#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pco h PRO 2 N 0.00 0.00 -3.38 7.34 0.13 -2.11 -3.35 132.00 130.63 1pco h PRO 2 Ca 0.00 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 64.43 1pco h PRO 2 Cb 0.00 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 30.78 1pco h PRO 2 CO 0.00 0.20 -0.15 0.16 -0.23 0.00 0.00 178.00 177.98 1pco s ASP 3 N -6.70 5.85 -0.90 1.44 1.47 -1.26 -5.07 116.67 111.50 1pco s ASP 3 Ca -0.03 -3.53 -0.24 0.00 1.18 0.00 0.00 52.55 49.92 1pco s ASP 3 Cb 0.15 -1.90 0.01 0.00 -0.34 0.00 0.00 42.92 40.83 1pco s ASP 3 CO 0.67 -0.23 1.62 -2.16 0.68 0.00 0.00 175.17 175.75 1pco s PRO 4 N -1.06 3.12 -1.07 2.11 0.04 -1.26 -4.91 135.00 131.96 1pco s PRO 4 Ca 0.25 -0.57 -0.07 0.00 0.04 0.00 0.00 61.00 60.65 1pco s PRO 4 Cb -0.10 -5.00 -0.07 0.00 0.04 0.00 0.00 34.50 29.37 1pco s PRO 4 CO -0.11 -2.61 2.96 2.89 0.04 0.00 0.00 177.00 180.17 1pco n ARG 5 N 8.98 3.40 -2.68 4.56 0.00 -1.26 -4.55 116.66 125.10 1pco n ARG 5 Ca 0.30 -2.24 -0.03 0.00 -0.00 0.00 0.00 57.85 55.87 1pco n ARG 5 Cb 0.50 -2.51 0.04 0.00 -0.00 0.00 0.00 32.46 30.48 1pco n ARG 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1pco n GLY 6 N 2.62 -1.64 0.16 2.89 0.00 -1.26 -5.08 105.19 102.89 1pco n GLY 6 Ca 0.64 1.21 -0.03 0.00 0.00 0.00 0.00 46.02 47.84 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 2.55 1.39 0.00 -0.61 6.09 -2.04 -3.48 117.51 121.40 1pco h ILE 7 Ca -0.03 -1.93 0.00 0.00 -1.37 0.00 0.00 64.86 61.53 1pco h ILE 7 Cb 1.17 1.99 0.00 0.00 0.47 0.00 0.00 36.82 40.45 1pco h ILE 7 CO -0.11 0.56 0.00 -0.38 -3.07 0.00 0.00 178.15 175.15 1pco n ILE 8 N -3.88 0.00 0.00 2.19 5.41 -1.26 -4.69 119.36 117.13 1pco n ILE 8 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.73 1pco n ILE 8 Cb 0.59 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.52 1pco n ILE 8 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 1pco n ILE 9 N 0.00 0.00 -3.33 1.39 -5.35 -1.26 -5.06 119.36 105.74 1pco n ILE 9 Ca 0.00 0.00 -0.19 0.00 -0.27 0.00 0.00 62.75 62.29 1pco n ILE 9 Cb 0.00 -0.25 0.01 0.00 -1.74 0.00 0.00 39.64 37.66 1pco n ILE 9 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1pco n ASN 10 N 0.00 -6.42 -3.85 7.28 2.04 -0.67 -4.96 115.26 108.68 1pco n ASN 10 Ca 0.00 -0.19 -0.25 0.00 -0.44 0.00 0.00 54.58 53.70 1pco n ASN 10 Cb 0.00 -3.36 -0.17 0.00 -2.53 0.00 0.00 39.78 33.72 1pco n ASN 10 CO 0.00 0.00 0.00 -0.22 -0.44 0.00 0.00 177.26 176.60 1pco s LEU 11 N -3.51 0.93 0.84 -4.53 2.96 -0.99 -4.88 118.68 109.50 1pco s LEU 11 Ca 0.16 -0.20 -0.12 0.00 -0.22 0.00 0.00 54.13 53.76 1pco s LEU 11 Cb -0.03 -0.65 0.13 0.00 0.50 0.00 0.00 46.19 46.14 1pco s LEU 11 CO 0.83 -0.15 1.19 -1.81 -1.32 0.00 0.00 176.35 175.09 1pco s ASP 12 N 1.78 4.02 0.31 3.68 1.01 -1.26 -2.94 116.67 123.27 1pco s ASP 12 Ca 0.04 0.45 -0.29 0.00 0.71 0.00 0.00 52.55 53.46 1pco s ASP 12 Cb -0.13 -0.79 -0.12 0.00 1.01 0.00 0.00 42.92 42.89 1pco s ASP 12 CO -0.06 -2.16 1.38 1.21 0.21 0.00 0.00 175.17 175.75 1pco n GLU 13 N -3.38 2.23 0.00 8.23 0.00 -1.26 -3.83 120.64 122.63 1pco n GLU 13 Ca 0.11 0.79 0.00 0.00 0.00 0.00 0.00 57.16 58.06 1pco n GLU 13 Cb 0.60 -2.43 0.00 0.00 0.00 0.00 0.00 31.44 29.61 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 1.32 2.31 3.89 8.31 0.00 -0.71 -4.95 105.19 115.36 1pco n GLY 14 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.46 3.41 0.20 1.61 0.41 -1.25 -4.88 118.70 117.74 1pco s GLU 15 Ca 0.00 -0.32 -0.30 0.00 -0.41 0.00 0.00 54.97 53.95 1pco s GLU 15 Cb 0.00 -3.09 -0.08 0.00 -1.78 0.00 0.00 34.13 29.18 1pco s GLU 15 CO 0.00 0.68 1.01 -0.51 -0.49 0.00 0.00 175.26 175.96 1pco s LEU 16 N -1.85 4.55 0.03 1.80 1.43 -1.26 -1.26 118.68 122.12 1pco s LEU 16 Ca 0.26 2.00 0.01 0.00 -1.03 0.00 0.00 54.13 55.37 1pco s LEU 16 Cb -0.13 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 1pco s LEU 16 CO 0.17 -0.05 -0.05 0.00 0.23 0.00 0.00 176.35 176.66 1pco n LEU 18 N 1.60 0.95 -4.99 0.00 4.77 -1.26 -4.63 117.00 113.43 1pco n LEU 18 Ca -0.23 0.23 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 1pco n LEU 18 Cb 0.55 -0.30 0.06 0.00 -2.33 0.00 0.00 43.42 41.40 1pco n LEU 18 CO 0.20 -0.30 0.38 0.54 -1.33 0.00 0.00 177.39 176.89 1pco s ASN 19 N -2.32 5.05 0.42 -1.43 2.20 -1.26 -4.60 114.94 113.00 1pco s ASN 19 Ca 0.00 -0.31 0.25 0.00 -0.94 0.00 0.00 52.86 51.85 1pco s ASN 19 Cb 0.00 -0.40 0.53 0.00 -2.00 0.00 0.00 41.25 39.38 1pco s ASN 19 CO 0.00 -1.32 1.68 0.28 -2.94 0.00 0.00 177.10 174.80 1pco h SER 20 N 0.01 0.00 0.00 3.54 0.02 -1.87 -3.35 113.55 111.90 1pco h SER 20 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 1pco h SER 20 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1pco h SER 20 CO 0.46 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.15 1pco n ALA 21 N -2.05 2.60 -0.03 3.77 0.00 -1.26 -2.71 120.51 120.83 1pco n ALA 21 Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.44 1pco n ALA 21 Cb 0.49 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.88 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 0.72 1.72 0.00 0.00 6.02 -1.26 -4.96 117.38 119.62 1pco n GLN 22 Ca 0.00 0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 1pco n GLN 22 Cb 0.44 -1.14 0.00 0.00 1.02 0.00 0.00 30.24 30.57 1pco n GLN 22 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1pco n LYS 24 N 0.00 0.00 -0.04 0.00 4.01 -1.15 -1.67 118.16 119.31 1pco n