#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dio s VAL 16 N 0.00 4.22 -0.30 -0.18 1.01 -1.26 -4.52 120.40 119.37 2dio s VAL 16 Ca 0.00 1.51 -0.07 0.00 0.00 0.00 0.00 61.98 63.42 2dio s VAL 16 Cb 0.00 -3.97 0.01 0.00 0.00 0.00 0.00 36.38 32.41 2dio s VAL 16 CO 0.00 -0.08 0.10 -1.10 0.00 0.00 0.00 175.10 174.02 2dio s GLN 17 N 3.00 3.10 0.02 2.72 -0.21 0.20 -4.92 119.66 123.57 2dio s GLN 17 Ca 0.56 -0.85 -0.22 0.00 0.02 0.00 0.00 55.36 54.86 2dio s GLN 17 Cb -0.24 -3.42 -0.05 0.00 1.00 0.00 0.00 33.01 30.30 2dio s GLN 17 CO 0.18 -0.45 0.66 -1.83 -2.12 0.00 0.00 175.29 171.73 2dio s GLU 18 N 1.52 4.39 -0.10 2.91 -1.05 -1.26 -1.52 118.70 123.58 2dio s GLU 18 Ca 0.03 0.86 -0.00 0.00 -0.15 0.00 0.00 54.97 55.71 2dio s GLU 18 Cb -0.17 -3.35 0.02 0.00 -0.44 0.00 0.00 34.13 30.19 2dio s GLU 18 CO 0.03 0.34 -0.08 -1.17 0.95 0.00 0.00 175.26 175.33 2dio s LEU 19 N -0.14 1.23 -0.02 1.83 2.96 -0.34 -4.97 118.68 119.22 2dio s LEU 19 Ca 0.34 -0.29 0.03 0.00 -0.22 0.00 0.00 54.13 53.99 2dio s LEU 19 Cb -0.19 -0.81 -0.03 0.00 0.50 0.00 0.00 46.19 45.66 2dio s LEU 19 CO 0.19 -0.10 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.58 2dio s SER 20 N 1.56 4.34 0.03 3.68 0.01 -1.26 -0.12 113.70 121.93 2dio s SER 20 Ca 0.02 -0.17 -0.07 0.00 1.31 0.00 0.00 55.95 57.04 2dio s SER 20 Cb -0.13 -0.96 -0.01 0.00 0.21 0.00 0.00 66.02 65.13 2dio s SER 20 CO -0.06 0.32 0.12 0.68 0.41 0.00 0.00 173.24 174.70 2dio s VAL 21 N -0.87 0.11 -0.18 3.43 -7.23 -0.54 -1.78 120.40 113.35 2dio s VAL 21 Ca 0.14 -0.94 -0.07 0.00 -1.81 0.00 0.00 61.98 59.30 2dio s VAL 21 Cb -0.11 -0.75 -0.04 0.00 0.56 0.00 0.00 36.38 36.05 2dio s VAL 21 CO 0.04 -0.52 0.05 -0.31 -0.31 0.00 0.00 175.10 174.05 2dio s TYR 22 N -2.22 3.20 -0.23 2.82 2.02 -0.65 -1.16 117.35 121.14 2dio s TYR 22 Ca -0.08 -0.03 -0.10 0.00 -0.37 0.00 0.00 57.07 56.50 2dio s TYR 22 Cb -0.03 -2.07 -0.05 0.00 -0.40 0.00 0.00 41.96 39.41 2dio s TYR 22 CO -0.03 0.08 0.13 -2.00 -1.57 0.00 0.00 175.55 172.16 2dio s GLU 23 N 0.48 4.01 -0.10 -0.62 2.12 0.13 -0.94 118.70 123.78 2dio s GLU 23 Ca 0.02 -0.31 0.02 0.00 0.36 0.00 0.00 54.97 55.06 2dio s GLU 23 Cb -0.13 -3.45 0.02 0.00 0.26 0.00 0.00 34.13 30.83 2dio s GLU 23 CO 0.01 0.08 -0.14 0.42 -0.54 0.00 0.00 175.26 175.09 2dio s ILE 24 N 0.98 1.35 -0.46 -3.70 -1.09 0.01 -1.04 121.20 117.25 2dio s ILE 24 Ca 0.06 -0.56 -0.25 0.00 -2.23 0.00 0.00 60.65 57.68 2dio s ILE 24 Cb -0.13 -1.24 0.03 0.00 -1.58 0.00 0.00 42.46 39.53 2dio s ILE 24 CO 0.04 0.41 0.89 0.21 -1.23 0.00 0.00 174.94 175.26 2dio s ASN 25 N 0.98 6.47 0.00 3.58 3.84 -0.16 -1.09 114.94 128.57 2dio s ASN 25 Ca -0.07 0.05 0.23 0.00 0.21 0.00 0.00 52.86 53.27 2dio s ASN 25 Cb -0.15 -2.43 0.54 0.00 -0.55 0.00 0.00 41.25 38.66 2dio s ASN 25 CO -0.01 -1.02 1.47 -0.62 -2.79 0.00 0.00 177.10 174.13 2dio n GLU 26 N 7.06 2.55 -1.28 0.43 1.02 -1.26 -4.85 120.64 124.31 2dio n GLU 26 Ca 0.05 -2.38 -0.10 0.00 -0.02 0.00 0.00 57.16 54.72 2dio n GLU 26 Cb 0.48 -1.53 -0.04 0.00 -0.02 0.00 0.00 31.44 30.33 2dio n GLU 26 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2dio n LEU 27 N 1.50 -0.57 -0.25 -4.62 7.99 -1.26 -4.86 117.00 114.93 2dio n LEU 27 Ca 0.21 0.24 0.08 0.00 -0.01 0.00 0.00 56.01 56.53 2dio n LEU 27 Cb 0.59 -1.86 0.14 0.00 -0.11 0.00 0.00 43.42 42.19 2dio n LEU 27 CO 0.16 -0.64 0.59 -0.90 -1.51 0.00 0.00 177.39 175.09 2dio n ASP 28 N -0.14 2.63 -0.36 -1.43 5.75 -1.26 -4.55 116.55 117.19 2dio n ASP 28 Ca -0.10 -2.85 0.06 0.00 -0.01 0.00 0.00 54.79 51.90 2dio n ASP 28 Cb 0.38 -0.37 0.10 0.00 -1.03 0.00 0.00 41.12 40.20 2dio n ASP 28 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2dio n ARG 29 N -1.01 0.86 -1.39 0.11 1.74 -1.26 -4.98 116.66 110.73 2dio n ARG 29 Ca 0.14 -2.18 -0.13 0.00 -0.77 0.00 0.00 57.85 54.91 2dio n ARG 29 Cb 0.62 -1.12 -0.06 0.00 -1.02 0.00 0.00 32.46 30.88 2dio n ARG 29 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2dio n HIS 30 N -0.85 0.00 -4.94 -1.55 8.25 -1.26 -4.86 115.22 110.02 2dio n HIS 30 Ca 0.11 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.31 2dio n HIS 30 Cb 0.70 -2.48 -0.15 0.00 1.12 0.00 0.00 29.99 29.18 2dio n HIS 30 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2dio s SER 31 N -2.77 2.35 0.60 0.41 0.15 -1.26 -3.91 113.70 109.27 2dio s SER 31 Ca 0.00 -0.38 -0.13 0.00 0.70 0.00 0.00 55.95 56.14 2dio s SER 31 Cb 0.00 -0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 64.02 2dio s SER 31 CO 0.00 0.24 1.03 -2.16 1.20 0.00 0.00 173.24 173.55 2dio s PRO 32 N -0.54 3.49 -0.29 5.44 0.04 -1.26 -4.71 135.00 137.17 2dio s PRO 32 Ca 0.08 0.94 -0.07 0.00 0.04 0.00 0.00 61.00 61.99 2dio s PRO 32 Cb -0.08 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2dio s PRO 32 CO -0.01 -0.65 0.08 0.21 0.04 0.00 0.00 177.00 176.67 2dio s LYS 33 N -4.63 3.17 -0.31 4.56 2.47 -1.02 -5.07 119.74 118.91 2dio s LYS 33 Ca 0.58 -0.80 -0.13 0.00 -1.56 0.00 0.00 55.97 54.06 2dio s LYS 33 Cb -0.12 -3.37 -0.03 0.00 -1.46 0.00 0.00 37.83 32.85 2dio s LYS 33 CO 0.45 -0.41 0.27 0.42 0.16 0.00 0.00 175.35 176.24 2dio s ILE 34 N 1.52 5.25 -0.46 5.43 1.01 -1.26 -3.44 121.20 129.25 2dio s ILE 34 Ca 0.03 0.05 -0.20 0.00 0.00 0.00 0.00 60.65 60.53 2dio s ILE 34 Cb -0.17 -3.68 0.03 0.00 0.01 0.00 0.00 42.46 38.65 2dio s ILE 34 CO 0.03 0.07 0.63 -0.76 0.00 0.00 0.00 174.94 174.91 2dio s LEU 35 N 1.84 4.62 -0.43 2.97 1.02 0.15 -5.01 118.68 123.85 2dio s LEU 35 Ca 0.09 -0.51 -0.13 0.00 0.02 0.00 0.00 54.13 53.60 2dio s LEU 35 Cb -0.17 -2.63 0.06 0.00 0.02 0.00 0.00 46.19 43.47 2dio s LEU 35 CO 0.11 -0.81 0.31 -0.75 0.02 0.00 0.00 176.35 175.23 2dio s LYS 36 N 2.77 2.86 -0.00 1.70 2.47 -1.26 -1.65 119.74 126.62 2dio s LYS 36 Ca 0.20 -1.26 0.00 0.00 -1.56 0.00 0.00 55.97 53.35 2dio s LYS 36 Cb -0.15 -3.94 -0.00 0.00 -1.46 0.00 0.00 37.83 32.27 2dio s LYS 