#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gim s GLU 1 N 0.00 1.09 -0.16 3.17 0.41 -1.26 -5.02 118.70 116.92 2gim s GLU 1 Ca 0.00 -1.27 -0.02 0.00 -0.41 0.00 0.00 54.97 53.27 2gim s GLU 1 Cb 0.00 -1.04 -0.01 0.00 -1.78 0.00 0.00 34.13 31.30 2gim s GLU 1 CO 0.00 0.21 -0.09 0.99 -0.49 0.00 0.00 175.26 175.88 2gim s THR 2 N -2.03 3.27 -0.04 3.63 2.01 -1.26 -0.66 115.64 120.55 2gim s THR 2 Ca 0.10 -0.56 0.05 0.00 0.31 0.00 0.00 61.69 61.59 2gim s THR 2 Cb -0.06 -2.42 -0.02 0.00 0.01 0.00 0.00 72.50 70.01 2gim s THR 2 CO 0.04 0.49 -0.18 -0.31 -0.69 0.00 0.00 174.62 173.97 2gim s TYR 3 N 0.74 2.60 -0.12 4.92 1.51 0.83 -4.99 117.35 122.84 2gim s TYR 3 Ca -0.04 -0.24 -0.02 0.00 -1.01 0.00 0.00 57.07 55.76 2gim s TYR 3 Cb -0.15 -1.60 -0.03 0.00 -0.11 0.00 0.00 41.96 40.08 2gim s TYR 3 CO 0.02 0.12 -0.04 0.99 -1.11 0.00 0.00 175.55 175.53 2gim s THR 4 N -0.69 3.94 -0.17 -0.71 2.01 -1.26 0.12 115.64 118.89 2gim s THR 4 Ca 0.11 -0.36 0.01 0.00 0.31 0.00 0.00 61.69 61.75 2gim s THR 4 Cb -0.10 -2.69 0.03 0.00 0.01 0.00 0.00 72.50 69.74 2gim s THR 4 CO 0.00 0.54 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.63 2gim s VAL 5 N -0.17 1.74 0.20 3.82 1.01 0.18 -4.46 120.40 122.72 2gim s VAL 5 Ca 0.03 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 60.92 2gim s VAL 5 Cb -0.13 -1.64 -0.08 0.00 0.00 0.00 0.00 36.38 34.53 2gim s VAL 5 CO 0.02 0.43 1.04 -0.54 0.00 0.00 0.00 175.10 176.06 2gim s LYS 6 N 1.41 4.68 -0.49 2.72 1.02 0.12 -1.34 119.74 127.87 2gim s LYS 6 Ca 0.04 1.64 -0.18 0.00 0.02 0.00 0.00 55.97 57.49 2gim s LYS 6 Cb -0.13 -3.28 0.06 0.00 -0.52 0.00 0.00 37.83 33.96 2gim s LYS 6 CO -0.11 0.23 0.52 -0.51 -0.92 0.00 0.00 175.35 174.56 2gim s LEU 7 N -0.72 5.24 0.00 3.17 1.43 0.57 -0.88 118.68 127.49 2gim s LEU 7 Ca 0.46 -1.08 0.00 0.00 -1.03 0.00 0.00 54.13 52.48 2gim s LEU 7 Cb -0.28 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.61 2gim s LEU 7 CO 0.35 -0.78 0.00 0.61 0.23 0.00 0.00 176.35 176.76 2gim n GLY 8 N 5.18 -1.29 3.79 -3.19 0.00 -0.14 -1.28 105.19 108.26 2gim n GLY 8 Ca -0.09 -1.06 -0.30 0.00 0.00 0.00 0.00 46.02 44.57 2gim n GLY 8 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gim s SER 9 N -0.28 4.68 0.52 1.61 1.04 -0.76 -3.80 113.70 116.71 2gim s SER 9 Ca 0.00 1.53 0.24 0.00 0.48 0.00 0.00 55.95 58.19 2gim s SER 9 Cb 0.00 -2.30 1.35 0.00 0.10 0.00 0.00 66.02 65.17 2gim s SER 9 CO 0.00 -1.88 2.00 0.44 0.98 0.00 0.00 173.24 174.79 2gim h ASP 10 N -1.02 0.04 -0.02 7.02 3.32 -1.96 0.14 116.42 123.92 2gim h ASP 10 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2gim h ASP 10 Cb 1.24 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2gim h ASP 10 CO 0.56 0.02 0.00 0.29 -1.72 0.00 0.00 179.24 178.39 2gim n LYS 11 N -4.40 1.13 -1.42 3.56 4.76 -1.26 -4.92 118.16 115.61 2gim n LYS 11 Ca 0.09 -0.20 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 2gim n LYS 11 Cb 0.55 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 32.39 2gim n LYS 11 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2gim n GLY 12 N 0.89 0.39 3.89 0.72 0.00 0.47 -5.05 105.19 106.51 2gim n GLY 12 Ca 0.16 -0.99 -0.31 0.00 0.00 0.00 0.00 46.02 44.88 2gim n GLY 12 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gim s LEU 13 N 0.00 4.13 -1.39 0.99 1.43 -1.26 -4.85 118.68 117.74 2gim s LEU 13 Ca 0.00 0.82 -0.15 0.00 -1.03 0.00 0.00 54.13 53.76 2gim s LEU 13 Cb 0.00 -3.60 0.06 0.00 0.03 0.00 0.00 46.19 42.68 2gim s LEU 13 CO 0.00 -0.11 2.02 0.18 0.23 0.00 0.00 176.35 178.67 