#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gfw n GLY 30 N 0.00 2.96 3.64 5.00 0.00 -1.26 -5.06 105.19 110.47 1gfw n GLY 30 Ca 0.00 -2.22 -0.46 0.00 0.00 0.00 0.00 46.02 43.34 1gfw n GLY 30 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1gfw n ILE 31 N -1.00 0.98 -3.85 -0.61 5.41 -1.26 -4.95 119.36 114.08 1gfw n ILE 31 Ca -0.01 -0.24 -0.34 0.00 1.00 0.00 0.00 62.75 63.15 1gfw n ILE 31 Cb 0.25 -1.25 -0.12 0.00 -0.71 0.00 0.00 39.64 37.81 1gfw n ILE 31 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1gfw s SER 32 N 0.16 5.06 1.00 4.38 1.04 -1.26 -5.09 113.70 118.99 1gfw s SER 32 Ca 0.69 -2.24 -0.17 0.00 0.48 0.00 0.00 55.95 54.72 1gfw s SER 32 Cb -0.72 -1.77 0.23 0.00 0.10 0.00 0.00 66.02 63.87 1gfw s SER 32 CO 0.51 -0.46 1.35 -0.76 0.98 0.00 0.00 173.24 174.86 1gfw s LEU 33 N 0.83 2.69 -0.35 2.42 1.43 -1.26 -5.04 118.68 119.40 1gfw s LEU 33 Ca 0.11 0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 1gfw s LEU 33 Cb -0.22 -2.10 0.31 0.00 0.03 0.00 0.00 46.19 44.21 1gfw s LEU 33 CO -0.05 -2.96 1.31 -0.67 0.23 0.00 0.00 176.35 174.21 1gfw n ASP 34 N -3.90 -1.44 -1.13 2.29 4.64 -1.26 -4.99 116.55 110.77 1gfw n ASP 34 Ca 0.17 -2.10 0.10 0.00 -1.38 0.00 0.00 54.79 51.57 1gfw n ASP 34 Cb 0.59 1.15 0.27 0.00 -1.04 0.00 0.00 41.12 42.10 1gfw n ASP 34 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 1gfw n ASN 35 N 0.79 3.27 -3.80 1.67 5.03 -1.26 -4.90 115.26 116.06 1gfw n ASN 35 Ca -0.02 -2.00 -0.12 0.00 0.87 0.00 0.00 54.58 53.31 1gfw n ASN 35 Cb 0.73 -0.41 -0.10 0.00 -1.02 0.00 0.00 39.78 38.98 1gfw n ASN 35 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1gfw s SER 36 N -1.00 -0.17 0.33 6.41 1.04 -1.26 -5.14 113.70 113.91 1gfw s SER 36 Ca 0.41 0.22 -0.29 0.00 0.48 0.00 0.00 55.95 56.77 1gfw s SER 36 Cb 0.21 0.38 -0.11 0.00 0.10 0.00 0.00 66.02 66.61 1gfw s SER 36 CO 0.28 -0.24 1.41 -0.31 0.98 0.00 0.00 173.24 175.35 1gfw s TYR 37 N -0.59 2.87 -0.39 5.02 2.02 -1.26 -4.92 117.35 120.10 1gfw s TYR 37 Ca -0.07 1.24 -0.28 0.00 -0.37 0.00 0.00 57.07 57.59 1gfw s TYR 37 Cb -0.04 -3.84 -0.02 0.00 -0.40 0.00 0.00 41.96 37.65 1gfw s TYR 37 CO 0.02 -2.47 1.87 0.21 -1.57 0.00 0.00 175.55 173.60 1gfw s LYS 38 N -1.61 3.11 -0.21 -0.62 2.20 -1.26 -4.79 119.74 116.56 1gfw s LYS 38 Ca 0.53 1.30 0.15 0.00 -0.36 0.00 0.00 55.97 57.59 1gfw s LYS 38 Cb -0.43 -4.27 0.59 0.00 -1.51 0.00 0.00 37.83 32.22 1gfw s LYS 38 CO 0.55 -2.13 1.51 -1.33 -0.36 0.00 0.00 175.35 173.59 1gfw n MET 39 N 8.63 3.24 -0.69 4.03 2.81 -1.26 -4.52 117.12 129.35 1gfw n MET 39 Ca 0.24 -2.94 0.05 0.00 -1.81 0.00 0.00 57.70 53.23 1gfw n MET 39 Cb 0.48 -1.94 0.30 0.00 -0.71 0.00 0.00 33.22 31.35 1gfw n MET 39 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1gfw n ASP 40 N -0.34 4.42 -4.76 7.83 5.68 -1.26 -4.93 116.55 123.19 1gfw n ASP 40 Ca 0.25 -3.10 -0.34 0.00 -0.50 0.00 0.00 54.79 51.10 1gfw n ASP 40 Cb 0.99 -0.62 0.05 0.00 -1.14 0.00 0.00 41.12 40.39 1gfw n ASP 40 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 1gfw s TYR 41 N -2.88 2.52 0.55 2.11 1.51 -1.26 -4.84 117.35 115.06 1gfw s TYR 41 Ca 0.48 1.56 0.50 0.00 -1.01 0.00 0.00 57.07 58.60 1gfw s TYR 41 Cb 0.38 -3.25 1.73 0.00 -0.11 0.00 0.00 41.96 40.71 1gfw s TYR 41 CO 0.11 -1.85 1.55 -0.35 -1.11 0.00 0.00 175.55 173.90 1gfw n PRO 42 N -2.24 -0.00 -4.35 -1.71 -0.04 -1.21 -4.32 135.00 121.14 1gfw n PRO 42 Ca 0.11 1.08 -0.19 0.00 -0.04 0.00 0.00 63.50 64.46 1gfw n PRO 42 Cb 0.51 -2.49 -0.14 0.00 -0.04 0.00 0.00 33.50 31.35 1gfw n PRO 42 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1gfw s GLU 43 N -4.84 0.83 0.36 0.54 2.02 -0.46 -5.04 118.70 112.11 1gfw s GLU 43 Ca -0.05 -0.59 0.27 0.00 0.02 0.00 0.00 54.97 54.63 1gfw s GLU 43 Cb 0.27 -0.80 1.01 0.00 0.10 0.00 0.00 34.13 34.71 1gfw s GLU 43 CO 0.89 0.20 1.80 0.52 0.02 0.00 0.00 175.26 178.69 1gfw h MET 44 N 5.29 0.00 0.00 1.61 2.86 -1.75 -1.40 114.93 121.55 1gfw h MET 44 Ca -0.35 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1gfw h MET 44 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 1gfw h MET 44 CO 0.46 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.84 1gfw n GLY 45 N 0.34 3.24 3.76 8.32 0.00 -1.26 -2.79 105.19 116.79 1gfw n GLY 45 Ca 0.02 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 43.94 1gfw n GLY 45 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1gfw s LEU 46 N 0.00 4.52 -0.31 0.99 0.05 -1.26 -2.13 118.68 120.53 1gfw s LEU 46 Ca 0.00 1.55 -0.06 0.00 0.05 0.00 0.00 54.13 55.67 1gfw s LEU 46 Cb 0.00 -3.27 0.02 0.00 -2.05 0.00 0.00 46.19 40.89 1gfw s LEU 46 CO 0.00 0.10 0.09 0.00 -0.55 0.00 0.00 176.35 175.99 1gfw s ILE 48 N 1.45 5.16 -0.20 0.00 1.09 -0.61 -1.64 121.20 126.44 1gfw s ILE 48 Ca 0.00 0.87 0.01 0.00 -1.10 0.00 0.00 60.65 60.43 1gfw