36 CO 0.17 -0.89 0.00 0.09 0.16 0.00 0.00 175.35 174.88 2dio n ASN 37 N 5.09 1.60 -4.73 1.43 3.02 -1.26 -5.00 115.26 115.41 2dio n ASN 37 Ca -0.12 -0.34 -0.36 0.00 -0.03 0.00 0.00 54.58 53.73 2dio n ASN 37 Cb 0.45 1.00 0.08 0.00 -0.61 0.00 0.00 39.78 40.69 2dio n ASN 37 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dio s ALA 38 N -1.33 2.29 0.66 5.41 0.00 -1.26 -4.84 121.76 122.68 2dio s ALA 38 Ca 0.00 1.14 0.15 0.00 0.00 0.00 0.00 51.96 53.24 2dio s ALA 38 Cb 0.00 -3.54 0.77 0.00 0.00 0.00 0.00 23.12 20.36 2dio s ALA 38 CO 0.01 -1.70 1.43 0.27 0.00 0.00 0.00 175.76 175.76 2dio h PHE 39 N 0.30 0.00 -2.74 0.00 -0.00 -1.93 -3.45 116.94 109.12 2dio h PHE 39 Ca -0.50 0.00 -0.59 0.00 -0.00 0.00 0.00 57.97 56.88 2dio h PHE 39 Cb 1.33 0.00 -0.11 0.00 -0.00 0.00 0.00 35.95 37.17 2dio h PHE 39 CO 0.43 0.00 -0.65 -1.54 -0.00 0.00 0.00 178.31 176.54 2dio s SER 40 N -3.69 4.75 0.00 -0.68 1.04 -1.26 -5.15 113.70 108.71 2dio s SER 40 Ca -0.02 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.98 2dio s SER 40 Cb 0.05 -0.99 0.00 0.00 0.10 0.00 0.00 66.02 65.17 2dio s SER 40 CO 0.16 0.07 0.11 0.18 0.98 0.00 0.00 173.24 174.74 2dio n LEU 41 N -0.29 0.26 -4.78 2.42 4.77 -1.26 -4.83 117.00 113.30 2dio n LEU 41 Ca -0.09 -0.13 -0.37 0.00 -0.03 0.00 0.00 56.01 55.39 2dio n LEU 41 Cb 0.56 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 2dio n LEU 41 CO 0.39 0.05 0.69 -0.36 -1.33 0.00 0.00 177.39 176.83 2dio s PHE 43 N -0.51 3.57 0.30 -1.77 0.08 -1.26 -5.14 117.98 113.25 2dio s PHE 43 Ca 0.00 1.74 -0.15 0.00 0.12 0.00 0.00 56.93 58.64 2dio s PHE 43 Cb 0.00 -3.01 0.02 0.00 -0.57 0.00 0.00 43.02 39.46 2dio s PHE 43 CO 0.00 -0.09 0.64 0.20 -0.10 0.00 0.00 175.22 175.87 2dio s GLY 44 N -1.53 0.36 0.24 4.36 0.00 -1.26 -3.75 107.32 105.74 2dio s GLY 44 Ca 0.52 -0.70 -0.31 0.00 0.00 0.00 0.00 44.72 44.22 2dio s GLY 44 CO 0.26 -0.40 1.38 -0.10 0.00 0.00 0.00 173.10 174.25 2dio n LEU 45 N -0.46 2.98 0.00 0.66 7.94 -1.25 -1.56 117.00 125.30 2dio n LEU 45 Ca -0.04 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.01 2dio n LEU 45 Cb 0.60 -1.41 0.00 0.00 0.53 0.00 0.00 43.42 43.14 2dio n LEU 45 CO 0.21 -0.56 0.00 0.61 -1.11 0.00 0.00 177.39 176.54 2dio n GLY 46 N 2.11 2.36 3.75 -3.96 0.00 -1.26 -4.26 105.19 103.92 2dio n GLY 46 Ca 0.12 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 45.08 2dio n GLY 46 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dio s ASP 47 N -0.14 7.35 0.04 1.61 1.01 -0.60 -4.24 116.67 121.69 2dio s ASP 47 Ca 0.00 2.10 0.05 0.00 0.71 0.00 0.00 52.55 55.41 2dio s ASP 47 Cb 0.00 -2.61 -0.02 0.00 1.01 0.00 0.00 42.92 41.30 2dio s ASP 47 CO 0.00 -0.13 -0.15 -0.76 0.21 0.00 0.00 175.17 174.34 2dio s LEU 48 N -0.79 2.17 -0.40 1.23 1.43 -0.66 -1.50 118.68 120.17 2dio s LEU 48 Ca 0.46 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 2dio s LEU 48 Cb -0.29 -0.66 0.15 0.00 0.03 0.00 0.00 46.19 45.42 2dio s LEU 48 CO 0.36 0.05 0.28 -0.69 0.23 0.00 0.00 176.35 176.57 2dio s VAL 49 N -0.85 0.49 0.39 -1.59 1.01 0.35 -0.67 120.40 119.52 2dio s VAL 49 Ca 0.02 -2.28 -0.27 0.00 0.00 0.00 0.00 61.98 59.45 2dio s VAL 49 Cb -0.08 -1.35 -0.10 0.00 0.00 0.00 0.00 36.38 34.85 2dio s VAL 49 CO 0.01 -1.07 1.46 -2.84 0.00 0.00 0.00 175.10 172.66 2dio s PRO 50 N 0.49 4.03 0.15 2.72 0.02 -1.22 -1.33 135.00 139.86 2dio s PRO 50 Ca 0.24 2.52 -0.13 0.00 0.02 0.00 0.00 61.00 63.65 2dio s PRO 50 Cb -0.12 -2.90 0.01 0.00 0.02 0.00 0.00 34.50 31.51 2dio s PRO 50 CO -0.08 -0.58 0.36 -0.59 -0.33 0.00 0.00 177.00 175.79 2dio s PHE 51 N -1.14 0.07 -0.29 6.54 -0.12 -0.49 -2.44 117.98 120.11 2dio s PHE 51 Ca 0.54 -0.43 -0.13 0.00 -0.05 0.00 0.00 56.93 56.87 2dio s PHE 51 Cb -0.45 0.14 0.12 0.00 -0.63 0.00 0.00 43.02 42.20 2dio s PHE 51 CO 0.61 -0.74 0.71 -0.08 -0.05 0.00 0.00 175.22 175.67 2dio s THR 52 N -3.89 -0.60 0.42 -4.49 -1.32 -1.26 -1.76 115.64 102.75 2dio s THR 52 Ca 0.10 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.64 2dio s THR 52 Cb 0.02 -1.00 -0.07 0.00 -1.51 0.00 0.00 72.50 69.94 2dio s THR 52 CO -0.05 0.00 0.01 0.20 -2.21 0.00 0.00 174.62 172.57 2dio s ASN 53 N 2.39 3.86 0.40 8.08 0.01 -1.11 -4.73 114.94 123.84 2dio s ASN 53 Ca -0.07 -1.41 -0.15 0.00 -0.71 0.00 0.00 52.86 50.52 2dio s ASN 53 Cb -0.09 -0.27 -0.08 0.00 0.41 0.00 0.00 41.25 41.22 2dio s ASN 53 CO -0.19 -0.51 0.82 -0.54 -1.51 0.00 0.00 177.10 175.17 2dio s LYS 54 N -3.74 3.95 -0.05 -0.60 1.02 -0.25 -1.16 119.74 118.91 2dio s LYS 54 Ca 0.31 0.72 0.04 0.00 0.02 0.00 0.00 55.97 57.06 2dio s LYS 54 Cb 0.09 -2.33 0.00 0.00 -0.52 0.00 0.00 37.83 35.07 2dio s LYS 54 CO 0.16 -0.01 -0.16 -1.17 -0.92 0.00 0.00 175.35 173.25 2dio s LEU 55 N -3.50 1.86 0.19 3.17 2.96 -0.26 -0.81 118.68 122.29 2dio s LEU 55 Ca 0.55 -0.34 0.09 0.00 -0.22 0.00 0.00 54.13 54.20 2dio s LEU 55 Cb -0.10 -0.94 -0.04 0.00 0.50 0.00 0.00 46.19 45.60 2dio s LEU 55 CO 0.24 0.12 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.91 2dio s TYR 56 N 0.21 1.82 0.96 5.38 2.02 -0.12 -0.60 117.35 127.02 2dio s TYR 56 Ca -0.07 -0.49 -0.11 0.00 -0.37 0.00 0.00 57.07 56.03 2dio s TYR 56 Cb -0.13 -0.88 0.17 0.00 -0.40 0.00 0.00 41.96 40.72 2dio s TYR 56 CO 0.03 0.37 1.11 0.95 -1.57 0.00 0.00 175.55 176.44 2dio s THR 57 N -2.36 2.21 0.48 -0.71 -4.23 0.07 -1.64 115.64 109.46 2dio s THR 57 Ca 0.19 0.07 0.15 0.00 -1.18 0.00 0.00 61.69 60.92 2dio s THR 57 Cb -0.04 -2.17 0.23 0.00 1.34 0.00 0.00 72.50 71.85 2dio s THR 57 CO 0.07 -0.09 2.07 1.23 -0.54 0.00 0.00 174.62 177.36 2dio h GLY 58 N -1.97 0.01 0.26 3.99 0.00 -1.60 -0.88 103.07 102.88 2dio h GLY 58 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2dio h GLY 58 CO 0.45 0.01 0.00 2.09 0.00 0.00 0.00 176.54 179.09 2dio n ASP 59 N -4.43 0.69 -0.35 0.19 5.68 -1.26 -1.40 116.55 115.66 2dio n ASP 59 Ca -0.03 -1.29 -0.05 0.00 -0.50 