#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 -0.62 -0.08 1.61 0.01 -1.26 -5.17 113.70 108.19 2d8y s SER 2 Ca 0.00 1.12 -0.29 0.00 1.31 0.00 0.00 55.95 58.10 2d8y s SER 2 Cb 0.00 1.08 0.07 0.00 0.21 0.00 0.00 66.02 67.38 2d8y s SER 2 CO 0.00 -0.20 0.65 -0.55 0.41 0.00 0.00 173.24 173.55 2d8y s SER 3 N 0.79 -0.63 0.00 2.44 0.15 -1.26 -5.08 113.70 110.11 2d8y s SER 3 Ca -0.04 0.77 0.00 0.00 0.70 0.00 0.00 55.95 57.38 2d8y s SER 3 Cb -0.05 0.65 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 2d8y s SER 3 CO -0.06 -0.54 0.00 0.61 1.20 0.00 0.00 173.24 174.45 2d8y n GLY 4 N 1.21 -1.24 3.34 9.45 0.00 -1.26 -5.11 105.19 111.58 2d8y n GLY 4 Ca -0.18 0.35 -0.46 0.00 0.00 0.00 0.00 46.02 45.73 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 6.41 -0.13 1.61 0.15 -1.26 -5.00 113.70 115.48 2d8y s SER 5 Ca 0.00 -2.01 -0.16 0.00 0.70 0.00 0.00 55.95 54.49 2d8y s SER 5 Cb 0.00 -2.25 0.04 0.00 -1.71 0.00 0.00 66.02 62.10 2d8y s SER 5 CO 0.00 -0.85 0.42 -0.94 1.20 0.00 0.00 173.24 173.07 2d8y s SER 6 N 3.16 -0.41 0.95 5.45 1.04 -1.26 -5.16 113.70 117.47 2d8y s SER 6 Ca 0.12 0.70 -0.11 0.00 0.48 0.00 0.00 55.95 57.14 2d8y s SER 6 Cb -0.20 0.74 0.17 0.00 0.10 0.00 0.00 66.02 66.83 2d8y s SER 6 CO -0.01 -0.23 1.10 -0.83 0.98 0.00 0.00 173.24 174.25 2d8y s GLY 7 N -0.15 1.64 0.04 7.32 0.00 -1.26 -5.06 107.32 109.85 2d8y s GLY 7 Ca -0.03 0.26 -0.02 0.00 0.00 0.00 0.00 44.72 44.92 2d8y s GLY 7 CO 0.02 0.75 0.01 -0.29 0.00 0.00 0.00 173.10 173.59 2d8y s MET 8 N -4.69 0.56 -0.09 2.90 0.00 -1.26 -5.09 119.30 111.63 2d8y s MET 8 Ca 0.66 -0.99 -0.11 0.00 0.00 0.00 0.00 55.69 55.24 2d8y s MET 8 Cb -0.22 0.20 -0.04 0.00 0.00 0.00 0.00 34.83 34.77 2d8y s MET 8 CO 0.59 -0.12 -0.23 1.17 0.00 0.00 0.00 175.02 176.44 2d8y n LYS 9 N 0.51 0.35 -0.70 4.11 3.00 -1.26 -4.98 118.16 119.20 2d8y n LYS 9 Ca -0.17 0.14 -0.31 0.00 -0.00 0.00 0.00 58.31 57.97 2d8y n LYS 9 Cb 0.59 -1.11 0.16 0.00 0.00 0.00 0.00 35.03 34.68 2d8y n LYS 9 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2d8y n PHE 10 N -4.09 -0.29 -1.04 5.64 3.01 -1.26 -4.67 117.46 114.75 2d8y n PHE 10 Ca -0.12 0.27 -0.46 0.00 1.01 0.00 0.00 57.45 58.16 2d8y n PHE 10 Cb 0.38 -1.87 -0.08 0.00 -0.01 0.00 0.00 39.48 37.90 2d8y n PHE 10 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 2d8y n GLN 11 N -3.31 0.00 -0.28 -1.08 1.13 -1.26 -4.76 117.38 107.82 2d8y n GLN 11 Ca 0.09 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 55.07 2d8y n GLN 11 Cb 0.53 -1.08 -0.07 0.00 0.11 0.00 0.00 30.24 29.74 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 4.39 -0.43 -1.77 -1.58 0.00 -1.26 -4.39 120.51 115.47 2d8y n ALA 12 Ca 0.33 0.57 -0.36 0.00 0.00 0.00 0.00 53.44 53.98 2d8y n ALA 12 