#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 6.84 0.37 1.61 0.01 -1.26 -4.99 113.70 116.29 2d8y s SER 2 Ca 0.00 -2.53 0.06 0.00 1.31 0.00 0.00 55.95 54.79 2d8y s SER 2 Cb 0.00 -2.37 -0.07 0.00 0.21 0.00 0.00 66.02 63.79 2d8y s SER 2 CO 0.00 -0.86 0.01 -0.94 0.41 0.00 0.00 173.24 171.86 2d8y s SER 3 N 3.07 3.40 0.00 2.44 1.04 -1.26 -5.10 113.70 117.29 2d8y s SER 3 Ca 0.35 -1.35 0.00 0.00 0.48 0.00 0.00 55.95 55.43 2d8y s SER 3 Cb -0.05 -0.30 0.00 0.00 0.10 0.00 0.00 66.02 65.77 2d8y s SER 3 CO -0.06 -0.47 0.00 0.61 0.98 0.00 0.00 173.24 174.30 2d8y n GLY 4 N -0.86 2.26 3.60 7.32 0.00 -1.26 -5.08 105.19 111.17 2d8y n GLY 4 Ca -0.04 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 2d8y n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d8y s SER 5 N 0.00 6.49 -0.13 1.61 0.15 -1.26 -4.88 113.70 115.68 2d8y s SER 5 Ca 0.00 0.48 -0.17 0.00 0.70 0.00 0.00 55.95 56.96 2d8y s SER 5 Cb 0.00 -2.55 -0.25 0.00 -1.71 0.00 0.00 66.02 61.51 2d8y s SER 5 CO 0.00 -1.37 0.48 -1.28 1.20 0.00 0.00 173.24 172.27 2d8y h SER 6 N 9.79 0.27 -4.70 5.45 0.87 -2.06 -3.51 113.55 119.67 2d8y h SER 6 Ca -0.25 -0.80 0.00 0.00 -1.23 0.00 0.00 61.79 59.52 2d8y h SER 6 Cb 1.07 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 2d8y h SER 6 CO 1.13 1.57 -1.00 0.61 -0.53 0.00 0.00 176.83 178.61 2d8y n GLY 7 N 1.69 -5.83 1.67 5.77 0.00 -1.26 -4.70 105.19 102.52 2d8y n GLY 7 Ca -0.26 0.04 -0.05 0.00 0.00 0.00 0.00 46.02 45.75 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 1.88 1.33 -2.72 1.61 3.85 -1.26 -4.83 117.12 116.99 2d8y n MET 8 Ca 0.00 -0.40 -0.42 0.00 -1.00 0.00 0.00 57.70 55.88 2d8y n MET 8 Cb 0.00 -1.31 -0.03 0.00 -1.05 0.00 0.00 33.22 30.83 2d8y n MET 8 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2d8y s LYS 9 N 0.09 3.26 0.31 3.17 3.01 -1.26 -4.96 119.74 123.35 2d8y s LYS 9 Ca 0.20 -0.77 0.04 0.00 -1.01 0.00 0.00 55.97 54.43 2d8y s LYS 9 Cb 0.10 -4.45 -0.03 0.00 -1.01 0.00 0.00 37.83 32.45 2d8y s LYS 9 CO -0.01 -1.98 0.28 -0.06 0.51 0.00 0.00 175.35 174.09 2d8y s PHE 10 N 4.62 1.51 -0.34 3.18 0.08 -1.26 -5.09 117.98 120.68 2d8y s PHE 10 Ca 0.31 -1.54 -0.40 0.00 0.12 0.00 0.00 56.93 55.43 2d8y s PHE 10 Cb -0.10 -0.57 -0.15 0.00 -0.57 0.00 0.00 43.02 41.62 2d8y s PHE 10 CO 0.07 -0.87 1.93 1.04 -0.10 0.00 0.00 175.22 177.29 2d8y n GLN 11 N -0.54 0.91 -0.37 0.44 1.13 -1.26 -4.83 117.38 112.86 2d8y n GLN 11 Ca 0.05 0.30 -0.10 0.00 -1.94 0.00 0.00 57.00 55.32 2d8y n GLN 11 Cb 0.63 -2.10 -0.09 0.00 0.11 0.00 0.00 30.24 28.79 2d8y n GLN 11 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2d8y n ALA 12 N 6.98 -0.57 -1.77 -1.58 0.00 -1.26 -4.47 120.51 117.84 2d8y n ALA 12 Ca 0.35 0.75 -0.35 0.00 0.00 0.00 0.00 53.44 54.19 2d8y n ALA 12 Cb 