#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d8y s SER 2 N 0.00 5.59 -0.89 1.61 0.15 -1.26 -5.05 113.70 113.85 2d8y s SER 2 Ca 0.00 0.21 -0.23 0.00 0.70 0.00 0.00 55.95 56.62 2d8y s SER 2 Cb 0.00 -1.74 0.06 0.00 -1.71 0.00 0.00 66.02 62.63 2d8y s SER 2 CO 0.00 0.34 1.29 -0.44 1.20 0.00 0.00 173.24 175.63 2d8y s SER 3 N -0.62 6.40 -0.37 5.45 0.01 -1.26 -4.76 113.70 118.55 2d8y s SER 3 Ca 0.11 -1.26 -0.02 0.00 1.31 0.00 0.00 55.95 56.09 2d8y s SER 3 Cb -0.12 -2.52 0.24 0.00 0.21 0.00 0.00 66.02 63.83 2d8y s SER 3 CO 0.02 -1.50 1.10 0.61 0.41 0.00 0.00 173.24 173.88 2d8y n GLY 4 N 6.09 -1.38 2.70 3.44 0.00 -1.26 -5.13 105.19 109.65 2d8y n GLY 4 Ca 0.20 0.93 -0.25 0.00 0.00 0.00 0.00 46.02 46.90 2d8y n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d8y s SER 5 N 0.06 2.21 0.39 1.61 1.04 -1.26 -5.13 113.70 112.62 2d8y s SER 5 Ca 0.26 -0.47 -0.25 0.00 0.48 0.00 0.00 55.95 55.98 2d8y s SER 5 Cb 0.16 -0.40 -0.12 0.00 0.10 0.00 0.00 66.02 65.77 2d8y s SER 5 CO -0.11 -0.28 0.92 -0.24 0.98 0.00 0.00 173.24 174.51 2d8y n SER 6 N 5.17 0.85 -2.62 7.02 2.88 -1.26 -4.84 113.62 120.82 2d8y n SER 6 Ca -0.07 1.04 -0.26 0.00 -1.33 0.00 0.00 58.87 58.25 2d8y n SER 6 Cb 0.49 -1.29 -0.08 0.00 -0.75 0.00 0.00 64.21 62.57 2d8y n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d8y n GLY 7 N 1.31 4.07 3.09 0.46 0.00 -1.26 -4.98 105.19 107.88 2d8y n GLY 7 Ca 0.10 -1.66 -0.35 0.00 0.00 0.00 0.00 46.02 44.11 2d8y n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2d8y n MET 8 N 1.87 -0.10 -3.75 1.61 -0.00 -1.26 -5.01 117.12 110.48 2d8y n MET 8 Ca 0.53 -0.02 -0.13 0.00 -0.00 0.00 0.00 57.70 58.09 2d8y n MET 8 Cb 0.57 -1.20 -0.11 0.00 -0.00 0.00 0.00 33.22 32.49 2d8y n MET 8 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 2d8y s LYS 9 N -2.38 0.39 0.31 3.17 2.20 -1.26 -5.17 119.74 117.01 2d8y s LYS 9 Ca 0.44 0.51 -0.15 0.00 -0.36 0.00 0.00 55.97 56.41 2d8y s LYS 9 Cb -0.16 0.16 0.02 0.00 -1.51 0.00 0.00 37.83 36.34 2d8y s LYS 9 CO 0.78 -0.06 0.65 -0.06 -0.36 0.00 0.00 175.35 176.30 2d8y s PHE 10 N 0.35 0.19 -0.05 4.03 0.08 -1.26 -5.17 117.98 116.15 2d8y s PHE 10 Ca -0.01 -0.66 0.02 0.00 0.12 0.00 0.00 56.93 56.39 2d8y s PHE 10 Cb -0.03 0.53 -0.03 0.00 -0.57 0.00 0.00 43.02 42.92 2d8y s PHE 10 CO -0.01 -1.27 -0.07 -0.65 -0.10 0.00 0.00 175.22 173.12 2d8y s GLN 11 N -3.35 2.68 0.01 0.44 -1.52 -1.26 -5.05 119.66 111.60 2d8y s GLN 11 Ca 0.17 -0.60 -0.25 0.00 -1.95 0.00 0.00 55.36 52.73 2d8y s GLN 11 Cb -0.04 -2.56 -0.14 0.00 -0.22 0.00 0.00 33.01 30.06 2d8y s GLN 11 CO 0.10 0.64 1.03 0.00 -0.25 0.00 0.00 175.29 176.82 2d8y h ALA 12 N 5.04 -0.90 0.00 6.09 0.00 -2.02 -3.07 119.26 124.39 2d8y h ALA 12 Ca -0.49 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2d8y h ALA 12 Cb 1.17 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2d8y