#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ggm s ASN 1 N 0.00 6.43 -0.14 6.12 0.01 -1.26 -5.04 114.94 121.06 3ggm s ASN 1 Ca 0.00 0.04 0.02 0.00 -0.71 0.00 0.00 52.86 52.21 3ggm s ASN 1 Cb 0.00 -2.36 0.00 0.00 0.41 0.00 0.00 41.25 39.31 3ggm s ASN 1 CO 0.00 -0.75 -0.21 -0.69 -1.51 0.00 0.00 177.10 173.95 3ggm s VAL 2 N 2.98 2.22 0.54 1.60 1.01 -1.26 -4.99 120.40 122.49 3ggm s VAL 2 Ca 0.27 -0.93 -0.18 0.00 0.00 0.00 0.00 61.98 61.14 3ggm s VAL 2 Cb -0.13 -1.89 -0.06 0.00 0.00 0.00 0.00 36.38 34.29 3ggm s VAL 2 CO 0.18 0.54 1.05 -2.16 0.00 0.00 0.00 175.10 174.72 3ggm s PRO 3 N 0.72 3.56 0.06 2.72 0.04 -1.26 -4.91 135.00 135.92 3ggm s PRO 3 Ca -0.09 1.31 0.09 0.00 0.04 0.00 0.00 61.00 62.36 3ggm s PRO 3 Cb -0.16 -2.06 -0.21 0.00 0.04 0.00 0.00 34.50 32.11 3ggm s PRO 3 CO 0.01 -0.63 1.05 -0.44 0.04 0.00 0.00 177.00 177.03 3ggm h ASP 4 N 1.05 0.00 -4.41 6.66 3.32 -1.10 -3.37 116.42 118.57 3ggm h ASP 4 Ca -0.48 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.38 3ggm h ASP 4 Cb 1.22 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.54 3ggm h ASP 4 CO 0.58 0.99 -0.61 -0.32 -1.72 0.00 0.00 179.24 178.16 3ggm s MET 5 N -2.68 0.25 -0.12 3.56 -2.45 -0.61 0.94 119.30 118.20 3ggm s MET 5 Ca -0.01 -0.22 -0.03 0.00 -1.25 0.00 0.00 55.69 54.17 3ggm s MET 5 Cb 0.09 0.10 0.05 0.00 1.25 0.00 0.00 34.83 36.32 3ggm s MET 5 CO 0.82 -0.05 0.07 0.42 1.05 0.00 0.00 175.02 177.33 3ggm s ILE 6 N -0.75 -0.01 -0.22 10.11 1.01 0.17 -0.48 121.20 131.04 3ggm s ILE 6 Ca -0.08 0.03 -0.09 0.00 0.00 0.00 0.00 60.65 60.51 3ggm s ILE 6 Cb -0.05 -0.46 -0.04 0.00 0.01 0.00 0.00 42.46 41.92 3ggm s ILE 6 CO 0.00 -0.07 0.11 -0.76 0.00 0.00 0.00 174.94 174.22 3ggm s LEU 7 N 2.11 3.89 0.33 2.97 1.02 -0.37 -0.21 118.68 128.42 3ggm s LEU 7 Ca 0.03 0.04 0.04 0.00 0.02 0.00 0.00 54.13 54.26 3ggm s LEU 7 Cb -0.14 -2.02 -0.03 0.00 0.02 0.00 0.00 46.19 44.01 3ggm s LEU 7 CO -0.07 0.08 0.17 -0.72 0.02 0.00 0.00 176.35 175.84 3ggm s TYR 8 N 0.93 1.67 -1.38 0.29 1.13 -0.37 -0.23 117.35 119.39 3ggm s TYR 8 Ca 0.06 -1.39 -0.07 0.00 -1.41 0.00 0.00 57.07 54.25 3ggm s TYR 8 Cb -0.13 -0.90 0.03 0.00 -1.10 0.00 0.00 41.96 39.85 3ggm s TYR 8 CO 0.03 -0.52 0.99 -1.71 -2.51 0.00 0.00 175.55 171.83 3ggm n ASN 9 N -1.11 -4.09 -0.45 -0.18 5.15 -0.41 -0.49 115.26 113.69 3ggm n ASN 9 Ca 0.01 -0.69 0.00 0.00 -0.60 0.00 0.00 54.58 53.30 3ggm n ASN 9 Cb 0.64 -4.47 0.00 0.00 -0.53 0.00 0.00 39.78 35.42 3ggm n ASN 9 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ggm