 175.09 1fy4 s SER 84 N -0.93 3.47 -0.10 5.45 0.01 -1.26 -0.81 113.70 119.53 1fy4 s SER 84 Ca -0.10 0.27 -0.06 0.00 1.31 0.00 0.00 55.95 57.37 1fy4 s SER 84 Cb -0.04 -0.42 -0.04 0.00 0.21 0.00 0.00 66.02 65.73 1fy4 s SER 84 CO 0.04 -2.51 0.14 -0.76 0.41 0.00 0.00 173.24 170.56 1fy4 s LEU 85 N -5.75 4.34 -0.14 2.44 1.43 -1.26 -1.20 118.68 118.53 1fy4 s LEU 85 Ca 0.71 0.43 0.12 0.00 -1.03 0.00 0.00 54.13 54.36 1fy4 s LEU 85 Cb -0.05 -2.14 -0.24 0.00 0.03 0.00 0.00 46.19 43.79 1fy4 s LEU 85 CO 0.51 0.38 0.29 -0.24 0.23 0.00 0.00 176.35 177.53 1fy4 n SER 86 N 1.82 0.74 -3.63 2.29 2.88 0.61 -4.64 113.62 113.69 1fy4 n SER 86 Ca -0.18 0.16 -0.09 0.00 -1.33 0.00 0.00 58.87 57.42 1fy4 n SER 86 Cb 0.55 0.27 -0.02 0.00 -0.75 0.00 0.00 64.21 64.26 1fy4 n SER 86 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1fy4 s SER 87 N -5.97 -0.41 -0.02 -3.46 1.04 -1.19 -4.98 113.70 98.71 1fy4 s SER 87 Ca -0.12 -0.28 0.01 0.00 0.48 0.00 0.00 55.95 56.04 1fy4 s SER 87 Cb 0.07 0.64 0.02 0.00 0.10 0.00 0.00 66.02 66.85 1fy4 s SER 87 CO 0.80 -1.11 -0.01 -0.69 0.98 0.00 0.00 173.24 173.21 1fy4 s VAL 88 N -3.77 0.19 -0.11 5.02 1.01 -1.26 -1.26 120.40 120.23 1fy4 s VAL 88 Ca 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 1fy4 s VAL 88 Cb -0.03 -0.26 0.03 0.00 0.00 0.00 0.00 36.38 36.13 1fy4 s VAL 88 CO -0.03 0.12 -0.01 -0.60 0.00 0.00 0.00 175.10 174.58 1fy4 s ARG 89 N 0.73 0.85 0.33 2.72 6.06 -0.05 -5.01 118.95 124.59 1fy4 s ARG 89 Ca -0.07 -0.11 -0.05 0.00 -2.50 0.00 0.00 55.73 53.00 1fy4 s ARG 89 Cb -0.10 -1.39 -0.05 0.00 0.06 0.00 0.00 34.95 33.47 1fy4 s ARG 89 CO -0.01 -0.37 0.61 0.08 -2.50 0.00 0.00 175.30 173.10 1fy4 s VAL 90 N 1.88 4.99 0.28 7.11 1.01 -1.26 -0.48 120.40 133.93 1fy4 s VAL 90 Ca 0.03 0.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.78 1fy4 s VAL 90 Cb -0.13 -3.77 -0.13 0.00 0.00 0.00 0.00 36.38 32.35 1fy4 s VAL 90 CO -0.07 -0.44 1.28 1.57 0.00 0.00 0.00 175.10 177.44 1fy4 n HIS 91 N -1.26 2.01 0.28 5.22 -0.00 -0.37 -4.82 115.22 116.28 1fy4 n HIS 91 Ca -0.01 0.54 0.14 0.00 0.46 0.00 0.00 57.72 58.85 1fy4 n HIS 91 Cb 0.54 -2.40 0.68 0.00 -0.12 0.00 0.00 29.99 28.70 1fy4 n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1fy4 h PRO 92 N 3.12 0.00 -0.31 1.57 0.13 -1.92 -1.17 132.00 133.42 1fy4 h PRO 92 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1fy4 h PRO 92 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1fy4 h PRO 92 CO 0.68 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.88 1fy4 n SER 93 N -2.52 4.11 -4.63 1.44 7.64 -1.26 -4.99 113.62 113.42 1fy4 n SER 93 Ca -0.00 -2.95 -0.49 0.00 1.01 0.00 0.00 58.87 56.44 1fy4 n SER 93 Cb 0.14 -0.55 -0.05 0.00 -1.01 0.00 0.00 64.21 62.74 1fy4 n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fy4 n TYR 94 N -0.27 1.90 -3.65 1.43 9.36 -0.44 -4.64 117.16 120.85 1fy4 n TYR 94 Ca 0.22 0.45 -0.06 0.00 3.32 0.00 0.00 57.90 61.83 1fy4 n TYR 94 Cb 0.91 -2.44 -0.06 0.00 -0.63 0.00 0.00 39.34 37.12 1fy4 n TYR 94 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1fy4 s SER 95 N 0.76 -0.95 1.16 2.98 0.15 -0.96 -5.03 113.70 111.81 1fy4 s SER 95 Ca 0.82 1.48 0.00 0.00 0.70 0.00 0.00 55.95 58.95 1fy4 s SER 95 Cb -0.82 1.61 0.00 0.00 -1.71 0.00 0.00 66.02 65.10 1fy4 s SER 95 CO 0.43 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 175.25 1fy4 n GLY 96 N 4.68 3.20 0.05 9.45 0.00 -1.26 -1.62 105.19 119.69 1fy4 n GLY 96 Ca -0.18 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 45.95 1fy4 n GLY 96 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fy4 n ASN 99 N 3.54 0.43 -4.79 1.61 5.03 -1.26 -4.93 115.26 114.89 1fy4 n ASN 99 Ca 0.00 -0.21 -0.38 0.00 0.87 0.00 0.00 54.58 54.87 1fy4 n ASN 99 Cb 0.00 -0.01 -0.06 0.00 -1.02 0.00 0.00 39.78 38.69 1fy4 n ASN 99 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1fy4 s ASN 100 N -2.83 7.26 -1.25 6.41 2.47 -0.64 -4.12 114.94 122.24 1fy4 s ASN 100 Ca 0.17 1.60 -0.00 0.00 0.42 0.00 0.00 52.86 55.04 1fy4 s ASN 100 Cb 0.19 -2.48 0.00 0.00 -1.45 0.00 0.00 41.25 37.50 1fy4 s ASN 100 CO 0.59 0.10 0.88 0.59 -3.72 0.00 0.00 177.10 175.55 1fy4 n ASN 101 N 1.10 -1.76 -3.58 -4.21 3.02 -1.26 -2.26 115.26 106.31 1fy4 n ASN 101 Ca -0.03 -0.70 -0.41 0.00 -0.03 0.00 0.00 54.58 53.41 1fy4 n ASN 101 Cb 0.50 -4.70 -0.00 0.00 -0.61 0.00 0.00 39.78 34.96 1fy4 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1fy4 n ASP 102 N -3.10 7.32 -4.13 6.41 2.03 -1.26 -4.19 116.55 119.63 1fy4 n ASP 102 Ca -0.29 -3.14 -0.16 0.00 0.52 0.00 0.00 54.79 51.72 1fy4 n ASP 102 Cb 0.67 -1.39 -0.12 0.00 -0.72 0.00 0.00 41.12 39.57 1fy4 n ASP 102 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1fy4 s LEU 103 N -1.67 2.28 0.01 -2.67 1.43 -1.26 -2.69 118.68 114.11 1fy4 s LEU 103 Ca 0.50 -0.61 -0.03 0.00 -1.03 0.00 0.00 54.13 52.96 1fy4 s LEU 103 Cb 0.16 -0.36 -0.01 0.00 0.03 0.00 0.00 46.19 46.02 1fy4 s LEU 103 CO -0.07 -0.14 0.05 0.00 0.23 0.00 0.00 176.35 176.42 1fy4 s ALA 104 N -1.43 -0.09 -0.21 4.21 0.00 -0.08 -1.24 121.76 122.92 1fy4 s ALA 104 Ca -0.04 -0.31 -0.07 0.00 0.00 0.00 0.00 51.96 51.53 1fy4 s ALA 104 Cb -0.09 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 1fy4 s ALA 104 