h ALA 12 CO 0.53 -0.83 0.00 -0.35 0.00 0.00 0.00 179.25 178.59 2d8y n PRO 13 N -5.34 0.43 -3.70 0.00 -0.04 -1.26 -4.86 135.00 120.23 2d8y n PRO 13 Ca -0.11 0.03 -0.24 0.00 -0.04 0.00 0.00 63.50 63.14 2d8y n PRO 13 Cb 0.35 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.36 2d8y n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d8y n ALA 14 N -1.06 -1.63 -2.22 0.55 0.00 -1.16 -4.99 120.51 109.99 2d8y n ALA 14 Ca 0.11 0.10 -0.13 0.00 0.00 0.00 0.00 53.44 53.51 2d8y n ALA 14 Cb 0.07 -3.64 -0.10 0.00 0.00 0.00 0.00 19.45 15.77 2d8y n ALA 14 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2d8y s ARG 15 N -6.16 1.18 0.04 0.00 1.70 -1.26 -5.07 118.95 109.38 2d8y s ARG 15 Ca 0.34 -1.61 -0.01 0.00 -0.47 0.00 0.00 55.73 53.99 2d8y s ARG 15 Cb -0.16 0.05 -0.04 0.00 -0.57 0.00 0.00 34.95 34.23 2d8y s ARG 15 CO 0.79 -0.30 0.20 -1.21 -1.08 0.00 0.00 175.30 173.69 2d8y s GLU 16 N -4.07 3.41 0.05 3.89 2.02 -1.26 -4.90 118.70 117.84 2d8y s GLU 16 Ca 0.33 -0.42 0.03 0.00 0.02 0.00 0.00 54.97 54.94 2d8y s GLU 16 Cb 0.07 -3.04 -0.02 0.00 0.10 0.00 0.00 34.13 31.24 2d8y s GLU 16 CO 0.09 0.63 -0.10 0.99 0.02 0.00 0.00 175.26 176.89 2d8y s THR 17 N -1.45 0.73 0.02 3.63 2.01 -1.26 -1.28 115.64 118.05 2d8y s THR 17 Ca 0.32 -1.09 -0.30 0.00 0.31 0.00 0.00 61.69 60.93 2d8y s THR 17 Cb -0.13 -0.75 -0.05 0.00 0.01 0.00 0.00 72.50 71.58 2d8y s THR 17 CO 0.25 -0.29 1.20 0.00 -0.69 0.00 0.00 174.62 175.09 2d8y n VAL 19 N 4.15 0.32 0.02 0.00 0.24 -0.99 -0.88 118.33 121.19 2d8y n VAL 19 Ca 0.10 -0.19 -0.01 0.00 -2.04 0.00 0.00 64.34 62.20 2d8y n VAL 19 Cb 0.46 -0.26 -0.00 0.00 -1.47 0.00 0.00 33.84 32.57 2d8y n VAL 19 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2d8y n GLU 20 N -0.01 0.03 -0.00 7.34 -0.58 -1.26 -4.83 120.64 121.33 2d8y n GLU 20 Ca 0.04 0.01 0.09 0.00 -0.42 0.00 0.00 57.16 56.88 2d8y n GLU 20 Cb 0.28 -0.56 -0.12 0.00 -0.57 0.00 0.00 31.44 30.48 2d8y n GLU 20 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2d8y n GLN 22 N -1.69 -3.51 -4.79 0.00 1.13 -0.06 -5.00 117.38 103.46 2d8y n GLN 22 Ca 0.01 0.50 -0.26 0.00 -1.94 0.00 0.00 57.00 55.30 2d8y n GLN 22 Cb 0.35 -4.41 -0.16 0.00 0.11 0.00 0.00 30.24 26.13 2d8y n GLN 22 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2d8y s LYS 23 N -4.65 1.95 -0.77 -1.09 3.01 -1.25 -4.80 119.74 112.14 2d8y s LYS 23 Ca 0.04 -0.57 -0.34 0.00 -1.01 0.00 0.00 55.97 54.08 2d8y s LYS 23 Cb -0.01 -1.61 -0.19 0.00 -1.01 0.00 0.00 37.83 35.02 2d8y s LYS 23 CO 0.43 0.14 2.48 2.41 0.51 0.00 0.00 175.35 181.32 2d8y n THR 24 N 3.48 0.01 -2.34 2.17 -1.04 -1.26 -1.77 114.28 113.52 2d8y n THR 24 Ca -0.20 -0.09 -0.42 0.00 -2.04 0.00 0.00 64.05 61.29 2d8y n THR 24 Cb 0.52 -0.80 -0.03 0.00 -1.82 0.00 0.00 70.33 68.21 2d8y n THR 24 