#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gpf s THR 2 N 0.00 3.67 0.10 3.17 -1.32 -1.26 -4.92 115.64 115.08 2gpf s THR 2 Ca 0.00 1.18 -0.31 0.00 -1.21 0.00 0.00 61.69 61.35 2gpf s THR 2 Cb 0.00 -3.56 -0.10 0.00 -1.51 0.00 0.00 72.50 67.33 2gpf s THR 2 CO 0.00 -0.09 1.86 -0.44 -2.21 0.00 0.00 174.62 173.74 2gpf s SER 3 N -1.70 6.43 0.07 8.08 0.01 -1.26 -4.88 113.70 120.45 2gpf s SER 3 Ca 0.62 2.73 -0.15 0.00 1.31 0.00 0.00 55.95 60.46 2gpf s SER 3 Cb -0.21 -2.56 -0.17 0.00 0.21 0.00 0.00 66.02 63.30 2gpf s SER 3 CO 0.25 -1.01 1.26 0.58 0.41 0.00 0.00 173.24 174.73 2gpf h VAL 4 N 4.92 1.32 -2.90 3.43 2.07 -2.08 -3.38 116.25 119.63 2gpf h VAL 4 Ca -0.47 -1.90 -0.61 0.00 0.82 0.00 0.00 66.70 64.54 2gpf h VAL 4 Cb 1.22 2.10 -0.40 0.00 -1.52 0.00 0.00 31.29 32.69 2gpf h VAL 4 CO 0.95 0.59 -0.74 0.12 0.02 0.00 0.00 177.57 178.51 2gpf s PHE 5 N -3.70 2.31 0.34 1.57 5.36 -1.26 -5.11 117.98 117.49 2gpf s PHE 5 Ca -0.12 -2.71 -0.27 0.00 -0.96 0.00 0.00 56.93 52.87 2gpf s PHE 5 Cb 0.07 -1.96 -0.09 0.00 -0.34 0.00 0.00 43.02 40.69 2gpf s PHE 5 CO 0.87 -0.72 1.14 0.34 -1.46 0.00 0.00 175.22 175.38 2gpf s ASP 6 N -0.27 6.90 0.00 6.13 2.15 -1.26 -3.82 116.67 126.51 2gpf s ASP 6 Ca 0.23 2.30 0.00 0.00 0.43 0.00 0.00 52.55 55.51 2gpf s ASP 6 Cb -0.13 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 39.88 2gpf s ASP 6 CO -0.09 -0.41 0.00 -1.14 -0.17 0.00 0.00 175.17 173.36 2gpf n ARG 7 N 0.60 0.00 0.00 4.34 0.63 -1.26 -4.90 116.66 116.07 2gpf n ARG 7 Ca 0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 2gpf n ARG 7 Cb 0.46 -0.03 0.00 0.00 0.45 0.00 0.00 32.46 33.33 2gpf n ARG 7 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2gpf n ASP 8 N 2.17 0.00 0.12 6.15 2.03 -1.25 -4.90 116.55 120.87 2gpf n ASP 8 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2gpf n ASP 8 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2gpf n ASP 8 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2gpf n ASP 9 N -2.08 -1.85 0.00 1.67 2.03 -1.26 -5.13 116.55 109.93 2gpf n ASP 9 Ca 0.00 0.45 0.00 0.00 0.52 0.00 0.00 54.79 55.76 2gpf n ASP 9 Cb 0.00 1.92 0.00 0.00 -0.72 0.00 0.00 41.12 42.32 2gpf n ASP 9 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2gpf n ILE 10 N -3.03 0.00 -4.08 5.18 3.06 -1.26 -5.12 119.36 114.11 2gpf n ILE 10 Ca 0.00 0.00 -0.34 0.00 -2.50 0.00 0.00 62.75 59.91 2gpf n ILE 10 Cb 0.00 