#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5sga s ALA 17 N 0.00 4.23 0.54 1.51 0.00 -1.26 -3.29 121.76 123.48 5sga s ALA 17 Ca 0.00 -1.28 -0.21 0.00 0.00 0.00 0.00 51.96 50.46 5sga s ALA 17 Cb 0.00 -0.57 -0.06 0.00 0.00 0.00 0.00 23.12 22.50 5sga s ALA 17 CO 0.00 -0.32 1.23 0.41 0.00 0.00 0.00 175.76 177.08 5sga n GLY 18 N -1.59 0.42 2.32 0.00 0.00 0.61 -2.60 105.19 104.35 5sga n GLY 18 Ca -0.04 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.98 5sga n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5sga n GLY 19 N 0.92 1.78 3.93 -0.02 0.00 0.78 -0.94 105.19 111.65 5sga n GLY 19 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 5sga n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 5sga s GLU 29 N -0.23 3.32 0.35 1.61 2.02 -1.07 -1.95 118.70 122.76 5sga s GLU 29 Ca 0.00 -0.15 -0.27 0.00 0.02 0.00 0.00 54.97 54.56 5sga s GLU 29 Cb 0.00 -2.49 -0.09 0.00 0.10 0.00 0.00 34.13 31.65 5sga s GLU 29 CO 0.00 -0.19 1.20 0.00 0.02 0.00 0.00 175.26 176.29 5sga s ALA 30 N -2.61 3.32 -0.01 5.21 0.00 -1.26 -0.34 121.76 126.06 5sga s ALA 30 Ca 0.46 1.04 0.03 0.00 0.00 0.00 0.00 51.96 53.50 5sga s ALA 30 Cb -0.10 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 5sga s ALA 30 CO 0.41 -0.48 -0.11 0.96 0.00 0.00 0.00 175.76 176.54 5sga s ILE 31 N -1.27 0.86 0.17 0.00 -4.36 -0.73 -4.83 121.20 111.04 5sga s ILE 31 Ca 0.52 -0.46 0.02 0.00 -0.26 0.00 0.00 60.65 60.47 5sga s ILE 31 Cb -0.34 -0.73 -0.05 0.00 1.25 0.00 0.00 42.46 42.60 5sga s ILE 31 CO 0.44 0.25 -0.01 0.42 0.24 0.00 0.00 174.94 176.28 5sga s THR 32 N -0.18 0.74 -0.15 8.37 -4.23 -1.26 -1.31 115.64 117.61 5sga s THR 32 Ca 0.03 -1.99 -0.05 0.00 -1.18 0.00 0.00 61.69 58.50 5sga s THR 32 Cb -0.05 -2.11 0.07 0.00 1.34 0.00 0.00 72.50 71.75 5sga s THR 32 CO -0.00 -0.49 0.30 0.28 -0.54 0.00 0.00 174.62 174.17 5sga s THR 33 N -3.62 -0.47 0.00 3.99 -1.32 -0.37 -0.60 115.64 113.25 5sga s THR 33 Ca 0.23 0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.97 5sga s THR 33 Cb 0.06 -0.50 0.00 0.00 -1.51 0.00 0.00 72.50 70.55 5sga s THR 33 CO 0.04 0.10 0.00 0.61 -2.21 0.00 0.00 174.62 173.16 5sga n GLY 34 N 5.36 3.00 0.51 6.08 0.00 -1.26 -0.16 105.19 118.72 5sga n GLY 34 Ca -0.07 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 45.96 5sga n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5sga n GLY 39 N 0.00 0.22 3.85 -0.02 0.00 -1.26 -4.92 105.19 103.06 5sga n GLY 39 Ca 0.00 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.29 5sga n GLY 39 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 5sga s SER 40 N -1.39 6.70 -0.03 1.61 0.01 0.78 -5.10 113.70 116.28 5sga s SER 40 Ca 0.28 0.84 0.03 0.00 1.31 0.00 0.00 55.95 58.42 5sga s SER 40 Cb 0.15 -2.20 -0.00 0.00 0.21 0.00 0.00 66.02 64.18 5sga s SER 40 CO 0.22 0.28 -0.12 -0.60 0.41 0.00 0.00 173.24 173.43 5sga s ARG 41 N -1.40 1.19 0.03 12.44 3.52 -1.26 -1.24 118.95 132.23 5sga s ARG 41 Ca 0.26 -0.41 0.00 0.00 -0.13 0.00 0.00 55.73 55.46 5sga s ARG 41 Cb -0.15 -1.09 -0.00 0.00 -1.56 0.00 0.00 34.95 32.15 5sga s ARG 41 CO 0.14 0.17 0.01 0.00 -0.81 0.00 0.00 175.30 174.82 5sga s SER 43 N -1.18 3.20 0.24 0.00 0.01 0.11 -1.78 113.70 114.30 5sga s SER 43 Ca 0.02 -0.80 -0.30 0.00 1.31 0.00 0.00 55.95 56.18 5sga s SER 43 Cb 0.00 -0.22 -0.09 0.00 0.21 0.00 0.00 66.02 65.93 5sga s SER 43 CO 0.01 0.12 1.03 -0.22 0.41 0.00 0.00 173.24 174.59 5sga s LEU 44 N -2.37 4.57 0.00 2.44 0.20 0.53 -3.46 118.68 120.60 5sga s LEU 44 Ca 0.16 2.10 0.00 0.00 0.69 0.00 0.00 54.13 57.08 5sga s LEU 44 Cb -0.09 -3.61 0.00 0.00 -0.43 0.00 0.00 46.19 42.06 5sga s LEU 44 CO 0.07 -0.04 0.00 0.61 -0.29 0.00 0.00 176.35 176.70 5sga n GLY 45 N 1.50 -0.36 3.19 7.98 0.00 0.70 -0.15 105.19 118.05 5sga n GLY 45 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 5sga n GLY 45 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 5sga s PHE 46 N -0.87 -0.25 0.13 1.61 0.08 -1.15 -4.09 117.98 113.43 5sga s PHE 46 Ca 0.00 0.57 -0.27 0.00 0.12 0.00 0.00 56.93 57.35 5sga s PHE 46 Cb 0.00 0.09 -0.07 0.00 -0.57 0.00 0.00 43.02 42.47 5sga s PHE 46 CO 0.00 -0.23 0.84 -0.80 -0.10 0.00 0.00 175.22 174.93 5sga s ASN 47 N -0.37 7.40 0.23 1.36 0.01 -1.26 -0.68 114.94 121.63 5sga s ASN 47 Ca -0.05 1.67 0.01 0.00 -0.71 0.00 0.00 52.86 53.78 5sga s ASN 47 Cb -0.03 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 39.06 5sga s ASN 47 CO 0.01 0.08 0.15 0.68 -1.51 0.00 0.00 177.10 176.51 5sga s VAL 48 N -0.55 0.05 -0.03 1.60 -7.23 0.49 -2.00 120.40 112.74 5sga s VAL 48 Ca 0.40 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.64 5sga s VAL 48 Cb -0.23 -2.51 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 5sga s VAL 48 CO 0.27 0.00 -0.24 -0.55 -0.31 0.00 0.00 175.10 174.27 5sga s SER 48 N -3.21 2.85 -0.26 4.85 0.15 0.93 -0.64 113.70 118.37 5sga s SER 48 Ca 0.39 -0.45 0.02 0.00 0.70 0.00 0.00 55.95 56.61 5sga s SER 48 Cb 0.06 -0.40 0.07 0.00 -1.71 0.00 0.00 66.02 64.04 5sga s SER 48 CO 0.15 0.29 -0.04 -0.69 1.20 0.00 0.00 173.24 174.15 5sga s VAL 48 N -0.49 1.75 -1.48 4.45 1.01 -0.03 -1.00 120.40 124.60 5sga s VAL 48 Ca 0.07 -1.51 -0.05 0.00 0.00 0.00 0.00 61.98 60.49 5sga s VAL 48 Cb -0.10 -2.04 0.04 0.00 0.00 0.00 0.00 36.38 34.28 5sga s VAL 48 CO -0.00 -0.21 0.56 0.59 0.00 0.00 0.00 175.10 176.04 5sga n ASN 48 N 4.56 -1.38 0.00 3.32 3.02 -1.26 -0.96 115.26 122.56 5sga n ASN 48 Ca -0.09 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 5sga n ASN 48 Cb 0.43 -3.09 0.00 0.00 -0.61 0.00 0.00 39.78 36.51 5sga n ASN 48 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 5sga n GLY 48 N -1.81 2.20 3.64 7.41 0.00 -1.26 -5.01 105.19 110.35 5sga n GLY 48 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 5sga n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 5sga s VAL 49 N -3.29 5.22 0.06 1.61 1.01 -0.13 -5.04 120.40 119.84 5sga s VAL 49 Ca 0.00 0.55 -0.31 0.00 0.00 0.00 0.00 61.98 62.22 5sga s VAL 49 Cb 