n GLY 10 N -1.68 5.33 2.99 8.20 0.00 -0.23 0.32 105.19 120.13 3ggm n GLY 10 Ca -0.09 -1.68 -0.30 0.00 0.00 0.00 0.00 46.02 43.94 3ggm n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ggm s LYS 11 N -0.04 2.00 -0.15 1.61 1.02 -0.83 -4.11 119.74 119.24 3ggm s LYS 11 Ca 0.00 -0.83 -0.00 0.00 0.02 0.00 0.00 55.97 55.16 3ggm s LYS 11 Cb 0.00 -2.39 0.04 0.00 -0.52 0.00 0.00 37.83 34.95 3ggm s LYS 11 CO 0.00 -0.43 -0.07 0.42 -0.92 0.00 0.00 175.35 174.36 3ggm s ILE 12 N 1.41 1.12 0.10 2.17 1.01 0.12 -0.72 121.20 126.41 3ggm s ILE 12 Ca -0.01 -0.54 -0.29 0.00 0.00 0.00 0.00 60.65 59.81 3ggm s ILE 12 Cb -0.16 -1.23 -0.06 0.00 0.01 0.00 0.00 42.46 41.02 3ggm s ILE 12 CO -0.08 0.22 0.92 -0.89 0.00 0.00 0.00 174.94 175.11 3ggm s THR 13 N 1.64 4.55 0.19 2.92 2.01 -1.26 -1.30 115.64 124.39 3ggm s THR 13 Ca 0.02 1.99 0.07 0.00 0.31 0.00 0.00 61.69 64.08 3ggm s THR 13 Cb -0.14 -4.28 -0.05 0.00 0.01 0.00 0.00 72.50 68.04 3ggm s THR 13 CO -0.08 0.33 -0.13 0.42 -0.69 0.00 0.00 174.62 174.46 3ggm s THR 14 N -0.01 1.62 -0.37 -0.82 -4.23 -0.53 -4.98 115.64 106.32 3ggm s THR 14 Ca 0.45 -2.18 0.07 0.00 -1.18 0.00 0.00 61.69 58.85 3ggm s THR 14 Cb -0.23 -2.01 0.62 0.00 1.34 0.00 0.00 72.50 72.22 3ggm s THR 14 CO 0.28 -0.62 1.67 0.18 -0.54 0.00 0.00 174.62 175.59 3ggm n LEU 15 N -0.35 5.61 -4.55 4.79 4.77 -1.26 -4.48 117.00 121.53 3ggm n LEU 15 Ca -0.08 -2.93 -0.42 0.00 -0.03 0.00 0.00 56.01 52.54 3ggm n LEU 15 Cb 0.60 -0.73 -0.06 0.00 -2.33 0.00 0.00 43.42 40.90 3ggm n LEU 15 CO 0.34 0.78 0.42 -0.62 -1.33 0.00 0.00 177.39 176.98 3ggm s ASP 16 N -0.79 6.41 0.45 -1.43 -1.08 -1.26 -4.94 116.67 114.02 3ggm s ASP 16 Ca 0.47 0.00 0.21 0.00 -0.52 0.00 0.00 52.55 52.71 3ggm s ASP 16 Cb 0.38 -2.34 1.19 0.00 -1.46 0.00 0.00 42.92 40.69 3ggm s ASP 16 CO 0.11 -0.69 1.89 -0.65 0.52 0.00 0.00 175.17 176.35 3ggm h PRO 17 N 8.63 0.28 0.00 4.34 0.11 -1.99 -0.08 132.00 143.29 3ggm h PRO 17 Ca -0.26 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3ggm h PRO 17 Cb 1.10 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3ggm h PRO 17 CO 0.87 0.18 -0.10 -1.13 -0.21 0.00 0.00 178.00 177.62 3ggm n SER 18 N -4.44 0.11 -2.78 -2.05 3.41 -1.26 -4.38 113.62 102.23 3ggm n SER 18 Ca 0.17 0.36 -0.09 0.00 -0.26 0.00 0.00 58.87 59.05 3ggm n SER 18 Cb 0.71 -0.36 0.04 0.00 -0.26 0.00 0.00 64.21 64.34 3ggm n SER 18 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 3ggm n GLN 19 N -1.51 0.75 0.10 4.33 7.27 -0.11 -5.01 117.38 123.19 3ggm n GLN 19 Ca 0.07 -1.85 0.10 0.00 0.07 0.00 0.00 57.00 55.39 3ggm n GLN 19 Cb 0.34 -1.46 0.44 0.00 2.41 0.00 0.00 30.24 31.97 3ggm n GLN 19 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 3ggm n PRO 20 N 1.78 0.13 -3.71 3.69 -0.04 -0.79 -4.43 135.00 131.63 3ggm n PRO 20 Ca 0.11 0.40 -0.14 0.00 -0.04 0.00 0.00 63.50 63.82 3ggm n PRO 20 Cb 0.62 -1.77 -0.14 0.00 -0.04 0.00 0.00 33.50 32.16 3ggm n PRO 20 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3ggm s GLU 21 N -3.24 0.10 0.29 0.54 0.41 -1.26 -1.45 118.70 114.08 3ggm s GLU 21 Ca 0.04 0.51 0.04 0.00 -0.41 0.00 0.00 54.97 55.15 3ggm s GLU 21 Cb 0.09 -0.18 -0.06 0.00 -1.78 0.00 0.00 34.13 32.20 3ggm s GLU 21 CO 0.33 -0.23 0.03 0.14 -0.49 0.00 0.00 175.26 175.04 3ggm s VAL 22 N 1.71 1.18 -0.98 2.63 -7.23 -0.42 -4.96 120.40 112.33 3ggm s VAL 22 Ca -0.04 -2.03 0.13 0.00 -1.81 0.00 0.00 61.98 58.23 3ggm s VAL 22 Cb -0.12 -2.62 -0.05 0.00 0.56 0.00 0.00 36.38 34.15 3ggm s VAL 22 CO -0.07 -0.12 0.67 -1.54 -0.31 0.00 0.00 175.10 173.73 3ggm n SER 23 N -0.59 1.14 -3.79 4.85 3.41 -0.77 -0.70 113.62 117.16 3ggm n SER 23 Ca -0.03 -1.07 -0.13 0.00 -0.26 0.00 0.00 58.87 57.38 3ggm n SER 23 Cb 0.65 0.64 -0.10 0.00 -0.26 0.00 0.00 64.21 65.15 3ggm n SER 23 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ggm s ALA 24 N -1.79 -0.64 0.02 7.33 0.00 -0.25 -1.06 121.76 125.36 3ggm s ALA 24 Ca 0.09 0.33 0.01 0.00 0.00 0.00 0.00 51.96 52.38 3ggm s ALA 24 Cb 0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.15 3ggm s ALA 24 CO 0.38 -0.21 -0.04 -1.50 0.00 0.00 0.00 175.76 174.39 3ggm s ILE 25 N -0.96 0.23 -0.06 0.00 2.07 0.68 -1.62 121.20 121.54 3ggm s ILE 25 Ca -0.10 -0.62 0.04 0.00 -1.41 0.00 0.00 60.65 58.55 3ggm s ILE 25 Cb -0.05 -0.30 -0.02 0.00 0.13 0.00 0.00 42.46 42.23 3ggm s ILE 25 CO 0.03 -0.25 -0.19 0.00 -1.91 0.00 0.00 174.94 172.62 3ggm s ALA 26 N -0.88 2.45 -0.08 1.50 0.00 0.41 -1.23 121.76 123.92 3ggm s ALA 26 Ca -0.08 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 50.91 3ggm s ALA 26 Cb -0.06 -0.88 0.01 0.00 0.00 0.00 0.00 23.12 22.18 3ggm s ALA 26 CO -0.00 0.45 -0.18 0.42 0.00 0.00 0.00 175.76 176.45 3ggm s ILE 27 N -0.35 1.60 -0.16 0.00 1.01 0.37 -0.48 121.20 123.20 3ggm s ILE 27 Ca 0.03 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.93 3ggm s ILE 27 Cb -0.12 -1.41 0.03 0.00 0.01 0.00 0.00 42.46 40.97 3ggm s ILE 27 CO 0.02 0.46 -0.12 -0.89 0.00 0.00 0.00 174.94 174.41 3ggm s THR 28 N 0.47 1.49 