2gim n LEU 14 N -0.40 6.10 -4.12 1.79 4.77 -1.26 -1.83 117.00 122.05 2gim n LEU 14 Ca -0.01 -4.08 -0.11 0.00 -0.03 0.00 0.00 56.01 51.78 2gim n LEU 14 Cb 0.53 -1.69 -0.09 0.00 -2.33 0.00 0.00 43.42 39.85 2gim n LEU 14 CO 0.47 0.75 -0.13 0.68 -1.33 0.00 0.00 177.39 177.83 2gim s VAL 15 N 3.44 0.02 0.06 4.08 -7.23 -1.26 -3.69 120.40 115.82 2gim s VAL 15 Ca 0.49 -1.79 -0.19 0.00 -1.81 0.00 0.00 61.98 58.68 2gim s VAL 15 Cb 0.10 -2.30 -0.06 0.00 0.56 0.00 0.00 36.38 34.67 2gim s VAL 15 CO -0.02 -0.09 0.57 -0.36 -0.31 0.00 0.00 175.10 174.89 2gim s PHE 16 N -4.09 3.78 -0.27 2.82 0.08 -1.26 -0.97 117.98 118.07 2gim s PHE 16 Ca 0.31 1.25 0.02 0.00 0.12 0.00 0.00 56.93 58.63 2gim s PHE 16 Cb 0.05 -2.51 0.07 0.00 -0.57 0.00 0.00 43.02 40.06 2gim s PHE 16 CO 0.09 0.55 -0.04 -2.00 -0.10 0.00 0.00 175.22 173.72 2gim s GLU 17 N -0.94 1.73 0.69 0.44 2.12 -0.06 -2.84 118.70 119.84 2gim s GLU 17 Ca 0.29 -1.31 -0.10 0.00 0.36 0.00 0.00 54.97 54.21 2gim s GLU 17 Cb -0.19 -2.78 0.02 0.00 0.26 0.00 0.00 34.13 31.44 2gim s GLU 17 CO 0.19 -0.69 1.06 -1.25 -0.54 0.00 0.00 175.26 174.03 2gim s PRO 18 N 1.20 2.75 0.00 4.30 0.04 -1.26 0.15 135.00 142.18 2gim s PRO 18 Ca -0.02 0.31 0.23 0.00 0.04 0.00 0.00 61.00 61.55 2gim s PRO 18 Cb -0.19 -2.07 0.08 0.00 0.04 0.00 0.00 34.50 32.35 2gim s PRO 18 CO -0.08 -1.03 1.12 0.00 0.04 0.00 0.00 177.00 177.05 2gim n ALA 19 N -2.95 4.14 -2.99 8.56 0.00 -1.13 -4.80 120.51 121.33 2gim n ALA 19 Ca 0.07 -0.52 -0.13 0.00 0.00 0.00 0.00 53.44 52.85 2gim n ALA 19 Cb 0.58 -0.89 -0.14 0.00 0.00 0.00 0.00 19.45 18.99 2gim n ALA 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2gim s LYS 20 N -2.88 0.02 0.02 0.00 -2.85 -1.26 -0.89 119.74 111.90 2gim s LYS 20 Ca 0.12 0.01 -0.12 0.00 -1.00 0.00 0.00 55.97 54.98 2gim s LYS 20 Cb 0.17 -0.06 0.01 0.00 -2.06 0.00 0.00 37.83 35.89 2gim s LYS 20 CO 0.75 -0.02 0.26 -0.48 0.10 0.00 0.00 175.35 175.96 2gim s LEU 21 N 0.15 1.09 -0.11 2.77 2.34 -0.87 -5.00 118.68 119.04 2gim s LEU 21 Ca -0.01 -0.15 0.02 0.00 0.06 0.00 0.00 54.13 54.05 2gim s LEU 21 Cb -0.02 1.13 -0.01 0.00 -0.56 0.00 0.00 46.19 46.73 2gim s LEU 21 CO -0.00 -0.51 -0.18 -0.89 -1.06 0.00 0.00 176.35 173.70 2gim s THR 22 N -2.01 2.60 0.32 5.48 2.01 -1.26 -0.93 115.64 121.84 2gim s THR 22 Ca -0.09 -0.83 0.05 0.00 0.31 0.00 0.00 61.69 61.12 2gim s THR 22 Cb -0.03 -2.04 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 2gim s THR 22 CO -0.00 0.55 0.21 0.27 -0.69 0.00 0.00 174.62 174.96 2gim s ILE 23 N 0.24 0.16 0.22 1.82 -4.36 -0.03 -4.96 121.20 114.29 2gim s ILE 23 Ca -0.12 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.33 2gim s ILE 23 Cb -0.16 -2.47 -0.04 0.00 1.25 0.00 0.00 42.46 41.04 2gim s ILE 23 CO 0.06 0.00 0.17 -0.54 0.24 0.00 0.00 174.94 174.87 2gim s LYS 24 N -3.64 2.89 0.56 0.37 1.02 -1.26 -1.31 119.74 118.37 2gim s LYS 24 Ca 0.37 -1.00 -0.20 0.00 0.02 0.00 0.00 55.97 55.15 2gim s LYS 24 Cb 0.03 -2.58 -0.05 0.00 -0.52 0.00 0.00 37.83 34.71 2gim s LYS 24 CO 0.22 0.43 1.15 -0.35 -0.92 0.00 0.00 175.35 175.88 2gim n PRO 25 N -0.88 1.28 -0.04 -1.68 -0.04 -1.26 -1.46 135.00 130.93 2gim n PRO 25 Ca -0.08 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 2gim n PRO 25 Cb 0.57 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 2gim n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2gim n GLY 26 N 1.04 2.06 3.90 0.55 0.00 -0.70 -4.86 105.19 107.18 2gim n GLY 26 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2gim n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gim