Cb -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 19.45 19.36 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 -5.10 3.64 0.34 0.00 0.04 -1.26 -4.96 135.00 127.70 2d8y s PRO 13 Ca -0.08 1.73 -0.27 0.00 0.04 0.00 0.00 61.00 62.41 2d8y s PRO 13 Cb 0.07 -2.29 -0.13 0.00 0.04 0.00 0.00 34.50 32.20 2d8y s PRO 13 CO 0.42 -0.64 1.16 0.00 0.04 0.00 0.00 177.00 177.98 2d8y n ALA 14 N -0.72 0.65 -1.97 8.56 0.00 -1.26 -4.99 120.51 120.78 2d8y n ALA 14 Ca 0.08 0.35 -0.23 0.00 0.00 0.00 0.00 53.44 53.64 2d8y n ALA 14 Cb 0.49 -2.15 0.05 0.00 0.00 0.00 0.00 19.45 17.83 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 -1.80 2.43 0.67 0.00 1.70 -1.26 -5.10 118.95 115.59 2d8y s ARG 15 Ca 0.58 -0.52 -0.02 0.00 -0.47 0.00 0.00 55.73 55.29 2d8y s ARG 15 Cb -0.61 -2.35 0.09 0.00 -0.57 0.00 0.00 34.95 31.51 2d8y s ARG 15 CO 0.61 -0.92 0.94 -1.83 -1.08 0.00 0.00 175.30 173.02 2d8y s GLU 16 N -4.97 2.01 -0.17 3.89 -1.05 -1.26 -5.06 118.70 112.09 2d8y s GLU 16 Ca 0.58 -0.79 -0.23 0.00 -0.15 0.00 0.00 54.97 54.38 2d8y s GLU 16 Cb -0.10 -2.32 0.06 0.00 -0.44 0.00 0.00 34.13 31.32 2d8y s GLU 16 CO 0.41 -1.21 0.59 0.99 0.95 0.00 0.00 175.26 176.99 2d8y s THR 17 N -3.08 0.01 0.05 1.83 2.01 -1.26 -3.44 115.64 111.76 2d8y s THR 17 Ca 0.62 -0.05 -0.31 0.00 0.31 0.00 0.00 61.69 62.27 2d8y s THR 17 Cb -0.08 -0.85 -0.07 0.00 0.01 0.00 0.00 72.50 71.51 2d8y s THR 17 CO 0.43 -0.03 1.41 0.00 -0.69 0.00 0.00 174.62 175.75 2d8y n VAL 19 N 4.36 0.35 0.01 0.00 0.24 -1.07 -0.87 118.33 121.35 2d8y n VAL 19 Ca 0.13 -0.22 -0.03 0.00 -2.04 0.00 0.00 64.34 62.18 2d8y n VAL 19 Cb 0.43 -0.23 -0.01 0.00 -1.47 0.00 0.00 33.84 32.56 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 0.08 -0.00 7.34 1.02 -1.26 -4.82 120.64 123.01 2d8y n GLU 20 Ca 0.05 0.03 0.08 0.00 -0.02 0.00 0.00 57.16 57.30 2d8y n GLU 20 Cb 0.29 -0.64 -0.11 0.00 -0.02 0.00 0.00 31.44 30.96 2d8y n GLU 20 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d8y n GLN 22 N -1.63 -4.18 -4.80 0.00 1.13 -0.05 -5.01 117.38 102.84 2d8y n GLN 22 Ca 0.01 0.56 -0.27 0.00 -1.94 0.00 0.00 57.00 55.37 2d8y n GLN 22 Cb 0.33 -4.70 -0.16 0.00 0.11 0.00 0.00 30.24 25.81 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 -4.83 1.99 -0.59 -1.09 3.01 -1.25 -4.82 119.74 112.15 2d8y s LYS 23 Ca 0.02 -0.57 -0.41 0.00 -1.01 0.00 0.00 55.97 54.00 2d8y s LYS 23 Cb -0.00 -1.63 -0.19 0.00 -1.01 0.00 0.00 37.83 34.99 2d8y s LYS 23 CO 0.48 0.14 2.22 2.41 0.51 0.00 0.00 175.35 181.11 2d8y n THR 24 N 3.51 0.00 -2.57 2.17 -1.04 -1.26 -2.27 114.28 112.83 2d8y n THR 24 Ca -0.20 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.38 2d8y n THR 24 Cb 0.52 -0.49 -0.02 0.00 -1.82 0.00 0.00 70.33 68.52 