#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g3d s SER 2 N 0.00 5.48 0.20 0.00 1.04 -1.26 -5.01 113.70 114.15 2g3d s SER 2 Ca 0.00 -0.11 -0.10 0.00 0.48 0.00 0.00 55.95 56.22 2g3d s SER 2 Cb 0.00 -0.90 0.14 0.00 0.10 0.00 0.00 66.02 65.36 2g3d s SER 2 CO 0.00 -0.95 1.83 0.50 0.98 0.00 0.00 173.24 175.61 2g3d h LYS 3 N 0.31 1.00 -0.12 4.02 3.64 -2.09 -2.85 116.57 120.48 2g3d h LYS 3 Ca -0.42 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2g3d h LYS 3 Cb 1.28 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 2g3d h LYS 3 CO 0.51 0.72 0.08 0.78 -2.27 0.00 0.00 179.45 179.27 2g3d h GLY 4 N 1.00 0.17 1.27 5.01 0.00 -2.03 -2.28 103.07 106.20 2g3d h GLY 4 Ca 0.26 -0.06 0.10 0.00 0.00 0.00 0.00 47.33 47.63 2g3d h GLY 4 CO -0.05 0.06 0.27 -2.09 0.00 0.00 0.00 176.54 174.73 2g3d h GLU 5 N 0.16 0.00 0.00 4.80 4.81 -1.90 -1.79 114.58 120.66 2g3d h GLU 5 Ca 0.04 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2g3d h GLU 5 Cb -0.02 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 2g3d h GLU 5 CO -0.01 0.00 -0.05 0.93 -0.73 0.00 0.00 179.01 179.15 2g3d h GLU 6 N 0.00 0.00 0.00 1.92 5.08 -1.57 -1.63 114.58 118.38 2g3d h GLU 6 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2g3d h GLU 6 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2g3d h GLU 6 CO -0.00 0.05 0.00 1.28 -1.00 0.00 0.00 179.01 179.34 2g3d n LEU 7 N -3.44 0.00 -0.12 1.33 4.77 -0.67 -3.75 117.00 115.12 2g3d n LEU 7 Ca -0.02 0.39 0.04 0.00 -0.03 0.00 0.00 56.01 56.38 2g3d n LEU 7 Cb 0.17 -0.39 0.07 0.00 -2.33 0.00 0.00 43.42 40.95 2g3d n LEU 7 CO 0.26 -0.14 0.54 0.49 -1.33 0.00 0.00 177.39 177.22 2g3d n PHE 8 N -1.39 0.08 0.43 -1.77 3.01 -0.61 -4.69 117.46 112.52 2g3d n PHE 8 Ca 0.07 -0.67 0.13 0.00 1.01 0.00 0.00 57.45 58.00 2g3d n PHE 8 Cb 0.19 -0.09 0.44 0.00 -0.01 0.00 0.00 39.48 40.00 2g3d n PHE 8 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 2g3d h THR 9 N 0.26 0.00 -3.26 4.37 1.35 -1.69 -3.37 112.91 110.57 2g3d h THR 9 Ca 0.00 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 2g3d h THR 9 Cb 0.71 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.55 2g3d h THR 9 CO 0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.89 2g3d n GLY 10 N 0.66 6.69 3.70 5.82 0.00 -1.26 -4.82 105.19 115.98 2g3d n GLY 10 Ca 0.03 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 2g3d n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g3d s VAL 11 N 0.34 4.49 -0.15 1.61 1.01 -1.26 -4.48 120.40 121.96 2g3d s VAL 11 Ca 0.00 1.79 0.01 0.00 0.00 0.00 0.00 61.98 63.78 2g3d s VAL 11 Cb 0.00 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.23 2g3d s VAL 11 CO 0.00 0.08 -0.18 -0.69 0.00 0.00 0.00 175.10 174.31 2g3d s VAL 12 N 1.50 2.46 0.48 2.92 1.01 0.06 -4.95 120.40 123.87 2g3d s VAL 12 