LYS 24 Ca 0.00 0.13 -0.02 0.00 -0.51 0.00 0.00 58.31 57.90 1pco n LYS 24 Cb 0.00 -0.62 -0.01 0.00 -0.51 0.00 0.00 35.03 33.89 1pco n LYS 24 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 1pco h SER 25 N 0.00 0.00 -0.52 4.39 4.64 -1.93 -3.38 113.55 116.75 1pco h SER 25 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1pco h SER 25 Cb 0.00 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 61.93 1pco h SER 25 CO 0.00 0.44 -0.27 0.21 -0.87 0.00 0.00 176.83 176.34 1pco s ASN 26 N -4.82 -0.76 -0.38 4.97 3.84 -1.26 -4.88 114.94 111.65 1pco s ASN 26 Ca -0.07 -0.81 0.11 0.00 0.21 0.00 0.00 52.86 52.29 1pco s ASN 26 Cb 0.01 0.99 0.32 0.00 -0.55 0.00 0.00 41.25 42.02 1pco s ASN 26 CO 0.11 -0.04 0.68 0.00 -2.79 0.00 0.00 177.10 175.07 1pco s GLN 29 N 2.36 3.69 -0.14 0.00 -0.44 -0.63 -1.18 119.66 123.31 1pco s GLN 29 Ca 0.19 -0.49 -0.26 0.00 -2.50 0.00 0.00 55.36 52.31 1pco s GLN 29 Cb -0.15 -3.58 -0.02 0.00 -1.64 0.00 0.00 33.01 27.61 1pco s GLN 29 CO 0.12 -0.27 0.83 -1.58 0.50 0.00 0.00 175.29 174.89 1pco s HIS 30 N 1.69 3.46 -1.20 1.67 5.65 0.27 -2.08 115.29 124.76 1pco s HIS 30 Ca 0.06 1.31 -0.08 0.00 0.25 0.00 0.00 55.06 56.60 1pco s HIS 30 Cb -0.16 -3.00 -0.05 0.00 -1.18 0.00 0.00 32.58 28.18 1pco s HIS 30 CO 0.08 -0.18 2.91 -0.40 -0.65 0.00 0.00 174.74 176.51 1pco n ASP 31 N 4.92 7.86 0.00 9.88 5.75 -1.21 -4.65 116.55 139.10 1pco n ASP 31 Ca 0.04 -2.75 0.00 0.00 -0.01 0.00 0.00 54.79 52.07 1pco n ASP 31 Cb 0.49 -1.46 0.00 0.00 -1.03 0.00 0.00 41.12 39.12 1pco n ASP 31 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1pco n THR 32 N 2.73 0.00 0.40 2.12 -2.24 -1.26 -4.69 114.28 111.34 1pco n THR 32 Ca 0.67 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 62.29 1pco n THR 32 Cb 0.37 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.52 1pco n THR 32 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1pco h ILE 33 N 0.00 0.00 -2.56 2.28 1.08 -1.92 -3.32 117.51 113.08 1pco h ILE 33 Ca 0.00 0.00 -0.76 0.00 -0.39 0.00 0.00 64.86 63.71 1pco h ILE 33 Cb 0.00 0.00 -0.21 0.00 -3.07 0.00 0.00 36.82 33.54 1pco h ILE 33 CO 0.00 0.00 1.11 -0.11 -0.69 0.00 0.00 178.15 178.46 1pco n LEU 34 N -4.78 5.32 -4.11 1.44 7.94 -1.26 -4.99 117.00 116.56 1pco n LEU 34 Ca -0.13 -4.63 -0.12 0.00 -1.11 0.00 0.00 56.01 50.03 1pco n LEU 34 Cb 0.41 -1.58 -0.07 0.00 0.53 0.00 0.00 43.42 42.71 1pco n LEU 34 CO 0.31 0.91 -0.00 -0.94 -1.11 0.00 0.00 177.39 176.56 1pco s SER 35 N 2.37 0.31 0.09 1.96 1.04 -1.25 -5.09 113.70 113.13 1pco s SER 35 Ca 0.39 -1.26 -0.21 0.00 0.48 0.00 0.00 55.95 55.36 1pco s SER 35 Cb -0.05 0.52 -0.07 0.00 0.10 0.00 0.00 66.02 66.53 1pco s SER 35 CO -0.02 -1.06 0.61 -0.22 0.98 