#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2goo n PHE 35 N 0.00 0.00 -4.62 0.54 1.16 -0.51 -4.79 117.46 109.24 2goo n PHE 35 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.25 2goo n PHE 35 Cb 0.00 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 37.74 2goo n PHE 35 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 2goo s LEU 36 N -1.14 3.01 -0.10 5.98 2.96 -0.01 -4.96 118.68 124.41 2goo s LEU 36 Ca 0.00 -0.17 -0.03 0.00 -0.22 0.00 0.00 54.13 53.71 2goo s LEU 36 Cb 0.00 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 2goo s LEU 36 CO 0.00 0.23 0.01 -0.75 -1.32 0.00 0.00 176.35 174.52 2goo s LYS 37 N -0.01 3.15 0.07 1.98 2.20 -1.26 -0.60 119.74 125.26 2goo s LYS 37 Ca -0.01 -0.40 0.02 0.00 -0.36 0.00 0.00 55.97 55.21 2goo s LYS 37 Cb -0.14 -2.86 -0.03 0.00 -1.51 0.00 0.00 37.83 33.29 2goo s LYS 37 CO 0.03 0.63 -0.06 0.00 -0.36 0.00 0.00 175.35 175.59 2goo s TYR 39 N -2.64 3.84 -0.02 0.00 5.04 -1.26 -1.43 117.35 120.89 2goo s TYR 39 Ca 0.01 1.84 0.03 0.00 -2.44 0.00 0.00 57.07 56.52 2goo s TYR 39 Cb -0.01 -3.07 -0.00 0.00 0.35 0.00 0.00 41.96 39.22 2goo s TYR 39 CO -0.03 0.13 -0.11 0.00 -1.34 0.00 0.00 175.55 174.20 2goo s SER 41 N -0.01 0.51 0.00 0.00 0.15 -0.64 -4.69 113.70 109.02 2goo s SER 41 Ca -0.00 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.09 2goo s SER 41 Cb -0.07 0.67 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 2goo s SER 41 CO 0.00 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.80 2goo n GLY 42 N 5.35 3.06 0.64 9.45 0.00 -1.26 -0.86 105.19 121.56 2goo n GLY 42 Ca -0.06 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.02 2goo n GLY 42 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2goo n HIS 43 N -1.51 0.00 -2.21 1.61 8.25 -1.23 -4.98 115.22 115.15 2goo n HIS 43 Ca 0.00 -1.20 -0.40 0.00 -0.26 0.00 0.00 57.72 55.86 2goo n HIS 43 Cb 0.00 -0.21 -0.02 0.00 1.12 0.00 0.00 29.99 30.88 2goo n HIS 43 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2goo s PRO 45 N -2.01 3.01 0.57 0.00 0.02 -1.26 -4.88 135.00 130.45 2goo s PRO 45 Ca 0.53 1.96 0.38 0.00 0.02 0.00 0.00 61.00 63.89 2goo s PRO 45 Cb -0.35 -2.04 2.06 0.00 0.02 0.00 0.00 34.50 34.19 2goo s PRO 45 CO 0.46 -1.21 2.17 -0.44 -0.33 0.00 0.00 177.00 177.64 2goo h ASP 46 N 1.07 0.00 -1.80 2.53 3.45 -2.03 -0.99 116.42 118.66 2goo h ASP 46 Ca -0.51 0.00 -0.70 0.00 0.43 0.00 0.00 57.03 56.25 2goo h ASP 46 Cb 1.30 0.00 -0.33 0.00 -0.56 0.00 0.00 39.33 39.74 2goo h ASP 46 CO 0.56 0.00 0.37 -0.90 -1.57 0.00 0.00 179.24 177.70 2goo n ASP 47 N -2.84 6.45 -4.72 6.45 5.75 -1.26 -5.03 116.55 121.35 2goo n ASP 47 Ca -0.02 -3.79 -0.41 0.00 -0.01 0.00 0.00 54.79 50.55 2goo n ASP 47 Cb 0.06 -0.83 -0.04 0.00 -1.03 0.00 0.00 41.12 39.28 2goo n ASP 47 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2goo s ALA 48 N -3.87 3.27 -0.45 2.12 0.00 -0.38 -5.03 121.76 117.42 2goo s ALA 48 Ca 0.51 0.40 -0.18 0.00 0.00 0.00 0.00 51.96 52.68 2goo s ALA 48 Cb 0.43 -3.16 0.04 0.00 0.00 0.00 0.00 23.12 20.42 2goo s ALA 48 CO -0.33 -0.09 0.53 0.42 0.00 0.00 0.00 175.76 176.29 2goo s ILE 49 N 0.49 4.98 -1.22 0.00 1.01 -1.24 -4.60 121.20 120.62 2goo s ILE 49 Ca 0.45 -0.34 -0.01 0.00 0.00 0.00 0.00 60.65 60.75 2goo s ILE 49 Cb -0.21 -4.15 -0.01 0.00 0.01 0.00 0.00 42.46 38.11 2goo s ILE 49 CO 0.25 -0.57 0.88 -3.20 0.00 0.00 0.00 174.94 172.30 2goo n ASN 50 N 5.87 -2.16 -3.99 3.58 5.15 -1.26 -2.73 115.26 119.71 2goo n ASN 50 Ca -0.06 -0.71 -0.32 0.00 -0.60 0.00 0.00 54.58 52.89 2goo n ASN 50 Cb 0.47 -4.70 0.01 0.00 -0.53 0.00 0.00 39.78 35.02 2goo n ASN 50 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2goo n ASN 51 N -3.10 -4.36 -4.11 1.20 4.13 -1.26 -4.97 115.26 102.79 2goo n ASN 51 Ca -0.27 -0.84 -0.24 0.00 1.68 0.00 0.00 54.58 54.91 2goo n ASN 51 Cb 0.67 -3.50 -0.16 0.00 -1.54 0.00 0.00 39.78 35.25 2goo n ASN 51 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2goo s THR 52 N -3.28 1.21 0.14 3.41 2.01 -1.10 -1.22 115.64 116.81 2goo s THR 52 Ca 0.69 -0.62 0.04 0.00 0.31 0.00 0.00 61.69 62.11 2goo s THR 52 Cb -0.36 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.08 2goo s THR 52 CO 0.85 0.35 -0.08 0.00 -0.69 0.00 0.00 174.62 175.05 2goo s ILE 54 N -3.41 1.84 0.21 0.00 1.01 -1.26 -0.33 121.20 119.25 2goo s ILE 54 Ca 0.17 -1.28 -0.17 0.00 0.00 0.00 0.00 60.65 59.36 2goo s ILE 54 Cb 0.03 -1.59 0.02 0.00 0.01 0.00 0.00 42.46 40.94 2goo s ILE 54 CO 0.00 0.25 0.54 0.28 0.00 0.00 0.00 174.94 176.02 2goo s THR 55 N -0.81 0.02 -2.97 2.92 -1.32 0.23 -4.98 115.64 108.72 2goo s THR 55 Ca 0.09 -0.88 0.24 0.00 -1.21 0.00 0.00 61.69 59.93 2goo s THR 55 Cb -0.09 -1.70 0.21 0.00 -1.51 0.00 0.00 72.50 69.40 2goo s THR 55 CO 0.02 -0.09 1.28 -0.46 -2.21 0.00 0.00 174.62 173.16 2goo n ASN 56 N -0.36 2.96 0.00 8.08 6.94 -1.26 -0.83 115.26 130.78 2goo n ASN 56 Ca -0.08 -1.98 0.00 0.00 -0.02 0.00 0.00 54.58 52.49 2goo n ASN 56 Cb 0.62 -0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.04 2goo n ASN 56 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2goo