0.00 0.00 54.79 52.92 2dio n ASP 59 Cb 0.17 -0.01 -0.02 0.00 -1.14 0.00 0.00 41.12 40.12 2dio n ASP 59 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2dio n LEU 60 N -0.44 0.27 0.08 -2.12 4.77 -0.33 -4.60 117.00 114.62 2dio n LEU 60 Ca 0.20 0.11 -0.03 0.00 -0.03 0.00 0.00 56.01 56.27 2dio n LEU 60 Cb 0.21 -2.23 -0.06 0.00 -2.33 0.00 0.00 43.42 39.01 2dio n LEU 60 CO 0.16 -0.84 0.14 0.11 -1.33 0.00 0.00 177.39 175.63 2dio h LYS 61 N 0.13 0.00 -4.87 3.23 1.57 -1.92 -0.13 116.57 114.58 2dio h LYS 61 Ca -0.09 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 58.28 2dio h LYS 61 Cb 0.90 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 32.93 2dio h LYS 61 CO 0.14 0.68 -0.78 0.15 -0.57 0.00 0.00 179.45 179.06 2dio s LYS 62 N -2.82 0.80 -0.10 3.15 1.02 -1.26 -4.32 119.74 116.22 2dio s LYS 62 Ca 0.01 -0.42 -0.30 0.00 0.02 0.00 0.00 55.97 55.29 2dio s LYS 62 Cb 0.09 -0.77 -0.02 0.00 -0.52 0.00 0.00 37.83 36.60 2dio s LYS 62 CO 0.79 0.21 1.19 0.50 -0.92 0.00 0.00 175.35 177.12 2dio s ARG 63 N -0.40 4.32 -0.18 1.68 6.06 0.18 -0.75 118.95 129.86 2dio s ARG 63 Ca 0.03 1.62 0.13 0.00 -2.50 0.00 0.00 55.73 55.01 2dio s ARG 63 Cb -0.05 -3.62 -0.21 0.00 0.06 0.00 0.00 34.95 31.14 2dio s ARG 63 CO -0.00 -0.51 0.02 1.33 -2.50 0.00 0.00 175.30 173.63 2dio n VAL 64 N 4.86 1.22 0.00 7.11 0.24 0.23 -1.89 118.33 130.11 2dio n VAL 64 Ca 0.12 -0.71 0.00 0.00 -2.04 0.00 0.00 64.34 61.71 2dio n VAL 64 Cb 0.46 -0.66 0.00 0.00 -1.47 0.00 0.00 33.84 32.17 2dio n VAL 64 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dio n GLY 65 N 2.00 -0.57 3.16 7.63 0.00 -0.72 -2.40 105.19 114.29 2dio n GLY 65 Ca -0.31 -0.26 -0.08 0.00 0.00 0.00 0.00 46.02 45.37 2dio n GLY 65 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2dio s ILE 66 N -2.69 0.16 0.18 -0.61 -4.36 -1.17 -1.10 121.20 111.60 2dio s ILE 66 Ca 0.00 -1.30 0.03 0.00 -0.26 0.00 0.00 60.65 59.12 2dio s ILE 66 Cb 0.00 -1.30 -0.03 0.00 1.25 0.00 0.00 42.46 42.37 2dio s ILE 66 CO 0.00 -0.72 0.30 0.42 0.24 0.00 0.00 174.94 175.18 2dio s THR 67 N -3.64 5.28 -0.27 8.37 -4.23 -0.31 -0.17 115.64 120.66 2dio s THR 67 Ca 0.04 -0.79 -0.14 0.00 -1.18 0.00 0.00 61.69 59.62 2dio s THR 67 Cb 0.05 -3.76 0.09 0.00 1.34 0.00 0.00 72.50 70.21 2dio s THR 67 CO -0.10 -0.16 0.65 0.00 -0.54 0.00 0.00 174.62 174.47 2dio s ALA 68 N -1.81 -1.80 0.00 3.99 0.00 -0.70 -2.76 121.76 118.67 2dio s ALA 68 Ca 0.34 2.30 0.00 0.00 0.00 0.00 0.00 51.96 54.61 2dio s ALA 68 Cb -0.10 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.58 2dio s ALA 68 CO 0.28 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2dio n GLY 69 N 4.52 -0.60 2.77 0.00 0.00 -0.72 -0.86 105.19 110.29 2dio n GLY 69 Ca -0.19 -0.56 -0.16 0.00 0.00 0.00 0.00 46.02 45.12 2dio n GLY 69 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dio s LEU 70 N 0.00 0.90 -0.23 0.99 2.96 -0.19 -1.40 118.68 121.72 2dio s LEU 70 Ca 0.00 0.07 -0.12 0.00 -0.22 0.00 0.00 54.13 53.85 2dio s LEU 70 Cb 0.00 -0.05 -0.05 0.00 0.50 0.00 0.00 46.19 46.60 2dio s LEU 70 CO 0.00 -0.15 0.25 0.00 -1.32 0.00 0.00 176.35 175.13 2dio s VAL 72 N 1.19 5.21 0.17 0.00 1.01 0.66 -0.49 120.40 128.16 2dio s VAL 72 Ca 0.11 -0.12 -0.31 0.00 0.00 0.00 0.00 61.98 61.67 2dio s VAL 72 Cb -0.14 -3.61 -0.09 0.00 0.00 0.00 0.00 36.38 32.54 2dio s VAL 72 CO 0.06 0.08 1.38 -0.69 0.00 0.00 0.00 175.10 175.93 2dio s VAL 73 N 1.72 3.11 -0.25 2.92 1.01 -0.56 -0.62 120.40 127.72 2dio s VAL 73 Ca 0.06 0.86 -0.08 0.00 0.00 0.00 0.00 61.98 62.82 2dio s VAL 73 Cb -0.17 -3.55 -0.12 0.00 0.00 0.00 0.00 36.38 32.54 2dio s VAL 73 CO 0.10 0.10 -0.29 -0.38 0.00 0.00 0.00 175.10 174.64 2dio n ILE 74 N 3.18 1.37 -3.51 2.22 2.08 0.49 -4.13 119.36 121.07 2dio n ILE 74 Ca 0.09 -0.41 -0.10 0.00 0.56 0.00 0.00 62.75 62.89 2dio n ILE 74 Cb 0.42 -1.68 -0.03 0.00 -0.75 0.00 0.00 39.64 37.60 2dio n ILE 74 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 2dio s GLU 75 N -2.46 0.85 0.28 0.38 -1.05 -1.12 -3.93 118.70 111.64 2dio s GLU 75 Ca -0.34 -0.17 -0.24 0.00 -0.15 0.00 0.00 54.97 54.07 2dio s GLU 75 Cb 0.12 0.39 -0.09 0.00 -0.44 0.00 0.00 34.13 34.11 2dio s GLU 75 CO 0.48 -0.34 0.86 -1.58 0.95 0.00 0.00 175.26 175.62 2dio s HIS 76 N -2.58 3.68 -0.66 4.83 5.65 -1.25 -1.52 115.29 123.43 2dio s HIS 76 Ca 0.02 1.63 0.04 0.00 0.25 0.00 0.00 55.06 57.00 2dio s HIS 76 Cb -0.01 -2.81 0.16 0.00 -1.18 0.00 0.00 32.58 28.75 2dio s HIS 76 CO -0.05 0.26 0.45 0.08 -0.65 0.00 0.00 174.74 174.82 2dio s VAL 77 N -1.58 2.93 0.29 0.89 1.01 0.39 -4.91 120.40 119.42 2dio s VAL 77 Ca 0.47 -3.96 -0.01 0.00 0.00 0.00 0.00 61.98 58.48 2dio s VAL 77 Cb -0.18 -2.94 0.27 0.00 0.00 0.00 0.00 36.38 33.53 2dio s VAL 77 CO 0.23 -0.95 1.94 1.55 0.00 0.00 0.00 175.10 177.86 2dio h PRO 78 N 5.78 1.08 0.00 2.72 0.13 -1.97 -2.07 132.00 137.68 2dio h PRO 78 Ca 0.08 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2dio h PRO 78 Cb 0.80 -0.24 0.00 0.00 0.13 0.00 0.00 31.00 31.69 2dio h PRO 78 CO 0.72 0.72 0.00 1.05 -0.23 0.00 0.00 178.00 180.25 2dio h GLU 79 N 1.11 0.00 -0.27 0.86 9.09 -1.94 -2.28 114.58 121.15 2dio h GLU 79 Ca 0.35 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.76 2dio h GLU 79 Cb 0.02 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.12 2dio h GLU 79 CO -0.10 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.59 2dio n LYS 80 N -3.08 2.25 -3.87 1.06 4.76 -0.83 -4.99 118.16 113.45 2dio n LYS 80 Ca -0.01 -1.83 -0.26 0.00 -2.87 0.00 0.00 58.31 53.34 2dio n LYS 80 Cb 0.20 -1.27 0.01 0.00 -1.84 0.00 0.00 35.03 32.14 2dio n LYS 80 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2dio n LYS 81 N 0.59 -4.50 -1.35 1.97 4.01 -0.86 -4.81 118.16 113.20 2dio n LYS 81 Ca 0.11 0.54 0.00 0.00 -0.51 0.00 0.00 58.31 58.44 2dio n LYS 81 Cb 0.39 -5.08 0.00 0.00 -0.51 0.00 0.00 35.03 29.83 2dio n LYS 81 