0.00 -3.67 -0.07 0.00 0.00 0.00 0.00 36.38 32.64 5sga s VAL 49 CO 0.00 0.23 1.50 0.00 0.00 0.00 0.00 175.10 176.83 5sga s ALA 50 N 1.56 3.64 0.24 5.51 0.00 -1.26 -0.85 121.76 130.59 5sga s ALA 50 Ca 0.15 1.09 0.01 0.00 0.00 0.00 0.00 51.96 53.21 5sga s ALA 50 Cb -0.15 -3.62 -0.04 0.00 0.00 0.00 0.00 23.12 19.31 5sga s ALA 50 CO 0.08 -0.91 0.15 -1.01 0.00 0.00 0.00 175.76 174.08 5sga s HIS 51 N 2.11 1.36 -0.03 0.00 3.76 0.19 -2.16 115.29 120.52 5sga s HIS 51 Ca 0.68 -1.40 0.02 0.00 -0.15 0.00 0.00 55.06 54.22 5sga s HIS 51 Cb -0.36 -0.67 0.01 0.00 1.11 0.00 0.00 32.58 32.66 5sga s HIS 51 CO 0.30 -0.62 -0.09 0.00 -0.85 0.00 0.00 174.74 173.48 5sga s ALA 52 N -3.92 0.87 0.17 -1.40 0.00 0.15 -0.38 121.76 117.25 5sga s ALA 52 Ca 0.39 -0.29 -0.09 0.00 0.00 0.00 0.00 51.96 51.96 5sga s ALA 52 Cb 0.06 -0.36 -0.07 0.00 0.00 0.00 0.00 23.12 22.75 5sga s ALA 52 CO 0.15 0.11 0.48 -0.51 0.00 0.00 0.00 175.76 176.00 5sga s LEU 53 N 0.37 4.25 0.00 0.00 1.02 0.14 -1.16 118.68 123.29 5sga s LEU 53 Ca -0.06 0.84 -0.01 0.00 0.02 0.00 0.00 54.13 54.92 5sga s LEU 53 Cb -0.10 -3.41 0.01 0.00 0.02 0.00 0.00 46.19 42.70 5sga s LEU 53 CO 0.01 0.02 0.11 1.07 0.02 0.00 0.00 176.35 177.58 5sga n THR 54 N 0.23 0.00 -2.76 5.49 5.66 -0.54 -0.22 114.28 122.15 5sga n THR 54 Ca -0.02 -0.24 -0.36 0.00 -3.05 0.00 0.00 64.05 60.38 5sga n THR 54 Cb 0.52 0.18 -0.06 0.00 -1.55 0.00 0.00 70.33 69.42 5sga n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 5sga s ALA 55 N -1.49 3.15 0.31 1.79 0.00 -1.26 -1.50 121.76 122.75 5sga s ALA 55 Ca 0.04 0.51 0.04 0.00 0.00 0.00 0.00 51.96 52.55 5sga s ALA 55 Cb -0.00 -3.19 0.50 0.00 0.00 0.00 0.00 23.12 20.43 5sga s ALA 55 CO 0.03 0.11 1.79 0.78 0.00 0.00 0.00 175.76 178.46 5sga h GLY 56 N 2.73 0.50 2.00 0.00 0.00 -1.56 -1.78 103.07 104.97 5sga h GLY 56 Ca -0.48 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.49 5sga h GLY 56 CO 0.63 0.34 0.00 1.12 0.00 0.00 0.00 176.54 178.63 5sga h HIS 57 N 0.43 0.00 0.00 5.60 2.07 -1.87 0.12 115.15 121.50 5sga h HIS 57 Ca 0.07 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.54 5sga h HIS 57 Cb 0.54 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.51 5sga h HIS 57 CO 0.02 0.00 -0.35 0.00 -3.07 0.00 0.00 177.93 174.53 5sga h THR 59 N -1.00 0.21 0.00 0.00 1.35 -1.05 -1.44 112.91 110.99 5sga h THR 59 Ca -0.09 -0.20 -0.02 0.00 -0.55 0.00 0.00 66.41 65.55 5sga h THR 59 Cb 0.86 1.16 -0.00 0.00 -1.73 0.00 0.00 68.15 68.43 5sga h THR 59 CO -0.05 0.03 -0.12 0.78 -0.25 0.00 0.00 175.52 175.91 5sga h ASN 62 N 0.00 0.00 -0.14 5.36 4.21 -0.90 -3.12 115.58 120.99 5sga h ASN 62 Ca -0.00 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.53 5sga h ASN 62 Cb 0.16 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.34 5sga h ASN 62 CO 0.00 0.12 -0.00 0.40 -1.29 0.00 0.00 177.43 176.66 5sga h ILE 63 N 0.00 0.90 -3.20 2.81 2.04 -1.42 -3.47 117.51 115.17 5sga h ILE 63 Ca -0.00 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 5sga h ILE 63 Cb 0.24 0.85 -0.11 0.00 -0.74 0.00 0.00 36.82 37.07 5sga h ILE 63 CO 0.02 0.01 0.08 -0.55 0.00 0.00 0.00 178.15 177.71 5sga s SER 64 N -5.22 -0.35 0.18 1.72 0.15 -1.18 -5.03 113.70 103.97 5sga s SER 64 Ca -0.13 -0.31 0.23 0.00 0.70 0.00 0.00 55.95 56.44 5sga s SER 64 Cb 0.09 0.58 0.19 0.00 -1.71 0.00 0.00 66.02 65.17 5sga s SER 64 CO 0.68 -1.02 1.22 0.00 1.20 0.00 0.00 173.24 175.32 5sga h ALA 65 N 2.15 0.57 -2.94 5.45 0.00 -1.91 -3.45 119.26 119.14 5sga h ALA 65 Ca -0.30 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 53.95 5sga h ALA 65 Cb 1.27 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.85 5sga h ALA 65 CO 0.38 0.00 -0.60 0.45 0.00 0.00 0.00 179.25 179.48 5sga s SER 65 N -4.87 5.29 0.24 0.00 0.15 -1.26 -0.67 113.70 112.58 5sga s SER 65 Ca 0.03 -0.23 0.10 0.00 0.70 0.00 0.00 55.95 56.56 5sga s SER 65 Cb 0.11 -1.96 -0.05 0.00 -1.71 0.00 0.00 66.02 62.42 5sga s SER 65 CO 0.75 -0.06 -0.19 0.26 1.20 0.00 0.00 173.24 175.20 5sga s TRP 66 N 1.63 2.08 0.40 3.44 0.52 -0.03 -4.60 118.94 122.39 5sga s TRP 66 Ca 0.06 -0.41 0.16 0.00 0.02 0.00 0.00 56.10 55.93 5sga s TRP 66 Cb -0.15 -0.94 1.05 0.00 -1.15 0.00 0.00 33.47 32.27 5sga s TRP 66 CO 0.05 0.56 1.83 0.66 0.02 0.00 0.00 176.95 180.07 5sga h SER 84 N 2.54 0.46 0.19 2.95 4.64 -1.23 -1.65 113.55 121.44 5sga h SER 84 Ca -0.40 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 5sga h SER 84 Cb 1.24 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 5sga h SER 84 CO 0.58 0.17 -0.58 2.30 -0.87 0.00 0.00 176.83 178.43 5sga n ILE 85 N -4.55 0.00 -3.18 0.95 -5.35 -1.26 -5.01 119.36 100.96 5sga n ILE 85 Ca 0.21 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.60 5sga n ILE 85 Cb 0.71 0.71 0.00 0.00 -1.74 0.00 0.00 39.64 39.32 5sga n ILE 85 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 5sga n GLY 86 N 1.45 -0.31 3.58 3.28 0.00 -0.62 -1.05 105.19 111.51 5sga n GLY 86 Ca 0.07 -1.18 -0.34 0.00 0.00 0.00 0.00 46.02 44.57 5sga n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5sga s THR 87 N -3.10 3.98 0.23 2.61 2.01 -0.86 -0.85 115.64 119.66 5sga s THR 87 Ca 0.00 -0.35 -0.31 0.00 0.31 0.00 0.00 61.69 61.34 5sga s THR 87 Cb 0.00 -2.69 -0.10 0.00 0.01 0.00 0.00 72.50 69.72 5sga s THR 87 CO 0.00 0.56 1.53 -0.60 -0.69 0.00 0.00 174.62 175.42 5sga s ARG 88 N -0.34 4.21 0.00 4.92 3.52 0.16 -0.14 118.95 131.28 5sga s ARG 88 Ca 0.06 2.39 0.00 0.00 -0.13 0.00 0.00 55.73 58.05 5sga s ARG 88 Cb -0.12 -3.11 0.00 0.00 -1.56 0.00 0.00 34.95 30.16 5sga s ARG 88 CO 0.02 -0.55 0.67 0.25 -0.81 0.00 0.00 175.30 174.88 5sga n THR 89 N 2.96 0.33 -3.59 4.11 -2.24 0.18 -4.84 114.28 111.19 5sga n THR 89 Ca 0.10 -0.66 -0.08 0.00 -2.27 0.00 0.00 64.05 61.14 5sga n THR 89 Cb 0.39 0.84 -0.05 0.00 -2.10 0.00 0.00 70.33 69.41 5sga n THR 89 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 5sga s GLY 90 N -0.33 -0.17 -0.10 3.38 0.00 -1.10 -4.96 107.32 104.03 5sga s GLY 90 