#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ok3 s ASP 3 N 0.00 0.15 0.40 2.61 -0.00 -1.26 -1.86 116.67 116.70 1ok3 s ASP 3 Ca 0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 52.55 52.51 1ok3 s ASP 3 Cb 0.00 -0.04 -0.04 0.00 -0.00 0.00 0.00 42.92 42.85 1ok3 s ASP 3 CO 0.00 -0.01 0.65 0.00 -0.00 0.00 0.00 175.17 175.81 1ok3 n GLY 5 N -1.93 1.28 3.72 0.00 0.00 -1.26 -1.50 105.19 105.50 1ok3 n GLY 5 Ca -0.02 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 1ok3 n GLY 5 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ok3 n LEU 6 N 0.00 4.00 -4.69 0.99 4.77 -1.25 -4.67 117.00 116.15 1ok3 n LEU 6 Ca 0.00 1.18 -0.29 0.00 -0.03 0.00 0.00 56.01 56.86 1ok3 n LEU 6 Cb 0.00 -1.54 0.16 0.00 -2.33 0.00 0.00 43.42 39.71 1ok3 n LEU 6 CO 0.00 -0.13 0.65 -2.16 -1.33 0.00 0.00 177.39 174.42 1ok3 s PRO 7 N -1.15 0.87 0.71 3.23 0.04 -1.26 -4.98 135.00 132.46 1ok3 s PRO 7 Ca 0.60 0.81 -0.15 0.00 0.04 0.00 0.00 61.00 62.30 1ok3 s PRO 7 Cb -0.54 -1.77 0.03 0.00 0.04 0.00 0.00 34.50 32.26 1ok3 s PRO 7 CO 0.55 -2.50 1.20 -2.14 0.04 0.00 0.00 177.00 174.15 1ok3 s PRO 8 N -4.88 2.28 -0.27 0.56 0.02 -1.26 -4.97 135.00 126.48 1ok3 s PRO 8 Ca 0.64 1.75 -0.25 0.00 0.02 0.00 0.00 61.00 63.17 1ok3 s PRO 8 Cb -0.19 -1.85 -0.00 0.00 0.02 0.00 0.00 34.50 32.48 1ok3 s PRO 8 CO 0.58 -1.73 0.84 0.34 -0.33 0.00 0.00 177.00 176.70 1ok3 s ASP 9 N -2.01 6.78 -0.19 2.53 3.68 -1.26 -4.98 116.67 121.22 1ok3 s ASP 9 Ca 0.74 0.90 -0.05 0.00 2.13 0.00 0.00 52.55 56.27 1ok3 s ASP 9 Cb -0.29 -2.44 -0.03 0.00 -1.45 0.00 0.00 42.92 38.72 1ok3 s ASP 9 CO 0.44 -0.59 0.01 -0.69 0.13 0.00 0.00 175.17 174.46 1ok3 s VAL 10 N 2.96 4.13 0.17 1.11 1.01 -1.26 -5.07 120.40 123.45 1ok3 s VAL 10 Ca 0.35 -0.26 -0.32 0.00 0.00 0.00 0.00 61.98 61.75 1ok3 s VAL 10 Cb -0.15 -2.85 -0.11 0.00 0.00 0.00 0.00 36.38 33.27 1ok3 s VAL 10 CO 0.10 0.45 1.75 -2.84 0.00 0.00 0.00 175.10 174.55 1ok3 s PRO 11 N 0.72 4.14 -0.91 2.72 0.02 -1.26 -2.39 135.00 138.04 1ok3 s PRO 11 Ca 0.00 2.58 0.00 0.00 0.02 0.00 0.00 61.00 63.60 1ok3 s PRO 11 Cb -0.14 -3.28 0.00 0.00 0.02 0.00 0.00 34.50 31.10 1ok3 s PRO 11 CO 0.02 -0.77 0.00 0.09 -0.33 0.00 0.00 177.00 176.01 1ok3 n ASN 12 N 4.63 -4.15 -4.02 2.53 3.02 -1.26 -4.77 115.26 111.23 1ok3 n ASN 12 Ca 0.16 0.21 -0.09 0.00 -0.03 0.00 0.00 54.58 54.84 1ok3 n ASN 12 Cb 0.37 -2.40 -0.11 0.00 -0.61 0.00 0.00 39.78 37.03 1ok3 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ok3 s ALA 13 N -2.28 0.27 -0.04 5.41 0.00 -1.01 -0.40 121.76 123.72 1ok3 s ALA 13 Ca 0.00 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.19 1ok3 s ALA 13 Cb 0.00 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1ok3 s ALA 13 CO 0.00 -0.22 -0.14 -0.65 0.00 0.00 0.00 175.76 174.74 1ok3 s GLN 14 N -2.30 1.56 0.35 0.00 -1.52 -0.12 -4.54 119.66 113.10 1ok3 s GLN 14 Ca -0.08 -0.50 -0.15 0.00 -1.95 0.00 0.00 55.36 52.68 1ok3 s GLN 14 Cb -0.04 -1.36 -0.09 0.00 -0.22 0.00 0.00 33.01 31.30 1ok3 s GLN 14 CO -0.04 0.18 0.77 -1.25 -0.25 0.00 0.00 175.29 174.70 1ok3 s PRO 15 N 0.17 4.00 -0.46 2.91 0.04 -1.26 -0.31 135.00 140.09 1ok3 s PRO 15 Ca -0.05 0.71 -0.19 0.00 0.04 0.00 0.00 61.00 61.51 1ok3 s PRO 15 Cb -0.11 -2.38 0.04 0.00 0.04 0.00 0.00 34.50 32.08 1ok3 s PRO 15 CO 0.02 0.10 0.57 0.00 0.04 0.00 0.00 177.00 177.73 1ok3 s ALA 16 N -2.08 3.39 -0.19 8.56 0.00 -0.74 -4.90 121.76 125.81 1ok3 s ALA 16 Ca 0.55 -1.55 0.22 0.00 0.00 0.00 0.00 51.96 51.18 1ok3 s ALA 16 Cb -0.10 -3.25 -0.28 0.00 0.00 0.00 0.00 23.12 19.49 1ok3 s ALA 16 CO 