n GLY 57 N 1.35 0.54 3.02 4.83 0.00 -1.22 -4.46 105.19 109.24 2goo n GLY 57 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 2goo n GLY 57 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2goo s HIS 58 N 1.05 0.38 0.28 1.61 3.76 -0.08 -4.83 115.29 117.45 2goo s HIS 58 Ca 0.00 -0.68 -0.13 0.00 -0.15 0.00 0.00 55.06 54.11 2goo s HIS 58 Cb 0.00 -0.27 -0.08 0.00 1.11 0.00 0.00 32.58 33.34 2goo s HIS 58 CO 0.00 -0.23 0.66 0.00 -0.85 0.00 0.00 174.74 174.32 2goo s PHE 60 N -1.92 0.46 0.05 0.00 -0.71 0.36 -1.30 117.98 114.91 2goo s PHE 60 Ca 0.51 -0.97 0.05 0.00 -1.04 0.00 0.00 56.93 55.49 2goo s PHE 60 Cb -0.11 -0.34 -0.02 0.00 -1.21 0.00 0.00 43.02 41.34 2goo s PHE 60 CO 0.19 -0.38 -0.15 0.00 -1.34 0.00 0.00 175.22 173.54 2goo s ALA 61 N -3.66 1.28 -0.05 1.99 0.00 -0.07 -1.98 121.76 119.27 2goo s ALA 61 Ca 0.05 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.11 2goo s ALA 61 Cb 0.06 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.01 2goo s ALA 61 CO -0.09 0.24 -0.04 -1.50 0.00 0.00 0.00 175.76 174.37 2goo s ILE 62 N -0.91 0.53 -0.17 0.00 2.07 0.58 -1.15 121.20 122.16 2goo s ILE 62 Ca 0.02 -0.09 -0.08 0.00 -1.41 0.00 0.00 60.65 59.09 2goo s ILE 62 Cb -0.08 -0.58 -0.04 0.00 0.13 0.00 0.00 42.46 41.88 2goo s ILE 62 CO 0.02 0.24 0.09 -0.51 -1.91 0.00 0.00 174.94 172.86 2goo s ILE 63 N 1.11 5.06 -0.01 2.00 2.07 -0.44 -1.29 121.20 129.71 2goo s ILE 63 Ca -0.08 0.06 0.01 0.00 -1.41 0.00 0.00 60.65 59.22 2goo s ILE 63 Cb -0.14 -3.26 0.00 0.00 0.13 0.00 0.00 42.46 39.19 2goo s ILE 63 CO -0.01 0.50 -0.02 -1.83 -1.91 0.00 0.00 174.94 171.67 2goo s GLU 64 N -0.02 0.21 -0.27 3.50 -1.05 -0.65 -0.54 118.70 119.88 2goo s GLU 64 Ca 0.08 -0.05 -0.10 0.00 -0.15 0.00 0.00 54.97 54.75 2goo s GLU 64 Cb -0.12 -0.24 -0.04 0.00 -0.44 0.00 0.00 34.13 33.29 2goo s GLU 64 CO 0.00 0.01 0.16 -2.00 0.95 0.00 0.00 175.26 174.38 2goo s GLU 65 N 0.16 3.90 0.00 -4.83 2.12 -0.13 -1.31 118.70 118.61 2goo s GLU 65 Ca -0.01 -0.35 0.00 0.00 0.36 0.00 0.00 54.97 54.97 2goo s GLU 65 Cb -0.03 -3.56 0.00 0.00 0.26 0.00 0.00 34.13 30.80 2goo s GLU 65 CO -0.00 -0.15 0.00 -0.40 -0.54 0.00 0.00 175.26 174.17 2goo n ASP 66 N 4.91 -0.30 -0.01 -1.70 5.68 -1.05 -4.05 116.55 120.05 2goo n ASP 66 Ca -0.15 -0.61 0.02 0.00 -0.50 0.00 0.00 54.79 53.55 2goo n ASP 66 Cb 0.52 0.00 0.36 0.00 -1.14 0.00 0.00 41.12 40.86 2goo n ASP 66 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2goo h ASP 67 N -0.30 0.49 0.28 -1.12 3.32 -1.99 -3.10 