Ca 0.00 2.23 -0.25 0.00 0.00 0.00 0.00 44.72 46.70 5sga s GLY 90 CO 0.00 1.04 0.59 -1.08 0.00 0.00 0.00 173.10 173.65 5sga s THR 91 N -1.13 0.01 -0.28 0.90 -1.32 -1.26 -0.97 115.64 111.59 5sga s THR 91 Ca 0.01 -0.09 0.01 0.00 -1.21 0.00 0.00 61.69 60.42 5sga s THR 91 Cb -0.01 -0.89 0.16 0.00 -1.51 0.00 0.00 72.50 70.26 5sga s THR 91 CO -0.01 -0.05 0.42 -0.55 -2.21 0.00 0.00 174.62 172.22 5sga s SER 93 N -0.72 0.24 -0.28 8.08 0.15 0.13 -4.98 113.70 116.33 5sga s SER 93 Ca -0.08 -0.22 -0.23 0.00 0.70 0.00 0.00 55.95 56.12 5sga s SER 93 Cb -0.02 1.17 0.09 0.00 -1.71 0.00 0.00 66.02 65.55 5sga s SER 93 CO 0.06 -0.34 0.81 0.12 1.20 0.00 0.00 173.24 175.09 5sga s PHE 94 N 2.56 -0.74 0.00 3.44 5.36 -1.26 -2.29 117.98 125.06 5sga s PHE 94 Ca 0.10 1.71 0.00 0.00 -0.96 0.00 0.00 56.93 57.78 5sga s PHE 94 Cb -0.13 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 42.91 5sga s PHE 94 CO -0.27 -0.36 0.00 -0.35 -1.46 0.00 0.00 175.22 172.78 5sga n PRO 99 N 2.90 2.84 0.00 10.12 -0.04 -1.26 -4.95 135.00 144.60 5sga n PRO 99 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 5sga n PRO 99 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 5sga n PRO 99 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 5sga n ASN 100 N 0.00 0.00 -5.01 3.54 5.15 -0.14 -4.74 115.26 114.06 5sga n ASN 100 Ca 0.00 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.77 5sga n ASN 100 Cb 0.00 0.00 0.05 0.00 -0.53 0.00 0.00 39.78 39.30 5sga n ASN 100 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 5sga s ASN 101 N -0.88 5.02 -0.41 1.20 0.02 -1.26 -1.91 114.94 116.71 5sga s ASN 101 Ca 0.00 -0.92 0.08 0.00 -1.02 0.00 0.00 52.86 51.00 5sga s ASN 101 Cb 0.00 0.33 0.27 0.00 0.02 0.00 0.00 41.25 41.87 5sga s ASN 101 CO 0.00 -1.31 0.68 -0.67 0.02 0.00 0.00 177.10 175.82 5sga n ASP 102 N -2.17 -0.56 -3.90 -1.22 4.64 -1.18 -4.05 116.55 108.12 5sga n ASP 102 Ca 0.13 -2.95 -0.09 0.00 -1.38 0.00 0.00 54.79 50.51 5sga n ASP 102 Cb 0.62 0.08 -0.08 0.00 -1.04 0.00 0.00 41.12 40.70 5sga n ASP 102 CO 0.00 0.00 0.00 -0.72 -0.82 0.00 0.00 177.20 175.66 5sga s TYR 103 N -0.88 0.21 0.20 -0.67 1.13 -0.97 -3.37 117.35 113.01 5sga s TYR 103 Ca 0.34 -0.65 -0.22 0.00 -1.41 0.00 0.00 57.07 55.13 5sga s TYR 103 Cb 0.22 -0.12 0.05 0.00 -1.10 0.00 0.00 41.96 41.01 5sga s TYR 103 CO -0.13 -0.50 0.64 0.20 -2.51 0.00 0.00 175.55 173.25 5sga s GLY 104 N -2.81 -0.42 0.00 5.49 0.00 -0.57 -0.69 107.32 108.32 5sga s GLY 104 Ca 0.05 0.19 -0.01 0.00 0.00 0.00 0.00 44.72 44.94 5sga s GLY 104 CO -0.10 0.06 0.01 -1.50 0.00 0.00 0.00 173.10 171.57 5sga s ILE 105 N -3.81 0.04 -0.06 0.90 2.07 -0.14 -1.46 121.20 118.74 5sga s ILE 105 Ca 0.05 -0.33 0.03 0.00 -1.41 0.00 0.00 60.65 58.98 5sga s ILE 105 Cb -0.03 -0.14 0.01 0.00 0.13 0.00 0.00 42.46 42.44 5sga s ILE 105 CO -0.06 -0.18 -0.13 -0.63 -1.91 0.00 0.00 174.94 172.03 5sga s ILE 106 N -0.54 1.17 -0.07 2.00 1.01 -0.31 -0.64 121.20 123.81 5sga s ILE 106 Ca -0.06 -0.52 -0.24 0.00 0.00 0.00 0.00 60.65 59.83 5sga s ILE 106 Cb -0.04 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.35 5sga s ILE 106 CO -0.00 0.36 0.74 -0.60 0.00 0.00 0.00 174.94 175.43 5sga s ARG 107 N 0.48 4.43 0.22 2.79 3.52 0.80 0.31 118.95 131.51 5sga s ARG 107 Ca -0.11 0.93 -0.30 0.00 -0.13 0.00 0.00 55.73 56.12 5sga s ARG 107 Cb -0.14 -3.46 -0.09 0.00 -1.56 0.00 0.00 34.95 29.69 5sga s ARG 107 CO 0.03 0.01 1.35 -1.01 -0.81 0.00 0.00 175.30 174.88 5sga s HIS 108 N 0.95 3.17 0.28 5.12 3.76 -0.92 -2.03 115.29 125.63 5sga s HIS 108 Ca 0.39 1.17 0.04 0.00 -0.15 0.00 0.00 55.06 56.51 5sga s HIS 108 Cb -0.18 -3.67 0.40 0.00 1.11 0.00 0.00 32.58 30.24 5sga s HIS 108 CO 0.18 -2.13 1.68 0.77 -0.85 0.00 0.00 174.74 174.39 5sga h SER 109 N 5.17 0.35 -3.68 1.40 0.02 -1.44 -3.39 113.55 111.98 5sga h SER 109 Ca -0.45 -0.14 -0.64 0.00 -0.84 0.00 0.00 61.79 59.71 5sga h SER 109 Cb 1.22 -0.10 -0.40 0.00 0.14 0.00 0.00 62.40 63.26 5sga h SER 109 CO 0.77 0.71 -0.72 0.21 -1.14 0.00 0.00 176.83 176.66 5sga s ASN 110 N -6.87 4.53 0.61 3.07 2.47 -1.26 -4.99 114.94 112.50 5sga s ASN 110 Ca -0.05 -2.20 0.32 0.00 0.42 0.00 0.00 52.86 51.34 5sga s ASN 110 Cb 0.13 -1.47 1.83 0.00 -1.45 0.00 0.00 41.25 40.30 5sga s ASN 110 CO 0.78 -0.36 2.16 -0.65 -3.72 0.00 0.00 177.10 175.32 5sga h PRO 111 N 7.51 0.00 0.00 0.43 0.11 -1.94 -0.84 132.00 137.27 5sga h PRO 111 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 5sga h PRO 111 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 5sga h PRO 111 CO 0.53 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.32 5sga h ALA 112 N 1.81 1.00 -0.00 -0.75 0.00 -1.97 -2.55 119.26 116.81 5sga h ALA 112 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 5sga h ALA 112 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 5sga h ALA 112 CO -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 179.25 179.16 5sga n ALA 113 N -2.00 2.60 -2.47 0.00 0.00 -0.32 -4.67 120.51 113.65 5sga n ALA 113 Ca 0.01 -0.17 -0.40 0.00 0.00 0.00 0.00 53.44 52.87 5sga n ALA 113 Cb 0.25 -1.41 -0.01 0.00 0.00 0.00 0.00 19.45 18.28 5sga n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 5sga s ALA 114 N -2.81 3.00 -0.44 0.00 0.00 -0.96 -1.49 121.76 119.06 5sga s ALA 114 Ca 0.19 -2.75 -0.29 0.00 0.00 0.00 0.00 51.96 49.11 5sga s ALA 114 Cb 0.19 -4.65 0.03 0.00 0.00 0.00 0.00 23.12 18.69 5sga s ALA 114 CO 0.53 -3.70 1.12 0.34 0.00 0.00 0.00 175.76 174.04 5sga s ASP 115 N 4.71 6.71 0.00 0.00 -1.08 -1.21 -4.95 116.67 120.85 5sga s ASP 115 Ca 0.57 0.61 -0.04 0.00 -0.52 0.00 0.00 52.55 53.17 5sga s ASP 115 Cb 0.03 -2.55 -0.20 0.00 -1.46 0.00 0.00 42.92 38.74 5sga s ASP 115 CO 0.09 -1.15 2.99 0.61 0.52 0.00 0.00 175.17 178.23 5sga n GLY 116 N 4.59 2.65 3.28 2.66 0.00 -1.26 -4.51 105.19 112.60 5sga n GLY 116 Ca 0.12 -0.91 -0.15 0.00 0.00 0.00 0.00 46.02 45.09 5sga n GLY 116 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 5sga s ARG 117 N 1.17 1.48 -0.10 1.61 0.52 -1.26 -1.85 118.95 120.51 5sga s ARG 117 Ca 0.50 -1.75 0.03 0.00 -0.52 0.00 0.00 55.73 53.99 5sga s ARG 117 Cb 0.24 0.32 -0.01 0.00 0.52 0.00 0.00 34.95 36.02 5sga s ARG 117 CO 0.00 -0.53 -0.20 0.08 0.02 0.00 0.00 175.30 174.67 5sga s VAL 118 N -3.80 2.47 0.02 3.52 1.01 0.51 -0.28 120.40 123.85 5sga s VAL 118 Ca 0.38 -0.88 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 5sga s VAL 118 Cb 0.04 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 5sga s VAL 118 CO 0.18 0.55 1.02 -0.47 0.00 0.00 0.00 175.10 176.38 5sga s TYR 119 N 0.23 3.63 -2.57 5.22 5.04 -0.11 0.16 117.35 128.95 5sga s TYR 119 Ca -0.13 1.63 0.24 0.00 -2.44 0.00 0.00 57.07 56.37 5sga s TYR 119 Cb -0.16 -3.17 0.57 0.00 0.35 0.00 0.00 41.96 39.54 5sga s TYR 119 CO 0.07 -0.24 1.47 1.28 -1.34 0.00 0.00 175.55 176.79 5sga n LEU 120 N 3.78 2.50 -1.78 6.97 4.77 -0.16 -4.82 117.00 128.26 5sga n LEU 120 Ca 0.06 -0.96 -0.16 0.00 -0.03 0.00 0.00 56.01 54.92 5sga n LEU 120 Cb 0.50 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.48 5sga n LEU 120 CO 0.53 0.48 -0.20 -1.22 -1.33 0.00 0.00 177.39 175.65 5sga n TYR 120 N 0.90 -0.71 -2.21 -1.77 4.01 -1.26 -4.50 117.16 111.62 5sga n TYR 120 Ca 0.17 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.92 5sga n TYR 120 Cb 0.48 -3.24 -0.00 0.00 -0.31 0.00 0.00 39.34 36.28 5sga n TYR 120 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 5sga n ASN 120 N -1.01 0.27 0.00 7.72 0.23 -1.26 -4.93 115.26 116.28 5sga n ASN 120 Ca -0.19 -1.89 0.00 0.00 -0.53 0.00 0.00 54.58 51.98 5sga n ASN 120 Cb 0.64 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 38.19 5sga n ASN 120 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 5sga n GLY 120 N 0.21 0.61 3.53 4.83 0.00 -1.26 -5.02 105.19 108.08 5sga n GLY 120 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 5sga n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 5sga s SER 120 N -2.31 3.24 0.06 1.61 0.01 -1.26 -5.05 113.70 110.00 5sga s SER 120 Ca 0.00 -1.31 0.02 0.00 1.31 0.00 0.00 55.95 55.97 5sga s SER 120 Cb 0.00 -0.26 -0.03 0.00 0.21 0.00 0.00 66.02 65.94 5sga s SER 120 CO 0.00 -0.43 -0.07 -0.31 0.41 0.00 0.00 173.24 172.84 5sga s TYR 121 N -2.91 0.73 -0.21 2.43 1.51 -1.26 -0.99 117.35 116.65 5sga s TYR 121 Ca 0.34 -0.65 -0.08 0.00 -1.01 0.00 0.00 57.07 55.67 5sga s TYR 121 Cb 0.07 -0.43 -0.04 0.00 -0.11 0.00 0.00 41.96 41.45 5sga s TYR 121 CO 0.16 -0.12 0.08 -1.14 -1.11 0.00 0.00 175.55 173.43 5sga s GLN 122 N -2.39 3.94 0.20 -0.62 2.00 0.12 -4.92 119.66 117.99 5sga s GLN 122 Ca -0.02 -0.35 -0.30 0.00 -2.00 0.00 0.00 55.36 52.68 5sga s GLN 122 Cb -0.04 -3.30 -0.08 0.00 0.80 0.00 0.00 33.01 30.39 5sga s GLN 122 CO -0.02 0.15 1.09 0.34 -0.50 0.00 0.00 175.29 176.35 5sga s ASP 123 N 0.73 7.30 -0.13 6.67 2.15 -1.26 -0.36 116.67 131.76 5sga s ASP 123 Ca 0.04 2.12 -0.04 0.00 0.43 0.00 0.00 52.55 55.10 5sga s ASP 123 Cb -0.13 -2.61 -0.03 0.00 -0.30 0.00 0.00 42.92 39.84 5sga s ASP 123 CO 0.02 -0.18 0.03 -0.63 -0.17 0.00 0.00 175.17 174.24 5sga s ILE 124 N -0.50 4.49 0.00 4.11 -1.09 -0.77 -4.08 121.20 123.36 5sga s ILE 124 Ca 0.48 -0.16 0.00 0.00 -2.23 0.00 0.00 60.65 58.74 5sga s ILE 124 Cb -0.30 -2.95 0.00 0.00 -1.58 0.00 0.00 42.46 37.64 5sga s ILE 124 CO 0.36 0.55 0.00 0.35 -1.23 0.00 0.00 174.94 174.97 5sga n THR 125 N 2.77 0.00 -4.20 2.92 -2.24 0.43 -4.81 114.28 109.15 5sga n THR 125 Ca -0.18 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.44 5sga n THR 125 Cb 0.53 -0.53 -0.08 0.00 -2.10 0.00 0.00 70.33 68.15 5sga n THR 125 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 5sga s THR 126 N -1.65 0.00 0.11 4.28 -1.32 -1.03 -4.93 115.64 111.10 5sga s THR 126 Ca 0.00 -1.87 0.09 0.00 -1.21 0.00 0.00 61.69 58.70 5sga s THR 126 Cb 0.00 -2.51 -0.04 0.00 -1.51 0.00 0.00 72.50 68.44 5sga s THR 126 CO 0.00 0.00 -0.19 0.00 -2.21 0.00 0.00 174.62 172.22 5sga s ALA 127 N -3.59 2.63 0.18 11.08 0.00 -1.26 -0.48 121.76 130.32 5sga s ALA 127 Ca 0.37 -1.35 -0.00 0.00 0.00 0.00 0.00 51.96 50.98 5sga s ALA 127 Cb 0.03 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.53 5sga s ALA 127 CO 0.21 0.59 0.23 0.41 0.00 0.00 0.00 175.76 177.19 5sga n GLY 128 N 0.89 2.75 3.58 0.00 0.00 0.72 -4.84 105.19 108.29 5sga n GLY 128 Ca -0.16 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 5sga n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 5sga s ASN 129 N -2.11 4.75 0.72 1.61 0.01 -1.26 -4.52 114.94 114.13 5sga s ASN 129 Ca 0.16 -0.02 -0.11 0.00 -0.71 0.00 0.00 52.86 52.18 5sga s ASN 129 Cb -0.00 -1.32 0.02 0.00 0.41 0.00 0.00 41.25 40.36 5sga s ASN 129 CO 0.11 0.33 1.07 0.00 -1.51 0.00 0.00 177.10 177.10 5sga s ALA 130 N -0.61 2.53 0.02 0.60 0.00 -1.26 -5.08 121.76 117.97 5sga s ALA 130 Ca 0.09 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.23 5sga s ALA 130 Cb -0.12 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 5sga s ALA 130 CO 0.02 -1.40 -0.06 -0.59 0.00 0.00 0.00 175.76 173.73 5sga s PHE 131 N -2.97 0.48 0.23 0.00 -0.71 -1.26 -5.08 117.98 108.66 5sga s PHE 131 Ca 0.59 -0.37 -0.31 0.00 -1.04 0.00 0.00 56.93 55.80 5sga s PHE 131 Cb -0.15 -0.30 -0.11 0.00 -1.21 0.00 0.00 43.02 41.24 5sga s PHE 131 CO 0.55 -0.08 1.65 0.08 -1.34 0.00 0.00 175.22 176.08 5sga s VAL 132 N -0.99 2.14 0.00 -2.49 1.01 -1.26 -1.75 120.40 117.07 5sga s VAL 132 Ca -0.08 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.01 5sga s VAL 132 Cb -0.07 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.24 5sga s VAL 132 CO -0.00 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.72 5sga n GLY 133 N 3.33 0.88 3.76 4.51 0.00 0.35 -4.99 105.19 113.03 5sga n GLY 133 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 5sga n GLY 133 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 5sga s GLN 134 N -0.65 4.40 -0.15 1.61 0.74 -0.71 -4.72 119.66 120.18 5sga s GLN 134 Ca 0.00 2.11 -0.29 0.00 0.05 0.00 0.00 55.36 57.22 5sga s GLN 