s ASP 27 N -3.40 5.23 -0.04 1.61 1.01 -0.53 -4.65 116.67 115.90 2gim s ASP 27 Ca 0.00 0.92 0.06 0.00 0.71 0.00 0.00 52.55 54.25 2gim s ASP 27 Cb 0.00 -1.69 -0.02 0.00 1.01 0.00 0.00 42.92 42.23 2gim s ASP 27 CO 0.00 -1.42 -0.24 -0.89 0.21 0.00 0.00 175.17 172.83 2gim s THR 28 N -3.32 2.23 -0.24 -1.27 2.01 0.16 -1.08 115.64 114.13 2gim s THR 28 Ca 0.58 -1.02 -0.05 0.00 0.31 0.00 0.00 61.69 61.51 2gim s THR 28 Cb -0.11 -1.81 -0.01 0.00 0.01 0.00 0.00 72.50 70.59 2gim s THR 28 CO 0.49 0.58 -0.01 -0.69 -0.69 0.00 0.00 174.62 174.30 2gim s VAL 29 N -0.40 3.56 -0.20 3.82 1.01 -0.65 -0.12 120.40 127.42 2gim s VAL 29 Ca 0.04 -0.50 -0.14 0.00 0.00 0.00 0.00 61.98 61.37 2gim s VAL 29 Cb -0.12 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 2gim s VAL 29 CO 0.01 0.35 0.33 -0.70 0.00 0.00 0.00 175.10 175.09 2gim s GLU 30 N 1.49 4.18 -0.23 2.72 2.12 0.12 -0.37 118.70 128.73 2gim s GLU 30 Ca 0.05 0.09 -0.08 0.00 0.36 0.00 0.00 54.97 55.39 2gim s GLU 30 Cb -0.15 -3.51 -0.04 0.00 0.26 0.00 0.00 34.13 30.70 2gim s GLU 30 CO -0.02 0.05 0.09 -0.06 -0.54 0.00 0.00 175.26 174.78 2gim s PHE 31 N 1.05 3.15 -0.18 5.30 0.40 0.21 -0.65 117.98 127.27 2gim s PHE 31 Ca 0.16 -0.18 0.01 0.00 -0.60 0.00 0.00 56.93 56.33 2gim s PHE 31 Cb -0.14 -2.21 0.02 0.00 0.51 0.00 0.00 43.02 41.20 2gim s PHE 31 CO 0.06 -0.17 -0.19 -1.17 0.70 0.00 0.00 175.22 174.45 2gim s LEU 32 N 1.26 2.20 0.11 -0.37 2.96 -0.45 -1.06 118.68 123.34 2gim s LEU 32 Ca 0.05 -0.67 -0.31 0.00 -0.22 0.00 0.00 54.13 52.98 2gim s LEU 32 Cb -0.14 -1.49 -0.10 0.00 0.50 0.00 0.00 46.19 44.95 2gim s LEU 32 CO 0.04 -0.01 1.79 0.21 -1.32 0.00 0.00 176.35 177.06 2gim s ASN 33 N 1.29 6.47 0.00 3.68 2.47 0.49 -0.31 114.94 129.02 2gim s ASN 33 Ca 0.05 2.70 0.00 0.00 0.42 0.00 0.00 52.86 56.02 2gim s ASN 33 Cb -0.13 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.10 2gim s ASN 33 CO -0.12 -0.98 0.00 -3.20 -3.72 0.00 0.00 177.10 169.08 2gim n ASN 34 N 5.63 0.00 -4.34 -4.21 5.15 -0.41 -3.42 115.26 113.65 2gim n ASN 34 Ca 0.17 0.00 -0.18 0.00 -0.60 0.00 0.00 54.58 53.97 2gim n ASN 34 Cb 0.39 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.54 2gim n ASN 34 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2gim s LYS 35 N -0.20 1.33 -0.76 1.20 -0.14 -0.87 -4.86 119.74 115.43 2gim s LYS 35 Ca 0.00 -1.62 -0.02 0.00 -1.36 0.00 0.00 55.97 52.96 2gim s LYS 35 Cb 0.00 -0.94 0.00 0.00 -1.68 0.00 0.00 37.83 35.21 2gim s LYS 35 CO 0.00 0.08 0.64 1.55 -0.76 0.00 0.00 175.35 176.86 2gim n VAL 36 N -0.40 -6.43 -0.96 3.17 3.14 -1.26 -4.08 118.33 111.52 2gim n VAL 36 Ca -0.07 -0.07 -0.29 0.00 -2.96 0.00 0.00 64.34 60.95 2gim n VAL 36 Cb 0.62 -4.75 0.18 0.00 -1.06 0.00 0.00 33.84 28.83 2gim n VAL 36 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2gim s PRO 37 N -3.97 0.40 0.11 1.45 0.04 -1.26 -4.76 135.00 127.01 2gim s PRO 37 Ca 0.03 0.83 0.04 0.00 0.04 0.00 0.00 61.00 61.93 2gim s PRO 37 Cb -0.00 -1.71 -0.04 0.00 0.04 0.00 0.00 34.50 32.79 2gim s PRO 37 CO 0.83 -2.83 0.08 -1.25 0.04 0.00 0.00 177.00 173.88 2gim s PRO 38 N -4.78 2.83 0.12 0.56 0.04 -1.26 -5.15 135.00 127.36 2gim s PRO 38 Ca 0.66 -0.78 0.08 0.00 0.04 0.00 0.00 61.00 61.00 2gim s PRO 38 Cb -0.21 -2.67 -0.04 0.00 0.04 0.00 0.00 34.50 31.63 2gim s PRO 38 CO 0.59 0.53 -0.19 -1.01 0.04 0.00 0.00 177.00 176.97 2gim s HIS 39 N -1.50 1.72 0.06 0.56 3.76 -1.26 -4.72 115.29 113.90 2gim s HIS 39 Ca 0.29 -0.45 0.01 0.00 -0.15 0.00 0.00 55.06 54.76 2gim s HIS 39 Cb -0.11 -0.91 -0.00 