0.00 0.00 173.24 173.54 1pco s LEU 36 N -3.14 4.54 -0.36 2.42 2.96 -1.26 -4.86 118.68 118.98 1pco s LEU 36 Ca 0.31 1.34 -0.11 0.00 -0.22 0.00 0.00 54.13 55.46 1pco s LEU 36 Cb 0.02 -2.99 0.02 0.00 0.50 0.00 0.00 46.19 43.75 1pco s LEU 36 CO 0.14 0.26 0.20 -0.44 -1.32 0.00 0.00 176.35 175.18 1pco s SER 37 N -1.13 5.69 0.01 3.68 0.01 -1.26 -3.34 113.70 117.36 1pco s SER 37 Ca 0.31 -0.94 0.08 0.00 1.31 0.00 0.00 55.95 56.71 1pco s SER 37 Cb -0.20 -2.02 -0.02 0.00 0.21 0.00 0.00 66.02 63.99 1pco s SER 37 CO 0.21 -0.36 -0.25 -0.60 0.41 0.00 0.00 173.24 172.65 1pco s ARG 38 N 1.56 1.86 0.56 12.44 3.52 -0.88 -2.14 118.95 135.86 1pco s ARG 38 Ca 0.02 -0.96 -0.19 0.00 -0.13 0.00 0.00 55.73 54.47 1pco s ARG 38 Cb -0.19 -1.90 -0.05 0.00 -1.56 0.00 0.00 34.95 31.25 1pco s ARG 38 CO 0.06 0.51 1.13 0.00 -0.81 0.00 0.00 175.30 176.19 1pco n ALA 40 N -1.47 0.53 -2.15 0.00 0.00 -1.22 -1.73 120.51 114.46 1pco n ALA 40 Ca 0.11 -1.80 -0.39 0.00 0.00 0.00 0.00 53.44 51.36 1pco n ALA 40 Cb 0.51 1.26 -0.06 0.00 0.00 0.00 0.00 19.45 21.16 1pco n ALA 40 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1pco s LEU 41 N 0.00 4.54 0.31 0.00 1.43 -1.26 -4.32 118.68 119.38 1pco s LEU 41 Ca 0.21 1.54 -0.29 0.00 -1.03 0.00 0.00 54.13 54.56 1pco s LEU 41 Cb 0.01 -3.23 -0.10 0.00 0.03 0.00 0.00 46.19 42.90 1pco s LEU 41 CO 0.15 0.15 1.27 -1.59 0.23 0.00 0.00 176.35 176.56 1pco s LYS 42 N -0.78 4.41 0.52 1.70 -2.85 -1.26 -4.61 119.74 116.87 1pco s LYS 42 Ca 0.36 2.13 -0.19 0.00 -1.00 0.00 0.00 55.97 57.27 1pco s LYS 42 Cb -0.22 -3.10 -0.07 0.00 -2.06 0.00 0.00 37.83 32.38 1pco s LYS 42 CO 0.24 -0.12 1.05 0.00 0.10 0.00 0.00 175.35 176.62 1pco s ALA 43 N -1.06 2.82 0.40 0.59 0.00 -1.25 -4.57 121.76 118.69 1pco s ALA 43 Ca 0.49 0.56 0.08 0.00 0.00 0.00 0.00 51.96 53.09 1pco s ALA 43 Cb -0.38 -3.25 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 1pco s ALA 43 CO 0.50 -0.48 0.43 1.03 0.00 0.00 0.00 175.76 177.24 1pco s ARG 44 N -3.47 2.70 0.04 0.00 0.52 -1.26 -1.38 118.95 116.09 1pco s ARG 44 Ca 0.67 -1.37 -0.35 0.00 -0.52 0.00 0.00 55.73 54.15 1pco s ARG 44 Cb -0.17 -2.54 -0.14 0.00 0.52 0.00 0.00 34.95 32.62 1pco s ARG 44 CO 0.25 -0.16 1.61 -1.91 0.02 0.00 0.00 175.30 175.11 1pco n GLU 45 N -1.63 1.81 -2.38 3.54 2.13 -1.26 -1.76 120.64 121.10 1pco n GLU 45 Ca 0.04 0.66 -0.09 0.00 0.66 0.00 0.00 57.16 58.42 1pco n GLU 45 Cb 0.60 -2.40 0.01 0.00 0.27 0.00 0.00 31.44 29.92 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 4.15 -3.27 -4.21 4.31 3.02 0.32 -4.99 115.26 114.59 1pco n ASN 46 Ca 0.20 -0.07 -0.18 0.00 -0.03 0.00 0.00 54.58 54.50 1pco n ASN 46 Cb 0.25 -2.37 -0.11 0.00 -0.61 0.00 0.00 39.78 36.94 1pco n ASN 