116.42 114.00 2goo h ASP 67 Ca 0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2goo h ASP 67 Cb 0.00 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.42 2goo h ASP 67 CO 0.00 0.45 -0.51 0.00 -1.72 0.00 0.00 179.24 177.47 2goo n GLN 68 N -4.38 0.40 0.00 3.56 3.00 -1.26 -4.93 117.38 113.77 2goo n GLN 68 Ca 0.02 -0.26 0.00 0.00 -0.01 0.00 0.00 57.00 56.75 2goo n GLN 68 Cb 0.15 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 28.89 2goo n GLN 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2goo n GLY 69 N 1.44 0.60 3.55 1.08 0.00 -1.17 -5.04 105.19 105.66 2goo n GLY 69 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2goo n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2goo s GLU 70 N -0.78 2.93 0.12 1.61 2.12 -1.26 -4.81 118.70 118.64 2goo s GLU 70 Ca 0.00 0.25 -0.15 0.00 0.36 0.00 0.00 54.97 55.43 2goo s GLU 70 Cb 0.00 -4.27 -0.07 0.00 0.26 0.00 0.00 34.13 30.05 2goo s GLU 70 CO 0.00 -2.40 0.55 0.95 -0.54 0.00 0.00 175.26 173.81 2goo s THR 71 N 7.38 4.84 0.13 -1.70 -4.23 -1.26 -2.51 115.64 118.28 2goo s THR 71 Ca 0.53 0.92 0.05 0.00 -1.18 0.00 0.00 61.69 62.01 2goo s THR 71 Cb -0.11 -3.77 -0.04 0.00 1.34 0.00 0.00 72.50 69.92 2goo s THR 71 CO 0.19 0.33 -0.12 0.42 -0.54 0.00 0.00 174.62 174.89 2goo s THR 72 N -1.37 1.26 -0.06 3.99 -4.23 -0.43 -4.99 115.64 109.82 2goo s THR 72 Ca 0.35 -1.85 0.06 0.00 -1.18 0.00 0.00 61.69 59.07 2goo s THR 72 Cb -0.16 -1.64 -0.01 0.00 1.34 0.00 0.00 72.50 72.03 2goo s THR 72 CO 0.19 -0.55 -0.24 -0.22 -0.54 0.00 0.00 174.62 173.26 2goo s LEU 73 N -2.73 2.06 0.11 4.79 0.20 -1.26 -1.64 118.68 120.21 2goo s LEU 73 Ca 0.12 -0.50 -0.04 0.00 0.69 0.00 0.00 54.13 54.39 2goo s LEU 73 Cb -0.02 -1.34 -0.03 0.00 -0.43 0.00 0.00 46.19 44.37 2goo s LEU 73 CO 0.02 0.23 0.11 0.00 -0.29 0.00 0.00 176.35 176.42 2goo s ALA 74 N -0.09 0.40 0.17 5.97 0.00 -0.41 -4.91 121.76 122.88 2goo s ALA 74 Ca -0.05 -1.13 -0.17 0.00 0.00 0.00 0.00 51.96 50.61 2goo s ALA 74 Cb -0.14 0.65 0.03 0.00 0.00 0.00 0.00 23.12 23.66 2goo s ALA 74 CO 0.04 -0.50 0.47 -1.54 0.00 0.00 0.00 175.76 174.23 2goo s SER 75 N -2.97 -0.24 0.00 0.00 1.04 -0.04 -0.31 113.70 111.18 2goo s SER 75 Ca 0.15 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.14 2goo s SER 75 Cb 0.06 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.72 2goo s SER 75 CO -0.04 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.82 2goo n GLY 76 N -0.29 -0.71 3.63 7.32 0.00 -0.84 -1.63 105.19 112.66 2goo n GLY 76 Ca -0.12 