0.00 -0.07 0.00 0.54 0.00 0.00 39.64 40.11 2gpf n ILE 10 CO 0.00 0.00 0.00 -1.10 -2.50 0.00 0.00 176.55 172.95 2gpf s GLN 11 N -0.16 3.14 0.43 9.51 -0.21 -1.26 -2.37 119.66 128.74 2gpf s GLN 11 Ca 0.00 -0.42 0.04 0.00 0.02 0.00 0.00 55.36 54.99 2gpf s GLN 11 Cb 0.00 -2.92 -0.02 0.00 1.00 0.00 0.00 33.01 31.08 2gpf s GLN 11 CO 0.00 0.67 0.14 -0.06 -2.12 0.00 0.00 175.29 173.92 2gpf s PHE 12 N -1.17 1.78 0.18 0.91 0.08 0.15 -0.17 117.98 119.74 2gpf s PHE 12 Ca 0.22 -1.33 -0.19 0.00 0.12 0.00 0.00 56.93 55.76 2gpf s PHE 12 Cb -0.12 -1.17 0.04 0.00 -0.57 0.00 0.00 43.02 41.20 2gpf s PHE 12 CO 0.13 -0.32 0.52 1.14 -0.10 0.00 0.00 175.22 176.59 2gpf s GLN 13 N -3.67 1.31 -0.18 0.44 -2.07 0.13 -1.07 119.66 114.55 2gpf s GLN 13 Ca 0.20 -0.75 -0.12 0.00 -1.82 0.00 0.00 55.36 52.87 2gpf s GLN 13 Cb 0.01 0.53 -0.05 0.00 -1.09 0.00 0.00 33.01 32.41 2gpf s GLN 13 CO 0.14 -0.55 0.22 0.08 -1.32 0.00 0.00 175.29 173.85 2gpf s VAL 14 N -3.83 5.35 0.10 3.63 1.01 -1.23 -0.74 120.40 124.68 2gpf s VAL 14 Ca 0.06 0.38 0.10 0.00 0.00 0.00 0.00 61.98 62.52 2gpf s VAL 14 Cb -0.01 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 2gpf s VAL 14 CO -0.07 0.41 -0.26 0.68 0.00 0.00 0.00 175.10 175.87 2gpf s VAL 15 N 0.43 2.13 -0.01 2.92 -7.23 0.01 -0.46 120.40 118.19 2gpf s VAL 15 Ca 0.13 -1.61 0.04 0.00 -1.81 0.00 0.00 61.98 58.73 2gpf s VAL 15 Cb -0.12 -1.87 -0.01 0.00 0.56 0.00 0.00 36.38 34.94 2gpf s VAL 15 CO 0.01 0.15 -0.14 0.54 -0.31 0.00 0.00 175.10 175.35 2gpf s VAL 16 N -0.99 1.12 -0.50 1.32 0.11 0.10 -0.57 120.40 120.99 2gpf s VAL 16 Ca 0.12 -0.64 0.03 0.00 -2.93 0.00 0.00 61.98 58.57 2gpf s VAL 16 Cb -0.10 -0.94 0.15 0.00 -1.53 0.00 0.00 36.38 33.96 2gpf s VAL 16 CO 0.05 0.29 0.31 0.21 -3.33 0.00 0.00 175.10 172.63 2gpf s ASN 17 N -0.40 3.63 0.00 3.54 2.47 -0.80 -0.23 114.94 123.16 2gpf s ASN 17 Ca 0.05 -3.01 0.00 0.00 0.42 0.00 0.00 52.86 50.32 2gpf s ASN 17 Cb -0.06 -1.13 0.00 0.00 -1.45 0.00 0.00 41.25 38.61 2gpf s ASN 17 CO -0.00 -0.21 0.00 1.57 -3.72 0.00 0.00 177.10 174.74 2gpf n HIS 18 N 3.03 0.00 0.74 0.43 -0.00 -1.26 -3.98 115.22 114.19 2gpf n HIS 18 Ca 0.14 0.00 0.10 0.00 -0.00 0.00 0.00 57.72 57.96 2gpf n HIS 18 Cb 0.36 0.00 0.27 0.00 -0.00 0.00 0.00 29.99 30.63 2gpf n HIS 18 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2gpf n GLU 19 N 0.00 2.04 -1.40 1.57 4.71 -1.26 -4.85 120.64 121.45 2gpf n