#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gps s ILE 2 N 0.00 4.07 -0.53 -0.18 -1.09 -1.26 -0.52 121.20 121.70 1gps s ILE 2 Ca 0.00 -0.36 -0.22 0.00 -2.23 0.00 0.00 60.65 57.84 1gps s ILE 2 Cb 0.00 -2.95 0.05 0.00 -1.58 0.00 0.00 42.46 37.98 1gps s ILE 2 CO 0.00 0.29 0.80 0.00 -1.23 0.00 0.00 174.94 174.79 1gps s ARG 4 N 3.35 0.86 0.02 0.00 3.52 -1.26 -1.10 118.95 124.33 1gps s ARG 4 Ca 0.23 -1.07 -0.00 0.00 -0.13 0.00 0.00 55.73 54.76 1gps s ARG 4 Cb -0.15 -2.17 -0.02 0.00 -1.56 0.00 0.00 34.95 31.05 1gps s ARG 4 CO 0.16 -0.91 -0.02 1.03 -0.81 0.00 0.00 175.30 174.75 1gps s ARG 5 N 1.56 0.27 0.54 5.12 0.52 0.12 -4.91 118.95 122.17 1gps s ARG 5 Ca 0.07 -0.52 -0.18 0.00 -0.52 0.00 0.00 55.73 54.58 1gps s ARG 5 Cb -0.18 0.10 -0.11 0.00 0.52 0.00 0.00 34.95 35.28 1gps s ARG 5 CO -0.20 -0.04 0.25 2.89 0.02 0.00 0.00 175.30 178.22 1gps n ARG 6 N 1.80 0.30 -2.63 3.54 1.85 -1.26 -0.13 116.66 120.12 1gps n ARG 6 Ca -0.22 0.12 -0.43 0.00 -1.00 0.00 0.00 57.85 56.32 1gps n ARG 6 Cb 0.56 -1.41 -0.03 0.00 -1.05 0.00 0.00 32.46 30.53 1gps n ARG 6 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1gps s SER 7 N -1.10 6.49 0.00 2.89 0.15 -0.59 -4.81 113.70 116.72 1gps s SER 7 Ca 0.64 0.17 0.00 0.00 0.70 0.00 0.00 55.95 57.45 1gps s SER 7 Cb -0.47 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.31 1gps s SER 7 CO 0.59 -1.37 0.81 0.00 1.20 0.00 0.00 173.24 174.47 1gps n ALA 8 N 8.11 2.50 0.06 5.45 0.00 -1.26 -3.24 120.51 132.12 1gps n ALA 8 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1gps n ALA 8 Cb 0.49 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1gps n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gps n GLY 9 N 1.71 -1.00 3.55 0.00 0.00 -1.26 -5.08 105.19 103.11 1gps n GLY 9 Ca 0.00 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1gps n GLY 9 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gps s PHE 10 N -2.00 3.16 -0.52 1.61 2.19 -1.20 -5.03 117.98 116.19 1gps s PHE 10 Ca 0.00 0.14 -0.11 0.00 0.33 0.00 0.00 56.93 57.28 1gps s PHE 10 Cb 0.00 -2.98 0.13 0.00 -1.31 0.00 0.00 43.02 38.85 1gps s PHE 10 CO 0.00 -0.59 0.42 0.15 1.83 0.00 0.00 175.22 177.03 1gps s LYS 11 N 2.45 2.70 0.00 10.12 3.01 -1.26 -4.25 119.74 132.51 1gps s LYS 11 Ca 0.19 -1.80 0.00 0.00 -1.01 0.00 0.00 55.97 53.35 1gps s LYS 11 Cb -0.15 -4.07 0.00 0.00 -1.01 0.00 0.00 37.83 32.60 1gps s LYS 11 CO 0.14 -1.24 0.00 0.41 0.51 0.00 0.00 175.35 175.17 1gps n GLY 12 N 4.94 0.86 3.54 -3.33 0.00 -1.26 -4.96 105.19 104.98 1gps n GLY 12 Ca -0.08 -1.42 -0.37 0.00 0.00 0.00 0.00 46.02 44.14 1gps n GLY 12 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1gps n PRO 13 N 0.00 0.92 -0.72 1.61 -0.02 -1.11 -2.23 135.00 133.44 1gps n PRO 13 Ca 0.00 0.02 -0.13 0.00 -2.02 0.00 0.00 63.50 61.37 1gps n PRO 13 Cb 0.00 -3.13 -0.09 0.00 -0.02 0.00 0.00 33.50 30.26 1gps n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gps h MET 15 N 4.55 0.59 -1.52 0.00 4.05 -1.91 -3.03 114.93 117.65 1gps h MET 15 Ca 0.25 -0.09 -0.48 0.00 -0.28 0.00 0.00 59.70 59.10 1gps h MET 15 Cb 0.79 -0.10 -0.19 0.00 -0.80 0.00 0.00 31.60 31.29 1gps h MET 15 CO 0.65 0.53 0.58 -1.13 0.23 0.00 0.00 176.91 177.77 1gps n SER 16 N -4.67 6.87 0.00 1.39 3.41 -1.26 -4.92 113.62 114.43 1gps n SER 16 Ca 0.00 -3.33 0.00 0.00 -0.26 0.00 0.00 58.87 55.28 1gps n SER 16 Cb 0.12 -1.