s ILE 48 Cb -0.18 -3.80 0.03 0.00 -1.06 0.00 0.00 42.46 37.45 1gfw s ILE 48 CO 0.02 0.24 -0.17 -0.63 -0.10 0.00 0.00 174.94 174.30 1gfw s ILE 49 N 1.27 2.14 -0.38 2.92 1.01 -1.05 0.14 121.20 127.25 1gfw s ILE 49 Ca 0.23 -1.12 -0.12 0.00 0.00 0.00 0.00 60.65 59.64 1gfw s ILE 49 Cb -0.15 -2.00 0.02 0.00 0.01 0.00 0.00 42.46 40.34 1gfw s ILE 49 CO 0.09 0.38 0.23 -0.63 0.00 0.00 0.00 174.94 175.01 1gfw s ILE 50 N 1.25 4.75 -1.05 2.92 1.01 0.15 0.42 121.20 130.64 1gfw s ILE 50 Ca 0.01 -0.80 -0.05 0.00 0.00 0.00 0.00 60.65 59.82 1gfw s ILE 50 Cb -0.15 -3.64 0.29 0.00 0.01 0.00 0.00 42.46 38.97 1gfw s ILE 50 CO -0.10 -0.25 1.26 -3.20 0.00 0.00 0.00 174.94 172.65 1gfw n ASN 51 N 5.04 5.77 -4.64 3.58 4.05 -0.41 -0.74 115.26 127.91 1gfw n ASN 51 Ca -0.12 -3.28 -0.43 0.00 0.45 0.00 0.00 54.58 51.21 1gfw n ASN 51 Cb 0.46 -1.24 -0.02 0.00 1.23 0.00 0.00 39.78 40.21 1gfw n ASN 51 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 177.26 174.41 1gfw s ASN 52 N -0.73 6.81 -0.10 1.20 0.01 -0.90 -2.50 114.94 118.73 1gfw s ASN 52 Ca 0.31 1.28 0.01 0.00 -0.71 0.00 0.00 52.86 53.75 1gfw s ASN 52 Cb -0.00 -2.54 -0.07 0.00 0.41 0.00 0.00 41.25 39.05 1gfw s ASN 52 CO 0.02 -0.94 -0.09 1.17 -1.51 0.00 0.00 177.10 175.75 1gfw n LYS 53 N 7.01 0.25 -4.64 -0.60 4.81 -1.26 -4.57 118.16 119.15 1gfw n LYS 53 Ca 0.14 0.06 -0.33 0.00 -0.87 0.00 0.00 58.31 57.30 1gfw n LYS 53 Cb 0.46 -1.20 -0.13 0.00 0.02 0.00 0.00 35.03 34.18 1gfw n LYS 53 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1gfw s ASN 54 N -4.99 4.30 0.06 3.14 0.01 -1.26 -1.45 114.94 114.76 1gfw s ASN 54 Ca -0.14 -0.25 0.06 0.00 -0.71 0.00 0.00 52.86 51.83 1gfw s ASN 54 Cb 0.04 -1.66 -0.04 0.00 0.41 0.00 0.00 41.25 40.00 1gfw s ASN 54 CO 0.23 0.17 -0.13 -0.36 -1.51 0.00 0.00 177.10 175.51 1gfw s PHE 55 N 0.32 2.70 0.10 2.20 0.40 -1.26 -4.79 117.98 117.65 1gfw s PHE 55 Ca -0.08 -0.17 -0.32 0.00 -0.60 0.00 0.00 56.93 55.76 1gfw s PHE 55 Cb -0.15 -1.48 -0.11 0.00 0.51 0.00 0.00 43.02 41.79 1gfw s PHE 55 CO 0.05 0.35 1.82 0.72 0.70 0.00 0.00 175.22 178.85 1gfw n HIS 56 N 1.19 2.54 -0.14 0.36 8.25 -0.48 -4.80 115.22 122.14 1gfw n HIS 56 Ca -0.15 -0.08 0.13 0.00 -0.26 0.00 0.00 57.72 57.35 1gfw n HIS 56 Cb 0.52 -2.70 0.24 0.00 1.12 0.00 0.00 29.99 29.17 1gfw n HIS 56 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1gfw n LYS 57 N 5.53 -0.03 -0.18 -0.41 4.76 -1.26 0.19 118.16 126.76 1gfw n LYS 57 Ca 0.19 0.60 -0.07 0.00 -2.87 0.00 0.00 58.31 56.15 1gfw n LYS 57 Cb 0.35 -1.06 0.02 0.00 -1.84 0.00 0.00 35.03 32.50 1gfw n LYS 57 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1gfw h SER 58 N 0.00 0.65 -0.41 4.39 0.02 -1.96 -2.92 113.55 113.33 1gfw h SER 58 Ca 0.35 -0.09 0.12 0.00 -0.84 0.00 0.00 61.79 61.33 1gfw h SER 58 Cb 0.91 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 1gfw h SER 58 CO -0.34 0.55 0.50 0.71 -1.14 0.00 0.00 176.83 177.11 1gfw h THR 59 N 0.70 0.30 -2.82 -2.27 1.35 -0.54 -3.44 112.91 106.18 1gfw h THR 59 Ca 0.18 0.00 -0.20 0.00 -0.55 0.00 0.00 66.41 65.85 1gfw h THR 59 Cb 0.05 0.59 0.05 0.00 -1.73 0.00 0.00 68.15 67.11 1gfw h THR 59 CO -0.03 0.00 -0.31 0.61 -0.25 0.00 0.00 175.52 175.54 1gfw n GLY 60 N -1.47 0.15 3.24 5.82 0.00 -1.10 -5.03 105.19 106.80 1gfw n GLY 60 Ca 0.07 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 1gfw n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1gfw s MET 61 N -5.32 1.09 0.42 1.61 -1.94 -1.26 -5.14 119.30 108.75 1gfw s MET 61 Ca 0.21 -1.05 0.00 0.00 -1.71 0.00 0.00 55.69 53.14 1gfw s MET 61 Cb -0.09 -1.26 -0.01 0.00 2.01 0.00 0.00 34.83 35.48 1gfw s MET 61 CO 0.25 0.30 0.64 0.95 -0.01 0.00 0.00 175.02 177.15 1gfw s THR 62 N -1.09 4.40 0.47 2.05 -4.23 -1.26 -4.67 115.64 111.31 1gfw s THR 62 Ca 0.04 -0.45 -0.22 0.00 -1.18 0.00 0.00 61.69 59.89 1gfw s THR 62 Cb -0.10 -3.62 -0.08 0.00 1.34 0.00 0.00 72.50 70.05 1gfw s THR 62 CO 0.03 -0.43 1.10 -0.94 -0.54 0.00 0.00 174.62 173.84 1gfw s SER 63 N -4.15 6.25 -0.09 3.99 1.04 -1.26 -4.75 113.70 114.73 1gfw s SER 63 Ca 0.46 2.12 -0.16 0.00 0.48 0.00 0.00 55.95 58.85 1gfw s SER 63 Cb -0.10 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.39 1gfw s SER 63 CO 0.38 -0.85 0.40 -0.13 0.98 0.00 0.00 173.24 174.02 1gfw s ARG 64 N -2.91 4.16 0.05 4.02 0.52 -0.52 -5.03 118.95 119.23 1gfw s ARG 64 Ca 0.65 0.34 0.06 0.00 -0.52 0.00 0.00 55.73 56.26 1gfw s ARG 64 Cb -0.23 -3.35 -0.04 0.00 0.52 0.00 0.00 34.95 31.85 1gfw s ARG 64 CO 0.28 0.38 -0.13 -1.54 0.02 0.00 0.00 175.30 174.31 1gfw s SER 65 N -0.04 4.19 0.00 0.23 1.04 -1.26 -4.46 113.70 113.40 1gfw s SER 65 Ca 0.23 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.31 1gfw s SER 65 Cb -0.15 -0.80 0.00 0.00 0.10 0.00 0.00 66.02 65.17 1gfw s SER 65 CO 0.10 0.24 0.00 0.61 0.98 0.00 0.00 