Ca 0.54 -0.85 -0.22 0.00 0.00 0.00 0.00 61.98 61.45 2g3d s VAL 12 Cb -0.24 -2.02 -0.07 0.00 0.00 0.00 0.00 36.38 34.06 2g3d s VAL 12 CO 0.25 0.53 1.16 -2.16 0.00 0.00 0.00 175.10 174.88 2g3d s PRO 13 N 0.76 3.65 -0.02 2.72 0.04 -1.26 -0.94 135.00 139.95 2g3d s PRO 13 Ca -0.07 1.74 0.05 0.00 0.04 0.00 0.00 61.00 62.76 2g3d s PRO 13 Cb -0.16 -2.31 -0.01 0.00 0.04 0.00 0.00 34.50 32.07 2g3d s PRO 13 CO 0.00 -0.63 -0.17 0.42 0.04 0.00 0.00 177.00 176.66 2g3d s ILE 14 N -1.60 1.34 -0.03 0.56 1.01 -0.05 -4.87 121.20 117.56 2g3d s ILE 14 Ca 0.66 -0.71 0.06 0.00 0.00 0.00 0.00 60.65 60.65 2g3d s ILE 14 Cb -0.28 -1.13 -0.01 0.00 0.01 0.00 0.00 42.46 41.05 2g3d s ILE 14 CO 0.33 0.38 -0.20 -0.76 0.00 0.00 0.00 174.94 174.69 2g3d s LEU 15 N -0.27 2.00 -0.05 2.97 1.43 -1.26 -1.83 118.68 121.67 2g3d s LEU 15 Ca 0.04 -0.39 0.04 0.00 -1.03 0.00 0.00 54.13 52.78 2g3d s LEU 15 Cb -0.08 -1.08 0.00 0.00 0.03 0.00 0.00 46.19 45.06 2g3d s LEU 15 CO 0.00 0.22 -0.17 -0.69 0.23 0.00 0.00 176.35 175.94 2g3d s VAL 16 N -0.24 1.42 -0.05 -1.59 1.01 -0.28 -4.98 120.40 115.69 2g3d s VAL 16 Ca 0.02 -0.69 -0.00 0.00 0.00 0.00 0.00 61.98 61.31 2g3d s VAL 16 Cb -0.10 -1.23 0.03 0.00 0.00 0.00 0.00 36.38 35.07 2g3d s VAL 16 CO 0.01 0.41 -0.00 -1.61 0.00 0.00 0.00 175.10 173.91 2g3d s GLU 17 N 0.21 0.50 -0.05 2.72 0.41 -1.26 -0.42 118.70 120.81 2g3d s GLU 17 Ca -0.08 0.08 0.04 0.00 -0.41 0.00 0.00 54.97 54.59 2g3d s GLU 17 Cb -0.13 -0.75 0.00 0.00 -1.78 0.00 0.00 34.13 31.47 2g3d s GLU 17 CO 0.03 -0.21 -0.15 -1.17 -0.49 0.00 0.00 175.26 173.27 2g3d s LEU 18 N 1.47 1.84 -0.12 1.80 0.20 -0.10 -5.01 118.68 118.75 2g3d s LEU 18 Ca -0.03 -0.33 -0.01 0.00 0.69 0.00 0.00 54.13 54.45 2g3d s LEU 18 Cb -0.13 -0.92 -0.02 0.00 -0.43 0.00 0.00 46.19 44.69 2g3d s LEU 18 CO -0.03 0.11 -0.10 -1.81 -0.29 0.00 0.00 176.35 174.23 2g3d s ASP 19 N 0.25 4.29 0.09 3.68 1.01 -1.26 -0.85 116.67 123.88 2g3d s ASP 19 Ca -0.08 -0.23 0.04 0.00 0.71 0.00 0.00 52.55 52.99 2g3d s ASP 19 Cb -0.13 -1.55 -0.04 0.00 1.01 0.00 0.00 42.92 42.22 2g3d s ASP 19 CO 0.03 0.20 -0.10 -0.83 0.21 0.00 0.00 175.17 174.68 2g3d s GLY 20 N 0.15 0.84 -0.22 0.21 0.00 0.86 -4.99 107.32 104.17 2g3d s GLY 20 Ca -0.05 -1.17 -0.04 0.00 0.00 0.00 0.00 44.72 43.47 2g3d s GLY 20 CO 0.04 -1.24 0.26 -0.35 0.00 0.00 0.00 173.10 171.81 2g3d s ASP 21 N -2.39 1.14 -0.23 1.64 -1.08 -1.26 -1.57 116.67 112.92 2g3d s ASP 21 Ca 0.05 -0.15 0.02 0.00 -0.52 0.00 0.00 52.55 51.95 2g3d s ASP 21 Cb -0.03 0.56 0.05 0.00 -1.46 0.00 0.00 42.92 42.03 2g3d s ASP 21 CO 0.00 -0.32 -0.12 -0.69 0.52 0.00 0.00 175.17 174.55 2g3d s VAL 22 N 2.38 1.99 -1.42 1.11 1.01 -0.22 -4.67 120.40 120.57 2g3d s VAL 22 Ca 0.08 -1.32 -0.10 0.00 0.00 0.00 0.00 61.98 60.65 2g3d s VAL 22 Cb -0.16 -2.03 0.06 0.00 0.00 