0.19 -1.83 0.60 1.28 0.00 0.00 0.00 175.76 176.01 1ok3 n LEU 17 N 6.01 0.22 -3.30 0.00 4.77 -1.26 -4.59 117.00 118.84 1ok3 n LEU 17 Ca -0.06 -0.03 -0.24 0.00 -0.03 0.00 0.00 56.01 55.66 1ok3 n LEU 17 Cb 0.47 -0.01 0.05 0.00 -2.33 0.00 0.00 43.42 41.59 1ok3 n LEU 17 CO 0.51 0.01 0.08 -0.62 -1.33 0.00 0.00 177.39 176.05 1ok3 n GLU 18 N -2.19 -5.79 -0.73 3.23 1.02 -1.26 -2.90 120.64 112.02 1ok3 n GLU 18 Ca -0.02 0.82 0.00 0.00 -0.02 0.00 0.00 57.16 57.94 1ok3 n GLU 18 Cb 0.53 -5.74 0.00 0.00 -0.02 0.00 0.00 31.44 26.21 1ok3 n GLU 18 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ok3 n GLY 19 N -1.66 0.65 3.42 0.62 0.00 -1.26 -5.06 105.19 101.89 1ok3 n GLY 19 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 1ok3 n GLY 19 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ok3 s ARG 20 N -0.27 1.53 0.00 1.61 1.70 -1.14 -5.04 118.95 117.34 1ok3 s ARG 20 Ca 0.00 -1.71 0.00 0.00 -0.47 0.00 0.00 55.73 53.56 1ok3 s ARG 20 Cb 0.00 -1.45 -0.00 0.00 -0.57 0.00 0.00 34.95 32.93 1ok3 s ARG 20 CO 0.00 0.24 0.22 0.25 -1.08 0.00 0.00 175.30 174.93 1ok3 n THR 21 N -0.53 0.00 -4.50 4.99 -2.24 -1.26 -4.90 114.28 105.85 1ok3 n THR 21 Ca -0.06 -0.50 -0.21 0.00 -2.27 0.00 0.00 64.05 61.01 1ok3 n THR 21 Cb 0.61 1.00 -0.15 0.00 -2.10 0.00 0.00 70.33 69.69 1ok3 n THR 21 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ok3 s SER 22 N -0.59 1.36 -0.03 3.42 0.15 -1.26 -3.87 113.70 112.87 1ok3 s SER 22 Ca 0.00 -0.21 0.01 0.00 0.70 0.00 0.00 55.95 56.45 1ok3 s SER 22 Cb 0.00 -0.22 0.02 0.00 -1.71 0.00 0.00 66.02 64.11 1ok3 s SER 22 CO 0.01 0.12 -0.03 -0.36 1.20 0.00 0.00 173.24 174.18 1ok3 s PHE 23 N -0.14 0.53 0.57 3.44 0.08 -0.56 -4.98 117.98 116.92 1ok3 s PHE 23 Ca 0.02 -0.11 -0.17 0.00 0.12 0.00 0.00 56.93 56.80 1ok3 s PHE 23 Cb -0.06 -0.47 -0.05 0.00 -0.57 0.00 0.00 43.02 41.87 1ok3 s PHE 23 CO -0.00 -0.12 1.05 -1.25 -0.10 0.00 0.00 175.22 174.80 1ok3 s PRO 24 N 0.63 3.43 0.31 0.24 0.04 -1.26 0.28 135.00 138.67 1ok3 s PRO 24 Ca -0.07 1.22 -0.25 0.00 0.04 0.00 0.00 61.00 61.93 1ok3 s PRO 24 Cb -0.11 -2.05 -0.15 0.00 0.04 0.00 0.00 34.50 32.24 1ok3 s PRO 24 CO -0.00 -0.72 0.58 -1.91 0.04 0.00 0.00 177.00 174.99 1ok3 n GLU 25 N -1.83 0.47 -0.91 4.56 2.13 -0.78 -1.39 120.64 122.89 1ok3 n GLU 25 Ca 0.09 0.17 0.00 0.00 0.66 0.00 0.00 57.16 58.07 1ok3 n GLU 25 Cb 0.53 -1.34 0.00 0.00 0.27 0.00 0.00 31.44 30.90 1ok3 n GLU 25 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1ok3 n ASP 26 N 1.66 -0.94 -4.73 4.31 8.00 0.12 -4.97 116.55 120.00 1ok3 n ASP 26 Ca 0.13 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.22 1ok3 n ASP 26 Cb 0.33 -0.73 -0.03 0.00 -0.02 0.00 0.00 41.12 40.67 1ok3 n ASP 26 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ok3 s THR 27 N -2.92 2.83 -0.22 -3.53 2.01 -0.49 -4.75 115.64 108.58 1ok3 s THR 27 Ca 0.00 0.66 -0.05 0.00 0.31 0.00 0.00 61.69 62.61 1ok3 s THR 27 Cb 0.00 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 69.07 1ok3 s THR 27 CO 0.00 0.09 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.31 1ok3 s VAL 28 N 0.39 3.62 -0.16 3.82 1.01 -1.26 -1.52 120.40 126.29 1ok3 s VAL 28 Ca 0.62 -0.41 -0.02 0.00 0.00 0.00 0.00 61.98 62.16 1ok3 s VAL 28 Cb -0.41 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.30 1ok3 s VAL 28 CO 0.38 0.41 -0.08 -0.63 0.00 0.00 0.00 175.10 175.18 1ok3 s ILE 29 N 1.43 3.42 -0.08 2.22 1.01 -0.35 -4.96 121.20 123.88 1ok3 s ILE 29 Ca 0.05 -0.52 -0.04 0.00 0.00 0.00 0.00 60.65 60.14 1ok3 s ILE 29 Cb -0.14 