#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 2.85 -0.02 1.61 0.01 -1.26 -5.18 113.70 111.72 2yrt s SER 2 Ca 0.00 -1.70 -0.20 0.00 1.31 0.00 0.00 55.95 55.35 2yrt s SER 2 Cb 0.00 0.55 0.04 0.00 0.21 0.00 0.00 66.02 66.82 2yrt s SER 2 CO 0.00 -0.96 0.44 -0.44 0.41 0.00 0.00 173.24 172.69 2yrt s SER 3 N -3.62 -0.35 0.37 2.44 0.01 -1.26 -5.18 113.70 106.11 2yrt s SER 3 Ca 0.23 0.27 -0.14 0.00 1.31 0.00 0.00 55.95 57.62 2yrt s SER 3 Cb 0.02 0.40 0.06 0.00 0.21 0.00 0.00 66.02 66.70 2yrt s SER 3 CO 0.15 -0.53 0.74 0.61 0.41 0.00 0.00 173.24 174.62 2yrt n GLY 4 N 1.05 1.05 2.93 3.44 0.00 -1.26 -5.17 105.19 107.22 2yrt n GLY 4 Ca -0.20 -1.25 -0.21 0.00 0.00 0.00 0.00 46.02 44.36 2yrt n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yrt s SER 5 N -2.95 1.20 0.14 1.61 1.04 -1.26 -5.15 113.70 108.34 2yrt s SER 5 Ca 0.15 -0.18 -0.01 0.00 0.48 0.00 0.00 55.95 56.40 2yrt s SER 5 Cb -0.05 -0.56 -0.04 0.00 0.10 0.00 0.00 66.02 65.48 2yrt s SER 5 CO 0.11 -0.03 0.06 -0.44 0.98 0.00 0.00 173.24 173.92 2yrt s SER 6 N 0.88 0.37 0.00 7.02 0.01 -1.26 -5.06 113.70 115.66 2yrt s SER 6 Ca -0.11 -1.23 0.00 0.00 1.31 0.00 0.00 55.95 55.92 2yrt s SER 6 Cb -0.15 0.29 0.00 0.00 0.21 0.00 0.00 66.02 66.37 2yrt s SER 6 CO 0.01 -0.73 0.53 0.61 0.41 0.00 0.00 173.24 174.07 2yrt n GLY 7 N -0.13 0.24 0.00 3.44 0.00 -1.26 -4.94 105.19 102.54 2yrt n GLY 7 Ca -0.05 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.02 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 0.80 -2.46 1.61 -0.00 -1.26 -4.69 117.12 111.12 2yrt n MET 8 Ca -0.13 0.00 -0.41 0.00 -0.00 0.00 0.00 57.70 57.17 2yrt n MET 8 Cb 0.47 -1.17 -0.03 0.00 -0.00 0.00 0.00 33.22 32.48 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 -2.00 2.67 0.29 3.17 0.00 -1.26 -4.19 121.76 120.44 2yrt s ALA 9 Ca 0.13 -1.18 -0.28 0.00 0.00 0.00 0.00 51.96 50.63 2yrt s ALA 9 Cb 0.06 -4.25 -0.09 0.00 0.00 0.00 0.00 23.12 18.84 2yrt s ALA 9 CO 0.10 -3.34 0.96 -0.51 0.00 0.00 0.00 175.76 172.97 2yrt s LEU 10 N 6.29 4.48 -0.20 0.00 1.43 0.12 -4.67 118.68 126.13 2yrt s LEU 10 Ca 0.42 1.93 -0.24 0.00 -1.03 0.00 0.00 54.13 55.20 2yrt s LEU 10 Cb -0.09 -3.82 -0.01 0.00 0.03 0.00 0.00 46.19 42.29 2yrt s LEU 10 CO 0.17 0.00 0.79 -0.22 0.23 0.00 0.00 176.35 177.32 2yrt s LEU 11 N -1.67 4.14 -0.05 1.79 2.96 -1.26 -0.70 118.68 123.90 2yrt s LEU 11 Ca 0.46 1.06 -0.30 0.00 -0.22 0.00 0.00 54.13 55.14 2yrt s LEU 11 Cb -0.23 -3.15 -0.03 0.00 0.50 0.00 0.00 46.19 43.28 2yrt s LEU 11 CO 0.29 -0.41 1.08 0.00 -1.32 0.00 0.00 176.35 175.99 2yrt n TYR 13 N 4.70 0.59 -2.40 0.00 4.01 0.19 -3.01 117.16 121.24 2yrt n TYR 13 Ca 0.09 -0.35 -0.42 0.00 -0.16 0.00 0.00 57.90 57.06 2yrt n TYR 13 Cb 0.48 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.47 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 -1.21 7.07 0.17 7.72 0.01 -1.26 -4.83 114.94 122.60 2yrt s ASN 14 Ca 0.37 2.10 -0.34 0.00 -0.71 0.00 0.00 52.86 54.28 2yrt s ASN 14 Cb 0.21 -2.59 -0.14 0.00 0.41 0.00 0.00 41.25 39.13 2yrt s ASN 14 CO 0.28 -0.45 1.48 0.54 -1.51 0.00 0.00 177.10 177.44 2yrt n ARG 15 N 3.49 1.91 0.00 -0.60 1.74 -1.26 -1.23 116.66 120.71 2yrt n ARG 15 Ca 0.08 0.69 0.00 0.00 -0.77 0.00 0.00 57.85 57.84 2yrt n ARG 15 Cb 0.46 -2.40 0.00 0.00 -1.02 0.00 0.00 32.46 29.50 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 2.92 3.39 0.14 -0.13 0.00 -1.26 -0.35 105.19 109.90 2yrt n GLY 16 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 1.98 0.70 3.83 0.00 0.00 -1.10 -4.90 105.19 105.71 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 -2.30 2.44 0.88 1.61 -1.52 -1.24 -4.75 119.66 114.77 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 0.14 0.00 -0.22 0.00 0.00 33.01 30.68 2yrt s GLN 19 CO 0.00 -0.17 1.23 1.03 -0.25 0.00 0.00 175.29 177.13 2yrt s ARG 20 N -4.06 1.26 -0.06 2.91 1.81 -1.26 0.18 118.95 119.73 2yrt s ARG 20 Ca 0.46 -0.27 -0.31 0.00 -1.72 0.00 0.00 55.73 53.89 2yrt s ARG 20 Cb -0.01 -1.94 0.12 0.00 -0.45 0.00 0.00 34.95 32.67 2yrt s ARG 20 CO 0.26 -1.99 1.14 -0.59 -0.68 0.00 0.00 175.30 173.44 2yrt s PHE 21 N -3.69 -0.14 -0.17 -0.53 -0.71 0.13 -4.76 117.98 108.10 2yrt s PHE 21 Ca 0.68 0.03 -0.03 0.00 -1.04 0.00 0.00 56.93 56.58 2yrt s PHE 21 Cb -0.07 0.55 -0.02 0.00 -1.21 0.00 0.00 43.02 42.27 2yrt s PHE 21 CO 0.50 -0.37 -0.07 -0.51 -1.34 0.00 0.00 175.22 173.43 2yrt s ASP 22 N -2.57 4.35 0.22 1.98 1.01 -1.26 0.14 116.67 120.54 2yrt s ASP 22 Ca 0.10 -0.29 -0.01 0.00 0.71 0.00 0.00 52.55 53.06 2yrt s ASP 22 Cb 0.01 -1.71 0.22 0.00 1.01 0.00 0.00 42.92 42.45 2yrt s ASP 22 CO -0.04 0.10 1.59 1.55 0.21 0.00 0.00 175.17 178.57 2yrt h PRO 23 N 7.24 0.52 0.00 8.23 0.13 -1.94 0.65 132.00 146.83 2yrt h PRO 23 Ca -0.33 -0.27 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 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 0.59 0.86 0.09 -0.85 -0.23 0.00 0.00 178.00 178.46 