#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pco s PRO 2 N 0.00 1.04 -0.84 5.55 0.04 -1.25 -4.83 135.00 134.70 1pco s PRO 2 Ca 0.00 0.33 -0.04 0.00 0.04 0.00 0.00 61.00 61.33 1pco s PRO 2 Cb 0.00 -1.82 0.21 0.00 0.04 0.00 0.00 34.50 32.93 1pco s PRO 2 CO 0.00 -2.28 0.73 0.34 0.04 0.00 0.00 177.00 175.83 1pco s ASP 3 N -3.93 6.04 -1.25 6.66 -1.08 -1.26 -5.05 116.67 116.80 1pco s ASP 3 Ca 0.64 -3.38 -0.15 0.00 -0.52 0.00 0.00 52.55 49.13 1pco s ASP 3 Cb -0.15 -1.96 0.13 0.00 -1.46 0.00 0.00 42.92 39.47 1pco s ASP 3 CO 0.54 -0.28 1.57 -0.81 0.52 0.00 0.00 175.17 176.70 1pco n PRO 4 N 2.84 3.30 -1.84 4.34 -0.04 -1.26 -3.34 135.00 138.99 1pco n PRO 4 Ca 0.17 -3.61 -0.39 0.00 -0.04 0.00 0.00 63.50 59.63 1pco n PRO 4 Cb 0.39 -3.23 0.04 0.00 -0.04 0.00 0.00 33.50 30.66 1pco n PRO 4 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1pco n ARG 5 N 6.76 2.73 0.00 0.54 1.85 -1.10 -4.84 116.66 122.60 1pco n ARG 5 Ca 0.42 -3.44 0.08 0.00 -1.00 0.00 0.00 57.85 53.91 1pco n ARG 5 Cb 0.44 -2.26 0.42 0.00 -1.05 0.00 0.00 32.46 30.00 1pco n ARG 5 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1pco n GLY 6 N -0.51 -0.89 0.20 2.89 0.00 -1.15 -3.05 105.19 102.67 1pco n GLY 6 Ca 0.55 -0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.54 1pco n GLY 6 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1pco h ILE 7 N 0.00 1.04 0.00 -0.61 6.09 -1.88 -3.40 117.51 118.76 1pco h ILE 7 Ca 0.00 -1.22 -0.01 0.00 -1.37 0.00 0.00 64.86 62.26 1pco h ILE 7 Cb 0.18 1.70 -0.00 0.00 0.47 0.00 0.00 36.82 39.17 1pco h ILE 7 CO 0.00 0.33 -0.91 -0.38 -3.07 0.00 0.00 178.15 174.12 1pco n ILE 8 N -3.86 1.47 -3.79 2.19 2.08 -1.17 -5.04 119.36 111.24 1pco n ILE 8 Ca -0.01 0.16 -0.37 0.00 0.56 0.00 0.00 62.75 63.09 1pco n ILE 8 Cb 0.41 -2.25 -0.06 0.00 -0.75 0.00 0.00 39.64 36.98 1pco n ILE 8 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 1pco s ILE 9 N -2.80 5.40 -0.31 1.39 -4.36 -1.21 -5.09 121.20 114.22 1pco s ILE 9 Ca -0.26 0.36 0.01 0.00 -0.26 0.00 0.00 60.65 60.49 1pco s ILE 9 Cb 0.04 -3.47 0.14 0.00 1.25 0.00 0.00 42.46 40.42 1pco s ILE 9 CO 0.38 0.61 0.33 0.20 0.24 0.00 0.00 174.94 176.70 1pco s ASN 10 N -1.03 1.36 -0.20 4.36 0.01 -1.12 -4.40 114.94 113.92 1pco s ASN 10 Ca 0.17 -0.85 -0.05 0.00 -0.71 0.00 0.00 52.86 51.42 1pco s ASN 10 Cb -0.13 0.62 0.10 0.00 0.41 0.00 0.00 41.25 42.25 1pco s ASN 10 CO 0.06 -0.36 0.36 -0.22 -1.51 0.00 0.00 177.10 175.43 1pco s LEU 11 N 2.21 -0.53 0.74 0.60 2.96 -1.13 -4.84 118.68 118.68 1pco s LEU 11 Ca 0.11 0.52 -0.11 0.00 -0.22 0.00 0.00 54.13 54.43 1pco s LEU 11 Cb -0.14 1.06 0.03 0.00 0.50 0.00 0.00 46.19 47.64 1pco s LEU 11 CO -0.27 -0.27 1.08 -1.81 -1.32 0.00 0.00 176.35 173.76 1pco s ASP 12 N 2.53 