173.24 175.16 1gfw n GLY 66 N 1.29 3.01 0.37 7.32 0.00 -1.26 -4.90 105.19 111.02 1gfw n GLY 66 Ca -0.15 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.06 1gfw n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gfw h THR 67 N 0.00 0.70 0.00 2.61 1.03 -1.97 -0.37 112.91 114.92 1gfw h THR 67 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 66.41 66.32 1gfw h THR 67 Cb 0.00 0.75 -0.01 0.00 -1.07 0.00 0.00 68.15 67.81 1gfw h THR 67 CO 0.00 0.00 -0.38 0.44 -0.01 0.00 0.00 175.52 175.57 1gfw h ASP 68 N 0.00 0.00 -0.06 0.00 3.32 -1.90 0.12 116.42 117.90 1gfw h ASP 68 Ca 0.23 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.20 1gfw h ASP 68 Cb 0.94 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 1gfw h ASP 68 CO -0.00 0.38 -0.26 0.58 -1.72 0.00 0.00 179.24 178.22 1gfw h VAL 69 N 0.00 1.44 -0.29 -1.35 2.07 -1.49 -2.00 116.25 114.62 1gfw h VAL 69 Ca -0.00 -1.68 0.06 0.00 0.82 0.00 0.00 66.70 65.90 1gfw h VAL 69 Cb 0.83 2.35 -0.07 0.00 -1.52 0.00 0.00 31.29 32.88 1gfw h VAL 69 CO 0.05 0.48 -0.14 0.44 0.02 0.00 0.00 177.57 178.42 1gfw h ASP 70 N -0.23 -0.46 -0.72 0.57 3.32 -1.06 -0.20 116.42 117.64 1gfw h ASP 70 Ca -0.02 0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 1gfw h ASP 70 Cb 0.91 0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.68 1gfw h ASP 70 CO 0.05 -0.17 0.33 0.00 -1.72 0.00 0.00 179.24 177.73 1gfw h ALA 71 N 1.14 1.19 -0.48 3.45 0.00 -0.79 -2.23 119.26 121.55 1gfw h ALA 71 Ca 0.15 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1gfw h ALA 71 Cb 0.32 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1gfw h ALA 71 CO -0.35 0.60 -0.04 0.00 0.00 0.00 0.00 179.25 179.46 1gfw h ALA 72 N 1.30 0.65 -0.23 0.00 0.00 -0.81 -3.03 119.26 117.14 1gfw h ALA 72 Ca 0.25 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.90 1gfw h ALA 72 Cb 0.15 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1gfw h ALA 72 CO -0.03 0.49 -0.02 -0.97 0.00 0.00 0.00 179.25 178.73 1gfw h ASN 73 N 0.73 -0.13 -0.70 0.00 -0.73 -0.79 -1.76 115.58 112.19 1gfw h ASN 73 Ca 0.13 0.06 -0.06 0.00 1.87 0.00 0.00 56.30 58.29 1gfw h ASN 73 Cb 0.57 0.11 -0.03 0.00 0.27 0.00 0.00 38.32 39.24 1gfw h ASN 73 CO 0.03 -0.04 0.18 -0.07 -0.37 0.00 0.00 177.43 177.17 1gfw h LEU 74 N 0.05 1.05 -0.01 0.34 3.38 -1.43 -0.84 115.31 117.85 1gfw h LEU 74 Ca 0.11 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1gfw h LEU 74 Cb 0.15 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1gfw h LEU 74 CO -0.20 1.00 -0.01 -0.09 0.09 0.00 0.00 178.44 179.24 1gfw h ARG 75 N 1.05 -0.01 -0.82 1.13 2.43 -1.37 0.53 114.38 117.33 1gfw h ARG 75 Ca 0.22 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.38 1gfw h ARG 75 Cb 0.35 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 1gfw h ARG 75 CO -0.00 -0.01 0.45 1.49 -1.51 0.00 0.00 179.97 180.39 1gfw h GLU 76 N -0.01 1.14 -0.27 0.20 4.57 -1.14 0.21 114.58 119.28 1gfw h GLU 76 Ca 0.01 -0.13 -0.09 0.00 -1.18 0.00 0.00 59.36 57.96 1gfw h GLU 76 Cb 0.02 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.38 1gfw h GLU 76 CO -0.02 0.84 -0.18 1.15 -1.18 0.00 0.00 179.01 179.62 1gfw h THR 77 N 1.13 1.30 0.00 0.32 2.02 -0.63 -2.52 112.91 114.54 1gfw h THR 77 Ca 0.29 -1.31 -0.10 0.00 0.77 0.00 0.00 66.41 66.06 1gfw h THR 77 Cb 0.03 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 1gfw h THR 77 CO -0.05 0.41 -0.48 -0.26 0.37 0.00 0.00 175.52 175.51 1gfw h PHE 78 N 0.33 0.00 -0.63 3.16 0.04 0.14 -2.69 116.94 117.29 1gfw h PHE 78 Ca 0.05 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.76 1gfw h PHE 78 Cb 0.72 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.84 1gfw h PHE 78 CO 0.07 0.48 0.13 -0.09 -0.60 0.00 0.00 178.31 178.30 1gfw h ARG 79 N 0.00 1.02 0.00 1.51 2.43 -0.49 -0.19 114.38 118.66 1gfw h ARG 79 Ca -0.00 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 58.91 1gfw h ARG 79 Cb 1.29 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1gfw h ARG 79 CO 0.06 0.92 -0.04 -0.91 -1.51 0.00 0.00 179.97 178.49 1gfw h ASN 80 N 0.96 0.00 -0.40 -3.80 2.35 -1.21 -2.33 115.58 111.15 1gfw h ASN 80 Ca 0.20 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 1gfw h ASN 80 Cb 0.38 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 1gfw h ASN 80 CO 0.01 0.04 0.04 0.18 -1.65 0.00 0.00 177.43 176.04 1gfw n LEU 81 N -3.17 4.24 -1.83 1.61 4.77 -0.19 -4.88 117.00 117.56 1gfw n LEU 81 Ca 0.00 -2.16 -0.20 0.00 -0.03 0.00 0.00 56.01 53.62 1gfw n LEU 81 Cb 0.30 -0.63 -0.06 0.00 -2.33 0.00 0.00 43.42 40.70 1gfw n LEU 81 CO 0.28 0.53 -0.22 1.17 -1.33 0.00 0.00 177.39 177.82 1gfw n LYS 82 N 0.33 -1.49 -3.38 3.23 3.00 -0.88 -4.93 118.16 114.04 1gfw n LYS 82 Ca 0.20 1.14 -0.38 0.00 -0.00 0.00 0.00 58.31 59.27 1gfw n LYS 82 Cb 0.91 -5.59 -0.06 0.00 0.00 0.00 