#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 2.73 -0.29 1.45 0.02 -1.26 -4.33 135.00 133.32 1pco s PRO 2 Ca 0.00 -0.42 -0.03 0.00 0.02 0.00 0.00 61.00 60.57 1pco s PRO 2 Cb 0.00 -5.11 0.00 0.00 0.02 0.00 0.00 34.50 29.42 1pco s PRO 2 CO 0.00 -3.18 0.11 -3.47 -0.33 0.00 0.00 177.00 170.14 1pco n ASP 3 N 13.11 -7.20 0.06 2.53 -0.08 -1.26 -4.94 116.55 118.77 1pco n ASP 3 Ca 0.39 1.08 0.21 0.00 -1.51 0.00 0.00 54.79 54.95 1pco n ASP 3 Cb 0.48 -4.77 0.74 0.00 2.34 0.00 0.00 41.12 39.91 1pco n ASP 3 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1pco h PRO 4 N 2.44 0.00 -2.91 -0.67 0.11 -2.11 -3.48 132.00 125.37 1pco h PRO 4 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1pco h PRO 4 Cb 0.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.29 1pco h PRO 4 CO 0.10 0.00 -0.29 -2.13 -0.21 0.00 0.00 178.00 175.48 1pco n ARG 5 N -3.92 -1.22 -3.30 1.05 0.00 -1.26 -5.05 116.66 102.96 1pco n ARG 5 Ca 0.08 1.27 -0.26 0.00 -0.00 0.00 0.00 57.85 58.95 1pco n ARG 5 Cb 0.61 -1.67 -0.07 0.00 0.00 0.00 0.00 32.46 31.33 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 0.43 4.21 3.09 5.14 0.00 -1.26 -5.01 105.19 111.79 1pco n GLY 6 Ca -0.03 -2.35 -0.35 0.00 0.00 0.00 0.00 46.02 43.28 1pco n GLY 6 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pco s ILE 7 N -2.21 4.23 0.00 -0.61 -1.09 -1.26 -5.04 121.20 115.22 1pco s ILE 7 Ca 0.39 -3.91 0.00 0.00 -2.23 0.00 0.00 60.65 54.90 1pco s ILE 7 Cb 0.17 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.42 1pco s ILE 7 CO -0.05 -1.08 0.00 2.30 -1.23 0.00 0.00 174.94 174.88 1pco n ILE 8 N 2.30 0.00 -4.33 2.92 -6.64 -1.26 -4.76 119.36 107.59 1pco n ILE 8 Ca 0.21 0.00 -0.29 0.00 -1.77 0.00 0.00 62.75 60.90 1pco n ILE 8 Cb 0.37 0.00 -0.05 0.00 -1.44 0.00 0.00 39.64 38.52 1pco n ILE 8 CO 0.00 0.00 0.00 0.27 -1.77 0.00 0.00 176.55 175.05 1pco s ILE 9 N 0.00 1.52 0.00 7.28 -4.36 -1.26 -4.99 121.20 119.39 1pco s ILE 9 Ca 0.00 -1.76 0.00 0.00 -0.26 0.00 0.00 60.65 58.63 1pco s ILE 9 Cb 0.00 -2.28 0.00 0.00 1.25 0.00 0.00 42.46 41.43 1pco s ILE 9 CO 0.00 0.00 0.00 -0.46 0.24 0.00 0.00 174.94 174.72 1pco n ASN 10 N -1.45 -1.92 -4.25 4.36 0.23 0.12 -5.02 115.26 107.34 1pco n ASN 10 Ca -0.10 0.00 -0.15 0.00 -0.53 0.00 0.00 54.58 53.80 1pco n ASN 10 Cb 0.66 -0.96 -0.10 0.00 -2.08 0.00 0.00 39.78 37.29 1pco n ASN 10 CO 0.00 0.00 0.00 -1.48 -0.93 0.00 0.00 177.26 174.85 1pco s LEU 11 N -0.87 2.51 0.71 -4.53 0.05 -1.09 -4.69 118.68 110.77 1pco s LEU 11 Ca 0.00 -0.97 -0.11 0.00 0.05 0.00 0.00 54.13 53.10 1pco s LEU 11 Cb 0.00 -0.41 0.02 0.00 -2.05 0.00 0.00 46.19 43.76 1pco s LEU 11 CO 0.00 -0.28 1.09 -1.81 -0.55 0.00 0.00 176.35 174.80 1pco