2yrt n GLU 24 N -4.01 0.08 0.00 0.86 0.28 -1.26 -2.35 120.64 114.24 2yrt n GLU 24 Ca -0.02 0.55 0.00 0.00 -0.16 0.00 0.00 57.16 57.54 2yrt n GLU 24 Cb 0.53 -1.86 0.00 0.00 1.43 0.00 0.00 31.44 31.54 2yrt n GLU 24 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 2yrt n THR 25 N -1.93 0.00 -0.98 3.84 5.66 -1.08 -5.08 114.28 114.70 2yrt n THR 25 Ca -0.01 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.65 2yrt n THR 25 Cb 0.11 -0.40 -0.02 0.00 -1.55 0.00 0.00 70.33 68.46 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 -1.28 -0.85 -2.90 1.09 2.85 0.23 -4.96 115.26 109.44 2yrt n ASN 26 Ca 0.00 0.79 -0.16 0.00 -0.11 0.00 0.00 54.58 55.10 2yrt n ASN 26 Cb 0.23 -0.67 -0.06 0.00 1.24 0.00 0.00 39.78 40.53 2yrt n ASN 26 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2yrt n SER 27 N 1.39 -0.76 0.00 1.20 7.64 -1.26 -4.97 113.62 116.86 2yrt n SER 27 Ca 0.13 -2.85 0.14 0.00 1.01 0.00 0.00 58.87 57.29 2yrt n SER 27 Cb 0.17 1.65 0.69 0.00 -1.01 0.00 0.00 64.21 65.71 2yrt n SER 27 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2yrt n ASP 28 N -1.82 0.00 -2.15 6.43 -0.08 -1.26 -2.63 116.55 115.05 2yrt n ASP 28 Ca 0.05 -0.09 -0.03 0.00 -1.51 0.00 0.00 54.79 53.22 2yrt n ASP 28 Cb 0.52 -0.29 0.05 0.00 2.34 0.00 0.00 41.12 43.74 2yrt n ASP 28 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2yrt n ASP 29 N -1.29 2.06 -0.00 1.67 5.75 -1.24 -0.67 116.55 122.83 2yrt n ASP 29 Ca 0.13 -2.51 0.01 0.00 -0.01 0.00 0.00 54.79 52.41 2yrt n ASP 29 Cb 0.22 -0.41 -0.01 0.00 -1.03 0.00 0.00 41.12 39.89 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 -0.40 2.18 -3.24 2.12 0.00 -1.15 -4.89 120.51 115.13 2yrt n ALA 30 Ca 0.15 -0.05 -0.33 0.00 0.00 0.00 0.00 53.44 53.21 2yrt n ALA 30 Cb 0.91 -0.07 -0.16 0.00 0.00 0.00 0.00 19.45 20.13 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 0.46 2.98 0.28 0.00 2.01 -1.26 -1.17 115.64 118.95 2yrt s THR 32 Ca -0.13 -2.54 0.01 0.00 0.31 0.00 0.00 61.69 59.34 2yrt s THR 32 Cb -0.17 -3.06 -0.00 0.00 0.01 0.00 0.00 72.50 69.28 2yrt s THR 32 CO 0.05 -0.72 0.03 0.00 -0.69 0.00 0.00 174.62 173.29 2yrt n TYR 33 N 4.01 0.46 -3.98 4.92 4.11 -1.18 -3.46 117.16 122.05 2yrt n TYR 33 Ca 0.03 -1.53 -0.33 0.00 -0.00 0.00 0.00 57.90 56.06 2yrt n TYR 33 Cb 0.39 -0.12 -0.14 0.00 -0.00 0.00 0.00 39.34 39.47 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 -2.25 3.33 -2.00 -3.48 3.76 0.53 -2.30 115.29 112.88 2yrt