#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrt s SER 2 N 0.00 -0.29 0.19 1.61 0.01 -1.26 -5.19 113.70 108.77 2yrt s SER 2 Ca 0.00 0.46 -0.04 0.00 1.31 0.00 0.00 55.95 57.67 2yrt s SER 2 Cb 0.00 0.42 -0.03 0.00 0.21 0.00 0.00 66.02 66.62 2yrt s SER 2 CO 0.00 -0.17 0.20 -0.44 0.41 0.00 0.00 173.24 173.24 2yrt s SER 3 N -0.43 0.12 0.25 2.44 0.01 -1.26 -5.07 113.70 109.76 2yrt s SER 3 Ca 0.03 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.08 2yrt s SER 3 Cb -0.03 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2yrt s SER 3 CO -0.06 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.32 2yrt n GLY 4 N -0.25 1.20 3.68 3.44 0.00 -1.26 -4.90 105.19 107.10 2yrt n GLY 4 Ca -0.01 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.66 2yrt n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yrt s SER 5 N -4.00 7.14 -0.03 1.61 0.01 -1.26 -4.92 113.70 112.24 2yrt s SER 5 Ca 0.00 1.53 -0.06 0.00 1.31 0.00 0.00 55.95 58.74 2yrt s SER 5 Cb 0.00 -2.55 -0.02 0.00 0.21 0.00 0.00 66.02 63.66 2yrt s SER 5 CO 0.00 -0.57 -0.11 -0.24 0.41 0.00 0.00 173.24 172.73 2yrt n SER 6 N 5.64 0.84 0.00 2.44 2.88 -1.26 -5.07 113.62 119.09 2yrt n SER 6 Ca 0.11 0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 2yrt n SER 6 Cb 0.47 -0.44 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2yrt n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yrt n GLY 7 N 2.31 0.18 0.43 0.46 0.00 -1.26 -4.96 105.19 102.35 2yrt n GLY 7 Ca -0.04 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.04 2yrt n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2yrt n MET 8 N 0.00 1.55 -2.48 1.61 -0.00 -1.26 -4.79 117.12 111.74 2yrt n MET 8 Ca 0.00 -0.84 -0.41 0.00 -0.00 0.00 0.00 57.70 56.45 2yrt n MET 8 Cb 0.00 -1.24 -0.03 0.00 -0.00 0.00 0.00 33.22 31.95 2yrt n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2yrt s ALA 9 N -1.73 2.73 0.13 3.17 0.00 -1.26 -4.14 121.76 120.67 2yrt s ALA 9 Ca 0.21 -1.13 -0.29 0.00 0.00 0.00 0.00 51.96 50.75 2yrt s ALA 9 Cb 0.11 -4.21 -0.07 0.00 0.00 0.00 0.00 23.12 18.95 2yrt s ALA 9 CO 0.15 -3.22 0.92 -0.51 0.00 0.00 0.00 175.76 173.11 2yrt s LEU 10 N 6.01 4.53 -0.18 0.00 1.43 0.12 -4.69 118.68 125.90 2yrt s LEU 10 Ca 0.42 1.77 -0.29 0.00 -1.03 0.00 0.00 54.13 54.99 2yrt s LEU 10 Cb -0.09 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.61 2yrt s LEU 10 CO 0.18 0.01 1.04 -0.22 0.23 0.00 0.00 176.35 177.59 2yrt s LEU 11 N -0.32 4.16 0.11 1.79 2.96 -1.26 -1.08 118.68 125.04 2yrt s LEU 11 Ca 0.44 1.45 -0.30 0.00 -0.22 0.00 0.00 54.13 55.50 2yrt s LEU 11 Cb -0.23 