0.00 1.11 0.00 0.00 32.58 32.66 2gim s HIS 39 CO 0.22 0.23 0.03 0.27 -0.85 0.00 0.00 174.74 174.64 2gim n ASN 40 N 0.77 0.61 -3.52 1.40 0.23 -1.26 -1.32 115.26 112.17 2gim n ASN 40 Ca -0.17 -1.32 -0.25 0.00 -0.53 0.00 0.00 54.58 52.31 2gim n ASN 40 Cb 0.55 0.18 -0.14 0.00 -2.08 0.00 0.00 39.78 38.29 2gim n ASN 40 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2gim s VAL 41 N -1.91 -0.17 -0.22 3.53 1.01 -1.08 -4.09 120.40 117.47 2gim s VAL 41 Ca 0.04 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 2gim s VAL 41 Cb 0.00 -0.88 0.01 0.00 0.00 0.00 0.00 36.38 35.51 2gim s VAL 41 CO 0.03 -0.55 -0.10 -0.69 0.00 0.00 0.00 175.10 173.80 2gim s VAL 42 N 2.18 2.81 0.27 2.92 1.01 0.29 -0.38 120.40 129.50 2gim s VAL 42 Ca 0.08 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 60.95 2gim s VAL 42 Cb -0.16 -2.31 -0.09 0.00 0.00 0.00 0.00 36.38 33.82 2gim s VAL 42 CO -0.29 0.38 1.04 -0.36 0.00 0.00 0.00 175.10 175.87 2gim s PHE 43 N 1.37 3.71 0.22 5.22 0.40 -1.26 -0.29 117.98 127.34 2gim s PHE 43 Ca 0.04 1.77 -0.30 0.00 -0.60 0.00 0.00 56.93 57.84 2gim s PHE 43 Cb -0.15 -3.17 -0.09 0.00 0.51 0.00 0.00 43.02 40.13 2gim s PHE 43 CO -0.07 -0.19 1.21 0.34 0.70 0.00 0.00 175.22 177.21 2gim s ASP 44 N -1.03 7.05 0.51 1.36 -1.08 0.59 -4.76 116.67 119.31 2gim s ASP 44 Ca 0.44 2.32 0.30 0.00 -0.52 0.00 0.00 52.55 55.09 2gim s ASP 44 Cb -0.29 -2.62 1.08 0.00 -1.46 0.00 0.00 42.92 39.63 2gim s ASP 44 CO 0.37 -0.38 1.88 0.00 0.52 0.00 0.00 175.17 177.56 2gim h ALA 45 N 4.80 1.00 0.00 3.66 0.00 -1.90 -3.22 119.26 123.60 2gim h ALA 45 Ca -0.45 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.21 2gim h ALA 45 Cb 1.21 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 2gim h ALA 45 CO 0.73 0.05 -1.79 0.00 0.00 0.00 0.00 179.25 178.24 2gim n ALA 46 N -2.11 1.71 -1.69 0.00 0.00 -1.26 -3.26 120.51 113.90 2gim n ALA 46 Ca 0.01 -0.71 -0.33 0.00 0.00 0.00 0.00 53.44 52.41 2gim n ALA 46 Cb 0.38 0.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.84 2gim n ALA 46 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2gim n LEU 47 N -2.56 7.28 -4.18 0.00 4.77 -1.22 -4.23 117.00 116.86 2gim n LEU 47 Ca -0.20 -4.42 -0.11 0.00 -0.03 0.00 0.00 56.01 51.25 2gim n LEU 47 Cb 0.84 -1.32 -0.10 0.00 -2.33 0.00 0.00 43.42 40.51 2gim n LEU 47 CO 0.21 1.91 -0.33 0.54 -1.33 0.00 0.00 177.39 178.39 2gim s ASN 48 N 0.58 0.84 0.51 -1.43 2.20 -1.26 -2.21 114.94 114.17 2gim s ASN 48 Ca 0.58 -1.14 0.21 0.00 -0.94 0.00 0.00 52.86 51.57 2gim s ASN 48 Cb 0.27 0.18 1.35 0.00 -2.00 0.00 0.00 41.25 41.05 2gim s ASN 48 CO -0.14 -0.60 2.10 -0.65 -2.94 0.00 0.00 177.10 174.87 2gim h PRO 49 N 2.85 0.00 -0.00 3.55 0.11 -1.86 0.24 132.00 136.89 2gim h PRO 49 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2gim h PRO 49 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2gim h PRO 49 CO 0.62 0.09 -0.29 0.00 -0.21 0.00 0.00 178.00 178.21 2gim n ALA 50 N -2.42 3.10 -3.55 -0.75 0.00 -1.26 -4.93 120.51 110.70 2gim n ALA 50 Ca -0.03 -0.30 -0.26 0.00 0.00 0.00 0.00 53.44 52.85 2gim n ALA 50 Cb 0.17 -1.23 0.01 0.00 0.00 0.00 0.00 19.45 18.41 2gim n ALA 50 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2gim n LYS 51 N -1.24 -4.39 -3.62 0.00 5.02 0.86 -4.93 118.16 109.85 2gim n LYS 51 Ca 0.09 0.58 -0.39 0.00 -2.02 0.00 0.00 58.31 56.58 2gim n LYS 51 Cb 0.33 -5.39 -0.11 0.00 -0.02 0.00 0.00 35.03 29.84 2gim n LYS 51 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2gim s SER 52 N -2.95 5.76 0.45 4.39 0.15 -1.21 -4.74 113.70 