5.05 0.40 3.68 1.01 -1.26 -1.87 116.67 126.21 1pco s ASP 12 Ca 0.05 1.44 -0.27 0.00 0.71 0.00 0.00 52.55 54.48 1pco s ASP 12 Cb -0.14 -2.26 -0.10 0.00 1.01 0.00 0.00 42.92 41.43 1pco s ASP 12 CO -0.13 -1.63 1.48 1.21 0.21 0.00 0.00 175.17 176.30 1pco n GLU 13 N -3.23 2.56 -0.20 8.23 0.00 -1.26 -3.55 120.64 123.19 1pco n GLU 13 Ca 0.07 0.90 0.00 0.00 0.00 0.00 0.00 57.16 58.13 1pco n GLU 13 Cb 0.55 -2.67 0.00 0.00 0.00 0.00 0.00 31.44 29.32 1pco n GLU 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1pco n GLY 14 N 0.48 0.67 3.45 8.31 0.00 0.30 -4.94 105.19 113.46 1pco n GLY 14 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1pco n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pco s GLU 15 N -0.80 3.22 -0.08 1.61 2.02 -1.23 -4.94 118.70 118.51 1pco s GLU 15 Ca 0.00 -0.63 -0.30 0.00 0.02 0.00 0.00 54.97 54.07 1pco s GLU 15 Cb 0.00 -2.65 -0.05 0.00 0.10 0.00 0.00 34.13 31.53 1pco s GLU 15 CO 0.00 0.35 1.59 -1.17 0.02 0.00 0.00 175.26 176.05 1pco s LEU 16 N 0.01 4.29 0.17 1.80 0.20 -1.26 -1.84 118.68 122.04 1pco s LEU 16 Ca -0.02 2.13 0.07 0.00 0.69 0.00 0.00 54.13 56.99 1pco s LEU 16 Cb -0.14 -3.53 -0.04 0.00 -0.43 0.00 0.00 46.19 42.04 1pco s LEU 16 CO 0.04 -0.91 -0.14 0.00 -0.29 0.00 0.00 176.35 175.05 1pco n LEU 18 N -0.09 0.39 -4.88 0.00 4.77 -1.26 -3.96 117.00 111.97 1pco n LEU 18 Ca -0.10 0.11 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 1pco n LEU 18 Cb 0.59 -0.32 -0.05 0.00 -2.33 0.00 0.00 43.42 41.32 1pco n LEU 18 CO 0.32 -0.32 0.18 0.20 -1.33 0.00 0.00 177.39 176.44 1pco s ASN 19 N -2.68 6.57 0.37 -1.43 0.02 -1.26 -4.85 114.94 111.69 1pco s ASN 19 Ca 0.00 0.83 0.28 0.00 -1.02 0.00 0.00 52.86 52.94 1pco s ASN 19 Cb 0.00 -2.19 1.19 0.00 0.02 0.00 0.00 41.25 40.28 1pco s ASN 19 CO 0.00 -0.07 1.82 0.28 0.02 0.00 0.00 177.10 179.15 1pco h SER 20 N 2.45 0.00 0.00 -1.22 0.02 -0.17 -3.19 113.55 111.44 1pco h SER 20 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1pco h SER 20 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1pco h SER 20 CO 0.69 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.38 1pco n ALA 21 N -1.88 2.23 0.00 3.77 0.00 -1.26 -3.49 120.51 119.88 1pco n ALA 21 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1pco n ALA 21 Cb 0.22 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1pco n ALA 21 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1pco n GLN 22 N 0.56 0.01 -0.11 0.00 1.13 -1.21 -4.96 117.38 112.80 1pco n GLN 22 Ca 0.00 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.01 1pco n GLN 22 Cb 0.35 -0.54 0.05 0.00 0.11 0.00 0.00 30.24 30.21 1pco n GLN 22 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1pco h LYS 24 N 0.00 -0.50 0.00 0.00 1.79 -1.58 -3.14 