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 42.85 2yrt s LEU 11 CO 0.29 -0.59 1.02 0.00 -1.32 0.00 0.00 176.35 175.76 2yrt n TYR 13 N 2.89 0.48 -2.57 0.00 4.01 -0.25 -3.33 117.16 118.39 2yrt n TYR 13 Ca 0.03 -0.56 -0.42 0.00 -0.16 0.00 0.00 57.90 56.79 2yrt n TYR 13 Cb 0.48 -0.07 -0.03 0.00 -0.31 0.00 0.00 39.34 39.42 2yrt n TYR 13 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 2yrt s ASN 14 N -1.15 7.16 0.09 7.72 0.01 -1.26 -4.83 114.94 122.68 2yrt s ASN 14 Ca 0.24 1.72 -0.36 0.00 -0.71 0.00 0.00 52.86 53.74 2yrt s ASN 14 Cb 0.14 -2.56 -0.17 0.00 0.41 0.00 0.00 41.25 39.07 2yrt s ASN 14 CO 0.13 -0.48 1.31 0.54 -1.51 0.00 0.00 177.10 177.09 2yrt n ARG 15 N 4.84 1.10 0.00 -0.60 1.74 -1.26 -0.62 116.66 121.86 2yrt n ARG 15 Ca 0.09 0.40 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 2yrt n ARG 15 Cb 0.48 -2.02 0.00 0.00 -1.02 0.00 0.00 32.46 29.90 2yrt n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2yrt n GLY 16 N 2.43 2.81 0.37 -0.13 0.00 -1.26 0.20 105.19 109.61 2yrt n GLY 16 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2yrt n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yrt n GLY 18 N 2.41 0.73 3.83 0.00 0.00 -1.11 -4.89 105.19 106.15 2yrt n GLY 18 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2yrt n GLY 18 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yrt s GLN 19 N -2.42 2.43 0.86 1.61 -1.52 -1.24 -4.74 119.66 114.64 2yrt s GLN 19 Ca 0.00 -1.63 -0.13 0.00 -1.95 0.00 0.00 55.36 51.65 2yrt s GLN 19 Cb 0.00 -2.25 0.13 0.00 -0.22 0.00 0.00 33.01 30.67 2yrt s GLN 19 CO 0.00 -0.16 1.22 1.03 -0.25 0.00 0.00 175.29 177.13 2yrt s ARG 20 N -4.05 1.42 -0.04 2.91 1.81 -1.26 0.25 118.95 119.99 2yrt s ARG 20 Ca 0.46 -0.18 -0.31 0.00 -1.72 0.00 0.00 55.73 53.98 2yrt s ARG 20 Cb -0.01 -1.94 0.11 0.00 -0.45 0.00 0.00 34.95 32.66 2yrt s ARG 20 CO 0.26 -1.90 1.10 -0.59 -0.68 0.00 0.00 175.30 173.49 2yrt s PHE 21 N -3.67 -0.17 -0.17 -0.53 -0.71 -0.24 -4.76 117.98 107.73 2yrt s PHE 21 Ca 0.67 0.04 -0.03 0.00 -1.04 0.00 0.00 56.93 56.57 2yrt s PHE 21 Cb -0.08 0.55 -0.02 0.00 -1.21 0.00 0.00 43.02 42.26 2yrt s PHE 21 CO 0.50 -0.42 -0.06 -0.51 -1.34 0.00 0.00 175.22 173.39 2yrt s ASP 22 N -2.57 4.43 0.17 1.98 1.01 -1.26 0.14 116.67 120.56 2yrt s ASP 22 Ca 0.10 -0.27 -0.07 0.00 0.71 0.00 0.00 52.55 53.01 2yrt s ASP 22 Cb 0.00 -1.73 0.05 0.00 1.01 0.00 0.00 42.92 42.26 2yrt s ASP 22 CO -0.04 0.10 1.52 1.55 0.21 0.00 0.00 175.17 178.50 2yrt h PRO 23 N 7.21 0.80 0.00 8.23 0.13 -1.94 0.78 132.00 147.22 2yrt h PRO 23 Ca -0.33 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.38 2yrt h PRO 