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.50 2d8y n ALA 12 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2d8y s PRO 13 N -5.26 3.39 -0.49 0.00 0.04 -1.26 -4.90 135.00 126.51 2d8y s PRO 13 Ca -0.11 1.62 -0.26 0.00 0.04 0.00 0.00 61.00 62.29 2d8y s PRO 13 Cb 0.10 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.55 2d8y s PRO 13 CO 0.55 -0.82 2.29 0.00 0.04 0.00 0.00 177.00 179.05 2d8y s ALA 14 N -1.76 1.81 -0.09 8.56 0.00 -1.26 -4.94 121.76 124.08 2d8y s ALA 14 Ca 0.72 -0.05 -0.12 0.00 0.00 0.00 0.00 51.96 52.51 2d8y s ALA 14 Cb -0.24 -4.32 -0.05 0.00 0.00 0.00 0.00 23.12 18.51 2d8y s ALA 14 CO 0.27 -4.24 0.30 0.50 0.00 0.00 0.00 175.76 172.59 2d8y s ARG 15 N 7.89 3.91 0.60 0.00 3.52 -1.26 -5.09 118.95 128.51 2d8y s ARG 15 Ca 0.92 0.15 -0.03 0.00 -0.13 0.00 0.00 55.73 56.64 2d8y s ARG 15 Cb -0.17 -3.28 0.03 0.00 -1.56 0.00 0.00 34.95 29.96 2d8y s ARG 15 CO 0.26 0.56 0.87 -1.21 -0.81 0.00 0.00 175.30 174.96 2d8y s GLU 16 N -0.52 2.59 0.00 5.12 0.41 -1.26 -5.06 118.70 119.98 2d8y s GLU 16 Ca 0.19 -0.38 -0.21 0.00 -0.41 0.00 0.00 54.97 54.16 2d8y s GLU 16 Cb -0.14 -2.34 0.04 0.00 -1.78 0.00 0.00 34.13 29.91 2d8y s GLU 16 CO 0.07 -0.82 0.47 0.99 -0.49 0.00 0.00 175.26 175.48 2d8y s THR 17 N -2.95 0.04 0.14 3.63 2.01 -1.26 -3.35 115.64 113.90 2d8y s THR 17 Ca 0.56 -0.31 -0.30 0.00 0.31 0.00 0.00 61.69 61.95 2d8y s THR 17 Cb -0.10 -0.87 -0.07 0.00 0.01 0.00 0.00 72.50 71.47 2d8y s THR 17 CO 0.42 -0.17 1.04 0.00 -0.69 0.00 0.00 174.62 175.22 2d8y n VAL 19 N 2.61 1.35 0.00 0.00 0.24 -1.03 -1.49 118.33 120.00 2d8y n VAL 19 Ca 0.03 -0.72 0.00 0.00 -2.04 0.00 0.00 64.34 61.61 2d8y n VAL 19 Cb 0.47 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.55 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 0.38 0.00 -0.00 7.34 -0.58 -1.26 -4.84 120.64 121.67 2d8y n GLU 20 Ca 0.15 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.93 2d8y n GLU 20 Cb 0.70 -0.57 -0.06 0.00 -0.57 0.00 0.00 31.44 30.95 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 -1.39 -3.34 -4.71 0.00 1.13 -0.55 -5.01 117.38 103.51 2d8y n GLN 22 Ca 0.01 0.48 -0.25 0.00 -1.94 0.00 0.00 57.00 55.30 2d8y n GLN 22 Cb 0.17 -4.33 -0.16 0.00 0.11 0.00 0.00 30.24 26.03 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 -4.61 1.61 -0.72 -1.09 3.01 -1.25 -4.80 119.74 111.89 2d8y s LYS 23 Ca 0.04 -0.52 -0.33 0.00 -1.01 0.00 0.00 55.97 54.15 2d8y s LYS 23 Cb -0.01 -1.40 -0.17 0.00 -1.01 0.00 0.00 37.83 35.25 2d8y s LYS 23 CO 0.41 0.19 2.48 2.41 0.51 0.00 0.00 175.35 181.35 2d8y n THR 24 N 3.26 0.01 -2.25 2.17 -1.04 -1.26 -1.17 114.28 114.00 2d8y n THR 24 Ca -0.19 -0.21 -0.42 0.00 -2.04 0.00 0.00 64.05 61.19 2d8y n THR 24 Cb 0.53 -1.16 -0.03 0.00 -1.82 0.00 0.00 70.33 67.85 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 