134 Cb 0.00 -3.13 -0.01 0.00 1.10 0.00 0.00 33.01 30.96 5sga s GLN 134 CO 0.00 -0.17 1.22 0.00 -0.55 0.00 0.00 175.29 175.79 5sga s ALA 135 N -0.63 3.63 0.20 1.58 0.00 -1.26 -1.53 121.76 123.75 5sga s ALA 135 Ca 0.52 0.45 0.03 0.00 0.00 0.00 0.00 51.96 52.96 5sga s ALA 135 Cb -0.38 -3.59 -0.05 0.00 0.00 0.00 0.00 23.12 19.11 5sga s ALA 135 CO 0.45 -1.07 0.00 0.14 0.00 0.00 0.00 175.76 175.29 5sga s VAL 136 N 3.18 0.83 0.12 0.00 -7.23 -0.20 -4.75 120.40 112.34 5sga s VAL 136 Ca 0.53 -2.01 0.06 0.00 -1.81 0.00 0.00 61.98 58.76 5sga s VAL 136 Cb -0.21 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.44 5sga s VAL 136 CO 0.15 -0.38 -0.14 -1.10 -0.31 0.00 0.00 175.10 173.32 5sga s GLN 137 N -3.90 1.01 -0.00 4.82 -0.21 -0.25 -1.44 119.66 119.69 5sga s GLN 137 Ca 0.27 -1.22 0.03 0.00 0.02 0.00 0.00 55.36 54.45 5sga s GLN 137 Cb 0.06 -0.89 -0.01 0.00 1.00 0.00 0.00 33.01 33.17 5sga s GLN 137 CO 0.07 0.17 -0.08 0.50 -2.12 0.00 0.00 175.29 173.82 5sga s ARG 138 N -2.62 0.67 -0.04 2.91 3.52 0.82 -1.10 118.95 123.11 5sga s ARG 138 Ca 0.08 -0.33 0.05 0.00 -0.13 0.00 0.00 55.73 55.40 5sga s ARG 138 Cb -0.05 -0.64 -0.01 0.00 -1.56 0.00 0.00 34.95 32.69 5sga s ARG 138 CO 0.03 0.17 -0.19 0.45 -0.81 0.00 0.00 175.30 174.95 5sga s SER 139 N -0.28 2.38 0.09 -2.12 0.15 -0.47 -1.41 113.70 112.05 5sga s SER 139 Ca 0.03 -0.39 -0.23 0.00 0.70 0.00 0.00 55.95 56.06 5sga s SER 139 Cb -0.04 -0.63 0.06 0.00 -1.71 0.00 0.00 66.02 63.70 5sga s SER 139 CO -0.00 0.18 0.56 -0.83 1.20 0.00 0.00 173.24 174.34 5sga s GLY 140 N -0.05 -0.50 0.00 9.45 0.00 0.11 -2.53 107.32 113.80 5sga s GLY 140 Ca -0.03 0.56 0.20 0.00 0.00 0.00 0.00 44.72 45.44 5sga s GLY 140 CO 0.02 0.24 1.62 -1.14 0.00 0.00 0.00 173.10 173.85 5sga n SER 141 N 0.07 0.00 -0.12 1.64 3.41 -0.82 -0.37 113.62 117.43 5sga n SER 141 Ca -0.18 0.28 -0.24 0.00 -0.26 0.00 0.00 58.87 58.47 5sga n SER 141 Cb 0.62 -0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 64.08 5sga n SER 141 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 5sga n THR 142 N -1.40 1.52 0.83 6.66 -1.04 -1.26 -4.66 114.28 114.93 5sga n THR 142 Ca 0.07 -0.21 0.10 0.00 -2.04 0.00 0.00 64.05 61.96 5sga n THR 142 Cb 0.20 -2.01 0.05 0.00 -1.82 0.00 0.00 70.33 66.75 5sga n THR 142 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 5sga n THR 143 N -4.33 0.00 -1.08 12.58 -2.24 -1.24 -5.07 114.28 112.89 5sga n THR 143 Ca -0.42 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 60.93 5sga n THR 143 Cb 0.77 1.34 0.00 0.00 -2.10 0.00 0.00 70.33 70.34 5sga n THR 143 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 5sga n GLY 156 N 1.18 0.73 3.68 3.38 0.00 0.51 -4.78 105.19 109.89 5sga n GLY 156 Ca 0.10 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 5sga n GLY 156 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 5sga s LEU 157 N 0.00 3.86 0.04 0.99 2.96 -1.26 -0.71 118.68 124.55 5sga s LEU 157 Ca 0.00 0.15 0.00 0.00 -0.22 0.00 0.00 54.13 54.06 5sga s LEU 157 Cb 0.00 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 5sga s LEU 157 CO 0.00 0.25 -0.04 -0.13 -1.32 0.00 0.00 176.35 175.11 5sga s ARG 158 N -0.09 0.48 0.20 1.98 1.81 -0.50 -4.98 118.95 117.85 5sga s ARG 158 Ca 0.07 -0.87 0.06 0.00 -1.72 0.00 0.00 55.73 53.26 5sga s ARG 158 Cb -0.12 0.04 -0.05 0.00 -0.45 0.00 0.00 34.95 34.37 5sga s ARG 158 CO 0.01 -0.05 -0.09 -1.54 -0.68 0.00 0.00 175.30 172.96 5sga s SER 159 N -2.03 2.18 0.00 0.23 1.04 -1.26 -0.12 113.70 113.73 5sga s SER 159 Ca -0.06 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.29 5sga s SER 159 Cb -0.04 -0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.02 5sga s SER 159 CO -0.04 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.48 5sga n GLY 160 N -0.35 -0.76 3.18 7.32 0.00 -0.52 -4.72 105.19 109.34 5sga n GLY 160 Ca -0.08 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 5sga n GLY 160 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 5sga s SER 161 N -4.00 0.07 -0.01 1.61 1.04 -1.26 -1.04 113.70 110.11 5sga s SER 161 Ca 0.00 -0.46 -0.30 0.00 0.48 0.00 0.00 55.95 55.67 5sga s SER 161 Cb 0.00 0.30 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 5sga s SER 161 CO 0.00 -0.60 1.15 -0.69 0.98 0.00 0.00 173.24 174.08 5sga s VAL 162 N -2.93 4.33 -0.57 5.02 1.01 -0.58 -2.31 120.40 124.36 5sga s VAL 162 Ca -0.02 1.66 0.09 0.00 0.00 0.00 0.00 61.98 63.71 5sga s VAL 162 Cb 0.01 -4.06 -0.07 0.00 0.00 0.00 0.00 36.38 32.25 5sga s VAL 162 CO -0.06 0.07 0.46 0.35 0.00 0.00 0.00 175.10 175.91 5sga n THR 163 N 4.25 0.00 -3.55 3.92 -2.24 0.24 -0.50 114.28 116.40 5sga n THR 163 Ca 0.09 -0.32 -0.07 0.00 -2.27 0.00 0.00 64.05 61.48 5sga n THR 163 Cb 0.47 1.04 -0.02 0.00 -2.10 0.00 0.00 70.33 69.71 5sga n THR 163 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 5sga s GLY 164 N -1.68 -0.36 0.21 3.38 0.00 -1.06 -4.94 107.32 102.87 5sga s GLY 164 Ca 0.05 1.41 0.07 0.00 0.00 0.00 0.00 44.72 46.24 5sga s GLY 164 CO 0.33 0.50 -0.11 1.08 0.00 0.00 0.00 173.10 174.91 5sga s LEU 165 N -2.19 2.50 -1.54 0.66 1.43 -1.26 -0.30 118.68 117.98 5sga s LEU 165 Ca 0.06 -1.07 -0.11 0.00 -1.03 0.00 0.00 54.13 51.98 5sga s LEU 165 Cb -0.01 -0.57 0.08 0.00 0.03 0.00 0.00 46.19 45.72 5sga s LEU 165 CO -0.06 -0.26 0.79 -3.20 0.23 0.00 0.00 176.35 173.84 5sga n ASN 166 N -0.40 -3.08 -4.76 2.29 4.05 -0.86 -4.92 115.26 107.59 5sga n ASN 166 Ca -0.08 -0.90 -0.40 0.00 0.45 0.00 0.00 54.58 53.66 5sga n ASN 166 Cb 0.61 -3.40 -0.06 0.00 1.23 0.00 0.00 39.78 38.17 5sga n ASN 166 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 5sga s ALA 167 N -3.46 3.39 -0.12 5.20 0.00 0.18 -4.42 121.76 122.53 5sga s ALA 167 Ca 0.49 0.49 -0.17 0.00 0.00 0.00 0.00 51.96 52.77 5sga s ALA 167 Cb -0.26 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 5sga s ALA 167 CO 0.87 0.24 0.41 0.99 0.00 0.00 0.00 175.76 178.27 5sga s THR 168 N -1.11 5.22 -0.14 0.00 2.01 -1.26 -1.33 115.64 119.02 5sga