23 Cb 1.19 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2yrt h PRO 23 CO 0.60 1.05 0.27 1.05 -0.23 0.00 0.00 178.00 180.74 2yrt h GLU 24 N 0.65 0.00 0.00 0.86 4.11 -1.95 -2.11 114.58 116.15 2yrt h GLU 24 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 2yrt h GLU 24 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2yrt h GLU 24 CO 0.09 0.00 -0.67 -2.37 0.07 0.00 0.00 179.01 176.13 2yrt n THR 25 N -2.34 0.00 -1.01 -1.06 5.66 -1.10 -5.08 114.28 109.35 2yrt n THR 25 Ca -0.01 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.64 2yrt n THR 25 Cb 0.30 -0.23 -0.03 0.00 -1.55 0.00 0.00 70.33 68.82 2yrt n THR 25 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2yrt n ASN 26 N -1.29 -0.79 -3.69 1.09 2.85 0.27 -4.96 115.26 108.74 2yrt n ASN 26 Ca 0.00 0.81 -0.14 0.00 -0.11 0.00 0.00 54.58 55.14 2yrt n ASN 26 Cb 0.19 -0.67 -0.07 0.00 1.24 0.00 0.00 39.78 40.47 2yrt n ASN 26 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2yrt s SER 27 N -0.63 0.68 0.00 1.20 0.01 -1.26 -4.97 113.70 108.73 2yrt s SER 27 Ca 0.48 -1.42 0.19 0.00 1.31 0.00 0.00 55.95 56.51 2yrt s SER 27 Cb -0.69 0.54 1.06 0.00 0.21 0.00 0.00 66.02 67.14 2yrt s SER 27 CO 0.40 -1.08 1.58 0.47 0.41 0.00 0.00 173.24 175.02 2yrt n ASP 28 N -0.91 0.00 -2.14 2.44 8.00 -1.26 -2.76 116.55 119.91 2yrt n ASP 28 Ca 0.02 -0.26 -0.02 0.00 0.71 0.00 0.00 54.79 55.23 2yrt n ASP 28 Cb 0.63 -0.16 0.05 0.00 -0.02 0.00 0.00 41.12 41.62 2yrt n ASP 28 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2yrt n ASP 29 N -1.16 2.01 0.00 -2.24 5.75 -1.24 -0.42 116.55 119.25 2yrt n ASP 29 Ca 0.12 -2.49 0.00 0.00 -0.01 0.00 0.00 54.79 52.41 2yrt n ASP 29 Cb 0.11 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 39.79 2yrt n ASP 29 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2yrt n ALA 30 N -0.38 1.92 -3.63 2.12 0.00 -1.11 -4.89 120.51 114.53 2yrt n ALA 30 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.25 2yrt n ALA 30 Cb 0.91 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.21 2yrt n ALA 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yrt s THR 32 N 0.98 3.71 0.28 0.00 2.01 -1.26 -1.15 115.64 120.22 2yrt s THR 32 Ca -0.02 -2.35 0.01 0.00 0.31 0.00 0.00 61.69 59.64 2yrt s THR 32 Cb -0.15 -3.46 -0.00 0.00 0.01 0.00 0.00 72.50 68.90 2yrt s THR 32 CO -0.03 -0.79 0.03 0.00 -0.69 0.00 0.00 174.62 173.13 2yrt n TYR 33 N 4.23 0.51 -3.99 4.92 4.11 -1.17 -3.39 117.16 122.39 2yrt n TYR 33 Ca 0.01 -1.51 -0.33 0.00 -0.00 0.00 0.00 57.90 56.07 2yrt n TYR 33 Cb 0.40 -0.14 -0.14 0.00 -0.00 0.00 0.00 39.34 39.46 2yrt n TYR 33 