s ASP 12 N -3.04 5.32 -0.09 1.48 1.11 -1.26 -0.55 116.67 119.64 1pco s ASP 12 Ca 0.15 1.05 -0.30 0.00 0.18 0.00 0.00 52.55 53.64 1pco s ASP 12 Cb 0.01 -1.82 -0.02 0.00 1.07 0.00 0.00 42.92 42.16 1pco s ASP 12 CO 0.02 -1.40 1.20 -1.83 1.18 0.00 0.00 175.17 174.33 1pco s GLU 13 N -5.36 4.32 0.00 8.23 1.03 -1.26 -4.00 118.70 121.65 1pco s GLU 13 Ca 0.58 1.64 0.00 0.00 0.03 0.00 0.00 54.97 57.22 1pco s GLU 13 Cb -0.11 -3.61 0.00 0.00 -0.80 0.00 0.00 34.13 29.61 1pco s GLU 13 CO 0.51 -0.51 0.00 0.41 -1.33 0.00 0.00 175.26 174.34 1pco n GLY 14 N 3.41 0.16 3.40 -3.83 0.00 -0.06 -4.93 105.19 103.35 1pco n GLY 14 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 1.46 0.25 1.61 0.41 -1.26 -4.90 118.70 116.28 1pco s GLU 15 Ca 0.00 -1.53 -0.30 0.00 -0.41 0.00 0.00 54.97 52.74 1pco s GLU 15 Cb 0.00 -1.66 -0.09 0.00 -1.78 0.00 0.00 34.13 30.60 1pco s GLU 15 CO 0.00 0.34 1.22 -1.17 -0.49 0.00 0.00 175.26 175.16 1pco s LEU 16 N -2.81 4.47 0.43 1.80 0.20 -1.26 -1.24 118.68 120.28 1pco s LEU 16 Ca 0.21 2.39 0.03 0.00 0.69 0.00 0.00 54.13 57.45 1pco s LEU 16 Cb -0.07 -3.62 -0.03 0.00 -0.43 0.00 0.00 46.19 42.04 1pco s LEU 16 CO 0.09 -0.37 0.07 0.00 -0.29 0.00 0.00 176.35 175.85 1pco n LEU 18 N -1.00 0.00 0.00 0.00 4.32 -1.26 -4.89 117.00 114.16 1pco n LEU 18 Ca -0.10 0.00 -0.19 0.00 -0.02 0.00 0.00 56.01 55.70 1pco n LEU 18 Cb 0.66 -0.10 0.08 0.00 -1.62 0.00 0.00 43.42 42.44 1pco n LEU 18 CO 0.38 -0.21 0.41 -0.46 -1.22 0.00 0.00 177.39 176.30 1pco n ASN 19 N -1.77 1.54 0.13 -1.43 0.23 -1.26 -4.48 115.26 108.23 1pco n ASN 19 Ca 0.00 -2.19 0.12 0.00 -0.53 0.00 0.00 54.58 51.97 1pco n ASN 19 Cb 0.00 -0.48 0.07 0.00 -2.08 0.00 0.00 39.78 37.29 1pco n ASN 19 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1pco h SER 20 N -0.23 0.00 0.00 0.53 0.02 -1.85 -3.37 113.55 108.65 1pco h SER 20 Ca -0.27 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 1pco h SER 20 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1pco h SER 20 CO 0.33 0.01 0.00 0.00 -1.14 0.00 0.00 176.83 176.03 1pco n ALA 21 N -2.12 2.34 -0.03 3.77 0.00 -1.26 -3.43 120.51 119.77 1pco n ALA 21 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.42 1pco n ALA 21 Cb 0.53 -1.00 -0.13 0.00 0.00 0.00 0.00 19.45 18.85 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 -0.28 0.65 -1.92 0.00 6.02 -1.26 -4.72 117.38 115.87 1pco n GLN 22 Ca 0.00 0.09 -0.29 0.00 -0.01 0.00 0.00 57.00 56.79 1pco n GLN 22 Cb 0.08 -1.66 0.06 0.00 1.02 0.00 0.00 30.24 29.75 1pco n GLN 22 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1pco h LYS 24 N -0.78 -0.80 -6.05 0.00 1.57 -1.10 -3.36 116.57 106.05 1pco h LYS 24 Ca -0.45 0.05 -0.57 0.00 -1.87 