#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 4.12 -0.23 -0.18 1.01 -1.26 -4.42 120.40 119.44 2dio s VAL 16 Ca 0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 2dio s VAL 16 Cb 0.00 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.58 2dio s VAL 16 CO 0.00 0.52 -0.02 -1.10 0.00 0.00 0.00 175.10 174.51 2dio s GLN 17 N -0.02 3.45 0.09 2.72 -0.21 -0.08 -4.92 119.66 120.69 2dio s GLN 17 Ca 0.02 -0.59 -0.29 0.00 0.02 0.00 0.00 55.36 54.52 2dio s GLN 17 Cb -0.13 -3.08 -0.06 0.00 1.00 0.00 0.00 33.01 30.74 2dio s GLN 17 CO 0.02 -0.19 0.94 -1.21 -2.12 0.00 0.00 175.29 172.73 2dio s GLU 18 N 1.49 4.66 -0.07 2.91 2.02 -1.26 -1.55 118.70 126.90 2dio s GLU 18 Ca 0.06 1.40 -0.01 0.00 0.02 0.00 0.00 54.97 56.44 2dio s GLU 18 Cb -0.14 -3.38 0.03 0.00 0.10 0.00 0.00 34.13 30.73 2dio s GLU 18 CO -0.01 0.20 -0.02 -1.17 0.02 0.00 0.00 175.26 174.27 2dio s LEU 19 N 0.07 0.84 0.03 1.80 2.96 -0.65 -4.97 118.68 118.76 2dio s LEU 19 Ca 0.46 -0.14 0.06 0.00 -0.22 0.00 0.00 54.13 54.30 2dio s LEU 19 Cb -0.23 -0.52 -0.03 0.00 0.50 0.00 0.00 46.19 45.91 2dio s LEU 19 CO 0.29 -0.15 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.58 2dio s SER 20 N 1.72 4.02 0.01 3.68 0.01 -1.26 0.15 113.70 122.03 2dio s SER 20 Ca 0.02 -0.36 -0.07 0.00 1.31 0.00 0.00 55.95 56.85 2dio s SER 20 Cb -0.13 -0.73 -0.00 0.00 0.21 0.00 0.00 66.02 65.37 2dio s SER 20 CO -0.05 0.26 0.13 0.68 0.41 0.00 0.00 173.24 174.67 2dio s VAL 21 N -0.95 0.09 -0.21 3.43 -7.23 -0.70 -1.50 120.40 113.33 2dio s VAL 21 Ca 0.15 -0.75 -0.07 0.00 -1.81 0.00 0.00 61.98 59.50 2dio s VAL 21 Cb -0.11 -0.51 -0.04 0.00 0.56 0.00 0.00 36.38 36.29 2dio s VAL 21 CO 0.06 -0.41 0.07 -0.31 -0.31 0.00 0.00 175.10 174.20 2dio s TYR 22 N -1.59 3.19 -0.27 2.82 2.02 0.01 -1.01 117.35 122.52 2dio s TYR 22 Ca -0.13 -0.07 -0.10 0.00 -0.37 0.00 0.00 57.07 56.40 2dio s TYR 22 Cb -0.07 -2.14 -0.04 0.00 -0.40 0.00 0.00 41.96 39.31 2dio s TYR 22 CO 0.01 -0.02 0.14 -2.00 -1.57 0.00 0.00 175.55 172.11 2dio s GLU 23 N 0.82 3.84 -0.10 -0.62 2.12 -0.31 -0.37 118.70 124.07 2dio s GLU 23 Ca 0.04 -0.38 0.02 0.00 0.36 0.00 0.00 54.97 55.00 2dio s GLU 23 Cb -0.14 -3.53 0.02 0.00 0.26 0.00 0.00 34.13 30.74 2dio s GLU 23 CO 0.02 -0.18 -0.13 0.42 -0.54 0.00 0.00 175.26 174.85 2dio s ILE 24 N 1.69 1.35 -0.66 -3.70 1.01 -0.11 -0.23 121.20 120.57 2dio s ILE 24 Ca 0.07 -0.56 -0.25 0.00 0.00 0.00 0.00 60.65 59.91 2dio s ILE 24 Cb -0.16 -1.25 0.04 0.00 0.01 0.00 0.00 42.46 41.11 2dio s ILE 24 CO 0.08 0.41 1.11 0.21 0.00 0.00 0.00 174.94 176.75 2dio s ASN 25 N 1.00 6.24 -0.02 3.58 3.84 0.36 -1.45 114.94 128.50 2dio s ASN 25 Ca -0.07 -0.49 0.11 0.00 0.21 0.00 0.00 52.86 52.62 2dio s ASN 25 Cb -0.15 -2.50 0.35 0.00 -0.55 0.00 0.00 41.25 38.40 2dio s ASN 25 CO -0.01 -1.56 1.26 -0.62 -2.79 0.00 0.00 177.10 173.38 2dio n GLU 26 N 8.40 2.06 -1.28 0.43 1.02 -1.26 -4.90 120.64 125.11 2dio n GLU 26 Ca 0.02 -1.40 -0.10 0.00 -0.02 0.00 0.00 57.16 55.66 2dio n GLU 26 Cb 0.48 -1.39 -0.04 0.00 -0.02 0.00 0.00 31.44 30.47 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 0.56 -0.46 -0.25 -4.62 4.77 -1.26 -4.85 117.00 110.88 2dio n LEU 27 Ca 0.13 0.24 0.06 0.00 -0.03 0.00 0.00 56.01 56.41 2dio n LEU 27 Cb 0.39 -2.04 0.12 0.00 -2.33 0.00 0.00 43.42 39.55 2dio n LEU 27 CO 0.10 -0.73 0.58 -0.90 -1.33 0.00 0.00 177.39 175.11 2dio n ASP 28 N -0.45 2.57 -0.11 -1.43 5.75 -1.26 -4.58 116.55 117.05 2dio n ASP 28 Ca -0.10 -2.63 0.08 0.00 -0.01 0.00 0.00 54.79 52.13 2dio n ASP 28 Cb 0.43 -0.30 0.11 0.00 -1.03 0.00 0.00 41.12 40.32 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 -0.79 1.31 -1.81 0.11 1.74 -1.26 -4.98 116.66 110.98 2dio n ARG 29 Ca 0.12 -2.25 -0.20 0.00 -0.77 0.00 0.00 57.85 54.75 2dio n ARG 29 Cb 0.54 -1.32 -0.06 0.00 -1.02 0.00 0.00 32.46 30.61 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 -1.15 -0.28 -4.92 -1.55 8.25 -1.26 -4.86 115.22 109.45 2dio n HIS 30 Ca 0.12 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.28 2dio n HIS 30 Cb 0.60 -3.49 -0.15 0.00 1.12 0.00 0.00 29.99 28.08 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 -2.59 3.16 0.64 0.41 0.15 -1.26 -4.09 113.70 110.12 2dio s SER 31 Ca 0.00 -0.59 -0.12 0.00 0.70 0.00 0.00 55.95 55.95 2dio s SER 31 Cb 0.00 -0.29 -0.03 0.00 -1.71 0.00 0.00 66.02 63.99 2dio s SER 31 CO 0.00 0.26 1.04 -2.16 1.20 0.00 0.00 173.24 173.58 2dio s PRO 32 N -1.22 3.39 -0.27 5.44 0.04 -1.26 -4.79 135.00 136.33 2dio s PRO 32 Ca 0.12 0.85 -0.05 0.00 0.04 0.00 0.00 61.00 61.95 2dio s PRO 32 Cb -0.10 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.39 2dio s PRO 32 CO 0.02 -0.73 0.03 0.21 0.04 0.00 0.00 177.00 176.57 2dio s LYS 33 N -5.01 3.17 -0.26 4.56 2.47 -0.75 -5.06 119.74 118.87 2dio s LYS 33 Ca 0.57 -0.79 -0.13 0.00 -1.56 0.00 0.00 55.97 54.06 2dio s LYS 33 Cb -0.12 -3.22 -0.04 0.00 -1.46 0.00 0.00 37.83 32.98 2dio s LYS 33 CO 0.52 -0.36 0.30 0.42 0.16 0.00 0.00 175.35 176.40 2dio s ILE 34 N 1.48 5.24 -0.49 5.43 1.01 -1.26 -3.39 121.20 129.22 2dio s ILE 34 Ca 0.03 0.44 -0.13 0.00 0.00 0.00 0.00 60.65 60.98 2dio s ILE 34 Cb -0.16 -3.63 0.11 0.00 0.01 0.00 0.00 42.46 38.78 2dio s ILE 34 CO 0.00 0.22 0.40 -0.76 0.00 0.00 0.00 174.94 174.80 2dio s LEU 35 N 1.76 5.78 -0.28 2.97 1.43 -0.18 -5.01 118.68 125.14 2dio s LEU 35 Ca 0.12 -1.65 -0.20 0.00 -1.03 0.00 0.00 54.13 51.37 2dio s LEU 35 Cb -0.15 -2.12 -0.01 0.00 0.03 0.00 0.00 46.19 43.93 2dio s LEU 35 CO 0.09 -0.72 0.64 -0.75 0.23 0.00 0.00 176.35 175.84 2dio s LYS 36 N 1.53 3.99 0.00 1.70 2.47 -1.26 -1.53 119.74 126.65 2dio s LYS 36 Ca 0.04 0.42 0.00 0.00 -1.56 0.00 0.00 55.97 54.87 2dio s LYS 36 Cb -0.27 -3.69 0.00 0.00 -1.46 0.00 0.00 37.83 32.41 2dio s LYS 36 CO 0.03 -0.51 0.00 0.09 0.16 0.00 0.00 175.35 175.12 2dio n ASN 37 N 5.82 2.38 -4.77 1.43 3.02 -1.26 -4.98 115.26 116.90 2dio n ASN 37 Ca -0.01 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.15 2dio n ASN 37 Cb 0.49 0.41 -0.02 0.00 -0.61 0.00 0.00 39.78 40.05 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 -1.10 3.35 -1.41 5.41 0.00 -1.26 -4.89 121.76 121.87 2dio s ALA 38 Ca 0.00 1.14 -0.11 0.00 0.00 0.00 0.00 51.96 52.99 2dio s ALA 38 Cb 0.00 -3.44 0.08 0.00 0.00 0.00 0.00 23.12 19.76 2dio s ALA 38 CO 0.00 -0.60 2.19 1.19 0.00 0.00 0.00 175.76 178.55 2dio n PHE 39 N 0.52 3.16 -3.63 0.00 0.99 -1.26 -4.81 117.46 112.43 2dio n PHE 39 Ca 0.02 -2.92 -0.15 0.00 -0.00 0.00 0.00 57.45 54.40 2dio n PHE 39 Cb 0.44 -2.30 -0.07 0.00 -1.00 0.00 0.00 39.48 36.54 2dio n PHE 39 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2dio s SER 40 N 2.12 -0.59 0.00 4.37 0.15 -1.26 -5.12 113.70 113.37 2dio s SER 40 Ca 0.47 0.91 0.00 0.00 0.70 0.00 0.00 55.95 58.03 2dio s SER 40 Cb 0.13 0.89 0.00 0.00 -1.71 0.00 0.00 66.02 65.33 2dio s SER 40 CO -0.06 -0.38 0.49 0.18 1.20 0.00 0.00 173.24 174.68 2dio n LEU 41 N 1.94 1.45 -4.80 3.45 4.77 -1.26 -4.91 117.00 117.64 2dio n LEU 41 Ca -0.17 -0.73 -0.37 0.00 -0.03 0.00 0.00 56.01 54.72 2dio n LEU 41 Cb 0.56 -0.25 -0.06 0.00 -2.33 0.00 0.00 43.42 41.34 2dio n LEU 41 CO 0.14 0.25 0.52 -0.36 -1.33 0.00 0.00 177.39 176.61 2dio s PHE 43 N 0.39 3.70 0.30 -1.77 0.08 -1.26 -5.20 117.98 114.23 2dio s PHE 43 Ca 0.00 1.58 -0.13 0.00 0.12 0.00 0.00 56.93 58.50 2dio s PHE 43 Cb 0.00 -2.76 0.01 0.00 -0.57 0.00 0.00 43.02 39.70 2dio s PHE 43 CO 0.00 0.31 0.59 0.20 -0.10 0.00 0.00 175.22 176.23 2dio s GLY 44 N -1.57 0.56 0.17 4.36 0.00 -1.26 -3.75 107.32 105.84 2dio s GLY 44 Ca 0.45 -0.86 -0.34 0.00 0.00 0.00 0.00 44.72 43.97 2dio s GLY 44 CO 0.23 -0.53 1.55 -0.10 0.00 0.00 0.00 173.10 174.25 2dio n LEU 45 N -0.47 3.07 0.00 0.66 7.94 -1.26 -1.65 117.00 125.30 2dio n LEU 45 Ca -0.03 1.09 0.00 0.00 -1.11 0.00 0.00 56.01 55.96 2dio n LEU 45 Cb 0.61 -1.42 0.00 0.00 0.53 0.00 0.00 43.42 43.14 2dio n LEU 45 CO 0.23 -0.33 0.00 0.61 -1.11 0.00 0.00 177.39 176.79 2dio n GLY 46 N 3.22 0.63 3.73 -3.96 0.00 -1.26 -4.04 105.19 103.51 2dio n GLY 46 Ca 0.16 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.83 7.43 -0.03 1.61 1.01 -0.66 -4.13 116.67 121.08 2dio s ASP 47 Ca 0.00 1.81 0.06 0.00 0.71 0.00 0.00 52.55 55.13 2dio s ASP 47 Cb 0.00 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 2dio s ASP 47 CO 0.00 -0.14 -0.21 -0.76 0.21 0.00 0.00 175.17 174.27 2dio s LEU 48 N 0.20 2.01 -0.46 1.23 1.43 -0.58 -1.58 118.68 120.94 2dio s LEU 48 Ca 0.49 -0.41 0.03 0.00 -1.03 0.00 0.00 54.13 53.21 2dio s LEU 48 Cb -0.24 -1.13 0.15 0.00 0.03 0.00 0.00 46.19 45.00 2dio s LEU 48 CO 0.30 0.23 0.29 -0.69 0.23 0.00 0.00 176.35 176.71 2dio s VAL 49 N -0.29 1.25 0.40 -1.59 1.01 0.14 -1.01 120.40 120.31 2dio s VAL 49 Ca 0.03 -2.70 -0.27 0.00 0.00 0.00 0.00 61.98 59.04 2dio s VAL 49 Cb -0.10 -1.86 -0.09 0.00 0.00 0.00 0.00 36.38 34.32 2dio s VAL 49 CO 0.01 -0.99 1.39 -2.84 0.00 0.00 0.00 175.10 172.67 2dio s PRO 50 N 0.15 4.00 0.12 2.72 0.02 -1.22 -0.71 135.00 140.08 2dio s PRO 50 Ca 0.21 2.35 -0.13 0.00 0.02 0.00 0.00 61.00 63.46 2dio s PRO 50 Cb -0.16 -2.84 0.02 0.00 0.02 0.00 0.00 34.50 31.53 2dio s PRO 50 CO -0.06 -0.54 0.34 -0.59 -0.33 0.00 0.00 177.00 175.82 2dio s PHE 51 N -1.18 -0.03 -0.28 6.54 -0.12 -0.56 -1.80 117.98 120.55 2dio s PHE 51 Ca 0.55 -0.33 -0.09 0.00 -0.05 0.00 0.00 56.93 57.01 2dio s PHE 51 Cb -0.42 0.14 0.12 0.00 -0.63 0.00 0.00 43.02 42.23 2dio s PHE 51 CO 0.56 -0.68 0.60 -0.08 -0.05 0.00 0.00 175.22 175.57 2dio s THR 52 N -3.84 -0.92 0.40 -4.49 -1.32 -1.26 -1.80 115.64 102.40 2dio s THR 52 Ca 0.06 0.04 0.07 0.00 -1.21 0.00 0.00 61.69 60.65 2dio s THR 52 Cb 0.03 -0.93 -0.07 0.00 -1.51 0.00 0.00 72.50 70.02 2dio s THR 52 CO -0.10 0.02 0.04 0.20 -2.21 0.00 0.00 174.62 172.57 2dio s ASN 53 N 2.84 4.00 0.45 8.08 0.01 -1.13 -4.73 114.94 124.46 2dio s ASN 53 Ca -0.05 -1.28 -0.19 0.00 -0.71 0.00 0.00 52.86 50.63 2dio s ASN 53 Cb -0.12 -0.42 -0.10 0.00 0.41 0.00 0.00 41.25 41.02 2dio s ASN 53 CO -0.18 -0.44 0.95 -0.54 -1.51 0.00 0.00 177.10 175.38 2dio s LYS 54 N -3.74 4.12 -0.07 -0.60 1.02 -0.53 -0.98 119.74 118.96 2dio s LYS 54 Ca 0.36 1.04 0.04 0.00 0.02 0.00 0.00 55.97 57.43 2dio s LYS 54 Cb 0.08 -2.18 0.00 0.00 -0.52 0.00 0.00 37.83 35.21 2dio s LYS 54 CO 0.19 -0.10 -0.18 -1.17 -0.92 0.00 0.00 175.35 173.17 2dio s LEU 55 N -3.47 1.88 0.19 3.17 2.96 -0.22 -0.93 118.68 122.27 2dio s LEU 55 Ca 0.61 -0.40 0.10 0.00 -0.22 0.00 0.00 54.13 54.22 2dio s LEU 55 Cb -0.09 -1.06 -0.04 0.00 0.50 0.00 0.00 46.19 45.49 2dio s LEU 55 CO 0.19 0.12 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.82 2dio s TYR 56 N 0.32 2.09 0.77 5.38 2.02 0.50 -1.17 117.35 127.26 2dio s TYR 56 Ca -0.12 -0.41 -0.14 0.00 -0.37 0.00 0.00 57.07 56.03 2dio s TYR 56 Cb -0.15 -1.01 0.05 0.00 -0.40 0.00 0.00 41.96 40.44 2dio s TYR 56 CO 0.05 0.46 1.09 0.25 -1.57 0.00 0.00 175.55 175.82 2dio n THR 57 N 0.14 2.41 -0.15 -0.71 -2.24 0.10 -0.81 114.28 113.02 2dio n THR 57 Ca -0.12 -0.28 0.16 0.00 -2.27 0.00 0.00 64.05 61.54 2dio n THR 57 Cb 0.57 -1.16 0.53 0.00 -2.10 0.00 0.00 70.33 68.18 2dio n THR 57 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2dio h GLY 58 N -0.61 0.61 0.16 3.38 0.00 -1.55 -0.29 103.07 104.77 2dio h GLY 58 Ca -0.47 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.71 2dio h GLY 58 CO 0.46 0.05 0.00 2.09 0.00 0.00 0.00 176.54 179.14 2dio n ASP 59 N -4.46 0.77 0.00 0.19 5.68 -1.26 -1.37 116.55 