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2dio n GLY 82 N -1.70 1.37 3.37 0.72 0.00 -0.97 -4.89 105.19 103.09 2dio n GLY 82 Ca -0.18 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 2dio n GLY 82 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dio s GLU 83 N -1.88 1.35 -0.23 1.61 0.41 -1.26 -0.46 118.70 118.23 2dio s GLU 83 Ca 0.00 -1.35 -0.08 0.00 -0.41 0.00 0.00 54.97 53.13 2dio s GLU 83 Cb 0.00 -1.70 -0.04 0.00 -1.78 0.00 0.00 34.13 30.61 2dio s GLU 83 CO 0.00 0.39 0.09 0.50 -0.49 0.00 0.00 175.26 175.75 2dio s ARG 84 N -2.24 3.85 0.14 1.61 3.52 -0.58 -1.22 118.95 124.03 2dio s ARG 84 Ca 0.14 -0.39 0.08 0.00 -0.13 0.00 0.00 55.73 55.43 2dio s ARG 84 Cb -0.09 -3.36 -0.04 0.00 -1.56 0.00 0.00 34.95 29.90 2dio s ARG 84 CO 0.06 -0.01 -0.08 -0.06 -0.81 0.00 0.00 175.30 174.41 2dio s PHE 85 N 1.16 2.73 -0.23 5.12 0.08 0.35 -0.38 117.98 126.82 2dio s PHE 85 Ca 0.05 -0.17 -0.07 0.00 0.12 0.00 0.00 56.93 56.86 2dio s PHE 85 Cb -0.14 -1.38 -0.03 0.00 -0.57 0.00 0.00 43.02 40.90 2dio s PHE 85 CO 0.04 0.47 0.06 -2.00 -0.10 0.00 0.00 175.22 173.69 2dio s GLU 86 N -2.54 3.71 0.02 0.44 2.56 0.21 -1.15 118.70 121.95 2dio s GLU 86 Ca 0.24 -0.46 0.08 0.00 0.00 0.00 0.00 54.97 54.83 2dio s GLU 86 Cb -0.10 -3.26 -0.03 0.00 2.00 0.00 0.00 34.13 32.74 2dio s GLU 86 CO 0.15 -0.07 -0.24 0.00 -0.56 0.00 0.00 175.26 174.54 2dio s ALA 87 N 1.28 2.32 -0.12 6.30 0.00 0.48 -0.24 121.76 131.77 2dio s ALA 87 Ca 0.05 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 50.79 2dio s ALA 87 Cb -0.15 -0.58 0.04 0.00 0.00 0.00 0.00 23.12 22.44 2dio s ALA 87 CO 0.03 0.54 -0.00 0.99 0.00 0.00 0.00 175.76 177.32 2dio s THR 88 N -0.77 0.56 0.12 0.00 2.01 -0.53 -1.82 115.64 115.21 2dio s THR 88 Ca 0.12 -0.20 -0.26 0.00 0.31 0.00 0.00 61.69 61.66 2dio s THR 88 Cb -0.10 -0.81 0.07 0.00 0.01 0.00 0.00 72.50 71.66 2dio s THR 88 CO 0.02 0.12 0.93 -0.72 -0.69 0.00 0.00 174.62 174.27 2dio s TYR 89 N 1.88 -0.19 0.18 4.92 1.13 -1.12 -1.02 117.35 123.13 2dio s TYR 89 Ca 0.03 -0.08 0.08 0.00 -1.41 0.00 0.00 57.07 55.69 2dio s TYR 89 Cb -0.14 0.62 -0.04 0.00 -1.10 0.00 0.00 41.96 41.30 2dio s TYR 89 CO -0.07 -0.78 -0.17 -1.12 -2.51 0.00 0.00 175.55 170.90 2dio s SER 90 N -2.84 2.64 -0.19 -0.18 0.01 -0.04 -1.15 113.70 111.94 2dio s SER 90 Ca 0.10 -0.91 -0.01 0.00 1.31 0.00 0.00 55.95 56.45 2dio s SER 90 Cb -0.01 -0.15 0.01 0.00 0.21 0.00 0.00 66.02 66.07 2dio s SER 90 CO -0.00 -0.08 -0.14 -0.36 0.41 0.00 0.00 173.24 173.07 2dio s PHE 91 N -2.34 2.84 -0.19 2.43 0.08 0.35 -1.73 117.98 119.43 2dio s PHE 91 Ca 0.18 -1.34 -0.09 0.00 0.12 0.00 0.00 56.93 55.80 2dio s PHE 91 Cb -0.04 -1.98 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 2dio s PHE 91 CO 0.07 -0.69 0.09 0.71 -0.10 0.00 0.00 175.22 175.30 2dio s TYR 92 N 1.31 3.33 -0.49 0.36 2.02 0.75 -1.35 117.35 123.28 2dio s TYR 92 Ca 0.04 0.20 0.05 0.00 -0.37 0.00 0.00 57.07 56.99 2dio s TYR 92 Cb -0.14 -2.11 0.40 0.00 -0.40 0.00 0.00 41.96 39.71 2dio s TYR 92 CO -0.08 0.23 1.11 1.19 -1.57 0.00 0.00 175.55 176.43 2dio n PHE 93 N 3.48 3.55 -4.19 2.71 3.72 -0.04 -3.06 117.46 123.63 2dio n PHE 93 Ca -0.16 -3.29 0.00 0.00 -0.05 0.00 0.00 57.45 53.94 2dio n PHE 93 Cb 0.52 -0.23 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2dio n PHE 93 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dio n GLY 94 N -0.42 3.08 0.02 1.37 0.00 -1.06 -1.63 105.19 106.54 2dio n GLY 94 Ca 0.38 -0.33 0.11 0.00 0.00 0.00 0.00 46.02 46.18 2dio n GLY 94 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dio n ASP 95 N 1.68 0.14 0.22 1.61 8.00 -1.26 -3.00 116.55 123.94 2dio n ASP 95 Ca 0.00 0.52 0.05 0.00 0.71 0.00 0.00 54.79 56.07 2dio n ASP 95 Cb 0.00 -0.55 0.49 0.00 -0.02 0.00 0.00 41.12 41.03 2dio n ASP 95 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2dio h TYR 96 N 0.00 0.00 0.00 1.24 0.05 -1.65 -3.46 116.97 113.15 2dio h TYR 96 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2dio h TYR 96 Cb 0.41 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.15 2dio h TYR 96 CO 0.00 0.21 0.00 0.41 -1.05 0.00 0.00 178.16 177.73 2dio n GLY 97 N -0.93 0.51 3.18 3.88 0.00 -1.16 -0.39 105.19 110.27 2dio n GLY 97 Ca -0.02 -2.21 -0.08 0.00 0.00 0.00 0.00 46.02 43.70 2dio n GLY 97 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2dio s HIS 98 N -0.21 0.43 -0.04 1.61 -3.43 -1.12 -0.86 115.29 111.66 2dio s HIS 98 Ca 0.00 -0.88 0.06 0.00 -0.80 0.00 0.00 55.06 53.44 2dio s HIS 98 Cb 0.00 -0.24 -0.02 0.00 -1.43 0.00 0.00 32.58 30.89 2dio s HIS 98 CO 0.00 -0.51 -0.20 -0.51 -2.00 0.00 0.00 174.74 171.52 2dio s LEU 99 N -2.93 2.40 0.11 5.38 1.43 -0.46 -1.69 118.68 122.92 2dio s LEU 99 Ca 0.11 -0.34 0.06 0.00 -1.03 0.00 0.00 54.13 52.93 2dio s LEU 99 Cb 0.06 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.79 2dio s LEU 99 CO -0.07 0.32 -0.06 -0.44 0.23 0.00 0.00 176.35 176.33 2dio s SER 100 N -0.61 4.62 0.14 2.29 0.01 -0.36 -0.49 113.70 119.30 2dio s SER 100 Ca 0.09 -0.33 -0.03 0.00 1.31 0.00 0.00 55.95 56.99 2dio s SER 100 Cb -0.11 -0.96 -0.03 0.00 0.21 0.00 0.00 66.02 65.13 2dio s SER 100 CO 0.00 0.17 0.11 0.68 0.41 0.00 0.00 173.24 174.61 2dio s VAL 101 N -1.30 0.10 -0.20 3.43 -7.23 -0.30 -0.58 120.40 114.31 2dio s VAL 101 Ca 0.23 -1.78 -0.11 0.00 -1.81 0.00 0.00 61.98 58.52 2dio s VAL 101 Cb -0.11 -1.98 0.07 0.00 0.56 0.00 0.00 36.38 34.92 2dio s VAL 101 CO 0.16 -0.44 0.48 -1.58 -0.31 0.00 0.00 175.10 173.41 2dio s GLN 102 N -4.02 0.47 0.00 4.82 0.74 -0.61 -2.78 119.66 118.28 2dio s GLN 102 Ca 0.22 0.92 0.00 0.00 0.05 0.00 0.00 55.36 56.55 2dio s GLN 102 Cb 0.06 0.04 0.00 0.00 1.10 0.00 0.00 33.01 34.22 2dio s GLN 102 CO 0.01 -0.16 0.00 0.41 -0.55 0.00 0.00 175.29 175.00 2dio n GLY 103 N 4.34 -0.53 3.74 2.59 0.00 -0.76 -0.75 105.19 113.82 2dio n GLY 103 Ca -0.22 -1.46 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 