0.00 0.00 36.38 34.25 2g3d s VAL 22 CO -0.14 0.13 0.66 0.59 0.00 0.00 0.00 175.10 176.34 2g3d n ASN 23 N 4.54 -4.60 0.00 3.32 4.13 -1.26 -0.80 115.26 120.59 2g3d n ASN 23 Ca -0.16 -0.48 0.00 0.00 1.68 0.00 0.00 54.58 55.63 2g3d n ASN 23 Cb 0.45 -3.74 0.00 0.00 -1.54 0.00 0.00 39.78 34.95 2g3d n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2g3d n GLY 24 N -1.40 1.79 3.55 7.41 0.00 -1.26 -5.00 105.19 110.27 2g3d n GLY 24 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 2g3d n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2g3d s HIS 25 N -2.74 2.77 0.01 1.61 3.76 0.02 -5.02 115.29 115.70 2g3d s HIS 25 Ca 0.00 0.24 -0.07 0.00 -0.15 0.00 0.00 55.06 55.09 2g3d s HIS 25 Cb 0.00 -4.20 -0.05 0.00 1.11 0.00 0.00 32.58 29.45 2g3d s HIS 25 CO 0.00 -1.35 0.27 0.15 -0.85 0.00 0.00 174.74 172.95 2g3d s LYS 26 N 4.22 3.58 0.16 1.40 1.02 -1.26 -1.06 119.74 127.80 2g3d s LYS 26 Ca 0.37 -0.07 -0.23 0.00 0.02 0.00 0.00 55.97 56.06 2g3d s LYS 26 Cb -0.10 -3.08 0.07 0.00 -0.52 0.00 0.00 37.83 34.20 2g3d s LYS 26 CO 0.23 0.65 0.60 -0.59 -0.92 0.00 0.00 175.35 175.33 2g3d s PHE 27 N -1.29 -0.54 0.03 3.18 -0.71 -0.61 -4.99 117.98 113.06 2g3d s PHE 27 Ca 0.27 0.33 0.04 0.00 -1.04 0.00 0.00 56.93 56.53 2g3d s PHE 27 Cb -0.13 0.56 -0.02 0.00 -1.21 0.00 0.00 43.02 42.22 2g3d s PHE 27 CO 0.16 -0.85 -0.13 -1.12 -1.34 0.00 0.00 175.22 171.94 2g3d s SER 28 N -2.75 1.48 -0.04 1.98 0.01 -1.26 -0.10 113.70 113.02 2g3d s SER 28 Ca 0.01 -0.43 0.03 0.00 1.31 0.00 0.00 55.95 56.87 2g3d s SER 28 Cb -0.01 -0.09 0.01 0.00 0.21 0.00 0.00 66.02 66.13 2g3d s SER 28 CO -0.13 0.02 -0.11 -0.69 0.41 0.00 0.00 173.24 172.74 2g3d s VAL 29 N -0.82 0.94 -0.10 3.43 1.01 -0.03 -1.46 120.40 123.38 2g3d s VAL 29 Ca 0.00 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.57 2g3d s VAL 29 Cb -0.07 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.44 2g3d s VAL 29 CO 0.01 0.29 -0.14 -0.44 0.00 0.00 0.00 175.10 174.83 2g3d s SER 30 N 0.31 4.01 0.11 3.32 0.01 -0.42 -0.93 113.70 120.12 2g3d s SER 30 Ca -0.06 -0.27 0.06 0.00 1.31 0.00 0.00 55.95 56.99 2g3d s SER 30 Cb -0.11 -1.28 -0.04 0.00 0.21 0.00 0.00 66.02 64.80 2g3d s SER 30 CO 0.01 0.24 -0.15 -0.83 0.41 0.00 0.00 173.24 172.92 2g3d s GLY 31 N -0.11 1.07 0.01 3.44 0.00 0.44 -0.53 107.32 111.63 2g3d s GLY 31 Ca -0.02 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.48 2g3d s GLY 31 CO 0.04 -1.27 -0.02 -0.54 0.00 0.00 0.00 173.10 171.30 2g3d s GLU 32 N -2.35 0.22 0.00 2.90 2.02 -0.49 -1.13 118.70 119.88 2g3d s GLU 32 Ca 0.06 -0.41 0.00 0.00 0.02 0.00 0.00 54.97 54.64 2g3d s GLU 32 Cb -0.07 0.06 0.00 0.00 0.10 0.00 0.00 34.13 34.22 2g3d s GLU 32 CO 0.03 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.69 2g3d n GLY 33 N 2.10 -0.73 3.38 -1.39 0.00 -0.76 -1.23 105.19 106.57 2g3d n GLY 33 Ca -0.20 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 2g3d n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2g3d s GLU 34 N -0.78 1.07 0.04 1.61 -1.05 -0.69 -0.87 118.70 118.02 2g3d s GLU 34 Ca 0.00 -0.34 0.05 0.00 -0.15 0.00 0.00 54.97 54.53 2g3d s GLU 34 Cb 0.00 0.49 -0.02 0.00 -0.44 0.00 0.00 34.13 34.16 2g3d s GLU 34 CO 0.00 -0.41 -0.15 0.20 0.95 0.00 0.00 175.26 175.85 2g3d s GLY 35 N -2.20 0.84 -0.43 -3.83 0.00 -0.11 -1.66 107.32 99.92 2g3d s GLY 35 Ca -0.03 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 43.85 2g3d s GLY 35 CO -0.05 -0.83 0.28 -0.35 0.00 0.00 0.00 173.10 172.16 2g3d s ASP 36 N -1.12 3.03 0.55 1.64 3.68 0.19 -0.76 116.67 123.87 2g3d s ASP 36 Ca 0.03 -2.74 0.23 0.00 2.13 0.00 0.00 52.55 52.20 2g3d s ASP 36 Cb -0.08 -0.77 1.52 0.00 -1.45 0.00 0.00 42.92 42.15 2g3d s ASP 36 CO 0.01 -0.24 2.19 0.00 0.13 0.00 0.00 175.17 177.26 2g3d h ALA 37 N 6.40 1.71 -0.85 3.66 0.00 -1.79 -1.24 119.26 127.16 2g3d h ALA 37 Ca 0.09 -0.02 0.21 0.00 0.00 0.00 0.00 54.91 55.20 2g3d h ALA 37 Cb 0.92 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 2g3d h ALA 37 CO 0.42 0.03 0.58 1.15 0.00 0.00 0.00 179.25 181.42 2g3d h THR 38 N 0.00 0.66 -0.23 0.00 2.02 -1.88 -1.32 112.91 112.16 2g3d h THR 38 Ca -0.00 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.09 2g3d h THR 38 Cb 0.04 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2g3d h THR 38 CO 0.00 0.05 0.00 -1.22 0.37 0.00 0.00 175.52 174.72 2g3d n TYR 39 N -4.43 0.30 -2.30 3.16 4.01 -0.51 -4.99 117.16 112.40 2g3d n TYR 39 Ca 0.18 -0.43 -0.18 0.00 -0.16 0.00 0.00 57.90 57.31 2g3d n TYR 39 Cb 0.75 -0.03 -0.02 0.00 -0.31 0.00 0.00 39.34 39.73 2g3d n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2g3d n GLY 40 N 0.30 -0.23 3.47 2.72 0.00 -0.50 -4.95 105.19 106.00 2g3d n GLY 40 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2g3d n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2g3d s LYS 41 N -4.85 3.62 -0.05 1.61 2.20 -0.92 -4.96 119.74 116.38 2g3d s LYS 41 Ca 0.00 -0.55 0.05 0.00 -0.36 0.00 0.00 55.97 55.11 2g3d s LYS 41 Cb 0.00 -2.87 -0.00 0.00 -1.51 0.00 0.00 37.83 33.44 2g3d s LYS 41 CO 0.00 0.22 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.50 2g3d s LEU 42 N 0.40 1.96 -0.10 5.43 1.43 -1.26 -0.63 118.68 125.90 2g3d s LEU 42 Ca -0.05 -0.41 -0.00 0.00 -1.03 0.00 0.00 54.13 52.64 2g3d s LEU 42 Cb -0.14 -1.12 0.02 0.00 0.03 0.00 0.00 46.19 44.98 2g3d s LEU 42 CO 0.03 0.17 -0.07 0.42 0.23 0.00 0.00 176.35 177.13 2g3d s THR 43 N 0.05 0.94 -0.01 5.49 -4.23 -0.66 -5.03 115.64 112.19 2g3d s THR 43 Ca -0.06 -0.25 -0.04 0.00 -1.18 0.00 0.00 61.69 60.16 2g3d s THR 43 Cb -0.13 -0.96 -0.00 0.00 1.34 0.00 0.00 72.50 72.75 2g3d s THR 43 CO 0.03 0.35 0.08 -0.76 -0.54 0.00 0.00 174.62 173.78 2g3d s LEU 44 N 1.58 1.75 -0.09 4.79 1.43 -1.26 -1.71 118.68 125.17 2g3d s LEU 44 Ca 0.02 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 53.00 2g3d s LEU 44 Cb -0.13 0.42 0.01 0.00 0.03 0.00 0.00 46.19 46.52 2g3d s LEU 44 CO -0.06 -0.24 -0.15 -0.75 0.23 0.00 0.00 176.35 175.38 2g3d s LYS 45 N -0.92 2.09 -0.01 1.70 2.20 -0.36 -4.98 119.74 119.47 2g3d s LYS 45 Ca -0.10 -0.53 0.05 0.00 -0.36 0.00 0.00 55.97 55.03 2g3d s LYS 45 Cb -0.06 -1.74 -0.03 0.00 -1.51 0.00 0.00 37.83 34.49 2g3d s LYS 45 CO 0.00 -0.01 -0.15 -0.06 -0.36 0.00 0.00 175.35 174.77 2g3d s PHE 46 N 0.81 2.65 -0.05 4.03 0.40 -1.26 -1.39 117.98 123.17 2g3d s PHE 46 Ca -0.11 -0.20 0.03 0.00 -0.60 0.00 0.00 56.93 56.06 2g3d s PHE 46 Cb -0.16 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 41.82 2g3d s PHE 46 CO 0.02 0.23 -0.15 0.42 0.70 0.00 0.00 175.22 176.43 2g3d s ILE 47 N -0.84 1.32 -0.40 0.64 1.01 0.31 -4.99 121.20 118.24 2g3d s ILE 47 Ca 0.13 -0.63 -0.28 0.00 0.00 0.00 0.00 60.65 59.88 2g3d s ILE 47 Cb -0.11 -1.16 0.02 0.00 0.01 0.00 0.00 42.46 41.22 2g3d s ILE 47 CO 0.03 0.39 1.03 0.00 0.00 0.00 0.00 174.94 176.39 2g3d n THR 49 N 6.29 0.00 0.96 0.00 -2.24 -0.53 -3.71 114.28 115.05 2g3d n THR 49 Ca 0.10 -0.10 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 2g3d n THR 49 Cb 0.48 0.29 0.06 0.00 -2.10 0.00 0.00 70.33 69.06 2g3d n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2g3d n THR 50 N -0.83 0.00 0.00 4.28 -2.24 -1.25 -5.01 114.28 109.24 2g3d n THR 50 Ca 0.12 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2g3d n THR 50 Cb 0.34 1.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 2g3d n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g3d n GLY 51 N 1.33 0.27 3.73 3.38 0.00 -1.24 -5.03 105.19 107.62 2g3d n GLY 51 Ca 0.12 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.40 2g3d n GLY 51 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2g3d s LYS 52 N -0.01 4.64 0.06 1.61 2.20 -1.26 -4.69 119.74 122.29 2g3d s LYS 52 Ca 0.00 1.38 -0.31 0.00 -0.36 0.00 0.00 55.97 56.69 2g3d s LYS 52 Cb 0.00 -3.39 -0.07 0.00 -1.51 0.00 0.00 37.83 32.86 2g3d s LYS 52 CO 0.00 0.17 1.35 -1.17 -0.36 0.00 0.00 175.35 175.34 2g3d s LEU 53 N 0.20 4.35 0.00 5.43 2.96 -1.26 -4.93 118.68 125.44 2g3d s LEU 53 Ca 0.47 2.18 0.18 0.00 -0.22 0.00 0.00 54.13 56.74 2g3d s LEU 53 Cb -0.22 -3.58 0.82 0.00 0.50 0.00 0.00 46.19 43.71 2g3d s LEU 53 CO 0.28 -0.63 1.56 -0.81 -1.32 0.00 0.00 176.35 175.43 2g3d n PRO 54 N 4.41 1.40 -4.18 0.98 -0.04 -1.26 -4.80 135.00 131.51 2g3d n PRO 54 Ca 0.11 -0.61 -0.11 0.00 -0.04 0.00 0.00 63.50 62.85 2g3d n PRO 54 Cb 0.44 -1.32 -0.10 0.00 -0.04 0.00 0.00 33.50 32.47 2g3d n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2g3d s VAL 55 N -1.87 0.76 0.32 0.52 -7.23 -1.26 -5.11 120.40 106.53 2g3d s VAL 55 Ca 0.28 -1.96 -0.29 0.00 -1.81 0.00 0.00 61.98 58.21 2g3d s VAL 55 Cb 0.14 -1.72 -0.10 0.00 0.56 0.00 0.00 36.38 35.26 2g3d s VAL 55 CO 0.22 -0.85 1.28 -2.84 -0.31 0.00 0.00 175.10 172.61 2g3d s PRO 56 N -3.82 4.39 0.24 4.82 0.02 -1.26 -4.93 135.00 134.45 2g3d s PRO 56 Ca 0.13 2.16 -0.06 0.00 0.02 0.00 0.00 61.00 63.24 2g3d s PRO 56 Cb 0.05 -3.09 0.42 0.00 0.02 0.00 0.00 34.50 31.89 2g3d s PRO 56 CO -0.04 -0.14 1.70 -1.49 -0.33 0.00 0.00 177.00 176.70 2g3d h TRP 57 N 3.58 0.32 -0.31 6.54 4.06 -2.00 -0.99 115.95 127.15 2g3d h TRP 57 Ca -0.48 0.04 0.09 0.00 2.06 0.00 0.00 58.89 60.60 2g3d h TRP 57 Cb 1.22 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 29.34 2g3d h TRP 57 CO 0.57 -0.03 0.27 -1.35 -3.56 0.00 0.00 178.44 174.34 2g3d h PRO 58 N 0.32 0.00 0.00 0.49 0.11 -2.03 -0.65 132.00 130.24 2g3d h PRO 58 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 2g3d h PRO 58 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 2g3d h PRO 58 CO -0.45 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.59 2g3d n THR 59 N -4.06 0.74 0.80 -1.15 -2.24 -0.37 -2.64 114.28 105.35 2g3d n THR 59 Ca 0.05 0.17 0.09 0.00 -2.27 0.00 0.00 64.05 62.09 2g3d n THR 59 Cb 0.43 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 2g3d n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2g3d n LEU 60 N -1.57 1.82 -0.22 3.22 4.77 -0.25 -4.65 117.00 120.12 2g3d n LEU 60 Ca 0.04 -0.78 -0.06 0.00 -0.03 0.00 0.00 56.01 55.18 2g3d n LEU 60 Cb 0.22 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.35 2g3d n LEU 60 CO 0.18 0.34 1.11 0.58 -1.33 0.00 0.00 177.39 178.26 2g3d h VAL 61 N 2.14 1.18 0.00 4.08 2.07 -1.50 0.16 116.25 124.37 2g3d h VAL 61 Ca 0.00 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 2g3d h VAL 61 Cb 0.63 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2g3d h VAL 61 CO 0.00 0.18 -0.17 0.71 0.02 0.00 0.00 177.57 178.31 2g3d h THR 62 N 0.83 0.70 0.09 2.57 1.35 -1.82 0.15 112.91 116.78 2g3d h THR 62 Ca 0.22 -0.70 -0.23 0.00 -0.55 0.00 0.00 66.41 65.15 2g3d h THR 62 Cb -0.04 1.44 -0.00 0.00 -1.73 0.00 0.00 68.15 67.81 2g3d h THR 62 CO -0.04 0.17 -1.17 0.74 -0.25 0.00 0.00 175.52 174.97 2g3d h THR 63 N 0.00 1.16 0.00 6.82 2.02 -1.65 -3.39 112.91 117.86 2g3d h THR 63 Ca -0.00 -2.38 -0.08 0.00 0.77 0.00 0.00 66.41 64.71 2g3d h THR 63 Cb 0.42 2.78 -0.01 0.00 -1.74 0.00 0.00 68.15 69.60 2g3d h THR 63 CO 0.02 0.64 -1.23 0.18 0.37 0.00 0.00 175.52 175.51 2g3d n LEU 64 N -4.09 0.84 -0.41 2.58 4.77 -0.03 -5.14 117.00 115.52 2g3d n LEU 64 Ca -0.23 0.35 0.14 0.00 -0.03 0.00 0.00 56.01 56.24 2g3d n LEU 64 Cb 0.82 0.01 0.59 0.00 -2.33 0.00 0.00 43.42 42.51 2g3d n LEU 64 CO 0.38 -0.02 0.91 0.61 -1.33 0.00 0.00 177.39 177.94