0.00 35.03 30.29 1gfw n LYS 82 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1gfw s TYR 83 N -2.85 3.74 -1.04 5.64 1.51 -0.56 -4.07 117.35 119.73 1gfw s TYR 83 Ca 0.00 1.13 -0.19 0.00 -1.01 0.00 0.00 57.07 56.99 1gfw s TYR 83 Cb 0.00 -2.39 0.10 0.00 -0.11 0.00 0.00 41.96 39.56 1gfw s TYR 83 CO 0.00 0.58 1.35 -2.00 -1.11 0.00 0.00 175.55 174.38 1gfw s GLU 84 N -1.27 3.71 0.15 -0.62 2.12 -0.90 -4.41 118.70 117.47 1gfw s GLU 84 Ca 0.29 -1.67 -0.30 0.00 0.36 0.00 0.00 54.97 53.64 1gfw s GLU 84 Cb -0.18 -5.17 -0.07 0.00 0.26 0.00 0.00 34.13 28.97 1gfw s GLU 84 CO 0.17 -1.98 1.18 0.08 -0.54 0.00 0.00 175.26 174.16 1gfw s VAL 85 N 3.53 3.77 -0.34 3.70 1.01 -1.26 -1.20 120.40 129.61 1gfw s VAL 85 Ca 0.41 1.43 0.00 0.00 0.00 0.00 0.00 61.98 63.82 1gfw s VAL 85 Cb -0.02 -3.91 0.11 0.00 0.00 0.00 0.00 36.38 32.56 1gfw s VAL 85 CO -0.06 0.20 0.13 -0.13 0.00 0.00 0.00 175.10 175.24 1gfw s ARG 86 N 0.11 0.88 0.18 2.72 0.52 -0.65 -4.94 118.95 117.76 1gfw s ARG 86 Ca 0.54 -1.34 -0.30 0.00 -0.52 0.00 0.00 55.73 54.11 1gfw s ARG 86 Cb -0.31 -2.11 -0.08 0.00 0.52 0.00 0.00 34.95 32.98 1gfw s ARG 86 CO 0.34 -1.03 1.13 -0.80 0.02 0.00 0.00 175.30 174.96 1gfw s ASN 87 N 1.27 7.20 -0.25 0.23 -0.87 -1.26 -2.51 114.94 118.75 1gfw s ASN 87 Ca 0.12 2.13 -0.01 0.00 -1.57 0.00 0.00 52.86 53.53 1gfw s ASN 87 Cb -0.19 -2.60 0.08 0.00 -0.02 0.00 0.00 41.25 38.51 1gfw s ASN 87 CO -0.18 -0.28 0.05 -0.54 -2.57 0.00 0.00 177.10 173.59 1gfw s LYS 88 N -0.29 0.81 0.30 -0.60 -0.14 0.17 -4.95 119.74 115.03 1gfw s LYS 88 Ca 0.51 -0.80 -0.18 0.00 -1.36 0.00 0.00 55.97 54.14 1gfw s LYS 88 Cb -0.30 -2.12 -0.09 0.00 -1.68 0.00 0.00 37.83 33.64 1gfw s LYS 88 CO 0.35 -0.80 0.77 -0.80 -0.76 0.00 0.00 175.35 174.11 1gfw s ASN 89 N 1.68 6.93 -0.50 2.83 0.01 -1.26 -1.29 114.94 123.34 1gfw s ASN 89 Ca 0.03 1.40 -0.00 0.00 -0.71 0.00 0.00 52.86 53.58 1gfw s ASN 89 Cb -0.17 -2.42 0.00 0.00 0.41 0.00 0.00 41.25 39.07 1gfw s ASN 89 CO -0.16 -0.13 0.36 0.47 -1.51 0.00 0.00 177.10 176.13 1gfw n ASP 90 N 0.05 -2.86 -4.85 -1.22 9.92 -1.04 -4.90 116.55 111.64 1gfw n ASP 90 Ca 0.02 -0.60 -0.36 0.00 -0.53 0.00 0.00 54.79 53.32 1gfw n ASP 90 Cb 0.52 -0.95 -0.06 0.00 -0.64 0.00 0.00 41.12 39.99 1gfw n ASP 90 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1gfw s LEU 91 N -3.84 4.41 0.54 0.64 1.43 -1.26 -4.84 118.68 115.76 1gfw s LEU 91 Ca 0.00 0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 53.86 1gfw s LEU 91 Cb -0.00 -2.79 -0.06 0.00 0.03 0.00 0.00 46.19 43.37 1gfw s LEU 91 CO 0.54 0.24 0.96 0.42 0.23 0.00 0.00 176.35 178.74 1gfw s THR 92 N -1.25 4.68 0.56 5.49 -4.23 -1.26 0.60 115.64 120.23 1gfw s THR 92 Ca 0.29 0.89 0.33 0.00 -1.18 0.00 0.00 61.69 62.01 1gfw s THR 92 Cb -0.15 -3.80 0.48 0.00 1.34 0.00 0.00 72.50 70.37 1gfw s THR 92 CO 0.16 -0.89 1.81 0.08 -0.54 0.00 0.00 174.62 175.23 1gfw h ARG 93 N 0.33 0.00 0.08 3.99 0.11 -1.81 0.11 114.38 117.19 1gfw h ARG 93 Ca -0.46 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 59.34 1gfw h ARG 93 Cb 1.19 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.29 1gfw h ARG 93 CO 0.62 0.00 -1.17 0.93 0.10 0.00 0.00 179.97 180.45 1gfw h GLU 94 N 0.00 0.61 -0.00 0.08 3.07 -1.95 -3.13 114.58 113.26 1gfw h GLU 94 Ca 0.44 -0.76 -0.14 0.00 -0.50 0.00 0.00 59.36 58.40 1gfw h GLU 94 Cb 1.93 0.24 -0.02 0.00 -0.84 0.00 0.00 28.75 30.06 1gfw h GLU 94 CO -0.00 1.33 -0.65 0.93 -1.40 0.00 0.00 179.01 179.22 1gfw h GLU 95 N 0.30 0.01 0.29 2.33 5.08 -1.18 -1.79 114.58 119.60 1gfw h GLU 95 Ca -0.16 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1gfw h GLU 95 Cb 1.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.09 1gfw h GLU 95 CO 0.22 0.65 -0.14 0.82 -1.00 0.00 0.00 179.01 179.57 1gfw h ILE 96 N 0.01 0.74 -0.74 3.13 2.04 -1.29 0.78 117.51 122.18 1gfw h ILE 96 Ca -0.01 -0.19 0.04 0.00 1.00 0.00 0.00 64.86 65.70 1gfw h ILE 96 Cb 1.15 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 38.03 1gfw h ILE 96 CO 0.08 0.04 0.46 0.58 0.00 0.00 0.00 178.15 179.32 1gfw h VAL 97 N -0.48 1.07 -0.24 1.67 2.07 -1.48 -0.77 116.25 118.09 1gfw h VAL 97 Ca -0.04 -0.30 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1gfw h VAL 97 Cb 0.36 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1gfw h VAL 97 CO 0.06 0.16 -0.14 -0.08 0.02 0.00 0.00 177.57 177.60 1gfw h GLU 98 N 0.88 0.52 -0.36 1.57 4.81 -1.20 0.39 114.58 121.18 1gfw h GLU 98 Ca 0.31 -0.24 0.08 0.00 -0.13 0.00 0.00 59.36 59.38 1gfw h GLU 98 Cb 0.07 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.36 1gfw h GLU 98 CO -0.13 0.80 -0.22 1.25 -0.73 0.00 0.00 179.01 179.97 1gfw h LEU 99 N 0.23 -0.74 0.56 1.64 5.85 -0.54 0.51 115.31 122.82 1gfw h LEU 99 Ca 0.05 0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 1gfw h LEU 99 Cb 0.65 0.38 