CO 0.01 -0.16 0.06 0.42 0.00 0.00 0.00 175.76 176.09 1fy4 s ILE 105 N -1.24 4.59 -0.13 0.00 -1.09 0.36 -1.48 121.20 122.21 1fy4 s ILE 105 Ca -0.13 -0.09 -0.03 0.00 -2.23 0.00 0.00 60.65 58.16 1fy4 s ILE 105 Cb -0.08 -3.10 -0.03 0.00 -1.58 0.00 0.00 42.46 37.68 1fy4 s ILE 105 CO 0.00 0.41 -0.04 -0.76 -1.23 0.00 0.00 174.94 173.32 1fy4 s LEU 106 N 0.87 3.28 -0.13 2.97 1.43 0.47 -0.87 118.68 126.70 1fy4 s LEU 106 Ca 0.04 -0.07 -0.07 0.00 -1.03 0.00 0.00 54.13 53.00 1fy4 s LEU 106 Cb -0.14 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 1fy4 s LEU 106 CO 0.02 0.23 0.12 -0.54 0.23 0.00 0.00 176.35 176.41 1fy4 s LYS 107 N -0.01 3.50 -0.07 1.70 -0.14 -0.39 -1.03 119.74 123.31 1fy4 s LYS 107 Ca 0.01 -0.18 -0.12 0.00 -1.36 0.00 0.00 55.97 54.32 1fy4 s LYS 107 Cb -0.13 -3.17 -0.05 0.00 -1.68 0.00 0.00 37.83 32.80 1fy4 s LYS 107 CO 0.03 0.69 0.30 -0.51 -0.76 0.00 0.00 175.35 175.10 1fy4 s LEU 108 N -0.78 4.41 0.42 3.17 1.43 -0.01 -0.29 118.68 127.04 1fy4 s LEU 108 Ca 0.13 0.72 0.20 0.00 -1.03 0.00 0.00 54.13 54.16 1fy4 s LEU 108 Cb -0.12 -2.38 0.94 0.00 0.03 0.00 0.00 46.19 44.66 1fy4 s LEU 108 CO 0.03 0.31 1.87 0.28 0.23 0.00 0.00 176.35 179.07 1fy4 h SER 109 N 5.14 0.00 -3.14 2.29 0.02 -1.42 -3.42 113.55 113.02 1fy4 h SER 109 Ca -0.51 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 59.85 1fy4 h SER 109 Cb 1.21 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 63.39 1fy4 h SER 109 CO 0.63 0.28 -0.83 -0.89 -1.14 0.00 0.00 176.83 174.88 1fy4 s THR 110 N -3.97 1.47 0.43 -2.27 2.01 -1.26 -5.00 115.64 107.05 1fy4 s THR 110 Ca -0.02 -0.57 -0.24 0.00 0.31 0.00 0.00 61.69 61.17 1fy4 s THR 110 Cb 0.13 -1.39 -0.08 0.00 0.01 0.00 0.00 72.50 71.16 1fy4 s THR 110 CO 0.66 0.44 1.18 -0.44 -0.69 0.00 0.00 174.62 175.77 1fy4 s SER 111 N 1.49 6.32 -0.23 3.53 0.01 -1.26 -4.81 113.70 118.75 1fy4 s SER 111 Ca 0.04 2.34 0.02 0.00 1.31 0.00 0.00 55.95 59.66 1fy4 s SER 111 Cb -0.13 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.53 1fy4 s SER 111 CO -0.10 -0.81 -0.13 -0.63 0.41 0.00 0.00 173.24 171.97 1fy4 s ILE 112 N -1.47 2.21 0.46 1.44 1.01 0.45 -5.01 121.20 120.29 1fy4 s ILE 112 Ca 0.60 -1.34 -0.20 0.00 0.00 0.00 0.00 60.65 59.71 1fy4 s ILE 112 Cb -0.30 -2.16 -0.10 0.00 0.01 0.00 0.00 42.46 39.91 1fy4 s ILE 112 CO 0.37 0.18 0.98 -2.16 0.00 0.00 0.00 174.94 174.31 1fy4 s PRO 113 N 1.19 4.08 0.56 2.79 0.04 -1.26 -4.28 135.00 138.11 1fy4 s PRO 113 Ca -0.03 1.14 -0.16 0.00 0.04 0.00 0.00 61.00 62.00 1fy4 s PRO 113 Cb -0.17 -2.15 -0.06 0.00 0.04 0.00 0.00 34.50 32.16 1fy4 s PRO 113 CO -0.08 -0.17 1.02 0.45 0.04 0.00 0.00 177.00 178.27 1fy4 s SER 114 N -2.29 6.23 0.00 6.66 0.15 -1.26 -4.86 113.70 118.32 1fy4 s SER 114 Ca 0.63 1.66 0.00 0.00 0.70 0.00 0.00 55.95 58.93 1fy4 s SER 114 Cb -0.11 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1fy4 s SER 114 CO 0.18 -0.86 0.00 0.61 1.20 0.00 0.00 173.24 174.37 1fy4 n GLY 115 N -1.44 4.36 7.00 9.45 0.00 0.13 -5.00 105.19 119.69 1fy4 n GLY 115 Ca 0.07 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.67 1fy4 n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fy4 n GLY 116 N -1.82 2.67 1.05 -0.02 0.00 -1.26 -1.81 105.19 104.00 1fy4 n GLY 116 Ca 0.00 -0.34 0.04 0.00 0.00 0.00 0.00 46.02 45.71 1fy4 n GLY 116 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fy4 n ASN 117 N 3.86 2.95 -4.42 1.61 3.02 -1.26 -4.78 115.26 116.24 1fy4 n ASN 117 Ca 0.00 -2.34 -0.33 0.00 -0.03 0.00 0.00 54.58 51.88 1fy4 n ASN 117 Cb 0.00 -0.51 -0.14 0.00 -0.61 0.00 0.00 39.78 38.52 1fy4 n ASN 117 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1fy4 s ILE 118 N -1.77 3.01 0.29 2.41 1.01 -0.75 -4.45 121.20 120.95 1fy4 s ILE 118 Ca 0.25 -0.71 -0.01 0.00 0.00 0.00 0.00 60.65 60.18 1fy4 s ILE 118 Cb 0.18 -2.21 0.00 0.00 0.01 0.00 0.00 42.46 40.44 1fy4 s ILE 118 CO 0.09 0.56 0.39 0.61 0.00 0.00 0.00 174.94 176.59 1fy4 n GLY 119 N 2.92 2.35 3.56 6.18 0.00 -0.57 -0.70 105.19 118.94 1fy4 n GLY 119 Ca -0.18 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 43.94 1fy4 n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fy4 s TYR 120 N -3.25 2.71 0.18 1.61 2.02 -1.26 -3.31 117.35 116.06 1fy4 s TYR 120 Ca 0.25 -0.17 -0.30 0.00 -0.37 0.00 0.00 57.07 56.48 1fy4 s TYR 120 Cb -0.01 -1.43 -0.08 0.00 -0.40 0.00 0.00 41.96 40.05 1fy4 s TYR 120 CO 0.18 0.41 1.20 0.00 -1.57 0.00 0.00 175.55 175.78 1fy4 s ALA 121 N -1.19 3.44 -0.20 3.71 0.00 -0.40 -4.83 121.76 122.29 1fy4 s ALA 121 Ca 0.21 0.95 -0.22 0.00 0.00 0.00 0.00 51.96 52.90 1fy4 s ALA 121 Cb -0.11 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 1fy4 s ALA 121 CO 0.13 -0.39 0.70 0.50 0.00 0.00 0.00 175.76 176.70 1fy4 s ARG 122 N -0.13 4.23 0.07 0.00 3.52 -1.26 -4.91 118.95 120.47 1fy4 s ARG 122 Ca 0.54 0.75 -0.11 0.00 -0.13 0.00 0.00 55.73 56.77 1fy4 s ARG 122 Cb -0.33 -3.59 -0.06 0.00 -1.56 0.00 0.00 34.95 29.42 1fy4 s ARG 122 CO 0.36 -0.30 0.42 -0.51 -0.81 0.00 0.00 175.30 174.46 1fy4 s LEU 123 N 2.09 4.37 0.46 -0.88 1.43 -1.26 -0.45 118.68 124.44 1fy4 s LEU 123 Ca 0.32 0.86 -0.23 0.00 -1.03 0.00 0.00 54.13 54.05 1fy4 s LEU 123 Cb -0.16 -2.93 -0.10 0.00 0.03 0.00 0.00 46.19 43.03 1fy4 s LEU 123 