GLU 19 Ca 0.00 -1.59 -0.07 0.00 -0.01 0.00 0.00 57.16 55.49 2gpf n GLU 19 Cb 0.00 -1.41 -0.02 0.00 -1.01 0.00 0.00 31.44 29.00 2gpf n GLU 19 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 2gpf n GLU 20 N 0.80 -0.47 -2.20 3.49 2.13 -1.26 -4.96 120.64 118.17 2gpf n GLU 20 Ca 0.17 0.64 -0.40 0.00 0.66 0.00 0.00 57.16 58.22 2gpf n GLU 20 Cb 0.42 -4.44 -0.03 0.00 0.27 0.00 0.00 31.44 27.66 2gpf n GLU 20 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2gpf s GLN 21 N -2.95 3.01 -0.14 5.31 -0.21 -1.26 -4.89 119.66 118.54 2gpf s GLN 21 Ca 0.00 0.60 -0.11 0.00 0.02 0.00 0.00 55.36 55.87 2gpf s GLN 21 Cb 0.00 -4.25 -0.05 0.00 1.00 0.00 0.00 33.01 29.71 2gpf s GLN 21 CO 0.00 -2.29 0.21 1.52 -2.12 0.00 0.00 175.29 172.62 2gpf s TYR 22 N 7.45 3.53 0.34 0.91 1.13 -1.26 -1.91 117.35 127.54 2gpf s TYR 22 Ca 0.61 0.56 0.03 0.00 -1.41 0.00 0.00 57.07 56.86 2gpf s TYR 22 Cb -0.13 -2.15 -0.01 0.00 -1.10 0.00 0.00 41.96 38.57 2gpf s TYR 22 CO 0.23 0.48 0.38 0.45 -2.51 0.00 0.00 175.55 174.58 2gpf s SER 23 N -0.27 1.36 -0.12 -0.18 0.15 0.27 -4.96 113.70 109.94 2gpf s SER 23 Ca 0.15 -1.65 -0.02 0.00 0.70 0.00 0.00 55.95 55.13 2gpf s SER 23 Cb -0.13 0.62 -0.03 0.00 -1.71 0.00 0.00 66.02 64.77 2gpf s SER 23 CO 0.04 -1.19 -0.05 0.27 1.20 0.00 0.00 173.24 173.50 2gpf s ILE 24 N -3.19 3.84 -0.02 6.45 -4.36 -1.26 -0.81 121.20 121.85 2gpf s ILE 24 Ca 0.36 -0.40 0.04 0.00 -0.26 0.00 0.00 60.65 60.39 2gpf s ILE 24 Cb 0.01 -2.64 -0.01 0.00 1.25 0.00 0.00 42.46 41.08 2gpf s ILE 24 CO 0.25 0.54 -0.13 0.86 0.24 0.00 0.00 174.94 176.70 2gpf s TRP 25 N -0.13 1.19 0.22 1.37 -0.11 0.08 -4.93 118.94 116.62 2gpf s TRP 25 Ca 0.02 -0.26 -0.32 0.00 1.22 0.00 0.00 56.10 56.77 2gpf s TRP 25 Cb -0.13 -0.79 -0.14 0.00 -1.50 0.00 0.00 33.47 30.91 2gpf s TRP 25 CO 0.03 -0.05 1.40 -2.30 -4.62 0.00 0.00 176.95 171.40 2gpf n PRO 26 N 2.92 1.91 0.15 5.86 -0.02 -1.26 -0.69 135.00 143.87 2gpf n PRO 26 Ca -0.15 0.68 0.03 0.00 -2.02 0.00 0.00 63.50 62.04 2gpf n PRO 26 Cb 0.55 -2.33 0.42 0.00 -0.02 0.00 0.00 33.50 32.12 2gpf n PRO 26 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2gpf h GLU 27 N 4.32 0.17 0.00 -0.52 4.22 -0.80 -2.10 114.58 119.88 2gpf h GLU 27 Ca -0.45 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 58.95 2gpf h GLU 27 Cb 1.28 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2gpf h GLU 27 CO 0.77 0.32 -0.17 1.88 -2.18 0.00 0.00 179.01 179.63 2gpf h TYR 28 N 0.16 0.00 -3.15 0.92 0.05 -1.90 -3.47 116.97 109.59 2gpf h TYR 28 Ca 0.03 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.30 2gpf h TYR 28 Cb 0.37 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.10 2gpf h TYR 28 CO 0.00 0.00 -0.16 0.15 -1.05 0.00 0.00 178.16 177.11 2gpf s LYS 29 N -3.21 3.61 -0.08 4.88 1.02 -0.79 -5.04 119.74 120.13 2gpf s LYS 29 Ca 0.06 -0.05 -0.30 0.00 0.02 0.00 0.00 55.97 55.71 2gpf s LYS 29 Cb 0.07 -2.66 -0.03 0.00 -0.52 0.00 0.00 37.83 34.69 2gpf s LYS 29 CO 0.68 0.22 1.20 -2.00 -0.92 0.00 0.00 175.35 174.53 2gpf s GLU 30 N -3.61 4.33 0.28 1.68 2.12 -1.26 -4.88 118.70 117.36 2gpf s GLU 30 Ca 0.43 1.66 -0.29 0.00 0.36 0.00 0.00 54.97 57.13 2gpf s GLU 30 Cb -0.11 -3.59 -0.10 0.00 0.26 0.00 0.00 34.13 30.59 2gpf s GLU 30 CO 0.31 -0.49 1.34 0.42 -0.54 0.00 0.00 175.26 176.30 2gpf s ILE 31 N 2.43 2.80 0.44 -3.70 1.01 -1.26 -4.98 121.20 117.95 2gpf s ILE 31 Ca 0.55 0.74 -0.24 0.00 0.00 0.00 0.00 60.65 61.70 2gpf s ILE 31 Cb -0.24 -3.47 -0.09 0.00 0.01 0.00 0.00 42.46 38.67 2gpf s ILE 31 CO 0.20 0.15 1.18 -2.65 0.00 0.00 0.00 174.94 173.82 2gpf n PRO 32 N 1.59 1.68 0.26 2.79 -0.02 -1.26 -4.87 135.00 135.16 2gpf n PRO 32 Ca 0.03 0.60 0.18 0.00 -2.02 0.00 0.00 63.50 62.29 2gpf n PRO 32 Cb 0.42 -2.28 0.90 0.00 -0.02 0.00 0.00 33.50 32.52 2gpf n PRO 32 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 2gpf h GLN 33 N 1.79 0.00 0.00 -0.52 3.07 -2.05 -0.05 115.11 117.35 2gpf h GLN 33 Ca -0.47 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.25 2gpf h GLN 33 Cb 1.31 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.87 2gpf h GLN 33 CO 0.58 0.00 -0.62 0.78 0.09 0.00 0.00 178.83 179.66 2gpf h GLY 34 N 0.00 0.00 -5.10 0.06 0.00 -1.98 -3.46 103.07 92.59 2gpf h GLY 34 Ca 0.05 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.75 2gpf h GLY 34 CO -0.00 0.00 -0.51 -0.98 0.00 0.00 0.00 176.54 175.05 2gpf s TRP 35 N -3.23 3.50 -0.03 5.60 0.52 -0.03 -4.68 118.94 120.58 2gpf s TRP 35 Ca 0.02 0.31 0.06 0.00 0.02 0.00 0.00 56.10 56.52 2gpf s TRP 35 Cb 0.08 -1.80 -0.02 0.00 -1.15 0.00 0.00 33.47 30.58 2gpf s TRP 35 CO 0.74 0.62 -0.22 0.50 0.02 0.00 0.00 176.95 178.62 2gpf s ARG 36 N -2.04 2.29 0.12 4.98 6.06 0.68 -4.70 118.95 126.34 2gpf s ARG 36 Ca 0.28 -0.85 -0.30 0.00 -2.50 0.00 0.00 55.73 52.37 2gpf s ARG 36 Cb -0.13 -2.17 -0.06 0.00 