s HIS 34 Ca 0.05 -2.19 0.11 0.00 -0.15 0.00 0.00 55.06 52.88 2yrt s HIS 34 Cb 0.00 -2.17 0.63 0.00 1.11 0.00 0.00 32.58 32.15 2yrt s HIS 34 CO 0.03 -0.86 1.07 -0.35 -0.85 0.00 0.00 174.74 173.79 2yrt n PRO 35 N 4.51 0.49 0.00 8.40 -0.04 -1.26 -4.58 135.00 142.52 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 0.43 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 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 -0.01 2.35 3.09 0.55 0.00 -1.26 -4.98 105.19 104.94 2yrt n GLY 36 Ca 0.08 -1.86 -0.11 0.00 0.00 0.00 0.00 46.02 44.13 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 3.15 0.49 -0.15 1.61 -7.23 -1.26 -4.93 120.40 112.07 2yrt s VAL 37 Ca 0.00 -1.48 -0.29 0.00 -1.81 0.00 0.00 61.98 58.39 2yrt s VAL 37 Cb 0.00 -1.10 -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 -2.75 4.02 0.15 4.82 0.04 -1.26 -2.49 135.00 137.53 2yrt s PRO 38 Ca -0.00 1.86 0.09 0.00 0.04 0.00 0.00 61.00 62.98 2yrt s PRO 38 Cb -0.02 -3.97 -0.04 0.00 0.04 0.00 0.00 34.50 30.52 2yrt s PRO 38 CO -0.03 -1.01 -0.11 0.54 0.04 0.00 0.00 177.00 176.42 2yrt s VAL 39 N 4.44 3.15 -0.33 -0.36 0.11 0.75 -4.96 120.40 123.21 2yrt s VAL 39 Ca 0.69 -1.55 -0.01 0.00 -2.93 0.00 0.00 61.98 58.18 2yrt s VAL 39 Cb -0.27 -2.52 0.12 0.00 -1.53 0.00 0.00 36.38 32.17 2yrt s VAL 39 CO 0.27 -0.02 0.16 -0.36 -3.33 0.00 0.00 175.10 171.81 2yrt s PHE 40 N -1.49 1.01 -0.09 1.54 0.08 -1.26 -0.01 117.98 117.77 2yrt s PHE 40 Ca 0.23 -1.51 0.04 0.00 0.12 0.00 0.00 56.93 55.80 2yrt s PHE 40 Cb -0.10 -1.25 0.00 0.00 -0.57 0.00 0.00 43.02 41.11 2yrt s PHE 40 CO 0.14 -0.84 -0.21 -3.38 -0.10 0.00 0.00 175.22 170.83 2yrt s HIS 41 N 1.46 2.23 -1.49 0.36 -3.43 -0.88 -4.71 115.29 108.83 2yrt s HIS 41 Ca 0.13 -0.87 -0.12 0.00 -0.80 0.00 0.00 55.06 53.39 2yrt s HIS 41 Cb -0.19 -1.51 0.06 0.00 -1.43 0.00 0.00 32.58 29.51 2yrt s HIS 41 CO -0.18 -0.36 0.99 -0.25 -2.00 0.00 0.00 174.74 172.94 2yrt n ASP 42 N 3.54 -5.23 0.00 7.38 9.92 -1.26 0.20 116.55 131.10 2yrt n ASP 42 Ca -0.20 -0.68 0.00 0.00 -0.53 0.00 0.00 54.79 53.38 2yrt n ASP 42 Cb 0.53 -4.16 0.00 0.00 -0.64 0.00 0.00 41.12 36.84 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 -4.65 0.00 -3.35 2.24 0.00 -1.26 -4.95 120.51 108.55 2yrt n ALA 43 Ca 0.03 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 53.02 2yrt n ALA 43 Cb 0.54 -0.79 -0.06 0.00 0.00 0.00 0.00 19.45 19.14 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 