0.00 2.92 2.01 -0.41 -0.42 115.64 121.70 3ggm s THR 28 Ca -0.16 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.16 3ggm s THR 28 Cb -0.17 -1.47 0.00 0.00 0.01 0.00 0.00 72.50 70.88 3ggm s THR 28 CO 0.06 0.36 0.00 0.47 -0.69 0.00 0.00 174.62 174.82 3ggm n ASP 29 N 4.78 -5.98 0.00 3.53 8.00 -1.26 -2.21 116.55 123.41 3ggm n ASP 29 Ca -0.16 0.80 0.00 0.00 0.71 0.00 0.00 54.79 56.14 3ggm n ASP 29 Cb 0.49 -1.27 0.00 0.00 -0.02 0.00 0.00 41.12 40.32 3ggm n ASP 29 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ggm n GLY 30 N 2.25 0.00 3.30 0.44 0.00 -1.26 -4.87 105.19 105.05 3ggm n GLY 30 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 3ggm n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ggm s LEU 31 N 0.00 2.18 0.00 0.99 1.43 -0.94 -5.10 118.68 117.24 3ggm s LEU 31 Ca 0.00 -0.57 -0.30 0.00 -1.03 0.00 0.00 54.13 52.23 3ggm s LEU 31 Cb 0.00 -1.12 -0.06 0.00 0.03 0.00 0.00 46.19 45.04 3ggm s LEU 31 CO 0.00 0.20 1.48 -0.63 0.23 0.00 0.00 176.35 177.63 3ggm s ILE 32 N -0.83 3.58 -0.13 -0.59 -1.09 -1.26 -1.29 121.20 119.59 3ggm s ILE 32 Ca 0.10 0.94 0.19 0.00 -2.23 0.00 0.00 60.65 59.65 3ggm s ILE 32 Cb -0.09 -3.61 -0.27 0.00 -1.58 0.00 0.00 42.46 36.91 3ggm s ILE 32 CO 0.02 -0.02 0.29 0.41 -1.23 0.00 0.00 174.94 174.41 3ggm n THR 33 N 4.80 0.85 -3.55 2.92 -1.04 0.37 -4.91 114.28 113.73 3ggm n THR 33 Ca 0.14 -0.71 -0.07 0.00 -2.04 0.00 0.00 64.05 61.37 3ggm n THR 33 Cb 0.43 -0.31 -0.03 0.00 -1.82 0.00 0.00 70.33 68.60 3ggm n THR 33 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3ggm s ALA 34 N -2.91 -1.92 0.04 2.41 0.00 -1.21 -4.99 121.76 113.18 3ggm s ALA 34 Ca -0.09 1.30 -0.00 0.00 0.00 0.00 0.00 51.96 53.17 3ggm s ALA 34 Cb 0.09 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 3ggm s ALA 34 CO 0.86 -0.59 -0.03 0.14 0.00 0.00 0.00 175.76 176.14 3ggm s VAL 35 N -2.52 0.21 0.00 0.00 -7.23 -1.26 -0.45 120.40 109.15 3ggm s VAL 35 Ca 0.05 -1.46 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 3ggm s VAL 35 Cb -0.01 -1.04 0.00 0.00 0.56 0.00 0.00 36.38 35.90 3ggm s VAL 35 CO -0.06 -0.79 0.00 0.61 -0.31 0.00 0.00 175.10 174.55 3ggm n GLY 36 N 0.69 -0.36 0.00 2.32 0.00 -0.64 -5.00 105.19 102.20 3ggm n GLY 36 Ca -0.18 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.48 3ggm n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ggm n GLY 37 N 0.00 6.47 0.00 -0.02 0.00 -1.26 -1.09 105.19 109.29 3ggm n GLY 37 Ca 0.00 -2.02 0.04 0.00 0.00 0.00 0.00 46.02 44.04 3ggm n GLY 