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 1ok3 s ILE 29 CO -0.01 0.49 0.10 -0.89 0.00 0.00 0.00 174.94 174.63 1ok3 s THR 30 N 0.65 5.10 0.03 2.92 2.01 -1.26 -0.35 115.64 124.74 1ok3 s THR 30 Ca -0.04 -0.02 0.01 0.00 0.31 0.00 0.00 61.69 61.94 1ok3 s THR 30 Cb -0.15 -3.24 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 1ok3 s THR 30 CO 0.02 0.55 0.08 -0.31 -0.69 0.00 0.00 174.62 174.27 1ok3 s TYR 31 N -1.05 3.24 -0.10 4.92 2.02 0.18 -1.79 117.35 124.78 1ok3 s TYR 31 Ca 0.17 0.15 0.03 0.00 -0.37 0.00 0.00 57.07 57.04 1ok3 s TYR 31 Cb -0.12 -1.69 -0.01 0.00 -0.40 0.00 0.00 41.96 39.74 1ok3 s TYR 31 CO 0.06 0.53 -0.18 0.15 -1.57 0.00 0.00 175.55 174.55 1ok3 s LYS 32 N -2.00 3.01 0.61 -0.62 -0.14 0.58 -4.88 119.74 116.31 1ok3 s LYS 32 Ca 0.25 -0.77 -0.19 0.00 -1.36 0.00 0.00 55.97 53.90 1ok3 s LYS 32 Cb -0.12 -2.43 -0.03 0.00 -1.68 0.00 0.00 37.83 33.57 1ok3 s LYS 32 CO 0.17 0.31 1.31 0.00 -0.76 0.00 0.00 175.35 176.37 1ok3 s GLU 34 N -3.21 2.24 0.19 0.00 2.02 0.46 -4.82 118.70 115.57 1ok3 s GLU 34 Ca 0.78 0.11 -0.32 0.00 0.02 0.00 0.00 54.97 55.56 1ok3 s GLU 34 Cb -0.38 -2.02 -0.15 0.00 0.10 0.00 0.00 34.13 31.68 1ok3 s GLU 34 CO 0.42 -1.37 1.22 -1.91 0.02 0.00 0.00 175.26 173.64 1ok3 n GLU 35 N -3.14 1.35 -1.03 1.61 2.13 -1.26 -0.91 120.64 119.39 1ok3 n GLU 35 Ca 0.08 0.48 -0.01 0.00 0.66 0.00 0.00 57.16 58.37 1ok3 n GLU 35 Cb 0.60 -2.02 -0.00 0.00 0.27 0.00 0.00 31.44 30.29 1ok3 n GLU 35 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1ok3 n SER 36 N 2.06 -3.27 -4.04 4.31 7.64 -1.26 -5.03 113.62 114.03 1ok3 n SER 36 Ca 0.14 0.03 -0.19 0.00 1.01 0.00 0.00 58.87 59.86 1ok3 n SER 36 Cb 0.26 -0.86 -0.14 0.00 -1.01 0.00 0.00 64.21 62.45 1ok3 n SER 36 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ok3 s PHE 37 N -1.99 0.88 -0.02 1.43 0.40 -0.09 -3.12 117.98 115.46 1ok3 s PHE 37 Ca 0.00 -0.19 0.05 0.00 -0.60 0.00 0.00 56.93 56.19 1ok3 s PHE 37 Cb 0.00 -0.56 -0.01 0.00 0.51 0.00 0.00 43.02 42.96 1ok3 s PHE 37 CO 0.00 -0.01 -0.19 0.08 0.70 0.00 0.00 175.22 175.80 1ok3 s VAL 38 N -0.33 1.51 0.34 -0.44 1.01 2.72 -4.59 120.40 120.63 1ok3 s VAL 38 Ca 0.03 -0.80 -0.28 0.00 0.00 0.00 0.00 61.98 60.93 1ok3 s VAL 38 Cb -0.04 -1.27 -0.09 0.00 0.00 0.00 0.00 36.38 34.97 1ok3 s VAL 38 CO -0.00 0.43 1.19 -1.59 0.00 0.00 0.00 175.10 175.13 1ok3 s LYS 39 N -0.30 4.33 -0.38 2.72 -2.85 -1.26 -0.59 119.74 121.41 1ok3 s LYS 39 Ca 0.04 1.96 -0.27 0.00 -1.00 0.00 0.00 55.97 56.70 1ok3 s LYS 39 Cb -0.09 -2.96 0.02 0.00 -2.06 0.00 0.00 37.83 32.73 1ok3 s LYS 39 CO 0.00 -0.11 0.97 0.42 0.10 0.00 0.00 175.35 176.73 1ok3 s ILE 40 N -1.25 4.53 0.20 3.79 1.01 0.20 -4.89 121.20 124.79 1ok3 s ILE 40 Ca 0.50 1.26 -0.31 0.00 0.00 0.00 0.00 60.65 62.10 1ok3 s ILE 40 Cb -0.34 -4.38 -0.15 0.00 0.01 0.00 0.00 42.46 37.60 1ok3 s ILE 40 CO 0.44 -0.59 1.05 -2.65 0.00 0.00 0.00 174.94 173.19 1ok3 n PRO 41 N 6.92 1.06 -1.27 2.79 -0.02 -1.26 -2.57 135.00 140.65 1ok3 n PRO 41 Ca 0.08 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1ok3 n PRO 41 Cb 0.48 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 1ok3 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ok3 n GLY 42 N 1.78 0.47 3.23 -1.23 0.00 -1.26 -5.07 105.19 103.11 1ok3 n GLY 42 Ca 0.14 -0.92 -0.21 0.00 0.00 0.00 0.00 46.02 45.02 1ok3 n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ok3 s GLU 43 N -2.57 0.99 0.49 1.61 2.02 -1.06 -5.13 118.70 115.05 1ok3 s GLU 43 Ca 0.00 -1.05 -0.23 0.00 0.02 0.00 0.00 54.97 53.71 1ok3 s GLU 43 Cb 0.00 -1.13 -0.07 0.00 0.10 0.00 