6.09 -0.24 0.00 1.43 0.13 -4.24 118.68 121.85 2yrt s LEU 44 Ca 0.00 -1.81 -0.27 0.00 -1.03 0.00 0.00 54.13 51.03 2yrt s LEU 44 Cb 0.00 -2.17 0.00 0.00 0.03 0.00 0.00 46.19 44.05 2yrt s LEU 44 CO 0.00 -0.83 0.93 -0.54 0.23 0.00 0.00 176.35 176.14 2yrt s LYS 45 N 1.56 4.22 0.00 1.70 1.02 0.12 -2.08 119.74 126.28 2yrt s LYS 45 Ca 0.04 1.14 0.00 0.00 0.02 0.00 0.00 55.97 57.16 2yrt s LYS 45 Cb -0.29 -3.64 0.00 0.00 -0.52 0.00 0.00 37.83 33.37 2yrt s LYS 45 CO 0.02 -0.57 0.00 0.41 -0.92 0.00 0.00 175.35 174.29 2yrt n GLY 46 N 3.55 4.56 2.99 -3.33 0.00 0.99 -2.46 105.19 111.49 2yrt n GLY 46 Ca 0.09 -0.80 -0.10 0.00 0.00 0.00 0.00 46.02 45.21 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 0.24 0.20 -1.90 1.61 0.52 -1.26 -0.17 118.94 118.17 2yrt s TRP 47 Ca 0.00 -0.41 0.00 0.00 0.02 0.00 0.00 56.10 55.71 2yrt s TRP 47 Cb 0.00 -0.15 0.00 0.00 -1.15 0.00 0.00 33.47 32.17 2yrt s TRP 47 CO 0.00 -0.19 0.92 0.45 0.02 0.00 0.00 176.95 178.15 2yrt n SER 48 N 1.72 0.10 -0.12 2.95 2.88 -1.04 -3.36 113.62 116.75 2yrt n SER 48 Ca -0.23 -1.94 -0.22 0.00 -1.33 0.00 0.00 58.87 55.15 2yrt n SER 48 Cb 0.56 -0.05 -0.12 0.00 -0.75 0.00 0.00 64.21 63.85 2yrt n SER 48 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yrt n LYS 51 N -1.27 0.50 -1.64 0.00 5.02 -1.26 -4.57 118.16 114.93 2yrt n LYS 51 Ca -0.20 0.07 -0.57 0.00 -2.02 0.00 0.00 58.31 55.59 2yrt n LYS 51 Cb 0.67 -1.74 -0.07 0.00 -0.02 0.00 0.00 35.03 33.87 2yrt n LYS 51 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2yrt n ARG 52 N -2.42 0.88 -3.73 1.97 3.00 -1.26 -4.95 116.66 110.14 2yrt n ARG 52 Ca 0.01 0.32 -0.15 0.00 -0.00 0.00 0.00 57.85 58.02 2yrt n ARG 52 Cb 0.51 -1.94 -0.15 0.00 0.00 0.00 0.00 32.46 30.88 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 1.83 0.03 0.05 -0.14 6.06 -1.26 -4.09 118.95 121.44 2yrt s ARG 53 Ca 0.93 0.36 0.02 0.00 -2.50 0.00 0.00 55.73 54.54 2yrt s ARG 53 Cb -1.10 -0.24 -0.03 0.00 0.06 0.00 0.00 34.95 33.65 2yrt s ARG 53 CO 0.59 -0.20 -0.08 -0.08 -2.50 0.00 0.00 175.30 173.03 2yrt s THR 54 N 1.40 0.62 -0.11 4.11 -1.32 -1.03 -4.96 115.64 114.36 2yrt s THR 54 Ca -0.06 -1.24 0.20 0.00 -1.21 0.00 0.00 61.69 59.38 2yrt s THR 54 Cb -0.12 -0.82 -0.25 0.00 -1.51 0.00 0.00 72.50 69.80 2yrt s THR 54 CO -0.05 -0.45 0.50 0.35 -2.21 0.00 0.00 174.62 172.76 2yrt n THR 55 N 1.20 0.58 -2.49 5.08 -2.24 -1.26 0.16 114.28 115.32 2yrt n THR 55 Ca -0.21 -0.62 -0.42 0.00 -2.27 