0.06 0.00 0.00 34.95 32.65 2gpf s ARG 36 CO 0.20 0.56 1.14 0.00 -2.50 0.00 0.00 175.30 174.70 2gpf s ALA 37 N -0.60 3.37 0.09 6.12 0.00 -1.26 0.02 121.76 129.49 2gpf s ALA 37 Ca 0.09 0.82 -0.10 0.00 0.00 0.00 0.00 51.96 52.77 2gpf s ALA 37 Cb -0.11 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.62 2gpf s ALA 37 CO -0.00 -0.31 0.22 0.00 0.00 0.00 0.00 175.76 175.66 2gpf s ALA 38 N 0.39 -0.32 0.00 0.00 0.00 0.39 -4.90 121.76 117.32 2gpf s ALA 38 Ca 0.54 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.98 2gpf s ALA 38 Cb -0.29 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.31 2gpf s ALA 38 CO 0.32 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2gpf n GLY 39 N 0.01 0.65 3.26 0.00 0.00 -1.26 -3.53 105.19 104.31 2gpf n GLY 39 Ca -0.16 -0.68 -0.18 0.00 0.00 0.00 0.00 46.02 45.01 2gpf n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gpf s LYS 40 N 0.00 1.07 0.20 1.61 -0.14 -1.26 -4.98 119.74 116.24 2gpf s LYS 40 Ca 0.00 -1.31 0.09 0.00 -1.36 0.00 0.00 55.97 53.39 2gpf s LYS 40 Cb 0.00 -0.91 -0.04 0.00 -1.68 0.00 0.00 37.83 35.19 2gpf s LYS 40 CO 0.00 0.17 -0.07 -1.54 -0.76 0.00 0.00 175.35 173.14 2gpf s SER 41 N -2.64 4.33 0.00 2.83 1.04 -1.26 -3.61 113.70 114.39 2gpf s SER 41 Ca 0.12 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.96 2gpf s SER 41 Cb -0.04 -0.76 0.00 0.00 0.10 0.00 0.00 66.02 65.33 2gpf s SER 41 CO 0.03 0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.94 2gpf n GLY 42 N -0.16 -0.54 3.48 7.32 0.00 -0.23 -5.00 105.19 110.06 2gpf n GLY 42 Ca -0.10 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 2gpf n GLY 42 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gpf s LEU 43 N 0.00 0.52 0.04 0.99 2.01 -1.26 0.33 118.68 121.30 2gpf s LEU 43 Ca 0.00 1.30 -0.25 0.00 0.01 0.00 0.00 54.13 55.19 2gpf s LEU 43 Cb 0.00 -3.14 -0.17 0.00 0.01 0.00 0.00 46.19 42.89 2gpf s LEU 43 CO 0.00 -4.31 1.51 0.50 1.01 0.00 0.00 176.35 175.05 2gpf h LYS 44 N -2.70 -0.06 0.00 1.70 3.64 -1.81 -2.74 116.57 114.59 2gpf h LYS 44 Ca -0.58 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.78 2gpf h LYS 44 Cb 1.34 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.17 2gpf h LYS 44 CO 0.48 0.16 -0.10 1.57 -2.27 0.00 0.00 179.45 179.29 2gpf h LYS 45 N -0.29 0.00 -0.65 1.90 -0.00 -1.92 -0.57 116.57 115.05 2gpf h LYS 45 Ca -0.01 0.00 -0.03 0.00 -0.00 0.00 0.00 60.65 60.61 