37 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ggm n ASP 38 N 0.00 0.00 0.29 1.61 5.68 -1.26 -2.05 116.55 120.82 3ggm n ASP 38 Ca 0.00 0.12 0.17 0.00 -0.50 0.00 0.00 54.79 54.58 3ggm n ASP 38 Cb 0.00 -0.25 0.84 0.00 -1.14 0.00 0.00 41.12 40.57 3ggm n ASP 38 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3ggm h GLU 39 N 0.00 0.00 -0.16 0.11 9.09 -2.01 -1.60 114.58 120.00 3ggm h GLU 39 Ca 0.00 0.00 0.05 0.00 0.05 0.00 0.00 59.36 59.46 3ggm h GLU 39 Cb 0.07 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.16 3ggm h GLU 39 CO 0.00 0.06 0.13 -0.07 0.05 0.00 0.00 179.01 179.18 3ggm h LEU 40 N 0.00 0.00 -1.75 3.06 4.07 -1.81 -0.57 115.31 118.31 3ggm h LEU 40 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3ggm h LEU 40 Cb 0.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.05 3ggm h LEU 40 CO 0.01 0.00 0.00 -0.07 -1.08 0.00 0.00 178.44 177.30 3ggm h LEU 41 N 0.00 0.00 -1.24 1.67 3.38 -1.53 -1.60 115.31 115.99 3ggm h LEU 41 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3ggm h LEU 41 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3ggm h LEU 41 CO -0.00 0.00 0.00 0.78 0.09 0.00 0.00 178.44 179.31 3ggm h ASN 42 N 0.00 0.00 0.71 -0.43 2.35 -1.28 -2.65 115.58 114.27 3ggm h ASN 42 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3ggm h ASN 42 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 3ggm h ASN 42 CO 0.00 0.00 -0.46 -1.54 -1.65 0.00 0.00 177.43 173.78 3ggm n SER 43 N -3.01 0.51 -4.80 5.81 3.41 -0.60 -4.93 113.62 110.00 3ggm n SER 43 Ca 0.01 -0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.30 3ggm n SER 43 Cb 0.32 0.09 0.04 0.00 -0.26 0.00 0.00 64.21 64.41 3ggm n SER 43 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ggm s ALA 44 N -3.06 2.62 0.21 7.33 0.00 -1.00 -4.54 121.76 123.33 3ggm s ALA 44 Ca 0.10 0.24 -0.01 0.00 0.00 0.00 0.00 51.96 52.28 3ggm s ALA 44 Cb 0.16 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 3ggm s ALA 44 CO 0.68 -1.18 0.17 0.95 0.00 0.00 0.00 175.76 176.38 3ggm s THR 45 N -2.79 0.00 0.33 0.00 -4.23 -1.26 -5.00 115.64 102.68 3ggm s THR 45 Ca 0.61 -1.95 0.20 0.00 -1.18 0.00 0.00 61.69 59.37 3ggm s THR 45 Cb -0.16 -2.48 0.33 0.00 1.34 0.00 0.00 72.50 71.54 3ggm s THR 45 CO 0.49 0.00 1.32 -0.62 -0.54 0.00 0.00 174.62 175.27 3ggm n GLU 46 N -0.30 -0.04 0.16 3.99 -0.58 -1.26 0.13 120.64 122.73 3ggm n GLU 46 Ca 0.02 1.13 0.04 0.00 -0.42 0.00 0.00 57.16 57.92 3ggm n GLU 46 Cb 0.65 -2.08 0.14 0.00 -0.57 0.00 0.00 31.44 29.58 3ggm n GLU 46 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 3ggm h LYS 47 N 0.00 0.00 -6.37 3.49 1.57 -1.96 -3.45 116.57 109.85 3ggm h LYS 47 Ca 0.72 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.96 3ggm h LYS 47 Cb 2.