115.55 2gim s SER 52 Ca 0.50 -0.29 0.15 0.00 0.70 0.00 0.00 55.95 57.01 2gim s SER 52 Cb -0.25 -2.06 1.01 0.00 -1.71 0.00 0.00 66.02 63.00 2gim s SER 52 CO 0.61 -0.14 1.99 0.00 1.20 0.00 0.00 173.24 176.90 2gim h ALA 53 N 8.37 1.66 -0.16 5.45 0.00 -1.91 -2.13 119.26 130.55 2gim h ALA 53 Ca -0.34 -0.17 -0.22 0.00 0.00 0.00 0.00 54.91 54.18 2gim h ALA 53 Cb 1.17 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.94 2gim h ALA 53 CO 0.59 0.24 -0.76 -0.44 0.00 0.00 0.00 179.25 178.88 2gim h ASP 54 N 0.00 0.93 0.19 0.00 3.45 -1.93 0.11 116.42 119.17 2gim h ASP 54 Ca -0.00 -0.60 -0.01 0.00 0.43 0.00 0.00 57.03 56.85 2gim h ASP 54 Cb 0.34 -0.27 0.00 0.00 -0.56 0.00 0.00 39.33 38.84 2gim h ASP 54 CO 0.02 1.40 -0.09 0.25 -1.57 0.00 0.00 179.24 179.25 2gim h LEU 55 N 0.54 -0.21 -0.38 1.55 5.85 -1.91 -0.21 115.31 120.53 2gim h LEU 55 Ca -0.05 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.72 2gim h LEU 55 Cb 1.39 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.43 2gim h LEU 55 CO 0.16 -0.15 0.13 0.00 -0.34 0.00 0.00 178.44 178.24 2gim h ALA 56 N 0.56 0.45 -0.56 1.25 0.00 -1.27 -1.75 119.26 117.94 2gim h ALA 56 Ca -0.03 0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2gim h ALA 56 Cb 0.20 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 2gim h ALA 56 CO 0.04 -0.26 0.25 0.87 0.00 0.00 0.00 179.25 180.15 2gim h LYS 57 N 0.28 0.46 0.00 0.00 1.57 -0.64 -2.32 116.57 115.93 2gim h LYS 57 Ca 0.18 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2gim h LYS 57 Cb 0.16 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 2gim h LYS 57 CO -0.19 0.31 -0.02 0.66 -0.57 0.00 0.00 179.45 179.64 2gim h SER 58 N 0.48 0.00 0.19 0.86 4.64 -0.14 -2.40 113.55 117.17 2gim h SER 58 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2gim h SER 58 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2gim h SER 58 CO -0.22 0.02 -0.78 0.18 -0.87 0.00 0.00 176.83 175.16 2gim n LEU 59 N -3.76 0.86 -4.95 5.97 4.77 -0.90 -4.99 117.00 114.00 2gim n LEU 59 Ca -0.03 -0.32 -0.23 0.00 -0.03 0.00 0.00 56.01 55.40 2gim n LEU 59 Cb 0.11 -0.09 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 2gim n LEU 59 CO 0.27 0.21 0.34 -0.44 -1.33 0.00 0.00 177.39 176.44 2gim s SER 60 N -2.97 5.71 -0.44 -1.43 0.01 -0.91 -4.79 113.70 108.90 2gim s SER 60 Ca 0.10 0.33 0.03 0.00 1.31 0.00 0.00 55.95 57.72 2gim s SER 60 Cb 0.17 -1.48 0.16 0.00 0.21 0.00 0.00 66.02 65.08 2gim s SER 60 CO 0.79 -0.83 0.33 -1.00 0.41 0.00 0.00 173.24 172.94 2gim s HIS 61 N -2.66 1.36 0.39 2.43 3.76 0.48 -5.00 115.29 116.05 2gim s HIS 61 Ca 0.50 -2.34 0.19 0.00 -0.15 0.00 0.00 55.06 53.26 2gim s HIS 61 Cb -0.10 -1.17 1.05 0.00 1.11 0.00 0.00 32.58 33.47 2gim s HIS 61 CO 0.39 -0.79 1.95 0.87 -0.85 0.00 0.00 174.74 176.31 2gim h LYS 62 N 5.87 0.00 -6.53 1.40 6.56 -1.96 -2.86 116.57 119.05 2gim h LYS 62 Ca 0.21 0.00 -0.53 0.00 -1.06 0.00 0.00 60.65 59.27 2gim h LYS 62 Cb 0.90 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.58 2gim h LYS 62 CO 0.40 0.23 0.67 -1.14 -2.06 0.00 0.00 179.45 177.55 2gim s GLN 63 N -4.27 4.36 0.30 3.15 0.74 -1.26 -4.83 119.66 117.85 2gim s GLN 63 Ca -0.03 1.98 -0.30 0.00 0.05 0.00 0.00 55.36 57.07 2gim s GLN 63 Cb 0.14 -3.27 -0.12 0.00 1.10 0.00 0.00 33.01 30.86 2gim s GLN 63 CO 0.66 -0.37 1.51 1.28 -0.55 0.00 0.00 175.29 177.82 2gim n LEU 64 N 3.87 4.07 -4.59 3.68 4.77 -1.26 -4.70 117.00 122.85 2gim n LEU 64 Ca 0.10 1.17 -0.42 0.00 -0.03 0.00 0.00 56.01 56.83 2gim n LEU 64 Cb 0.43 -1.55 -0.02 0.00 -2.33 0.00 