CO 0.11 0.20 0.96 0.00 0.23 0.00 0.00 176.35 177.84 1fy4 n ALA 124 N 1.08 0.06 -1.73 4.21 0.00 0.38 -4.82 120.51 119.71 1fy4 n ALA 124 Ca -0.09 0.18 -0.39 0.00 0.00 0.00 0.00 53.44 53.14 1fy4 n ALA 124 Cb 0.52 -2.06 0.04 0.00 0.00 0.00 0.00 19.45 17.95 1fy4 n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fy4 n ALA 125 N -0.77 1.43 -1.67 0.00 0.00 -1.26 -4.53 120.51 113.71 1fy4 n ALA 125 Ca 0.10 0.14 -0.43 0.00 0.00 0.00 0.00 53.44 53.25 1fy4 n ALA 125 Cb 0.41 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.50 1fy4 n ALA 125 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1fy4 n SER 126 N -0.78 4.07 0.00 0.00 2.88 -1.26 -1.54 113.62 116.98 1fy4 n SER 126 Ca 0.10 0.92 0.00 0.00 -1.33 0.00 0.00 58.87 58.56 1fy4 n SER 126 Cb 0.44 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 1fy4 n SER 126 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1fy4 n GLY 127 N 4.49 0.63 3.80 0.46 0.00 -0.42 -5.04 105.19 109.11 1fy4 n GLY 127 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1fy4 n GLY 127 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fy4 s SER 128 N -2.55 5.39 -0.07 1.61 1.04 -0.59 -4.94 113.70 113.58 1fy4 s SER 128 Ca 0.00 1.79 -0.03 0.00 0.48 0.00 0.00 55.95 58.19 1fy4 s SER 128 Cb 0.00 -2.52 0.04 0.00 0.10 0.00 0.00 66.02 63.64 1fy4 s SER 128 CO 0.00 -1.44 0.14 -0.62 0.98 0.00 0.00 173.24 172.31 1fy4 s ASP 129 N -3.13 0.53 0.22 7.02 2.15 -1.26 -4.25 116.67 117.96 1fy4 s ASP 129 Ca 0.62 0.29 -0.32 0.00 0.43 0.00 0.00 52.55 53.58 1fy4 s ASP 129 Cb -0.16 0.20 -0.12 0.00 -0.30 0.00 0.00 42.92 42.54 1fy4 s ASP 129 CO 0.45 -0.22 1.70 -2.65 -0.17 0.00 0.00 175.17 174.29 1fy4 n PRO 130 N 4.99 2.76 -2.46 4.34 -0.02 -1.26 -4.91 135.00 138.43 1fy4 n PRO 130 Ca -0.11 0.99 -0.41 0.00 -2.02 0.00 0.00 63.50 61.95 1fy4 n PRO 130 Cb 0.50 -2.82 -0.04 0.00 -0.02 0.00 0.00 33.50 31.12 1fy4 n PRO 130 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1fy4 s VAL 131 N 0.93 3.86 0.21 -1.45 1.01 -1.26 -4.94 120.40 118.77 1fy4 s VAL 131 Ca 0.73 1.51 -0.32 0.00 0.00 0.00 0.00 61.98 63.90 1fy4 s VAL 131 Cb -0.51 -3.96 -0.14 0.00 0.00 0.00 0.00 36.38 31.77 1fy4 s VAL 131 CO 0.36 0.21 1.33 0.00 0.00 0.00 0.00 175.10 177.00 1fy4 n ALA 132 N 2.87 0.47 -0.19 5.51 0.00 -1.26 0.25 120.51 128.17 1fy4 n ALA 132 Ca 0.05 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1fy4 n ALA 132 Cb 0.46 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.72 1fy4 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fy4 n GLY 133 N 2.17 2.17 3.77 0.00 0.00 0.84 -4.90 105.19 109.23 1fy4 n GLY 133 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1fy4 n GLY 133 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fy4 s SER 134 N -3.50 4.86 -0.05 1.61 1.04 0.70 -4.67 113.70 113.68 1fy4 s SER 134 Ca 0.00 1.90 -0.18 0.00 0.48 0.00 0.00 55.95 58.15 1fy4 s SER 134 Cb 0.00 -2.54 -0.05 0.00 0.10 0.00 0.00 66.02 63.54 1fy4 s SER 134 CO 0.00 -1.80 0.50 -0.44 0.98 0.00 0.00 173.24 172.48 1fy4 s SER 135 N -2.99 6.81 0.14 7.02 0.01 -1.26 -0.83 113.70 122.60 1fy4 s SER 135 Ca 0.64 0.97 0.06 0.00 1.31 0.00 0.00 55.95 58.93 1fy4 s SER 135 Cb -0.19 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.70 1fy4 s SER 135 CO 0.48 0.11 -0.15 0.00 0.41 0.00 0.00 173.24 174.09 1fy4 s ALA 136 N -0.03 1.62 -0.07 1.44 0.00 -0.19 -2.83 121.76 121.69 1fy4 s ALA 136 Ca 0.27 -1.36 0.02 0.00 0.00 0.00 0.00 51.96 50.90 1fy4 s ALA 136 Cb -0.17 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 22.88 1fy4 s ALA 136 CO 0.13 0.12 -0.13 0.99 0.00 0.00 0.00 175.76 176.87 1fy4 s THR 137 N -2.22 1.24 0.11 0.00 2.01 0.45 -0.82 115.64 116.41 1fy4 s THR 137 Ca 0.11 -0.53 0.10 0.00 0.31 0.00 0.00 61.69 61.68 1fy4 s THR 137 Cb -0.04 -1.13 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 1fy4 s THR 137 CO 0.04 0.38 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.42 1fy4 s VAL 138 N 0.69 2.46 0.02 3.82 1.01 -0.27 0.11 120.40 128.23 1fy4 s VAL 138 Ca -0.14 -1.58 -0.04 0.00 0.00 0.00 0.00 61.98 60.22 1fy4 s VAL 138 Cb -0.16 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.13 1fy4 s VAL 138 CO 0.04 0.15 0.05 0.00 0.00 0.00 0.00 175.10 175.34 1fy4 s ALA 139 N -1.04 -0.03 0.00 5.51 0.00 -1.05 -1.12 121.76 124.03 1fy4 s ALA 139 Ca 0.15 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1fy4 s ALA 139 Cb -0.10 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1fy4 s ALA 139 CO 0.07 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.01 1fy4 n GLY 140 N 1.24 -1.50 0.83 0.00 0.00 -0.44 -4.20 105.19 101.13 1fy4 n GLY 140 Ca -0.22 -1.04 0.09 0.00 0.00 0.00 0.00 46.02 44.85 1fy4 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1fy4 n TRP 141 N 0.78 0.86 -1.64 1.61 8.01 -1.26 -1.86 117.44 123.94 1fy4 n TRP 141 Ca 0.00 -0.86 -0.30 0.00 -1.31 0.00 0.00 57.50 55.03 1fy4 n TRP 141 Cb 0.00 -0.29 0.19 0.00 -2.01 0.00 0.00 31.31 29.20 1fy4 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1fy4 s GLY 142 N -1.93 1.70 0.53 6.99 0.00 -1.25 -4.13 107.32 109.22 1fy4 s GLY 142 Ca 0.40 -1.04 -0.21 0.00 0.00 0.00 0.00 44.72 43.87 1fy4 s GLY 142 CO 0.09 -0.27 1.18 0.00 0.00 0.00 0.00 173.10 174.10 1fy4 n ALA 143 N -4.04 