8.95 3.67 0.61 12.58 1.01 -1.21 -4.89 120.40 141.12 2d8y s VAL 25 Ca 1.22 1.13 -0.10 0.00 0.00 0.00 0.00 61.98 64.23 2d8y s VAL 25 Cb -1.01 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 31.62 2d8y s VAL 25 CO 0.47 0.04 0.99 -0.31 0.00 0.00 0.00 175.10 176.28 2d8y s TYR 26 N 1.79 3.53 -2.00 5.22 1.51 -1.26 -4.69 117.35 121.45 2d8y s TYR 26 Ca 0.63 1.11 0.12 0.00 -1.01 0.00 0.00 57.07 57.91 2d8y s TYR 26 Cb -0.32 -2.71 0.70 0.00 -0.11 0.00 0.00 41.96 39.52 2d8y s TYR 26 CO 0.28 -0.71 1.13 -0.35 -1.11 0.00 0.00 175.55 174.79 2d8y n PRO 27 N -2.69 0.49 -0.08 -1.71 -0.04 -1.26 -1.64 135.00 128.07 2d8y n PRO 27 Ca 0.05 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.43 2d8y n PRO 27 Cb 0.55 -1.37 -0.11 0.00 -0.04 0.00 0.00 33.50 32.53 2d8y n PRO 27 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2d8y n MET 28 N -0.87 1.43 -0.50 0.54 2.81 -1.26 -4.52 117.12 114.74 2d8y n MET 28 Ca 0.09 0.01 0.05 0.00 -1.81 0.00 0.00 57.70 56.04 2d8y n MET 28 Cb 0.04 -1.38 0.22 0.00 -0.71 0.00 0.00 33.22 31.40 2d8y n MET 28 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 2d8y n GLU 29 N -2.62 2.29 -2.71 0.03 0.28 -0.99 -4.95 120.64 111.97 2d8y n GLU 29 Ca -0.25 -2.92 -0.42 0.00 -0.16 0.00 0.00 57.16 53.41 2d8y n GLU 29 Cb 0.96 -1.78 -0.03 0.00 1.43 0.00 0.00 31.44 32.02 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 -2.98 3.17 -0.38 3.44 3.52 -0.65 -3.75 118.95 121.32 2d8y s ARG 30 Ca 0.41 -0.49 -0.09 0.00 -0.13 0.00 0.00 55.73 55.44 2d8y s ARG 30 Cb 0.35 -4.19 0.05 0.00 -1.56 0.00 0.00 34.95 29.61 2d8y s ARG 30 CO 0.05 -1.94 0.20 -1.17 -0.81 0.00 0.00 175.30 171.62 2d8y s LEU 31 N 4.86 4.81 -0.03 -0.88 0.20 -0.00 -4.96 118.68 122.68 2d8y s LEU 31 Ca 0.29 -1.27 -0.30 0.00 0.69 0.00 0.00 54.13 53.54 2d8y s LEU 31 Cb -0.12 -1.96 -0.05 0.00 -0.43 0.00 0.00 46.19 43.62 2d8y s LEU 31 CO 0.13 -0.44 1.46 -0.22 -0.29 0.00 0.00 176.35 176.99 2d8y s LEU 32 N 1.45 4.30 -0.19 -0.68 1.98 -1.26 -1.01 118.68 123.27 2d8y s LEU 32 Ca 0.01 2.11 -0.04 0.00 -2.89 0.00 0.00 54.13 53.33 2d8y s LEU 32 Cb -0.21 -3.55 0.09 0.00 0.66 0.00 0.00 46.19 43.18 2d8y s LEU 32 CO 0.03 -0.78 0.23 0.00 -1.89 0.00 0.00 176.35 173.95 2d8y s ALA 33 N 2.90 -0.35 -0.96 5.97 0.00 -0.31 -4.88 121.76 124.12 2d8y s ALA 33 Ca 0.65 0.40 -0.06 0.00 0.00 0.00 0.00 51.96 52.96 2d8y s ALA 33 Cb -0.31 -1.28 0.01 0.00 0.00 0.00 0.00 23.12 21.54 2d8y s ALA 33 CO 0.26 -1.10 0.84 -1.71 0.00 0.00 0.00 175.76 174.05 2d8y n ASN 34 N 5.33 -4.84 -3.18 0.00 5.15 -1.26 -2.56 115.26 113.90 2d8y n ASN 34 Ca -0.05 -0.39 -0.23 0.00 -0.60 0.00 0.00 54.58 53.30 2d8y n ASN 34 Cb 0.50 -3.76 0.04 0.00 -0.53 0.00 0.00 39.78 36.03 2d8y n ASN 34 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2d8y n GLN 35 