46 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1pco s SER 47 N -2.74 1.83 0.23 6.41 0.01 -0.72 -4.91 113.70 113.81 1pco s SER 47 Ca 0.07 -0.76 -0.30 0.00 1.31 0.00 0.00 55.95 56.27 1pco s SER 47 Cb -0.03 -0.05 -0.09 0.00 0.21 0.00 0.00 66.02 66.06 1pco s SER 47 CO 0.08 -0.14 1.27 -1.61 0.41 0.00 0.00 173.24 173.25 1pco s GLU 48 N -2.44 4.42 0.02 12.44 2.02 -1.26 -1.16 118.70 132.75 1pco s GLU 48 Ca 0.05 2.04 0.01 0.00 0.02 0.00 0.00 54.97 57.09 1pco s GLU 48 Cb -0.06 -3.18 -0.02 0.00 0.10 0.00 0.00 34.13 30.98 1pco s GLU 48 CO 0.02 -0.17 -0.04 0.00 0.02 0.00 0.00 175.26 175.09 1pco s SER 50 N -1.24 6.41 0.09 0.00 0.01 -0.36 -2.44 113.70 116.17 1pco s SER 50 Ca -0.12 0.38 -0.13 0.00 1.31 0.00 0.00 55.95 57.39 1pco s SER 50 Cb -0.08 -2.55 -0.19 0.00 0.21 0.00 0.00 66.02 63.41 1pco s SER 50 CO -0.01 -1.46 1.26 0.00 0.41 0.00 0.00 173.24 173.45 1pco h ALA 51 N 10.01 0.24 -2.50 1.44 0.00 -1.90 -3.40 119.26 123.16 1pco h ALA 51 Ca -0.25 -0.63 -0.52 0.00 0.00 0.00 0.00 54.91 53.51 1pco h ALA 51 Cb 1.07 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1pco h ALA 51 CO 1.15 0.67 0.08 -0.59 0.00 0.00 0.00 179.25 180.56 1pco s PHE 52 N -3.59 3.59 0.05 0.00 -0.12 -1.26 -5.00 117.98 111.65 1pco s PHE 52 Ca -0.10 1.31 0.08 0.00 -0.05 0.00 0.00 56.93 58.16 1pco s PHE 52 Cb 0.08 -2.57 -0.03 0.00 -0.63 0.00 0.00 43.02 39.87 1pco s PHE 52 CO 0.91 0.30 -0.22 0.95 -0.05 0.00 0.00 175.22 177.12 1pco s THR 53 N -1.60 1.76 0.00 -4.49 -4.23 -1.26 -5.08 115.64 100.73 1pco s THR 53 Ca 0.44 -1.29 0.00 0.00 -1.18 0.00 0.00 61.69 59.66 1pco s THR 53 Cb -0.15 -1.53 0.00 0.00 1.34 0.00 0.00 72.50 72.15 1pco s THR 53 CO 0.20 0.19 0.00 0.00 -0.54 0.00 0.00 174.62 174.47 1pco n LEU 54 N 1.70 0.00 -3.34 4.79 -0.00 -1.26 -5.06 117.00 113.83 1pco n LEU 54 Ca -0.17 0.00 -0.26 0.00 -0.00 0.00 0.00 56.01 55.58 1pco n LEU 54 Cb 0.53 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.87 1pco n LEU 54 CO 0.23 0.00 -0.14 0.00 -0.00 0.00 0.00 177.39 177.48 1pco n TYR 55 N 0.00 1.39 -3.41 1.47 9.36 -1.26 -5.09 117.16 119.62 1pco n TYR 55 Ca 0.00 -3.82 0.00 0.00 3.32 0.00 0.00 57.90 57.40 1pco n TYR 55 Cb 0.00 -0.40 0.00 0.00 -0.63 0.00 0.00 39.34 38.31 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 1.32 -0.53 3.80 2.98 0.00 -1.26 -4.86 105.19 106.64 1pco n GLY 56 Ca 0.25 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 45.07 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 -3.03 4.20 0.22 1.61 1.01 -1.26 -3.39 120.40 119.75 1pco s VAL 57 Ca 0.00 1.61 0.09 0.00 0.00 0.00 0.00 61.98 63.68 1pco s VAL 57 Cb 0.00 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1pco s VAL 57 CO 0.00 -0.07 -0.18 -0.31 0.00 