116.57 113.14 1pco h LYS 24 Ca -0.07 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1pco h LYS 24 Cb 0.22 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 1pco h LYS 24 CO 0.04 -0.21 0.00 0.43 -1.08 0.00 0.00 179.45 178.63 1pco n SER 25 N -5.13 0.00 -2.68 0.86 7.64 -1.26 -2.92 113.62 110.12 1pco n SER 25 Ca -0.08 0.05 -0.05 0.00 1.01 0.00 0.00 58.87 59.80 1pco n SER 25 Cb 0.26 -0.06 0.08 0.00 -1.01 0.00 0.00 64.21 63.48 1pco n SER 25 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1pco n ASN 26 N -0.78 -1.51 -3.31 6.43 2.85 -1.21 -2.71 115.26 115.02 1pco n ASN 26 Ca 0.00 -2.01 -0.10 0.00 -0.11 0.00 0.00 54.58 52.36 1pco n ASN 26 Cb 0.00 0.91 -0.06 0.00 1.24 0.00 0.00 39.78 41.87 1pco n ASN 26 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pco s GLN 29 N 2.23 4.19 0.05 0.00 -0.44 -0.03 -1.88 119.66 123.79 1pco s GLN 29 Ca 0.15 0.41 -0.30 0.00 -2.50 0.00 0.00 55.36 53.12 1pco s GLN 29 Cb -0.16 -3.56 -0.04 0.00 -1.64 0.00 0.00 33.01 27.60 1pco s GLN 29 CO 0.14 -0.15 1.00 -1.58 0.50 0.00 0.00 175.29 175.19 1pco s HIS 30 N 1.66 3.69 0.00 1.67 5.65 -0.40 -1.76 115.29 125.80 1pco s HIS 30 Ca 0.24 1.70 0.00 0.00 0.25 0.00 0.00 55.06 57.25 1pco s HIS 30 Cb -0.15 -3.13 0.00 0.00 -1.18 0.00 0.00 32.58 28.12 1pco s HIS 30 CO 0.10 -0.07 0.84 -0.40 -0.65 0.00 0.00 174.74 174.55 1pco n ASP 31 N 3.42 2.45 -2.01 9.88 5.68 -1.24 -4.67 116.55 130.07 1pco n ASP 31 Ca 0.05 -1.56 -0.03 0.00 -0.50 0.00 0.00 54.79 52.75 1pco n ASP 31 Cb 0.50 -0.43 -0.02 0.00 -1.14 0.00 0.00 41.12 40.02 1pco n ASP 31 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1pco n THR 32 N 0.76 -7.88 0.00 2.12 -2.24 -1.26 -4.57 114.28 101.20 1pco n THR 32 Ca 0.00 1.39 0.00 0.00 -2.27 0.00 0.00 64.05 63.17 1pco n THR 32 Cb 0.37 -4.97 0.00 0.00 -2.10 0.00 0.00 70.33 63.63 1pco n THR 32 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1pco n ILE 33 N 0.84 0.00 -2.12 2.28 -0.00 -1.26 -4.90 119.36 114.20 1pco n ILE 33 Ca -0.20 0.00 -0.42 0.00 -0.00 0.00 0.00 62.75 62.13 1pco n ILE 33 Cb 0.31 0.00 -0.03 0.00 -0.00 0.00 0.00 39.64 39.92 1pco n ILE 33 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 1pco s LEU 34 N 0.00 4.36 -0.16 1.39 2.96 -1.26 -4.97 118.68 121.00 1pco s LEU 34 Ca 0.00 2.35 0.01 0.00 -0.22 0.00 0.00 54.13 56.27 1pco s LEU 34 Cb 0.00 -3.58 0.21 0.00 0.50 0.00 0.00 46.19 43.32 1pco s LEU 34 CO 0.00 -0.71 1.41 -1.54 -1.32 0.00 0.00 176.35 174.20 1pco n SER 35 N 4.30 3.68 -4.53 3.68 3.41 -1.26 -3.58 113.62 119.31 1pco n SER 35 Ca 0.12 -2.59 -0.42 0.00 -0.26 0.00 0.00 58.87 55.73 1pco n SER 35 Cb 0.42 -0.68 -0.03 0.00 -0.26 0.00 0.00 64.21 63.65 1pco n SER 35 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1pco s LEU 36 N -1.12 3.76 0.09 