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.34 3ggm h LYS 47 CO -0.57 0.46 0.90 0.95 -0.57 0.00 0.00 179.45 180.61 3ggm s THR 48 N -3.18 3.59 0.11 -0.16 -4.23 0.12 -4.91 115.64 106.98 3ggm s THR 48 Ca 0.03 0.95 -0.30 0.00 -1.18 0.00 0.00 61.69 61.19 3ggm s THR 48 Cb 0.09 -3.61 -0.06 0.00 1.34 0.00 0.00 72.50 70.26 3ggm s THR 48 CO 0.72 -0.01 1.00 -0.54 -0.54 0.00 0.00 174.62 175.25 3ggm s LYS 49 N 2.67 4.66 -0.05 3.99 3.01 0.27 -4.79 119.74 129.49 3ggm s LYS 49 Ca 0.66 1.51 0.05 0.00 -1.01 0.00 0.00 55.97 57.18 3ggm s LYS 49 Cb -0.33 -3.36 -0.00 0.00 -1.01 0.00 0.00 37.83 33.12 3ggm s LYS 49 CO 0.27 0.15 -0.20 -1.59 0.51 0.00 0.00 175.35 174.50 3ggm s LYS 50 N 0.04 2.09 -0.18 1.68 -2.85 -1.26 0.47 119.74 119.73 3ggm s LYS 50 Ca 0.48 -0.70 0.01 0.00 -1.00 0.00 0.00 55.97 54.76 3ggm s LYS 50 Cb -0.25 -1.77 0.04 0.00 -2.06 0.00 0.00 37.83 33.79 3ggm s LYS 50 CO 0.31 0.27 -0.11 0.42 0.10 0.00 0.00 175.35 176.33 3ggm s ILE 51 N 0.04 1.59 -0.57 3.79 1.01 0.70 -4.94 121.20 122.82 3ggm s ILE 51 Ca -0.05 -0.87 -0.28 0.00 0.00 0.00 0.00 60.65 59.45 3ggm s ILE 51 Cb -0.13 -1.62 0.03 0.00 0.01 0.00 0.00 42.46 40.76 3ggm s ILE 51 CO 0.03 0.26 1.15 -0.62 0.00 0.00 0.00 174.94 175.77 3ggm s ASP 52 N 1.44 6.44 0.00 3.58 -1.08 -1.26 -1.24 116.67 124.55 3ggm s ASP 52 Ca 0.01 0.06 0.10 0.00 -0.52 0.00 0.00 52.55 52.20 3ggm s ASP 52 Cb -0.15 -2.54 0.44 0.00 -1.46 0.00 0.00 42.92 39.21 3ggm s ASP 52 CO -0.09 -1.44 1.30 0.18 0.52 0.00 0.00 175.17 175.65 3ggm n LEU 53 N 8.28 0.00 -4.11 -1.34 4.77 0.36 -4.88 117.00 120.08 3ggm n LEU 53 Ca 0.08 0.47 -0.31 0.00 -0.03 0.00 0.00 56.01 56.22 3ggm n LEU 53 Cb 0.49 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 3ggm n LEU 53 CO 0.70 -0.31 -0.16 0.29 -1.33 0.00 0.00 177.39 176.59 3ggm n LYS 54 N -1.47 -3.06 -1.27 3.23 5.02 -1.19 -0.79 118.16 118.64 3ggm n LYS 54 Ca 0.03 0.37 -0.09 0.00 -2.02 0.00 0.00 58.31 56.59 3ggm n LYS 54 Cb 0.11 -4.72 -0.04 0.00 -0.02 0.00 0.00 35.03 30.37 3ggm n LYS 54 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3ggm n ARG 55 N -4.41 -1.26 -1.92 1.97 5.12 0.15 -5.01 116.66 111.30 3ggm n ARG 55 Ca -0.14 0.77 -0.32 0.00 -1.93 0.00 0.00 57.85 56.24 3ggm n ARG 55 Cb 0.60 -4.92 0.01 0.00 -1.16 