0.00 0.00 175.10 174.55 1pco s TYR 58 N -1.85 1.94 -0.25 5.22 2.02 -0.33 -4.89 117.35 119.22 1pco s TYR 58 Ca 0.56 -0.46 0.20 0.00 -0.37 0.00 0.00 57.07 57.00 1pco s TYR 58 Cb -0.15 -0.90 0.06 0.00 -0.40 0.00 0.00 41.96 40.57 1pco s TYR 58 CO 0.20 0.46 1.19 1.88 -1.57 0.00 0.00 175.55 177.72 1pco h TYR 59 N 2.69 0.00 -2.93 2.71 0.05 -1.86 0.79 116.97 118.42 1pco h TYR 59 Ca -0.40 0.00 -0.22 0.00 0.05 0.00 0.00 58.73 58.16 1pco h TYR 59 Cb 1.23 0.00 -0.32 0.00 1.01 0.00 0.00 36.73 38.65 1pco h TYR 59 CO 0.73 0.19 -0.53 0.15 -1.05 0.00 0.00 178.16 177.65 1pco s LYS 60 N -3.18 0.15 0.27 4.88 -0.14 -1.26 -4.83 119.74 115.63 1pco s LYS 60 Ca 0.01 0.67 -0.31 0.00 -1.36 0.00 0.00 55.97 54.99 1pco s LYS 60 Cb 0.08 -0.08 -0.12 0.00 -1.68 0.00 0.00 37.83 36.03 1pco s LYS 60 CO 0.76 -0.25 1.59 0.00 -0.76 0.00 0.00 175.35 176.69 1pco n PRO 62 N 2.48 1.12 -1.41 0.00 -0.02 -1.26 -3.82 135.00 132.08 1pco n PRO 62 Ca 0.10 -1.30 0.17 0.00 -2.02 0.00 0.00 63.50 60.46 1pco n PRO 62 Cb 0.35 -2.51 -0.08 0.00 -0.02 0.00 0.00 33.50 31.25 1pco n PRO 62 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pco s GLU 64 N -3.96 2.45 -0.13 0.00 -1.05 -0.48 -4.47 118.70 111.07 1pco s GLU 64 Ca 0.00 0.38 -0.29 0.00 -0.15 0.00 0.00 54.97 54.91 1pco s GLU 64 Cb 0.00 -1.98 -0.06 0.00 -0.44 0.00 0.00 34.13 31.65 1pco s GLU 64 CO 0.00 -1.31 1.92 0.50 0.95 0.00 0.00 175.26 177.33 1pco s ARG 65 N -5.39 3.71 0.00 -4.83 6.06 -1.26 -2.49 118.95 114.75 1pco s ARG 65 Ca 0.60 2.11 0.00 0.00 -2.50 0.00 0.00 55.73 55.94 1pco s ARG 65 Cb -0.12 -4.18 0.00 0.00 0.06 0.00 0.00 34.95 30.71 1pco s ARG 65 CO 0.51 -1.42 0.00 0.41 -2.50 0.00 0.00 175.30 172.30 1pco n GLY 66 N 4.95 2.53 3.92 8.12 0.00 -1.24 -5.11 105.19 118.35 1pco n GLY 66 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 4.30 0.06 0.99 1.02 -1.04 -3.30 118.68 120.71 1pco s LEU 67 Ca 0.00 0.37 0.00 0.00 0.02 0.00 0.00 54.13 54.52 1pco s LEU 67 Cb 0.00 -3.10 -0.04 0.00 0.02 0.00 0.00 46.19 43.07 1pco s LEU 67 CO 0.00 0.07 0.20 0.28 0.02 0.00 0.00 176.35 176.92 1pco s THR 68 N -1.67 5.35 -0.26 5.49 -1.32 0.22 -4.80 115.64 118.65 1pco s THR 68 Ca 0.37 -0.40 -0.18 0.00 -1.21 0.00 0.00 61.69 60.28 1pco s THR 68 Cb -0.12 -3.61 -0.03 0.00 -1.51 0.00 0.00 72.50 67.24 1pco s THR 68 CO 0.27 0.15 0.50 0.00 -2.21 0.00 0.00 174.62 173.33 1pco s GLU 70 N 2.29 4.13 -1.41 0.00 2.12 0.18 -4.82 118.70 121.19 1pco s GLU 70 Ca 0.21 -2.89 -0.12 0.00 0.36 0.00 0.00 54.97 52.52 1pco s GLU 70 Cb -0.16 -4.80 0.07 0.00 0.26 0.00 0.00 34.13 29.51 1pco s GLU 70 CO 0.09 -1.50 2.16 0.41 -0.54 0.00 0.00 175.26 175.89 1pco n GLY 71 N 3.42 4.53 0.14 -1.50 0.00 -1.26 -2.81 105.19 107.71 1pco n GLY 71 Ca 