116.09 2dio n ASP 59 Ca 0.14 -1.34 0.00 0.00 -0.50 0.00 0.00 54.79 53.09 2dio n ASP 59 Cb 0.55 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 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 -0.37 0.69 0.10 -2.12 4.77 -0.12 -4.64 117.00 115.31 2dio n LEU 60 Ca 0.20 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.15 2dio n LEU 60 Cb 0.22 -1.76 -0.05 0.00 -2.33 0.00 0.00 43.42 39.50 2dio n LEU 60 CO 0.16 -0.64 0.31 0.11 -1.33 0.00 0.00 177.39 175.99 2dio h LYS 61 N 0.40 0.00 -4.12 3.23 1.57 -1.92 0.76 116.57 116.48 2dio h LYS 61 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.45 2dio h LYS 61 Cb 0.60 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 32.61 2dio h LYS 61 CO 0.00 0.74 -0.75 0.15 -0.57 0.00 0.00 179.45 179.02 2dio s LYS 62 N -2.84 0.40 -0.09 3.15 1.02 -1.26 -4.22 119.74 115.90 2dio s LYS 62 Ca 0.02 -0.12 -0.30 0.00 0.02 0.00 0.00 55.97 55.60 2dio s LYS 62 Cb 0.09 -0.42 -0.03 0.00 -0.52 0.00 0.00 37.83 36.95 2dio s LYS 62 CO 0.78 0.04 1.23 0.50 -0.92 0.00 0.00 175.35 176.99 2dio s ARG 63 N 0.18 4.31 -0.21 1.68 6.06 0.30 -0.72 118.95 130.55 2dio s ARG 63 Ca -0.02 1.68 0.15 0.00 -2.50 0.00 0.00 55.73 55.05 2dio s ARG 63 Cb -0.05 -3.63 -0.24 0.00 0.06 0.00 0.00 34.95 31.09 2dio s ARG 63 CO -0.00 -0.54 0.03 1.33 -2.50 0.00 0.00 175.30 173.61 2dio n VAL 64 N 4.88 1.41 0.00 7.11 0.24 -0.32 -1.66 118.33 129.99 2dio n VAL 64 Ca 0.12 -0.81 0.00 0.00 -2.04 0.00 0.00 64.34 61.61 2dio n VAL 64 Cb 0.46 -0.61 0.00 0.00 -1.47 0.00 0.00 33.84 32.21 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 1.83 -0.59 3.24 7.63 0.00 -1.07 -1.96 105.19 114.26 2dio n GLY 65 Ca -0.35 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.47 0.11 0.26 -0.61 -4.36 -1.18 -1.05 121.20 111.91 2dio s ILE 66 Ca 0.00 -1.40 -0.03 0.00 -0.26 0.00 0.00 60.65 58.96 2dio s ILE 66 Cb 0.00 -1.63 -0.05 0.00 1.25 0.00 0.00 42.46 42.03 2dio s ILE 66 CO 0.00 -0.52 0.50 0.42 0.24 0.00 0.00 174.94 175.58 2dio s THR 67 N -3.93 5.09 -0.27 8.37 -4.23 -0.16 -0.13 115.64 120.39 2dio s THR 67 Ca 0.12 -0.13 -0.11 0.00 -1.18 0.00 0.00 61.69 60.39 2dio s THR 67 Cb 0.05 -3.74 0.10 0.00 1.34 0.00 0.00 72.50 70.25 2dio s THR 67 CO -0.05 -0.29 0.60 0.00 -0.54 0.00 0.00 174.62 174.34 2dio s ALA 68 N -2.03 -1.77 0.00 3.99 0.00 -0.57 -2.83 121.76 118.54 2dio s ALA 68 Ca 0.42 2.16 0.00 0.00 0.00 0.00 0.00 51.96 54.54 2dio s ALA 68 Cb -0.11 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.47 2dio s ALA 68 CO 0.30 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 175.77 2dio n GLY 69 N 5.05 -0.66 2.80 0.00 0.00 -0.75 -1.28 105.19 110.35 2dio n GLY 69 Ca -0.14 -0.39 -0.17 0.00 0.00 0.00 0.00 46.02 45.31 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 1.02 -0.19 0.99 2.96 -0.19 -1.49 118.68 121.77 2dio s LEU 70 Ca 0.00 -0.01 -0.08 0.00 -0.22 0.00 0.00 54.13 53.81 2dio s LEU 70 Cb 0.00 -0.21 -0.04 0.00 0.50 0.00 0.00 46.19 46.43 2dio s LEU 70 CO 0.00 -0.12 0.09 0.00 -1.32 0.00 0.00 176.35 175.00 2dio s VAL 72 N 0.41 4.09 0.20 0.00 1.01 -0.06 0.28 120.40 126.34 2dio s VAL 72 Ca 0.05 -0.49 -0.31 0.00 0.00 0.00 0.00 61.98 61.24 2dio s VAL 72 Cb -0.12 -3.03 -0.10 0.00 0.00 0.00 0.00 36.38 33.14 2dio s VAL 72 CO -0.00 0.18 1.44 -0.69 0.00 0.00 0.00 175.10 176.04 2dio s VAL 73 N 1.55 2.82 -0.25 2.92 1.01 -0.61 -0.72 120.40 127.11 2dio s VAL 73 Ca 0.04 0.64 -0.09 0.00 0.00 0.00 0.00 61.98 62.58 2dio s VAL 73 Cb -0.16 -3.41 -0.12 0.00 0.00 0.00 0.00 36.38 32.68 2dio s VAL 73 CO 0.03 0.08 -0.30 -0.38 0.00 0.00 0.00 175.10 174.53 2dio n ILE 74 N 2.98 1.40 -3.56 2.22 2.08 -0.15 -4.14 119.36 120.19 2dio n ILE 74 Ca 0.09 -0.40 -0.12 0.00 0.56 0.00 0.00 62.75 62.88 2dio n ILE 74 Cb 0.40 -1.72 -0.05 0.00 -0.75 0.00 0.00 39.64 37.53 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 -2.47 0.71 0.35 0.38 -1.05 -1.14 -4.07 118.70 111.40 2dio s GLU 75 Ca -0.35 0.13 -0.25 0.00 -0.15 0.00 0.00 54.97 54.35 2dio s GLU 75 Cb 0.12 0.33 -0.10 0.00 -0.44 0.00 0.00 34.13 34.05 2dio s GLU 75 CO 0.48 -0.23 0.95 -1.58 0.95 0.00 0.00 175.26 175.83 2dio s HIS 76 N -1.32 3.60 -0.61 4.83 5.65 -1.25 -1.43 115.29 124.78 2dio s HIS 76 Ca -0.03 1.74 0.04 0.00 0.25 0.00 0.00 55.06 57.07 2dio s HIS 76 Cb -0.00 -2.92 0.15 0.00 -1.18 0.00 0.00 32.58 28.63 2dio s HIS 76 CO 0.02 0.11 0.38 0.08 -0.65 0.00 0.00 174.74 174.68 2dio s VAL 77 N -1.72 2.60 0.44 0.89 1.01 0.42 -4.92 120.40 119.12 2dio s VAL 77 Ca 0.53 -3.75 0.13 0.00 0.00 0.00 0.00 61.98 58.89 2dio s VAL 77 Cb -0.17 -2.75 0.20 0.00 0.00 0.00 0.00 36.38 33.66 2dio s VAL 77 CO 0.22 -0.92 2.01 1.55 0.00 0.00 0.00 175.10 177.95 2dio h PRO 78 N 5.92 0.11 0.00 2.72 0.13 -1.96 -1.03 132.00 137.88 2dio h PRO 78 Ca 0.05 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2dio h PRO 78 Cb 0.82 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2dio h PRO 78 CO 0.68 0.21 0.00 1.05 -0.23 0.00 0.00 178.00 179.71 2dio h GLU 79 N 0.10 0.00 -0.02 0.86 9.09 -1.94 -2.15 114.58 120.53 2dio h GLU 79 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.43 2dio h GLU 79 Cb 0.24 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.34 2dio h GLU 79 CO 0.01 0.00 -0.11 1.63 0.05 0.00 0.00 179.01 180.59 2dio n LYS 80 N -2.83 1.37 -3.73 1.06 4.76 -0.84 -5.00 118.16 112.94 2dio n LYS 80 Ca 0.00 -1.17 -0.24 0.00 -2.87 0.00 0.00 58.31 54.03 2dio n LYS 80 Cb 0.24 -1.27 0.04 0.00 -1.84 0.00 0.00 35.03 32.20 2dio n LYS 80 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2dio n LYS 81 N 0.49 -5.72 -0.91 1.97 3.00 -0.45 -4.84 118.16 111.71 2dio n LYS 81 Ca 0.08 0.66 0.00 0.00 -0.00 0.00 0.00 58.31 59.05 2dio n LYS 81 Cb 0.35 -5.45 0.00 0.00 0.00 0.00 0.00 