N -3.69 -5.57 -3.81 1.20 6.02 -1.26 -4.98 117.38 105.29 2d8y n GLN 35 Ca -0.01 0.88 -0.12 0.00 -0.01 0.00 0.00 57.00 57.73 2d8y n GLN 35 Cb 0.55 -5.78 -0.10 0.00 1.02 0.00 0.00 30.24 25.93 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 -5.87 0.51 -0.17 -1.09 -0.21 -1.06 -5.13 119.66 106.63 2d8y s GLN 36 Ca 0.38 -0.13 -0.29 0.00 0.02 0.00 0.00 55.36 55.33 2d8y s GLN 36 Cb -0.17 0.22 -0.01 0.00 1.00 0.00 0.00 33.01 34.05 2d8y s GLN 36 CO 0.47 -0.12 1.26 0.08 -2.12 0.00 0.00 175.29 174.86 2d8y s VAL 37 N -0.98 4.29 0.07 1.09 1.01 -1.26 -1.17 120.40 123.45 2d8y s VAL 37 Ca -0.11 1.55 0.06 0.00 0.00 0.00 0.00 61.98 63.49 2d8y s VAL 37 Cb -0.05 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 2d8y s VAL 37 CO 0.02 -0.15 -0.17 -0.36 0.00 0.00 0.00 175.10 174.44 2d8y s PHE 38 N 3.54 1.43 -0.13 5.22 0.08 -0.18 -2.48 117.98 125.46 2d8y s PHE 38 Ca 0.54 -0.43 -0.24 0.00 0.12 0.00 0.00 56.93 56.93 2d8y s PHE 38 Cb -0.21 -0.80 -0.03 0.00 -0.57 0.00 0.00 43.02 41.41 2d8y s PHE 38 CO 0.15 0.10 0.74 -1.01 -0.10 0.00 0.00 175.22 175.10 2d8y s HIS 39 N -1.15 3.48 0.63 0.36 3.76 -1.26 -0.82 115.29 120.29 2d8y s HIS 39 Ca 0.02 1.20 0.17 0.00 -0.15 0.00 0.00 55.06 56.30 2d8y s HIS 39 Cb -0.10 -2.89 0.67 0.00 1.11 0.00 0.00 32.58 31.38 2d8y s HIS 39 CO 0.03 -0.08 1.28 0.82 -0.85 0.00 0.00 174.74 175.93 2d8y h ILE 40 N 5.00 0.03 0.00 0.60 5.03 -1.91 0.21 117.51 126.47 2d8y h ILE 40 Ca -0.35 0.00 -0.25 0.00 -0.12 0.00 0.00 64.86 64.14 2d8y h ILE 40 Cb 1.16 0.09 -0.04 0.00 -3.03 0.00 0.00 36.82 35.01 2d8y h ILE 40 CO 0.79 0.00 -1.62 -0.24 -0.68 0.00 0.00 178.15 176.40 2d8y n SER 41 N -2.98 1.91 -0.34 1.72 2.88 -1.26 -4.41 113.62 111.13 2d8y n SER 41 Ca 0.12 0.40 0.13 0.00 -1.33 0.00 0.00 58.87 58.19 2d8y n SER 41 Cb 1.20 -0.85 0.33 0.00 -0.75 0.00 0.00 64.21 64.14 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 -4.70 0.38 -4.11 0.00 7.35 0.47 -4.78 117.46 112.08 2d8y n PHE 43 Ca 0.22 0.02 -0.14 0.00 -0.76 0.00 0.00 57.45 56.79 2d8y n PHE 43 Cb 0.54 -1.23 -0.05 0.00 0.35 0.00 0.00 39.48 39.09 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 7.67 1.80 0.16 -4.13 0.52 -1.26 -2.36 118.95 121.34 2d8y s ARG 44 Ca 1.21 -1.71 -0.28 0.00 -0.52 0.00 0.00 55.73 54.43 2d8y s ARG 44 Cb -0.67 0.42 -0.07 0.00 0.52 0.00 0.00 34.95 35.15 2d8y s ARG 44 CO 0.43 -0.73 0.87 0.00 0.02 0.00 0.00 175.30 175.89 2d8y n SER 46 N 2.05 0.59 0.03 0.00 7.64 -0.73 -0.46 113.62 122.74 2d8y n SER 46 Ca -0.02 -1.98 0.00 0.00 1.01 0.00 0.00 58.87 57.88 2d8y n SER 46 Cb 0.48 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 2d8y n SER 46 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d8y n TYR 47 N -0.20 -0.17 -0.01 1.43 4.19 -1.26 -4.87 117.16 116.27 2d8y n TYR 47 Ca 0.00 0.03 0.08 0.00 3.31 