0.00 0.00 64.05 60.53 2yrt n THR 55 Cb 0.56 -0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.50 2yrt n THR 55 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2yrt s ASP 56 N -5.03 6.30 0.41 3.42 -1.08 -1.26 -4.80 116.67 114.62 2yrt s ASP 56 Ca -0.07 0.22 0.28 0.00 -0.52 0.00 0.00 52.55 52.46 2yrt s ASP 56 Cb 0.11 -2.55 1.44 0.00 -1.46 0.00 0.00 42.92 40.45 2yrt s ASP 56 CO 0.86 -1.58 1.58 0.15 0.52 0.00 0.00 175.17 176.70 2yrt h PHE 57 N 10.27 0.64 -0.59 -5.34 3.57 -1.95 1.70 116.94 125.23 2yrt h PHE 57 Ca -0.26 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.18 2yrt h PHE 57 Cb 1.07 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 2yrt h PHE 57 CO 1.03 -0.36 0.00 1.03 -2.23 0.00 0.00 178.31 177.79 2yrt h SER 58 N 0.01 1.01 -0.27 0.41 0.87 -1.99 -2.90 113.55 110.69 2yrt h SER 58 Ca 0.87 -0.28 -0.18 0.00 -1.23 0.00 0.00 61.79 60.97 2yrt h SER 58 Cb 2.60 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 64.29 2yrt h SER 58 CO -0.59 1.06 -0.53 0.44 -0.53 0.00 0.00 176.83 176.68 2yrt h ASP 59 N 0.95 0.93 -0.81 6.23 3.32 0.21 -2.98 116.42 124.27 2yrt h ASP 59 Ca 0.17 -0.54 0.13 0.00 0.02 0.00 0.00 57.03 56.81 2yrt h ASP 59 Cb 0.54 -0.27 -0.09 0.00 0.22 0.00 0.00 39.33 39.74 2yrt h ASP 59 CO 0.03 1.30 0.42 0.15 -1.72 0.00 0.00 179.24 179.41 2yrt h PHE 60 N 0.60 0.73 0.00 4.55 3.57 -0.94 0.43 116.94 125.89 2yrt h PHE 60 Ca 0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2yrt h PHE 60 Cb 1.14 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.67 2yrt h PHE 60 CO 0.08 0.21 0.00 1.28 -2.23 0.00 0.00 178.31 177.64 2yrt n LEU 61 N -4.86 0.48 -0.00 0.59 4.77 -1.11 -2.91 117.00 113.97 2yrt n LEU 61 Ca 0.15 0.57 -0.05 0.00 -0.03 0.00 0.00 56.01 56.66 2yrt n LEU 61 Cb 0.38 -0.46 -0.12 0.00 -2.33 0.00 0.00 43.42 40.89 2yrt n LEU 61 CO 0.22 -0.26 -0.44 -0.24 -1.33 0.00 0.00 177.39 175.34 2yrt n SER 62 N -1.98 0.84 -3.47 -1.43 2.88 0.13 -4.90 113.62 105.69 2yrt n SER 62 Ca 0.05 0.39 -0.35 0.00 -1.33 0.00 0.00 58.87 57.62 2yrt n SER 62 Cb 0.32 0.07 -0.11 0.00 -0.75 0.00 0.00 64.21 63.74 2yrt n SER 62 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2yrt n ILE 63 N -2.96 0.00 -1.74 2.46 5.41 0.21 -4.77 119.36 117.96 2yrt n ILE 63 Ca -0.14 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.19 2yrt n ILE 63 Cb 0.96 -0.39 -0.01 0.00 -0.71 0.00 0.00 39.64 39.49 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 1.46 -1.49 