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2d8y s VAL 25 N 8.33 3.93 0.60 12.58 1.01 -0.40 -4.90 120.40 141.54 2d8y s VAL 25 Ca 1.26 1.32 -0.09 0.00 0.00 0.00 0.00 61.98 64.48 2d8y s VAL 25 Cb -1.20 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 31.31 2d8y s VAL 25 CO 0.52 0.03 0.96 -0.31 0.00 0.00 0.00 175.10 176.30 2d8y s TYR 26 N 1.93 3.50 -2.00 5.22 1.51 -1.26 -4.53 117.35 121.71 2d8y s TYR 26 Ca 0.60 1.02 0.09 0.00 -1.01 0.00 0.00 57.07 57.77 2d8y s TYR 26 Cb -0.29 -2.68 0.51 0.00 -0.11 0.00 0.00 41.96 39.39 2d8y s TYR 26 CO 0.26 -0.70 0.96 -0.35 -1.11 0.00 0.00 175.55 174.61 2d8y n PRO 27 N -2.65 0.49 -0.05 -1.71 -0.04 -1.26 -1.85 135.00 127.93 2d8y n PRO 27 Ca 0.05 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.47 2d8y n PRO 27 Cb 0.55 -1.28 -0.10 0.00 -0.04 0.00 0.00 33.50 32.64 2d8y n PRO 27 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 2d8y n MET 28 N -0.78 1.61 -0.46 0.54 0.00 -1.26 -4.56 117.12 112.21 2d8y n MET 28 Ca 0.06 -0.03 0.06 0.00 -0.00 0.00 0.00 57.70 57.79 2d8y n MET 28 Cb 0.03 -1.32 0.19 0.00 0.00 0.00 0.00 33.22 32.12 2d8y n MET 28 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 2d8y n GLU 29 N -2.35 1.63 -2.87 2.12 0.28 -0.93 -4.98 120.64 113.54 2d8y n GLU 29 Ca -0.16 -3.03 -0.43 0.00 -0.16 0.00 0.00 57.16 53.38 2d8y n GLU 29 Cb 0.78 -1.63 -0.04 0.00 1.43 0.00 0.00 31.44 31.97 2d8y n GLU 29 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 2d8y s ARG 30 N -3.10 3.26 -0.30 3.44 3.52 -0.77 -3.80 118.95 121.19 2d8y s ARG 30 Ca 0.37 -0.45 -0.04 0.00 -0.13 0.00 0.00 55.73 55.49 2d8y s ARG 30 Cb 0.35 -4.10 0.04 0.00 -1.56 0.00 0.00 34.95 29.68 2d8y s ARG 30 CO -0.02 -1.54 0.03 -1.17 -0.81 0.00 0.00 175.30 171.80 2d8y s LEU 31 N 3.85 3.92 0.07 -0.88 0.20 0.04 -4.96 118.68 120.91 2d8y s LEU 31 Ca 0.27 -1.11 -0.31 0.00 0.69 0.00 0.00 54.13 53.67 2d8y s LEU 31 Cb -0.14 -1.77 -0.07 0.00 -0.43 0.00 0.00 46.19 43.78 2d8y s LEU 31 CO 0.16 -0.25 1.33 -0.22 -0.29 0.00 0.00 176.35 177.08 2d8y s LEU 32 N 1.33 4.36 -0.21 -0.68 1.98 -1.26 -0.31 118.68 123.89 2d8y s LEU 32 Ca -0.03 2.18 -0.04 0.00 -2.89 0.00 0.00 54.13 53.35 2d8y s LEU 32 Cb -0.19 -3.58 0.11 0.00 0.66 0.00 0.00 46.19 43.19 2d8y s LEU 32 CO 0.00 -0.61 0.34 0.00 -1.89 0.00 0.00 176.35 174.19 2d8y s ALA 33 N 1.40 -0.87 -1.21 5.97 0.00 0.02 -4.90 121.76 122.17 2d8y s ALA 33 Ca 0.62 0.88 -0.07 0.00 0.00 0.00 0.00 51.96 53.39 2d8y s ALA 33 Cb -0.33 -1.46 0.01 0.00 0.00 0.00 0.00 23.12 21.33 2d8y s ALA 33 CO 0.29 -1.09 1.05 0.09 0.00 0.00 0.00 175.76 176.10 2d8y n ASN 34 N 5.36 -5.44 -3.40 0.00 5.03 -1.26 -2.42 115.26 113.13 2d8y n ASN 34 Ca -0.05 -0.50 -0.21 0.00 0.87 0.00 0.00 54.58 54.69 2d8y n ASN 34 Cb 0.50 -4.61 0.08 0.00 -1.02 0.00 0.00 39.78 34.72 2d8y n ASN 34 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2d8y