0.91 1.06 3.20 0.00 -0.46 -2.87 120.51 118.31 1fy4 n ALA 143 Ca 0.14 0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.81 1fy4 n ALA 143 Cb 0.59 -2.23 0.10 0.00 0.00 0.00 0.00 19.45 17.91 1fy4 n ALA 143 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1fy4 n THR 144 N -1.08 0.00 -4.44 0.00 -2.24 -1.25 -1.01 114.28 104.25 1fy4 n THR 144 Ca 0.11 -0.13 -0.20 0.00 -2.27 0.00 0.00 64.05 61.57 1fy4 n THR 144 Cb 0.44 0.84 -0.15 0.00 -2.10 0.00 0.00 70.33 69.37 1fy4 n THR 144 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1fy4 s SER 145 N -2.69 1.24 0.18 3.42 0.01 -1.26 -4.49 113.70 110.10 1fy4 s SER 145 Ca 0.16 -0.20 -0.33 0.00 1.31 0.00 0.00 55.95 56.88 1fy4 s SER 145 Cb 0.18 -0.13 -0.15 0.00 0.21 0.00 0.00 66.02 66.13 1fy4 s SER 145 CO 0.65 0.12 1.41 1.21 0.41 0.00 0.00 173.24 177.04 1fy4 n GLU 146 N 2.77 1.76 -1.25 12.44 2.13 -1.26 -1.08 120.64 136.15 1fy4 n GLU 146 Ca -0.14 0.63 -0.09 0.00 0.66 0.00 0.00 57.16 58.23 1fy4 n GLU 146 Cb 0.56 -2.30 -0.04 0.00 0.27 0.00 0.00 31.44 29.94 1fy4 n GLU 146 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1fy4 n GLY 147 N 2.59 1.03 3.82 8.31 0.00 -1.26 -5.01 105.19 114.68 1fy4 n GLY 147 Ca 0.15 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1fy4 n GLY 147 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fy4 s GLY 148 N -2.80 2.27 0.00 -0.02 0.00 -0.24 -4.94 107.32 101.59 1fy4 s GLY 148 Ca 0.00 0.38 0.27 0.00 0.00 0.00 0.00 44.72 45.37 1fy4 s GLY 148 CO 0.00 0.67 1.66 -1.14 0.00 0.00 0.00 173.10 174.29 1fy4 n SER 149 N -1.23 0.77 -3.65 1.64 3.41 -1.26 -4.87 113.62 108.43 1fy4 n SER 149 Ca 0.08 -0.69 -0.14 0.00 -0.26 0.00 0.00 58.87 57.85 1fy4 n SER 149 Cb 0.53 0.06 -0.07 0.00 -0.26 0.00 0.00 64.21 64.48 1fy4 n SER 149 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1fy4 s SER 150 N -2.55 -0.36 0.02 4.04 1.04 -1.26 -5.17 113.70 109.46 1fy4 s SER 150 Ca 0.24 0.21 0.06 0.00 0.48 0.00 0.00 55.95 56.95 1fy4 s SER 150 Cb 0.19 0.43 -0.03 0.00 0.10 0.00 0.00 66.02 66.71 1fy4 s SER 150 CO 0.52 -0.60 -0.18 -0.89 0.98 0.00 0.00 173.24 173.08 1fy4 s THR 151 N -1.84 2.80 0.52 2.02 2.01 -1.26 -4.60 115.64 115.29 1fy4 s THR 151 Ca -0.09 -1.08 -0.21 0.00 0.31 0.00 0.00 61.69 60.62 1fy4 s THR 151 Cb -0.02 -2.15 -0.06 0.00 0.01 0.00 0.00 72.50 70.28 1fy4 s THR 151 CO 0.02 0.41 1.18 -2.16 -0.69 0.00 0.00 174.62 173.38 1fy4 s PRO 152 N -1.24 3.39 0.10 4.92 0.04 -1.26 -4.95 135.00 136.01 1fy4 s PRO 152 Ca 0.14 1.78 -0.11 0.00 0.04 0.00 0.00 61.00 62.84 1fy4 s PRO 152 Cb -0.10 -2.16 -0.15 0.00 0.04 0.00 0.00 34.50 32.13 1fy4 s PRO 152 CO 0.04 -0.86 1.28 0.28 0.04 0.00 0.00 177.00 177.79 1fy4 h VAL 153 N 1.39 1.29 -3.07 -0.36 2.07 -1.94 -3.46 116.25 112.17 1fy4 h VAL 153 Ca -0.50 -2.09 -0.65 0.00 0.82 0.00 0.00 66.70 64.28 1fy4 h VAL 153 Cb 1.27 2.13 -0.08 0.00 -1.52 0.00 0.00 31.29 33.09 1fy4 h VAL 153 CO 0.58 0.65 -0.57 0.20 0.02 0.00 0.00 177.57 178.46 1fy4 s ASN 154 N -7.15 5.78 0.33 0.57 0.01 -1.26 -1.46 114.94 111.76 1fy4 s ASN 154 Ca -0.09 0.14 -0.29 0.00 -0.71 0.00 0.00 52.86 51.90 1fy4 s ASN 154 Cb 0.08 -1.66 -0.11 0.00 0.41 0.00 0.00 41.25 39.97 1fy4 s ASN 154 CO 0.90 0.23 1.54 -0.22 -1.51 0.00 0.00 177.10 178.05 1fy4 s LEU 155 N -2.01 4.33 0.27 0.60 2.96 -0.16 -4.87 118.68 119.81 1fy4 s LEU 155 Ca 0.26 2.99 0.11 0.00 -0.22 0.00 0.00 54.13 57.27 1fy4 s LEU 155 Cb -0.12 -3.65 -0.05 0.00 0.50 0.00 0.00 46.19 42.87 1fy4 s LEU 155 CO 0.18 -0.89 -0.10 -0.76 -1.32 0.00 0.00 176.35 173.46 1fy4 s LEU 156 N -1.21 2.90 0.05 -0.68 1.43 -0.78 -1.31 118.68 119.08 1fy4 s LEU 156 Ca 0.58 -0.84 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1fy4 s LEU 156 Cb -0.47 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.32 1fy4 s LEU 156 CO 0.55 0.01 0.07 -1.59 0.23 0.00 0.00 176.35 175.62 1fy4 s LYS 157 N -3.60 0.63 -0.05 1.70 -2.85 -0.11 -1.32 119.74 114.13 1fy4 s LYS 157 Ca 0.31 -0.92 -0.14 0.00 -1.00 0.00 0.00 55.97 54.22 1fy4 s LYS 157 Cb -0.06 0.24 0.03 0.00 -2.06 0.00 0.00 37.83 35.98 1fy4 s LYS 157 CO 0.18 -0.15 0.33 0.54 0.10 0.00 0.00 175.35 176.34 1fy4 s VAL 158 N -3.15 0.04 -0.16 1.79 0.11 -0.28 -0.63 120.40 118.12 1fy4 s VAL 158 Ca -0.00 -0.33 -0.05 0.00 -2.93 0.00 0.00 61.98 58.67 1fy4 s VAL 158 Cb 0.02 -0.59 -0.03 0.00 -1.53 0.00 0.00 36.38 34.25 1fy4 s VAL 158 CO -0.07 -0.18 0.01 -0.89 -3.33 0.00 0.00 175.10 170.64 1fy4 s THR 159 N -0.88 4.34 0.03 5.04 2.01 -1.26 -1.12 115.64 123.79 1fy4 s THR 159 Ca -0.10 -0.20 -0.00 0.00 0.31 0.00 0.00 61.69 61.70 1fy4 s THR 159 Cb -0.04 -2.92 -0.02 0.00 0.01 0.00 0.00 72.50 69.52 1fy4 s THR 159 CO 0.03 0.49 -0.03 0.68 -0.69 0.00 0.00 174.62 175.10 1fy4 s VAL 160 N 0.28 0.15 0.39 3.82 -7.23 -0.00 -4.97 120.40 112.83 1fy4 s VAL 160 Ca 0.00 -1.09 -0.18 0.00 -1.81 0.00 0.00 61.98 58.90 1fy4 s VAL 160 Cb -0.13 -0.51 -0.10 0.00 0.56 0.00 0.00 36.38 36.20 1fy4 s VAL 160 CO 0.02 -0.59 0.86 -2.16 -0.31 0.00 0.00 175.10 172.91 1fy4 s PRO 161 N -1.94 4.11 0.33 4.82 0.04 -1.26 -1.03 135.00 140.08 1fy4 s PRO 161 Ca -0.11 0.92 -0.29 0.00 0.04 0.00 0.00 61.00 61.55 1fy4 s PRO 161 Cb -0.07 -2.28 -0.11 0.00 0.04 0.00 0.00 34.50 32.09 1fy4 s PRO 161 CO -0.03 0.03 1.42 0.42 0.04 0.00 0.00 