0.00 0.00 57.90 61.32 2d8y n TYR 47 Cb 0.15 0.08 -0.13 0.00 0.49 0.00 0.00 39.34 39.92 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 -2.13 -2.53 -4.76 0.00 2.85 0.39 -4.94 115.26 104.14 2d8y n ASN 49 Ca -0.05 -0.35 -0.35 0.00 -0.11 0.00 0.00 54.58 53.72 2d8y n ASN 49 Cb 0.49 -3.20 -0.08 0.00 1.24 0.00 0.00 39.78 38.23 2d8y n ASN 49 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2d8y s ASN 50 N -3.68 5.66 0.51 1.20 4.22 -1.26 -4.70 114.94 116.89 2d8y s ASN 50 Ca 0.07 0.25 -0.21 0.00 -2.14 0.00 0.00 52.86 50.82 2d8y s ASN 50 Cb -0.03 -1.68 -0.08 0.00 1.28 0.00 0.00 41.25 40.74 2d8y s ASN 50 CO 0.43 0.37 0.94 0.29 -2.04 0.00 0.00 177.10 177.09 2d8y n LYS 51 N 1.94 1.10 -4.19 3.55 4.76 -1.26 -2.60 118.16 121.46 2d8y n LYS 51 Ca -0.18 0.41 -0.12 0.00 -2.87 0.00 0.00 58.31 55.54 2d8y n LYS 51 Cb 0.54 -2.06 -0.10 0.00 -1.84 0.00 0.00 35.03 31.57 2d8y n LYS 51 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2d8y s LEU 52 N -0.97 1.11 0.05 -0.35 1.43 -0.99 -4.91 118.68 114.04 2d8y s LEU 52 Ca 0.68 -1.37 -0.01 0.00 -1.03 0.00 0.00 54.13 52.41 2d8y s LEU 52 Cb -0.49 0.50 -0.04 0.00 0.03 0.00 0.00 46.19 46.20 2d8y s LEU 52 CO 0.53 -0.88 -0.03 -0.44 0.23 0.00 0.00 176.35 175.76 2d8y s SER 53 N -3.16 0.45 -0.49 2.29 0.01 -1.26 -4.92 113.70 106.63 2d8y s SER 53 Ca 0.38 -0.92 -0.28 0.00 1.31 0.00 0.00 55.95 56.43 2d8y s SER 53 Cb 0.06 0.18 -0.09 0.00 0.21 0.00 0.00 66.02 66.38 2d8y s SER 53 CO 0.12 -0.55 2.39 0.18 0.41 0.00 0.00 173.24 175.79 2d8y n LEU 54 N 0.35 2.20 0.00 2.44 4.77 -1.26 -1.80 117.00 123.70 2d8y n LEU 54 Ca -0.16 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 2d8y n LEU 54 Cb 0.60 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.24 2d8y n LEU 54 CO 0.27 -1.19 0.00 0.61 -1.33 0.00 0.00 177.39 175.74 2d8y n GLY 55 N 6.11 3.49 0.13 -0.72 0.00 -1.26 -4.95 105.19 107.98 2d8y n GLY 55 Ca 0.40 -0.48 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 2d8y n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2d8y n THR 56 N 0.00 1.53 -0.84 2.61 -2.24 -0.74 -4.53 114.28 110.07 2d8y n THR 56 Ca 0.00 -0.49 -0.35 0.00 -2.27 0.00 0.00 64.05 60.93 2d8y n THR 56 Cb 0.00 -1.62 0.10 0.00 -2.10 0.00 0.00 70.33 66.71 2d8y n THR 56 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d8y n TYR 57 N -3.65 -1.60 -3.27 4.78 4.11 -1.18 -3.94 117.16 112.40 2d8y n TYR 57 Ca -0.47 0.37 0.03 0.00 -0.00 0.00 0.00 57.90 57.83 2d8y n TYR 57 Cb 0.95 -1.49 -0.02 0.00 -0.00 0.00 0.00 39.34 38.78 2d8y n TYR 57 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2d8y s ALA 58 N -2.13 -2.67 0.15 -3.48 0.00 -0.52 -4.85 121.76 108.26 2d8y s ALA 58 Ca 0.46 1.84 0.04 0.00 0.00 0.00 0.00 51.96 54.30 2d8y s ALA 58 Cb -0.03 -2.19 -0.04 0.00 0.00 0.00 0.00 23.12 20.87 