n GLN 35 N -4.48 -7.31 -3.68 3.52 6.02 -1.26 -5.00 117.38 105.19 2d8y n GLN 35 Ca -0.03 0.79 -0.15 0.00 -0.01 0.00 0.00 57.00 57.60 2d8y n GLN 35 Cb 0.57 -5.70 -0.08 0.00 1.02 0.00 0.00 30.24 26.05 2d8y n GLN 35 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2d8y s GLN 36 N -6.05 0.77 -0.26 -1.09 -0.21 -1.01 -5.13 119.66 106.67 2d8y s GLN 36 Ca 0.45 0.09 -0.29 0.00 0.02 0.00 0.00 55.36 55.63 2d8y s GLN 36 Cb -0.20 0.36 0.01 0.00 1.00 0.00 0.00 33.01 34.18 2d8y s GLN 36 CO 0.69 -0.21 1.14 0.08 -2.12 0.00 0.00 175.29 174.88 2d8y s VAL 37 N -1.02 4.44 0.12 1.09 1.01 -1.26 -0.80 120.40 123.98 2d8y s VAL 37 Ca -0.10 1.69 0.09 0.00 0.00 0.00 0.00 61.98 63.65 2d8y s VAL 37 Cb -0.03 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2d8y s VAL 37 CO 0.05 -0.34 -0.22 -0.36 0.00 0.00 0.00 175.10 174.24 2d8y s PHE 38 N 3.65 1.90 -0.18 5.22 0.08 0.58 -2.33 117.98 126.89 2d8y s PHE 38 Ca 0.49 -0.42 -0.23 0.00 0.12 0.00 0.00 56.93 56.89 2d8y s PHE 38 Cb -0.15 -1.02 -0.02 0.00 -0.57 0.00 0.00 43.02 41.26 2d8y s PHE 38 CO 0.14 0.25 0.74 -1.01 -0.10 0.00 0.00 175.22 175.25 2d8y s HIS 39 N -1.28 3.40 0.60 0.36 3.76 -1.26 -0.78 115.29 120.09 2d8y s HIS 39 Ca 0.09 1.11 0.24 0.00 -0.15 0.00 0.00 55.06 56.36 2d8y s HIS 39 Cb -0.09 -2.92 0.83 0.00 1.11 0.00 0.00 32.58 31.51 2d8y s HIS 39 CO 0.05 -0.21 1.25 -0.89 -0.85 0.00 0.00 174.74 174.10 2d8y n ILE 40 N 4.70 0.00 -0.10 0.60 -0.00 -1.25 -0.19 119.36 123.12 2d8y n ILE 40 Ca 0.02 1.22 -0.18 0.00 -0.00 0.00 0.00 62.75 63.81 2d8y n ILE 40 Cb 0.49 -2.20 -0.08 0.00 -0.00 0.00 0.00 39.64 37.85 2d8y n ILE 40 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 2d8y n SER 41 N -3.15 1.88 -0.34 4.38 2.88 -1.26 -4.38 113.62 113.63 2d8y n SER 41 Ca 0.21 0.44 0.12 0.00 -1.33 0.00 0.00 58.87 58.32 2d8y n SER 41 Cb 1.47 -0.88 0.31 0.00 -0.75 0.00 0.00 64.21 64.37 2d8y n SER 41 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2d8y n PHE 43 N -4.82 0.84 -3.79 0.00 7.35 0.36 -4.84 117.46 112.55 2d8y n PHE 43 Ca 0.23 0.29 -0.10 0.00 -0.76 0.00 0.00 57.45 57.10 2d8y n PHE 43 Cb 0.57 -2.43 -0.05 0.00 0.35 0.00 0.00 39.48 37.91 2d8y n PHE 43 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2d8y s ARG 44 N 8.74 1.14 0.35 -4.13 0.52 -1.26 -2.89 118.95 121.42 2d8y s ARG 44 Ca 1.23 -0.93 -0.28 0.00 -0.52 0.00 0.00 55.73 55.24 2d8y s ARG 44 Cb -0.89 0.43 -0.10 0.00 0.52 0.00 0.00 34.95 34.92 2d8y s ARG 44 CO 0.41 -0.44 1.33 0.00 0.02 0.00 0.00 175.30 176.62 2d8y n SER 46 N 0.60 2.92 0.02 0.00 2.88 0.73 -0.99 113.62 119.77 2d8y n SER 46 Ca 0.01 -2.22 0.00 0.00 -1.33 0.00 0.00 58.87 55.33 2d8y n SER 46 Cb 0.42 -0.55 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 2d8y n SER 46 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2d8y n TYR 47 N 0.24 -0.30 0.18 0.66 4.19 -1.26 -4.91 