177.00 178.88 1fy4 s ILE 162 N -2.13 2.41 -0.16 0.56 -1.09 -0.01 -1.44 121.20 119.36 1fy4 s ILE 162 Ca 0.58 0.40 -0.06 0.00 -2.23 0.00 0.00 60.65 59.35 1fy4 s ILE 162 Cb -0.10 -3.25 -0.04 0.00 -1.58 0.00 0.00 42.46 37.49 1fy4 s ILE 162 CO 0.16 0.09 0.04 -0.69 -1.23 0.00 0.00 174.94 173.30 1fy4 s VAL 163 N -0.86 4.57 0.61 2.92 1.01 -0.13 -0.11 120.40 128.42 1fy4 s VAL 163 Ca 0.53 -0.12 -0.19 0.00 0.00 0.00 0.00 61.98 62.20 1fy4 s VAL 163 Cb -0.43 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1fy4 s VAL 163 CO 0.55 0.50 1.20 -1.54 0.00 0.00 0.00 175.10 175.81 1fy4 n SER 164 N 3.19 1.77 -0.16 3.32 3.41 -1.26 -4.04 113.62 119.85 1fy4 n SER 164 Ca -0.17 0.85 0.03 0.00 -0.26 0.00 0.00 58.87 59.31 1fy4 n SER 164 Cb 0.53 -1.51 0.31 0.00 -0.26 0.00 0.00 64.21 63.28 1fy4 n SER 164 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1fy4 h ARG 165 N 0.68 0.83 -0.23 4.33 2.43 -1.95 0.09 114.38 120.56 1fy4 h ARG 165 Ca -0.50 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 58.62 1fy4 h ARG 165 Cb 1.34 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 1fy4 h ARG 165 CO 0.53 0.55 0.13 0.00 -1.51 0.00 0.00 179.97 179.67 1fy4 h ALA 166 N 1.60 0.30 -0.59 2.80 0.00 -1.99 0.55 119.26 121.92 1fy4 h ALA 166 Ca 0.25 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1fy4 h ALA 166 Cb -0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1fy4 h ALA 166 CO -0.06 -0.17 0.20 1.15 0.00 0.00 0.00 179.25 180.36 1fy4 h THR 167 N 0.27 1.24 -0.87 0.00 2.02 -1.77 -1.48 112.91 112.32 1fy4 h THR 167 Ca 0.08 -0.79 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 1fy4 h THR 167 Cb 0.06 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 1fy4 h THR 167 CO -0.01 0.30 0.52 0.00 0.37 0.00 0.00 175.52 176.69 1fy4 h ARG 169 N 1.20 0.37 -0.22 0.00 3.08 -0.65 -0.45 114.38 117.72 1fy4 h ARG 169 Ca 0.31 -0.11 -0.07 0.00 0.07 0.00 0.00 59.98 60.18 1fy4 h ARG 169 Cb -0.04 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1fy4 h ARG 169 CO -0.06 0.53 -0.19 0.00 -1.07 0.00 0.00 179.97 179.18 1fy4 h ALA 170 N 1.49 1.27 -0.08 0.04 0.00 -0.25 0.21 119.26 121.94 1fy4 h ALA 170 Ca 0.06 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 1fy4 h ALA 170 Cb 0.49 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1fy4 h ALA 170 CO 0.03 0.48 -0.33 1.96 0.00 0.00 0.00 179.25 181.39 1fy4 h GLN 171 N 0.35 0.37 0.00 0.00 4.20 -0.60 -3.40 115.11 116.04 1fy4 h GLN 171 Ca 0.06 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.48 1fy4 h GLN 171 Cb 0.54 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.37 1fy4 h GLN 171 CO 0.04 0.92 -1.54 0.66 -0.67 0.00 0.00 178.83 178.24 1fy4 n TYR 172 N -4.41 0.00 0.00 2.96 4.01 -0.24 -5.02 117.16 114.46 1fy4 n TYR 172 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 1fy4 n TYR 172 Cb 0.50 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 1fy4 n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fy4 n GLY 173 N 1.64 3.05 0.10 2.72 0.00 0.74 -4.66 105.19 108.78 1fy4 n GLY 173 Ca -0.02 -1.70 -0.10 0.00 0.00 0.00 0.00 46.02 44.21 1fy4 n GLY 173 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1fy4 h THR 173 N 0.00 1.01 0.00 2.61 2.02 -1.93 -2.74 112.91 113.88 1fy4 h THR 173 Ca 0.00 -0.07 -0.04 0.00 0.77 0.00 0.00 66.41 67.07 1fy4 h THR 173 Cb 0.00 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 1fy4 h THR 173 CO 0.00 0.04 -0.18 0.28 0.37 0.00 0.00 175.52 176.02 1fy4 h SER 174 N 0.20 0.00 0.59 4.18 0.02 -1.92 -3.28 113.55 113.34 1fy4 h SER 174 Ca 0.07 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.94 1fy4 h SER 174 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1fy4 h SER 174 CO -0.04 0.18 -0.40 0.00 -1.14 0.00 0.00 176.83 175.44 1fy4 h ALA 175 N 1.82 1.15 -3.10 3.77 0.00 -1.75 -3.39 119.26 117.75 1fy4 h ALA 175 Ca -0.00 -0.36 -0.69 0.00 0.00 0.00 0.00 54.91 53.86 1fy4 h ALA 175 Cb 0.86 -0.06 -0.28 0.00 0.00 0.00 0.00 17.79 18.31 1fy4 h ALA 175 CO 0.02 0.49 -0.62 0.42 0.00 0.00 0.00 179.25 179.57 1fy4 s ILE 176 N -3.86 3.83 0.58 0.00 -1.09 -1.23 -5.00 121.20 114.43 1fy4 s ILE 176 Ca -0.01 -0.93 0.05 0.00 -2.23 0.00 0.00 60.65 57.52 1fy4 s ILE 176 Cb 0.13 -3.07 0.07 0.00 -1.58 0.00 0.00 42.46 38.01 1fy4 s ILE 176 CO 0.70 -0.05 0.80 0.42 -1.23 0.00 0.00 174.94 175.59 1fy4 s THR 177 N 1.44 2.39 -1.76 2.92 -4.23 -1.26 -4.96 115.64 110.18 1fy4 s THR 177 Ca 0.00 -0.83 0.21 0.00 -1.18 0.00 0.00 61.69 59.89 1fy4 s THR 177 Cb -0.18 -2.56 0.50 0.00 1.34 0.00 0.00 72.50 71.60 1fy4 s THR 177 CO 0.02 0.00 1.64 0.59 -0.54 0.00 0.00 174.62 176.34 1fy4 n ASN 178 N -2.35 0.00 -1.23 3.99 4.13 -1.26 -2.07 115.26 116.47 1fy4 n ASN 178 Ca 0.13 -0.39 0.09 0.00 1.68 0.00 0.00 54.58 56.09 1fy4 n ASN 178 Cb 0.60 -0.12 0.29 0.00 -1.54 0.00 0.00 39.78 39.02 1fy4 n ASN 178 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1fy4 n GLN 179 N -1.12 3.27 -4.32 3.52 3.00 -1.26 -4.88 117.38 115.58 1fy4 n GLN 179 Ca 0.13 -2.65 -0.24 0.00 -0.01 0.00 0.00 57.00 54.23 1fy4 n GLN 179 Cb 0.11 -1.69 -0.12 0.00 0.00 0.00 0.00 30.24 28.54 1fy4 n GLN 179 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.06 175.42 1fy4 s MET 180 N -1.64 1.23 0.17 -1.09 -1.94 -0.88 -1.29 