2d8y s ALA 58 CO 0.67 -1.23 0.19 0.45 0.00 0.00 0.00 175.76 175.84 2d8y s SER 59 N 2.81 5.88 0.09 0.00 0.15 -1.26 -0.91 113.70 120.46 2d8y s SER 59 Ca 0.06 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2d8y s SER 59 Cb -0.11 -1.65 0.00 0.00 -1.71 0.00 0.00 66.02 62.54 2d8y s SER 59 CO -0.17 0.08 0.00 -0.11 1.20 0.00 0.00 173.24 174.24 2d8y n LEU 60 N -0.33 0.59 -1.49 3.45 7.94 -1.18 -4.88 117.00 121.11 2d8y n LEU 60 Ca -0.08 0.14 -0.13 0.00 -1.11 0.00 0.00 56.01 54.84 2d8y n LEU 60 Cb 0.54 -0.13 0.11 0.00 0.53 0.00 0.00 43.42 44.46 2d8y n LEU 60 CO 0.46 -0.68 0.37 1.41 -1.11 0.00 0.00 177.39 177.84 2d8y n HIS 61 N -3.18 1.71 0.00 1.96 8.25 -1.26 -4.90 115.22 117.80 2d8y n HIS 61 Ca 0.00 -1.97 0.00 0.00 -0.26 0.00 0.00 57.72 55.49 2d8y n HIS 61 Cb 0.00 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 30.72 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 -0.90 2.16 3.80 -1.41 0.00 -1.26 -5.06 105.19 102.52 2d8y n GLY 62 Ca 0.36 -0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 4.34 0.62 1.61 0.52 -1.26 -5.02 118.95 119.75 2d8y s ARG 63 Ca 0.00 0.89 -0.10 0.00 -0.52 0.00 0.00 55.73 56.00 2d8y s ARG 63 Cb 0.00 -3.25 -0.03 0.00 0.52 0.00 0.00 34.95 32.19 2d8y s ARG 63 CO 0.00 0.61 1.00 0.42 0.02 0.00 0.00 175.30 177.35 2d8y s ILE 64 N -1.11 4.44 -0.22 1.52 -1.09 -1.26 -3.08 121.20 120.40 2d8y s ILE 64 Ca 0.31 0.66 -0.22 0.00 -2.23 0.00 0.00 60.65 59.17 2d8y s ILE 64 Cb -0.21 -3.77 0.06 0.00 -1.58 0.00 0.00 42.46 36.96 2d8y s ILE 64 CO 0.22 -0.97 0.63 -0.31 -1.23 0.00 0.00 174.94 173.27 2d8y s TYR 65 N -3.15 -0.68 0.38 3.97 2.02 -0.09 -1.77 117.35 118.03 2d8y s TYR 65 Ca 0.55 1.61 -0.25 0.00 -0.37 0.00 0.00 57.07 58.61 2d8y s TYR 65 Cb -0.11 0.25 -0.09 0.00 -0.40 0.00 0.00 41.96 41.61 2d8y s TYR 65 CO 0.52 -0.35 1.08 0.00 -1.57 0.00 0.00 175.55 175.23 2d8y n LYS 67 N 0.15 -0.12 -0.01 0.00 4.76 -1.25 0.02 118.16 121.71 2d8y n LYS 67 Ca 0.04 1.37 -0.05 0.00 -2.87 0.00 0.00 58.31 56.81 2d8y n LYS 67 Cb 0.48 -2.05 -0.03 0.00 -1.84 0.00 0.00 35.03 31.59 2d8y n LYS 67 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 2d8y h PRO 68 N 0.00 -0.16 -0.59 1.97 0.11 -1.94 0.22 132.00 131.62 2d8y h PRO 68 Ca 0.39 0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.53 2d8y h PRO 68 Cb 0.61 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.72 2d8y h PRO 68 CO -0.90 -0.11 0.37 0.45 -0.21 0.00 0.00 178.00 177.60 2d8y h HIS 69 N -0.17 0.70 0.02 0.65 3.86 -1.62 -2.53 115.15 116.06 2d8y h HIS 69 Ca 0.01 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2d8y h HIS 69 Cb 0.20 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.44 2d8y h HIS 69 CO -0.52 0.41 -0.05 0.35 0.86 0.00 0.00 177.93 178.99 2d8y h PHE 70 N 0.74 -0.13 0.00 2.45 3.04 -0.02 0.56 116.94 