117.16 115.96 2d8y n TYR 47 Ca 0.08 0.05 0.05 0.00 3.31 0.00 0.00 57.90 61.40 2d8y n TYR 47 Cb 0.63 0.38 -0.08 0.00 0.49 0.00 0.00 39.34 40.77 2d8y n TYR 47 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2d8y n ASN 49 N -1.65 -2.14 -4.71 0.00 4.13 -0.16 -4.95 115.26 105.78 2d8y n ASN 49 Ca -0.01 -0.49 -0.35 0.00 1.68 0.00 0.00 54.58 55.41 2d8y n ASN 49 Cb 0.24 -4.15 -0.09 0.00 -1.54 0.00 0.00 39.78 34.25 2d8y n ASN 49 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2d8y s ASN 50 N -4.05 5.55 0.28 6.41 0.01 -1.26 -4.74 114.94 117.14 2d8y s ASN 50 Ca 0.01 0.20 -0.29 0.00 -0.71 0.00 0.00 52.86 52.07 2d8y s ASN 50 Cb -0.00 -1.71 -0.14 0.00 0.41 0.00 0.00 41.25 39.81 2d8y s ASN 50 CO 0.57 0.34 1.19 0.29 -1.51 0.00 0.00 177.10 177.98 2d8y n LYS 51 N 2.40 1.68 -3.77 -0.60 4.76 -1.26 -2.84 118.16 118.53 2d8y n LYS 51 Ca -0.19 0.59 -0.18 0.00 -2.87 0.00 0.00 58.31 55.66 2d8y n LYS 51 Cb 0.54 -2.09 -0.05 0.00 -1.84 0.00 0.00 35.03 31.58 2d8y n LYS 51 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2d8y n LEU 52 N 1.37 0.00 -3.80 -0.35 4.77 -1.14 -4.94 117.00 112.92 2d8y n LEU 52 Ca 0.09 -2.30 -0.10 0.00 -0.03 0.00 0.00 56.01 53.67 2d8y n LEU 52 Cb 0.32 0.78 -0.07 0.00 -2.33 0.00 0.00 43.42 42.13 2d8y n LEU 52 CO 0.61 -0.36 -0.03 -0.44 -1.33 0.00 0.00 177.39 175.85 2d8y s SER 53 N -2.84 0.01 -0.46 -1.43 0.01 -1.26 -4.97 113.70 102.75 2d8y s SER 53 Ca 0.16 -0.51 -0.28 0.00 1.31 0.00 0.00 55.95 56.63 2d8y s SER 53 Cb 0.01 0.37 -0.08 0.00 0.21 0.00 0.00 66.02 66.52 2d8y s SER 53 CO 0.11 -0.73 2.38 0.18 0.41 0.00 0.00 173.24 175.59 2d8y n LEU 54 N 0.03 2.34 0.00 2.44 4.77 -1.26 -1.75 117.00 123.57 2d8y n LEU 54 Ca -0.16 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.61 2d8y n LEU 54 Cb 0.62 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 2d8y n LEU 54 CO 0.21 -1.23 0.00 0.61 -1.33 0.00 0.00 177.39 175.65 2d8y n GLY 55 N 6.05 4.29 0.08 -0.72 0.00 -1.26 -4.92 105.19 108.71 2d8y n GLY 55 Ca 0.38 -0.84 -0.03 0.00 0.00 0.00 0.00 46.02 45.53 2d8y n GLY 55 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2d8y n THR 56 N 0.00 1.10 -2.17 2.61 5.66 -0.72 -4.94 114.28 115.81 2d8y n THR 56 Ca 0.00 -0.74 -0.40 0.00 -3.05 0.00 0.00 64.05 59.86 2d8y n THR 56 Cb 0.00 -0.50 -0.02 0.00 -1.55 0.00 0.00 70.33 68.26 2d8y n THR 56 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 2d8y s TYR 57 N -2.81 3.03 -0.35 1.09 -0.85 -1.05 -3.82 117.35 112.60 2d8y s TYR 57 Ca -0.07 1.47 0.01 0.00 -0.52 0.00 0.00 57.07 57.96 2d8y s TYR 57 Cb 0.08 -3.57 0.11 0.00 0.38 0.00 0.00 41.96 38.96 2d8y s TYR 57 CO 0.84 -1.68 0.13 0.00 -1.52 0.00 0.00 175.55 173.31 2d8y s ALA 58 N -1.25 1.97 -0.38 9.51 0.00 -0.03 -4.98 121.76 126.60 2d8y s ALA 58 Ca 0.53 -2.08 -0.21 0.00 0.00 0.00 0.00 51.96 50.20 2d8y s ALA 58 Cb -0.36 -1.76 