0.00 43.42 39.95 2gim n LEU 64 CO 0.58 -0.05 1.22 -0.76 -1.33 0.00 0.00 177.39 177.04 2gim s LEU 65 N -0.66 3.48 0.00 2.23 1.02 -0.44 -4.90 118.68 119.42 2gim s LEU 65 Ca 0.62 0.46 0.19 0.00 0.02 0.00 0.00 54.13 55.41 2gim s LEU 65 Cb -0.53 -3.25 0.45 0.00 0.02 0.00 0.00 46.19 42.87 2gim s LEU 65 CO 0.53 -1.58 1.37 0.23 0.02 0.00 0.00 176.35 176.92 2gim n MET 66 N 8.40 2.54 -4.65 1.70 2.81 -1.26 -4.50 117.12 122.17 2gim n MET 66 Ca 0.13 -2.28 -0.29 0.00 -1.81 0.00 0.00 57.70 53.46 2gim n MET 66 Cb 0.49 -1.44 -0.14 0.00 -0.71 0.00 0.00 33.22 31.42 2gim n MET 66 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2gim s SER 67 N -1.13 3.07 0.21 7.83 0.01 -1.26 -5.08 113.70 117.35 2gim s SER 67 Ca 0.36 -0.64 -0.32 0.00 1.31 0.00 0.00 55.95 56.66 2gim s SER 67 Cb 0.20 -0.24 -0.12 0.00 0.21 0.00 0.00 66.02 66.06 2gim s SER 67 CO 0.26 0.20 1.67 -2.65 0.41 0.00 0.00 173.24 173.14 2gim n PRO 68 N 1.44 2.63 -1.22 12.44 -0.02 -1.26 -1.73 135.00 147.28 2gim n PRO 68 Ca -0.18 0.95 -0.08 0.00 -2.02 0.00 0.00 63.50 62.17 2gim n PRO 68 Cb 0.53 -2.76 -0.03 0.00 -0.02 0.00 0.00 33.50 31.21 2gim n PRO 68 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gim n GLY 69 N 3.55 0.80 3.71 -1.23 0.00 -1.22 -4.96 105.19 105.84 2gim n GLY 69 Ca 0.15 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2gim n GLY 69 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2gim n GLN 70 N -0.82 2.06 -4.81 1.61 7.27 -0.70 -4.59 117.38 117.40 2gim n GLN 70 Ca -0.08 0.73 -0.31 0.00 0.07 0.00 0.00 57.00 57.42 2gim n GLN 70 Cb 0.50 -2.42 -0.14 0.00 2.41 0.00 0.00 30.24 30.60 2gim n GLN 70 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2gim s SER 71 N -0.45 3.54 0.13 1.69 0.15 -1.26 -0.38 113.70 117.12 2gim s SER 71 Ca 0.59 -0.47 0.01 0.00 0.70 0.00 0.00 55.95 56.78 2gim s SER 71 Cb -0.51 -0.50 -0.04 0.00 -1.71 0.00 0.00 66.02 63.26 2gim s SER 71 CO 0.59 0.27 -0.03 0.28 1.20 0.00 0.00 173.24 175.56 2gim s THR 72 N -0.85 0.60 0.02 6.45 -1.32 -0.22 -5.00 115.64 115.33 2gim s THR 72 Ca 0.13 -1.94 -0.07 0.00 -1.21 0.00 0.00 61.69 58.60 2gim s THR 72 Cb -0.10 -1.88 -0.00 0.00 -1.51 0.00 0.00 72.50 69.01 2gim s THR 72 CO 0.03 -0.69 0.13 -0.94 -2.21 0.00 0.00 174.62 170.94 2gim s SER 73 N -3.09 0.08 -0.25 8.08 1.04 -1.26 0.67 113.70 118.97 2gim s SER 73 Ca 0.17 -0.33 0.02 0.00 0.48 0.00 0.00 55.95 56.29 2gim s SER 73 Cb 0.06 0.22 0.06 0.00 0.10 0.00 0.00 66.02 66.45 2gim s SER 73 CO -0.01 -0.43 -0.10 -0.89 0.98 0.00 0.00 173.24 172.79 2gim s THR 74 N -1.88 2.00 -0.35 2.02 2.01 0.51 -4.98 115.64 114.96 2gim s THR 74 Ca -0.11 -1.48 -0.21 0.00 0.31 0.00 0.00 61.69 60.21 2gim s THR 74 Cb -0.05 -2.12 0.00 0.00 0.01 0.00 0.00 72.50 70.34 2gim s THR 74 CO -0.01 -0.00 0.65 -0.89 -0.69 0.00 0.00 174.62 173.68 2gim s THR 75 N 1.19 4.88 0.26 -0.82 2.01 -1.26 -1.64 115.64 120.25 2gim s THR 75 Ca -0.07 0.68 -0.30 0.00 0.31 0.00 0.00 61.69 62.31 2gim s THR 75 Cb -0.19 -4.08 -0.10 0.00 0.01 0.00 0.00 72.50 68.14 2gim s THR 75 CO -0.06 -0.30 1.36 -0.36 -0.69 0.00 0.00 174.62 174.57 2gim s PHE 76 N 2.74 3.11 0.62 4.92 0.40 -0.24 -4.96 117.98 124.56 2gim s PHE 76 Ca 0.25 1.20 -0.18 0.00 -0.60 0.00 0.00 56.93 57.60 2gim s PHE 76 Cb -0.14 -3.71 -0.03 0.00 0.51 0.00 0.00 43.02 39.65 2gim s PHE 76 CO 0.14 -2.17 1.13 -2.30 0.70 0.00 0.00 175.22 172.72 2gim n PRO 77 N 1.98 1.04 -0.35 0.24 -0.02 -1.26 -1.72 135.00 134.92 2gim n PRO 77 Ca 0.05 0.40 0.12 0.00 -2.02 0.00 0.00 63.50 62.05 2gim n PRO 77 Cb 0.41 -2.35 0.32 0.00 -0.02 0.00 0.00 33.50 