1.04 2.96 -1.26 -4.94 118.68 119.21 1pco s LEU 36 Ca 0.19 -1.24 -0.04 0.00 -0.22 0.00 0.00 54.13 52.82 1pco s LEU 36 Cb 0.16 -2.52 -0.05 0.00 0.50 0.00 0.00 46.19 44.28 1pco s LEU 36 CO 0.03 -1.51 0.30 -0.44 -1.32 0.00 0.00 176.35 173.41 1pco s SER 37 N 4.31 6.45 -0.02 3.68 0.01 -1.25 -3.95 113.70 122.92 1pco s SER 37 Ca 0.38 0.48 -0.01 0.00 1.31 0.00 0.00 55.95 58.11 1pco s SER 37 Cb -0.05 -2.05 0.01 0.00 0.21 0.00 0.00 66.02 64.15 1pco s SER 37 CO -0.01 0.13 0.05 -0.60 0.41 0.00 0.00 173.24 173.22 1pco s ARG 38 N -2.43 0.04 0.37 12.44 3.52 -0.72 -1.45 118.95 130.71 1pco s ARG 38 Ca 0.36 0.11 -0.28 0.00 -0.13 0.00 0.00 55.73 55.80 1pco s ARG 38 Cb -0.13 -0.05 -0.11 0.00 -1.56 0.00 0.00 34.95 33.11 1pco s ARG 38 CO 0.24 -0.05 1.47 0.00 -0.81 0.00 0.00 175.30 176.15 1pco s ALA 40 N -1.13 1.81 0.30 0.00 0.00 -1.24 -0.54 121.76 120.96 1pco s ALA 40 Ca 0.53 -2.01 -0.14 0.00 0.00 0.00 0.00 51.96 50.34 1pco s ALA 40 Cb -0.46 1.45 -0.09 0.00 0.00 0.00 0.00 23.12 24.03 1pco s ALA 40 CO 0.62 -0.65 0.70 -1.17 0.00 0.00 0.00 175.76 175.26 1pco s LEU 41 N -3.35 4.10 0.36 0.00 2.96 -1.26 -4.76 118.68 116.72 1pco s LEU 41 Ca 0.40 1.22 -0.28 0.00 -0.22 0.00 0.00 54.13 55.25 1pco s LEU 41 Cb 0.03 -3.97 -0.10 0.00 0.50 0.00 0.00 46.19 42.65 1pco s LEU 41 CO 0.25 -0.16 1.29 -0.54 -1.32 0.00 0.00 176.35 175.87 1pco s LYS 42 N -2.88 4.23 0.73 1.98 1.02 -1.26 -4.51 119.74 119.05 1pco s LYS 42 Ca 0.52 2.15 -0.11 0.00 0.02 0.00 0.00 55.97 58.55 1pco s LYS 42 Cb -0.11 -2.95 0.03 0.00 -0.52 0.00 0.00 37.83 34.28 1pco s LYS 42 CO 0.18 -0.27 1.07 0.00 -0.92 0.00 0.00 175.35 175.41 1pco s ALA 43 N -1.20 2.57 0.49 5.17 0.00 -1.24 -4.59 121.76 122.96 1pco s ALA 43 Ca 0.52 -0.07 0.04 0.00 0.00 0.00 0.00 51.96 52.45 1pco s ALA 43 Cb -0.38 -3.13 0.04 0.00 0.00 0.00 0.00 23.12 19.65 1pco s ALA 43 CO 0.50 -1.37 0.33 0.54 0.00 0.00 0.00 175.76 175.76 1pco n ARG 44 N -3.21 0.77 -1.75 0.00 3.00 -1.26 -2.39 116.66 111.82 1pco n ARG 44 Ca 0.07 -3.15 -0.41 0.00 -0.01 0.00 0.00 57.85 54.35 1pco n ARG 44 Cb 0.55 0.40 -0.01 0.00 0.00 0.00 0.00 32.46 33.40 1pco n ARG 44 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1pco n GLU 45 N -1.60 2.75 -3.05 5.56 2.13 -1.26 -2.81 120.64 122.36 1pco n GLU 45 Ca -0.04 0.98 -0.16 0.00 0.66 0.00 0.00 57.16 58.60 1pco n GLU 45 Cb 0.57 -2.77 0.04 0.00 0.27 0.00 0.00 31.44 29.55 1pco n GLU 45 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1pco n ASN 46 N 2.09 -4.81 -4.13 4.31 3.02 0.54 -4.97 115.26 111.30 1pco n ASN 46 Ca 0.08 -0.29 -0.23 0.00 -0.03 0.00 0.00 54.58 54.10 1pco n ASN 46 Cb 0.37 -3.50 -0.15 0.00 -0.61 0.00 0.00 39.78 35.89 1pco n ASN 46 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1pco s SER 47 N -3.06 1.81 -0.74 6.41 0.15 -1.12 -4.89 113.70 112.26 1pco s SER 47 Ca 0.32 -0.29 -0.26 0.00 0.70 0.00 0.00 55.95 56.42 1pco s SER 47 Cb -0.14 -0.20 -0.01 0.00 -1.71 0.00 0.00 66.02 63.96 1pco s SER 47 CO 0.39 0.18 1.71 -1.61 1.20 0.00 0.00 173.24 175.11 1pco s GLU 48 N -0.41 2.83 -0.09 5.44 2.02 -1.26 -1.96 118.70 125.26 1pco s GLU 48 Ca 0.06 0.07 -0.12 0.00 0.02 0.00 0.00 54.97 55.00 1pco s GLU 48 Cb -0.06 -4.57 -0.05 0.00 0.10 0.00 0.00 34.13 29.55 1pco s GLU 48 CO -0.00 -2.68 0.29 0.00 0.02 0.00 0.00 175.26 172.89 1pco s SER 50 N -0.52 6.57 0.00 0.00 1.04 -0.17 -2.24 113.70 118.38 1pco s SER 50 Ca 0.19 0.47 0.00 0.00 0.48 0.00 0.00 55.95 57.09 1pco s SER 50 Cb -0.14 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.60 1pco s SER 50 CO 0.07 -0.62 0.00 0.00 0.98 0.00 0.00 173.24 173.67 1pco n ALA 51 N 6.18 0.00 -2.53 5.32 0.00 -1.26 -3.66 120.51 124.57 1pco n ALA 51 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.29 1pco n ALA 51 Cb 0.48 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.82 1pco n ALA 51 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1pco s PHE 52 N 0.00 1.29 0.04 0.00 0.40 -1.26 -4.70 117.98 113.76 1pco s PHE 52 Ca 0.00 -0.56 0.00 0.00 -0.60 0.00 0.00 56.93 55.77 1pco s PHE 52 Cb 0.00 -0.69 0.00 0.00 0.51 0.00 0.00 43.02 42.84 1pco s PHE 52 CO 0.00 0.10 0.00 0.25 0.70 0.00 0.00 175.22 176.27 1pco n THR 53 N 0.67 -2.05 0.00 0.64 -2.24 -1.26 -5.07 114.28 104.97 1pco n THR 53 Ca -0.17 0.57 0.00 0.00 -2.27 0.00 0.00 64.05 62.18 1pco n THR 53 Cb 0.57 -1.20 0.00 0.00 -2.10 0.00 0.00 70.33 67.60 1pco n THR 53 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1pco n LEU 54 N 1.35 0.00 0.00 3.22 0.00 -1.26 -5.04 117.00 115.27 1pco n LEU 54 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1pco n LEU 54 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 43.42 43.54 1pco n LEU 54 CO 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 177.39 176.97 1pco n TYR 55 N -2.27 0.00 0.00 1.96 9.36 -1.26 -5.08 117.16 119.87 1pco n TYR 55 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1pco n TYR 55 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 1pco n TYR 55 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1pco n GLY 56 N -0.52 0.85 2.82 2.98 0.00 -1.26 -4.86 105.19 105.20 1pco n GLY 56 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1pco n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pco s VAL 57 N -1.05 0.08 -0.09 1.61 1.01 -1.26 0.55 120.40 121.24 1pco s VAL 57 Ca 0.00 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.10 1pco s VAL 57 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.21 1pco s VAL 57 CO 0.00 0.09 -0.20 -0.31 0.00 0.00 0.00 175.10 174.68 1pco s TYR 58 N 0.75 