0.01 0.00 0.00 0.00 0.00 23.12 21.00 2d8y s ALA 58 CO 0.47 -1.77 0.64 -1.12 0.00 0.00 0.00 175.76 173.98 2d8y s SER 59 N 1.15 6.39 -0.19 0.00 0.01 -1.26 -1.78 113.70 118.02 2d8y s SER 59 Ca 0.12 0.00 -0.02 0.00 1.31 0.00 0.00 55.95 57.36 2d8y s SER 59 Cb -0.19 -2.33 -0.01 0.00 0.21 0.00 0.00 66.02 63.70 2d8y s SER 59 CO -0.15 -0.66 -0.09 -0.22 0.41 0.00 0.00 173.24 172.53 2d8y s LEU 60 N 2.76 2.76 -1.51 2.44 2.96 0.13 -4.54 118.68 123.68 2d8y s LEU 60 Ca 0.24 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2d8y s LEU 60 Cb -0.14 -1.67 0.00 0.00 0.50 0.00 0.00 46.19 44.87 2d8y s LEU 60 CO 0.16 0.04 0.00 1.41 -1.32 0.00 0.00 176.35 176.64 2d8y n HIS 61 N 4.41 -0.40 0.00 5.38 8.25 -1.26 -2.03 115.22 129.56 2d8y n HIS 61 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 2d8y n HIS 61 Cb 0.51 -3.04 0.00 0.00 1.12 0.00 0.00 29.99 28.59 2d8y n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2d8y n GLY 62 N -1.02 2.94 3.73 -1.41 0.00 -1.26 -5.03 105.19 103.14 2d8y n GLY 62 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 2d8y n GLY 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d8y s ARG 63 N -0.04 4.73 0.49 1.61 0.52 -0.86 -5.00 118.95 120.40 2d8y s ARG 63 Ca 0.00 1.47 -0.10 0.00 -0.52 0.00 0.00 55.73 56.58 2d8y s ARG 63 Cb 0.00 -3.35 -0.06 0.00 0.52 0.00 0.00 34.95 32.06 2d8y s ARG 63 CO 0.00 0.28 0.86 0.42 0.02 0.00 0.00 175.30 176.88 2d8y s ILE 64 N -0.28 4.75 0.13 1.52 -1.09 -1.26 0.23 121.20 125.20 2d8y s ILE 64 Ca 0.46 0.68 -0.24 0.00 -2.23 0.00 0.00 60.65 59.31 2d8y s ILE 64 Cb -0.24 -3.79 0.07 0.00 -1.58 0.00 0.00 42.46 36.92 2d8y s ILE 64 CO 0.31 -0.75 0.64 -0.31 -1.23 0.00 0.00 174.94 173.59 2d8y s TYR 65 N -2.67 -0.52 0.51 3.97 1.51 -0.74 -0.20 117.35 119.23 2d8y s TYR 65 Ca 0.52 0.34 -0.02 0.00 -1.01 0.00 0.00 57.07 56.91 2d8y s TYR 65 Cb -0.10 0.55 0.00 0.00 -0.11 0.00 0.00 41.96 42.30 2d8y s TYR 65 CO 0.39 -0.80 0.77 0.00 -1.11 0.00 0.00 175.55 174.80 2d8y h LYS 67 N 0.15 -0.14 -0.11 0.00 1.79 -1.95 0.42 116.57 116.73 2d8y h LYS 67 Ca -0.45 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.04 2d8y h LYS 67 Cb 1.26 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.90 2d8y h LYS 67 CO 0.58 -0.09 -0.29 -1.35 -1.08 0.00 0.00 179.45 177.22 2d8y h PRO 68 N -0.14 -0.28 -0.10 3.15 0.11 -1.95 -1.12 132.00 131.67 2d8y h PRO 68 Ca 0.09 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 2d8y h PRO 68 Cb 0.27 0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.44 2d8y h PRO 68 CO -0.21 -0.18 0.04 0.45 -0.21 0.00 0.00 178.00 177.89 2d8y h HIS 69 N -0.29 0.16 0.00 0.65 3.86 -1.95 -1.98 115.15 115.60 2d8y h HIS 69 Ca 0.02 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2d8y h HIS 69 Cb 0.35 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.77 2d8y h HIS 69 CO -0.55 