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 6.51 4.52 0.66 12.58 1.01 -1.22 -4.90 120.40 139.56 2d8y s VAL 25 Ca 1.21 1.84 -0.11 0.00 0.00 0.00 0.00 61.98 64.92 2d8y s VAL 25 Cb -1.43 -4.18 -0.01 0.00 0.00 0.00 0.00 36.38 30.75 2d8y s VAL 25 CO 0.62 -0.15 1.05 -0.31 0.00 0.00 0.00 175.10 176.30 2d8y s TYR 26 N 3.26 3.24 -2.00 5.22 1.51 -1.26 -4.64 117.35 122.68 2d8y s TYR 26 Ca 0.48 1.40 0.09 0.00 -1.01 0.00 0.00 57.07 58.03 2d8y s TYR 26 Cb -0.18 -2.85 0.52 0.00 -0.11 0.00 0.00 41.96 39.34 2d8y s TYR 26 CO 0.10 -1.06 0.97 -0.35 -1.11 0.00 0.00 175.55 174.09 2d8y n PRO 27 N -2.90 0.49 -0.01 -1.71 -0.04 -1.26 -1.98 135.00 127.60 2d8y n PRO 27 Ca 0.07 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.59 2d8y n PRO 27 Cb 0.54 -1.28 -0.09 0.00 -0.04 0.00 0.00 33.50 32.63 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 0.43 -0.54 0.54 0.00 -1.26 -4.56 117.12 110.95 2d8y n MET 28 Ca 0.07 -0.10 0.07 0.00 -0.00 0.00 0.00 57.70 57.73 2d8y n MET 28 Cb 0.03 -1.28 0.15 0.00 0.00 0.00 0.00 33.22 32.13 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 -1.92 1.22 -3.02 2.12 0.28 -0.84 -5.01 120.64 113.48 2d8y n GLU 29 Ca -0.03 -2.80 -0.43 0.00 -0.16 0.00 0.00 57.16 53.75 2d8y n GLU 29 Cb 0.32 -1.33 -0.06 0.00 1.43 0.00 0.00 31.44 31.81 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 -2.56 3.32 -0.30 3.44 3.52 -0.87 -3.75 118.95 121.76 2d8y s ARG 30 Ca 0.33 -0.30 -0.01 0.00 -0.13 0.00 0.00 55.73 55.63 2d8y s ARG 30 Cb 0.32 -3.98 0.06 0.00 -1.56 0.00 0.00 34.95 29.79 2d8y s ARG 30 CO -0.05 -1.14 -0.01 -1.17 -0.81 0.00 0.00 175.30 172.12 2d8y s LEU 31 N 3.15 3.93 0.02 -0.88 0.20 -0.02 -4.96 118.68 120.12 2d8y s LEU 31 Ca 0.26 -1.39 -0.30 0.00 0.69 0.00 0.00 54.13 53.38 2d8y s LEU 31 Cb -0.14 -1.68 -0.07 0.00 -0.43 0.00 0.00 46.19 43.87 2d8y s LEU 31 CO 0.20 -0.27 1.65 -0.22 -0.29 0.00 0.00 176.35 177.42 2d8y s LEU 32 N 1.19 4.35 -0.20 -0.68 1.98 -1.26 -1.01 118.68 123.06 2d8y s LEU 32 Ca -0.04 2.38 -0.04 0.00 -2.89 0.00 0.00 54.13 53.54 2d8y s LEU 32 Cb -0.20 -3.55 0.09 0.00 0.66 0.00 0.00 46.19 43.19 2d8y s LEU 32 CO -0.02 -0.89 0.20 0.00 -1.89 0.00 0.00 176.35 173.74 2d8y s ALA 33 N 3.16 -0.14 -1.03 5.97 0.00 0.23 -4.87 121.76 125.07 2d8y s ALA 33 Ca 0.74 0.16 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 2d8y s ALA 33 Cb -0.37 -1.26 0.01 0.00 0.00 0.00 0.00 23.12 21.50 2d8y s ALA 33 CO 0.31 -1.19 0.90 -1.71 0.00 0.00 0.00 175.76 174.07 2d8y n ASN 34 N 5.31 -5.34 -2.67 0.00 5.15 -1.26 -2.47 115.26 113.98 2d8y n ASN 34 Ca -0.06 -0.41 -0.19 0.00 -0.60 0.00 0.00 54.58 53.32 2d8y n ASN 34 Cb 0.49 -3.94 0.04 0.00 -0.53 0.00 0.00 39.78 35.84 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 -3.92 -4.57 -3.80 1.20 6.02 -1.26 -5.00 117.38 106.05 2d8y n GLN 35 Ca 0.01 0.77 -0.12 0.00 -0.01 0.00 0.00 57.00 57.65 2d8y n GLN 35 Cb 0.55 -5.36 -0.09 0.00 1.02 0.00 0.00 30.24 26.36 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 -5.61 0.66 -0.24 -1.09 -0.21 -1.03 -5.13 119.66 107.01 2d8y s GLN 36 Ca 0.29 -0.39 -0.29 0.00 0.02 0.00 0.00 55.36 54.99 2d8y s GLN 36 Cb -0.13 0.28 0.01 0.00 1.00 0.00 0.00 33.01 34.17 2d8y s GLN 36 CO 0.36 -0.19 1.07 0.08 -2.12 0.00 0.00 175.29 174.49 2d8y s VAL 37 N -1.83 4.62 0.10 1.09 1.01 -1.26 -0.60 120.40 123.52 2d8y s VAL 37 Ca -0.10 1.94 0.08 0.00 0.00 0.00 0.00 61.98 63.90 2d8y s VAL 37 Cb -0.04 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 2d8y s VAL 37 CO 0.01 -0.22 -0.20 -0.36 0.00 0.00 0.00 175.10 174.33 2d8y s PHE 38 N 3.30 1.71 -0.18 5.22 0.08 -0.18 -2.61 117.98 125.32 2d8y s PHE 38 Ca 0.45 -0.42 -0.25 0.00 0.12 0.00 0.00 56.93 56.83 2d8y s PHE 38 Cb -0.15 -0.94 -0.01 0.00 -0.57 0.00 0.00 43.02 41.34 2d8y s PHE 38 CO 0.08 0.18 0.81 -1.01 -0.10 0.00 0.00 175.22 175.18 2d8y s HIS 39 N -1.17 3.41 0.61 0.36 3.76 -1.26 -0.84 115.29 120.16 2d8y s HIS 39 Ca 0.05 1.21 0.24 0.00 -0.15 0.00 0.00 55.06 56.42 2d8y s HIS 39 Cb -0.10 -2.99 0.84 0.00 1.11 0.00 0.00 32.58 31.43 2d8y s HIS 39 CO 0.04 -0.25 1.27 0.82 -0.85 0.00 0.00 174.74 175.78 2d8y h ILE 40 N 5.21 0.00 0.00 0.60 5.03 -1.91 0.29 117.51 126.73 2d8y h ILE 40 Ca -0.29 0.00 -0.21 0.00 -0.12 0.00 0.00 64.86 64.24 2d8y h ILE 40 Cb 1.13 0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 34.89 2d8y h ILE 40 CO 0.83 0.00 -1.37 -0.24 -0.68 0.00 0.00 178.15 176.69 2d8y n SER 41 N -3.18 1.88 -0.31 1.72 2.88 -1.26 -4.39 113.62 110.96 2d8y n SER 41 Ca 0.22 0.44 0.09 0.00 -1.33 0.00 0.00 58.87 58.29 2d8y n SER 41 Cb 1.50 -0.88 0.26 0.00 -0.75 0.00 0.00 64.21 64.33 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 -4.88 0.23 -4.21 0.00 7.35 0.37 -4.80 117.46 111.53 2d8y n PHE 43 Ca 0.19 0.03 -0.13 0.00 -0.76 0.00 0.00 57.45 56.77 2d8y n PHE 43 Cb 0.50 -0.98 -0.09 0.00 0.35 0.00 0.00 39.48 39.25 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 7.45 1.34 0.25 -4.13 0.52 -1.26 -0.05 118.95 123.08 2d8y s ARG 44 Ca 1.26 -1.70 -0.26 0.00 -0.52 0.00 0.00 55.73 54.51 2d8y s ARG 44 Cb -0.77 0.29 -0.09 0.00 0.52 0.00 0.00 34.95 34.91 2d8y s ARG 44 CO 0.49 -0.46 0.87 0.00 0.02 0.00 0.00 175.30 176.22 2d8y n SER 46 N 1.03 2.46 0.06 0.00 7.64 0.11 -1.33 113.62 123.59 2d8y n SER 46 Ca -0.01 -2.15 0.00 0.00 1.01 0.00 0.00 58.87 57.72 2d8y n SER 46 Cb 0.49 -0.53 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 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 0.22 -0.92 -0.06 1.43 4.19 -1.26 -4.91 117.16 115.84 2d8y n TYR 47 Ca 0.05 0.16 -0.02 0.00 3.31 0.00 