2.61 0.19 5.22 2.02 -0.79 -4.90 117.35 122.45 1pco s TYR 58 Ca -0.07 -0.78 -0.11 0.00 -0.37 0.00 0.00 57.07 55.74 1pco s TYR 58 Cb -0.10 -1.71 0.10 0.00 -0.40 0.00 0.00 41.96 39.85 1pco s TYR 58 CO -0.02 -0.26 1.79 1.88 -1.57 0.00 0.00 175.55 177.37 1pco h TYR 59 N 6.44 0.92 -3.10 2.71 -1.99 -1.87 -1.05 116.97 119.03 1pco h TYR 59 Ca -0.26 -0.03 -0.31 0.00 2.00 0.00 0.00 58.73 60.12 1pco h TYR 59 Cb 1.21 -0.29 -0.37 0.00 2.00 0.00 0.00 36.73 39.29 1pco h TYR 59 CO 0.47 0.67 -0.66 0.15 -0.00 0.00 0.00 178.16 178.80 1pco s LYS 60 N -5.78 0.02 0.50 4.88 -0.14 -1.26 -4.36 119.74 113.60 1pco s LYS 60 Ca -0.13 0.50 -0.19 0.00 -1.36 0.00 0.00 55.97 54.79 1pco s LYS 60 Cb 0.14 -0.40 -0.12 0.00 -1.68 0.00 0.00 37.83 35.76 1pco s LYS 60 CO 0.79 -0.34 0.23 0.00 -0.76 0.00 0.00 175.35 175.27 1pco n PRO 62 N 0.80 0.61 -1.53 0.00 -0.04 -1.24 -3.68 135.00 129.92 1pco n PRO 62 Ca 0.10 -0.11 0.07 0.00 -0.04 0.00 0.00 63.50 63.52 1pco n PRO 62 Cb 0.45 -1.36 -0.04 0.00 -0.04 0.00 0.00 33.50 32.51 1pco n PRO 62 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pco s GLU 64 N -4.99 2.46 -0.49 0.00 -1.05 -1.01 -4.51 118.70 109.11 1pco s GLU 64 Ca 0.00 1.88 -0.27 0.00 -0.15 0.00 0.00 54.97 56.43 1pco s GLU 64 Cb 0.00 -1.86 -0.02 0.00 -0.44 0.00 0.00 34.13 31.81 1pco s GLU 64 CO 0.00 -1.62 1.84 0.50 0.95 0.00 0.00 175.26 176.93 1pco s ARG 65 N -3.60 2.91 0.00 -4.83 6.06 -1.26 -2.63 118.95 115.59 1pco s ARG 65 Ca 0.78 0.96 0.00 0.00 -2.50 0.00 0.00 55.73 54.97 1pco s ARG 65 Cb -0.32 -4.31 0.00 0.00 0.06 0.00 0.00 34.95 30.38 1pco s ARG 65 CO 0.41 -2.38 0.00 0.41 -2.50 0.00 0.00 175.30 171.24 1pco n GLY 66 N 5.58 1.30 3.88 8.12 0.00 -1.26 -5.14 105.19 117.67 1pco n GLY 66 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 1pco n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pco s LEU 67 N 0.00 4.37 -0.15 0.99 1.02 -1.08 -3.39 118.68 120.44 1pco s LEU 67 Ca 0.00 0.60 -0.09 0.00 0.02 0.00 0.00 54.13 54.67 1pco s LEU 67 Cb 0.00 -2.72 -0.04 0.00 0.02 0.00 0.00 46.19 43.44 1pco s LEU 67 CO 0.00 0.24 0.16 0.28 0.02 0.00 0.00 176.35 177.05 1pco s THR 68 N -1.31 5.44 -0.37 5.49 -1.32 -0.06 -4.82 115.64 118.70 1pco s THR 68 Ca 0.28 0.25 -0.17 0.00 -1.21 0.00 0.00 61.69 60.84 1pco s THR 68 Cb -0.13 -3.46 0.00 0.00 -1.51 0.00 0.00 72.50 67.40 1pco s THR 68 CO 0.16 0.54 0.47 0.00 -2.21 0.00 0.00 174.62 173.58 1pco s GLU 70 N 2.28 4.08 -0.38 0.00 -1.05 -0.82 -4.79 118.70 118.01 1pco s GLU 70 Ca 0.16 -2.71 -0.03 0.00 -0.15 0.00 0.00 54.97 52.24 1pco s GLU 70 Cb -0.16 -4.89 -0.13 0.00 -0.44 0.00 0.00 34.13 28.51 1pco s GLU 70 CO 0.13 -1.60 1.19 0.41 0.95 0.00 0.00 175.26 176.34 1pco n GLY 71 N 3.79 -0.19 2.71 -3.83 0.00 -1.26 -3.76 105.19 102.65 1pco n GLY 