0.25 0.37 0.35 0.86 0.00 0.00 177.93 179.21 2d8y h PHE 70 N 0.01 0.00 0.00 2.45 3.57 0.07 1.21 116.94 124.26 2d8y h PHE 70 Ca 0.03 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 2d8y h PHE 70 Cb 0.16 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 2d8y h PHE 70 CO -0.02 0.00 -1.98 0.09 -2.23 0.00 0.00 178.31 174.17 2d8y n ASN 71 N -2.12 0.33 0.01 0.41 3.02 -0.44 -3.35 115.26 113.11 2d8y n ASN 71 Ca -0.01 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.36 2d8y n ASN 71 Cb 0.39 1.81 -0.14 0.00 -0.61 0.00 0.00 39.78 41.23 2d8y n ASN 71 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 2d8y h GLN 72 N 0.00 0.21 0.17 3.52 4.15 0.17 -2.64 115.11 120.69 2d8y h GLN 72 Ca -0.07 -0.36 -0.31 0.00 0.77 0.00 0.00 58.65 58.68 2d8y h GLN 72 Cb 1.09 0.13 0.01 0.00 0.21 0.00 0.00 27.48 28.93 2d8y h GLN 72 CO 0.00 1.04 -1.48 -0.07 -1.93 0.00 0.00 178.83 176.40 2d8y h LEU 73 N 0.06 0.56 0.00 -2.39 3.38 -0.69 -3.40 115.31 112.83 2d8y h LEU 73 Ca -0.38 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 56.92 2d8y h LEU 73 Cb 2.03 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.60 2d8y h LEU 73 CO 0.10 1.55 -0.09 -0.26 0.09 0.00 0.00 178.44 179.82 2d8y h PHE 74 N 0.10 0.00 -3.29 1.13 -1.00 -1.71 -3.48 116.94 108.68 2d8y h PHE 74 Ca -0.23 0.00 -0.36 0.00 2.81 0.00 0.00 57.97 60.18 2d8y h PHE 74 Cb 2.06 0.00 0.17 0.00 3.61 0.00 0.00 35.95 41.79 2d8y h PHE 74 CO 0.09 0.00 0.17 1.17 -1.61 0.00 0.00 178.31 178.13 2d8y n LYS 75 N -4.34 -2.49 -3.79 1.51 4.81 -0.99 -5.05 118.16 107.83 2d8y n LYS 75 Ca -0.01 -1.64 -0.03 0.00 -0.87 0.00 0.00 58.31 55.76 2d8y n LYS 75 Cb 0.05 -1.41 -0.00 0.00 0.02 0.00 0.00 35.03 33.69 2d8y n LYS 75 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 2d8y s SER 76 N -4.46 -0.11 -0.21 3.14 1.04 -1.26 -4.65 113.70 107.20 2d8y s SER 76 Ca 0.65 -0.48 -0.17 0.00 0.48 0.00 0.00 55.95 56.42 2d8y s SER 76 Cb -0.05 0.48 0.06 0.00 0.10 0.00 0.00 66.02 66.60 2d8y s SER 76 CO 0.48 -0.91 0.55 -1.59 0.98 0.00 0.00 173.24 172.76 2d8y s LYS 77 N -2.87 0.61 -0.43 4.02 0.00 -1.26 -5.09 119.74 114.71 2d8y s LYS 77 Ca 0.15 0.84 0.08 0.00 0.00 0.00 0.00 55.97 57.04 2d8y s LYS 77 Cb -0.01 0.23 0.29 0.00 0.00 0.00 0.00 37.83 38.34 2d8y s LYS 77 CO 0.03 -0.10 0.85 0.41 0.00 0.00 0.00 175.35 176.54 2d8y n GLY 78 N 3.26 1.62 3.83 0.59 0.00 -1.26 -5.13 105.19 108.09 2d8y n GLY 78 Ca -0.16 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 44.85 2d8y n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d8y s ASN 79 N -1.64 6.96 -0.12 1.61 4.22 -1.26 -5.07 114.94 119.64 2d8y s ASN 79 Ca 0.31 1.43 0.02 0.00 -2.14 0.00 0.00 52.86 52.49 2d8y s ASN 79 Cb 0.27 -2.43 0.01 0.00 1.28 0.00 0.00 41.25 40.38 2d8y s ASN 79 CO -0.12 -0.11 -0.20 -0.31 -2.04 0.00 0.00 177.10 174.32 2d8y s TYR 80 N -1.78 2.35 0.40 