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.86 175.85 2yrt s HIS 34 N -2.20 3.34 -2.00 -3.48 3.76 0.13 -2.23 115.29 112.61 2yrt s HIS 34 Ca 0.04 -2.24 0.12 0.00 -0.15 0.00 0.00 55.06 52.83 2yrt s HIS 34 Cb 0.00 -2.17 0.70 0.00 1.11 0.00 0.00 32.58 32.22 2yrt s HIS 34 CO 0.03 -0.86 1.13 -0.35 -0.85 0.00 0.00 174.74 173.83 2yrt n PRO 35 N 4.49 0.49 0.00 8.40 -0.04 -1.26 -4.58 135.00 142.50 2yrt n PRO 35 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 2yrt n PRO 35 Cb 0.42 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 2yrt n PRO 35 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2yrt n GLY 36 N -0.02 2.06 3.10 0.55 0.00 -1.26 -4.96 105.19 104.66 2yrt n GLY 36 Ca 0.09 -1.90 -0.11 0.00 0.00 0.00 0.00 46.02 44.10 2yrt n GLY 36 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2yrt s VAL 37 N 2.94 0.50 -0.15 1.61 -7.23 -1.26 -4.91 120.40 111.91 2yrt s VAL 37 Ca 0.00 -1.48 -0.29 0.00 -1.81 0.00 0.00 61.98 58.40 2yrt s VAL 37 Cb 0.00 -1.09 -0.03 0.00 0.56 0.00 0.00 36.38 35.81 2yrt s VAL 37 CO 0.00 -0.67 1.56 -2.16 -0.31 0.00 0.00 175.10 173.52 2yrt s PRO 38 N -2.73 4.02 0.18 4.82 0.04 -1.26 -2.35 135.00 137.72 2yrt s PRO 38 Ca -0.00 1.85 0.10 0.00 0.04 0.00 0.00 61.00 62.99 2yrt s PRO 38 Cb -0.02 -3.97 -0.04 0.00 0.04 0.00 0.00 34.50 30.51 2yrt s PRO 38 CO -0.03 -1.02 -0.18 0.54 0.04 0.00 0.00 177.00 176.35 2yrt s VAL 39 N 4.45 2.72 -0.33 -0.36 0.11 0.68 -4.97 120.40 122.70 2yrt s VAL 39 Ca 0.69 -1.84 -0.01 0.00 -2.93 0.00 0.00 61.98 57.88 2yrt s VAL 39 Cb -0.27 -2.32 0.11 0.00 -1.53 0.00 0.00 36.38 32.37 2yrt s VAL 39 CO 0.26 -0.10 0.16 -0.36 -3.33 0.00 0.00 175.10 171.73 2yrt s PHE 40 N -1.64 0.97 -0.10 1.54 0.08 -1.26 -0.38 117.98 117.19 2yrt s PHE 40 Ca 0.22 -1.48 0.03 0.00 0.12 0.00 0.00 56.93 55.83 2yrt s PHE 40 Cb -0.08 -1.22 0.01 0.00 -0.57 0.00 0.00 43.02 41.15 2yrt s PHE 40 CO 0.12 -0.84 -0.20 -3.38 -0.10 0.00 0.00 175.22 170.82 2yrt s HIS 41 N 1.50 2.28 -1.46 0.36 -3.43 -0.91 -4.72 115.29 108.91 2yrt s HIS 41 Ca 0.13 -0.96 -0.11 0.00 -0.80 0.00 0.00 55.06 53.32 2yrt s HIS 41 Cb -0.19 -1.56 0.06 0.00 -1.43 0.00 0.00 32.58 29.46 2yrt s HIS 41 CO -0.19 -0.42 1.00 -0.25 -2.00 0.00 0.00 174.74 172.87 2yrt n ASP 42 N 3.72 -4.62 0.00 7.38 9.92 -1.26 0.10 116.55 131.78 2yrt n ASP 42 Ca -0.20 -0.72 0.00 0.00 -0.53 0.00 0.00 54.79 53.34 2yrt n ASP 42 Cb 0.52 -4.21 0.00 0.00 -0.64 0.00 0.00 41.12 36.79 2yrt n ASP 42 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2yrt n ALA 43 N -4.69 0.00 -3.27 2.24 0.00 -1.26 -4.93 120.51 108.59 2yrt n ALA 43 Ca -0.02 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 