0.01 0.00 0.37 0.00 0.00 40.66 42.07 1gfw h LEU 99 CO 0.04 -0.25 -0.27 0.24 -0.34 0.00 0.00 178.44 177.86 1gfw h MET 100 N -0.17 -0.73 -0.63 1.25 2.86 -1.09 0.49 114.93 116.91 1gfw h MET 100 Ca 0.18 0.05 0.13 0.00 -2.06 0.00 0.00 59.70 58.00 1gfw h MET 100 Cb 0.45 0.17 -0.10 0.00 0.06 0.00 0.00 31.60 32.17 1gfw h MET 100 CO -0.47 -0.42 0.05 -0.09 1.06 0.00 0.00 176.91 177.04 1gfw h ARG 101 N -0.96 0.16 -0.20 1.72 2.43 -0.58 0.31 114.38 117.26 1gfw h ARG 101 Ca -0.08 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1gfw h ARG 101 Cb 0.64 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1gfw h ARG 101 CO 0.13 0.10 0.09 -0.44 -1.51 0.00 0.00 179.97 178.34 1gfw h ASP 102 N 0.16 0.27 -0.48 -3.80 3.45 0.18 -2.25 116.42 113.95 1gfw h ASP 102 Ca 0.34 -0.15 -0.07 0.00 0.43 0.00 0.00 57.03 57.57 1gfw h ASP 102 Cb 0.54 -0.07 -0.02 0.00 -0.56 0.00 0.00 39.33 39.22 1gfw h ASP 102 CO -0.50 0.35 0.05 0.58 -1.57 0.00 0.00 179.24 178.14 1gfw h VAL 103 N 0.18 1.25 0.00 -1.35 2.07 0.82 -2.09 116.25 117.12 1gfw h VAL 103 Ca 0.07 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.54 1gfw h VAL 103 Cb 0.16 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1gfw h VAL 103 CO -0.01 0.36 -0.26 0.77 0.02 0.00 0.00 177.57 178.45 1gfw h SER 104 N 0.83 0.00 1.23 0.57 4.64 -0.30 -2.05 113.55 118.47 1gfw h SER 104 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1gfw h SER 104 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1gfw h SER 104 CO 0.02 0.26 0.00 0.11 -0.87 0.00 0.00 176.83 176.35 1gfw h LYS 105 N 0.00 0.00 -7.26 4.77 1.79 -0.76 -3.46 116.57 111.65 1gfw h LYS 105 Ca -0.00 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.96 1gfw h LYS 105 Cb 0.50 0.00 0.19 0.00 -1.58 0.00 0.00 32.23 31.34 1gfw h LYS 105 CO 0.03 0.00 0.21 -1.21 -1.08 0.00 0.00 179.45 177.40 1gfw s GLU 106 N -3.30 0.91 -0.63 3.15 2.02 -0.77 -4.95 118.70 115.13 1gfw s GLU 106 Ca 0.06 1.46 -0.21 0.00 0.02 0.00 0.00 54.97 56.30 1gfw s GLU 106 Cb 0.09 -1.72 0.09 0.00 0.10 0.00 0.00 34.13 32.69 1gfw s GLU 106 CO 0.53 -2.68 0.84 0.34 0.02 0.00 0.00 175.26 174.32 1gfw s ASP 107 N -2.70 6.18 -0.16 -0.19 2.15 -1.26 -4.86 116.67 115.82 1gfw s ASP 107 Ca 0.67 -1.19 0.05 0.00 0.43 0.00 0.00 52.55 52.51 1gfw s ASP 107 Cb -0.23 -2.36 0.38 0.00 -0.30 0.00 0.00 42.92 40.41 1gfw s ASP 107 CO 0.58 -1.29 1.25 1.41 -0.17 0.00 0.00 175.17 176.96 1gfw n HIS 108 N 7.06 1.23 -0.19 -5.34 8.25 -1.26 -4.56 115.22 120.42 1gfw n HIS 108 Ca -0.06 -0.66 -0.01 0.00 -0.26 0.00 0.00 57.72 56.73 1gfw n HIS 108 Cb 0.44 -0.42 0.09 0.00 1.12 0.00 0.00 29.99 31.23 1gfw n HIS 108 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1gfw h SER 109 N 1.45 0.11 -0.25 0.41 0.02 -1.91 -1.70 113.55 111.67 1gfw h SER 109 Ca 0.12 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 1gfw h SER 109 Cb 1.50 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 64.13 1gfw h SER 109 CO 0.36 0.08 0.01 0.29 -1.14 0.00 0.00 176.83 176.42 1gfw n LYS 110 N -5.06 2.66 -4.98 3.45 4.76 -1.26 -4.88 118.16 112.86 1gfw n LYS 110 Ca 0.08 -1.36 -0.32 0.00 -2.87 0.00 0.00 58.31 53.83 1gfw n LYS 110 Cb 0.27 -1.83 -0.14 0.00 -1.84 0.00 0.00 35.03 31.50 1gfw n LYS 110 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1gfw s ARG 111 N -1.75 2.37 0.15 1.97 0.52 -0.64 -1.35 118.95 120.21 1gfw s ARG 111 Ca 0.24 -0.78 0.03 0.00 -0.52 0.00 0.00 55.73 54.70 1gfw s ARG 111 Cb 0.18 -2.28 -0.08 0.00 0.52 0.00 0.00 34.95 33.30 1gfw s ARG 111 CO 0.07 0.60 1.33 0.77 0.02 0.00 0.00 175.30 178.09 1gfw h SER 112 N 5.31 0.19 -0.36 0.23 0.02 -1.40 -3.47 113.55 114.07 1gfw h SER 112 Ca -0.46 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.32 1gfw h SER 112 Cb 1.14 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.62 1gfw h SER 112 CO 0.49 1.03 0.00 -1.54 -1.14 0.00 0.00 176.83 175.67 1gfw n SER 113 N -3.57 0.00 -3.65 3.07 3.41 -1.12 -4.14 113.62 107.62 1gfw n SER 113 Ca -0.03 -0.29 -0.02 0.00 -0.26 0.00 0.00 58.87 58.26 1gfw n SER 113 Cb 0.86 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.76 1gfw n SER 113 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1gfw s PHE 114 N -3.97 -1.27 0.14 7.33 5.36 -1.03 -4.16 117.98 120.39 1gfw s PHE 114 Ca 0.00 2.22 0.07 0.00 -0.96 0.00 0.00 56.93 58.26 1gfw s PHE 114 Cb 0.00 0.74 -0.04 0.00 -0.34 0.00 0.00 43.02 43.38 1gfw s PHE 114 CO 0.00 -0.64 -0.02 0.08 -1.46 0.00 0.00 175.22 173.18 1gfw s VAL 115 N 2.86 3.72 -0.21 3.12 1.01 -1.21 0.92 120.40 130.61 1gfw s VAL 115 Ca -0.05 -1.30 -0.06 0.00 0.00 0.00 0.00 61.98 60.57 1gfw s VAL 115 Cb -0.12 -2.82 0.10 0.00 0.00 0.00 0.00 36.38 33.54 1gfw s VAL 115 CO -0.18 -0.02 0.41 0.00 0.00 0.00 0.00 175.10 175.31 1gfw s VAL 117 N 2.60 3.46 -0.35 0.00 1.01 0.37 -0.85 120.40 126.64 1gfw s VAL 117 Ca 