0.00 57.90 61.41 2d8y n TYR 47 Cb 0.52 0.41 -0.15 0.00 0.49 0.00 0.00 39.34 40.60 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 -2.51 -3.09 -4.65 0.00 5.15 -0.44 -4.95 115.26 104.77 2d8y n ASN 49 Ca -0.20 -0.14 -0.36 0.00 -0.60 0.00 0.00 54.58 53.27 2d8y n ASN 49 Cb 0.89 -1.70 -0.10 0.00 -0.53 0.00 0.00 39.78 38.35 2d8y n ASN 49 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2d8y s ASN 50 N -3.10 5.96 0.13 1.20 -0.87 -1.26 -4.69 114.94 112.32 2d8y s ASN 50 Ca 0.15 0.10 -0.34 0.00 -1.57 0.00 0.00 52.86 51.19 2d8y s ASN 50 Cb -0.06 -2.06 -0.16 0.00 -0.02 0.00 0.00 41.25 38.94 2d8y s ASN 50 CO 0.19 0.09 1.21 1.17 -2.57 0.00 0.00 177.10 177.19 2d8y n LYS 51 N 4.09 1.07 -3.09 -0.60 4.81 -1.26 -2.93 118.16 120.25 2d8y n LYS 51 Ca -0.16 0.38 -0.13 0.00 -0.87 0.00 0.00 58.31 57.54 2d8y n LYS 51 Cb 0.52 -1.92 -0.03 0.00 0.02 0.00 0.00 35.03 33.62 2d8y n LYS 51 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2d8y n LEU 52 N 2.16 0.00 -3.68 3.14 4.77 0.92 -4.94 117.00 119.38 2d8y n LEU 52 Ca 0.17 -1.33 -0.10 0.00 -0.03 0.00 0.00 56.01 54.72 2d8y n LEU 52 Cb 0.22 0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 2d8y n LEU 52 CO 0.61 -0.19 0.34 -0.55 -1.33 0.00 0.00 177.39 176.27 2d8y s SER 53 N -2.13 -0.33 -0.38 -1.43 0.15 -1.26 -4.88 113.70 103.43 2d8y s SER 53 Ca 0.03 -0.38 -0.38 0.00 0.70 0.00 0.00 55.95 55.91 2d8y s SER 53 Cb 0.00 0.61 -0.14 0.00 -1.71 0.00 0.00 66.02 64.78 2d8y s SER 53 CO 0.02 -1.08 2.11 0.18 1.20 0.00 0.00 173.24 175.66 2d8y n LEU 54 N -0.37 1.82 0.00 3.45 4.77 -1.26 -0.24 117.00 125.17 2d8y n LEU 54 Ca -0.11 0.59 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 2d8y n LEU 54 Cb 0.62 -1.15 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 2d8y n LEU 54 CO 0.15 -0.69 0.00 0.61 -1.33 0.00 0.00 177.39 176.13 2d8y n GLY 55 N 6.42 2.25 0.09 -0.72 0.00 -1.26 -4.86 105.19 107.11 2d8y n GLY 55 Ca 0.42 -0.67 -0.04 0.00 0.00 0.00 0.00 46.02 45.73 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 1.31 -1.56 2.61 -2.24 0.67 -4.95 114.28 110.12 2d8y n THR 56 Ca 0.00 -0.74 -0.29 0.00 -2.27 0.00 0.00 64.05 60.74 2d8y n THR 56 Cb 0.00 -0.76 0.18 0.00 -2.10 0.00 0.00 70.33 67.64 2d8y n THR 56 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2d8y s TYR 57 N -2.77 1.68 -0.30 4.78 -0.85 -0.95 -2.78 117.35 116.16 2d8y s TYR 57 Ca -0.05 0.57 -0.11 0.00 -0.52 0.00 0.00 57.07 56.96 2d8y s TYR 57 Cb 0.08 -3.66 0.18 0.00 0.38 0.00 0.00 41.96 38.94 2d8y s TYR 57 CO 0.82 -2.84 0.99 0.00 -1.52 0.00 0.00 175.55 173.00 2d8y s ALA 58 N -3.43 -3.34 0.19 9.51 0.00 -0.16 -4.73 121.76 119.81 2d8y s ALA 58 Ca 0.69 1.47 0.03 0.00 0.00 0.00 0.00 51.96 54.14 2d8y s ALA 58 Cb -0.10 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.50 