s THR 168 Ca 0.39 0.81 -0.00 0.00 0.31 0.00 0.00 61.69 63.20 5sga s THR 168 Cb -0.24 -3.75 0.03 0.00 0.01 0.00 0.00 72.50 68.54 5sga s THR 168 CO 0.29 0.36 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.81 5sga s VAL 169 N 0.45 1.23 -0.40 3.82 1.01 0.46 -5.00 120.40 121.96 5sga s VAL 169 Ca 0.23 -0.50 -0.18 0.00 0.00 0.00 0.00 61.98 61.53 5sga s VAL 169 Cb -0.15 -1.25 0.01 0.00 0.00 0.00 0.00 36.38 34.99 5sga s VAL 169 CO 0.08 0.33 0.49 0.21 0.00 0.00 0.00 175.10 176.21 5sga s ASN 170 N 1.62 6.25 -0.20 3.32 3.84 -1.26 -0.36 114.94 128.14 5sga s ASN 170 Ca 0.04 -0.40 0.10 0.00 0.21 0.00 0.00 52.86 52.80 5sga s ASN 170 Cb -0.13 -2.25 0.63 0.00 -0.55 0.00 0.00 41.25 38.94 5sga s ASN 170 CO -0.09 -0.57 1.50 -1.22 -2.79 0.00 0.00 177.10 173.93 5sga n TYR 171 N 5.74 1.72 0.00 0.43 0.53 0.42 -5.01 117.16 121.00 5sga n TYR 171 Ca -0.06 -0.68 0.00 0.00 -1.02 0.00 0.00 57.90 56.14 5sga n TYR 171 Cb 0.48 -0.47 0.00 0.00 -1.03 0.00 0.00 39.34 38.32 5sga n TYR 171 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 5sga n GLY 172 N 0.34 3.92 0.32 2.72 0.00 -1.25 -2.32 105.19 108.92 5sga n GLY 172 Ca 0.25 0.02 0.16 0.00 0.00 0.00 0.00 46.02 46.45 5sga n GLY 172 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 5sga h SER 173 N 0.00 0.00 1.22 1.61 4.64 -2.05 -0.75 113.55 118.22 5sga h SER 173 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 5sga h SER 173 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 5sga h SER 173 CO 0.00 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.76 5sga n SER 174 N -3.81 0.53 0.00 4.97 7.64 -0.98 -5.04 113.62 116.93 5sga n SER 174 Ca -0.01 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.43 5sga n SER 174 Cb 0.20 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 5sga n SER 174 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 5sga n GLY 175 N 1.18 -2.70 3.50 0.23 0.00 -0.29 -4.65 105.19 102.46 5sga n GLY 175 Ca 0.06 -2.16 -0.33 0.00 0.00 0.00 0.00 46.02 43.58 5sga n GLY 175 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5sga s ILE 176 N -0.79 3.29 0.06 -0.61 1.01 -1.26 -0.43 121.20 122.47 5sga s ILE 176 Ca 0.00 -0.63 0.09 0.00 0.00 0.00 0.00 60.65 60.10 5sga s ILE 176 Cb 0.00 -2.31 -0.03 0.00 0.01 0.00 0.00 42.46 40.12 5sga s ILE 176 CO 0.00 0.59 -0.22 0.68 0.00 0.00 0.00 174.94 175.99 5sga s VAL 177 N -0.67 2.51 0.23 2.92 -7.23 0.52 -0.97 120.40 117.71 5sga s VAL 177 Ca 0.10 -1.37 0.11 0.00 -1.81 0.00 0.00 61.98 59.02 5sga s VAL 177 Cb -0.11 -2.05 -0.05 0.00 0.56 0.00 0.00 36.38 34.73 5sga s VAL 177 CO 0.01 0.29 -0.21 -0.31 -0.31 0.00 0.00 175.10 174.57 5sga s TYR 178 N -0.93 2.32 -1.02 2.82 1.51 -0.80 -0.41 117.35 120.84 5sga s TYR 178 Ca 0.14 -0.34 -0.03 0.00 -1.01 0.00 0.00 57.07 55.83 5sga s TYR 178 Cb -0.10 -1.09 0.00 0.00 -0.11 0.00 0.00 41.96 40.66 5sga s TYR 178 CO 0.05 0.59 0.36 0.41 -1.11 0.00 0.00 175.55 175.85 5sga n GLY 179 N -0.11 -0.10 3.84 0.71 0.00 -1.07 -4.80 105.19 103.65 5sga n GLY 179 Ca -0.09 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 5sga n GLY 179 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 5sga s MET 180 N -5.23 4.01 0.19 1.61 -1.94 -0.45 -4.38 119.30 113.11 5sga s MET 180 Ca 0.18 0.55 -0.30 0.00 -1.71 0.00 0.00 55.69 54.41 5sga s MET 180 Cb -0.08 -2.85 -0.08 0.00 2.01 0.00 0.00 34.83 33.84 5sga s MET 180 CO 0.22 0.42 1.02 0.42 -0.01 0.00 0.00 175.02 177.09 5sga s ILE 181 N -1.56 4.02 -0.07 2.53 1.01 0.01 -0.64 121.20 126.49 5sga s ILE 181 Ca 0.41 1.84 0.02 0.00 0.00 0.00 0.00 60.65 62.91 5sga s ILE 181 Cb -0.14 -4.17 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 5sga s ILE 181 CO 0.20 0.36 -0.11 -1.58 0.00 0.00 0.00 174.94 173.81 5sga s GLN 182 N -0.65 2.77 0.18 2.79 0.74 0.59 -0.37 119.66 125.71 5sga s GLN 182 Ca 0.46 -0.63 -0.01 0.00 0.05 0.00 0.00 55.36 55.23 5sga s GLN 182 Cb -0.27 -2.52 -0.04 0.00 1.10 0.00 0.00 33.01 31.27 5sga s GLN 182 CO 0.34 0.57 0.10 0.95 -0.55 0.00 0.00 175.29 176.70 5sga s THR 183 N -0.56 0.04 -0.28 -0.34 -4.23 0.26 -0.59 115.64 109.93 5sga s THR 183 Ca 0.08 -1.97 0.12 0.00 -1.18 0.00 0.00 61.69 58.74 5sga s THR 183 Cb -0.12 -2.34 0.76 0.00 1.34 0.00 0.00 72.50 72.14 5sga s THR 183 CO 0.02 -0.16 1.76 -0.46 -0.54 0.00 0.00 174.62 175.23 5sga n ASN 184 N -0.21 5.08 -4.80 3.99 0.23 -0.98 -1.32 115.26 117.25 5sga n ASN 184 Ca -0.01 -3.12 -0.39 0.00 -0.53 0.00 0.00 54.58 50.54 5sga n ASN 184 Cb 0.65 -0.71 -0.06 0.00 -2.08 0.00 0.00 39.78 37.58 5sga n ASN 184 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 5sga s VAL 190 N -2.91 4.72 0.65 3.53 1.01 -1.26 -4.68 120.40 121.46 5sga s VAL 190 Ca 0.54 1.26 -0.10 0.00 0.00 0.00 0.00 61.98 63.67 5sga s VAL 190 Cb 0.43 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 5sga s VAL 190 CO 0.14 0.54 1.03 0.00 0.00 0.00 0.00 175.10 176.82 5sga s ALA 192 N -3.22 -1.52 0.15 0.00 0.00 -1.26 -4.93 121.76 110.99 5sga s ALA 192 Ca 0.56 0.31 0.01 0.00 0.00 0.00 0.00 51.96 52.84 5sga s ALA 192 Cb -0.11 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 23.83 5sga s ALA 192 CO 0.52 -0.84 0.01 -0.65 0.00 0.00 0.00 175.76 174.80 5sga s GLN 192 N -3.77 1.03 0.21 0.00 -0.21 -1.26 -4.43 119.66 111.23 5sga s GLN 192 Ca 0.04 -1.49 -0.32 0.00 0.02 0.00 0.00 55.36 53.61 5sga s GLN 192 Cb -0.02 -0.12 -0.15 0.00 1.00 0.00 0.00 33.01 33.72 5sga s GLN 192 CO -0.08 -0.15 1.24 -2.30 -2.12 0.00 0.00 175.29 171.88 5sga n PRO 192 N -0.18 1.51 0.00 2.91 -0.02 -1.26 -0.75 135.00 137.21 5sga n PRO 192 Ca -0.07 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 5sga n PRO 192 Cb 0.63 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 5sga n PRO 192 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 5sga n GLY 193 N 1.98 2.68 0.20 -1.23 0.00 -1.26 -4.78 105.19 102.79 5sga n GLY 193 Ca 0.13 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.29 5sga n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 5sga h ASP 194 N 0.30 