52.96 2yrt n ALA 43 Cb 0.56 -0.80 -0.04 0.00 0.00 0.00 0.00 19.45 19.17 2yrt n ALA 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2yrt s LEU 44 N 0.00 6.16 -0.29 0.00 1.43 0.11 -4.08 118.68 122.01 2yrt s LEU 44 Ca 0.00 -1.93 -0.26 0.00 -1.03 0.00 0.00 54.13 50.91 2yrt s LEU 44 Cb 0.00 -2.23 0.01 0.00 0.03 0.00 0.00 46.19 44.00 2yrt s LEU 44 CO 0.00 -0.84 0.93 -0.54 0.23 0.00 0.00 176.35 176.12 2yrt s LYS 45 N 1.49 4.06 0.00 1.70 1.02 -0.33 -2.13 119.74 125.55 2yrt s LYS 45 Ca 0.08 0.90 0.00 0.00 0.02 0.00 0.00 55.97 56.97 2yrt s LYS 45 Cb -0.24 -3.71 0.00 0.00 -0.52 0.00 0.00 37.83 33.36 2yrt s LYS 45 CO 0.01 -0.73 0.00 0.41 -0.92 0.00 0.00 175.35 174.12 2yrt n GLY 46 N 3.91 4.68 3.09 -3.33 0.00 0.49 -2.72 105.19 111.31 2yrt n GLY 46 Ca 0.08 -0.96 -0.14 0.00 0.00 0.00 0.00 46.02 45.00 2yrt n GLY 46 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2yrt s TRP 47 N -0.04 0.80 -1.69 1.61 0.52 -1.26 -0.23 118.94 118.64 2yrt s TRP 47 Ca 0.00 -0.49 0.00 0.00 0.02 0.00 0.00 56.10 55.63 2yrt s TRP 47 Cb 0.00 -0.47 0.01 0.00 -1.15 0.00 0.00 33.47 31.86 2yrt s TRP 47 CO 0.00 -0.05 0.86 0.45 0.02 0.00 0.00 176.95 178.23 2yrt n SER 48 N 1.41 0.37 -0.14 2.95 2.88 -0.99 -3.56 113.62 116.53 2yrt n SER 48 Ca -0.22 -2.00 -0.29 0.00 -1.33 0.00 0.00 58.87 55.02 2yrt n SER 48 Cb 0.55 -0.16 -0.10 0.00 -0.75 0.00 0.00 64.21 63.75 2yrt n SER 48 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yrt h LYS 51 N 0.00 0.00 -4.51 0.00 1.57 -1.97 -3.42 116.57 108.25 2yrt h LYS 51 Ca -0.34 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 57.90 2yrt h LYS 51 Cb 1.10 0.00 0.06 0.00 0.08 0.00 0.00 32.23 33.47 2yrt h LYS 51 CO 0.55 0.37 -0.19 -2.13 -0.57 0.00 0.00 179.45 177.47 2yrt n ARG 52 N -2.96 0.00 -3.68 3.15 3.00 -1.26 -4.94 116.66 109.98 2yrt n ARG 52 Ca -0.10 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 57.65 2yrt n ARG 52 Cb 0.89 -0.93 -0.10 0.00 0.00 0.00 0.00 32.46 32.33 2yrt n ARG 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 2yrt s ARG 53 N -0.40 0.46 0.00 -0.14 6.06 -1.26 -4.20 118.95 119.47 2yrt s ARG 53 Ca 0.58 0.94 0.00 0.00 -2.50 0.00 0.00 55.73 54.75 2yrt s ARG 53 Cb -0.82 0.09 -0.00 0.00 0.06 0.00 0.00 34.95 34.28 2yrt s ARG 53 CO 0.42 -0.17 -0.01 -0.08 -2.50 0.00 0.00 175.30 172.96 2yrt s THR 54 N 1.68 0.07 -0.03 4.11 -1.32 -1.10 -4.96 115.64 114.08 2yrt s THR 54 Ca -0.08 -0.07 0.12 0.00 -1.21 0.00 0.00 61.69 60.45 2yrt s THR 54 Cb -0.08 -0.08 -0.13 0.00 -1.51 0.00 0.00 72.50 70.70 2yrt s THR 54 CO -0.15 0.00 1.11 0.71 -2.21 0.00 0.00 174.62 174.09 2yrt h