2dio n GLY 103 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dio s PRO 104 N -2.00 4.75 -0.22 1.61 0.04 -1.26 -0.39 135.00 137.53 2dio s PRO 104 Ca 0.00 1.47 0.02 0.00 0.04 0.00 0.00 61.00 62.53 2dio s PRO 104 Cb 0.00 -3.34 0.05 0.00 0.04 0.00 0.00 34.50 31.24 2dio s PRO 104 CO 0.00 0.32 -0.13 -0.47 0.04 0.00 0.00 177.00 176.76 2dio s TYR 105 N -0.41 2.91 -0.20 0.56 5.04 -0.30 -4.69 117.35 120.26 2dio s TYR 105 Ca 0.45 -1.96 -0.04 0.00 -2.44 0.00 0.00 57.07 53.07 2dio s TYR 105 Cb -0.24 -1.84 -0.02 0.00 0.35 0.00 0.00 41.96 40.20 2dio s TYR 105 CO 0.31 -0.83 -0.02 -0.51 -1.34 0.00 0.00 175.55 173.16 2dio s LEU 106 N 1.23 3.11 0.62 6.97 1.43 -1.26 -0.49 118.68 130.29 2dio s LEU 106 Ca -0.04 -0.27 0.40 0.00 -1.03 0.00 0.00 54.13 53.19 2dio s LEU 106 Cb -0.17 -1.79 1.97 0.00 0.03 0.00 0.00 46.19 46.23 2dio s LEU 106 CO -0.08 0.04 2.21 0.71 0.23 0.00 0.00 176.35 179.46 2dio h THR 107 N 5.50 0.01 -0.01 5.49 1.35 -1.54 -3.11 112.91 120.59 2dio h THR 107 Ca -0.37 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 2dio h THR 107 Cb 1.17 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.82 2dio h THR 107 CO 0.60 0.00 -0.44 0.00 -0.25 0.00 0.00 175.52 175.44 2dio n TYR 108 N -3.09 0.00 -3.61 4.73 4.11 -1.26 -4.93 117.16 113.10 2dio n TYR 108 Ca -0.01 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.79 2dio n TYR 108 Cb 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 39.34 39.49 2dio n TYR 108 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.86 175.03 2dio s GLU 109 N -2.14 1.48 0.75 -3.48 -1.05 -1.18 -5.13 118.70 107.95 2dio s GLU 109 Ca 0.14 -0.69 -0.13 0.00 -0.15 0.00 0.00 54.97 54.14 2dio s GLU 109 Cb 0.14 0.59 0.05 0.00 -0.44 0.00 0.00 34.13 34.47 2dio s GLU 109 CO 0.49 -0.66 1.12 -0.51 0.95 0.00 0.00 175.26 176.65 2dio s ASP 110 N -2.82 4.44 0.29 0.83 1.01 -1.26 -4.40 116.67 114.75 2dio s ASP 110 Ca 0.06 2.02 -0.05 0.00 0.71 0.00 0.00 52.55 55.29 2dio s ASP 110 Cb -0.03 -2.55 -0.01 0.00 1.01 0.00 0.00 42.92 41.34 2dio s ASP 110 CO -0.04 -2.08 0.40 -0.94 0.21 0.00 0.00 175.17 172.71 2dio s SER 111 N -2.80 0.50 -0.06 0.27 1.04 -0.86 -4.95 113.70 106.84 2dio s SER 111 Ca 0.66 -1.31 0.05 0.00 0.48 0.00 0.00 55.95 55.82 2dio s SER 111 Cb -0.21 0.58 -0.01 0.00 0.10 0.00 0.00 66.02 66.48 2dio s SER 111 CO 0.50 -1.15 -0.21 -0.36 0.98 0.00 0.00 173.24 173.00 2dio s PHE 112 N -3.59 2.10 0.15 5.02 0.08 -1.26 -0.55 117.98 119.92 2dio s PHE 112 Ca 0.30 -0.65 0.06 0.00 0.12 0.00 0.00 56.93 56.76 2dio s PHE 112 Cb 0.01 -1.40 -0.04 0.00 -0.57 0.00 0.00 43.02 41.03 2dio s PHE 112 CO 0.16 -0.22 0.03 -0.51 -0.10 0.00 0.00 175.22 174.58 2dio s LEU 113 N 0.01 3.48 0.10 -0.37 1.02 -0.48 -4.41 118.68 118.03 2dio s LEU 113 Ca -0.06 -0.27 -0.30 0.00 0.02 0.00 0.00 54.13 53.52 2dio s LEU 113 Cb -0.13 -2.14 -0.06 0.00 0.02 0.00 0.00 46.19 43.88 2dio s LEU 113 CO 0.04 0.11 1.04 0.00 0.02 0.00 0.00 176.35 177.55 2dio s ALA 114 N -1.62 3.29 -0.51 4.21 0.00 0.07 -0.84 121.76 126.35 2dio s ALA 114 Ca 0.28 0.68 -0.28 0.00 0.00 0.00 0.00 51.96 52.64 2dio s ALA 114 Cb -0.10 -3.34 0.03 0.00 0.00 0.00 0.00 23.12 19.71 2dio s ALA 114 CO 0.20 -0.18 1.13 0.42 0.00 0.00 0.00 175.76 177.33 2dio s ILE 115 N 0.29 4.18 -0.42 0.00 1.01 -0.23 -1.57 121.20 124.44 2dio s ILE 115 Ca 0.50 1.04 0.23 0.00 0.00 0.00 0.00 60.65 62.43 2dio s ILE 115 Cb -0.26 -4.63 0.08 0.00 0.01 0.00 0.00 42.46 37.67 2dio s ILE 115 CO 0.31 -1.11 1.25 0.71 0.00 0.00 0.00 174.94 176.10 2dio h THR 116 N 6.19 0.00 0.00 2.92 1.35 -1.15 -3.37 112.91 118.85 2dio h THR 116 Ca -0.24 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 2dio h THR 116 Cb 1.06 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 2dio h THR 116 CO 1.14 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 177.02 2dio n GLY 117 N 1.22 -2.38 3.69 5.82 0.00 -1.23 -4.99 105.19 107.33 2dio n GLY 117 Ca 0.02 -1.26 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 2dio n GLY 117 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dio s GLY 118 N 0.00 0.38 0.15 -0.02 0.00 -1.24 -1.22 107.32 105.36 2dio s GLY 118 Ca 0.00 -0.72 0.01 0.00 0.00 0.00 0.00 44.72 44.01 2dio s GLY 118 CO 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 173.10 172.65 2dio s ALA 119 N -3.79 1.18 0.00 3.20 0.00 -0.68 -4.03 121.76 117.64 2dio s ALA 119 Ca 0.19 -1.52 0.00 0.00 0.00 0.00 0.00 51.96 50.62 2dio s ALA 119 Cb -0.03 0.54 0.00 0.00 0.00 0.00 0.00 23.12 23.63 2dio s ALA 119 CO 0.09 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.92 2dio n GLY 120 N -0.17 1.23 0.26 0.00 0.00 -1.26 -2.37 105.19 102.87 2dio n GLY 120 Ca -0.07 -0.62 0.17 0.00 0.00 0.00 0.00 46.02 45.49 2dio n GLY 120 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2dio h ILE 121 N 0.00 0.00 -0.27 -0.61 3.07 -1.05 -2.00 117.51 116.65 2dio h ILE 121 Ca 0.00 -0.22 0.00 0.00 1.55 0.00 0.00 64.86 66.19 2dio h ILE 121 Cb 0.00 1.09 0.00 0.00 -0.27 0.00 0.00 36.82 37.64 2dio h ILE 121 CO 0.00 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.59 2dio n PHE 122 N -2.81 0.35 -1.63 0.16 3.72 -1.00 -4.56 117.46 111.69 2dio n PHE 122 Ca -0.01 -0.17 -0.48 0.00 -0.05 0.00 0.00 57.45 56.74 2dio n PHE 122 Cb 0.17 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.67 2dio n PHE 122 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 2dio n GLU 123 N 0.71 1.68 -0.19 -1.08 0.00 -0.75 -0.90 120.64 120.11 2dio n GLU 123 Ca 0.17 0.60 0.00 0.00 0.00 0.00 0.00 57.16 57.93 2dio n GLU 123 Cb 0.41 -2.26 0.00 0.00 0.00 0.00 0.00 31.44 29.59 2dio n GLU 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dio n GLY 124 N 2.59 1.22 3.64 8.31 0.00 -1.26 -4.43 105.19 115.25 2dio n GLY 124 Ca 0.15 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.71 2dio n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dio n ALA 