0.00 -2.88 1.61 3.45 -1.26 -3.23 116.42 114.41 5sga h ASP 194 Ca 0.00 0.00 -0.59 0.00 0.43 0.00 0.00 57.03 56.87 5sga h ASP 194 Cb 0.00 0.00 0.13 0.00 -0.56 0.00 0.00 39.33 38.90 5sga h ASP 194 CO 0.00 0.00 0.14 -1.20 -1.57 0.00 0.00 179.24 176.61 5sga n SER 195 N -2.83 1.24 0.00 6.45 7.64 -1.26 -2.23 113.62 122.63 5sga n SER 195 Ca 0.03 1.07 0.00 0.00 1.01 0.00 0.00 58.87 60.98 5sga n SER 195 Cb 0.41 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.28 5sga n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 5sga n GLY 196 N 1.20 2.66 3.62 0.23 0.00 0.77 0.05 105.19 113.72 5sga n GLY 196 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 5sga n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 5sga s GLY 197 N -1.84 1.56 0.09 -0.02 0.00 -0.94 -1.50 107.32 104.67 5sga s GLY 197 Ca 0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 44.72 44.15 5sga s GLY 197 CO 0.00 0.37 1.05 -0.56 0.00 0.00 0.00 173.10 173.96 5sga s SER 198 N -3.17 7.32 -0.18 1.64 0.01 -1.05 -1.12 113.70 117.15 5sga s SER 198 Ca 0.66 1.89 -0.02 0.00 1.31 0.00 0.00 55.95 59.79 5sga s SER 198 Cb -0.20 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.43 5sga s SER 198 CO 0.60 -0.24 -0.08 -0.22 0.41 0.00 0.00 173.24 173.70 5sga s LEU 199 N 0.38 2.83 0.21 2.44 2.96 -0.16 -1.37 118.68 125.96 5sga s LEU 199 Ca 0.51 -0.35 -0.13 0.00 -0.22 0.00 0.00 54.13 53.94 5sga s LEU 199 Cb -0.26 -1.68 0.00 0.00 0.50 0.00 0.00 46.19 44.75 5sga s LEU 199 CO 0.31 0.07 0.43 0.72 -1.32 0.00 0.00 176.35 176.56 5sga s PHE 200 N 0.94 0.25 -0.27 5.38 -0.12 -0.26 -0.69 117.98 123.21 5sga s PHE 200 Ca -0.01 -0.61 -0.03 0.00 -0.05 0.00 0.00 56.93 56.23 5sga s PHE 200 Cb -0.15 0.17 0.09 0.00 -0.63 0.00 0.00 43.02 42.51 5sga s PHE 200 CO 0.00 -0.90 0.11 0.00 -0.05 0.00 0.00 175.22 174.38 5sga s ALA 201 N -3.97 0.84 0.00 1.99 0.00 -0.43 -1.08 121.76 119.11 5sga s ALA 201 Ca 0.18 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 51.03 5sga s ALA 201 Cb 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.73 5sga s ALA 201 CO 0.03 -1.57 0.00 0.41 0.00 0.00 0.00 175.76 174.64 5sga n GLY 202 N 5.15 2.62 0.89 0.00 0.00 -1.26 -1.80 105.19 110.78 5sga n GLY 202 Ca -0.05 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.65 5sga n GLY 202 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 5sga n SER 207 N 3.69 2.52 -4.41 1.61 3.41 -1.26 -4.79 113.62 114.39 5sga n SER 207 Ca 0.00 -2.19 -0.36 0.00 -0.26 0.00 0.00 58.87 56.06 5sga n SER 207 Cb 0.00 -0.39 -0.13 0.00 -0.26 0.00 0.00 64.21 63.43 5sga n SER 207 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 5sga s THR 208 N -1.66 3.99 0.19 6.66 2.01 -0.75 -0.43 115.64 125.65 5sga s THR 208 Ca 0.25 -0.28 -0.30 0.00 0.31 0.00 0.00 61.69 61.67 5sga s THR 208 Cb 0.16 -2.84 -0.08 0.00 0.01 0.00 0.00 72.50 69.75 5sga s THR 208 CO 0.13 0.38 1.12 0.00 -0.69 0.00 0.00 174.62 175.55 5sga s ALA 209 N 1.44 3.39 0.00 7.40 0.00 0.37 -1.31 121.76 133.04 5sga s ALA 209 Ca 0.05 0.85 0.00 0.00 0.00 0.00 0.00 51.96 52.86 5sga s ALA 209 Cb -0.15 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.61 5sga s ALA 209 CO 0.01 -0.23 0.00 1.28 0.00 0.00 0.00 175.76 176.82 5sga n LEU 210 N 2.25 1.95 -3.83 0.00 4.77 0.13 -0.20 117.00 122.08 5sga n LEU 210 Ca 0.03 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.94 5sga n LEU 210 Cb 0.46 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.56 5sga n LEU 210 CO 0.54 0.33 0.62 -0.83 -1.33 0.00 0.00 177.39 176.71 5sga s GLY 211 N -3.58 0.14 -0.10 -0.72 0.00 -0.70 -1.13 107.32 101.25 5sga s GLY 211 Ca 0.00 -0.45 0.04 0.00 0.00 0.00 0.00 44.72 44.30 5sga s GLY 211 CO 0.00 0.44 -0.22 1.08 0.00 0.00 0.00 173.10 174.40 5sga s LEU 212 N -3.11 2.02 0.15 0.66 1.43 0.26 -0.99 118.68 119.10 5sga s LEU 212 Ca 0.16 -0.52 -0.32 0.00 -1.03 0.00 0.00 54.13 52.42 5sga s LEU 212 Cb -0.04 -1.32 -0.12 0.00 0.03 0.00 0.00 46.19 44.74 5sga s LEU 212 CO 0.08 0.14 1.77 0.41 0.23 0.00 0.00 176.35 178.98 5sga n THR 213 N 3.57 0.20 -0.05 5.49 -1.04 -0.27 -0.89 114.28 121.29 5sga n THR 213 Ca -0.20 -0.04 -0.08 0.00 -2.04 0.00 0.00 64.05 61.70 5sga n THR 213 Cb 0.53 -1.99 -0.03 0.00 -1.82 0.00 0.00 70.33 67.02 5sga n THR 213 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 5sga n SER 214 N 4.82 1.62 -0.59 8.00 2.88 -0.22 -0.17 113.62 129.97 5sga n SER 214 Ca 0.17 0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 5sga n SER 214 Cb 0.35 -0.60 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 5sga n SER 214 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 5sga n GLY 215 N 2.08 1.01 0.00 0.46 0.00 -1.08 -4.81 105.19 102.85 5sga n GLY 215 Ca -0.13 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.12 5sga n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5sga n GLY 216 N 0.00 -0.73 3.26 -0.02 0.00 -1.26 -0.05 105.19 106.40 5sga n GLY 216 Ca 0.00 -0.98 -0.17 0.00 0.00 0.00 0.00 46.02 44.87 5sga n GLY 216 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 5sga s SER 217 N -4.00 2.02 0.00 1.61 1.04 0.08 -5.00 113.70 109.46 5sga s SER 217 Ca 0.00 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.50 5sga s SER 217 Cb 0.00 -0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.06 5sga s SER 217 CO 0.00 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.61 5sga n GLY 218 N 0.09 -1.15 3.81 7.32 0.00 -1.26 -1.96 105.19 112.03 5sga n GLY 218 Ca -0.12 -1.37 -0.09 0.00 0.00 0.00 0.00 46.02 44.44 5sga n GLY 218 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 5sga s ASN 219 N -4.00 -0.01 0.00 1.61 2.20 -0.85 -4.86 114.94 109.03 5sga s ASN 219 Ca 0.00 -1.12 0.10 0.00 -0.94 0.00 0.00 52.86 50.90 5sga s ASN 219 Cb 0.00 0.84 0.60 0.00 -2.00 0.00 0.00 41.25 40.69 5sga s ASN 219 CO 0.00 -1.67 1.34 0.00 -2.94 0.00 0.00 177.10 173.83 5sga n ARG 221 N -0.67 0.53 0.01 0.00 -4.01 -1.26 -4.54 116.66 106.72 5sga n ARG 221 Ca 0.08 0.12 0.11 0.00 -1.04 0.00 0.00 57.85 57.12 