119.30 113.88 1fy4 s MET 180 Ca 0.43 -1.29 0.00 0.00 -1.71 0.00 0.00 55.69 53.12 1fy4 s MET 180 Cb 0.27 -1.46 -0.04 0.00 2.01 0.00 0.00 34.83 35.61 1fy4 s MET 180 CO 0.22 0.32 0.05 -0.59 -0.01 0.00 0.00 175.02 175.01 1fy4 s PHE 181 N -1.49 1.14 0.19 -0.03 -0.12 -0.35 -4.75 117.98 112.56 1fy4 s PHE 181 Ca 0.11 -1.15 0.11 0.00 -0.05 0.00 0.00 56.93 55.95 1fy4 s PHE 181 Cb -0.08 -0.64 -0.04 0.00 -0.63 0.00 0.00 43.02 41.62 1fy4 s PHE 181 CO 0.06 -0.37 -0.22 0.00 -0.05 0.00 0.00 175.22 174.63 1fy4 s ALA 183 N -1.84 -1.42 0.00 0.00 0.00 -0.39 -0.95 121.76 117.16 1fy4 s ALA 183 Ca 0.20 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.40 1fy4 s ALA 183 Cb -0.07 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.66 1fy4 s ALA 183 CO 0.09 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.96 1fy4 n GLY 184 N 1.77 -0.31 3.49 0.00 0.00 -0.52 -1.15 105.19 108.46 1fy4 n GLY 184 Ca -0.17 -1.37 -0.33 0.00 0.00 0.00 0.00 46.02 44.15 1fy4 n GLY 184 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fy4 s VAL 184 N -1.90 3.18 0.32 1.61 0.11 -1.26 -4.15 120.40 118.32 1fy4 s VAL 184 Ca 0.00 -0.67 0.02 0.00 -2.93 0.00 0.00 61.98 58.40 1fy4 s VAL 184 Cb 0.00 -2.27 0.19 0.00 -1.53 0.00 0.00 36.38 32.77 1fy4 s VAL 184 CO 0.00 0.59 1.90 -1.28 -3.33 0.00 0.00 175.10 172.98 1fy4 h SER 185 N 5.46 0.65 0.24 3.54 0.87 -1.99 0.96 113.55 123.27 1fy4 h SER 185 Ca -0.45 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.03 1fy4 h SER 185 Cb 1.16 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1fy4 h SER 185 CO 0.51 0.61 0.00 -1.54 -0.53 0.00 0.00 176.83 175.88 1fy4 n SER 186 N -4.33 0.00 0.00 6.23 3.41 -1.26 -1.01 113.62 116.66 1fy4 n SER 186 Ca 0.04 -0.62 0.00 0.00 -0.26 0.00 0.00 58.87 58.03 1fy4 n SER 186 Cb 0.18 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1fy4 n SER 186 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fy4 n GLY 187 N 1.06 -2.47 0.00 5.00 0.00 0.33 -4.21 105.19 104.90 1fy4 n GLY 187 Ca 0.19 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1fy4 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fy4 n GLY 188 N -0.58 1.20 2.80 -0.02 0.00 -0.11 -4.78 105.19 103.70 1fy4 n GLY 188 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1fy4 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fy4 s LYS 188 N -0.83 0.83 0.04 1.61 1.02 -1.26 -3.62 119.74 117.53 1fy4 s LYS 188 Ca 0.00 -0.01 -0.29 0.00 0.02 0.00 0.00 55.97 55.69 1fy4 s LYS 188 Cb 0.00 -1.19 0.10 0.00 -0.52 0.00 0.00 37.83 36.22 1fy4 s LYS 188 CO 0.00 -0.32 1.13 0.34 -0.92 0.00 0.00 175.35 175.58 1fy4 s ASP 189 N 1.90 -0.13 0.63 2.83 -1.08 -0.73 -4.45 116.67 115.64 1fy4 s ASP 189 Ca 0.05 -0.22 -0.12 0.00 -0.52 0.00 0.00 52.55 51.74 1fy4 s ASP 189 Cb -0.13 0.30 -0.03 0.00 -1.46 0.00 0.00 42.92 41.61 1fy4 s ASP 189 CO -0.06 -0.55 1.04 -0.94 0.52 0.00 0.00 175.17 175.18 1fy4 s SER 190 N -2.86 5.98 0.33 -0.34 1.04 -1.26 -0.35 113.70 116.23 1fy4 s SER 190 Ca 0.12 1.53 0.05 0.00 0.48 0.00 0.00 55.95 58.13 1fy4 s SER 190 Cb 0.02 -2.49 -0.03 0.00 0.10 0.00 0.00 66.02 63.62 1fy4 s SER 190 CO -0.02 -1.04 0.20 0.00 0.98 0.00 0.00 173.24 173.36 1fy4 n GLN 192 N -0.64 1.92 0.00 0.00 3.00 -1.26 -1.34 117.38 119.06 1fy4 n GLN 192 Ca 0.02 0.69 0.00 0.00 -0.01 0.00 0.00 57.00 57.70 1fy4 n GLN 192 Cb 0.64 -2.37 0.00 0.00 0.00 0.00 0.00 30.24 28.51 1fy4 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1fy4 n GLY 193 N 2.60 1.31 0.04 1.08 0.00 -1.26 -1.35 105.19 107.60 1fy4 n GLY 193 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1fy4 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fy4 n ASP 194 N 0.00 0.56 -4.60 1.61 8.00 -0.45 -3.80 116.55 117.88 1fy4 n ASP 194 Ca 0.00 0.05 -0.43 0.00 0.71 0.00 0.00 54.79 55.12 1fy4 n ASP 194 Cb 0.00 0.08 -0.00 0.00 -0.02 0.00 0.00 41.12 41.18 1fy4 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1fy4 n SER 195 N -1.84 1.27 0.00 -2.24 7.64 -1.26 -1.84 113.62 115.35 1fy4 n SER 195 Ca 0.05 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1fy4 n SER 195 Cb 0.39 -1.32 0.00 0.00 -1.01 0.00 0.00 64.21 62.28 1fy4 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fy4 n GLY 196 N 1.20 3.11 3.85 0.23 0.00 0.14 -0.69 105.19 113.03 1fy4 n GLY 196 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1fy4 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fy4 s GLY 197 N -1.54 1.65 0.26 -0.02 0.00 -0.77 -3.63 107.32 103.28 1fy4 s GLY 197 Ca 0.00 -0.82 -0.20 0.00 0.00 0.00 0.00 44.72 43.70 1fy4 s GLY 197 CO 0.00 -0.18 0.77 2.56 0.00 0.00 0.00 173.10 176.25 1fy4 s PRO 198 N -5.58 4.26 -0.12 2.90 0.04 -1.26 -1.01 135.00 134.24 1fy4 s PRO 198 Ca 0.67 0.92 0.03 0.00 0.04 0.00 0.00 61.00 62.66 1fy4 s PRO 198 Cb -0.10 -2.76 0.01 0.00 0.04 0.00 0.00 34.50 31.69 1fy4 s PRO 198 CO 0.52 0.32 -0.21 -1.50 0.04 0.00 0.00 177.00 176.17 1fy4 s ILE 199 N -1.64 1.88 0.18 0.56 2.07 -0.79 -2.52 121.20 120.94 1fy4 s ILE 199 Ca 0.47 -0.89 0.09 0.00 -1.41 0.00 0.00 60.65 58.91 1fy4 s ILE 199 Cb -0.16 -1.66 -0.04 0.00 0.13 0.00 0.00 42.46 40.73 1fy4 s ILE 199 CO 0.20 0.52 -0.09 0.68 -1.91 0.00 0.00 174.94 174.34 1fy4 s VAL 200 N 0.69 3.20 0.76 4.00 -7.23 0.29 0.44 120.40 122.56 