0.30 -1.74 -0.17 0.00 0.00 0.00 0.00 46.02 44.40 1pco n GLY 71 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pco h ASP 72 N 5.86 0.53 -3.19 1.61 3.32 -1.93 -3.44 116.42 119.17 1pco h ASP 72 Ca 0.54 -0.76 -0.48 0.00 0.02 0.00 0.00 57.03 56.34 1pco h ASP 72 Cb 0.62 -0.16 -0.40 0.00 0.22 0.00 0.00 39.33 39.60 1pco h ASP 72 CO 1.80 1.22 -0.76 -0.75 -1.72 0.00 0.00 179.24 179.04 1pco s LYS 73 N -3.19 0.38 0.35 3.56 2.36 -1.26 -5.01 119.74 116.92 1pco s LYS 73 Ca -0.13 -0.19 0.00 0.00 -2.55 0.00 0.00 55.97 53.10 1pco s LYS 73 Cb 0.03 -1.78 0.00 0.00 -1.05 0.00 0.00 37.83 35.03 1pco s LYS 73 CO 0.82 -0.60 0.00 0.45 1.55 0.00 0.00 175.35 177.58 1pco n SER 74 N 5.16 -2.70 -2.93 1.43 2.88 -1.26 -4.04 113.62 112.16 1pco n SER 74 Ca -0.08 0.66 -0.10 0.00 -1.33 0.00 0.00 58.87 58.02 1pco n SER 74 Cb 0.48 2.62 0.01 0.00 -0.75 0.00 0.00 64.21 66.57 1pco n SER 74 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1pco n LEU 75 N -3.28 -7.00 0.00 2.46 7.99 -1.26 -4.40 117.00 111.51 1pco n LEU 75 Ca 0.00 0.64 0.00 0.00 -0.01 0.00 0.00 56.01 56.64 1pco n LEU 75 Cb 0.00 -3.05 0.00 0.00 -0.11 0.00 0.00 43.42 40.26 1pco n LEU 75 CO 0.00 -2.18 0.00 0.55 -1.51 0.00 0.00 177.39 174.25 1pco n VAL 76 N 0.02 0.00 -2.15 4.08 3.14 -1.26 -4.70 118.33 117.46 1pco n VAL 76 Ca 0.06 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.35 1pco n VAL 76 Cb 0.39 0.00 -0.00 0.00 -1.06 0.00 0.00 33.84 33.17 1pco n VAL 76 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1pco n GLY 77 N 0.00 0.02 0.26 7.55 0.00 -1.26 -5.00 105.19 106.77 1pco n GLY 77 Ca 0.00 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.36 1pco n GLY 77 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1pco h SER 78 N 0.00 0.99 -2.22 1.61 0.87 -1.96 -3.32 113.55 109.52 1pco h SER 78 Ca -0.20 -0.46 -0.60 0.00 -1.23 0.00 0.00 61.79 59.29 1pco h SER 78 Cb 1.15 -0.28 -0.42 0.00 -0.44 0.00 0.00 62.40 62.41 1pco h SER 78 CO 0.24 1.26 -0.56 0.00 -0.53 0.00 0.00 176.83 177.25 1pco n ILE 79 N -4.05 2.57 -1.33 2.23 0.13 -1.26 -4.93 119.36 112.72 1pco n ILE 79 Ca -0.02 -5.30 0.00 0.00 -1.10 0.00 0.00 62.75 56.32 1pco n ILE 79 Cb 0.56 -1.99 0.00 0.00 -0.84 0.00 0.00 39.64 37.36 1pco n ILE 79 CO 0.00 0.00 0.00 1.07 2.80 0.00 0.00 176.55 180.42 1pco n THR 80 N 0.69 0.00 -3.31 9.51 5.66 -1.25 -5.06 114.28 120.52 1pco n THR 80 Ca 0.30 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 61.16 1pco n THR 80 Cb 0.40 -0.52 -0.06 0.00 -1.55 0.00 0.00 70.33 68.61 1pco n THR 80 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1pco s ASN 81 N 0.00 0.61 -1.10 1.09 3.84 -1.26 -5.00 114.94 113.11 1pco s ASN 81 Ca 0.00 -1.56 -0.05 0.00 0.21 0.00 0.00 52.86 51.46 