35.03 29.93 2dio n LYS 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2dio n GLY 82 N -1.63 2.07 3.34 3.14 0.00 -1.06 -4.89 105.19 106.16 2dio n GLY 82 Ca -0.14 -0.98 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 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 -1.68 1.27 -0.23 1.61 0.41 -1.26 -0.44 118.70 118.39 2dio s GLU 83 Ca 0.00 -1.29 -0.07 0.00 -0.41 0.00 0.00 54.97 53.20 2dio s GLU 83 Cb 0.00 -1.59 -0.03 0.00 -1.78 0.00 0.00 34.13 30.73 2dio s GLU 83 CO 0.00 0.36 0.05 0.50 -0.49 0.00 0.00 175.26 175.68 2dio s ARG 84 N -2.15 3.69 0.16 1.61 3.52 -0.51 -1.61 118.95 123.67 2dio s ARG 84 Ca 0.11 -0.47 0.07 0.00 -0.13 0.00 0.00 55.73 55.31 2dio s ARG 84 Cb -0.09 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 30.02 2dio s ARG 84 CO 0.06 -0.07 0.02 -0.06 -0.81 0.00 0.00 175.30 174.44 2dio s PHE 85 N 1.26 2.91 -0.24 5.12 0.08 0.31 -0.98 117.98 126.43 2dio s PHE 85 Ca 0.04 -0.11 -0.06 0.00 0.12 0.00 0.00 56.93 56.92 2dio s PHE 85 Cb -0.15 -1.42 -0.02 0.00 -0.57 0.00 0.00 43.02 40.87 2dio s PHE 85 CO 0.03 0.51 0.04 -2.00 -0.10 0.00 0.00 175.22 173.70 2dio s GLU 86 N -2.88 3.56 -0.07 0.44 2.56 0.10 -1.42 118.70 120.99 2dio s GLU 86 Ca 0.28 -0.53 0.02 0.00 0.00 0.00 0.00 54.97 54.74 2dio s GLU 86 Cb -0.10 -3.25 -0.02 0.00 2.00 0.00 0.00 34.13 32.76 2dio s GLU 86 CO 0.19 -0.20 -0.14 0.00 -0.56 0.00 0.00 175.26 174.55 2dio s ALA 87 N 1.58 2.65 -0.17 6.30 0.00 -0.03 -0.88 121.76 131.21 2dio s ALA 87 Ca 0.06 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 51.05 2dio s ALA 87 Cb -0.15 -1.05 0.05 0.00 0.00 0.00 0.00 23.12 21.97 2dio s ALA 87 CO 0.02 0.46 0.00 0.99 0.00 0.00 0.00 175.76 177.23 2dio s THR 88 N -0.39 0.71 0.22 0.00 2.01 -0.59 -2.00 115.64 115.59 2dio s THR 88 Ca 0.04 -0.49 -0.23 0.00 0.31 0.00 0.00 61.69 61.33 2dio s THR 88 Cb -0.12 -1.05 0.05 0.00 0.01 0.00 0.00 72.50 71.38 2dio s THR 88 CO 0.02 -0.03 0.87 -0.72 -0.69 0.00 0.00 174.62 174.08 2dio s TYR 89 N 1.79 -0.11 0.20 4.92 1.13 -1.11 -1.03 117.35 123.15 2dio s TYR 89 Ca 0.00 -0.29 0.08 0.00 -1.41 0.00 0.00 57.07 55.45 2dio s TYR 89 Cb -0.16 0.69 -0.05 0.00 -1.10 0.00 0.00 41.96 41.34 2dio s TYR 89 CO -0.07 -1.04 -0.16 -1.12 -2.51 0.00 0.00 175.55 170.65 2dio s SER 90 N -2.99 2.67 -0.17 -0.18 0.01 -0.40 -1.25 113.70 111.39 2dio s SER 90 Ca 0.13 -0.99 0.01 0.00 1.31 0.00 0.00 55.95 56.41 2dio s SER 90 Cb -0.03 -0.15 0.01 0.00 0.21 0.00 0.00 66.02 66.05 2dio s SER 90 CO 0.05 -0.13 -0.18 -0.36 0.41 0.00 0.00 173.24 173.04 2dio s PHE 91 N -2.73 2.77 -0.16 2.43 0.08 0.27 -1.51 117.98 119.11 2dio s PHE 91 Ca 0.21 -1.35 -0.06 0.00 0.12 0.00 0.00 56.93 55.85 2dio s PHE 91 Cb -0.02 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.49 2dio s PHE 91 CO 0.07 -0.65 0.05 0.71 -0.10 0.00 0.00 175.22 175.30 2dio s TYR 92 N 1.07 3.24 -0.42 0.36 2.02 0.82 -1.52 117.35 122.92 2dio s TYR 92 Ca -0.01 0.09 0.06 0.00 -0.37 0.00 0.00 57.07 56.83 2dio s TYR 92 Cb -0.14 -2.02 0.42 0.00 -0.40 0.00 0.00 41.96 39.83 2dio s TYR 92 CO -0.06 0.22 1.11 1.19 -1.57 0.00 0.00 175.55 176.45 2dio n PHE 93 N 3.23 3.30 0.00 2.71 3.72 -0.16 -3.09 117.46 127.17 2dio n PHE 93 Ca -0.17 -3.03 0.00 0.00 -0.05 0.00 0.00 57.45 54.20 2dio n PHE 93 Cb 0.53 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 38.95 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 -0.49 3.47 0.18 1.37 0.00 -0.83 -0.92 105.19 107.97 2dio n GLY 94 Ca 0.39 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.50 2dio n GLY 94 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dio h ASP 95 N 0.00 0.00 1.20 1.61 3.32 -1.60 -3.25 116.42 117.69 2dio h ASP 95 Ca 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 2dio h ASP 95 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2dio h ASP 95 CO 0.00 0.00 -0.59 1.88 -1.72 0.00 0.00 179.24 178.81 2dio h TYR 96 N 0.00 0.00 0.00 4.55 0.05 -1.34 -3.47 116.97 116.76 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 0.37 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.11 2dio h TYR 96 CO 0.00 0.59 0.00 0.41 -1.05 0.00 0.00 178.16 178.11 2dio n GLY 97 N 0.97 0.47 3.37 3.88 0.00 -1.23 -0.75 105.19 111.90 2dio n GLY 97 Ca 0.01 -2.00 -0.10 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.07 -0.05 0.01 1.61 -3.43 -0.85 -0.99 115.29 110.52 2dio s HIS 98 Ca 0.00 -0.29 0.07 0.00 -0.80 0.00 0.00 55.06 54.03 2dio s HIS 98 Cb 0.00 0.22 -0.03 0.00 -1.43 0.00 0.00 32.58 31.34 2dio s HIS 98 CO 0.00 -0.75 -0.19 -0.51 -2.00 0.00 0.00 174.74 171.29 2dio s LEU 99 N -2.86 2.51 0.10 5.38 1.43 -0.58 -0.87 118.68 123.80 2dio s LEU 99 Ca 0.07 -0.40 0.10 0.00 -1.03 0.00 0.00 54.13 52.87 2dio s LEU 99 Cb 0.02 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 2dio s LEU 99 CO -0.07 0.29 -0.25 -0.44 0.23 0.00 0.00 176.35 176.10 2dio s SER 100 N -1.14 3.41 0.07 2.29 0.01 0.44 -0.57 113.70 118.20 2dio s SER 100 Ca 0.13 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.74 2dio s SER 100 Cb -0.10 -0.32 -0.04 0.00 0.21 0.00 0.00 66.02 65.77 2dio s SER 100 CO 0.03 0.21 -0.04 0.68 0.41 0.00 0.00 173.24 174.52 2dio s VAL 101 N -0.99 0.39 -0.10 3.43 -7.23 -0.38 -1.02 120.40 114.49 2dio s VAL 101 Ca 0.14 -1.83 -0.06 0.00 -1.81 0.00 0.00 61.98 58.42 2dio s VAL 101 Cb -0.10 -1.54 0.04 0.00 0.56 0.00 0.00 36.38 35.34 2dio s VAL 101 CO 0.05 -0.94 0.25 -1.58 -0.31 0.00 0.00 175.10 172.57 2dio s GLN 102 N -3.82 0.22 0.00 4.82 0.74 -0.63 -2.75 119.66 118.25 2dio s GLN 102 Ca 0.08 0.49 0.00 0.00 0.05 0.00 0.00 55.36 55.98 2dio s GLN 102 Cb 0.07 -0.06 0.00 0.00 1.10 0.00 0.00 33.01 34.11 2dio s GLN 102 CO -0.08 -0.13 0.00 0.41 -0.55 0.00 0.00 175.29 174.94 2dio n GLY 103 N 3.94 -0.21 3.74 