0.00 0.00 60.65 57.81 1pco h LYS 24 Cb 1.28 0.18 -0.10 0.00 0.08 0.00 0.00 32.23 33.67 1pco h LYS 24 CO 0.64 -0.52 0.88 -1.54 -0.57 0.00 0.00 179.45 178.34 1pco s SER 25 N -4.61 6.17 -1.16 0.86 1.04 -1.26 -4.95 113.70 109.79 1pco s SER 25 Ca -0.12 -0.62 -0.23 0.00 0.48 0.00 0.00 55.95 55.45 1pco s SER 25 Cb 0.01 -2.51 -0.11 0.00 0.10 0.00 0.00 66.02 63.51 1pco s SER 25 CO 0.38 -1.70 1.96 -0.46 0.98 0.00 0.00 173.24 174.39 1pco n ASN 26 N 8.80 2.84 -3.40 7.02 6.94 -1.26 -4.79 115.26 131.40 1pco n ASN 26 Ca 0.01 -2.67 -0.19 0.00 -0.02 0.00 0.00 54.58 51.70 1pco n ASN 26 Cb 0.48 -1.72 -0.10 0.00 -2.36 0.00 0.00 39.78 36.08 1pco n ASN 26 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1pco s GLN 29 N 1.58 3.99 0.78 0.00 2.00 0.90 -1.26 119.66 127.65 1pco s GLN 29 Ca 0.19 1.33 -0.14 0.00 -2.00 0.00 0.00 55.36 54.75 1pco s GLN 29 Cb -0.15 -2.21 0.07 0.00 0.80 0.00 0.00 33.01 31.52 1pco s GLN 29 CO 0.09 -0.27 1.20 -1.58 -0.50 0.00 0.00 175.29 174.23 1pco s HIS 30 N -1.96 1.90 -0.22 1.67 5.04 -1.02 -2.32 115.29 118.37 1pco s HIS 30 Ca 0.64 1.65 0.11 0.00 -1.54 0.00 0.00 55.06 55.91 1pco s HIS 30 Cb -0.16 -3.47 -0.21 0.00 0.04 0.00 0.00 32.58 28.78 1pco s HIS 30 CO 0.20 -2.76 -0.06 -0.40 -2.34 0.00 0.00 174.74 169.38 1pco n ASP 31 N -3.13 0.99 -0.08 9.88 5.68 -1.05 -2.81 116.55 126.04 1pco n ASP 31 Ca 0.13 -0.06 -0.12 0.00 -0.50 0.00 0.00 54.79 54.24 1pco n ASP 31 Cb 0.50 0.38 -0.06 0.00 -1.14 0.00 0.00 41.12 40.81 1pco n ASP 31 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 1pco h THR 32 N 0.00 0.44 0.04 2.12 2.02 -1.97 -3.36 112.91 112.21 1pco h THR 32 Ca -0.54 -1.54 -0.00 0.00 0.77 0.00 0.00 66.41 65.09 1pco h THR 32 Cb 2.06 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 69.52 1pco h THR 32 CO -0.02 0.15 -0.02 0.16 0.37 0.00 0.00 175.52 176.16 1pco h ILE 33 N -1.00 1.22 -3.71 3.11 3.07 -1.98 -3.42 117.51 114.81 1pco h ILE 33 Ca -0.15 -1.67 -0.64 0.00 1.55 0.00 0.00 64.86 63.95 1pco h ILE 33 Cb 0.84 2.21 -0.15 0.00 -0.27 0.00 0.00 36.82 39.44 1pco h ILE 33 CO -0.09 0.38 -0.24 -0.22 -1.05 0.00 0.00 178.15 176.93 1pco s LEU 34 N -8.60 4.14 -1.29 0.16 0.20 -1.26 -5.04 118.68 106.99 1pco s LEU 34 Ca -0.14 0.16 -0.06 0.00 0.69 0.00 0.00 54.13 54.79 1pco s LEU 34 Cb -0.01 -2.42 0.15 0.00 -0.43 0.00 0.00 46.19 43.48 1pco s LEU 34 CO 0.53 -0.23 2.24 -1.54 -0.29 0.00 0.00 176.35 177.05 1pco n SER 35 N 5.37 7.53 -3.16 3.68 3.41 -1.26 -2.53 113.62 126.67 1pco n SER 35 Ca -0.08 -3.19 0.05 0.00 -0.26 0.00 0.00 58.87 55.39 1pco n SER 35 Cb 0.50 -1.36 -0.02 0.00 -0.26 0.00 0.00 64.21 63.08 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 -2.05 -0.43 -0.23 1.04 2.96 -1.12 -4.97 