1.39 3.14 -1.26 -4.88 118.33 122.36 2yrt n VAL 64 Ca 0.50 -0.36 -0.44 0.00 -2.96 0.00 0.00 64.34 61.08 2yrt n VAL 64 Cb 0.01 -1.88 -0.01 0.00 -1.06 0.00 0.00 33.84 30.91 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 1.43 -1.14 0.00 7.55 0.00 -1.22 -4.89 105.19 106.92 2yrt n GLY 65 Ca 0.06 0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.37 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 -3.04 3.05 0.03 0.00 2.01 -0.97 -5.03 115.64 111.68 2yrt s THR 67 Ca 0.07 -1.71 0.06 0.00 0.31 0.00 0.00 61.69 60.41 2yrt s THR 67 Cb 0.16 -2.97 -0.02 0.00 0.01 0.00 0.00 72.50 69.68 2yrt s THR 67 CO 0.84 -0.19 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.87 2yrt s LYS 68 N -3.83 1.16 0.00 4.92 -0.14 -1.26 -3.12 119.74 117.47 2yrt s LYS 68 Ca 0.37 -0.76 0.00 0.00 -1.36 0.00 0.00 55.97 54.22 2yrt s LYS 68 Cb -0.03 -1.19 0.00 0.00 -1.68 0.00 0.00 37.83 34.94 2yrt s LYS 68 CO 0.22 0.31 0.00 0.41 -0.76 0.00 0.00 175.35 175.53 2yrt n GLY 69 N 2.08 -0.68 3.60 -3.33 0.00 0.16 -4.78 105.19 102.24 2yrt n GLY 69 Ca -0.17 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.10 3.93 0.16 1.61 0.52 -1.08 -0.85 118.95 123.13 2yrt s ARG 70 Ca 0.00 -0.36 -0.33 0.00 -0.52 0.00 0.00 55.73 54.52 2yrt s ARG 70 Cb 0.00 -3.30 -0.16 0.00 0.52 0.00 0.00 34.95 32.00 2yrt s ARG 70 CO 0.00 0.13 1.05 0.72 0.02 0.00 0.00 175.30 177.22 2yrt n HIS 71 N 3.98 0.94 -3.07 -0.53 8.25 -1.26 -4.89 115.22 118.64 2yrt n HIS 71 Ca -0.16 0.78 -0.43 0.00 -0.26 0.00 0.00 57.72 57.65 2yrt n HIS 71 Cb 0.52 -2.20 -0.06 0.00 1.12 0.00 0.00 29.99 29.36 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 -0.17 6.35 -0.02 0.41 4.22 -1.26 -4.91 114.94 119.56 2yrt s ASN 72 Ca 0.74 -0.27 0.02 0.00 -2.14 0.00 0.00 52.86 51.20 2yrt s ASN 72 Cb -0.92 -2.34 0.09 0.00 1.28 0.00 0.00 41.25 39.36 2yrt s ASN 72 CO 0.54 -0.81 0.70 -0.24 -2.04 0.00 0.00 177.10 175.24 2yrt n SER 73 N 6.38 1.37 -3.74 3.54 2.88 -1.26 -0.64 113.62 122.15 2yrt n SER 73 Ca -0.01 -2.09 -0.15 0.00 -1.33 0.00 0.00 58.87 55.30 2yrt n SER 73 Cb 0.48 -0.46 -0.15 0.00 -0.75 0.00 0.00 64.21 63.33 2yrt n SER 73 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2yrt s GLU 74 N -1.29 0.04 0.00 -1.46 2.02 -1.26 -4.82 118.70 111.93 2yrt s GLU 74 Ca 0.06 0.34 0.27 0.00 0.02 0.00 0.00 54.97 55.66 2yrt s GLU 74 Cb 0.04 -0.23 0.91 0.00 0.10 0.00 0.00 34.13 34.95 2yrt s GLU 74 CO 0.02 -0.19 1.66 0.36 0.02 0.00 0.00 175.26 177.13