123.58 2d8y h PHE 70 Ca 0.23 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.18 2d8y h PHE 70 Cb -0.02 0.05 0.00 0.00 2.56 0.00 0.00 35.95 38.54 2d8y h PHE 70 CO -0.05 -0.05 0.39 -0.97 -2.02 0.00 0.00 178.31 175.60 2d8y h ASN 71 N -0.07 0.00 0.00 0.41 -1.24 -0.56 0.75 115.58 114.86 2d8y h ASN 71 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2d8y h ASN 71 Cb 0.07 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.12 2d8y h ASN 71 CO -0.02 0.00 -0.01 -0.61 -1.29 0.00 0.00 177.43 175.50 2d8y h GLN 72 N 0.00 0.00 -0.86 6.67 4.15 -0.56 -2.94 115.11 121.57 2d8y h GLN 72 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 2d8y h GLN 72 Cb 0.77 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.42 2d8y h GLN 72 CO 0.00 0.00 0.45 -0.07 -1.93 0.00 0.00 178.83 177.28 2d8y h LEU 73 N -0.02 1.08 0.37 -2.39 3.38 0.42 -3.17 115.31 114.99 2d8y h LEU 73 Ca 0.00 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 2d8y h LEU 73 Cb 0.01 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.48 2d8y h LEU 73 CO 0.00 0.88 -0.18 -0.26 0.09 0.00 0.00 178.44 178.97 2d8y h PHE 74 N 1.21 -0.46 -3.99 1.13 -1.00 0.34 -3.46 116.94 110.71 2d8y h PHE 74 Ca 0.30 -0.01 -0.44 0.00 2.81 0.00 0.00 57.97 60.63 2d8y h PHE 74 Cb 0.05 0.15 0.16 0.00 3.61 0.00 0.00 35.95 39.93 2d8y h PHE 74 CO 0.01 -0.15 0.33 0.21 -1.61 0.00 0.00 178.31 177.10 2d8y s LYS 75 N -3.91 0.39 0.07 1.51 2.20 -1.11 -5.03 119.74 113.85 2d8y s LYS 75 Ca -0.12 -0.14 -0.24 0.00 -0.36 0.00 0.00 55.97 55.12 2d8y s LYS 75 Cb 0.01 -1.79 0.06 0.00 -1.51 0.00 0.00 37.83 34.60 2d8y s LYS 75 CO 0.41 -2.63 0.56 -1.12 -0.36 0.00 0.00 175.35 172.21 2d8y s SER 76 N -4.44 -0.50 0.02 1.43 0.01 -1.26 -4.69 113.70 104.27 2d8y s SER 76 Ca 0.70 0.18 -0.30 0.00 1.31 0.00 0.00 55.95 57.84 2d8y s SER 76 Cb -0.08 0.53 -0.07 0.00 0.21 0.00 0.00 66.02 66.61 2d8y s SER 76 CO 0.53 -0.78 1.61 -0.75 0.41 0.00 0.00 173.24 174.26 2d8y s LYS 77 N -2.72 4.21 0.00 12.44 2.20 -1.26 -4.77 119.74 129.84 2d8y s LYS 77 Ca -0.04 2.23 0.00 0.00 -0.36 0.00 0.00 55.97 57.80 2d8y s LYS 77 Cb -0.00 -3.71 0.00 0.00 -1.51 0.00 0.00 37.83 32.61 2d8y s LYS 77 CO -0.04 -0.74 0.00 0.41 -0.36 0.00 0.00 175.35 174.62 2d8y n GLY 78 N 3.97 0.84 2.77 5.54 0.00 -1.26 -5.06 105.19 112.00 2d8y n GLY 78 Ca 0.16 -1.81 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 2d8y n GLY 78 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2d8y s ASN 79 N -4.00 2.34 0.06 1.61 3.84 -1.26 -5.13 114.94 112.39 2d8y s ASN 79 Ca 0.00 -0.49 -0.05 0.00 0.21 0.00 0.00 52.86 52.53 2d8y s ASN 79 Cb 0.00 -0.58 -0.02 0.00 -0.55 0.00 0.00 41.25 40.11 2d8y s ASN 79 CO 0.00 -0.24 0.09 -0.31 -2.79 0.00 0.00 177.10 173.85 2d8y s TYR 80 N 1.88 0.26 0.21 0.43 2.02 -1.26 -5.12 117.35 115.77 