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.00 1gps n SER 16 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1gps n ASN 17 N 0.07 0.00 -0.28 4.04 3.02 -1.15 -0.04 115.26 120.92 1gps n ASN 17 Ca 0.44 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 55.08 1gps n ASN 17 Cb 0.57 0.00 0.25 0.00 -0.61 0.00 0.00 39.78 39.98 1gps n ASN 17 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1gps h LYS 18 N 0.00 0.35 -0.38 3.52 3.64 -1.91 -1.28 116.57 120.51 1gps h LYS 18 Ca 0.00 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 1gps h LYS 18 Cb 0.00 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1gps h LYS 18 CO 0.00 0.23 -0.15 -0.91 -2.27 0.00 0.00 179.45 176.36 1gps h ASN 19 N 0.36 0.70 -0.18 4.20 4.21 -0.85 0.24 115.58 124.26 1gps h ASN 19 Ca 0.49 -0.21 0.00 0.00 1.21 0.00 0.00 56.30 57.79 1gps h ASN 19 Cb 0.88 -0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 37.88 1gps h ASN 19 CO -0.51 0.86 0.12 0.00 -1.29 0.00 0.00 177.43 176.61 1gps h ALA 21 N 1.06 0.51 -0.24 0.00 0.00 -0.18 -2.50 119.26 117.90 1gps h ALA 21 Ca 0.07 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.90 1gps h ALA 21 Cb -0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1gps h ALA 21 CO -0.01 0.08 -0.01 0.37 0.00 0.00 0.00 179.25 179.67 1gps h GLN 22 N 0.49 0.06 0.19 0.00 4.15 -0.30 0.98 115.11 120.69 1gps h GLN 22 Ca 0.13 -0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.56 1gps h GLN 22 Cb 0.13 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 1gps h GLN 22 CO -0.02 0.04 -0.21 0.28 -1.93 0.00 0.00 178.83 177.00 1gps h VAL 23 N 0.06 0.55 -0.74 2.39 2.07 -0.94 -1.09 116.25 118.55 1gps h VAL 23 Ca 0.12 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.72 1gps h VAL 23 Cb 0.15 0.55 -0.07 0.00 -1.52 0.00 0.00 31.29 30.41 1gps h VAL 23 CO -0.21 0.00 0.41 0.00 0.02 0.00 0.00 177.57 177.79 1gps h GLN 25 N 0.71 0.48 -0.25 0.00 4.20 -0.65 0.63 115.11 120.23 1gps h GLN 25 Ca 0.35 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.99 1gps h GLN 25 Cb 0.29 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1gps h GLN 25 CO -0.22 0.37 0.04 0.37 -0.67 0.00 0.00 178.83 178.71 1gps h GLN 26 N 0.45 0.35 0.02 1.46 4.15 -0.57 -2.97 115.11 118.00 1gps h GLN 26 Ca 0.13 -0.05 -0.21 0.00 0.77 0.00 0.00 58.65 59.29 1gps h GLN 26 Cb 0.02 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1gps h GLN 26 CO -0.02 0.35 -0.94 1.49 -1.93 0.00 0.00 178.83 177.78 1gps h GLU 27 N 0.35 0.15 0.00 1.69 4.81 -0.15 -3.48 114.58 117.95 1gps h GLU 27 Ca 0.08 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1gps h GLU 27 Cb 0.17 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1gps h GLU 27 CO -0.00 0.98 0.00 0.41 -0.73 0.00 0.00 179.01 179.67 1gps n GLY 28 N 1.04 1.08 3.53 1.92 0.00 -0.42 -5.07 105.19 107.27 1gps n GLY 28 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 1gps n GLY 28 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1gps s TRP 29 N -1.94 2.38 -0.47 1.61 0.52 0.08 -5.00 118.94 116.12 1gps s TRP 29 Ca 0.00 -0.46 0.04 0.00 0.02 0.00 0.00 56.10 55.70 1gps s TRP 29 Cb 0.00 -1.29 0.61 0.00 -1.15 0.00 0.00 33.47 31.64 1gps s TRP 29 CO 0.00 0.62 1.87 0.41 0.02 0.00 0.00 176.95 179.87 1gps n GLY 30 N -0.75 4.84 0.00 0.98 0.00 0.11 -3.74 105.19 106.62 1gps n GLY 30 Ca -0.05 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.61 1gps n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gps