1fy4 s VAL 200 Ca -0.11 -1.66 -0.13 0.00 -1.81 0.00 0.00 61.98 58.27 1fy4 s VAL 200 Cb -0.16 -2.59 0.18 0.00 0.56 0.00 0.00 36.38 34.37 1fy4 s VAL 200 CO 0.02 -0.11 0.92 -0.90 -0.31 0.00 0.00 175.10 174.72 1fy4 n ASP 201 N 0.03 -0.40 0.11 4.85 5.68 -0.37 0.17 116.55 126.61 1fy4 n ASP 201 Ca -0.11 -1.26 0.11 0.00 -0.50 0.00 0.00 54.79 53.04 1fy4 n ASP 201 Cb 0.55 -0.74 0.46 0.00 -1.14 0.00 0.00 41.12 40.26 1fy4 n ASP 201 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1fy4 n SER 201 N -3.81 0.54 -0.46 -1.12 3.41 -1.13 -1.24 113.62 109.81 1fy4 n SER 201 Ca 0.12 0.65 0.14 0.00 -0.26 0.00 0.00 58.87 59.51 1fy4 n SER 201 Cb 0.42 -0.76 0.49 0.00 -0.26 0.00 0.00 64.21 64.10 1fy4 n SER 201 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1fy4 n SER 202 N -2.11 1.49 -0.18 4.04 7.64 -1.26 -4.95 113.62 118.28 1fy4 n SER 202 Ca 0.02 -1.43 -0.02 0.00 1.01 0.00 0.00 58.87 58.44 1fy4 n SER 202 Cb 0.20 0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.41 1fy4 n SER 202 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1fy4 n ASN 203 N 0.10 -3.85 -4.73 6.43 3.02 -0.38 -5.04 115.26 110.82 1fy4 n ASN 203 Ca 0.18 0.06 -0.41 0.00 -0.03 0.00 0.00 54.58 54.38 1fy4 n ASN 203 Cb 0.36 -1.56 -0.04 0.00 -0.61 0.00 0.00 39.78 37.93 1fy4 n ASN 203 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1fy4 s THR 204 N -1.90 3.96 -0.16 3.41 2.01 -1.26 -4.78 115.64 116.91 1fy4 s THR 204 Ca 0.00 1.66 -0.29 0.00 0.31 0.00 0.00 61.69 63.36 1fy4 s THR 204 Cb 0.00 -4.06 -0.02 0.00 0.01 0.00 0.00 72.50 68.43 1fy4 s THR 204 CO 0.00 0.27 1.41 -0.22 -0.69 0.00 0.00 174.62 175.38 1fy4 s LEU 209 N -0.20 4.14 -0.15 4.42 2.96 0.40 -1.24 118.68 129.01 1fy4 s LEU 209 Ca 0.50 1.74 0.17 0.00 -0.22 0.00 0.00 54.13 56.32 1fy4 s LEU 209 Cb -0.29 -3.54 -0.24 0.00 0.50 0.00 0.00 46.19 42.62 1fy4 s LEU 209 CO 0.34 -0.91 0.15 2.30 -1.32 0.00 0.00 176.35 176.91 1fy4 n ILE 210 N 5.65 0.97 -3.84 6.68 -5.35 0.17 -0.47 119.36 123.17 1fy4 n ILE 210 Ca 0.15 -0.70 -0.05 0.00 -0.27 0.00 0.00 62.75 61.88 1fy4 n ILE 210 Cb 0.45 -0.39 0.01 0.00 -1.74 0.00 0.00 39.64 37.97 1fy4 n ILE 210 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1fy4 s GLY 211 N -5.03 0.13 0.01 3.28 0.00 -0.97 0.37 107.32 105.11 1fy4 s GLY 211 Ca -0.09 -0.39 0.07 0.00 0.00 0.00 0.00 44.72 44.31 1fy4 s GLY 211 CO 0.77 1.21 -0.21 0.00 0.00 0.00 0.00 173.10 174.87 1fy4 s ALA 212 N -2.43 1.74 0.16 3.20 0.00 -0.82 -1.89 121.76 121.72 1fy4 s ALA 212 Ca 0.18 -0.96 -0.34 0.00 0.00 0.00 0.00 51.96 50.85 1fy4 s ALA 212 Cb -0.03 -0.40 -0.14 0.00 0.00 0.00 0.00 23.12 22.55 1fy4 s ALA 212 CO 0.07 0.41 1.59 0.28 0.00 0.00 0.00 175.76 178.11 1fy4 n VAL 213 N 2.29 0.01 0.01 0.00 0.31 -0.18 -1.22 118.33 119.55 1fy4 n VAL 213 Ca -0.16 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1fy4 n VAL 213 Cb 0.53 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 1fy4 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1fy4 n SER 214 N 3.51 0.12 -3.46 4.52 2.88 -0.94 -0.69 113.62 119.56 1fy4 n SER 214 Ca 0.17 0.04 -0.08 0.00 -1.33 0.00 0.00 58.87 57.67 1fy4 n SER 214 Cb 0.29 -0.02 -0.00 0.00 -0.75 0.00 0.00 64.21 63.73 1fy4 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1fy4 s TRP 215 N -1.16 -0.06 0.00 0.66 1.48 -0.69 -4.93 118.94 114.24 1fy4 s TRP 215 Ca 0.00 -0.50 0.00 0.00 -1.06 0.00 0.00 56.10 54.54 1fy4 s TRP 215 Cb 0.00 0.77 0.00 0.00 -1.16 0.00 0.00 33.47 33.08 1fy4 s TRP 215 CO 0.00 -1.38 0.00 0.41 -4.06 0.00 0.00 176.95 171.92 1fy4 n GLY 216 N -0.49 0.33 3.44 3.67 0.00 -1.26 -0.66 105.19 110.22 1fy4 n GLY 216 Ca -0.06 -0.90 -0.44 0.00 0.00 0.00 0.00 46.02 44.62 1fy4 n GLY 216 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fy4 s ASN 217 N 0.00 6.22 0.66 1.61 2.47 -1.26 -4.89 114.94 119.75 1fy4 s ASN 217 Ca 0.00 -0.96 0.00 0.00 0.42 0.00 0.00 52.86 52.32 1fy4 s ASN 217 Cb 0.00 -2.36 0.00 0.00 -1.45 0.00 0.00 41.25 37.44 1fy4 s ASN 217 CO 0.00 -1.18 0.00 0.61 -3.72 0.00 0.00 177.10 172.81 1fy4 n GLY 219 N 5.24 0.26 2.78 1.21 0.00 -1.26 -4.66 105.19 108.76 1fy4 n GLY 219 Ca -0.05 -0.92 -0.19 0.00 0.00 0.00 0.00 46.02 44.87 1fy4 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fy4 n ALA 221 N 4.55 -0.50 -1.80 0.00 0.00 -1.26 -4.69 120.51 116.81 1fy4 n ALA 221 Ca -0.18 0.19 -0.35 0.00 0.00 0.00 0.00 53.44 53.10 1fy4 n ALA 221 Cb 0.50 -2.02 -0.06 0.00 0.00 0.00 0.00 19.45 17.87 1fy4 n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1fy4 s ARG 221 N -4.64 4.30 0.41 0.00 0.52 -1.26 -0.94 118.95 117.34 1fy4 s ARG 221 Ca 0.00 1.24 -0.27 0.00 -0.52 0.00 0.00 55.73 56.18 1fy4 s ARG 221 Cb 0.00 -2.40 -0.10 0.00 0.52 0.00 0.00 34.95 32.97 1fy4 s ARG 221 CO 0.00 0.02 1.46 -1.25 0.02 0.00 0.00 175.30 175.56 1fy4 s PRO 222 N -2.77 3.93 -1.58 3.54 0.04 -1.26 -2.73 135.00 134.17 1fy4 s PRO 222 Ca 0.58 2.51 0.00 0.00 0.04 0.00 0.00 61.00 64.13 1fy4 s PRO 222 Cb -0.14 -2.84 0.00 0.00 0.04 0.00 0.00 34.50 31.57 1fy4 s PRO 222 CO 0.18 -0.66 0.00 0.09 0.04 0.00 0.00 177.00 176.66 1fy4 n ASN 223 N 0.18 -5.15 -3.56 6.66 3.02 -0.18 -4.92 115.26 111.31 1fy4 n ASN 223 Ca 0.03 0.37 -0.29 0.00 -0.03 0.00 0.00 54.58 54.65 1fy4 n ASN 223 Cb 0.40 -3.96 -0.14 0.00 -0.61 0.00 0.00 39.78 35.47 1fy4 n ASN 223 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1fy4 s TYR 224 N -2.44 0.71 0.74 3.10 2.02 -1.11 -4.80 117.35 115.58 1fy4 s TYR 224 Ca 0.00 -1.26 -0.14 0.00 -0.37 0.00 0.00 57.07 55.31 1fy4 s TYR 224 Cb 0.00 -1.08 0.05 0.00 -0.40 0.00 0.00 41.96 40.53 1fy4 s TYR 224 CO 0.00 -0.84 1.16 -1.12 -1.57 0.00 0.00 175.55 173.18 1fy4 s SER 225 N 1.71 4.28 0.40 2.29 0.01 -1.26 -4.41 113.70 116.71 1fy4 s SER 225 Ca 0.12 2.18 -0.25 0.00 1.31 0.00 0.00 55.95 59.30 1fy4 s SER 225 Cb -0.18 -2.57 -0.08 0.00 0.21 0.00 0.00 66.02 63.40 1fy4 s SER 225 CO -0.25 -2.20 1.17 -0.83 0.41 0.00 0.00 173.24 171.54 1fy4 s GLY 226 N -2.43 2.87 -0.09 3.44 0.00 -0.30 -4.57 107.32 106.24 1fy4 s GLY 226 Ca 0.70 0.97 0.02 0.00 0.00 0.00 0.00 44.72 46.41 1fy4 s GLY 226 CO 0.47 1.48 -0.15 0.14 0.00 0.00 0.00 173.10 175.05 1fy4 s VAL 227 N -1.41 2.95 0.01 1.40 1.01 0.17 -1.26 120.40 123.27 1fy4 s VAL 227 Ca 0.57 -0.73 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1fy4 s VAL 227 Cb -0.31 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 1fy4 s VAL 227 CO 0.39 0.56 -0.19 -0.31 0.00 0.00 0.00 175.10 175.55 1fy4 s TYR 228 N -0.15 1.65 0.08 5.22 1.51 0.38 -1.70 117.35 124.35 1fy4 s TYR 228 Ca -0.01 -0.34 -0.30 0.00 -1.01 0.00 0.00 57.07 55.41 1fy4 s TYR 228 Cb -0.14 -1.02 -0.06 0.00 -0.11 0.00 0.00 41.96 40.64 1fy4 s TYR 228 CO 0.03 0.03 1.16 0.00 -1.11 0.00 0.00 175.55 175.66 1fy4 s ALA 229 N -0.62 3.36 -0.34 3.71 0.00 -0.36 -1.21 121.76 126.30 1fy4 s ALA 229 Ca 0.06 0.81 -0.22 0.00 0.00 0.00 0.00 51.96 52.62 1fy4 s ALA 229 Cb -0.08 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1fy4 s ALA 229 CO 0.00 -0.36 0.73 0.45 0.00 0.00 0.00 175.76 176.58 1fy4 s SER 230 N 0.78 6.53 0.09 0.00 0.15 -0.41 -1.94 113.70 118.91 1fy4 s SER 230 Ca 0.56 0.37 -0.25 0.00 0.70 0.00 0.00 55.95 57.32 1fy4 s SER 230 Cb -0.29 -2.37 -0.15 0.00 -1.71 0.00 0.00 66.02 61.51 1fy4 s SER 230 CO 0.30 -0.64 1.71 0.58 1.20 0.00 0.00 173.24 176.39 1fy4 h VAL 231 N 5.68 0.82 -0.79 4.45 2.07 -0.43 -1.07 116.25 126.97 1fy4 h VAL 231 Ca -0.25 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.37 1fy4 h VAL 231 Cb 1.10 0.82 -0.08 0.00 -1.52 0.00 0.00 31.29 31.61 1fy4 h VAL 231 CO 0.87 0.00 0.43 1.23 0.02 0.00 0.00 177.57 180.12 1fy4 h GLY 232 N -0.22 1.23 2.00 2.17 0.00 -1.78 -2.08 103.07 104.40 1fy4 h GLY 232 Ca -0.01 -0.28 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 1fy4 h GLY 232 CO 0.01 0.09 -0.48 0.00 0.00 0.00 0.00 176.54 176.16 1fy4 h ALA 233 N 1.46 0.91 -0.20 3.60 0.00 -1.68 -1.11 119.26 122.24 1fy4 h ALA 233 Ca 0.39 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1fy4 h ALA 233 Cb 0.40 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1fy4 h ALA 233 CO -0.27 0.60 0.00 1.28 0.00 0.00 0.00 179.25 180.86 1fy4 n LEU 234 N -3.53 3.51 -0.09 0.00 4.77 -0.43 -4.68 117.00 116.55 1fy4 n LEU 234 Ca -0.00 -3.04 0.03 0.00 -0.03 0.00 0.00 56.01 52.98 1fy4 n LEU 234 Cb 0.59 -0.52 0.36 0.00 -2.33 0.00 0.00 43.42 41.52 1fy4 n LEU 234 CO 0.39 0.68 1.19 0.03 -1.33 0.00 0.00 177.39 178.36 1fy4 h ARG 235 N 1.36 0.70 -0.42 3.23 2.47 -1.51 -2.80 114.38 117.42 1fy4 h ARG 235 Ca 0.00 -0.04 -0.07 0.00 -1.26 0.00 0.00 59.98 58.61 1fy4 h ARG 235 Cb 1.34 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 29.48 1fy4 h ARG 235 CO 0.17 0.46 -0.00 0.77 0.56 0.00 0.00 179.97 181.93 1fy4 h SER 236 N 0.72 0.72 -0.22 7.04 0.02 -1.90 0.82 113.55 120.75 1fy4 h SER 236 Ca 0.21 -0.31 0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1fy4 h SER 236 Cb -0.03 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 1fy4 h SER 236 CO -0.05 0.86 0.13 0.15 -1.14 0.00 0.00 176.83 176.77 1fy4 h PHE 237 N 0.57 0.24 -0.30 3.45 3.57 -1.92 -1.68 116.94 120.86 1fy4 h PHE 237 Ca 0.12 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.65 1fy4 h PHE 237 Cb 0.49 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 1fy4 h PHE 237 CO 0.04 0.14 0.14 0.82 -2.23 0.00 0.00 178.31 177.22 1fy4 h ILE 238 N 0.26 0.98 -0.12 1.41 2.04 -1.18 -2.50 117.51 118.40 1fy4 h ILE 238 Ca 0.09 -0.10 -0.06 0.00 1.00 0.00 0.00 64.86 65.78 1fy4 h ILE 238 Cb -0.00 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1fy4 h ILE 238 CO -0.04 0.05 -0.20 0.44 0.00 0.00 0.00 178.15 178.40 1fy4 h ASP 239 N 0.30 0.20 -0.63 1.72 3.32 -0.72 0.93 116.42 121.53 1fy4 h ASP 239 Ca 0.13 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1fy4 h ASP 239 Cb 0.05 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1fy4 h ASP 239 CO -0.10 0.41 0.31 0.74 -1.72 0.00 0.00 179.24 178.89 1fy4 h THR 240 N 0.19 1.21 0.00 0.35 2.02 -0.86 -3.33 112.91 112.50 1fy4 h THR 240 Ca 0.03 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1fy4 h THR 240 Cb 0.47 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 1fy4 h THR 240 CO 0.03 0.24 -1.07 -1.22 0.37 0.00 0.00 175.52 173.87 1fy4 n TYR 241 N -4.51 0.00 0.29 3.16 4.01 -1.04 -5.12 117.16 113.95 1fy4 n TYR 241 Ca 0.04 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.81 1fy4 n TYR 241 Cb 0.12 -0.13 0.14 0.00 -0.31 0.00 0.00 39.34 39.15 1fy4 n TYR 241 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40