2.59 0.00 -0.85 -0.92 105.19 113.48 2dio n GLY 103 Ca -0.22 -1.37 -0.40 0.00 0.00 0.00 0.00 46.02 44.02 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 4.53 -0.26 1.61 0.04 -1.26 -0.85 135.00 136.80 2dio s PRO 104 Ca 0.00 1.14 0.02 0.00 0.04 0.00 0.00 61.00 62.20 2dio s PRO 104 Cb 0.00 -3.38 0.06 0.00 0.04 0.00 0.00 34.50 31.21 2dio s PRO 104 CO 0.00 0.21 -0.09 -0.47 0.04 0.00 0.00 177.00 176.69 2dio s TYR 105 N 0.16 3.24 -0.22 0.56 5.04 -0.51 -4.68 117.35 120.93 2dio s TYR 105 Ca 0.41 -2.20 -0.06 0.00 -2.44 0.00 0.00 57.07 52.78 2dio s TYR 105 Cb -0.21 -1.96 -0.03 0.00 0.35 0.00 0.00 41.96 40.11 2dio s TYR 105 CO 0.24 -0.86 0.03 -0.51 -1.34 0.00 0.00 175.55 173.11 2dio s LEU 106 N 1.14 3.35 0.34 6.97 1.43 -1.26 -0.53 118.68 130.12 2dio s LEU 106 Ca -0.07 -0.20 0.26 0.00 -1.03 0.00 0.00 54.13 53.09 2dio s LEU 106 Cb -0.20 -1.87 1.09 0.00 0.03 0.00 0.00 46.19 45.25 2dio s LEU 106 CO -0.05 0.02 1.79 0.71 0.23 0.00 0.00 176.35 179.05 2dio h THR 107 N 5.44 0.00 -0.00 5.49 1.35 -1.68 -3.18 112.91 120.33 2dio h THR 107 Ca -0.37 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 2dio h THR 107 Cb 1.17 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 2dio h THR 107 CO 0.60 0.00 -0.86 0.00 -0.25 0.00 0.00 175.52 175.01 2dio n TYR 108 N -2.47 0.00 -3.57 4.73 4.11 -1.26 -4.95 117.16 113.76 2dio n TYR 108 Ca 0.02 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.82 2dio n TYR 108 Cb 0.25 0.00 -0.02 0.00 -0.00 0.00 0.00 39.34 39.57 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 -2.74 1.43 0.61 -3.48 -1.05 -1.20 -5.10 118.70 107.17 2dio s GLU 109 Ca 0.07 -0.64 -0.19 0.00 -0.15 0.00 0.00 54.97 54.07 2dio s GLU 109 Cb 0.14 0.59 -0.03 0.00 -0.44 0.00 0.00 34.13 34.39 2dio s GLU 109 CO 0.75 -0.64 1.27 -0.51 0.95 0.00 0.00 175.26 177.08 2dio s ASP 110 N -2.80 4.97 0.16 0.83 1.01 -1.26 -4.41 116.67 115.16 2dio s ASP 110 Ca 0.05 2.55 -0.02 0.00 0.71 0.00 0.00 52.55 55.83 2dio s ASP 110 Cb -0.03 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 2dio s ASP 110 CO -0.06 -1.75 0.11 -0.94 0.21 0.00 0.00 175.17 172.74 2dio s SER 111 N -1.40 0.22 -0.11 0.27 1.04 -0.85 -4.97 113.70 107.91 2dio s SER 111 Ca 0.78 -1.22 0.01 0.00 0.48 0.00 0.00 55.95 56.01 2dio s SER 111 Cb -0.35 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.10 2dio s SER 111 CO 0.38 -0.79 -0.14 -0.36 0.98 0.00 0.00 173.24 173.31 2dio s PHE 112 N -4.07 2.76 0.15 5.02 0.08 -1.26 -0.55 117.98 120.11 2dio s PHE 112 Ca 0.28 -0.56 0.06 0.00 0.12 0.00 0.00 56.93 56.83 2dio s PHE 112 Cb 0.07 -1.78 -0.04 0.00 -0.57 0.00 0.00 43.02 40.69 2dio s PHE 112 CO 0.05 -0.13 0.05 -0.51 -0.10 0.00 0.00 175.22 174.58 2dio s LEU 113 N 0.09 3.54 0.25 -0.37 1.02 -0.32 -4.39 118.68 118.50 2dio s LEU 113 Ca -0.06 -0.24 -0.30 0.00 0.02 0.00 0.00 54.13 53.55 2dio s LEU 113 Cb -0.15 -2.19 -0.09 0.00 0.02 0.00 0.00 46.19 43.78 2dio s LEU 113 CO 0.05 0.10 1.08 0.00 0.02 0.00 0.00 176.35 177.60 2dio s ALA 114 N -1.65 3.39 -0.43 4.21 0.00 -0.10 -1.37 121.76 125.80 2dio s ALA 114 Ca 0.29 0.85 -0.23 0.00 0.00 0.00 0.00 51.96 52.87 2dio s ALA 114 Cb -0.10 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 19.72 2dio s ALA 114 CO 0.20 -0.14 0.76 0.42 0.00 0.00 0.00 175.76 177.01 2dio s ILE 115 N -0.90 4.70 -0.47 0.00 1.01 -0.19 -1.61 121.20 123.74 2dio s ILE 115 Ca 0.45 0.44 0.24 0.00 0.00 0.00 0.00 60.65 61.78 2dio s ILE 115 Cb -0.31 -4.28 0.13 0.00 0.01 0.00 0.00 42.46 38.02 2dio s ILE 115 CO 0.38 -0.65 1.36 0.71 0.00 0.00 0.00 174.94 176.74 2dio h THR 116 N 5.93 0.00 0.00 2.92 1.35 -1.38 -3.38 112.91 118.35 2dio h THR 116 Ca -0.25 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 2dio h THR 116 Cb 1.09 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 2dio h THR 116 CO 0.94 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.82 2dio n GLY 117 N 1.22 -1.79 3.62 5.82 0.00 -1.23 -5.00 105.19 107.82 2dio n GLY 117 Ca 0.03 -1.34 -0.11 0.00 0.00 0.00 0.00 46.02 44.59 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 0.88 0.11 -0.02 0.00 -1.23 -0.42 107.32 106.65 2dio s GLY 118 Ca 0.00 -1.10 0.02 0.00 0.00 0.00 0.00 44.72 43.64 2dio s GLY 118 CO 0.00 -0.68 -0.06 0.00 0.00 0.00 0.00 173.10 172.36 2dio s ALA 119 N -3.14 1.06 0.00 3.20 0.00 -0.05 -4.04 121.76 118.79 2dio s ALA 119 Ca 0.24 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.81 2dio s ALA 119 Cb -0.02 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.30 2dio s ALA 119 CO 0.14 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.08 2dio n GLY 120 N -0.08 0.41 0.17 0.00 0.00 -1.26 -2.02 105.19 102.41 2dio n GLY 120 Ca -0.11 -0.80 0.13 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.23 -0.61 3.07 -1.30 -1.02 117.51 117.42 2dio h ILE 121 Ca 0.00 -0.14 0.00 0.00 1.55 0.00 0.00 64.86 66.27 2dio h ILE 121 Cb 0.00 0.80 0.00 0.00 -0.27 0.00 0.00 36.82 37.35 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 -2.36 0.30 -1.64 0.16 3.72 -0.93 -4.58 117.46 112.13 2dio n PHE 122 Ca 0.00 -0.15 -0.47 0.00 -0.05 0.00 0.00 57.45 56.79 2dio n PHE 122 Cb 0.14 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 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 0.75 1.77 -0.27 -1.08 0.00 -0.39 -1.63 120.64 119.79 2dio n GLU 123 Ca 0.17 0.63 0.00 0.00 0.00 0.00 0.00 57.16 57.96 2dio n GLU 123 Cb 0.43 -2.27 0.00 0.00 0.00 0.00 0.00 31.44 29.60 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 2.35 1.25 3.77 8.31 0.00 -1.26 -4.48 105.19 115.13 2dio n GLY 124 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2dio n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dio s ALA 125 N -2.83 3.25 0.30 4.61 0.00 -0.64 -4.36 