2d8y s ALA 58 CO 0.54 -1.50 0.33 0.45 0.00 0.00 0.00 175.76 175.57 2d8y s SER 59 N 2.94 6.34 0.04 0.00 0.15 -1.26 -0.95 113.70 120.96 2d8y s SER 59 Ca 0.04 0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.87 2d8y s SER 59 Cb -0.10 -1.91 0.00 0.00 -1.71 0.00 0.00 66.02 62.30 2d8y s SER 59 CO -0.13 -0.00 0.00 -0.11 1.20 0.00 0.00 173.24 174.19 2d8y n LEU 60 N -0.84 0.12 -1.47 3.45 7.94 -1.15 -4.90 117.00 120.16 2d8y n LEU 60 Ca -0.07 0.07 -0.12 0.00 -1.11 0.00 0.00 56.01 54.78 2d8y n LEU 60 Cb 0.55 0.00 0.15 0.00 0.53 0.00 0.00 43.42 44.65 2d8y n LEU 60 CO 0.48 -0.56 0.69 1.41 -1.11 0.00 0.00 177.39 178.29 2d8y n HIS 61 N -2.73 1.65 0.00 1.96 8.25 -1.26 -4.88 115.22 118.21 2d8y n HIS 61 Ca 0.00 -1.89 0.00 0.00 -0.26 0.00 0.00 57.72 55.57 2d8y n HIS 61 Cb 0.00 -0.58 0.00 0.00 1.12 0.00 0.00 29.99 30.53 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 -1.03 2.28 3.85 -1.41 0.00 -1.26 -5.07 105.19 102.54 2d8y n GLY 62 Ca 0.39 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.19 3.98 0.35 1.61 0.52 -1.26 -5.03 118.95 118.93 2d8y s ARG 63 Ca 0.00 0.51 -0.07 0.00 -0.52 0.00 0.00 55.73 55.65 2d8y s ARG 63 Cb 0.00 -2.85 -0.06 0.00 0.52 0.00 0.00 34.95 32.57 2d8y s ARG 63 CO 0.00 0.42 0.67 0.42 0.02 0.00 0.00 175.30 176.83 2d8y s ILE 64 N -1.56 4.91 -0.02 1.52 -1.09 -1.26 -2.93 121.20 120.76 2d8y s ILE 64 Ca 0.41 0.32 -0.22 0.00 -2.23 0.00 0.00 60.65 58.93 2d8y s ILE 64 Cb -0.14 -3.74 0.04 0.00 -1.58 0.00 0.00 42.46 37.04 2d8y s ILE 64 CO 0.20 -0.45 0.47 -0.31 -1.23 0.00 0.00 174.94 173.62 2d8y s TYR 65 N -2.26 -0.39 0.10 3.97 2.02 -0.13 0.05 117.35 120.71 2d8y s TYR 65 Ca 0.47 0.62 -0.26 0.00 -0.37 0.00 0.00 57.07 57.53 2d8y s TYR 65 Cb -0.10 0.24 -0.06 0.00 -0.40 0.00 0.00 41.96 41.63 2d8y s TYR 65 CO 0.31 -0.50 0.81 0.00 -1.57 0.00 0.00 175.55 174.61 2d8y n LYS 67 N 2.41 -0.13 -0.01 0.00 4.01 -1.12 0.17 118.16 123.49 2d8y n LYS 67 Ca -0.02 0.71 -0.05 0.00 -0.51 0.00 0.00 58.31 58.43 2d8y n LYS 67 Cb 0.49 -1.05 -0.04 0.00 -0.51 0.00 0.00 35.03 33.93 2d8y n LYS 67 CO 0.00 0.00 0.00 -1.35 -1.11 0.00 0.00 177.40 174.94 2d8y h PRO 68 N 0.00 -0.19 -0.85 1.97 0.11 -1.92 0.85 132.00 131.98 2d8y h PRO 68 Ca 0.14 0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.29 2d8y h PRO 68 Cb 0.26 0.04 -0.05 0.00 0.11 0.00 0.00 31.00 31.36 2d8y h PRO 68 CO -0.45 -0.13 0.55 0.45 -0.21 0.00 0.00 178.00 178.21 2d8y h HIS 69 N -0.20 1.03 0.08 0.65 3.86 -1.10 -2.17 115.15 117.31 2d8y h HIS 69 Ca 0.01 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 2d8y h HIS 69 Cb 0.24 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.35 2d8y h HIS 69 CO -0.52 0.61 -0.19 0.35 0.86 0.00 0.00 177.93 179.04 2d8y h PHE 70 