31.86 2gim n PRO 77 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gim h ALA 78 N 0.57 1.67 -0.31 3.55 0.00 -1.93 -0.76 119.26 122.05 2gim h ALA 78 Ca -0.50 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2gim h ALA 78 Cb 1.35 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2gim h ALA 78 CO 0.52 -0.02 0.00 -0.40 0.00 0.00 0.00 179.25 179.35 2gim n ASP 79 N -4.73 3.18 -4.68 0.00 5.75 -1.26 -4.69 116.55 110.11 2gim n ASP 79 Ca 0.22 -2.39 -0.45 0.00 -0.01 0.00 0.00 54.79 52.17 2gim n ASP 79 Cb 0.54 -0.53 -0.04 0.00 -1.03 0.00 0.00 41.12 40.06 2gim n ASP 79 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gim n ALA 80 N 0.38 1.59 -1.77 2.12 0.00 -0.30 -4.91 120.51 117.62 2gim n ALA 80 Ca 0.14 0.34 -0.35 0.00 0.00 0.00 0.00 53.44 53.57 2gim n ALA 80 Cb 0.66 -2.50 0.01 0.00 0.00 0.00 0.00 19.45 17.62 2gim n ALA 80 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2gim s PRO 81 N 2.55 3.31 0.35 0.00 0.04 -1.26 -4.79 135.00 135.20 2gim s PRO 81 Ca 0.84 1.63 -0.28 0.00 0.04 0.00 0.00 61.00 63.23 2gim s PRO 81 Cb -0.60 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 31.84 2gim s PRO 81 CO 0.41 -0.89 1.39 0.00 0.04 0.00 0.00 177.00 177.95 2gim s ALA 82 N -1.76 3.54 0.00 8.56 0.00 -1.26 -4.75 121.76 126.09 2gim s ALA 82 Ca 0.73 1.41 0.00 0.00 0.00 0.00 0.00 51.96 54.10 2gim s ALA 82 Cb -0.25 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.33 2gim s ALA 82 CO 0.28 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.61 2gim n GLY 83 N 0.67 0.83 3.85 0.00 0.00 0.33 -4.79 105.19 106.09 2gim n GLY 83 Ca 0.01 -1.88 -0.38 0.00 0.00 0.00 0.00 46.02 43.77 2gim n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gim s GLU 84 N -1.64 3.81 -0.28 1.61 2.02 -1.26 -0.47 118.70 122.49 2gim s GLU 84 Ca 0.00 0.29 0.01 0.00 0.02 0.00 0.00 54.97 55.29 2gim s GLU 84 Cb 0.00 -3.21 0.08 0.00 0.10 0.00 0.00 34.13 31.10 2gim s GLU 84 CO 0.00 0.71 0.02 0.71 0.02 0.00 0.00 175.26 176.72 2gim s TYR 85 N -1.07 2.45 0.09 1.61 1.51 0.11 -3.38 117.35 118.67 2gim s TYR 85 Ca 0.22 -2.00 -0.25 0.00 -1.01 0.00 0.00 57.07 54.03 2gim s TYR 85 Cb -0.16 -1.91 -0.07 0.00 -0.11 0.00 0.00 41.96 39.72 2gim s TYR 85 CO 0.11 -0.84 0.75 0.99 -1.11 0.00 0.00 175.55 175.46 2gim s THR 86 N 1.37 4.59 0.07 -0.71 2.01 -0.94 -0.91 115.64 121.12 2gim s THR 86 Ca 0.03 1.63 -0.01 0.00 0.31 0.00 0.00 61.69 63.64 2gim s THR 86 Cb -0.18 -4.11 -0.04 0.00 0.01 0.00 0.00 72.50 68.18 2gim s THR 86 CO -0.12 0.44 -0.00 0.72 -0.69 0.00 0.00 174.62 174.97 2gim s PHE 87 N -0.56 0.58 0.20 4.92 -0.12 -0.41 -0.30 117.98 122.29 2gim s PHE 87 Ca 0.37 -1.09 -0.14 0.00 -0.05 0.00 0.00 56.93 56.02 2gim s PHE 87 Cb -0.21 -0.39 0.01 0.00 -0.63 0.00 0.00 43.02 41.79 2gim s PHE 87 CO 0.24 -0.42 0.45 1.52 -0.05 0.00 0.00 175.22 176.96 2gim s TYR 88 N -3.95 0.15 -0.14 3.49 1.13 0.60 0.28 117.35 118.91 2gim s TYR 88 Ca 0.11 -0.51 -0.15 0.00 -1.41 0.00 0.00 57.07 55.10 2gim s TYR 88 Cb 0.08 0.22 -0.05 0.00 -1.10 0.00 0.00 41.96 41.12 2gim s TYR 88 CO -0.07 -0.89 0.35 0.00 -2.51 0.00 0.00 175.55 172.42 2gim h GLU 90 N 6.63 -0.42 -0.97 0.00 5.08 -1.89 0.15 114.58 123.15 2gim h GLU 90 Ca -0.41 0.03 0.18 0.00 -1.00 0.00 0.00 59.36 58.15 2gim h GLU 90 Cb 1.17 0.10 -0.10 0.00 0.50 0.00 0.00 28.75 30.41 2gim h GLU 90 CO 0.75 -0.11 0.57 -1.35 -1.00 0.00 0.00 179.01 177.88 2gim h PRO 91 N -0.79 0.72 -0.40 2.33 0.10 -1.95 -3.01 132.00 129.00 2gim h PRO 91 Ca -0.05 -0.04 0.00 0.00 0.10 0.00 0.00 66.00 66.01 2gim h PRO 91 Cb 0.52 -0.16 0.00 0.00 0.10 0.00 