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 2goo n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2goo s MET 78 N -1.18 1.86 0.60 0.00 0.00 0.72 -4.94 119.30 116.37 2goo s MET 78 Ca 0.16 -0.46 -0.20 0.00 0.00 0.00 0.00 55.69 55.19 2goo s MET 78 Cb -0.11 -1.54 -0.03 0.00 0.00 0.00 0.00 34.83 33.15 2goo s MET 78 CO 0.05 0.02 1.32 0.21 0.00 0.00 0.00 175.02 176.62 2goo s LYS 79 N 0.71 2.82 0.17 4.11 2.20 -1.26 -0.91 119.74 127.59 2goo s LYS 79 Ca -0.13 2.13 -0.14 0.00 -0.36 0.00 0.00 55.97 57.46 2goo s LYS 79 Cb -0.16 -2.02 0.09 0.00 -1.51 0.00 0.00 37.83 34.23 2goo s LYS 79 CO 0.03 -1.41 1.82 -0.92 -0.36 0.00 0.00 175.35 174.51 2goo h TYR 80 N 0.95 0.58 -2.13 4.03 3.20 -1.89 -3.36 116.97 118.36 2goo h TYR 80 Ca -0.51 0.02 -0.57 0.00 3.14 0.00 0.00 58.73 60.81 2goo h TYR 80 Cb 1.32 -0.19 0.01 0.00 1.54 0.00 0.00 36.73 39.41 2goo h TYR 80 CO 0.43 0.34 1.33 0.39 -1.64 0.00 0.00 178.16 179.01 2goo n GLU 81 N -4.79 2.39 -0.52 1.82 -0.58 -1.26 -1.65 120.64 116.05 2goo n GLU 81 Ca 0.03 0.80 0.00 0.00 -0.42 0.00 0.00 57.16 57.58 2goo n GLU 81 Cb 0.06 -3.04 0.00 0.00 -0.57 0.00 0.00 31.44 27.90 2goo n GLU 81 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2goo n GLY 82 N 5.08 0.76 0.20 0.62 0.00 -1.26 -4.95 105.19 105.63 2goo n GLY 82 Ca 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.23 2goo n GLY 82 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2goo h SER 83 N 0.00 0.31 -0.67 1.61 4.64 -1.46 -2.54 113.55 115.45 2goo h SER 83 Ca 0.00 -0.14 0.14 0.00 -0.47 0.00 0.00 61.79 61.32 2goo h SER 83 Cb 0.00 -0.09 -0.12 0.00 -0.31 0.00 0.00 62.40 61.88 2goo h SER 83 CO 0.00 0.72 -0.09 0.44 -0.87 0.00 0.00 176.83 177.03 2goo h ASP 84 N 0.24 -0.48 -0.04 4.97 3.45 -1.93 0.97 116.42 123.60 2goo h ASP 84 Ca 0.02 0.19 -0.01 0.00 0.43 0.00 0.00 57.03 57.65 2goo h ASP 84 Cb 0.89 0.37 -0.00 0.00 -0.56 0.00 0.00 39.33 40.02 2goo h ASP 84 CO 0.07 -0.19 -0.02 -0.26 -1.57 0.00 0.00 179.24 177.28 2goo h PHE 85 N 0.04 0.10 -0.35 4.55 0.05 -1.87 -2.86 116.94 116.60 2goo h PHE 85 Ca 0.34 -0.02 -0.14 0.00 3.82 0.00 0.00 57.97 61.96 2goo h PHE 85 Cb 0.55 -0.02 -0.01 0.00 2.00 0.00 0.00 35.95 38.47 2goo h PHE 85 CO -0.47 0.45 -0.34 1.96 -0.18 0.00 0.00 178.31 179.73 2goo h GLN 86 N -0.29 0.84 -0.33 1.51 4.20 -1.14 0.84 115.11 120.75 2goo h GLN 86 Ca 0.01 -0.44 -0.08 0.00 0.06 0.00 0.00 58.65 58.19 2goo h GLN 86 Cb 0.43 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 2goo h GLN 86 CO 0.01 1.08 -0.15 0.00 -0.67 0.00 0.00 178.83 179.10 