1pco s ASN 81 Cb 0.00 0.80 0.29 0.00 -0.55 0.00 0.00 41.25 41.80 1pco s ASN 81 CO 0.00 -0.23 1.45 0.35 -2.79 0.00 0.00 177.10 175.89 1pco n THR 82 N 4.10 5.15 -3.67 -5.21 -2.24 -1.26 -4.71 114.28 106.44 1pco n THR 82 Ca 0.13 -5.74 -0.15 0.00 -2.27 0.00 0.00 64.05 56.02 1pco n THR 82 Cb 0.48 -2.18 -0.15 0.00 -2.10 0.00 0.00 70.33 66.38 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 -1.06 0.50 0.20 3.42 2.47 -1.26 -5.18 114.94 114.03 1pco s ASN 83 Ca 0.32 0.43 0.06 0.00 0.42 0.00 0.00 52.86 54.09 1pco s ASN 83 Cb 0.03 0.42 -0.05 0.00 -1.45 0.00 0.00 41.25 40.20 1pco s ASN 83 CO 0.07 -0.23 -0.11 -0.36 -3.72 0.00 0.00 177.10 172.75 1pco s PHE 84 N 2.20 1.62 0.75 0.43 0.08 -1.26 -4.08 117.98 117.73 1pco s PHE 84 Ca 0.01 -0.67 -0.12 0.00 0.12 0.00 0.00 56.93 56.27 1pco s PHE 84 Cb -0.12 -0.81 0.05 0.00 -0.57 0.00 0.00 43.02 41.57 1pco s PHE 84 CO -0.07 0.25 1.12 0.20 -0.10 0.00 0.00 175.22 176.62 1pco s GLY 85 N -3.30 1.93 -0.09 4.36 0.00 -1.02 -4.72 107.32 104.48 1pco s GLY 85 Ca 0.22 0.49 -0.03 0.00 0.00 0.00 0.00 44.72 45.40 1pco s GLY 85 CO 0.06 0.86 0.05 -0.42 0.00 0.00 0.00 173.10 173.65 1pco s ILE 86 N -2.56 4.73 -0.06 0.90 -1.09 -1.12 -0.25 121.20 121.74 1pco s ILE 86 Ca 0.66 -0.11 -0.30 0.00 -2.23 0.00 0.00 60.65 58.67 1pco s ILE 86 Cb -0.21 -3.03 -0.04 0.00 -1.58 0.00 0.00 42.46 37.61 1pco s ILE 86 CO 0.50 0.59 1.37 0.00 -1.23 0.00 0.00 174.94 176.17 1pco s HIS 88 N 2.93 0.94 -0.18 0.00 3.76 -0.42 -0.52 115.29 121.81 1pco s HIS 88 Ca 0.61 -0.53 -0.16 0.00 -0.15 0.00 0.00 55.06 54.84 1pco s HIS 88 Cb -0.28 -0.54 -0.04 0.00 1.11 0.00 0.00 32.58 32.83 1pco s HIS 88 CO 0.23 -0.02 0.39 1.21 -0.85 0.00 0.00 174.74 175.69 1pco s ASN 89 N -1.85 6.48 0.00 1.40 2.47 -1.26 -0.61 114.94 121.57 1pco s ASN 89 Ca -0.03 0.57 0.00 0.00 0.42 0.00 0.00 52.86 53.81 1pco s ASN 89 Cb -0.08 -2.23 0.00 0.00 -1.45 0.00 0.00 41.25 37.49 1pco s ASN 89 CO 0.01 -0.02 0.00 0.55 -3.72 0.00 0.00 177.10 173.92 1pco n VAL 90 N 4.03 0.00 0.00 -5.21 3.14 -1.26 -4.99 118.33 114.05 1pco n VAL 90 Ca -0.09 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 1pco n VAL 90 Cb 0.51 0.24 0.00 0.00 -1.06 0.00 0.00 33.84 33.53 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 0.00 2.10 0.00 7.55 0.00 -1.21 -4.78 105.19 108.85 1pco n GLY 91 Ca 0.00 -0.32 0.08 0.00 0.00 0.00 0.00 46.02 45.77 1pco n GLY 91 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1pco n ARG 92 N 0.00 0.16 0.00 1.61 0.63 -1.26 -4.91 116.66 112.88 1pco n ARG 92 Ca 0.00 0.17 0.05 0.00 -0.92 0.00 0.00 57.85 57.15 1pco n ARG 92 Cb 0.00 -1.50 0.05 0.00 0.45 0.00 0.00 32.46 31.46 1pco n ARG 92 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57