n GLY 31 N -1.10 0.85 0.00 -0.02 0.00 -1.21 -4.83 105.19 98.88 1gps n GLY 31 Ca 0.57 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1gps n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gps n GLY 32 N -1.09 4.44 0.00 -0.02 0.00 -1.26 -2.13 105.19 105.13 1gps n GLY 32 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1gps n GLY 32 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gps n ASN 33 N 0.00 1.21 -4.25 1.61 0.23 -1.13 -1.52 115.26 111.41 1gps n ASN 33 Ca 0.00 0.00 -0.43 0.00 -0.53 0.00 0.00 54.58 53.62 1gps n ASN 33 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1gps n ASN 33 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1gps s ASP 35 N 3.47 4.90 0.77 0.00 1.01 -1.25 -4.75 116.67 120.82 1gps s ASP 35 Ca 0.49 -0.15 0.00 0.00 0.71 0.00 0.00 52.55 53.61 1gps s ASP 35 Cb 0.07 -1.82 0.00 0.00 1.01 0.00 0.00 42.92 42.17 1gps s ASP 35 CO 0.01 0.11 0.00 0.61 0.21 0.00 0.00 175.17 176.12 1gps n GLY 36 N 3.92 1.67 3.66 0.21 0.00 -1.26 -4.55 105.19 108.84 1gps n GLY 36 Ca -0.17 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 1gps n GLY 36 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1gps s PRO 37 N 0.00 4.19 0.54 1.61 0.02 -1.26 -4.91 135.00 135.19 1gps s PRO 37 Ca 0.00 2.19 0.25 0.00 0.02 0.00 0.00 61.00 63.46 1gps s PRO 37 Cb 0.00 -3.94 1.42 0.00 0.02 0.00 0.00 34.50 32.01 1gps s PRO 37 CO 0.00 -0.83 2.03 0.35 -0.33 0.00 0.00 177.00 178.22 1gps h PHE 38 N 9.37 0.00 -0.91 6.54 3.57 -1.85 -2.61 116.94 131.05 1gps h PHE 38 Ca -0.39 0.00 -0.54 0.00 3.53 0.00 0.00 57.97 60.56 1gps h PHE 38 Cb 1.18 0.00 -0.29 0.00 2.79 0.00 0.00 35.95 39.63 1gps h PHE 38 CO 0.87 0.00 0.56 0.54 -2.23 0.00 0.00 178.31 178.05 1gps n ARG 39 N -4.27 2.46 -3.68 1.11 5.12 -1.26 -4.50 116.66 111.64 1gps n ARG 39 Ca 0.07 -3.22 -0.15 0.00 -1.93 0.00 0.00 57.85 52.62 1gps n ARG 39 Cb 0.50 -2.18 -0.15 0.00 -1.16 0.00 0.00 32.46 29.47 1gps n ARG 39 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1gps s ARG 40 N -3.52 0.08 -0.49 5.56 6.06 -0.99 -2.73 118.95 122.92 1gps s ARG 40 Ca 0.58 0.60 -0.26 0.00 -2.50 0.00 0.00 55.73 54.15 1gps s ARG 40 Cb 0.48 -0.19 -0.06 0.00 0.06 0.00 0.00 34.95 35.24 1gps s ARG 40 CO 0.05 -0.28 2.28 0.00 -2.50 0.00 0.00 175.30 174.84 1gps s LYS 42 N 7.83 3.01 0.11 0.00 2.20 -0.83 -1.55 119.74 130.52 1gps s LYS 42 Ca 0.92 -0.84 0.08 0.00 -0.36 0.00 0.00 55.97 55.77 1gps s LYS 42 Cb -0.18 -2.52 -0.04 0.00 -1.51 0.00 0.00 37.83 33.58 1gps s LYS 42 CO 0.26 -0.13 -0.15 0.00 -0.36 0.00 0.00 175.35 174.98 1gps s ILE 44 N -1.19 3.25 -0.07 0.00 -4.36 -0.90 -0.70 121.20 117.22 1gps s ILE 44 Ca 0.19 -1.37 -0.31 0.00 -0.26 0.00 0.00 60.65 58.90 1gps s ILE 44 Cb -0.11 -2.53 0.08 0.00 1.25 0.00 0.00 42.46 41.15 1gps s ILE 44 CO 0.12 0.07 0.71 -0.60 0.24 0.00 0.00 174.94 175.48 1gps s ARG 45 N -2.30 1.00 -0.39 0.37 3.52 -0.26 0.07 118.95 120.97 1gps s ARG 45 Ca 0.21 0.28 -0.23 0.00 -0.13 0.00 0.00 55.73 55.86 1gps s ARG 45 Cb -0.11 0.47 0.01 0.00 -1.56 0.00 0.00 34.95 33.77 1gps s ARG 45 CO 0.13 -0.31 0.79 -1.14 -0.81 0.00 0.00 175.30 173.97 1gps s GLN 46 N -1.12 3.67 0.00 5.12 2.00 -1.26 -1.65 119.66 126.42 1gps s GLN 46 Ca -0.10 0.22 0.19 0.00 -2.00 0.00 0.00 55.36 53.67 1gps s GLN 46 Cb -0.00 -3.84 0.15 0.00 0.80 0.00 0.00 33.01 30.11 1gps s GLN 46 CO 0.09 -0.93 1.09 0.00 -0.50 0.00 0.00 175.29 175.04