0.00 34.13 33.03 1ok3 s GLU 43 CO 0.00 0.26 1.25 0.15 0.02 0.00 0.00 175.26 176.94 1ok3 s LYS 44 N -1.78 3.55 -0.06 1.61 1.02 -1.26 -4.95 119.74 117.88 1ok3 s LYS 44 Ca 0.03 1.97 0.08 0.00 0.02 0.00 0.00 55.97 58.07 1ok3 s LYS 44 Cb -0.10 -2.38 0.12 0.00 -0.52 0.00 0.00 37.83 34.95 1ok3 s LYS 44 CO 0.03 -0.78 1.03 -0.40 -0.92 0.00 0.00 175.35 174.31 1ok3 n ASP 45 N -0.63 1.16 -3.83 2.83 3.85 -1.26 -4.79 116.55 113.88 1ok3 n ASP 45 Ca 0.08 -2.39 -0.09 0.00 -0.71 0.00 0.00 54.79 51.68 1ok3 n ASP 45 Cb 0.47 -0.27 -0.07 0.00 -1.35 0.00 0.00 41.12 39.90 1ok3 n ASP 45 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1ok3 s SER 46 N -1.72 0.04 0.34 -1.12 1.04 -1.26 0.51 113.70 111.52 1ok3 s SER 46 Ca 0.14 -0.62 0.07 0.00 0.48 0.00 0.00 55.95 56.01 1ok3 s SER 46 Cb 0.12 0.38 -0.07 0.00 0.10 0.00 0.00 66.02 66.56 1ok3 s SER 46 CO 0.01 -0.78 -0.04 0.68 0.98 0.00 0.00 173.24 174.09 1ok3 s VAL 47 N -3.87 1.86 -0.01 5.02 -7.23 0.53 -4.91 120.40 111.79 1ok3 s VAL 47 Ca 0.07 -2.11 0.01 0.00 -1.81 0.00 0.00 61.98 58.14 1ok3 s VAL 47 Cb 0.04 -2.69 0.01 0.00 0.56 0.00 0.00 36.38 34.30 1ok3 s VAL 47 CO -0.09 -0.16 -0.03 -0.51 -0.31 0.00 0.00 175.10 174.00 1ok3 s ILE 48 N -2.85 0.28 -0.52 -0.62 2.07 -1.26 -1.21 121.20 117.09 1ok3 s ILE 48 Ca 0.33 -0.08 -0.28 0.00 -1.41 0.00 0.00 60.65 59.20 1ok3 s ILE 48 Cb 0.05 -0.28 0.01 0.00 0.13 0.00 0.00 42.46 42.37 1ok3 s ILE 48 CO 0.15 0.11 1.41 0.00 -1.91 0.00 0.00 174.94 174.70 1ok3 n LEU 50 N 9.34 0.00 -4.74 0.00 4.77 0.18 0.15 117.00 126.69 1ok3 n LEU 50 Ca 0.14 -2.10 -0.36 0.00 -0.03 0.00 0.00 56.01 53.66 1ok3 n LEU 50 Cb 0.49 -0.59 0.05 0.00 -2.33 0.00 0.00 43.42 41.03 1ok3 n LEU 50 CO 0.71 -0.93 0.85 -0.54 -1.33 0.00 0.00 177.39 176.15 1ok3 s LYS 51 N -4.95 2.76 0.00 3.23 -0.14 -1.26 -3.06 119.74 116.33 1ok3 s LYS 51 Ca 0.63 1.87 0.00 0.00 -1.36 0.00 0.00 55.97 57.11 1ok3 s LYS 51 Cb -0.04 -1.90 0.00 0.00 -1.68 0.00 0.00 37.83 34.21 1ok3 s LYS 51 CO 0.42 -1.38 0.00 0.41 -0.76 0.00 0.00 175.35 174.04 1ok3 n GLY 52 N 0.57 0.74 2.91 -3.33 0.00 -1.26 -3.83 105.19 100.98 1ok3 n GLY 52 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 1ok3 n GLY 52 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ok3 n SER 53 N 0.00 -2.79 -4.15 1.61 2.88 -1.17 -5.03 113.62 104.97 1ok3 n SER 53 Ca 0.00 -0.46 -0.26 0.00 -1.33 0.00 0.00 58.87 56.82 1ok3 n SER 53 Cb 0.00 -4.01 -0.16 0.00 -0.75 0.00 0.00 64.21 59.29 1ok3 n SER 53 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1ok3 s GLN 54 N -5.26 1.81 0.34 -1.46 0.74 -1.18 -4.73 119.66 109.93 1ok3 s GLN 54 Ca 0.10 -0.64 -0.15 0.00 0.05 0.00 0.00 55.36 54.73 1ok3 s GLN 54 Cb -0.05 -1.59 -0.09 0.00 1.10 0.00 0.00 33.01 32.39 1ok3 s GLN 54 CO 0.56 0.27 0.76 -1.58 -0.55 0.00 0.00 175.29 174.75 1ok3 s TRP 55 N -0.02 3.38 0.80 1.67 0.52 -1.26 0.51 118.94 124.53 1ok3 s TRP 55 Ca -0.03 1.24 -0.11 0.00 0.02 0.00 0.00 56.10 57.22 1ok3 s TRP 55 Cb -0.11 -2.56 0.07 0.00 -1.15 0.00 0.00 33.47 29.72 1ok3 s TRP 55 CO 0.02 0.05 1.09 -1.54 0.02 0.00 0.00 176.95 176.59 1ok3 s SER 56 N -2.37 4.31 0.47 2.95 1.04 -0.02 -4.87 113.70 115.21 1ok3 s SER 56 Ca 0.55 1.69 -0.20 0.00 0.48 0.00 0.00 55.95 58.47 1ok3 s SER 56 Cb -0.10 -2.40 -0.09 0.00 0.10 0.00 0.00 66.02 63.52 1ok3 s SER 56 CO 0.19 -2.14 1.00 -1.81 0.98 0.00 0.00 173.24 171.46 1ok3 s ASP 57 N -3.46 6.59 -0.10 7.02 1.01 -1.26 -4.64 116.67 121.82 1ok3 s ASP 57 Ca 0.61 1.80 -0.09 0.00 0.71 0.00 0.00 52.55 55.59 1ok3 s ASP 57 Cb -0.17 -2.55 0.03 0.00 1.01 0.00 0.00 42.92 41.24 1ok3 