0.00 31.00 31.45 2gim h PRO 91 CO 0.07 0.47 0.00 0.72 0.10 0.00 0.00 178.00 179.37 2gim n HIS 92 N -4.79 0.52 -0.24 0.65 8.25 -1.17 -4.53 115.22 113.91 2gim n HIS 92 Ca 0.22 -0.32 0.05 0.00 -0.26 0.00 0.00 57.72 57.41 2gim n HIS 92 Cb 0.53 -0.01 0.17 0.00 1.12 0.00 0.00 29.99 31.81 2gim n HIS 92 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2gim h ARG 93 N 3.70 0.31 0.00 -0.41 2.43 -0.55 -0.23 114.38 119.63 2gim h ARG 93 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2gim h ARG 93 Cb 0.88 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 2gim h ARG 93 CO 0.00 0.20 0.00 0.78 -1.51 0.00 0.00 179.97 179.44 2gim h GLY 94 N 0.32 0.00 0.63 2.80 0.00 -1.82 -1.98 103.07 103.02 2gim h GLY 94 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 2gim h GLY 94 CO -0.47 0.00 -0.10 0.00 0.00 0.00 0.00 176.54 175.97 2gim n ALA 95 N -1.85 2.77 0.00 3.60 0.00 -0.18 -4.93 120.51 119.91 2gim n ALA 95 Ca 0.04 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2gim n ALA 95 Cb 0.40 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.55 2gim n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gim n GLY 96 N 1.25 0.85 3.57 0.00 0.00 -0.74 -4.94 105.19 105.17 2gim n GLY 96 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2gim n GLY 96 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2gim s MET 97 N -0.36 3.79 0.01 1.61 -2.45 -0.68 -4.86 119.30 116.36 2gim s MET 97 Ca 0.00 -1.57 0.01 0.00 -1.25 0.00 0.00 55.69 52.88 2gim s MET 97 Cb 0.00 -5.44 -0.01 0.00 1.25 0.00 0.00 34.83 30.63 2gim s MET 97 CO 0.00 -2.23 -0.04 0.08 1.05 0.00 0.00 175.02 173.89 2gim s VAL 98 N 4.57 0.26 0.27 10.11 1.01 -1.26 -1.80 120.40 133.55 2gim s VAL 98 Ca 0.50 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 62.13 2gim s VAL 98 Cb 0.02 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 2gim s VAL 98 CO -0.01 -0.08 0.15 -0.83 0.00 0.00 0.00 175.10 174.33 2gim s GLY 99 N -0.48 1.85 -0.14 4.51 0.00 0.14 -4.72 107.32 108.49 2gim s GLY 99 Ca -0.03 -1.79 -0.06 0.00 0.00 0.00 0.00 44.72 42.84 2gim s GLY 99 CO -0.00 -1.53 0.31 1.25 0.00 0.00 0.00 173.10 173.13 2gim s LYS 100 N -3.92 0.24 -0.16 2.90 2.20 -0.07 -1.29 119.74 119.64 2gim s LYS 100 Ca 0.37 0.74 -0.06 0.00 -0.36 0.00 0.00 55.97 56.66 2gim s LYS 100 Cb 0.06 0.00 -0.04 0.00 -1.51 0.00 0.00 37.83 36.34 2gim s LYS 100 CO 0.16 -0.22 0.07 0.42 -0.36 0.00 0.00 175.35 175.42 2gim s ILE 101 N 1.93 4.85 -0.17 5.43 1.01 -0.09 -2.06 121.20 132.09 2gim s ILE 101 Ca -0.04 -0.02 -0.03 0.00 0.00 0.00 0.00 60.65 60.55 2gim s ILE 101 Cb -0.11 -3.15 -0.02 0.00 0.01 0.00 0.00 42.46 39.19 2gim s ILE 101 CO -0.10 0.51 -0.05 -0.89 0.00 0.00 0.00 174.94 174.41 2gim s THR 102 N -0.09 3.60 -0.16 2.92 2.01 -0.11 0.08 115.64 123.89 2gim s THR 102 Ca 0.07 -0.45 -0.14 0.00 0.31 0.00 0.00 61.69 61.48 2gim s THR 102 Cb -0.12 -2.59 -0.05 0.00 0.01 0.00 0.00 72.50 69.76 2gim s THR 102 CO 0.01 0.47 0.30 -0.69 -0.69 0.00 0.00 174.62 174.02 2gim s VAL 103 N 0.73 5.30 0.26 3.82 1.01 0.38 -0.85 120.40 131.05 2gim s VAL 103 Ca -0.02 0.55 -0.04 0.00 0.00 0.00 0.00 61.98 62.47 2gim s VAL 103 Cb -0.15 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 2gim s VAL 103 CO 0.02 0.39 0.33 0.00 0.00 0.00 0.00 175.10 175.84 2gim s ALA 104 N 0.46 0.70 -2.00 5.51 0.00 -0.43 -0.51 121.76 125.49 2gim s ALA 104 Ca 0.17 -1.43 0.16 0.00 0.00 0.00 0.00 51.96 50.86 2gim s ALA 104 Cb -0.13 1.25 0.98 0.00 0.00 0.00 0.00 23.12 25.22 2gim s ALA 104 CO 0.04 -0.72 1.39 0.41 0.00 0.00 0.00 175.76 176.87