121.76 122.09 2dio s ALA 125 Ca 0.00 1.26 -0.15 0.00 0.00 0.00 0.00 51.96 53.07 2dio s ALA 125 Cb 0.00 -3.50 0.02 0.00 0.00 0.00 0.00 23.12 19.64 2dio s ALA 125 CO 0.00 -0.88 0.62 1.52 0.00 0.00 0.00 175.76 177.02 2dio s TYR 126 N -1.26 0.20 -0.44 0.00 -0.85 0.01 -3.96 117.35 111.05 2dio s TYR 126 Ca 0.58 -0.64 0.00 0.00 -0.52 0.00 0.00 57.07 56.49 2dio s TYR 126 Cb -0.39 0.47 0.00 0.00 0.38 0.00 0.00 41.96 42.42 2dio s TYR 126 CO 0.50 -1.21 0.00 0.41 -1.52 0.00 0.00 175.55 173.73 2dio n GLY 127 N -0.46 0.56 3.40 5.49 0.00 -1.26 -1.06 105.19 111.87 2dio n GLY 127 Ca -0.03 -2.26 -0.21 0.00 0.00 0.00 0.00 46.02 43.52 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 -0.18 1.49 -0.03 1.61 -2.07 -1.26 -1.02 119.66 118.20 2dio s GLN 128 Ca 0.00 -1.71 0.03 0.00 -1.82 0.00 0.00 55.36 51.86 2dio s GLN 128 Cb 0.00 -1.23 0.00 0.00 -1.09 0.00 0.00 33.01 30.69 2dio s GLN 128 CO 0.00 0.13 -0.13 0.54 -1.32 0.00 0.00 175.29 174.51 2dio s VAL 129 N -2.93 1.07 -0.17 3.63 0.11 -0.47 -1.31 120.40 120.33 2dio s VAL 129 Ca 0.27 -0.52 -0.17 0.00 -2.93 0.00 0.00 61.98 58.63 2dio s VAL 129 Cb 0.01 -0.93 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 2dio s VAL 129 CO 0.10 0.32 0.45 -0.75 -3.33 0.00 0.00 175.10 171.89 2dio s LYS 130 N 0.12 4.24 -0.26 1.54 2.20 0.19 -1.18 119.74 126.59 2dio s LYS 130 Ca -0.03 0.33 -0.12 0.00 -0.36 0.00 0.00 55.97 55.79 2dio s LYS 130 Cb -0.10 -3.50 -0.05 0.00 -1.51 0.00 0.00 37.83 32.67 2dio s LYS 130 CO 0.01 0.02 0.21 -1.17 -0.36 0.00 0.00 175.35 174.06 2dio s LEU 131 N 1.10 4.07 -0.22 5.43 0.20 0.29 -1.39 118.68 128.16 2dio s LEU 131 Ca 0.22 0.10 -0.02 0.00 0.69 0.00 0.00 54.13 55.13 2dio s LEU 131 Cb -0.15 -2.18 0.01 0.00 -0.43 0.00 0.00 46.19 43.45 2dio s LEU 131 CO 0.09 -0.02 -0.09 -1.10 -0.29 0.00 0.00 176.35 174.93 2dio s GLN 132 N 1.51 3.05 -0.18 1.98 -0.21 0.26 -2.00 119.66 124.07 2dio s GLN 132 Ca 0.09 -0.83 -0.19 0.00 0.02 0.00 0.00 55.36 54.45 2dio s GLN 132 Cb -0.15 -2.89 -0.03 0.00 1.00 0.00 0.00 33.01 30.94 2dio s GLN 132 CO 0.08 -0.29 0.56 1.14 -2.12 0.00 0.00 175.29 174.67 2dio s GLN 133 N 1.36 4.24 -0.24 2.91 -2.07 -1.26 -0.77 119.66 123.84 2dio s GLN 133 Ca 0.03 0.52 -0.16 0.00 -1.82 0.00 0.00 55.36 53.93 2dio s GLN 133 Cb -0.15 -3.54 -0.13 0.00 -1.09 0.00 0.00 33.01 28.11 2dio s GLN 133 CO -0.06 -0.11 -0.18 1.28 -1.32 0.00 0.00 175.29 174.90 2dio n LEU 134 N 4.60 1.92 -3.87 2.60 4.77 -0.77 -4.89 117.00 121.36 2dio n LEU 134 Ca -0.04 0.38 -0.27 0.00 -0.03 0.00 0.00 56.01 56.06 2dio n LEU 134 Cb 0.50 -0.86 -0.17 0.00 -2.33 0.00 0.00 43.42 40.57 2dio n LEU 134 CO 0.43 0.31 -0.42 -0.69 -1.33 0.00 0.00 177.39 175.69 2dio s VAL 135 N -2.50 0.93 0.02 4.08 1.01 -0.98 -4.70 120.40 118.26 2dio s VAL 135 Ca -0.33 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 2dio s VAL 135 Cb 0.10 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 2dio s VAL 135 CO 0.49 0.24 1.07 -0.47 0.00 0.00 0.00 175.10 176.44 2dio s TYR 136 N 1.73 3.56 -0.27 5.22 5.04 -1.26 0.25 117.35 131.63 2dio s TYR 136 Ca 0.03 1.53 0.13 0.00 -2.44 0.00 0.00 57.07 56.32 2dio s TYR 136 Cb -0.14 -3.25 0.81 0.00 0.35 0.00 0.00 41.96 39.74 2dio s TYR 136 CO -0.08 -0.54 1.78 -0.35 -1.34 0.00 0.00 175.55 175.02 2dio n PRO 137 N 3.95 4.63 0.01 4.97 -0.04 -1.26 -4.96 135.00 142.30 2dio n PRO 137 Ca 0.07 -3.16 0.11 0.00 -0.04 0.00 0.00 63.50 60.49 2dio n PRO 137 Cb 0.49 -2.27 -0.13 0.00 -0.04 0.00 0.00 33.50 31.56 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 0.42 0.09 -4.16 0.52 -2.24 0.14 -4.76 114.28 104.28 2dio n THR 138 Ca 0.32 -0.42 -0.25 0.00 -2.27 0.00 0.00 64.05 61.43 2dio n THR 138 Cb 1.26 0.10 -0.17 0.00 -2.10 0.00 0.00 70.33 69.43 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 -3.41 1.45 0.09 -0.78 1.02 -0.35 -0.48 119.74 117.28 2dio s LYS 139 Ca -0.04 -0.27 0.06 0.00 0.02 0.00 0.00 55.97 55.74 2dio s LYS 139 Cb 0.14 -1.40 -0.03 0.00 -0.52 0.00 0.00 37.83 36.01 2dio s LYS 139 CO 0.88 -0.15 -0.16 -0.51 -0.92 0.00 0.00 175.35 174.49 2dio s LEU 140 N 1.27 2.31 -0.04 3.17 1.02 0.69 -1.84 118.68 125.25 2dio s LEU 140 Ca -0.04 -0.68 0.06 0.00 0.02 0.00 0.00 54.13 53.50 2dio s LEU 140 Cb -0.14 -0.65 -0.02 0.00 0.02 0.00 0.00 46.19 45.41 2dio s LEU 140 CO -0.03 -0.05 -0.23 0.12 0.02 0.00 0.00 176.35 176.18 2dio s PHE 141 N -1.42 2.44 0.04 0.29 5.36 0.05 -1.17 117.98 123.58 2dio s PHE 141 Ca 0.03 -0.49 0.06 0.00 -0.96 0.00 0.00 56.93 55.57 2dio s PHE 141 Cb -0.09 -1.56 -0.02 0.00 -0.34 0.00 0.00 43.02 41.00 2dio s PHE 141 CO 0.03 -0.06 -0.17 0.71 -1.46 0.00 0.00 175.22 174.26 2dio s TYR 142 N -0.46 1.51 -0.23 10.12 1.51 -0.18 -0.57 117.35 129.05 2dio s TYR 142 Ca 0.05 -0.36 0.01 0.00 -1.01 0.00 0.00 57.07 55.76 2dio s TYR 142 Cb -0.11 -0.89 0.06 0.00 -0.11 0.00 0.00 41.96 40.90 2dio s TYR 142 CO 0.01 0.06 -0.06 0.99 -1.11 0.00 0.00 175.55 175.45 2dio s THR 143 N -0.82 1.56 -0.03 -0.71 2.01 -0.48 -1.73 115.64 115.44 2dio s THR 143 Ca 0.04 -1.22 -0.29 0.00 0.31 0.00 0.00 61.69 60.53 2dio s THR 143 Cb -0.08 -1.81 -0.03 0.00 0.01 0.00 0.00 72.50 70.59 2dio s THR 143 CO 0.02 -0.08 0.95 -0.36 -0.69 0.00 0.00 174.62 174.46 2dio s PHE 144 N 1.39 3.63 -1.08 4.92 0.40 0.12 -0.64 117.98 126.71 2dio s PHE 144 Ca -0.06 1.63 -0.10 0.00 -0.60 0.00 0.00 56.93 57.80 2dio s PHE 144 Cb -0.19 -3.09 0.26 0.00 0.51 0.00 0.00 43.02 40.51 2dio s PHE 144 CO -0.06 -0.03 1.10 0.71 0.70 0.00 0.00 175.22 177.63 2dio s TYR 145 N 1.15 4.12 -0.26 0.36 2.02 -0.43 -1.64 117.35 122.68 2dio s TYR 145 Ca 0.50 -2.53 -0.29 0.00 -0.37 0.00 0.00 57.07 54.38 2dio s TYR 145 Cb -0.20 -3.89 0.01 0.00 -0.40 0.00 0.00 41.96 37.48 2dio s TYR 145 CO 0.25 -1.01 1.08 -0.51 -1.57 