2d8y s TYR 80 Ca 0.02 -0.67 -0.23 0.00 -0.37 0.00 0.00 57.07 55.82 2d8y s TYR 80 Cb -0.15 -0.18 -0.15 0.00 -0.40 0.00 0.00 41.96 41.09 2d8y s TYR 80 CO -0.07 -0.42 0.38 -3.47 -1.57 0.00 0.00 175.55 170.40 2d8y n ASP 81 N 0.36 -1.38 -2.39 2.29 2.03 -1.26 -4.90 116.55 111.30 2d8y n ASP 81 Ca -0.17 0.93 -0.15 0.00 0.52 0.00 0.00 54.79 55.92 2d8y n ASP 81 Cb 0.60 -0.82 0.03 0.00 -0.72 0.00 0.00 41.12 40.21 2d8y n ASP 81 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2d8y n GLU 82 N 0.93 2.78 -0.81 -0.67 1.02 -1.26 -4.90 120.64 117.74 2d8y n GLU 82 Ca 0.15 -3.91 -0.09 0.00 -0.02 0.00 0.00 57.16 53.28 2d8y n GLU 82 Cb 0.24 -1.98 -0.05 0.00 -0.02 0.00 0.00 31.44 29.63 2d8y n GLU 82 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2d8y n GLY 83 N -0.61 3.07 3.13 0.62 0.00 -1.26 -4.82 105.19 105.32 2d8y n GLY 83 Ca 0.28 -0.72 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 2d8y n GLY 83 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2d8y s PHE 84 N -0.11 2.06 -0.07 1.61 5.36 -1.26 -5.13 117.98 120.44 2d8y s PHE 84 Ca 0.31 -0.83 -0.01 0.00 -0.96 0.00 0.00 56.93 55.45 2d8y s PHE 84 Cb 0.17 -1.42 -0.03 0.00 -0.34 0.00 0.00 43.02 41.40 2d8y s PHE 84 CO -0.02 -0.36 -0.01 0.20 -1.46 0.00 0.00 175.22 173.57 2d8y s GLY 85 N 0.51 1.83 0.24 13.12 0.00 -1.26 -5.12 107.32 116.64 2d8y s GLY 85 Ca -0.17 -0.84 0.05 0.00 0.00 0.00 0.00 44.72 43.76 2d8y s GLY 85 CO 0.06 -0.63 -0.04 -1.35 0.00 0.00 0.00 173.10 171.14 2d8y s SER 86 N -0.99 2.28 0.98 1.64 1.04 -1.26 -5.14 113.70 112.25 2d8y s SER 86 Ca 0.14 -1.18 -0.13 0.00 0.48 0.00 0.00 55.95 55.26 2d8y s SER 86 Cb -0.11 -0.08 0.06 0.00 0.10 0.00 0.00 66.02 65.99 2d8y s SER 86 CO 0.04 -0.41 0.44 0.61 0.98 0.00 0.00 173.24 174.90 2d8y n GLY 87 N -0.47 -1.92 3.77 7.32 0.00 -1.26 -4.95 105.19 107.67 2d8y n GLY 87 Ca -0.06 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 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 -3.73 2.89 -0.18 1.61 0.04 -1.26 -4.90 135.00 129.47 2d8y s PRO 88 Ca 0.58 1.42 -0.33 0.00 0.04 0.00 0.00 61.00 62.71 2d8y s PRO 88 Cb -0.20 -1.96 -0.10 0.00 0.04 0.00 0.00 34.50 32.28 2d8y s PRO 88 CO 0.66 -1.18 2.03 -1.13 0.04 0.00 0.00 177.00 177.42 2d8y n SER 89 N -2.24 3.12 -3.79 6.66 3.41 -1.26 -4.77 113.62 114.74 2d8y n SER 89 Ca 0.11 0.68 -0.24 0.00 -0.26 0.00 0.00 58.87 59.15 2d8y n SER 89 Cb 0.52 -1.39 0.17 0.00 -0.26 0.00 0.00 64.21 63.25 2d8y n SER 89 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2d8y n SER 90 N 8.49 -2.90 0.00 4.04 3.41 -1.26 -5.11 113.62 120.28 2d8y n SER 90 Ca 0.29 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 2d8y n SER 90 Cb 0.31 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 2d8y n SER 90 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49