s ASP 57 CO 0.56 -0.61 0.27 -0.51 0.21 0.00 0.00 175.17 175.10 1ok3 s ILE 58 N -2.12 -0.01 0.25 0.77 2.07 -1.26 -4.93 121.20 115.97 1ok3 s ILE 58 Ca 0.64 0.02 0.09 0.00 -1.41 0.00 0.00 60.65 59.99 1ok3 s ILE 58 Cb -0.13 -0.39 -0.04 0.00 0.13 0.00 0.00 42.46 42.03 1ok3 s ILE 58 CO 0.18 0.01 0.04 -1.61 -1.91 0.00 0.00 174.94 171.65 1ok3 s GLU 59 N 0.32 2.46 0.16 3.50 8.01 -1.26 -5.04 118.70 126.86 1ok3 s GLU 59 Ca -0.01 -1.27 -0.34 0.00 0.01 0.00 0.00 54.97 53.35 1ok3 s GLU 59 Cb -0.03 -2.29 -0.15 0.00 -4.31 0.00 0.00 34.13 27.35 1ok3 s GLU 59 CO -0.01 0.39 1.39 0.39 0.01 0.00 0.00 175.26 177.43 1ok3 n GLU 60 N -0.82 1.67 0.00 1.61 1.02 -1.26 -4.85 120.64 118.01 1ok3 n GLU 60 Ca -0.07 0.60 0.00 0.00 -0.02 0.00 0.00 57.16 57.67 1ok3 n GLU 60 Cb 0.58 -2.26 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 1ok3 n GLU 60 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 1ok3 n PHE 61 N 2.45 0.00 -4.22 -0.32 -1.74 -1.26 -5.05 117.46 107.32 1ok3 n PHE 61 Ca 0.16 -0.23 -0.29 0.00 -0.56 0.00 0.00 57.45 56.53 1ok3 n PHE 61 Cb 0.26 -0.02 -0.09 0.00 1.52 0.00 0.00 39.48 41.15 1ok3 n PHE 61 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1ok3 s ASN 63 N -2.42 -0.01 -0.64 0.00 2.47 0.24 -4.91 114.94 109.66 1ok3 s ASN 63 Ca 0.23 -0.34 -0.02 0.00 0.42 0.00 0.00 52.86 53.15 1ok3 s ASN 63 Cb -0.11 0.32 0.00 0.00 -1.45 0.00 0.00 41.25 40.02 1ok3 s ASN 63 CO 0.15 -0.60 0.63 0.54 -3.72 0.00 0.00 177.10 174.10 1ok3 n ARG 64 N 0.55 -1.34 -3.89 0.43 3.00 -1.18 0.62 116.66 114.86 1ok3 n ARG 64 Ca -0.18 1.49 -0.09 0.00 -0.01 0.00 0.00 57.85 59.06 1ok3 n ARG 64 Cb 0.60 -5.40 -0.06 0.00 0.00 0.00 0.00 32.46 27.59 1ok3 n ARG 64 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1ok3 s SER 65 N -2.85 0.00 0.82 0.55 0.15 -1.26 -4.16 113.70 106.95 1ok3 s SER 65 Ca 0.03 -0.74 -0.12 0.00 0.70 0.00 0.00 55.95 55.82 1ok3 s SER 65 Cb -0.01 0.43 0.08 0.00 -1.71 0.00 0.00 66.02 64.82 1ok3 s SER 65 CO 0.69 -0.87 1.13 0.00 1.20 0.00 0.00 173.24 175.39 1ok3 s GLU 67 N -5.36 1.40 0.24 0.00 8.01 -1.26 -4.50 118.70 117.23 1ok3 s GLU 67 Ca 0.61 0.12 -0.31 0.00 0.01 0.00 0.00 54.97 55.41 1ok3 s GLU 67 Cb -0.13 -1.88 -0.11 0.00 -4.31 0.00 0.00 34.13 27.70 1ok3 s GLU 67 CO 0.52 -1.99 1.61 0.08 0.01 0.00 0.00 175.26 175.49 1ok3 s VAL 68 N -3.48 2.22 0.18 2.63 1.01 -1.26 -4.86 120.40 116.84 1ok3 s VAL 68 Ca 0.64 0.17 -0.33 0.00 0.00 0.00 0.00 61.98 62.47 1ok3 s VAL 68 Cb -0.12 -3.11 -0.16 0.00 0.00 0.00 0.00 36.38 33.00 1ok3 s VAL 68 CO 0.51 0.02 1.14 -2.65 0.00 0.00 0.00 175.10 174.12 1ok3 n PRO 69 N 2.99 1.13 -1.79 2.72 -0.02 -1.26 -4.88 135.00 133.89 1ok3 n PRO 69 Ca 0.11 0.40 -0.38 0.00 -2.02 0.00 0.00 63.50 61.61 1ok3 n PRO 69 Cb 0.37 -1.88 0.05 0.00 -0.02 0.00 0.00 33.50 32.02 1ok3 n PRO 69 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1ok3 s THR 70 N -0.26 2.10 -0.14 3.45 2.01 -1.26 -4.91 115.64 116.63 1ok3 s THR 70 Ca 0.72 0.07 -0.29 0.00 0.31 0.00 0.00 61.69 62.50 1ok3 s THR 70 Cb -0.85 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 68.59 1ok3 s THR 70 CO 0.53 -0.00 1.64 -0.60 -0.69 0.00 0.00 174.62 175.49 1ok3 s ARG 71 N -3.00 3.96 -0.04 4.92 3.52 -1.26 -5.01 118.95 122.03 1ok3 s ARG 71 Ca 0.74 1.91 -0.06 0.00 -0.13 0.00 0.00 55.73 58.18 1ok3 s ARG 71 Cb -0.39 -4.01 -0.04 0.00 -1.56 0.00 0.00 34.95 28.94 1ok3 s ARG 71 CO 0.46 -1.10 0.20 -0.51 -0.81 0.00 0.00 175.30 173.54 1ok3 s LEU 72 N 4.71 4.38 0.32 -0.88 1.43 -1.26 -5.00 118.68 122.39 1ok3 s LEU 72 Ca 0.72 0.49 0.21 0.00 -1.03 0.00 0.00 54.13 