71 Ca 0.31 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.91 1pco n GLY 71 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pco n ASP 72 N 3.75 4.97 0.00 1.61 8.00 -1.26 -4.86 116.55 128.76 1pco n ASP 72 Ca 0.26 -2.91 0.00 0.00 0.71 0.00 0.00 54.79 52.85 1pco n ASP 72 Cb 0.24 -1.58 0.00 0.00 -0.02 0.00 0.00 41.12 39.76 1pco n ASP 72 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1pco n LYS 73 N 4.93 0.00 0.00 -1.24 5.02 -1.26 -4.61 118.16 121.00 1pco n LYS 73 Ca 0.52 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.81 1pco n LYS 73 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.37 1pco n LYS 73 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1pco n SER 74 N 1.24 0.00 0.21 4.39 7.64 -1.23 -4.71 113.62 121.16 1pco n SER 74 Ca 0.00 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.03 1pco n SER 74 Cb 0.00 0.00 0.55 0.00 -1.01 0.00 0.00 64.21 63.75 1pco n SER 74 CO 0.00 0.00 0.00 0.17 -3.01 0.00 0.00 175.04 172.20 1pco h LEU 75 N 0.00 0.00 -6.82 -3.43 -0.00 -1.88 -3.41 115.31 99.78 1pco h LEU 75 Ca 0.00 0.00 -0.71 0.00 -0.00 0.00 0.00 57.88 57.17 1pco h LEU 75 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 40.58 1pco h LEU 75 CO 0.00 0.00 2.50 0.55 -0.00 0.00 0.00 178.44 181.49 1pco n VAL 76 N -2.74 3.83 -3.11 0.15 3.14 -1.26 -4.77 118.33 113.56 1pco n VAL 76 Ca 0.02 -3.74 -0.09 0.00 -2.96 0.00 0.00 64.34 57.57 1pco n VAL 76 Cb 0.31 -2.48 -0.03 0.00 -1.06 0.00 0.00 33.84 30.59 1pco n VAL 76 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1pco s GLY 77 N 3.11 -0.64 0.00 7.55 0.00 -1.26 -4.97 107.32 111.11 1pco s GLY 77 Ca 0.48 -0.65 -0.01 0.00 0.00 0.00 0.00 44.72 44.53 1pco s GLY 77 CO -0.01 3.24 2.00 -1.26 0.00 0.00 0.00 173.10 177.07 1pco n SER 78 N 3.64 4.54 0.00 1.64 2.88 -1.26 -4.02 113.62 121.04 1pco n SER 78 Ca 0.16 -2.23 0.00 0.00 -1.33 0.00 0.00 58.87 55.47 1pco n SER 78 Cb 0.53 -1.01 0.00 0.00 -0.75 0.00 0.00 64.21 62.97 1pco n SER 78 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pco n ILE 79 N 1.78 0.00 -4.92 2.46 3.06 -1.26 -5.13 119.36 115.35 1pco n ILE 79 Ca 0.08 0.00 -0.26 0.00 -2.50 0.00 0.00 62.75 60.07 1pco n ILE 79 Cb 0.50 0.00 -0.15 0.00 0.54 0.00 0.00 39.64 40.52 1pco n ILE 79 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 1pco s THR 80 N -0.58 1.49 -0.57 9.51 -4.23 -1.26 -5.07 115.64 114.94 1pco s THR 80 Ca 0.00 -0.81 -0.07 0.00 -1.18 0.00 0.00 61.69 59.64 1pco s THR 80 Cb 0.00 -1.24 -0.15 0.00 1.34 0.00 0.00 72.50 72.45 1pco s THR 80 CO 0.00 0.42 3.25 0.59 -0.54 0.00 0.00 174.62 178.35 1pco n ASN 81 N 2.64 6.51 -3.95 3.99 4.13 -1.26 -4.73 115.26 122.59 1pco n ASN 81 Ca -0.15 -2.65 -0.40 0.00 1.68 0.00 0.00 54.58 53.05 1pco n ASN 81 Cb 0.53 -1.42 -0.01 