N 1.08 -0.53 -0.44 2.45 3.04 0.24 0.31 116.94 123.09 2d8y h PHE 70 Ca 0.33 0.01 0.13 0.00 3.98 0.00 0.00 57.97 62.42 2d8y h PHE 70 Cb -0.03 0.22 -0.02 0.00 2.56 0.00 0.00 35.95 38.69 2d8y h PHE 70 CO -0.02 -0.22 0.43 -0.97 -2.02 0.00 0.00 178.31 175.51 2d8y h ASN 71 N -0.29 0.00 0.06 0.41 -1.24 -0.79 0.80 115.58 114.53 2d8y h ASN 71 Ca -0.01 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.00 2d8y h ASN 71 Cb 0.28 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.33 2d8y h ASN 71 CO -0.08 0.00 -0.03 -0.61 -1.29 0.00 0.00 177.43 175.42 2d8y h GLN 72 N 0.00 -0.08 0.00 6.67 4.15 -0.51 0.53 115.11 125.87 2d8y h GLN 72 Ca 0.21 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.61 2d8y h GLN 72 Cb 1.07 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.78 2d8y h GLN 72 CO -0.00 -0.05 -0.11 -0.07 -1.93 0.00 0.00 178.83 176.66 2d8y h LEU 73 N -0.19 0.00 0.00 -2.39 3.38 -0.17 -3.25 115.31 112.68 2d8y h LEU 73 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2d8y h LEU 73 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2d8y h LEU 73 CO 0.01 0.11 -0.12 -0.26 0.09 0.00 0.00 178.44 178.28 2d8y h PHE 74 N 0.00 0.00 -3.57 1.13 -1.00 0.51 -3.48 116.94 110.53 2d8y h PHE 74 Ca -0.00 0.00 -0.46 0.00 2.81 0.00 0.00 57.97 60.32 2d8y h PHE 74 Cb 0.21 0.00 0.12 0.00 3.61 0.00 0.00 35.95 39.88 2d8y h PHE 74 CO 0.00 0.00 0.30 0.21 -1.61 0.00 0.00 178.31 177.21 2d8y s LYS 75 N -1.50 1.42 -0.09 1.51 2.20 0.19 -5.02 119.74 118.44 2d8y s LYS 75 Ca -0.03 -0.49 -0.29 0.00 -0.36 0.00 0.00 55.97 54.80 2d8y s LYS 75 Cb 0.00 -2.06 0.07 0.00 -1.51 0.00 0.00 37.83 34.34 2d8y s LYS 75 CO 0.05 -1.80 0.67 -1.54 -0.36 0.00 0.00 175.35 172.37 2d8y s SER 76 N -4.73 -0.66 0.28 1.43 1.04 -1.26 -4.42 113.70 105.39 2d8y s SER 76 Ca 0.67 0.83 -0.19 0.00 0.48 0.00 0.00 55.95 57.74 2d8y s SER 76 Cb -0.07 0.70 -0.13 0.00 0.10 0.00 0.00 66.02 66.62 2d8y s SER 76 CO 0.48 -0.54 0.18 1.17 0.98 0.00 0.00 173.24 175.51 2d8y n LYS 77 N 1.25 0.00 0.00 4.02 3.00 -1.26 -4.83 118.16 120.35 2d8y n LYS 77 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 2d8y n LYS 77 Cb 0.57 -0.81 0.00 0.00 0.00 0.00 0.00 35.03 34.79 2d8y n LYS 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2d8y n GLY 78 N 1.81 0.94 3.19 3.14 0.00 -1.26 -5.14 105.19 107.87 2d8y n GLY 78 Ca 0.11 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 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 0.00 3.41 -0.10 1.61 4.22 -1.26 -5.11 114.94 117.70 2d8y s ASN 79 Ca 0.00 -0.56 0.01 0.00 -2.14 0.00 0.00 52.86 50.17 2d8y s ASN 79 Cb 0.00 -1.53 -0.02 0.00 1.28 0.00 0.00 41.25 40.98 2d8y s ASN 79 CO 0.00 0.04 -0.13 -0.31 -2.04 0.00 0.00 177.10 174.66 2d8y s TYR 80 N 1.08 2.80 -0.84 1.54 