1.54 2.02 -1.26 -5.13 117.35 115.49 2d8y s TYR 80 Ca 0.50 -1.11 0.08 0.00 -0.37 0.00 0.00 57.07 56.17 2d8y s TYR 80 Cb -0.13 -1.62 -0.05 0.00 -0.40 0.00 0.00 41.96 39.75 2d8y s TYR 80 CO 0.19 -0.51 0.21 0.34 -1.57 0.00 0.00 175.55 174.20 2d8y s ASP 81 N 0.78 4.55 -0.42 2.29 2.15 -1.26 -5.03 116.67 119.73 2d8y s ASP 81 Ca -0.09 -0.99 -0.02 0.00 0.43 0.00 0.00 52.55 51.88 2d8y s ASP 81 Cb -0.16 -0.52 0.24 0.00 -0.30 0.00 0.00 42.92 42.18 2d8y s ASP 81 CO 0.00 -0.53 2.14 -0.62 -0.17 0.00 0.00 175.17 176.00 2d8y n GLU 82 N -1.28 2.10 0.00 4.34 -0.58 -1.26 -4.19 120.64 119.78 2d8y n GLU 82 Ca -0.01 -2.08 0.00 0.00 -0.42 0.00 0.00 57.16 54.65 2d8y n GLU 82 Cb 0.64 -1.85 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 2d8y n GLU 82 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2d8y n GLY 83 N 0.15 -0.06 3.48 0.62 0.00 -1.26 -5.07 105.19 103.05 2d8y n GLY 83 Ca 0.40 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 2d8y n GLY 83 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2d8y s PHE 84 N -1.37 2.65 -0.54 1.61 0.40 -1.26 -4.98 117.98 114.50 2d8y s PHE 84 Ca 0.00 -0.40 0.00 0.00 -0.60 0.00 0.00 56.93 55.93 2d8y s PHE 84 Cb 0.00 -4.28 0.14 0.00 0.51 0.00 0.00 43.02 39.38 2d8y s PHE 84 CO 0.00 -1.64 0.32 0.20 0.70 0.00 0.00 175.22 174.80 2d8y s GLY 85 N 3.53 2.37 0.31 4.36 0.00 -1.26 -4.47 107.32 112.16 2d8y s GLY 85 Ca 0.25 -3.11 0.10 0.00 0.00 0.00 0.00 44.72 41.96 2d8y s GLY 85 CO 0.12 1.05 -0.12 -0.56 0.00 0.00 0.00 173.10 173.60 2d8y s SER 86 N 0.52 3.80 0.00 1.64 0.01 -1.26 -5.11 113.70 113.31 2d8y s SER 86 Ca 0.15 -1.06 0.00 0.00 1.31 0.00 0.00 55.95 56.35 2d8y s SER 86 Cb -0.22 -0.39 0.00 0.00 0.21 0.00 0.00 66.02 65.62 2d8y s SER 86 CO -0.03 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.14 2d8y n GLY 87 N -0.75 3.53 3.66 3.44 0.00 -1.26 -5.11 105.19 108.70 2d8y n GLY 87 Ca -0.05 -1.79 -0.29 0.00 0.00 0.00 0.00 46.02 43.89 2d8y n GLY 87 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d8y s PRO 88 N -3.43 0.16 -0.35 1.61 0.04 -1.26 -5.01 135.00 126.76 2d8y s PRO 88 Ca 0.00 0.43 -0.16 0.00 0.04 0.00 0.00 61.00 61.31 2d8y s PRO 88 Cb 0.00 -1.71 -0.01 0.00 0.04 0.00 0.00 34.50 32.82 2d8y s PRO 88 CO 0.00 -2.89 0.41 0.45 0.04 0.00 0.00 177.00 175.00 2d8y s SER 89 N -3.50 6.22 -0.19 6.66 0.15 -1.26 -5.05 113.70 116.72 2d8y s SER 89 Ca 0.66 -0.21 -0.02 0.00 0.70 0.00 0.00 55.95 57.08 2d8y s SER 89 Cb -0.18 -2.22 -0.00 0.00 -1.71 0.00 0.00 66.02 61.91 2d8y s SER 89 CO 0.58 -0.39 -0.10 -0.94 1.20 0.00 0.00 173.24 173.59 2d8y s SER 90 N 1.74 3.97 0.00 5.45 1.04 -1.26 -5.36 113.70 119.29 2d8y s SER 90 Ca 0.14 -0.44 0.27 0.00 0.48 0.00 0.00 55.95 56.40 2d8y s SER 90 Cb -0.16 -1.65 0.76 0.00 0.10 0.00 0.00 66.02 65.07 2d8y s SER 90 CO 0.12 0.02 1.58 0.61 0.98 0.00 0.00 173.24 176.56