125 N -0.82 0.53 -2.93 4.61 0.00 -0.08 -4.42 120.51 117.40 2dio n ALA 125 Ca 0.00 0.45 -0.10 0.00 0.00 0.00 0.00 53.44 53.79 2dio n ALA 125 Cb 0.00 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.17 2dio n ALA 125 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2dio s TYR 126 N 0.24 0.53 -1.25 0.00 -0.85 -0.42 -4.04 117.35 111.56 2dio s TYR 126 Ca 0.74 -0.86 0.00 0.00 -0.52 0.00 0.00 57.07 56.43 2dio s TYR 126 Cb -0.74 0.01 0.00 0.00 0.38 0.00 0.00 41.96 41.61 2dio s TYR 126 CO 0.47 -0.89 0.00 0.41 -1.52 0.00 0.00 175.55 174.01 2dio n GLY 127 N -0.34 0.50 3.21 5.49 0.00 -1.26 -1.09 105.19 111.69 2dio n GLY 127 Ca -0.01 -2.05 -0.13 0.00 0.00 0.00 0.00 46.02 43.83 2dio n GLY 127 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2dio s GLN 128 N -0.50 0.96 -0.05 1.61 -2.07 -1.26 -1.07 119.66 117.28 2dio s GLN 128 Ca 0.00 -1.38 0.04 0.00 -1.82 0.00 0.00 55.36 52.21 2dio s GLN 128 Cb 0.00 -0.47 -0.00 0.00 -1.09 0.00 0.00 33.01 31.44 2dio s GLN 128 CO 0.00 0.05 -0.19 0.54 -1.32 0.00 0.00 175.29 174.37 2dio s VAL 129 N -3.31 1.55 -0.15 3.63 0.11 -0.02 -1.34 120.40 120.87 2dio s VAL 129 Ca 0.14 -0.78 -0.20 0.00 -2.93 0.00 0.00 61.98 58.21 2dio s VAL 129 Cb 0.03 -1.33 -0.03 0.00 -1.53 0.00 0.00 36.38 33.52 2dio s VAL 129 CO -0.01 0.44 0.59 -0.75 -3.33 0.00 0.00 175.10 172.04 2dio s LYS 130 N 0.05 4.30 -0.23 1.54 2.20 0.21 -1.39 119.74 126.42 2dio s LYS 130 Ca -0.05 0.61 -0.07 0.00 -0.36 0.00 0.00 55.97 56.10 2dio s LYS 130 Cb -0.12 -3.51 -0.03 0.00 -1.51 0.00 0.00 37.83 32.66 2dio s LYS 130 CO 0.03 -0.05 0.05 -1.17 -0.36 0.00 0.00 175.35 173.85 2dio s LEU 131 N 1.27 3.44 -0.19 5.43 0.20 0.28 -1.66 118.68 127.45 2dio s LEU 131 Ca 0.29 -0.17 0.00 0.00 0.69 0.00 0.00 54.13 54.95 2dio s LEU 131 Cb -0.16 -1.90 0.02 0.00 -0.43 0.00 0.00 46.19 43.72 2dio s LEU 131 CO 0.12 0.02 -0.16 -1.10 -0.29 0.00 0.00 176.35 174.94 2dio s GLN 132 N 1.27 3.02 -0.06 1.98 -0.21 0.25 -2.04 119.66 123.87 2dio s GLN 132 Ca 0.04 -0.82 -0.24 0.00 0.02 0.00 0.00 55.36 54.36 2dio s GLN 132 Cb -0.15 -2.68 -0.03 0.00 1.00 0.00 0.00 33.01 31.15 2dio s GLN 132 CO 0.03 -0.23 0.74 -1.14 -2.12 0.00 0.00 175.29 172.57 2dio s GLN 133 N 1.32 4.45 -0.21 2.91 0.74 -1.26 -0.67 119.66 126.93 2dio s GLN 133 Ca 0.04 0.95 -0.07 0.00 0.05 0.00 0.00 55.36 56.33 2dio s GLN 133 Cb -0.14 -3.46 -0.10 0.00 1.10 0.00 0.00 33.01 30.42 2dio s GLN 133 CO -0.11 0.03 -0.25 1.28 -0.55 0.00 0.00 175.29 175.70 2dio n LEU 134 N 3.86 1.86 -3.75 3.68 4.77 -0.09 -4.91 117.00 122.42 2dio n LEU 134 Ca -0.00 0.16 -0.23 0.00 -0.03 0.00 0.00 56.01 55.91 2dio n LEU 134 Cb 0.51 -0.63 -0.18 0.00 -2.33 0.00 0.00 43.42 40.79 2dio n LEU 134 CO 0.48 0.54 -0.37 -0.69 -1.33 0.00 0.00 177.39 176.01 2dio s VAL 135 N -2.39 0.31 -0.06 4.08 1.01 -0.96 -4.52 120.40 117.87 2dio s VAL 135 Ca -0.29 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.50 2dio s VAL 135 Cb 0.10 -0.52 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 2dio s VAL 135 CO 0.39 0.20 1.09 -0.47 0.00 0.00 0.00 175.10 176.31 2dio s TYR 136 N 1.99 3.40 -0.53 5.22 5.04 -1.26 -0.29 117.35 130.92 2dio s TYR 136 Ca 0.04 1.44 0.16 0.00 -2.44 0.00 0.00 57.07 56.27 2dio s TYR 136 Cb -0.13 -3.29 0.63 0.00 0.35 0.00 0.00 41.96 39.53 2dio s TYR 136 CO -0.05 -0.69 1.54 -0.35 -1.34 0.00 0.00 175.55 174.66 2dio n PRO 137 N 4.89 3.64 0.00 4.97 -0.04 -1.26 -4.96 135.00 142.24 2dio n PRO 137 Ca 0.09 -2.84 0.08 0.00 -0.04 0.00 0.00 63.50 60.79 2dio n PRO 137 Cb 0.48 -1.90 -0.07 0.00 -0.04 0.00 0.00 33.50 31.98 2dio n PRO 137 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2dio n THR 138 N 0.33 0.00 -3.68 0.52 -2.24 0.60 -4.73 114.28 105.08 2dio n THR 138 Ca 0.23 -0.16 -0.19 0.00 -2.27 0.00 0.00 64.05 61.66 2dio n THR 138 Cb 0.91 1.07 -0.17 0.00 -2.10 0.00 0.00 70.33 70.04 2dio n THR 138 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2dio s LYS 139 N -2.46 -0.05 0.04 -0.78 1.02 -0.45 -0.99 119.74 116.08 2dio s LYS 139 Ca 0.09 0.40 0.01 0.00 0.02 0.00 0.00 55.97 56.50 2dio s LYS 139 Cb 0.14 -0.44 -0.03 0.00 -0.52 0.00 0.00 37.83 36.98 2dio s LYS 139 CO 0.63 -0.31 -0.06 -0.51 -0.92 0.00 0.00 175.35 174.18 2dio s LEU 140 N 2.10 2.29 -0.05 3.17 1.02 -0.20 -0.91 118.68 126.09 2dio s LEU 140 Ca 0.03 -0.61 0.02 0.00 0.02 0.00 0.00 54.13 53.60 2dio s LEU 140 Cb -0.12 -0.06 0.01 0.00 0.02 0.00 0.00 46.19 46.04 2dio s LEU 140 CO -0.04 -0.28 -0.10 0.12 0.02 0.00 0.00 176.35 176.07 2dio s PHE 141 N -1.77 1.24 0.05 0.29 5.36 0.15 -0.70 117.98 122.60 2dio s PHE 141 Ca -0.09 -0.42 0.09 0.00 -0.96 0.00 0.00 56.93 55.55 2dio s PHE 141 Cb -0.07 -0.93 -0.03 0.00 -0.34 0.00 0.00 43.02 41.65 2dio s PHE 141 CO -0.01 -0.23 -0.24 0.71 -1.46 0.00 0.00 175.22 173.99 2dio s TYR 142 N 0.62 2.12 -0.27 10.12 1.51 -0.31 -0.58 117.35 130.56 2dio s TYR 142 Ca -0.12 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 55.56 2dio s TYR 142 Cb -0.14 -1.26 0.07 0.00 -0.11 0.00 0.00 41.96 40.52 2dio s TYR 142 CO 0.02 0.13 -0.01 0.99 -1.11 0.00 0.00 175.55 175.57 2dio s THR 143 N -0.83 1.63 -0.11 -0.71 2.01 -0.66 -1.46 115.64 115.51 2dio s THR 143 Ca 0.10 -1.52 -0.27 0.00 0.31 0.00 0.00 61.69 60.32 2dio s THR 143 Cb -0.10 -2.00 -0.02 0.00 0.01 0.00 0.00 72.50 70.39 2dio s THR 143 CO 0.02 -0.29 0.87 -0.36 -0.69 0.00 0.00 174.62 174.17 2dio s PHE 144 N 1.30 3.51 -1.12 4.92 0.40 0.82 -0.61 117.98 127.20 2dio s PHE 144 Ca -0.00 1.40 -0.10 0.00 -0.60 0.00 0.00 56.93 57.63 2dio s PHE 144 Cb -0.19 -3.03 0.27 0.00 0.51 0.00 0.00 43.02 40.58 2dio s PHE 144 CO -0.09 -0.14 1.13 0.71 0.70 0.00 0.00 175.22 177.53 2dio s TYR 145 N 1.69 4.21 -0.12 0.36 2.02 -0.45 -1.20 117.35 123.86 2dio s TYR 145 Ca 0.42 -2.64 -0.28 0.00 -0.37 0.00 0.00 57.07 54.21 2dio s TYR 145 Cb -0.18 -3.88 -0.01 0.00 -0.40 0.00 0.00 41.96 37.49 2dio s TYR 145 CO 0.17 -0.99 0.93 -0.51 -1.57 0.00 