2.02 -1.26 -5.03 117.35 117.66 2d8y s TYR 80 Ca -0.00 -0.45 -0.29 0.00 -0.37 0.00 0.00 57.07 55.95 2d8y s TYR 80 Cb -0.14 -1.78 -0.17 0.00 -0.40 0.00 0.00 41.96 39.46 2d8y s TYR 80 CO -0.06 -0.06 2.61 -0.25 -1.57 0.00 0.00 175.55 176.22 2d8y n ASP 81 N 3.11 0.91 -2.38 2.29 8.00 -1.26 -4.77 116.55 122.45 2d8y n ASP 81 Ca -0.18 -0.04 -0.34 0.00 0.71 0.00 0.00 54.79 54.94 2d8y n ASP 81 Cb 0.53 -1.13 0.07 0.00 -0.02 0.00 0.00 41.12 40.57 2d8y n ASP 81 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2d8y n GLU 82 N 8.65 2.82 0.00 -1.24 0.28 -1.26 -4.86 120.64 125.03 2d8y n GLU 82 Ca 0.57 -3.45 0.00 0.00 -0.16 0.00 0.00 57.16 54.12 2d8y n GLU 82 Cb 0.19 -2.29 0.00 0.00 1.43 0.00 0.00 31.44 30.78 2d8y n GLU 82 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2d8y n GLY 83 N -0.83 2.70 3.37 -1.84 0.00 -1.26 -4.96 105.19 102.36 2d8y n GLY 83 Ca 0.59 -0.70 -0.45 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.75 3.26 -0.56 1.61 0.40 -1.26 -4.99 117.98 115.69 2d8y s PHE 84 Ca 0.00 -1.36 -0.39 0.00 -0.60 0.00 0.00 56.93 54.58 2d8y s PHE 84 Cb 0.00 -3.98 -0.18 0.00 0.51 0.00 0.00 43.02 39.36 2d8y s PHE 84 CO 0.00 -1.21 2.11 0.41 0.70 0.00 0.00 175.22 177.22 2d8y n GLY 85 N 4.96 -0.20 2.89 4.36 0.00 -1.26 -4.89 105.19 111.05 2d8y n GLY 85 Ca 0.02 1.06 -0.15 0.00 0.00 0.00 0.00 46.02 46.94 2d8y n GLY 85 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d8y s SER 86 N 6.16 0.76 0.00 1.61 1.04 -1.26 -5.12 113.70 116.88 2d8y s SER 86 Ca 1.15 0.26 0.00 0.00 0.48 0.00 0.00 55.95 57.84 2d8y s SER 86 Cb -1.36 0.54 0.00 0.00 0.10 0.00 0.00 66.02 65.30 2d8y s SER 86 CO 0.59 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 175.15 2d8y n GLY 87 N 5.34 4.21 1.90 7.32 0.00 -1.26 -4.78 105.19 117.91 2d8y n GLY 87 Ca -0.05 -0.59 -0.16 0.00 0.00 0.00 0.00 46.02 45.21 2d8y n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d8y n PRO 88 N -1.36 -2.18 -5.06 1.61 -0.04 -1.26 -5.06 135.00 121.65 2d8y n PRO 88 Ca 0.00 -0.95 -0.32 0.00 -0.04 0.00 0.00 63.50 62.19 2d8y n PRO 88 Cb 0.00 -0.89 -0.15 0.00 -0.04 0.00 0.00 33.50 32.42 2d8y n PRO 88 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d8y s SER 89 N -3.10 3.50 -0.40 3.54 0.15 -1.26 -5.05 113.70 111.07 2d8y s SER 89 Ca 0.38 -0.42 -0.38 0.00 0.70 0.00 0.00 55.95 56.24 2d8y s SER 89 Cb -0.04 -1.16 -0.16 0.00 -1.71 0.00 0.00 66.02 62.95 2d8y s SER 89 CO 0.30 0.22 1.28 -1.20 1.20 0.00 0.00 173.24 175.04 2d8y n SER 90 N 3.11 0.97 0.00 5.45 7.64 -1.26 -5.37 113.62 124.16 2d8y n SER 90 Ca -0.18 0.95 0.00 0.00 1.01 0.00 0.00 58.87 60.66 2d8y n SER 90 Cb 0.52 -0.71 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 2d8y n SER 90 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64