2gpf h LYS 45 Cb 0.26 0.00 -0.03 0.00 -0.00 0.00 0.00 32.23 32.46 2gpf h LYS 45 CO 0.01 0.10 0.28 -0.44 -0.00 0.00 0.00 179.45 179.40 2gpf h ASP 46 N 0.00 0.88 -0.01 7.07 3.32 -1.85 0.11 116.42 125.94 2gpf h ASP 46 Ca -0.00 -0.16 -0.26 0.00 0.02 0.00 0.00 57.03 56.64 2gpf h ASP 46 Cb 0.18 -0.23 0.02 0.00 0.22 0.00 0.00 39.33 39.52 2gpf h ASP 46 CO 0.01 0.80 -0.98 0.00 -1.72 0.00 0.00 179.24 177.35 2gpf h LEU 48 N 0.42 0.05 -0.52 0.00 3.38 -0.97 -1.93 115.31 115.74 2gpf h LEU 48 Ca -0.11 -0.03 0.09 0.00 0.09 0.00 0.00 57.88 57.93 2gpf h LEU 48 Cb 1.63 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 42.29 2gpf h LEU 48 CO 0.19 0.06 0.10 0.00 0.09 0.00 0.00 178.44 178.88 2gpf h ALA 49 N 0.99 0.59 -0.88 1.53 0.00 -0.82 -1.52 119.26 119.15 2gpf h ALA 49 Ca 0.01 0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.14 2gpf h ALA 49 Cb 0.02 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 17.89 2gpf h ALA 49 CO -0.00 -0.31 0.52 -0.92 0.00 0.00 0.00 179.25 178.53 2gpf h TYR 50 N 0.24 0.93 -0.17 0.00 5.03 -0.96 -2.57 116.97 119.47 2gpf h TYR 50 Ca 0.26 0.03 -0.14 0.00 2.58 0.00 0.00 58.73 61.46 2gpf h TYR 50 Cb 0.37 -0.29 -0.01 0.00 1.55 0.00 0.00 36.73 38.35 2gpf h TYR 50 CO -0.24 0.37 -0.51 0.82 -1.32 0.00 0.00 178.16 177.29 2gpf h ILE 51 N 0.84 1.33 -0.85 1.81 1.08 -0.52 -2.82 117.51 118.38 2gpf h ILE 51 Ca 0.43 -1.74 -0.03 0.00 -0.39 0.00 0.00 64.86 63.12 2gpf h ILE 51 Cb 0.41 1.75 -0.04 0.00 -3.07 0.00 0.00 36.82 35.88 2gpf h ILE 51 CO -0.26 0.54 0.41 -0.08 -0.69 0.00 0.00 178.15 178.07 2gpf h GLU 52 N 0.36 1.23 -0.32 2.37 4.57 -1.05 -3.32 114.58 118.41 2gpf h GLU 52 Ca 0.01 -0.18 0.04 0.00 -1.18 0.00 0.00 59.36 58.05 2gpf h GLU 52 Cb 1.01 -0.22 -0.07 0.00 -0.16 0.00 0.00 28.75 29.32 2gpf h GLU 52 CO 0.09 0.94 -0.45 0.93 -1.18 0.00 0.00 179.01 179.34 2gpf h GLU 53 N 1.21 -0.32 0.02 1.92 4.39 -1.26 -3.47 114.58 117.08 2gpf h GLU 53 Ca 0.29 0.02 -0.29 0.00 0.34 0.00 0.00 59.36 59.73 2gpf h GLU 53 Cb 0.12 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.80 2gpf h GLU 53 CO -0.04 -0.21 -1.61 -0.24 -1.16 0.00 0.00 179.01 175.75 2gpf h VAL 54 N -0.33 0.99 0.00 3.13 3.04 -1.71 -3.18 116.25 118.18 2gpf h VAL 54 Ca 0.06 -2.79 -0.12 0.00 -1.01 0.00 0.00 66.70 62.83 2gpf h VAL 54 Cb 0.49 2.52 -0.23 0.00 -2.01 0.00 0.00 31.29 32.06 2gpf h VAL 54 CO -0.48 0.63 -0.69 1.87 -1.01 0.00 0.00 177.57 177.89 