118.68 113.87 1pco s LEU 36 Ca 0.50 0.29 -0.19 0.00 -0.22 0.00 0.00 54.13 54.51 1pco s LEU 36 Cb 0.17 1.37 -0.03 0.00 0.50 0.00 0.00 46.19 48.20 1pco s LEU 36 CO -0.08 -0.08 0.56 -0.44 -1.32 0.00 0.00 176.35 174.99 1pco s SER 37 N 2.92 6.55 0.03 3.68 0.01 -1.14 -4.60 113.70 121.15 1pco s SER 37 Ca -0.02 0.66 0.02 0.00 1.31 0.00 0.00 55.95 57.92 1pco s SER 37 Cb -0.10 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.81 1pco s SER 37 CO -0.11 -0.26 -0.07 -0.60 0.41 0.00 0.00 173.24 172.61 1pco s ARG 38 N 2.04 0.47 0.26 12.44 6.06 -0.98 -2.53 118.95 136.71 1pco s ARG 38 Ca 0.24 -0.59 -0.30 0.00 -2.50 0.00 0.00 55.73 52.59 1pco s ARG 38 Cb -0.16 -0.27 -0.10 0.00 0.06 0.00 0.00 34.95 34.48 1pco s ARG 38 CO 0.09 0.05 1.42 0.00 -2.50 0.00 0.00 175.30 174.37 1pco n ALA 40 N 2.16 0.44 -2.39 0.00 0.00 -0.23 -0.88 120.51 119.60 1pco n ALA 40 Ca 0.06 -1.42 -0.25 0.00 0.00 0.00 0.00 53.44 51.84 1pco n ALA 40 Cb 0.40 1.02 0.00 0.00 0.00 0.00 0.00 19.45 20.88 1pco n ALA 40 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1pco s LEU 41 N 0.00 3.72 0.45 0.00 2.34 -1.26 -4.64 118.68 119.29 1pco s LEU 41 Ca 0.19 0.53 -0.16 0.00 0.06 0.00 0.00 54.13 54.75 1pco s LEU 41 Cb 0.01 -3.42 -0.08 0.00 -0.56 0.00 0.00 46.19 42.14 1pco s LEU 41 CO 0.14 -0.58 0.91 -0.54 -1.06 0.00 0.00 176.35 175.22 1pco s LYS 42 N -4.57 3.98 0.62 1.48 1.02 -1.26 -4.72 119.74 116.29 1pco s LYS 42 Ca 0.46 0.87 -0.12 0.00 0.02 0.00 0.00 55.97 57.19 1pco s LYS 42 Cb -0.10 -2.23 -0.03 0.00 -0.52 0.00 0.00 37.83 34.95 1pco s LYS 42 CO 0.40 -0.13 1.03 0.00 -0.92 0.00 0.00 175.35 175.73 1pco s ALA 43 N -2.41 2.98 0.46 5.17 0.00 -0.35 -4.65 121.76 122.96 1pco s ALA 43 Ca 0.58 0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.60 1pco s ALA 43 Cb -0.10 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 1pco s ALA 43 CO 0.26 -0.75 0.07 1.03 0.00 0.00 0.00 175.76 176.36 1pco s ARG 44 N -4.91 2.12 0.17 0.00 0.52 -1.26 -2.12 118.95 113.47 1pco s ARG 44 Ca 0.57 -2.18 -0.33 0.00 -0.52 0.00 0.00 55.73 53.26 1pco s ARG 44 Cb -0.12 -1.69 -0.16 0.00 0.52 0.00 0.00 34.95 33.51 1pco s ARG 44 CO 0.50 -0.24 1.20 -1.91 0.02 0.00 0.00 175.30 174.87 1pco n GLU 45 N -1.20 1.24 -1.14 3.54 2.13 -1.26 -2.24 120.64 121.71 1pco n GLU 45 Ca -0.10 0.44 -0.05 0.00 0.66 0.00 0.00 57.16 58.11 1pco n GLU 45 Cb 0.66 -1.97 -0.02 0.00 0.27 0.00 0.00 31.44 30.38 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 -4.16 -4.58 4.31 4.13 -0.70 -4.97 115.26 111.38 1pco n ASN 46 Ca 0.15 0.12 -0.28 0.00 1.68 0.00 0.00 54.58 56.25 1pco n ASN 46 Cb 0.25 -2.08 -0.09 0.00 -1.54 0.00 0.00 39.78 36.31 1pco n ASN 46 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1pco