54.52 1ok3 s LEU 72 Cb -0.29 -2.43 0.16 0.00 0.03 0.00 0.00 46.19 43.66 1ok3 s LEU 72 CO 0.29 0.32 1.37 0.78 0.23 0.00 0.00 176.35 179.33 1ok3 h ASN 73 N 4.34 0.00 0.49 2.29 2.35 -2.02 -3.35 115.58 119.68 1ok3 h ASN 73 Ca -0.52 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.08 1ok3 h ASN 73 Cb 1.21 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.55 1ok3 h ASN 73 CO 0.64 0.14 -1.64 -1.54 -1.65 0.00 0.00 177.43 173.38 1ok3 n SER 74 N -3.00 0.57 -3.90 5.81 3.41 -1.26 -4.81 113.62 110.43 1ok3 n SER 74 Ca 0.01 0.24 -0.11 0.00 -0.26 0.00 0.00 58.87 58.76 1ok3 n SER 74 Cb 0.60 0.65 -0.11 0.00 -0.26 0.00 0.00 64.21 65.09 1ok3 n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ok3 s ALA 75 N -2.99 -0.17 0.06 7.33 0.00 -1.26 -0.87 121.76 123.87 1ok3 s ALA 75 Ca -0.05 -0.24 0.09 0.00 0.00 0.00 0.00 51.96 51.76 1ok3 s ALA 75 Cb 0.09 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 1ok3 s ALA 75 CO 0.83 -0.17 -0.23 -1.54 0.00 0.00 0.00 175.76 174.65 1ok3 s SER 76 N -1.24 3.49 0.34 0.00 1.04 0.32 -4.16 113.70 113.49 1ok3 s SER 76 Ca -0.13 -0.55 -0.29 0.00 0.48 0.00 0.00 55.95 55.46 1ok3 s SER 76 Cb -0.08 -0.42 -0.11 0.00 0.10 0.00 0.00 66.02 65.51 1ok3 s SER 76 CO 0.01 0.24 1.50 -0.11 0.98 0.00 0.00 173.24 175.86 1ok3 n LEU 77 N 1.49 4.50 -4.88 2.42 7.94 -1.26 -0.59 117.00 126.62 1ok3 n LEU 77 Ca -0.17 1.20 -0.30 0.00 -1.11 0.00 0.00 56.01 55.64 1ok3 n LEU 77 Cb 0.52 -1.60 0.06 0.00 0.53 0.00 0.00 43.42 42.94 1ok3 n LEU 77 CO 0.25 0.08 0.76 -0.54 -1.11 0.00 0.00 177.39 176.83 1ok3 s LYS 78 N -1.55 2.51 0.30 1.96 1.02 -0.17 -4.52 119.74 119.29 1ok3 s LYS 78 Ca 0.57 0.37 -0.28 0.00 0.02 0.00 0.00 55.97 56.66 1ok3 s LYS 78 Cb -0.49 -1.99 -0.09 0.00 -0.52 0.00 0.00 37.83 34.73 1ok3 s LYS 78 CO 0.59 -1.26 0.98 -1.14 -0.92 0.00 0.00 175.35 173.59 1ok3 s GLN 79 N -5.40 4.64 0.00 1.68 2.00 -1.26 -1.75 119.66 119.57 1ok3 s GLN 79 Ca 0.60 1.48 0.24 0.00 -2.00 0.00 0.00 55.36 55.68 1ok3 s GLN 79 Cb -0.11 -3.00 0.29 0.00 0.80 0.00 0.00 33.01 30.99 1ok3 s GLN 79 CO 0.51 0.31 1.30 -0.35 -0.50 0.00 0.00 175.29 176.56 1ok3 n PRO 80 N 0.91 1.93 -0.25 1.67 -0.04 -1.26 -4.90 135.00 133.05 1ok3 n PRO 80 Ca 0.00 -1.53 0.19 0.00 -0.04 0.00 0.00 63.50 62.12 1ok3 n PRO 80 Cb 0.48 -1.47 0.50 0.00 -0.04 0.00 0.00 33.50 32.97 1ok3 n PRO 80 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1ok3 h TYR 81 N 3.74 0.57 0.00 0.54 -1.99 -1.71 -1.56 116.97 116.56 1ok3 h TYR 81 Ca 0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1ok3 h TYR 81 Cb 0.86 -0.17 0.00 0.00 2.00 0.00 0.00 36.73 39.41 1ok3 h TYR 81 CO 0.00 0.15 0.02 0.97 -0.00 0.00 0.00 178.16 179.30 1ok3 h ILE 82 N 0.43 0.00 -0.14 -2.88 2.10 -1.59 -1.62 117.51 113.81 1ok3 h ILE 82 Ca 0.48 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.42 1ok3 h ILE 82 Cb 1.16 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 37.75 1ok3 h ILE 82 CO -0.19 0.00 0.00 0.35 -1.08 0.00 0.00 178.15 177.23 1ok3 n THR 83 N -2.87 0.36 -3.22 2.19 -2.24 -0.59 -5.03 114.28 102.87 1ok3 n THR 83 Ca -0.03 -0.68 -0.23 0.00 -2.27 0.00 0.00 64.05 60.84 1ok3 n THR 83 Cb 0.08 0.98 -0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1ok3 n THR 83 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1ok3 s GLN 84 N -0.98 3.33 0.00 -0.78 -0.21 -0.61 -5.00 119.66 115.41 1ok3 s GLN 84 Ca 0.17 -0.39 0.00 0.00 0.02 0.00 0.00 55.36 55.16 1ok3 s GLN 84 Cb 0.11 -2.62 0.00 0.00 1.00 0.00 0.00 33.01 31.49 1ok3 s GLN 84 CO 0.15 -0.01 0.00 0.27 -2.12 0.00 0.00 175.29 173.58 1ok3 n