THR 55 N 5.11 1.08 -2.43 5.08 1.35 -1.85 -0.87 112.91 120.37 2yrt h THR 55 Ca -0.25 -2.68 -0.54 0.00 -0.55 0.00 0.00 66.41 62.40 2yrt h THR 55 Cb 1.21 2.49 -0.04 0.00 -1.73 0.00 0.00 68.15 70.08 2yrt h THR 55 CO 0.51 0.61 1.27 -0.62 -0.25 0.00 0.00 175.52 177.03 2yrt s ASP 56 N -6.34 5.69 0.57 5.36 2.15 -1.26 -4.76 116.67 118.08 2yrt s ASP 56 Ca -0.00 0.66 0.40 0.00 0.43 0.00 0.00 52.55 54.04 2yrt s ASP 56 Cb 0.09 -2.53 1.46 0.00 -0.30 0.00 0.00 42.92 41.63 2yrt s ASP 56 CO 0.80 -1.99 1.56 0.15 -0.17 0.00 0.00 175.17 175.53 2yrt h PHE 57 N 13.33 0.00 -0.06 -5.34 3.57 -1.94 0.77 116.94 127.26 2yrt h PHE 57 Ca -0.29 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.16 2yrt h PHE 57 Cb 1.15 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.89 2yrt h PHE 57 CO 1.01 0.00 -0.17 1.03 -2.23 0.00 0.00 178.31 177.95 2yrt h SER 58 N 0.00 0.25 -0.72 0.41 0.87 -1.96 -3.23 113.55 109.17 2yrt h SER 58 Ca 0.69 -0.61 -0.05 0.00 -1.23 0.00 0.00 61.79 60.59 2yrt h SER 58 Cb 3.08 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 64.94 2yrt h SER 58 CO -0.01 0.81 0.24 0.44 -0.53 0.00 0.00 176.83 177.78 2yrt h ASP 59 N -0.30 1.03 -1.00 6.23 5.19 0.12 -2.63 116.42 125.06 2yrt h ASP 59 Ca -0.00 -0.20 0.23 0.00 -0.62 0.00 0.00 57.03 56.43 2yrt h ASP 59 Cb 0.79 -0.27 -0.10 0.00 0.18 0.00 0.00 39.33 39.92 2yrt h ASP 59 CO 0.04 0.95 0.62 0.15 -3.12 0.00 0.00 179.24 177.88 2yrt h PHE 60 N 1.05 0.88 0.00 4.55 3.57 -1.29 0.83 116.94 126.52 2yrt h PHE 60 Ca 0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.76 2yrt h PHE 60 Cb 0.28 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.76 2yrt h PHE 60 CO 0.02 0.14 0.00 -0.07 -2.23 0.00 0.00 178.31 176.17 2yrt h LEU 61 N 0.58 0.00 0.01 0.59 3.38 -1.49 -3.21 115.31 115.16 2yrt h LEU 61 Ca 0.58 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.29 2yrt h LEU 61 Cb 1.18 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.89 2yrt h LEU 61 CO -0.35 0.00 -1.44 -1.28 0.09 0.00 0.00 178.44 175.45 2yrt h SER 62 N 0.00 0.03 0.00 -0.43 0.87 0.72 -3.46 113.55 111.27 2yrt h SER 62 Ca 0.00 -0.04 -0.41 0.00 -1.23 0.00 0.00 61.79 60.11 2yrt h SER 62 Cb 0.90 -0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.78 2yrt h SER 62 CO 0.00 1.04 1.32 -0.38 -0.53 0.00 0.00 176.83 178.27 2yrt n ILE 63 N -3.18 0.00 -1.68 2.23 5.41 0.75 -4.79 119.36 118.10 2yrt n ILE 63 Ca -0.11 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.25 2yrt n ILE 63 Cb 1.01 -0.38 0.04 0.00 -0.71 0.00 0.00 39.64 39.60 2yrt n ILE 63 CO 0.00 0.00 0.00 0.55 0.00 0.00 0.00 176.55 177.10 2yrt n VAL 64 N 5.68 3.63 -1.65 1.39 3.14 -1.26 -4.89 118.33 124.37 2yrt n VAL 64 Ca 0.50 -0.50 -0.41 0.00 -2.96 0.00 0.00 64.34 60.97 2yrt n VAL 64 Cb 0.02 -1.41 0.01 0.00 -1.06 0.00 0.00 33.84 31.40 2yrt n VAL 64 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2yrt n GLY 65 N 1.00 0.08 0.00 7.55 0.00 -1.22 -4.91 105.19 107.71 2yrt n GLY 65 Ca 0.12 0.15 0.10 0.00 0.00 0.00 0.00 46.02 46.39 2yrt n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yrt s THR 67 N -3.05 3.11 0.02 0.00 2.01 -0.95 -5.02 115.64 111.77 2yrt s THR 67 Ca 0.07 -1.74 0.06 0.00 0.31 0.00 0.00 61.69 60.38 2yrt s THR 67 Cb 0.16 -2.96 -0.02 0.00 0.01 0.00 0.00 72.50 69.69 2yrt s THR 67 CO 0.85 -0.22 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.85 2yrt s LYS 68 N -3.81 1.26 0.00 4.92 -0.14 -1.26 -3.03 119.74 117.68 2yrt s LYS 68 Ca 0.36 -0.76 0.00 0.00 -1.36 0.00 0.00 55.97 54.21 2yrt s LYS 68 Cb -0.03 -1.28 0.00 0.00 -1.68 0.00 0.00 37.83 34.84 2yrt s LYS 68 CO 0.22 0.33 0.00 0.41 -0.76 0.00 0.00 175.35 175.55 2yrt n GLY 69 N 2.19 -0.70 3.61 -3.33 0.00 0.44 -4.77 105.19 102.63 2yrt n GLY 69 Ca -0.16 -0.41 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 2yrt n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yrt s ARG 70 N -0.01 3.95 0.15 1.61 0.52 -1.16 -0.99 118.95 123.03 2yrt s ARG 70 Ca 0.00 -0.35 -0.33 0.00 -0.52 0.00 0.00 55.73 54.52 2yrt s ARG 70 Cb 0.00 -3.27 -0.16 0.00 0.52 0.00 0.00 34.95 32.04 2yrt s ARG 70 CO 0.00 0.19 1.17 0.72 0.02 0.00 0.00 175.30 177.39 2yrt n HIS 71 N 3.81 1.26 -2.97 -0.53 8.25 -1.26 -4.89 115.22 118.89 2yrt n HIS 71 Ca -0.16 0.70 -0.43 0.00 -0.26 0.00 0.00 57.72 57.56 2yrt n HIS 71 Cb 0.52 -2.27 -0.05 0.00 1.12 0.00 0.00 29.99 29.31 2yrt n HIS 71 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2yrt s ASN 72 N 0.04 6.28 0.00 0.41 4.22 -1.26 -4.88 114.94 119.74 2yrt s ASN 72 Ca 0.75 -0.65 0.10 0.00 -2.14 0.00 0.00 52.86 50.92 2yrt s ASN 72 Cb -0.88 -2.37 0.60 0.00 1.28 0.00 0.00 41.25 39.88 2yrt s ASN 72 CO 0.52 -1.11 1.35 -1.54 -2.04 0.00 0.00 177.10 174.27 2yrt n SER 73 N 6.96 0.00 -4.54 3.54 3.41 -1.26 -1.09 113.62 120.64 2yrt n SER 73 Ca -0.02 -1.59 -0.30 0.00 -0.26 0.00 0.00 58.87 56.70 2yrt n SER 73 Cb 0.46 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.30 2yrt n SER 73 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2yrt s GLU 74 N -2.00 2.17 0.00 4.33 -1.05 -1.26 -4.83 118.70 116.06 2yrt s GLU 74 Ca 0.15 -0.96 0.29 0.00 -0.15 0.00 0.00 54.97 54.30 2yrt s GLU 74 Cb 0.07 -2.30 1.75 0.00 -0.44 0.00 0.00 34.13 33.22 2yrt s GLU 74 CO 0.12 0.53 2.09 1.63 0.95 0.00 0.00 175.26 180.58