0.00 0.00 32.46 27.00 3ggm n ARG 55 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3ggm s LYS 56 N -2.56 3.40 0.02 5.56 1.02 0.03 -4.58 119.74 122.63 3ggm s LYS 56 Ca 0.00 0.96 -0.25 0.00 0.02 0.00 0.00 55.97 56.70 3ggm s LYS 56 Cb 0.00 -2.05 -0.05 0.00 -0.52 0.00 0.00 37.83 35.21 3ggm s LYS 56 CO 0.00 -0.73 0.76 0.50 -0.92 0.00 0.00 175.35 174.96 3ggm s ARG 57 N -4.67 4.48 -0.18 1.68 3.52 -1.26 -1.97 118.95 120.56 3ggm s ARG 57 Ca 0.59 1.04 -0.08 0.00 -0.13 0.00 0.00 55.73 57.15 3ggm s ARG 57 Cb -0.13 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 3ggm s ARG 57 CO 0.46 0.22 0.07 0.00 -0.81 0.00 0.00 175.30 175.25 3ggm s ALA 58 N 0.17 3.46 -0.01 6.12 0.00 0.10 -4.90 121.76 126.70 3ggm s ALA 58 Ca 0.39 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.65 3ggm s ALA 58 Cb -0.20 -1.95 -0.01 0.00 0.00 0.00 0.00 23.12 20.96 3ggm s ALA 58 CO 0.22 0.20 -0.11 0.42 0.00 0.00 0.00 175.76 176.49 3ggm s ILE 59 N 0.30 0.86 0.33 0.00 1.01 -1.26 -4.43 121.20 118.01 3ggm s ILE 59 Ca 0.04 -0.46 -0.29 0.00 0.00 0.00 0.00 60.65 59.95 3ggm s ILE 59 Cb -0.12 -0.72 -0.11 0.00 0.01 0.00 0.00 42.46 41.52 3ggm s ILE 59 CO -0.00 0.25 1.43 -2.84 0.00 0.00 0.00 174.94 173.77 3ggm s PRO 60 N -0.21 4.23 0.71 2.79 0.02 -1.26 -4.97 135.00 136.30 3ggm s PRO 60 Ca 0.03 2.40 -0.12 0.00 0.02 0.00 0.00 61.00 63.33 3ggm s PRO 60 Cb -0.05 -3.04 0.02 0.00 0.02 0.00 0.00 34.50 31.46 3ggm s PRO 60 CO -0.00 -0.40 1.08 0.20 -0.33 0.00 0.00 177.00 177.54 3ggm s GLY 61 N -0.11 1.79 0.15 0.52 0.00 -1.26 -4.92 107.32 103.50 3ggm s GLY 61 Ca 0.54 0.25 -0.33 0.00 0.00 0.00 0.00 44.72 45.18 3ggm s GLY 61 CO 0.54 0.58 1.69 1.04 0.00 0.00 0.00 173.10 176.96 3ggm n LEU 62 N -3.04 3.59 -3.52 0.66 7.99 -1.26 -4.93 117.00 116.49 3ggm n LEU 62 Ca 0.09 1.05 -0.28 0.00 -0.01 0.00 0.00 56.01 56.86 3ggm n LEU 62 Cb 0.53 -1.49 -0.11 0.00 -0.11 0.00 0.00 43.42 42.23 3ggm n LEU 62 CO 0.53 -0.03 -0.27 0.21 -1.51 0.00 0.00 177.39 176.32 3ggm s ASN 63 N 1.52 2.52 -0.11 -1.43 2.47 -1.26 -4.90 114.94 113.75 3ggm s ASN 63 Ca 0.79 -2.93 -0.16 0.00 0.42 0.00 0.00 52.86 50.98 3ggm s ASN 63 Cb -0.59 -0.68 0.04 0.00 -1.45 0.00 0.00 41.25 38.58 3ggm s ASN 63 CO 0.37 -0.20 0.41 -0.62 -3.72 0.00 0.00 177.10 173.33 3ggm s ASP 64 N 0.10 -0.38 0.45 -4.21 2.15 -1.26 -5.04 116.67 108.48 3ggm s ASP 64 Ca 0.27 0.62 0.31 0.00 0.43 0.00 0.00 52.55 54.18 3ggm s ASP 64 Cb -0.07 0.68 1.58 0.00 -0.30 0.00 0.00 42.92 44.81 3ggm s ASP 64 CO -0.12 -0.26 1.93 0.77 -0.17 0.00 