2gpf n TRP 55 N -3.17 0.00 -2.76 3.17 -0.00 -1.26 -4.53 117.44 108.89 2gpf n TRP 55 Ca -0.15 -0.36 -0.00 0.00 -0.00 0.00 0.00 57.50 56.98 2gpf n TRP 55 Cb 1.03 0.04 0.01 0.00 -0.00 0.00 0.00 31.31 32.40 2gpf n TRP 55 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 177.69 177.61 2gpf s THR 56 N 0.00 -0.28 -0.75 5.87 -1.32 -1.25 -5.09 115.64 112.82 2gpf s THR 56 Ca 0.18 -0.11 -0.26 0.00 -1.21 0.00 0.00 61.69 60.29 2gpf s THR 56 Cb 0.20 0.00 0.02 0.00 -1.51 0.00 0.00 72.50 71.21 2gpf s THR 56 CO -0.09 0.00 1.42 -0.62 -2.21 0.00 0.00 174.62 173.13 2gpf s ASP 57 N 1.58 6.01 0.00 8.08 2.15 -1.20 -4.63 116.67 128.66 2gpf s ASP 57 Ca 0.18 -0.43 0.00 0.00 0.43 0.00 0.00 52.55 52.74 2gpf s ASP 57 Cb 0.06 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.12 2gpf s ASP 57 CO -0.13 -1.93 0.00 0.80 -0.17 0.00 0.00 175.17 173.75 2gpf n MET 58 N 9.27 3.27 -4.27 4.34 1.56 -1.26 -5.02 117.12 125.01 2gpf n MET 58 Ca 0.11 0.00 -0.27 0.00 -0.27 0.00 0.00 57.70 57.26 2gpf n MET 58 Cb 0.50 -0.45 -0.17 0.00 2.15 0.00 0.00 33.22 35.25 2gpf n MET 58 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 2gpf s ARG 59 N -0.69 1.88 -0.78 2.12 0.52 -1.26 -5.04 118.95 115.70 2gpf s ARG 59 Ca 0.00 -0.43 -0.20 0.00 -0.52 0.00 0.00 55.73 54.58 2gpf s ARG 59 Cb 0.00 -1.70 -0.15 0.00 0.52 0.00 0.00 34.95 33.63 2gpf s ARG 59 CO 0.00 -0.12 1.94 -0.35 0.02 0.00 0.00 175.30 176.78 2gpf n PRO 60 N 4.40 1.55 0.25 3.54 -0.04 -1.26 -4.68 135.00 138.76 2gpf n PRO 60 Ca -0.18 -1.79 0.17 0.00 -0.04 0.00 0.00 63.50 61.67 2gpf n PRO 60 Cb 0.51 -2.86 0.91 0.00 -0.04 0.00 0.00 33.50 32.02 2gpf n PRO 60 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 2gpf h LEU 61 N 13.19 0.00 -1.05 1.53 8.10 -1.96 -1.93 115.31 133.19 2gpf h LEU 61 Ca 0.43 0.00 0.07 0.00 0.11 0.00 0.00 57.88 58.48 2gpf h LEU 61 Cb 0.61 0.00 -0.07 0.00 -0.44 0.00 0.00 40.66 40.76 2gpf h LEU 61 CO 1.90 0.00 0.63 0.77 -4.11 0.00 0.00 178.44 177.64 2gpf h SER 62 N 0.00 1.00 -0.22 0.17 4.64 -1.93 -2.16 113.55 115.05 2gpf h SER 62 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2gpf h SER 62 Cb 0.02 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 2gpf h SER 62 CO 0.00 0.64 0.00 0.00 -0.87 0.00 0.00 176.83 176.60 2gpf n LEU 63 N -4.50 2.63 -0.60 5.97 -0.00 -0.75 -4.45 117.00 115.30 2gpf n LEU 63 Ca 0.15 -1.51 0.13 0.00 -0.00 0.00 0.00 56.01 54.78 2gpf n LEU 63 Cb 