2goo h LYS 88 N 0.53 -0.29 -2.15 0.00 1.63 -1.34 -3.46 116.57 111.49 2goo h LYS 88 Ca 0.09 0.02 0.24 0.00 -0.85 0.00 0.00 60.65 60.15 2goo h LYS 88 Cb 0.57 0.07 -0.09 0.00 -0.60 0.00 0.00 32.23 32.18 2goo h LYS 88 CO 0.04 -0.00 -0.52 -3.47 -3.45 0.00 0.00 179.45 172.05 2goo n ASP 89 N -5.10 -5.60 -4.46 4.20 2.03 0.27 -4.84 116.55 103.05 2goo n ASP 89 Ca -0.09 0.59 -0.34 0.00 0.52 0.00 0.00 54.79 55.46 2goo n ASP 89 Cb 0.23 -2.97 -0.12 0.00 -0.72 0.00 0.00 41.12 37.53 2goo n ASP 89 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2goo s SER 90 N -6.13 4.80 0.00 1.67 0.15 -1.26 -4.98 113.70 107.94 2goo s SER 90 Ca 0.00 -0.18 0.16 0.00 0.70 0.00 0.00 55.95 56.62 2goo s SER 90 Cb 0.00 -1.81 0.79 0.00 -1.71 0.00 0.00 66.02 63.30 2goo s SER 90 CO 0.00 0.10 1.44 -0.81 1.20 0.00 0.00 173.24 175.16 2goo n PRO 91 N 4.02 0.24 -0.26 5.44 -0.04 -1.26 -2.48 135.00 140.65 2goo n PRO 91 Ca -0.17 0.13 0.12 0.00 -0.04 0.00 0.00 63.50 63.54 2goo n PRO 91 Cb 0.52 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.74 2goo n PRO 91 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2goo n LYS 92 N -1.27 2.60 -1.58 0.54 5.02 -1.26 -4.96 118.16 117.25 2goo n LYS 92 Ca 0.08 -2.44 -0.41 0.00 -2.02 0.00 0.00 58.31 53.51 2goo n LYS 92 Cb 0.12 -1.54 0.01 0.00 -0.02 0.00 0.00 35.03 33.61 2goo n LYS 92 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2goo n ALA 93 N 1.56 -0.21 0.04 7.82 0.00 -1.04 -4.93 120.51 123.75 2goo n ALA 93 Ca 0.21 0.21 -0.19 0.00 0.00 0.00 0.00 53.44 53.68 2goo n ALA 93 Cb 0.61 -2.01 -0.09 0.00 0.00 0.00 0.00 19.45 17.96 2goo n ALA 93 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2goo h GLN 94 N 1.35 0.69 -6.15 0.00 1.08 -1.93 -3.43 115.11 106.72 2goo h GLN 94 Ca -0.43 -0.72 -0.59 0.00 -1.45 0.00 0.00 58.65 55.46 2goo h GLN 94 Cb 1.35 0.20 -0.05 0.00 -0.05 0.00 0.00 27.48 28.93 2goo h GLN 94 CO 0.56 1.30 -0.10 -0.51 -0.95 0.00 0.00 178.83 179.13 2goo s LEU 95 N -8.12 4.51 0.15 1.46 1.43 -1.26 -5.06 118.68 111.79 2goo s LEU 95 Ca -0.09 1.15 -0.25 0.00 -1.03 0.00 0.00 54.13 53.90 2goo s LEU 95 Cb 0.07 -2.78 -0.08 0.00 0.03 0.00 0.00 46.19 43.44 2goo s LEU 95 CO 0.92 0.29 0.77 0.00 0.23 0.00 0.00 176.35 178.56 2goo s ARG 96 N -1.10 4.56 0.02 1.70 1.70 -1.26 -4.96 118.95 119.61 2goo s ARG 96 Ca 0.27 1.14 -0.28 0.00 -0.47 0.00 0.00 55.73 56.40 2goo s ARG 96 Cb -0.18 -3.27 0.09 0.00 -0.57 0.00 0.00 34.95 31.02 2goo s ARG 96 CO 0.17 0.55 0.81 -0.98 -1.08 0.00 0.00 175.30 174.76 2goo s ARG 97 N -1.04 0.94 -0.04 