0.01 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 1gfw s VAL 117 Cb -0.13 -2.56 0.05 0.00 0.00 0.00 0.00 36.38 33.74 1gfw s VAL 117 CO -0.13 0.44 0.13 -0.76 0.00 0.00 0.00 175.10 174.78 1gfw s LEU 118 N 1.23 4.49 -0.36 3.92 1.43 -0.78 0.29 118.68 128.90 1gfw s LEU 118 Ca 0.03 -1.25 -0.10 0.00 -1.03 0.00 0.00 54.13 51.78 1gfw s LEU 118 Cb -0.14 -1.88 0.03 0.00 0.03 0.00 0.00 46.19 44.22 1gfw s LEU 118 CO -0.01 -0.37 0.18 -0.76 0.23 0.00 0.00 176.35 175.62 1gfw s LEU 119 N 1.39 4.57 0.00 1.79 1.43 0.08 -1.68 118.68 126.26 1gfw s LEU 119 Ca -0.00 -0.97 0.00 0.00 -1.03 0.00 0.00 54.13 52.13 1gfw s LEU 119 Cb -0.20 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.03 1gfw s LEU 119 CO 0.02 -0.35 0.00 -0.24 0.23 0.00 0.00 176.35 176.01 1gfw n SER 120 N 4.96 0.00 -4.89 2.29 2.88 0.02 -2.12 113.62 116.76 1gfw n SER 120 Ca -0.12 -0.69 -0.29 0.00 -1.33 0.00 0.00 58.87 56.44 1gfw n SER 120 Cb 0.46 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.92 1gfw n SER 120 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1gfw s HIS 121 N -3.69 3.57 0.06 0.66 3.76 -1.26 -3.73 115.29 114.66 1gfw s HIS 121 Ca 0.00 0.98 -0.03 0.00 -0.15 0.00 0.00 55.06 55.86 1gfw s HIS 121 Cb 0.00 -2.44 0.01 0.00 1.11 0.00 0.00 32.58 31.26 1gfw s HIS 121 CO 0.00 -0.38 0.16 0.41 -0.85 0.00 0.00 174.74 174.08 1gfw n GLY 122 N -2.30 1.61 3.51 -2.22 0.00 -1.25 -2.46 105.19 102.08 1gfw n GLY 122 Ca 0.02 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.92 1gfw n GLY 122 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gfw s GLU 123 N -2.01 0.84 -0.41 1.61 2.02 0.17 -4.21 118.70 116.71 1gfw s GLU 123 Ca 0.03 -0.17 -0.40 0.00 0.02 0.00 0.00 54.97 54.45 1gfw s GLU 123 Cb -0.01 0.39 -0.16 0.00 0.10 0.00 0.00 34.13 34.45 1gfw s GLU 123 CO 0.02 -0.34 2.08 -1.91 0.02 0.00 0.00 175.26 175.13 1gfw n GLU 124 N 0.05 0.57 0.00 1.61 4.07 -1.00 -0.21 120.64 125.74 1gfw n GLU 124 Ca -0.11 0.17 0.00 0.00 -0.06 0.00 0.00 57.16 57.16 1gfw n GLU 124 Cb 0.61 -1.96 0.00 0.00 -0.06 0.00 0.00 31.44 30.03 1gfw n GLU 124 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1gfw n GLY 125 N 6.51 3.26 3.22 8.31 0.00 -1.26 -5.03 105.19 120.20 1gfw n GLY 125 Ca 0.45 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.25 1gfw n GLY 125 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1gfw s ILE 126 N -2.41 1.41 -0.00 -0.61 -0.00 0.71 0.16 121.20 120.46 1gfw s ILE 126 Ca 0.00 -1.28 0.05 0.00 -0.00 0.00 0.00 60.65 59.42 1gfw s ILE 126 Cb 0.00 -1.28 -0.01 0.00 -0.00 0.00 0.00 42.46 41.16 1gfw s ILE 126 CO 0.00 -0.03 -0.16 0.27 -0.00 0.00 0.00 174.94 175.02 1gfw s ILE 127 N -1.03 1.26 -0.02 8.37 -5.25 0.12 -1.49 121.20 123.16 1gfw s ILE 127 Ca 0.03 -0.75 -0.27 0.00 -0.99 0.00 0.00 60.65 58.67 1gfw s ILE 127 Cb -0.09 -1.06 -0.03 0.00 2.95 0.00 0.00 42.46 44.22 1gfw s ILE 127 CO 0.03 0.30 0.86 -0.36 -1.79 0.00 0.00 174.94 173.97 1gfw s PHE 128 N -0.46 3.64 1.02 1.37 0.08 -1.03 0.12 117.98 122.72 1gfw s PHE 128 Ca 0.06 1.51 -0.17 0.00 0.12 0.00 0.00 56.93 58.45 1gfw s PHE 128 Cb -0.06 -2.98 0.23 0.00 -0.57 0.00 0.00 43.02 39.64 1gfw s PHE 128 CO -0.00 0.05 1.33 0.20 -0.10 0.00 0.00 175.22 176.70 1gfw s GLY 129 N 0.84 1.80 0.13 4.36 0.00 0.96 -4.68 107.32 110.72 1gfw s GLY 129 Ca 0.45 -1.29 0.20 0.00 0.00 0.00 0.00 44.72 44.08 1gfw s GLY 129 CO 0.24 -0.45 1.62 -1.30 0.00 0.00 0.00 173.10 173.21 1gfw n THR 130 N -3.98 0.84 -0.00 0.90 -2.24 0.20 -3.35 114.28 106.65 1gfw n THR 130 Ca 0.17 0.20 -0.00 0.00 -2.27 0.00 0.00 64.05 62.14 1gfw n THR 130 Cb 0.59 -1.02 -0.01 0.00 -2.10 0.00 0.00 70.33 67.79 1gfw n THR 130 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1gfw n ASN 131 N -1.89 4.61 -1.59 3.42 6.94 -1.26 -1.39 115.26 124.10 1gfw n ASN 131 Ca 0.03 0.00 -0.03 0.00 -0.02 0.00 0.00 54.58 54.56 1gfw n ASN 131 Cb 0.22 0.76 0.00 0.00 -2.36 0.00 0.00 39.78 38.41 1gfw n ASN 131 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1gfw n GLY 132 N 2.70 1.95 3.88 4.83 0.00 -1.21 -4.69 105.19 112.64 1gfw n GLY 132 Ca -0.02 -1.18 -0.31 0.00 0.00 0.00 0.00 46.02 44.51 1gfw n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gfw s PRO 133 N -2.09 3.77 -0.03 1.61 0.04 -1.26 0.32 135.00 137.36 1gfw s PRO 133 Ca 0.06 0.23 0.05 0.00 0.04 0.00 0.00 61.00 61.37 1gfw s PRO 133 Cb -0.01 -2.65 -0.01 0.00 0.04 0.00 0.00 34.50 31.87 1gfw s PRO 133 CO 0.05 0.31 -0.17 0.08 0.04 0.00 0.00 177.00 177.30 1gfw s VAL 134 N -1.85 1.37 -0.04 -0.36 1.01 0.32 -4.77 120.40 116.09 1gfw s VAL 134 Ca 0.47 -0.71 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 1gfw s VAL 134 Cb -0.11 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 1gfw s VAL 134 CO 0.23 0.39 1.00 -1.81 0.00 0.00 0.00 175.10 174.91 1gfw s ASP 135 N -0.15 7.31 0.40 3.32 -0.00 -1.26 0.15 