s SER 47 N -2.50 4.32 0.29 6.41 0.15 -0.95 -4.90 113.70 116.52 1pco s SER 47 Ca 0.00 -0.50 -0.29 0.00 0.70 0.00 0.00 55.95 55.86 1pco s SER 47 Cb 0.00 -0.77 -0.10 0.00 -1.71 0.00 0.00 66.02 63.43 1pco s SER 47 CO 0.00 0.13 1.43 -1.61 1.20 0.00 0.00 173.24 174.39 1pco s GLU 48 N -2.58 4.26 0.01 5.44 2.02 -1.26 -1.52 118.70 125.07 1pco s GLU 48 Ca 0.23 2.34 0.02 0.00 0.02 0.00 0.00 54.97 57.58 1pco s GLU 48 Cb -0.10 -3.07 -0.01 0.00 0.10 0.00 0.00 34.13 31.05 1pco s GLU 48 CO 0.15 -0.39 -0.06 0.00 0.02 0.00 0.00 175.26 174.97 1pco s SER 50 N -0.59 5.98 -0.04 0.00 0.01 0.07 -1.67 113.70 117.46 1pco s SER 50 Ca -0.02 -0.33 -0.24 0.00 1.31 0.00 0.00 55.95 56.67 1pco s SER 50 Cb -0.05 -2.55 -0.23 0.00 0.21 0.00 0.00 66.02 63.40 1pco s SER 50 CO -0.00 -1.95 1.04 0.00 0.41 0.00 0.00 173.24 172.74 1pco h ALA 51 N 11.04 0.04 0.20 1.44 0.00 -1.90 -3.38 119.26 126.70 1pco h ALA 51 Ca -0.25 -0.48 -0.32 0.00 0.00 0.00 0.00 54.91 53.86 1pco h ALA 51 Cb 1.07 0.02 0.04 0.00 0.00 0.00 0.00 17.79 18.91 1pco h ALA 51 CO 1.27 0.12 -1.36 0.27 0.00 0.00 0.00 179.25 179.55 1pco h PHE 52 N -0.44 0.98 -3.42 0.00 -5.15 -1.91 -3.49 116.94 103.51 1pco h PHE 52 Ca -0.04 -0.68 0.35 0.00 -0.20 0.00 0.00 57.97 57.40 1pco h PHE 52 Cb 1.04 -0.05 -0.17 0.00 0.22 0.00 0.00 35.95 36.99 1pco h PHE 52 CO 0.17 1.52 -1.10 0.25 -2.00 0.00 0.00 178.31 177.15 1pco n THR 53 N -3.77 -0.55 -3.65 0.88 -2.24 -1.26 -5.09 114.28 98.60 1pco n THR 53 Ca -0.16 0.75 0.00 0.00 -2.27 0.00 0.00 64.05 62.37 1pco n THR 53 Cb 1.05 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1pco n THR 53 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pco n LEU 54 N -4.30 0.00 -3.89 3.22 -0.00 -1.26 -5.05 117.00 105.72 1pco n LEU 54 Ca -0.07 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.51 1pco n LEU 54 Cb 0.68 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 44.10 1pco n LEU 54 CO 0.03 0.00 1.50 0.00 -0.00 0.00 0.00 177.39 178.92 1pco n TYR 55 N 0.00 2.50 -3.10 1.47 9.36 -1.26 -4.94 117.16 121.19 1pco n TYR 55 Ca 0.00 -2.64 0.00 0.00 3.32 0.00 0.00 57.90 58.58 1pco n TYR 55 Cb 0.00 -1.49 0.00 0.00 -0.63 0.00 0.00 39.34 37.22 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 1.64 -0.96 3.79 2.98 0.00 -1.26 -4.82 105.19 106.56 1pco n GLY 56 Ca 0.35 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 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 -3.00 4.04 -0.09 1.61 1.01 -1.26 -2.99 120.40 119.72 1pco s VAL 57 Ca 0.00 1.51 -0.00 0.00 0.00 0.00 0.00 61.98 63.49 1pco s VAL 57 Cb 0.00 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1pco s VAL 57 CO 0.00 -0.04 -0.07 -0.31 0.00 0.00 0.00 175.10 174.69 1pco