ASN 85 N -1.90 0.00 -4.47 5.90 0.23 -1.26 -4.96 115.26 108.80 1ok3 n ASN 85 Ca -0.02 -0.15 -0.43 0.00 -0.53 0.00 0.00 54.58 53.45 1ok3 n ASN 85 Cb 0.57 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.17 1ok3 n ASN 85 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1ok3 s TYR 86 N 0.00 3.23 -0.46 -2.53 6.14 -1.26 -4.85 117.35 117.62 1ok3 s TYR 86 Ca 0.00 -0.54 0.07 0.00 0.64 0.00 0.00 57.07 57.24 1ok3 s TYR 86 Cb 0.00 -2.62 0.24 0.00 0.42 0.00 0.00 41.96 40.00 1ok3 s TYR 86 CO 0.00 -0.59 0.55 1.19 0.64 0.00 0.00 175.55 177.34 1ok3 n PHE 87 N 5.21 0.60 -0.71 4.97 3.01 -1.26 -5.04 117.46 124.24 1ok3 n PHE 87 Ca -0.11 -3.69 -0.31 0.00 1.01 0.00 0.00 57.45 54.35 1ok3 n PHE 87 Cb 0.47 -0.34 0.17 0.00 -0.01 0.00 0.00 39.48 39.77 1ok3 n PHE 87 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1ok3 s PRO 88 N -1.36 0.85 0.12 -1.08 0.04 -1.26 -0.70 135.00 131.62 1ok3 s PRO 88 Ca 0.36 1.45 -0.35 0.00 0.04 0.00 0.00 61.00 62.49 1ok3 s PRO 88 Cb 0.14 -1.72 -0.16 0.00 0.04 0.00 0.00 34.50 32.81 1ok3 s PRO 88 CO -0.10 -2.71 1.35 0.28 0.04 0.00 0.00 177.00 175.86 1ok3 n VAL 89 N -4.28 0.21 0.00 -0.36 0.31 -1.26 -1.52 118.33 111.43 1ok3 n VAL 89 Ca 0.11 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1ok3 n VAL 89 Cb 0.52 -0.98 0.00 0.00 -0.91 0.00 0.00 33.84 32.47 1ok3 n VAL 89 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ok3 n GLY 90 N 2.57 2.63 3.70 2.92 0.00 0.07 -5.01 105.19 112.07 1ok3 n GLY 90 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1ok3 n GLY 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ok3 s THR 91 N -2.67 2.49 -0.13 2.61 2.01 -0.57 -4.68 115.64 114.69 1ok3 s THR 91 Ca 0.00 0.18 0.01 0.00 0.31 0.00 0.00 61.69 62.19 1ok3 s THR 91 Cb 0.00 -3.11 -0.01 0.00 0.01 0.00 0.00 72.50 69.39 1ok3 s THR 91 CO 0.00 0.01 -0.17 0.54 -0.69 0.00 0.00 174.62 174.31 1ok3 s VAL 92 N 2.03 2.65 0.27 3.82 0.11 -1.26 -0.32 120.40 127.70 1ok3 s VAL 92 Ca 0.76 -0.80 0.08 0.00 -2.93 0.00 0.00 61.98 59.10 1ok3 s VAL 92 Cb -0.46 -2.09 -0.04 0.00 -1.53 0.00 0.00 36.38 32.27 1ok3 s VAL 92 CO 0.34 0.53 0.09 0.68 -3.33 0.00 0.00 175.10 173.41 1ok3 s VAL 93 N 0.47 3.78 0.08 2.04 -7.23 -0.37 -4.96 120.40 114.22 1ok3 s VAL 93 Ca -0.12 -1.70 0.10 0.00 -1.81 0.00 0.00 61.98 58.45 1ok3 s VAL 93 Cb -0.16 -3.07 -0.03 0.00 0.56 0.00 0.00 36.38 33.67 1ok3 s VAL 93 CO 0.05 -0.35 -0.25 -0.70 -0.31 0.00 0.00 175.10 173.54 1ok3 s GLU 94 N -3.76 1.66 0.34 4.82 2.12 -1.26 -1.97 118.70 120.65 1ok3 s GLU 94 Ca 0.33 -1.20 0.08 0.00 0.36 0.00 0.00 54.97 54.54 1ok3 s GLU 94 Cb -0.07 -1.98 -0.04 0.00 0.26 0.00 0.00 34.13 32.30 1ok3 s GLU 94 CO 0.22 0.49 0.13 0.71 -0.54 0.00 0.00 175.26 176.27 1ok3 s TYR 95 N -0.94 2.69 0.03 5.30 1.51 0.50 -1.00 117.35 125.43 1ok3 s TYR 95 Ca 0.13 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.82 1ok3 s TYR 95 Cb -0.10 -1.62 -0.02 0.00 -0.11 0.00 0.00 41.96 40.11 1ok3 s TYR 95 CO 0.05 0.35 -0.05 -1.83 -1.11 0.00 0.00 175.55 172.96 1ok3 s GLU 96 N -3.83 0.39 0.48 -0.62 -1.05 0.24 -4.76 118.70 109.55 1ok3 s GLU 96 Ca 0.37 -0.63 -0.23 0.00 -0.15 0.00 0.00 54.97 54.33 1ok3 s GLU 96 Cb -0.02 -0.09 -0.07 0.00 -0.44 0.00 0.00 34.13 33.51 1ok3 s GLU 96 CO 0.22 0.00 1.26 0.00 0.95 0.00 0.00 175.26 177.70 1ok3 s ARG 98 N -2.66 1.52 -0.07 0.00 0.52 -0.05 -4.71 118.95 113.51 1ok3 s ARG 98 Ca 0.65 -0.98 -0.07 0.00 -0.52 0.00 0.00 55.73 54.80 1ok3 s ARG 98 Cb -0.35 -2.25 -0.04 0.00 0.52 0.00 0.00 34.95 32.83 1ok3 s ARG 98 CO 0.43 -1.60 0.20 -1.25 0.02 0.00 0.00 175.30 173.10 