0.00 -1.54 0.00 0.00 39.78 37.34 1pco n ASN 81 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1pco n THR 82 N 2.49 4.74 -3.62 3.41 -2.24 -1.26 -4.91 114.28 112.89 1pco n THR 82 Ca 0.54 -5.76 -0.29 0.00 -2.27 0.00 0.00 64.05 56.27 1pco n THR 82 Cb 0.65 -2.14 -0.14 0.00 -2.10 0.00 0.00 70.33 66.60 1pco n THR 82 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1pco s ASN 83 N -1.56 3.60 0.35 3.42 3.84 -1.26 -5.13 114.94 118.19 1pco s ASN 83 Ca 0.32 -1.89 0.04 0.00 0.21 0.00 0.00 52.86 51.54 1pco s ASN 83 Cb 0.05 -0.68 -0.01 0.00 -0.55 0.00 0.00 41.25 40.05 1pco s ASN 83 CO 0.06 -0.37 0.14 0.49 -2.79 0.00 0.00 177.10 174.64 1pco n PHE 84 N 4.48 0.04 -2.42 0.43 3.72 -1.26 -3.48 117.46 118.97 1pco n PHE 84 Ca 0.03 -2.31 -0.41 0.00 -0.05 0.00 0.00 57.45 54.71 1pco n PHE 84 Cb 0.39 0.02 -0.04 0.00 -0.94 0.00 0.00 39.48 38.92 1pco n PHE 84 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1pco s GLY 85 N -3.18 2.75 -0.03 1.37 0.00 -0.95 -4.02 107.32 103.27 1pco s GLY 85 Ca 0.20 0.91 -0.20 0.00 0.00 0.00 0.00 44.72 45.63 1pco s GLY 85 CO 0.14 1.78 0.56 -0.42 0.00 0.00 0.00 173.10 175.15 1pco s ILE 86 N -0.19 4.98 -0.18 0.90 -1.09 -1.25 -0.55 121.20 123.84 1pco s ILE 86 Ca 0.51 1.16 -0.28 0.00 -2.23 0.00 0.00 60.65 59.80 1pco s ILE 86 Cb -0.32 -3.89 -0.00 0.00 -1.58 0.00 0.00 42.46 36.67 1pco s ILE 86 CO 0.37 0.41 0.99 0.00 -1.23 0.00 0.00 174.94 175.47 1pco s HIS 88 N 2.62 1.05 -0.17 0.00 3.76 -0.41 -0.34 115.29 121.80 1pco s HIS 88 Ca 0.44 -0.57 -0.16 0.00 -0.15 0.00 0.00 55.06 54.61 1pco s HIS 88 Cb -0.16 -0.58 -0.04 0.00 1.11 0.00 0.00 32.58 32.90 1pco s HIS 88 CO 0.11 0.01 0.42 1.21 -0.85 0.00 0.00 174.74 175.64 1pco s ASN 89 N -2.12 6.52 0.00 1.40 2.47 -1.26 -0.88 114.94 121.08 1pco s ASN 89 Ca 0.01 0.61 0.00 0.00 0.42 0.00 0.00 52.86 53.90 1pco s ASN 89 Cb -0.06 -2.25 0.00 0.00 -1.45 0.00 0.00 41.25 37.49 1pco s ASN 89 CO 0.01 -0.04 0.00 0.55 -3.72 0.00 0.00 177.10 173.89 1pco n VAL 90 N 4.07 0.00 -2.22 -5.21 3.14 -1.26 -5.00 118.33 111.85 1pco n VAL 90 Ca -0.08 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.29 1pco n VAL 90 Cb 0.51 -0.47 0.00 0.00 -1.06 0.00 0.00 33.84 32.83 1pco n VAL 90 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1pco n GLY 91 N 1.29 -0.79 5.00 7.55 0.00 -1.22 -4.24 105.19 112.78 1pco n GLY 91 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1pco n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pco n ARG 92 N -1.18 0.00 0.00 1.61 1.74 -1.26 -5.19 116.66 112.38 1pco n ARG 92 Ca 0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 1pco n ARG 92 Cb 0.44 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.88 1pco n ARG 92 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54