s TYR 58 N -1.78 2.95 0.07 5.22 2.02 -0.39 -4.94 117.35 120.50 1pco s TYR 58 Ca 0.57 -0.09 -0.26 0.00 -0.37 0.00 0.00 57.07 56.91 1pco s TYR 58 Cb -0.18 -1.78 -0.17 0.00 -0.40 0.00 0.00 41.96 39.44 1pco s TYR 58 CO 0.22 0.21 1.62 1.88 -1.57 0.00 0.00 175.55 177.91 1pco h TYR 59 N 5.68 -0.30 -2.95 2.71 -1.99 -1.96 -2.72 116.97 115.43 1pco h TYR 59 Ca -0.43 -0.01 -0.45 0.00 2.00 0.00 0.00 58.73 59.85 1pco h TYR 59 Cb 1.18 0.10 -0.40 0.00 2.00 0.00 0.00 36.73 39.61 1pco h TYR 59 CO 0.56 -0.13 -0.74 0.15 -0.00 0.00 0.00 178.16 178.00 1pco s LYS 60 N -5.84 0.09 0.84 4.88 3.01 -1.26 -4.72 119.74 116.74 1pco s LYS 60 Ca -0.15 -0.08 -0.15 0.00 -1.01 0.00 0.00 55.97 54.58 1pco s LYS 60 Cb 0.04 -1.69 -0.04 0.00 -1.01 0.00 0.00 37.83 35.14 1pco s LYS 60 CO 0.64 -0.70 0.21 0.00 0.51 0.00 0.00 175.35 176.00 1pco s PRO 62 N -2.83 -1.44 0.50 0.00 0.04 -1.26 -3.39 135.00 126.62 1pco s PRO 62 Ca 0.57 0.76 -0.20 0.00 0.04 0.00 0.00 61.00 62.17 1pco s PRO 62 Cb -0.28 -1.50 -0.08 0.00 0.04 0.00 0.00 34.50 32.69 1pco s PRO 62 CO 0.66 -4.05 1.07 0.00 0.04 0.00 0.00 177.00 174.73 1pco s GLU 64 N -3.20 0.03 -0.16 0.00 1.03 -0.90 -4.79 118.70 110.71 1pco s GLU 64 Ca 0.69 0.31 -0.29 0.00 0.03 0.00 0.00 54.97 55.71 1pco s GLU 64 Cb -0.19 -1.71 -0.07 0.00 -0.80 0.00 0.00 34.13 31.36 1pco s GLU 64 CO 0.23 -2.96 2.15 -2.13 -1.33 0.00 0.00 175.26 171.22 1pco n ARG 65 N -4.30 2.12 0.00 -4.83 0.63 -1.26 -2.09 116.66 106.93 1pco n ARG 65 Ca 0.07 0.65 0.00 0.00 -0.92 0.00 0.00 57.85 57.65 1pco n ARG 65 Cb 0.58 -3.09 0.00 0.00 0.45 0.00 0.00 32.46 30.40 1pco n ARG 65 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1pco n GLY 66 N 5.48 2.42 3.61 5.14 0.00 -1.26 -5.12 105.19 115.46 1pco n GLY 66 Ca 0.28 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 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 3.17 0.14 0.99 1.02 -0.89 -4.61 118.68 118.51 1pco s LEU 67 Ca 0.00 -0.29 0.06 0.00 0.02 0.00 0.00 54.13 53.92 1pco s LEU 67 Cb 0.00 -1.92 -0.04 0.00 0.02 0.00 0.00 46.19 44.25 1pco s LEU 67 CO 0.00 0.20 0.03 0.28 0.02 0.00 0.00 176.35 176.88 1pco s THR 68 N -1.19 4.01 -0.22 5.49 -1.32 0.31 -4.55 115.64 118.16 1pco s THR 68 Ca 0.22 -1.20 -0.15 0.00 -1.21 0.00 0.00 61.69 59.35 1pco s THR 68 Cb -0.11 -2.99 -0.04 0.00 -1.51 0.00 0.00 72.50 67.85 1pco s THR 68 CO 0.14 -0.04 0.37 0.00 -2.21 0.00 0.00 174.62 172.88 1pco n GLU 70 N 4.67 3.74 -1.63 0.00 0.28 -0.95 -4.87 120.64 121.88 1pco n GLU 70 Ca -0.09 -4.01 -0.30 0.00 -0.16 0.00 0.00 57.16 52.60 1pco n GLU 70 Cb 0.51 -2.80 -0.08 0.00 1.43 0.00 0.00 31.44 30.50 1pco n GLU 70 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1pco n GLY 71 N 2.79 0.94 0.31 -1.84 0.00 -1.26 -4.08 105.19 102.04 1pco n GLY 71 Ca 0.33 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 13.78 0.00 -3.65 1.61 9.92 -1.26 -4.89 116.55 132.06 1pco n ASP 72 Ca 0.45 0.00 -0.14 0.00 -0.53 0.00 0.00 54.79 54.57 1pco n ASP 72 Cb 0.45 -0.17 -0.08 0.00 -0.64 0.00 0.00 41.12 40.69 1pco n ASP 72 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 1pco s LYS 73 N -0.64 0.77 -0.13 -1.24 -2.85 -1.26 -4.73 119.74 109.67 1pco s LYS 73 Ca 0.00 0.91 -0.10 0.00 -1.00 0.00 0.00 55.97 55.79 1pco s LYS 73 Cb 0.00 0.37 -0.06 0.00 -2.06 0.00 0.00 37.83 36.09 1pco s LYS 73 CO 0.00 -0.09 -0.22 -1.13 0.10 0.00 0.00 175.35 174.01 1pco n SER 74 N 2.73 1.39 0.00 0.03 3.41 -0.61 -4.74 113.62 115.84 1pco n SER 74 Ca -0.14 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1pco n SER 74 Cb 0.55 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1pco n SER 74 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1pco n LEU 75 N -3.91 0.00 0.00 1.04 -0.00 -1.15 -5.03 117.00 107.95 1pco n LEU 75 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.79 1pco n LEU 75 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.97 1pco n LEU 75 CO 0.07 0.00 -0.00 0.55 -0.00 0.00 0.00 177.39 178.01 1pco n VAL 76 N 0.00 0.00 0.00 1.96 3.14 -1.23 -5.03 118.33 117.16 1pco n VAL 76 Ca 0.00 -0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.14 1pco n VAL 76 Cb 0.00 1.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.78 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 0.48 2.00 0.18 7.55 0.00 -1.20 -4.83 105.19 109.38 1pco n GLY 77 Ca 0.00 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.42 -0.62 1.61 0.87 -1.98 -2.64 113.55 110.37 1pco h SER 78 Ca 0.00 0.09 -0.37 0.00 -1.23 0.00 0.00 61.79 60.28 1pco h SER 78 Cb 0.00 0.21 -0.18 0.00 -0.44 0.00 0.00 62.40 61.99 1pco h SER 78 CO 0.00 -0.17 0.48 2.30 -0.53 0.00 0.00 176.83 178.90 1pco n ILE 79 N -5.28 2.69 -3.71 2.23 -6.64 -1.26 -5.05 119.36 102.33 1pco n ILE 79 Ca -0.02 -1.60 0.03 0.00 -1.77 0.00 0.00 62.75 59.39 1pco n ILE 79 Cb 0.20 -0.99 -0.01 0.00 -1.44 0.00 0.00 39.64 37.41 1pco n ILE 79 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 1pco n THR 80 N -0.25 0.00 -2.48 7.28 -2.24 -1.00 -5.06 114.28 110.53 1pco n THR 80 Ca 0.38 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 62.12 1pco n THR 80 Cb 0.91 -0.07 0.01 0.00 -2.10 0.00 0.00 70.33 69.07 1pco n THR 80 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1pco n ASN 81 N -1.80 -6.48 0.00 3.42 5.15 -1.26 -3.57 115.26 110.72 1pco n ASN 81 Ca 0.00 0.59 0.00 0.00 -0.60 0.00 0.00 54.58 54.58 1pco n ASN 81 Cb 0.10 -4.29 0.00 0.00 -0.53 0.00 0.00 39.78 35.06 1pco n ASN 81 