0.00 0.00 175.55 173.80 2dio s LEU 146 N -0.76 4.04 0.28 -1.29 1.43 -0.60 -4.06 118.68 117.73 2dio s LEU 146 Ca 0.30 1.29 0.08 0.00 -1.03 0.00 0.00 54.13 54.77 2dio s LEU 146 Cb -0.09 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 2dio s LEU 146 CO -0.07 -0.77 0.15 -0.54 0.23 0.00 0.00 176.35 175.34 2dio s LYS 147 N 3.42 2.64 0.00 1.70 1.02 -0.23 -0.90 119.74 127.40 2dio s LYS 147 Ca 0.46 -1.26 0.00 0.00 0.02 0.00 0.00 55.97 55.19 2dio s LYS 147 Cb -0.15 -2.38 0.00 0.00 -0.52 0.00 0.00 37.83 34.78 2dio s LYS 147 CO 0.11 0.30 0.00 0.41 -0.92 0.00 0.00 175.35 175.25 2dio n GLY 148 N -1.12 0.80 3.77 -3.33 0.00 -1.26 -0.81 105.19 103.24 2dio n GLY 148 Ca -0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 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 4.35 0.23 0.99 1.43 -1.26 -4.44 118.68 119.98 2dio s LEU 149 Ca 0.00 2.52 -0.08 0.00 -1.03 0.00 0.00 54.13 55.54 2dio s LEU 149 Cb 0.00 -3.79 0.20 0.00 0.03 0.00 0.00 46.19 42.63 2dio s LEU 149 CO 0.00 -0.56 1.86 0.00 0.23 0.00 0.00 176.35 177.88 2dio h ALA 150 N 3.14 1.12 -2.32 4.21 0.00 -1.81 -3.47 119.26 120.14 2dio h ALA 150 Ca -0.49 -0.12 -0.31 0.00 0.00 0.00 0.00 54.91 54.00 2dio h ALA 150 Cb 1.23 -0.35 -0.15 0.00 0.00 0.00 0.00 17.79 18.52 2dio h ALA 150 CO 0.64 0.61 -0.64 -0.80 0.00 0.00 0.00 179.25 179.06 2dio s ASN 151 N -6.17 1.14 0.51 0.00 0.01 -1.26 -5.12 114.94 104.05 2dio s ASN 151 Ca -0.13 -1.26 -0.23 0.00 -0.71 0.00 0.00 52.86 50.53 2dio s ASN 151 Cb 0.16 0.15 -0.06 0.00 0.41 0.00 0.00 41.25 41.91 2dio s ASN 151 CO 0.82 -0.64 1.39 0.47 -1.51 0.00 0.00 177.10 177.63 2dio n ASP 152 N -0.32 2.96 -4.76 -1.22 8.00 -1.26 -4.95 116.55 115.01 2dio n ASP 152 Ca -0.04 1.04 -0.38 0.00 0.71 0.00 0.00 54.79 56.12 2dio n ASP 152 Cb 0.64 -1.59 0.03 0.00 -0.02 0.00 0.00 41.12 40.18 2dio n ASP 152 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2dio s LEU 153 N -3.12 3.86 0.44 0.64 1.43 -1.26 -4.94 118.68 115.72 2dio s LEU 153 Ca 0.67 2.58 -0.25 0.00 -1.03 0.00 0.00 54.13 56.10 2dio s LEU 153 Cb -0.43 -4.32 -0.08 0.00 0.03 0.00 0.00 46.19 41.39 2dio s LEU 153 CO 0.53 -1.41 1.37 -2.16 0.23 0.00 0.00 176.35 174.91 2dio s PRO 154 N -2.92 3.76 0.37 1.29 0.04 -1.26 -4.90 135.00 131.37 2dio s PRO 154 Ca 0.71 2.30 0.12 0.00 0.04 0.00 0.00 61.00 64.17 2dio s PRO 154 Cb -0.36 -2.67 0.91 0.00 0.04 0.00 0.00 34.50 32.43 2dio s PRO 154 CO 0.42 -0.71 1.84 -0.07 0.04 0.00 0.00 177.00 178.51 2dio h LEU 155 N 2.40 0.58 -1.07 -3.56 3.38 -1.97 -1.36 115.31 113.72 2dio h LEU 155 Ca -0.50 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2dio h LEU 155 Cb 1.26 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2dio h LEU 155 CO 0.61 0.25 0.00 1.05 0.09 0.00 0.00 178.44 180.44 2dio h GLU 156 N 0.59 0.00 0.00 1.13 4.11 -2.02 -1.98 114.58 116.42 2dio h GLU 156 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.92 2dio h GLU 156 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2dio h GLU 156 CO -0.24 0.00 -0.73 1.28 0.07 0.00 0.00 179.01 179.39 2dio n LEU 157 N -2.37 0.69 -0.40 3.06 4.77 -0.52 -4.51 117.00 117.73 2dio n LEU 157 Ca 0.01 -0.18 0.09 0.00 -0.03 0.00 0.00 56.01 55.90 2dio n LEU 157 Cb 0.18 -0.15 0.18 0.00 -2.33 0.00 0.00 43.42 41.31 2dio n LEU 157 CO 0.18 0.16 0.61 0.35 -1.33 0.00 0.00 177.39 177.36 2dio n THR 158 N -1.55 2.06 -1.58 -5.08 -2.24 -0.75 -4.70 114.28 100.45 2dio n THR 158 Ca 0.05 -2.23 -0.41 0.00 -2.27 0.00 0.00 64.05 59.19 2dio n THR 158 Cb 0.34 -0.25 0.02 0.00 -2.10 0.00 0.00 70.33 68.34 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 -1.13 -0.49 3.67 3.38 0.00 -1.21 -4.84 105.19 104.58 2dio n GLY 159 Ca 0.19 0.07 -0.47 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.80 0.27 -2.04 2.61 -1.04 -1.26 -4.26 114.28 107.76 2dio n THR 160 Ca 0.10 -0.05 -0.37 0.00 -2.04 0.00 0.00 64.05 61.70 2dio n THR 160 Cb 0.41 -1.71 0.02 0.00 -1.82 0.00 0.00 70.33 67.23 2dio n THR 160 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2dio s PRO 161 N 2.37 3.22 0.07 -2.82 0.02 -1.26 -4.19 135.00 132.41 2dio s PRO 161 Ca 0.85 1.89 -0.31 0.00 0.02 0.00 0.00 61.00 63.45 2dio s PRO 161 Cb -0.67 -2.12 -0.08 0.00 0.02 0.00 0.00 34.50 31.65 2dio s PRO 161 CO 0.44 -1.02 1.57 0.08 -0.33 0.00 0.00 177.00 177.73 2dio s VAL 162 N -1.53 3.17 0.23 3.83 1.01 -0.47 -4.87 120.40 121.77 2dio s VAL 162 Ca 0.73 0.66 -0.32 0.00 0.00 0.00 0.00 61.98 63.05 2dio s VAL 162 Cb -0.32 -3.42 -0.13 0.00 0.00 0.00 0.00 36.38 32.51 2dio s VAL 162 CO 0.36 0.01 1.51 -2.65 0.00 0.00 0.00 175.10 174.33 2dio n PRO 163 N 5.27 2.26 -2.15 2.72 -0.02 -1.26 -4.88 135.00 136.93 2dio n PRO 163 Ca 0.15 0.81 -0.41 0.00 -2.02 0.00 0.00 63.50 62.02 2dio n PRO 163 Cb 0.41 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.33 2dio n PRO 163 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2dio s PRO 164 N 0.02 4.34 0.13 0.52 0.04 -1.26 -4.97 135.00 133.83 2dio s PRO 164 Ca 0.70 2.13 -0.10 0.00 0.04 0.00 0.00 61.00 63.77 2dio s PRO 164 Cb -0.61 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 30.75 2dio s PRO 164 CO 0.45 -0.33 0.27 0.45 0.04 0.00 0.00 177.00 177.89 2dio s SER 165 N 0.44 0.03 0.49 6.66 0.15 -1.26 -5.04 113.70 115.17 2dio s SER 165 Ca 0.59 -0.69 0.22 0.00 0.70 0.00 0.00 55.95 56.76 2dio s SER 165 Cb -0.38 0.41 1.28 0.00 -1.71 0.00 0.00 66.02 65.61 2dio s SER 165 CO 0.39 -0.83 2.05 0.11 1.20 0.00 0.00 173.24 176.16 2dio h LYS 166 N 2.59 0.00 -0.02 5.44 1.57 -1.94 -3.14 116.57 121.07 2dio h LYS 166 Ca -0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2dio h LYS 166 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2dio h LYS 166 CO 0.51 0.14 -0.03 -0.25 -0.57 0.00 0.00 179.45 179.25 