0.00 175.17 177.32 3ggm h SER 65 N 4.85 0.00 -0.03 -0.34 4.64 -2.06 -2.13 113.55 118.49 3ggm h SER 65 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3ggm h SER 65 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3ggm h SER 65 CO 0.30 0.00 -0.09 1.41 -0.87 0.00 0.00 176.83 177.58 3ggm n HIS 66 N -2.61 0.00 -5.20 4.77 8.25 -1.26 -4.93 115.22 114.24 3ggm n HIS 66 Ca -0.01 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.13 3ggm n HIS 66 Cb 0.10 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.06 3ggm n HIS 66 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3ggm s ILE 67 N -2.06 2.28 -0.18 1.59 -1.09 -0.80 -5.11 121.20 115.83 3ggm s ILE 67 Ca 0.26 -1.01 0.01 0.00 -2.23 0.00 0.00 60.65 57.67 3ggm s ILE 67 Cb 0.19 -1.82 0.02 0.00 -1.58 0.00 0.00 42.46 39.27 3ggm s ILE 67 CO 0.35 0.58 -0.19 -2.28 -1.23 0.00 0.00 174.94 172.16 3ggm s HIS 68 N -0.53 2.80 -0.22 3.97 5.65 -1.26 -4.65 115.29 121.06 3ggm s HIS 68 Ca 0.07 -1.66 -0.24 0.00 0.25 0.00 0.00 55.06 53.48 3ggm s HIS 68 Cb -0.11 -1.92 -0.01 0.00 -1.18 0.00 0.00 32.58 29.36 3ggm s HIS 68 CO 0.00 -0.81 0.80 0.08 -0.65 0.00 0.00 174.74 174.17 3ggm s VAL 69 N 1.29 4.87 -0.34 0.89 1.01 -1.26 -5.00 120.40 121.86 3ggm s VAL 69 Ca 0.05 1.53 -0.29 0.00 0.00 0.00 0.00 61.98 63.27 3ggm s VAL 69 Cb -0.13 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.15 3ggm s VAL 69 CO -0.13 -0.02 1.31 -0.63 0.00 0.00 0.00 175.10 175.63 3ggm s ILE 70 N 2.53 4.10 0.25 2.22 1.01 -1.26 -5.01 121.20 125.04 3ggm s ILE 70 Ca 0.35 1.21 -0.00 0.00 0.00 0.00 0.00 60.65 62.20 3ggm s ILE 70 Cb -0.16 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 3ggm s ILE 70 CO 0.09 -0.58 0.45 -0.13 0.00 0.00 0.00 174.94 174.77 3ggm s ARG 71 N 4.36 3.52 -0.05 2.79 1.81 -1.26 -4.61 118.95 125.51 3ggm s ARG 71 Ca 0.57 -0.33 0.00 0.00 -1.72 0.00 0.00 55.73 54.24 3ggm s ARG 71 Cb -0.15 -2.78 0.00 0.00 -0.45 0.00 0.00 34.95 31.57 3ggm s ARG 71 CO 0.26 0.32 0.00 0.41 -0.68 0.00 0.00 175.30 175.61 3ggm n GLY 72 N -1.03 0.46 3.76 -3.53 0.00 -1.26 -5.04 105.19 98.56 3ggm n GLY 72 Ca -0.05 -0.53 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 3ggm n GLY 72 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ggm s LEU 73 N -0.11 4.45 0.00 0.99 1.43 -1.26 -5.37 118.68 118.81 3ggm s LEU 73 Ca 0.00 1.29 0.18 0.00 -1.03 0.00 0.00 54.13 54.57 3ggm s LEU 73 Cb 0.00 -3.03 0.14 0.00 0.03 0.00 0.00 46.19 43.33 3ggm s LEU 73 CO 0.00 0.10 1.08 -0.62 0.23 0.00 0.00 176.35 177.13