0.19 -0.14 0.42 0.00 -0.00 0.00 0.00 43.42 43.89 2gpf n LEU 63 CO 0.32 0.59 0.81 0.54 -0.00 0.00 0.00 177.39 179.65 2gpf n ARG 64 N 0.74 1.83 -3.76 1.47 5.12 -0.82 -4.84 116.66 116.40 2gpf n ARG 64 Ca 0.11 -1.20 -0.13 0.00 -1.93 0.00 0.00 57.85 54.69 2gpf n ARG 64 Cb 0.40 -1.47 -0.09 0.00 -1.16 0.00 0.00 32.46 30.14 2gpf n ARG 64 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 2gpf s GLN 65 N -1.98 0.61 -0.20 5.56 -2.07 -1.21 0.05 119.66 120.43 2gpf s GLN 65 Ca 0.36 -0.04 -0.17 0.00 -1.82 0.00 0.00 55.36 53.68 2gpf s GLN 65 Cb 0.21 0.28 -0.13 0.00 -1.09 0.00 0.00 33.01 32.27 2gpf s GLN 65 CO 0.32 -0.16 0.01 1.58 -1.32 0.00 0.00 175.29 175.73 2gpf n HIS 66 N 1.62 0.83 -0.06 9.60 -0.00 -0.30 -4.81 115.22 122.10 2gpf n HIS 66 Ca -0.20 0.36 -0.11 0.00 -0.00 0.00 0.00 57.72 57.77 2gpf n HIS 66 Cb 0.56 -0.97 -0.04 0.00 -0.00 0.00 0.00 29.99 29.54 2gpf n HIS 66 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2gpf n MET 67 N -4.46 0.35 0.00 1.57 -0.00 0.23 -5.04 117.12 109.76 2gpf n MET 67 Ca -0.27 0.14 0.00 0.00 -0.00 0.00 0.00 57.70 57.57 2gpf n MET 67 Cb 0.59 -1.10 0.00 0.00 -0.00 0.00 0.00 33.22 32.71 2gpf n MET 67 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2gpf n ASP 68 N -3.96 0.00 0.00 3.17 2.03 -0.30 -5.11 116.55 112.38 2gpf n ASP 68 Ca -0.20 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.11 2gpf n ASP 68 Cb 0.51 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 2gpf n ASP 68 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2gpf n LYS 69 N 0.00 0.00 -3.40 -0.67 4.81 -1.25 -5.01 118.16 112.65 2gpf n LYS 69 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 2gpf n LYS 69 Cb 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.02 2gpf n LYS 69 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2gpf s ALA 70 N -1.00 -2.44 0.00 3.14 0.00 -1.25 -4.77 121.76 115.44 2gpf s ALA 70 Ca 0.00 2.03 0.00 0.00 0.00 0.00 0.00 51.96 53.99 2gpf s ALA 70 Cb 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 21.08 2gpf s ALA 70 CO 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 175.76 174.66 2gpf n ALA 71 N 5.32 0.00 0.46 0.00 0.00 0.11 -4.92 120.51 121.48 2gpf n ALA 71 Ca -0.08 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.42 2gpf n ALA 71 Cb 0.51 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.01 2gpf n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91