3.89 1.70 -1.26 -0.95 118.95 122.18 2goo s ARG 97 Ca 0.36 -0.26 -0.00 0.00 -0.47 0.00 0.00 55.73 55.35 2goo s ARG 97 Cb -0.23 0.43 0.03 0.00 -0.57 0.00 0.00 34.95 34.61 2goo s ARG 97 CO 0.26 -0.39 0.01 0.99 -1.08 0.00 0.00 175.30 175.08 2goo s THR 98 N -2.96 0.18 -0.08 4.99 2.01 0.30 -4.45 115.64 115.63 2goo s THR 98 Ca 0.02 0.14 0.01 0.00 0.31 0.00 0.00 61.69 62.17 2goo s THR 98 Cb -0.01 -0.31 -0.03 0.00 0.01 0.00 0.00 72.50 72.16 2goo s THR 98 CO -0.08 0.17 -0.10 -0.51 -0.69 0.00 0.00 174.62 173.42 2goo s ILE 99 N 1.37 3.39 -0.02 1.82 2.07 -1.26 -1.32 121.20 127.25 2goo s ILE 99 Ca -0.05 -0.58 0.03 0.00 -1.41 0.00 0.00 60.65 58.65 2goo s ILE 99 Cb -0.13 -2.39 -0.00 0.00 0.13 0.00 0.00 42.46 40.07 2goo s ILE 99 CO -0.02 0.57 -0.12 -1.61 -1.91 0.00 0.00 174.94 171.84 2goo s GLU 100 N -0.41 1.15 0.17 3.50 2.02 -0.30 -4.96 118.70 119.87 2goo s GLU 100 Ca 0.05 -0.43 0.10 0.00 0.02 0.00 0.00 54.97 54.72 2goo s GLU 100 Cb -0.12 -1.07 -0.04 0.00 0.10 0.00 0.00 34.13 32.99 2goo s GLU 100 CO 0.02 0.21 -0.21 0.00 0.02 0.00 0.00 175.26 175.31 2goo n ARG 103 N -0.27 2.49 -4.28 0.00 1.74 -1.26 -0.96 116.66 114.12 2goo n ARG 103 Ca -0.09 -3.68 -0.22 0.00 -0.77 0.00 0.00 57.85 53.09 2goo n ARG 103 Cb 0.63 -1.80 -0.12 0.00 -1.02 0.00 0.00 32.46 30.14 2goo n ARG 103 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2goo s THR 104 N -3.79 1.66 -0.07 0.55 -4.23 -1.26 -5.04 115.64 103.46 2goo s THR 104 Ca 0.41 -1.64 -0.37 0.00 -1.18 0.00 0.00 61.69 58.91 2goo s THR 104 Cb 0.38 -1.59 -0.15 0.00 1.34 0.00 0.00 72.50 72.47 2goo s THR 104 CO -0.02 -0.17 1.59 0.59 -0.54 0.00 0.00 174.62 176.08 2goo n ASN 105 N 0.85 2.32 -0.03 3.99 3.02 -1.26 -1.72 115.26 122.42 2goo n ASN 105 Ca -0.18 1.08 -0.00 0.00 -0.03 0.00 0.00 54.58 55.45 2goo n ASN 105 Cb 0.55 -1.22 -0.00 0.00 -0.61 0.00 0.00 39.78 38.50 2goo n ASN 105 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2goo n LEU 106 N 4.26 0.77 0.01 3.41 4.32 0.15 -4.78 117.00 125.14 2goo n LEU 106 Ca 0.22 0.01 0.00 0.00 -0.02 0.00 0.00 56.01 56.22 2goo n LEU 106 Cb 0.19 -2.14 0.02 0.00 -1.62 0.00 0.00 43.42 39.88 2goo n LEU 106 CO 0.71 -0.82 0.52 0.00 -1.22 0.00 0.00 177.39 176.58 2goo h ASN 108 N 0.00 0.10 -0.77 0.00 -1.24 -1.86 -3.40 115.58 108.41 2goo h ASN 108 Ca 0.00 -0.10 -0.01 0.00 0.71 0.00 0.00 56.30 56.89 2goo h ASN 108 Cb 0.36 -0.03 -0.04 0.00 0.73 0.00 0.00 38.32 39.34 2goo h ASN 108 CO 0.00 1.02 0.43 1.56 -1.29 0.00 0.00 177.43 179.15 2goo h GLN 109 N 0.03 1.08 0.00 6.67 4.20 -1.70 -2.92 115.11 122.47 2goo h GLN 109 Ca -0.03 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.56 2goo h GLN 109 Cb 1.70 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 29.26 2goo h GLN 109 CO 0.14 0.79 -0.14 0.66 -0.67 0.00 0.00 178.83 179.61 2goo n TYR 110 N -4.35 0.00 -2.39 2.96 4.02 -1.26 -4.98 117.16 111.16 2goo n TYR 110 Ca 0.08 -1.12 -0.43 0.00 -0.01 0.00 0.00 57.90 56.42 2goo n TYR 110 Cb 0.10 -0.18 -0.02 0.00 -0.02 0.00 0.00 39.34 39.22 2goo n TYR 110 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2goo s LEU 111 N -2.93 4.10 -0.41 7.72 1.43 -1.11 -4.98 118.68 122.50 2goo s LEU 111 Ca 0.33 1.59 0.01 0.00 -1.03 0.00 0.00 54.13 55.04 2goo s LEU 111 Cb 0.30 -3.54 0.14 0.00 0.03 0.00 0.00 46.19 43.12 2goo s LEU 111 CO 0.00 -0.87 0.23 -1.10 0.23 0.00 0.00 176.35 174.85 2goo s GLN 112 N 3.74 1.02 0.87 1.70 -0.21 -1.26 -4.88 119.66 120.64 2goo s GLN 112 Ca 0.57 -1.78 -0.11 0.00 0.02 0.00 0.00 55.36 54.06 2goo s GLN 112 Cb -0.21 -1.94 0.11 0.00 1.00 0.00 0.00 33.01 31.97 2goo s GLN 112 CO 0.18 -1.19 1.10 -2.14 -2.12 0.00 0.00 175.29 171.12 2goo s PRO 113 N 0.58 1.48 -0.14 2.91 0.02 -1.26 -5.03 135.00 133.56 2goo s PRO 113 Ca 0.18 1.08 -0.04 0.00 0.02 0.00 0.00 61.00 62.24 2goo s PRO 113 Cb -0.23 -1.81 -0.03 0.00 0.02 0.00 0.00 34.50 32.45 2goo s PRO 113 CO -0.00 -2.16 -0.01 0.95 -0.33 0.00 0.00 177.00 175.44 2goo s THR 114 N -2.85 4.16 0.50 0.99 -4.23 -1.26 -4.75 115.64 108.21 2goo s THR 114 Ca 0.63 -0.27 -0.19 0.00 -1.18 0.00 0.00 61.69 60.68 2goo s THR 114 Cb -0.19 -2.81 -0.13 0.00 1.34 0.00 0.00 72.50 70.72 2goo s THR 114 CO 0.57 0.52 0.19 0.18 -0.54 0.00 0.00 174.62 175.55 2goo n LEU 115 N 3.09 -1.67 -4.76 4.79 7.99 -1.26 -4.69 117.00 120.50 2goo n LEU 115 Ca -0.18 0.73 -0.38 0.00 -0.01 0.00 0.00 56.01 56.17 2goo n LEU 115 Cb 0.53 -0.99 0.03 0.00 -0.11 0.00 0.00 43.42 42.87 2goo n LEU 115 CO 0.32 -3.92 0.97 -2.84 -1.51 0.00 0.00 177.39 170.40 2goo s PRO 116 N -1.43 3.37 -0.36 3.23 0.02 -1.26 -4.82 135.00 133.75 2goo s PRO 116 Ca 0.62 2.17 -0.40 0.00 0.02 0.00 0.00 61.00 63.41 2goo s PRO 116 Cb -0.51 -2.37 -0.16 0.00 0.02 0.00 0.00 34.50 31.49 2goo s PRO 116 CO 0.61 -0.98 1.90 -2.30 -0.33 0.00 0.00 177.00 175.90 2goo n PRO 117 N -0.75 0.83 0.00 5.54 -0.02 -1.26 -5.00 135.00 134.34 2goo n PRO 117 Ca 0.09 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2goo n PRO 117 Cb 0.45 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 2goo n PRO 117 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76