5sga n ARG 221 Cb 0.03 -1.42 -0.09 0.00 -3.04 0.00 0.00 32.46 27.95 5sga n ARG 221 CO 0.00 0.00 0.00 0.25 -3.04 0.00 0.00 177.63 174.84 5sga n THR 222 N -3.13 0.07 0.00 8.89 -2.24 -1.20 -5.09 114.28 111.58 5sga n THR 222 Ca -0.37 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 5sga n THR 222 Cb 0.89 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 5sga n THR 222 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 5sga n GLY 223 N 1.37 -0.48 0.00 3.38 0.00 0.23 -4.91 105.19 104.78 5sga n GLY 223 Ca 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.25 5sga n GLY 223 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5sga n GLY 224 N -0.51 -1.24 3.40 -0.02 0.00 -1.25 -2.01 105.19 103.56 5sga n GLY 224 Ca 0.00 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 5sga n GLY 224 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5sga s THR 225 N -2.80 2.88 0.08 2.61 2.01 -0.83 -4.21 115.64 115.38 5sga s THR 225 Ca 0.00 -0.76 0.04 0.00 0.31 0.00 0.00 61.69 61.28 5sga s THR 225 Cb 0.00 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.33 5sga s THR 225 CO 0.00 0.56 -0.12 0.42 -0.69 0.00 0.00 174.62 174.79 5sga s THR 226 N -0.23 1.04 0.03 -0.82 -4.23 -0.43 -0.74 115.64 110.25 5sga s THR 226 Ca 0.00 -1.46 0.09 0.00 -1.18 0.00 0.00 61.69 59.14 5sga s THR 226 Cb -0.13 -1.19 -0.03 0.00 1.34 0.00 0.00 72.50 72.49 5sga s THR 226 CO 0.03 -0.38 -0.25 -0.36 -0.54 0.00 0.00 174.62 173.12 5sga s PHE 227 N -1.80 2.36 0.02 3.99 0.40 0.93 -0.58 117.98 123.31 5sga s PHE 227 Ca 0.01 -0.40 0.04 0.00 -0.60 0.00 0.00 56.93 55.98 5sga s PHE 227 Cb -0.07 -1.43 -0.02 0.00 0.51 0.00 0.00 43.02 42.02 5sga s PHE 227 CO 0.02 0.11 -0.12 0.71 0.70 0.00 0.00 175.22 176.63 5sga s TYR 228 N -0.78 1.04 -0.05 0.36 2.02 0.51 -1.05 117.35 119.40 5sga s TYR 228 Ca 0.12 -0.31 -0.30 0.00 -0.37 0.00 0.00 57.07 56.21 5sga s TYR 228 Cb -0.10 -0.63 -0.03 0.00 -0.40 0.00 0.00 41.96 40.81 5sga s TYR 228 CO 0.02 0.00 1.06 -1.14 -1.57 0.00 0.00 175.55 173.92 5sga s GLN 229 N -0.91 4.45 0.17 -0.62 2.00 -0.06 -0.81 119.66 123.87 5sga s GLN 229 Ca 0.01 1.50 -0.32 0.00 -2.00 0.00 0.00 55.36 54.55 5sga s GLN 229 Cb -0.07 -3.50 -0.12 0.00 0.80 0.00 0.00 33.01 30.12 5sga s GLN 229 CO 0.01 -0.26 1.76 -2.30 -0.50 0.00 0.00 175.29 173.99 5sga n PRO 230 N 4.62 2.74 0.13 1.67 -0.02 -1.26 -0.58 135.00 142.31 5sga n PRO 230 Ca 0.08 0.99 0.00 0.00 -2.02 0.00 0.00 63.50 62.56 5sga n PRO 230 Cb 0.49 -2.85 0.28 0.00 -0.02 0.00 0.00 33.50 31.39 5sga n PRO 230 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 5sga h VAL 231 N 4.12 1.29 -0.60 -1.45 3.04 -1.43 -3.11 116.25 118.11 5sga h VAL 231 Ca -0.44 -1.41 0.01 0.00 -1.01 0.00 0.00 66.70 63.84 5sga h VAL 231 Cb 1.21 1.68 -0.03 0.00 -2.01 0.00 0.00 31.29 32.14 5sga h VAL 231 CO 0.95 0.42 0.40 0.71 -1.01 0.00 0.00 177.57 179.03 5sga h THR 232 N 0.12 1.15 -0.47 3.17 1.35 -1.82 -0.33 112.91 116.07 5sga h THR 232 Ca 0.01 -0.28 -0.12 0.00 -0.55 0.00 0.00 66.41 65.47 5sga h THR 232 Cb 0.74 0.27 -0.01 0.00 -1.73 0.00 0.00 68.15 67.41 5sga h THR 232 CO 0.06 0.15 -0.19 -0.08 -0.25 0.00 0.00 175.52 175.21 5sga h GLU 233 N 0.81 0.94 -0.39 4.72 4.81 -1.94 -1.27 114.58 122.26 5sga h GLU 233 Ca 0.22 -0.38 -0.06 0.00 -0.13 0.00 0.00 59.36 59.02 5sga h GLU 233 Cb -0.09 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 5sga h GLU 233 CO -0.05 1.04 0.03 0.00 -0.73 0.00 0.00 179.01 179.30 5sga h ALA 234 N 0.96 0.52 -0.54 2.92 0.00 -1.53 -1.07 119.26 120.52 5sga h ALA 234 Ca 0.11 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 5sga h ALA 234 Cb 0.74 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 5sga h ALA 234 CO 0.06 0.27 0.27 -0.07 0.00 0.00 0.00 179.25 179.78 5sga h LEU 235 N 0.51 0.70 -0.73 0.00 3.38 -0.86 -2.79 115.31 115.51 5sga h LEU 235 Ca 0.11 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 5sga h LEU 235 Cb 0.43 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 5sga h LEU 235 CO 0.01 0.62 -0.61 0.77 0.09 0.00 0.00 178.44 179.32 5sga h SER 235 N 0.72 0.08 -0.63 -0.43 4.64 -1.17 0.13 113.55 116.89 5sga h SER 235 Ca 0.19 -0.05 0.05 0.00 -0.47 0.00 0.00 61.79 61.51 5sga h SER 235 Cb 0.10 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.13 5sga h SER 235 CO -0.03 0.68 0.42 0.00 -0.87 0.00 0.00 176.83 177.03 5sga h ALA 236 N 1.32 1.75 -0.11 5.18 0.00 -0.94 -2.96 119.26 123.51 5sga h ALA 236 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 5sga h ALA 236 Cb 1.10 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.71 5sga h ALA 236 CO 0.08 0.15 0.00 0.66 0.00 0.00 0.00 179.25 180.15 5sga n TYR 237 N -4.47 0.13 -3.36 0.00 4.01 -1.05 -4.99 117.16 107.43 5sga n TYR 237 Ca 0.09 -0.14 -0.19 0.00 -0.16 0.00 0.00 57.90 57.50 5sga n TYR 237 Cb 0.21 -0.01 0.06 0.00 -0.31 0.00 0.00 39.34 39.29 5sga n TYR 237 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 5sga n GLY 238 N 0.61 -0.25 3.76 2.72 0.00 0.14 -4.95 105.19 107.22 5sga n GLY 238 Ca 0.08 0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 5sga n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5sga s ALA 239 N -3.26 3.44 0.02 4.61 0.00 0.21 -4.41 121.76 122.37 5sga s ALA 239 Ca 0.43 -1.53 0.04 0.00 0.00 0.00 0.00 51.96 50.90 5sga s ALA 239 Cb -0.19 -1.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.83 5sga s ALA 239 CO 0.59 0.24 -0.13 0.95 0.00 0.00 0.00 175.76 177.41 5sga s THR 240 N -2.22 1.01 0.41 0.00 -4.23 -0.17 -4.64 115.64 105.80 5sga s THR 240 Ca 0.33 -0.79 -0.24 0.00 -1.18 0.00 0.00 61.69 59.81 5sga s THR 240 Cb -0.07 -0.89 -0.08 0.00 1.34 0.00 0.00 72.50 72.80 5sga s THR 240 CO 0.23 0.10 1.13 0.68 -0.54 0.00 0.00 174.62 176.22 5sga s VAL 241 N -0.62 3.32 -2.55 2.29 -7.23 -1.26 -0.05 120.40 114.30 5sga s VAL 241 Ca 0.02 1.05 0.28 0.00 -1.81 0.00 0.00 61.98 61.52 5sga s VAL 241 Cb -0.06 -3.56 0.51 0.00 0.56 0.00 0.00 36.38 33.83 5sga s VAL 241 CO 0.00 0.04 1.70 0.18 -0.31 0.00 0.00 175.10 176.71