0.00 175.55 173.58 2dio s LEU 146 N -1.03 4.23 0.30 -1.29 1.43 -0.58 -4.06 118.68 117.68 2dio s LEU 146 Ca 0.31 1.40 0.11 0.00 -1.03 0.00 0.00 54.13 54.92 2dio s LEU 146 Cb -0.09 -3.42 -0.05 0.00 0.03 0.00 0.00 46.19 42.65 2dio s LEU 146 CO -0.07 -0.41 -0.11 -0.54 0.23 0.00 0.00 176.35 175.45 2dio s LYS 147 N 1.95 1.90 0.00 1.70 1.02 -0.25 -0.63 119.74 125.43 2dio s LYS 147 Ca 0.44 -1.72 0.00 0.00 0.02 0.00 0.00 55.97 54.72 2dio s LYS 147 Cb -0.18 -1.87 0.00 0.00 -0.52 0.00 0.00 37.83 35.26 2dio s LYS 147 CO 0.16 0.27 0.00 0.41 -0.92 0.00 0.00 175.35 175.28 2dio n GLY 148 N -0.76 0.95 3.79 -3.33 0.00 -1.26 -1.30 105.19 103.27 2dio n GLY 148 Ca -0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 2dio n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dio s LEU 149 N 0.00 4.08 0.33 0.99 1.02 -1.26 -4.44 118.68 119.41 2dio s LEU 149 Ca 0.00 2.00 0.11 0.00 0.02 0.00 0.00 54.13 56.26 2dio s LEU 149 Cb 0.00 -4.26 0.58 0.00 0.02 0.00 0.00 46.19 42.53 2dio s LEU 149 CO 0.00 -0.53 1.75 0.00 0.02 0.00 0.00 176.35 177.59 2dio h ALA 150 N 2.32 1.24 -2.49 4.21 0.00 -1.80 -3.47 119.26 119.27 2dio h ALA 150 Ca -0.48 -0.40 -0.20 0.00 0.00 0.00 0.00 54.91 53.82 2dio h ALA 150 Cb 1.21 -0.07 -0.15 0.00 0.00 0.00 0.00 17.79 18.78 2dio h ALA 150 CO 0.62 0.56 -0.63 -0.80 0.00 0.00 0.00 179.25 179.00 2dio s ASN 151 N -6.90 0.25 0.36 0.00 0.01 -1.26 -5.13 114.94 102.26 2dio s ASN 151 Ca -0.03 -1.26 -0.28 0.00 -0.71 0.00 0.00 52.86 50.57 2dio s ASN 151 Cb 0.14 0.33 -0.11 0.00 0.41 0.00 0.00 41.25 42.02 2dio s ASN 151 CO 0.74 -0.77 1.48 -1.81 -1.51 0.00 0.00 177.10 175.23 2dio s ASP 152 N -3.09 6.40 0.48 -1.22 1.01 -1.26 -4.97 116.67 114.03 2dio s ASP 152 Ca 0.29 2.99 -0.24 0.00 0.71 0.00 0.00 52.55 56.30 2dio s ASP 152 Cb 0.07 -2.66 -0.07 0.00 1.01 0.00 0.00 42.92 41.27 2dio s ASP 152 CO 0.05 -0.84 1.38 -0.76 0.21 0.00 0.00 175.17 175.22 2dio s LEU 153 N -1.81 4.02 0.50 1.23 1.43 -1.26 -4.96 118.68 117.83 2dio s LEU 153 Ca 0.54 2.82 -0.23 0.00 -1.03 0.00 0.00 54.13 56.22 2dio s LEU 153 Cb -0.46 -4.07 -0.07 0.00 0.03 0.00 0.00 46.19 41.62 2dio s LEU 153 CO 0.60 -1.30 1.38 -0.81 0.23 0.00 0.00 176.35 176.45 2dio n PRO 154 N -0.50 1.94 -0.01 1.29 -0.04 -1.26 -4.90 135.00 131.51 2dio n PRO 154 Ca 0.07 0.70 0.03 0.00 -0.04 0.00 0.00 63.50 64.26 2dio n PRO 154 Cb 0.43 -2.58 0.39 0.00 -0.04 0.00 0.00 33.50 31.70 2dio n PRO 154 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2dio h LEU 155 N 1.83 0.49 -1.01 1.53 3.38 -1.97 -1.57 115.31 117.98 2dio h LEU 155 Ca -0.51 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2dio h LEU 155 Cb 1.29 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2dio h LEU 155 CO 0.59 0.40 0.00 -1.84 0.09 0.00 0.00 178.44 177.67 2dio n GLU 156 N -4.43 0.17 0.00 1.13 0.28 -1.26 -1.72 120.64 114.80 2dio n GLU 156 Ca 0.03 0.52 0.10 0.00 -0.16 0.00 0.00 57.16 57.65 2dio n GLU 156 Cb 0.10 -1.90 -0.09 0.00 1.43 0.00 0.00 31.44 30.97 2dio n GLU 156 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2dio n LEU 157 N -2.23 1.11 -0.50 -1.84 4.77 -0.60 -4.56 117.00 113.16 2dio n LEU 157 Ca 0.00 -0.52 0.07 0.00 -0.03 0.00 0.00 56.01 55.54 2dio n LEU 157 Cb 0.14 -0.01 0.19 0.00 -2.33 0.00 0.00 43.42 41.41 2dio n LEU 157 CO 0.15 0.26 0.55 0.35 -1.33 0.00 0.00 177.39 177.37 2dio n THR 158 N -1.31 2.14 -1.65 -5.08 -2.24 -0.70 -4.61 114.28 100.82 2dio n THR 158 Ca 0.05 -2.55 -0.37 0.00 -2.27 0.00 0.00 64.05 58.91 2dio n THR 158 Cb 0.35 -0.25 0.07 0.00 -2.10 0.00 0.00 70.33 68.40 2dio n THR 158 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dio n GLY 159 N -1.16 0.37 3.65 3.38 0.00 -1.23 -4.83 105.19 105.36 2dio n GLY 159 Ca 0.20 -0.19 -0.52 0.00 0.00 0.00 0.00 46.02 45.51 2dio n GLY 159 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2dio n THR 160 N -2.05 0.40 -1.71 2.61 -1.04 -1.26 -4.27 114.28 106.96 2dio n THR 160 Ca 0.15 -0.12 -0.40 0.00 -2.04 0.00 0.00 64.05 61.64 2dio n THR 160 Cb 0.48 -1.59 0.02 0.00 -1.82 0.00 0.00 70.33 67.42 2dio n THR 160 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2dio n PRO 161 N 6.53 1.91 -1.86 -2.82 -0.02 -1.26 -4.18 135.00 133.30 2dio n PRO 161 Ca 0.28 0.68 -0.42 0.00 -2.02 0.00 0.00 63.50 62.02 2dio n PRO 161 Cb 0.22 -2.43 -0.03 0.00 -0.02 0.00 0.00 33.50 31.24 2dio n PRO 161 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2dio s VAL 162 N -1.22 2.47 0.27 -1.45 1.01 -0.49 -4.87 120.40 116.11 2dio s VAL 162 Ca 0.63 0.30 -0.31 0.00 0.00 0.00 0.00 61.98 62.60 2dio s VAL 162 Cb -0.49 -3.19 -0.12 0.00 0.00 0.00 0.00 36.38 32.59 2dio s VAL 162 CO 0.57 0.02 1.65 -2.84 0.00 0.00 0.00 175.10 174.49 2dio s PRO 163 N 1.36 4.12 0.18 2.72 0.02 -1.26 -4.89 135.00 137.24 2dio s PRO 163 Ca 0.72 2.60 -0.32 0.00 0.02 0.00 0.00 61.00 64.03 2dio s PRO 163 Cb -0.45 -3.04 -0.11 0.00 0.02 0.00 0.00 34.50 30.92 2dio s PRO 163 CO 0.32 -0.68 1.61 -1.25 -0.33 0.00 0.00 177.00 176.66 2dio s PRO 164 N 0.07 4.19 0.27 5.54 0.04 -1.26 -4.95 135.00 138.90 2dio s PRO 164 Ca 0.67 2.44 -0.13 0.00 0.04 0.00 0.00 61.00 64.02 2dio s PRO 164 Cb -0.49 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 30.93 2dio s PRO 164 CO 0.43 -0.64 0.53 -1.54 0.04 0.00 0.00 177.00 175.81 2dio s SER 165 N 1.11 -0.03 0.59 6.66 1.04 -1.26 -5.02 113.70 116.79 2dio s SER 165 Ca 0.71 -0.94 0.30 0.00 0.48 0.00 0.00 55.95 56.50 2dio s SER 165 Cb -0.45 0.63 1.77 0.00 0.10 0.00 0.00 66.02 68.06 2dio s SER 165 CO 0.32 -1.21 2.18 0.50 0.98 0.00 0.00 173.24 176.00 2dio h LYS 166 N 2.19 0.00 -0.00 4.02 3.64 -1.95 -3.00 116.57 121.46 2dio h LYS 166 Ca -0.25 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 2dio h LYS 166 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2dio h LYS 166 CO 0.34 0.00 -0.58 -0.25 -2.27 0.00 0.00 179.45 176.69 2dio n ASP 167 N -3.77 1.05 -4.73 4.20 8.00 -1.26 -4.88 116.55 