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1pco n THR 82 N -0.10 0.00 -2.77 -0.44 -2.24 -1.26 -2.92 114.28 104.55 1pco n THR 82 Ca 0.06 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.47 1pco n THR 82 Cb 0.25 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1pco n THR 82 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1pco n ASN 83 N 0.00 6.49 -4.90 3.42 4.13 -1.26 -1.57 115.26 121.56 1pco n ASN 83 Ca 0.00 -3.66 -0.33 0.00 1.68 0.00 0.00 54.58 52.27 1pco n ASN 83 Cb 0.00 -1.02 -0.05 0.00 -1.54 0.00 0.00 39.78 37.18 1pco n ASN 83 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1pco s PHE 84 N -3.95 3.55 0.55 3.10 0.08 -1.26 -4.52 117.98 115.53 1pco s PHE 84 Ca 0.41 0.37 0.07 0.00 0.12 0.00 0.00 56.93 57.90 1pco s PHE 84 Cb 0.20 -1.84 0.10 0.00 -0.57 0.00 0.00 43.02 40.90 1pco s PHE 84 CO -0.11 0.63 0.76 0.41 -0.10 0.00 0.00 175.22 176.81 1pco n GLY 85 N 0.83 1.65 3.63 4.36 0.00 -0.67 -3.84 105.19 111.15 1pco n GLY 85 Ca -0.10 -2.17 -0.34 0.00 0.00 0.00 0.00 46.02 43.41 1pco n GLY 85 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pco s ILE 86 N -2.36 3.97 -0.00 -0.61 -1.09 -1.26 -0.82 121.20 119.04 1pco s ILE 86 Ca 0.56 -0.43 -0.30 0.00 -2.23 0.00 0.00 60.65 58.24 1pco s ILE 86 Cb -0.04 -2.67 -0.06 0.00 -1.58 0.00 0.00 42.46 38.11 1pco s ILE 86 CO 0.36 0.56 1.45 0.00 -1.23 0.00 0.00 174.94 176.08 1pco s HIS 88 N 2.62 0.18 -0.07 0.00 3.76 -0.38 -1.73 115.29 119.68 1pco s HIS 88 Ca 0.66 -0.49 -0.11 0.00 -0.15 0.00 0.00 55.06 54.97 1pco s HIS 88 Cb -0.32 -0.12 -0.05 0.00 1.11 0.00 0.00 32.58 33.20 1pco s HIS 88 CO 0.27 -0.40 0.28 1.21 -0.85 0.00 0.00 174.74 175.24 1pco s ASN 89 N -2.25 6.59 -0.67 1.40 3.84 -1.26 -0.53 114.94 122.06 1pco s ASN 89 Ca -0.03 0.70 0.05 0.00 0.21 0.00 0.00 52.86 53.79 1pco s ASN 89 Cb 0.00 -2.16 0.18 0.00 -0.55 0.00 0.00 41.25 38.72 1pco s ASN 89 CO -0.05 0.34 0.53 0.52 -2.79 0.00 0.00 177.10 175.64 1pco n VAL 90 N 2.05 1.49 0.00 -5.21 0.31 -1.26 -4.86 118.33 110.85 1pco n VAL 90 Ca -0.16 -4.80 0.00 0.00 -0.01 0.00 0.00 64.34 59.37 1pco n VAL 90 Cb 0.53 -2.13 0.00 0.00 -0.91 0.00 0.00 33.84 31.34 1pco n VAL 90 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pco n GLY 91 N 1.83 -1.55 3.02 2.92 0.00 -1.26 -5.10 105.19 105.05 1pco n GLY 91 Ca 0.22 0.75 -0.43 0.00 0.00 0.00 0.00 46.02 46.56 1pco n GLY 91 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1pco n ARG 92 N 0.00 3.15 0.00 1.61 0.00 -1.26 -5.29 116.66 114.87 1pco n ARG 92 Ca 0.00 -3.08 0.13 0.00 -0.00 0.00 0.00 57.85 54.90 1pco n ARG 92 Cb 0.00 -3.23 0.79 0.00 -0.00 0.00 0.00 32.46 30.02 1pco n ARG 92 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08