116.67 126.44 1gfw s ASP 135 Ca 0.01 1.63 0.15 0.00 -0.00 0.00 0.00 52.55 54.34 1gfw s ASP 135 Cb -0.09 -2.57 1.01 0.00 -0.00 0.00 0.00 42.92 41.27 1gfw s ASP 135 CO 0.01 -0.34 1.88 -0.07 -0.00 0.00 0.00 175.17 176.64 1gfw h LEU 136 N 7.26 0.46 -0.44 1.23 3.38 0.12 0.46 115.31 127.79 1gfw h LEU 136 Ca -0.37 0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.46 1gfw h LEU 136 Cb 1.19 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 1gfw h LEU 136 CO 0.79 0.21 -0.58 0.50 0.09 0.00 0.00 178.44 179.45 1gfw h LYS 137 N 0.48 0.61 -0.25 1.13 1.63 -1.92 -1.89 116.57 116.36 1gfw h LYS 137 Ca 0.44 -0.41 -0.01 0.00 -0.85 0.00 0.00 60.65 59.82 1gfw h LYS 137 Cb 0.96 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.64 1gfw h LYS 137 CO -0.17 1.02 0.12 -0.22 -3.45 0.00 0.00 179.45 176.75 1gfw h LYS 138 N 0.46 0.33 0.04 1.90 1.63 -1.28 -2.00 116.57 117.66 1gfw h LYS 138 Ca 0.00 -0.03 -0.38 0.00 -0.85 0.00 0.00 60.65 59.40 1gfw h LYS 138 Cb 1.15 -0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 32.66 1gfw h LYS 138 CO 0.11 0.26 -2.27 0.44 -3.45 0.00 0.00 179.45 174.54 1gfw n ILE 139 N -4.46 1.59 0.91 2.00 -5.35 -1.06 -4.06 119.36 108.92 1gfw n ILE 139 Ca 0.01 -0.63 0.08 0.00 -0.27 0.00 0.00 62.75 61.93 1gfw n ILE 139 Cb 0.11 -1.43 0.45 0.00 -1.74 0.00 0.00 39.64 37.03 1gfw n ILE 139 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1gfw n THR 140 N -3.28 0.20 0.63 7.28 -2.24 -0.72 -2.26 114.28 113.89 1gfw n THR 140 Ca -0.39 0.05 0.12 0.00 -2.27 0.00 0.00 64.05 61.56 1gfw n THR 140 Cb 1.03 -0.80 0.22 0.00 -2.10 0.00 0.00 70.33 68.68 1gfw n THR 140 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1gfw n ASN 141 N -1.10 0.68 0.20 3.42 4.13 -0.76 -3.31 115.26 118.51 1gfw n ASN 141 Ca 0.10 0.16 0.14 0.00 1.68 0.00 0.00 54.58 56.66 1gfw n ASN 141 Cb 0.08 0.03 0.48 0.00 -1.54 0.00 0.00 39.78 38.83 1gfw n ASN 141 CO 0.00 0.00 0.00 -0.26 0.28 0.00 0.00 177.26 177.28 1gfw h PHE 142 N 0.00 0.00 -0.50 3.10 0.04 -1.67 -3.05 116.94 114.87 1gfw h PHE 142 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1gfw h PHE 142 Cb 0.72 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.87 1gfw h PHE 142 CO 0.00 0.00 0.00 1.19 -0.60 0.00 0.00 178.31 178.90 1gfw n PHE 143 N -2.72 0.67 -1.80 -0.55 3.72 -1.21 -3.75 117.46 111.82 1gfw n PHE 143 Ca 0.03 -0.46 -0.39 0.00 -0.05 0.00 0.00 57.45 56.57 1gfw n PHE 143 Cb 0.35 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 38.91 1gfw n PHE 143 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1gfw s ARG 144 N -1.03 3.47 0.62 -1.08 0.52 -1.15 -4.46 118.95 115.84 1gfw s ARG 144 Ca 0.35 2.33 0.11 0.00 -0.52 0.00 0.00 55.73 58.00 1gfw s ARG 144 Cb 0.18 -2.50 0.38 0.00 0.52 0.00 0.00 34.95 33.54 1gfw s ARG 144 CO 0.24 -0.96 1.09 0.41 0.02 0.00 0.00 175.30 176.11 1gfw n GLY 145 N 0.64 -0.59 0.31 -3.53 0.00 -1.26 0.16 105.19 100.91 1gfw n GLY 145 Ca 0.07 0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.31 1gfw n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gfw n ASP 146 N -2.76 1.45 -0.00 1.61 5.75 -1.26 -4.48 116.55 116.86 1gfw n ASP 146 Ca 0.10 -1.23 0.02 0.00 -0.01 0.00 0.00 54.79 53.68 1gfw n ASP 146 Cb 1.19 0.47 -0.03 0.00 -1.03 0.00 0.00 41.12 41.72 1gfw n ASP 146 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gfw n ARG 147 N -0.17 4.70 -3.28 0.11 1.74 0.43 -4.68 116.66 115.50 1gfw n ARG 147 Ca 0.06 -0.01 -0.25 0.00 -0.77 0.00 0.00 57.85 56.88 1gfw n ARG 147 Cb 0.28 -0.78 -0.07 0.00 -1.02 0.00 0.00 32.46 30.87 1gfw n ARG 147 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1gfw h ARG 149 N 4.05 0.01 -0.28 0.00 3.08 -1.83 0.13 114.38 119.53 1gfw h ARG 149 Ca 0.12 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1gfw h ARG 149 Cb 0.79 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1gfw h ARG 149 CO 0.62 0.01 0.00 -1.13 -1.07 0.00 0.00 179.97 178.39 1gfw n SER 150 N -5.55 0.28 0.00 7.04 3.41 -1.26 -2.18 113.62 115.35 1gfw n SER 150 Ca 0.17 -1.49 0.00 0.00 -0.26 0.00 0.00 58.87 57.29 1gfw n SER 150 Cb 0.55 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 1gfw n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1gfw n LEU 151 N -0.26 0.42 -4.72 1.04 4.77 0.42 -4.02 117.00 114.65 1gfw n LEU 151 Ca 0.00 -0.46 -0.42 0.00 -0.03 0.00 0.00 56.01 55.10 1gfw n LEU 151 Cb 0.07 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1gfw n LEU 151 CO 0.00 0.11 1.22 -0.89 -1.33 0.00 0.00 177.39 176.50 1gfw s THR 152 N -0.07 2.54 0.00 -5.08 2.01 -0.93 -1.10 115.64 113.01 1gfw s THR 152 Ca 0.00 0.40 0.00 0.00 0.31 0.00 0.00 61.69 62.40 1gfw s THR 152 Cb 0.00 -3.26 0.00 0.00 0.01 0.00 0.00 72.50 69.25 1gfw s THR 152 CO 0.00 0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.58 1gfw n GLY 153 N 3.47 1.36 3.74 4.40 0.00 -1.26 -5.02 105.19 111.88 1gfw n GLY 153 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1gfw n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gfw s LYS 154 N -0.49 2.77 -0.31 1.61 1.02 -0.26 -4.95 119.74 119.12 1gfw s LYS 154 Ca 0.00 -0.73 -0.29 0.00 0.02 0.00 0.00 55.97 54.97 1gfw s LYS 154 Cb 0.00 -2.66 0.01 0.00 -0.52 0.00 0.00 37.83 34.66 1gfw s LYS 154 CO 0.00 0.56 1.15 -1.25 -0.92 0.00 0.00 175.35 174.89 1gfw s PRO 155 N -2.31 4.02 -0.38 -1.68 0.04 -1.26 -4.99 135.00 128.44 1gfw s PRO 155 Ca 0.28 1.13 -0.17 0.00 0.04 0.00 0.00 61.00 62.28 1gfw s PRO 155 Cb -0.12 -3.79 0.00 0.00 0.04 0.00 0.00 34.50 30.64 1gfw s PRO 155 CO 0.20 -0.97 0.45 0.15 0.04 0.00 0.00 177.00 176.87 1gfw s LYS 156 N 3.82 3.41 -0.20 4.56 3.01 -1.26 -2.45 119.74 130.63 1gfw s LYS 156 Ca 0.49 -0.45 -0.04 0.00 -1.01 0.00 0.00 55.97 54.96 1gfw s LYS 156 Cb -0.14 -3.87 -0.01 0.00 -1.01 0.00 0.00 37.83 32.80 1gfw s LYS 156 CO 0.18 -0.70 -0.04 -0.51 0.51 0.00 0.00 175.35 174.79 1gfw s LEU 157 N 2.22 2.99 -0.23 3.17 1.43 0.26 -5.00 118.68 123.53 1gfw s LEU 157 Ca 0.15 -0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1gfw s LEU 157 Cb -0.16 -1.75 0.02 0.00 0.03 0.00 0.00 46.19 44.33 1gfw s LEU 157 CO 0.13 0.04 -0.08 -0.36 0.23 0.00 0.00 176.35 176.31 1gfw s PHE 158 N 1.11 3.00 -0.16 0.29 0.40 -1.26 0.18 117.98 121.53 1gfw s PHE 158 Ca 0.02 -1.46 -0.06 0.00 -0.60 0.00 0.00 56.93 54.82 1gfw s PHE 158 Cb -0.15 -2.04 -0.04 0.00 0.51 0.00 0.00 43.02 41.31 1gfw s PHE 158 CO -0.00 -0.71 0.03 0.42 0.70 0.00 0.00 175.22 175.66 1gfw s ILE 159 N 1.34 4.53 -0.23 0.64 1.01 -0.03 -4.98 121.20 123.49 1gfw s ILE 159 Ca 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.54 1gfw s ILE 159 Cb -0.16 -3.01 0.06 0.00 0.01 0.00 0.00 42.46 39.36 1gfw s ILE 159 CO -0.06 0.49 -0.04 -0.63 0.00 0.00 0.00 174.94 174.70 1gfw s ILE 160 N 0.21 1.43 -0.55 2.92 1.01 -1.26 -1.86 121.20 123.10 1gfw s ILE 160 Ca 0.02 -1.16 -0.08 0.00 0.00 0.00 0.00 60.65 59.43 1gfw s ILE 160 Cb -0.13 -1.72 0.14 0.00 0.01 0.00 0.00 42.46 40.76 1gfw s ILE 160 CO 0.01 -0.11 0.42 -1.58 0.00 0.00 0.00 174.94 173.67 1gfw s GLN 161 N 1.44 2.62 -0.02 2.79 2.00 -0.68 -5.01 119.66 122.80 1gfw s GLN 161 Ca -0.05 -2.03 -0.30 0.00 -2.00 0.00 0.00 55.36 50.98 1gfw s GLN 161 Cb -0.19 -3.93 0.11 0.00 0.80 0.00 0.00 33.01 29.80 1gfw s GLN 161 CO -0.06 -1.20 1.10 0.00 -0.50 0.00 0.00 175.29 174.63 1gfw s ALA 162 N 0.88 -1.97 0.46 1.58 0.00 -1.24 -0.80 121.76 120.67 1gfw s ALA 162 Ca 0.10 0.89 -0.21 0.00 0.00 0.00 0.00 51.96 52.74 1gfw s ALA 162 Cb -0.23 0.30 -0.09 0.00 0.00 0.00 0.00 23.12 23.11 1gfw s ALA 162 CO -0.03 -0.84 1.02 0.00 0.00 0.00 0.00 175.76 175.91 1gfw n ARG 164 N -0.71 1.82 -1.11 0.00 1.74 -1.26 0.46 116.66 117.59 1gfw n ARG 164 Ca 0.08 -2.79 0.00 0.00 -0.77 0.00 0.00 57.85 54.37 1gfw n ARG 164 Cb 0.52 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 1gfw n ARG 164 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gfw n GLY 165 N -1.12 0.41 1.52 -0.13 0.00 -1.26 -2.37 105.19 102.24 1gfw n GLY 165 Ca 0.19 -1.54 -0.00 0.00 0.00 0.00 0.00 46.02 44.67 1gfw n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gfw n THR 166 N 9.00 1.32 -2.72 2.61 -2.24 -1.26 -4.91 114.28 116.08 1gfw n THR 166 Ca 0.00 -2.55 -0.30 0.00 -2.27 0.00 0.00 64.05 58.93 1gfw n THR 166 Cb 0.00 0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.52 1gfw n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1gfw s GLU 167 N -2.25 3.76 -0.09 -0.78 2.02 -1.26 -5.08 118.70 115.01 1gfw s GLU 167 Ca 0.37 0.50 0.03 0.00 0.02 0.00 0.00 54.97 55.89 1gfw s GLU 167 Cb 0.37 -2.34 0.01 0.00 0.10 0.00 0.00 34.13 32.27 1gfw s GLU 167 CO -0.08 -0.11 -0.17 -0.51 0.02 0.00 0.00 175.26 174.40 1gfw s LEU 168 N -4.06 1.83 -0.82 1.80 1.43 -1.26 -5.08 118.68 112.52 1gfw s LEU 168 Ca 0.52 -0.44 -0.21 0.00 -1.03 0.00 0.00 54.13 52.97 1gfw s LEU 168 Cb -0.10 -1.13 0.10 0.00 0.03 0.00 0.00 46.19 45.09 1gfw s LEU 168 CO 0.34 0.07 1.09 -0.62 0.23 0.00 0.00 176.35 177.46 1gfw s ASP 169 N 0.68 6.41 0.00 2.29 -1.08 -1.26 -4.84 116.67 118.88 1gfw s ASP 169 Ca -0.13 -1.51 0.11 0.00 -0.52 0.00 0.00 52.55 50.50 1gfw s ASP 169 Cb -0.16 -2.43 0.58 0.00 -1.46 0.00 0.00 42.92 39.46 1gfw s ASP 169 CO 0.03 -1.28 1.25 0.00 0.52 0.00 0.00 175.17 175.70 1gfw n GLY 171 N -0.31 -1.84 2.79 0.00 0.00 -1.26 -4.87 105.19 99.69 1gfw n GLY 171 Ca 0.06 -1.05 -0.25 0.00 0.00 0.00 0.00 46.02 44.77 1gfw n GLY 171 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1gfw s ILE 172 N -2.29 0.56 -2.60 -0.61 1.10 -1.26 -5.30 121.20 110.80 1gfw s ILE 172 Ca 0.00 -0.17 0.27 0.00 -0.51 0.00 0.00 60.65 60.24 1gfw s ILE 172 Cb 0.00 -0.79 0.48 0.00 0.15 0.00 0.00 42.46 42.29 1gfw s ILE 172 CO 0.00 0.14 1.64 1.21 -2.11 0.00 0.00 174.94 175.82