115.16 2dio n ASP 167 Ca -0.01 -0.85 -0.38 0.00 0.71 0.00 0.00 54.79 54.26 2dio n ASP 167 Cb 0.21 0.48 0.05 0.00 -0.02 0.00 0.00 41.12 41.83 2dio n ASP 167 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2dio n ILE 168 N -1.02 3.92 -3.96 0.53 -6.64 -1.14 -5.04 119.36 106.01 2dio n ILE 168 Ca 0.07 -0.50 -0.11 0.00 -1.77 0.00 0.00 62.75 60.44 2dio n ILE 168 Cb 0.36 -1.62 -0.12 0.00 -1.44 0.00 0.00 39.64 36.82 2dio n ILE 168 CO 0.00 0.00 0.00 -1.61 -1.77 0.00 0.00 176.55 173.17 2dio s GLU 169 N -2.91 0.23 0.54 6.28 0.41 -1.26 -5.07 118.70 116.92 2dio s GLU 169 Ca 0.73 -0.38 -0.22 0.00 -0.41 0.00 0.00 54.97 54.69 2dio s GLU 169 Cb -0.42 -0.01 -0.05 0.00 -1.78 0.00 0.00 34.13 31.88 2dio s GLU 169 CO 0.48 -0.01 1.36 -0.35 -0.49 0.00 0.00 175.26 176.25 2dio n PRO 170 N 2.22 1.71 -1.56 0.39 -0.04 -1.26 -4.93 135.00 131.52 2dio n PRO 170 Ca -0.19 0.63 -0.48 0.00 -0.04 0.00 0.00 63.50 63.42 2dio n PRO 170 Cb 0.57 -2.58 -0.03 0.00 -0.04 0.00 0.00 33.50 31.42 2dio n PRO 170 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dio n ALA 171 N -1.01 -0.88 -0.30 0.55 0.00 -0.06 -4.75 120.51 114.06 2dio n ALA 171 Ca 0.10 0.45 0.16 0.00 0.00 0.00 0.00 53.44 54.15 2dio n ALA 171 Cb 0.44 -1.98 0.42 0.00 0.00 0.00 0.00 19.45 18.33 2dio n ALA 171 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2dio h PRO 172 N 2.81 0.58 -0.20 0.00 0.11 -1.91 -0.37 132.00 133.01 2dio h PRO 172 Ca -0.41 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 2dio h PRO 172 Cb 1.35 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2dio h PRO 172 CO 0.66 0.38 -0.05 0.93 -0.21 0.00 0.00 178.00 179.71 2dio h GLU 173 N 0.59 0.31 -0.14 1.05 5.08 -1.91 -1.43 114.58 118.13 2dio h GLU 173 Ca 0.53 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.80 2dio h GLU 173 Cb 1.04 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 2dio h GLU 173 CO -0.27 0.38 -0.04 0.00 -1.00 0.00 0.00 179.01 178.08 2dio h ALA 174 N 1.66 0.19 -0.47 3.43 0.00 -1.24 -1.26 119.26 121.57 2dio h ALA 174 Ca 0.07 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.77 2dio h ALA 174 Cb 0.29 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2dio h ALA 174 CO 0.01 -0.06 0.31 0.87 0.00 0.00 0.00 179.25 180.39 2dio h LYS 175 N -0.05 0.52 -0.02 0.00 1.57 -1.06 -1.84 116.57 115.69 2dio h LYS 175 Ca 0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2dio h LYS 175 Cb 0.47 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2dio h LYS 175 CO 0.01 0.34 0.00 0.00 -0.57 0.00 0.00 179.45 179.24 2dio n ALA 176 N -2.48 2.56 -2.40 3.86 0.00 -0.56 -4.94 120.51 116.56 2dio n ALA 176 Ca 0.05 -0.47 -0.20 0.00 0.00 0.00 0.00 53.44 52.82 2dio n ALA 176 Cb 0.14 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.46 2dio n ALA 176 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dio n LEU 177 N 0.30 -1.92 -4.78 0.00 4.77 -0.69 -4.98 117.00 109.69 2dio n LEU 177 Ca 0.18 -0.03 -0.34 0.00 -0.03 0.00 0.00 56.01 55.80 2dio n LEU 177 Cb 0.38 -2.79 0.02 0.00 -2.33 0.00 0.00 43.42 38.69 2dio n LEU 177 CO 0.16 -0.19 0.75 -1.61 -1.33 0.00 0.00 177.39 175.17 2dio s GLU 178 N -5.00 3.18 0.30 3.23 0.41 -0.52 -4.87 118.70 115.43 2dio s GLU 178 Ca 0.01 1.41 0.05 0.00 -0.41 0.00 0.00 54.97 56.03 2dio s GLU 178 Cb -0.00 -2.00 0.69 0.00 -1.78 0.00 0.00 34.13 31.04 2dio s GLU 178 CO 0.01 -0.95 1.81 -1.35 -0.49 0.00 0.00 175.26 174.29 2dio h PRO 179 N 0.62 0.81 0.00 0.39 0.11 -1.92 0.10 132.00 132.11 2dio h PRO 179 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2dio h PRO 179 Cb 1.24 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2dio h PRO 179 CO 0.56 0.53 0.00 0.66 -0.21 0.00 0.00 178.00 179.55 2dio h SER 180 N 0.83 0.00 -0.56 -2.05 4.64 -1.92 -3.09 113.55 111.41 2dio h SER 180 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 2dio h SER 180 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2dio h SER 180 CO -0.32 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.25 2dio n GLY 181 N 0.19 2.71 3.18 -0.77 0.00 -0.00 -4.87 105.19 105.63 2dio n GLY 181 Ca 0.01 -0.65 -0.18 0.00 0.00 0.00 0.00 46.02 45.21 2dio n GLY 181 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dio s VAL 182 N -1.19 1.13 0.57 1.61 -7.23 -1.04 -0.64 120.40 113.60 2dio s VAL 182 Ca 0.39 -1.43 -0.10 0.00 -1.81 0.00 0.00 61.98 59.03 2dio s VAL 182 Cb 0.22 -1.20 -0.04 0.00 0.56 0.00 0.00 36.38 35.91 2dio s VAL 182 CO 0.24 -0.31 0.96 0.27 -0.31 0.00 0.00 175.10 175.95 2dio s ILE 183 N -1.62 4.74 0.19 -0.62 -4.36 -0.79 -4.87 121.20 113.88 2dio s ILE 183 Ca 0.01 0.74 -0.32 0.00 -0.26 0.00 0.00 60.65 60.82 2dio s ILE 183 Cb -0.08 -3.85 -0.11 0.00 1.25 0.00 0.00 42.46 39.67 2dio s ILE 183 CO 0.02 -1.01 1.70 -0.44 0.24 0.00 0.00 174.94 175.46 2dio s SER 184 N -4.01 6.43 -1.46 4.36 0.01 -1.26 -2.23 113.70 115.54 2dio s SER 184 Ca 0.53 2.80 -0.11 0.00 1.31 0.00 0.00 55.95 60.48 2dio s SER 184 Cb -0.11 -2.59 0.05 0.00 0.21 0.00 0.00 66.02 63.58 2dio s SER 184 CO 0.49 -0.95 0.98 0.59 0.41 0.00 0.00 173.24 174.76 2dio n ASN 185 N 4.19 -5.45 -4.51 2.44 3.02 -1.26 -3.99 115.26 109.70 2dio n ASN 185 Ca 0.16 -0.62 -0.45 0.00 -0.03 0.00 0.00 54.58 53.64 2dio n ASN 185 Cb 0.36 -4.33 -0.02 0.00 -0.61 0.00 0.00 39.78 35.18 2dio n ASN 185 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dio n TYR 186 N -4.74 0.41 -2.40 3.10 0.18 -0.94 -4.12 117.16 108.65 2dio n TYR 186 Ca 0.01 0.77 -0.41 0.00 1.88 0.00 0.00 57.90 60.16 2dio n TYR 186 Cb 0.55 -2.11 -0.04 0.00 -0.38 0.00 0.00 39.34 37.36 2dio n TYR 186 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2dio s THR 187 N -1.11 3.51 0.00 -3.48 2.01 -1.01 -4.83 115.64 110.73 2dio s THR 187 Ca 0.61 1.37 0.00 0.00 0.31 0.00 0.00 61.69 63.98 2dio s THR 187 Cb -0.76 -3.87 0.00 0.00 0.01 0.00 0.00 72.50 67.88 2dio s THR 187 CO 0.58 0.26 0.00 -3.20 -0.69 0.00 0.00 174.62 171.58