2dio n ASP 167 N -3.95 1.77 -4.70 0.86 8.00 -1.26 -4.88 116.55 112.39 2dio n ASP 167 Ca -0.02 -1.56 -0.39 0.00 0.71 0.00 0.00 54.79 53.53 2dio n ASP 167 Cb 0.23 0.02 0.03 0.00 -0.02 0.00 0.00 41.12 41.39 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 0.35 3.38 -3.85 0.53 -6.64 -1.19 -5.03 119.36 106.91 2dio n ILE 168 Ca 0.17 -0.50 -0.12 0.00 -1.77 0.00 0.00 62.75 60.53 2dio n ILE 168 Cb 0.41 -1.49 -0.12 0.00 -1.44 0.00 0.00 39.64 36.99 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 -2.62 0.24 0.72 6.28 0.41 -1.26 -5.07 118.70 117.40 2dio s GLU 169 Ca 0.69 -0.01 -0.15 0.00 -0.41 0.00 0.00 54.97 55.10 2dio s GLU 169 Cb -0.45 0.11 0.03 0.00 -1.78 0.00 0.00 34.13 32.04 2dio s GLU 169 CO 0.52 -0.04 1.17 -1.25 -0.49 0.00 0.00 175.26 175.17 2dio s PRO 170 N -0.37 2.26 0.40 0.39 0.04 -1.26 -4.94 135.00 131.53 2dio s PRO 170 Ca -0.04 1.63 -0.25 0.00 0.04 0.00 0.00 61.00 62.38 2dio s PRO 170 Cb -0.03 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 32.54 2dio s PRO 170 CO 0.00 -1.71 0.94 0.00 0.04 0.00 0.00 177.00 176.28 2dio n ALA 171 N -2.74 -0.12 0.05 8.56 0.00 0.26 -4.73 120.51 121.79 2dio n ALA 171 Ca 0.12 0.24 0.08 0.00 0.00 0.00 0.00 53.44 53.89 2dio n ALA 171 Cb 0.51 -2.03 0.51 0.00 0.00 0.00 0.00 19.45 18.44 2dio n ALA 171 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2dio h PRO 172 N 1.49 0.34 -0.65 0.00 0.13 -1.92 -0.98 132.00 130.40 2dio h PRO 172 Ca -0.43 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2dio h PRO 172 Cb 1.35 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 32.37 2dio h PRO 172 CO 0.57 0.22 0.39 0.93 -0.23 0.00 0.00 178.00 179.88 2dio h GLU 173 N 0.35 0.87 -0.09 0.86 3.07 -1.90 -0.42 114.58 117.33 2dio h GLU 173 Ca 0.15 -0.07 -0.13 0.00 -0.50 0.00 0.00 59.36 58.81 2dio h GLU 173 Cb 0.16 -0.19 0.01 0.00 -0.84 0.00 0.00 28.75 27.89 2dio h GLU 173 CO -0.03 0.61 -0.45 0.00 -1.40 0.00 0.00 179.01 177.74 2dio h ALA 174 N 1.54 0.17 -0.86 3.43 0.00 -1.34 -1.37 119.26 120.83 2dio h ALA 174 Ca 0.23 -0.49 0.05 0.00 0.00 0.00 0.00 54.91 54.70 2dio h ALA 174 Cb -0.04 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 2dio h ALA 174 CO -0.04 0.32 0.54 -0.22 0.00 0.00 0.00 179.25 179.85 2dio h LYS 175 N 0.02 0.99 -0.00 0.00 1.63 -1.09 -2.68 116.57 115.45 2dio h LYS 175 Ca -0.03 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 2dio h LYS 175 Cb 1.10 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 32.50 2dio h LYS 175 CO 0.09 0.66 -0.18 0.00 -3.45 0.00 0.00 179.45 176.57 2dio n ALA 176 N -2.35 2.89 -3.13 5.00 0.00 -0.19 -4.96 120.51 117.78 2dio n ALA 176 Ca 0.11 -0.30 -0.17 0.00 0.00 0.00 0.00 53.44 53.08 2dio n ALA 176 Cb 0.13 -1.27 0.05 0.00 0.00 0.00 0.00 19.45 18.36 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 -0.95 -2.80 -4.79 0.00 4.77 -0.71 -5.00 117.00 107.51 2dio n LEU 177 Ca 0.13 -0.33 -0.35 0.00 -0.03 0.00 0.00 56.01 55.42 2dio n LEU 177 Cb 0.31 -2.35 -0.06 0.00 -2.33 0.00 0.00 43.42 38.99 2dio n LEU 177 CO 0.25 0.37 0.68 -1.61 -1.33 0.00 0.00 177.39 175.76 2dio s GLU 178 N -5.75 4.29 0.41 3.23 2.02 -0.60 -4.93 118.70 117.37 2dio s GLU 178 Ca 0.36 1.33 0.18 0.00 0.02 0.00 0.00 54.97 56.85 2dio s GLU 178 Cb -0.16 -2.49 1.08 0.00 0.10 0.00 0.00 34.13 32.67 2dio s GLU 178 CO 0.44 0.01 1.84 -1.35 0.02 0.00 0.00 175.26 176.22 2dio h PRO 179 N 2.48 0.40 0.00 0.39 0.11 -1.92 0.22 132.00 133.67 2dio h PRO 179 Ca -0.48 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2dio h PRO 179 Cb 1.20 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 2dio h PRO 179 CO 0.63 0.26 -0.03 0.66 -0.21 0.00 0.00 178.00 179.31 2dio h SER 180 N 0.41 0.00 -0.36 -2.05 4.64 -1.93 -3.05 113.55 111.21 2dio h SER 180 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 2dio h SER 180 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2dio h SER 180 CO -0.20 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.40 2dio n GLY 181 N -0.40 3.35 3.10 -0.77 0.00 0.74 -4.85 105.19 106.36 2dio n GLY 181 Ca -0.01 -0.76 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.00 0.47 0.53 1.61 -7.23 -1.10 -0.54 120.40 112.14 2dio s VAL 182 Ca 0.37 -1.59 -0.04 0.00 -1.81 0.00 0.00 61.98 58.91 2dio s VAL 182 Cb 0.26 -1.23 -0.00 0.00 0.56 0.00 0.00 36.38 35.97 2dio s VAL 182 CO 0.14 -0.75 0.81 0.27 -0.31 0.00 0.00 175.10 175.26 2dio s ILE 183 N -2.93 3.97 0.30 -0.62 -4.36 -0.66 -4.86 121.20 112.03 2dio s ILE 183 Ca 0.02 -0.11 -0.29 0.00 -0.26 0.00 0.00 60.65 60.01 2dio s ILE 183 Cb 0.01 -3.53 -0.11 0.00 1.25 0.00 0.00 42.46 40.08 2dio s ILE 183 CO -0.04 -0.49 1.50 -0.44 0.24 0.00 0.00 174.94 175.70 2dio s SER 184 N -4.25 6.49 -1.41 4.36 0.01 -1.26 -2.05 113.70 115.60 2dio s SER 184 Ca 0.51 2.86 -0.12 0.00 1.31 0.00 0.00 55.95 60.51 2dio s SER 184 Cb -0.10 -2.64 0.10 0.00 0.21 0.00 0.00 66.02 63.59 2dio s SER 184 CO 0.43 -0.81 0.61 0.59 0.41 0.00 0.00 173.24 174.47 2dio n ASN 185 N 1.75 -3.68 -4.53 2.44 3.02 -1.26 -2.43 115.26 110.58 2dio n ASN 185 Ca 0.06 -0.58 -0.45 0.00 -0.03 0.00 0.00 54.58 53.57 2dio n ASN 185 Cb 0.39 -3.02 -0.02 0.00 -0.61 0.00 0.00 39.78 36.52 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 -4.11 0.61 -2.58 3.10 0.18 -0.87 -3.94 117.16 109.55 2dio n TYR 186 Ca 0.02 0.76 -0.40 0.00 1.88 0.00 0.00 57.90 60.16 2dio n TYR 186 Cb 0.52 -2.14 -0.05 0.00 -0.38 0.00 0.00 39.34 37.29 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 -1.10 3.72 0.00 -3.48 2.01 -1.03 -4.85 115.64 110.90 2dio s THR 187 Ca 0.61 1.67 0.00 0.00 0.31 0.00 0.00 61.69 64.28 2dio s THR 187 Cb -0.74 -4.04 0.00 0.00 0.01 0.00 0.00 72.50 67.73 2dio s THR 187 CO 0.59 0.35 0.00 -3.20 -0.69 0.00 0.00 174.62 171.67