1ok3 s PRO 99 N -5.26 3.53 -0.97 3.54 0.04 -1.26 -0.87 135.00 133.74 1ok3 s PRO 99 Ca 0.67 -0.07 -0.03 0.00 0.04 0.00 0.00 61.00 61.61 1ok3 s PRO 99 Cb -0.05 -3.16 0.26 0.00 0.04 0.00 0.00 34.50 31.59 1ok3 s PRO 99 CO 0.46 0.73 1.03 0.41 0.04 0.00 0.00 177.00 179.67 1ok3 n GLY 100 N 1.67 4.46 3.51 0.56 0.00 -1.26 -5.04 105.19 109.10 1ok3 n GLY 100 Ca -0.16 -2.63 -0.24 0.00 0.00 0.00 0.00 46.02 42.98 1ok3 n GLY 100 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ok3 s TYR 101 N -1.81 2.38 0.05 1.61 2.02 -0.05 -0.68 117.35 120.86 1ok3 s TYR 101 Ca 0.31 -0.34 -0.01 0.00 -0.37 0.00 0.00 57.07 56.65 1ok3 s TYR 101 Cb -0.03 -1.10 -0.03 0.00 -0.40 0.00 0.00 41.96 40.40 1ok3 s TYR 101 CO -0.05 0.67 -0.02 -0.98 -1.57 0.00 0.00 175.55 173.61 1ok3 s ARG 102 N -3.56 0.57 0.44 -0.62 1.70 0.13 -4.63 118.95 112.99 1ok3 s ARG 102 Ca 0.31 -1.08 -0.25 0.00 -0.47 0.00 0.00 55.73 54.24 1ok3 s ARG 102 Cb -0.04 0.20 -0.08 0.00 -0.57 0.00 0.00 34.95 34.46 1ok3 s ARG 102 CO 0.16 -0.11 1.35 1.03 -1.08 0.00 0.00 175.30 176.65 1ok3 s ARG 103 N -3.43 3.75 -0.74 3.89 1.81 -1.26 0.38 118.95 123.35 1ok3 s ARG 103 Ca 0.02 2.24 -0.11 0.00 -1.72 0.00 0.00 55.73 56.17 1ok3 s ARG 103 Cb 0.04 -2.63 0.19 0.00 -0.45 0.00 0.00 34.95 32.10 1ok3 s ARG 103 CO -0.08 -0.70 0.64 -2.00 -0.68 0.00 0.00 175.30 172.47 1ok3 s GLU 104 N -2.43 3.21 0.52 3.54 2.56 0.16 -4.77 118.70 121.50 1ok3 s GLU 104 Ca 0.61 -2.41 0.37 0.00 0.00 0.00 0.00 54.97 53.54 1ok3 s GLU 104 Cb -0.40 -4.19 1.54 0.00 2.00 0.00 0.00 34.13 33.08 1ok3 s GLU 104 CO 0.51 -1.25 1.75 -1.35 -0.56 0.00 0.00 175.26 174.35 1ok3 h PRO 105 N 7.65 0.04 0.00 4.30 0.11 -1.94 0.11 132.00 142.28 1ok3 h PRO 105 Ca 0.03 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1ok3 h PRO 105 Cb 1.02 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1ok3 h PRO 105 CO 0.76 0.03 0.00 -1.13 -0.21 0.00 0.00 178.00 177.45 1ok3 n SER 106 N -4.21 0.00 -4.43 -2.05 3.41 -1.26 -4.75 113.62 100.33 1ok3 n SER 106 Ca 0.30 0.46 -0.31 0.00 -0.26 0.00 0.00 58.87 59.06 1ok3 n SER 106 Cb 1.37 -0.48 -0.13 0.00 -0.26 0.00 0.00 64.21 64.71 1ok3 n SER 106 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ok3 s LEU 107 N -2.96 2.50 0.21 1.04 1.43 0.37 -5.11 118.68 116.16 1ok3 s LEU 107 Ca 0.09 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.44 1ok3 s LEU 107 Cb 0.11 -1.46 -0.08 0.00 0.03 0.00 0.00 46.19 44.79 1ok3 s LEU 107 CO 0.31 0.26 1.07 -0.55 0.23 0.00 0.00 176.35 177.67 1ok3 s SER 108 N -1.32 7.33 -0.51 2.29 0.15 -1.26 -4.81 113.70 115.57 1ok3 s SER 108 Ca 0.14 2.10 0.01 0.00 0.70 0.00 0.00 55.95 58.89 1ok3 s SER 108 Cb -0.10 -2.61 0.48 0.00 -1.71 0.00 0.00 66.02 62.08 1ok3 s SER 108 CO 0.04 -0.14 1.94 -0.81 1.20 0.00 0.00 173.24 175.47 1ok3 n PRO 109 N 1.99 2.32 -4.63 5.44 -0.04 -1.26 -4.65 135.00 134.17 1ok3 n PRO 109 Ca 0.01 -2.80 -0.27 0.00 -0.04 0.00 0.00 63.50 60.40 1ok3 n PRO 109 Cb 0.46 -2.10 -0.14 0.00 -0.04 0.00 0.00 33.50 31.68 1ok3 n PRO 109 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1ok3 s LYS 110 N -3.18 1.48 0.01 0.54 1.02 -1.26 -0.37 119.74 117.97 1ok3 s LYS 110 Ca 0.54 -1.09 0.07 0.00 0.02 0.00 0.00 55.97 55.51 1ok3 s LYS 110 Cb 0.44 -1.70 -0.02 0.00 -0.52 0.00 0.00 37.83 36.03 1ok3 s LYS 110 CO 0.04 0.43 -0.20 -0.51 -0.92 0.00 0.00 175.35 174.18 1ok3 s LEU 111 N -1.45 2.10 -0.04 3.17 1.43 -0.83 -4.98 118.68 118.08 1ok3 s LEU 111 Ca 0.10 -0.44 0.05 0.00 -1.03 0.00 0.00 54.13 52.81 1ok3 s LEU 111 Cb -0.10 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.12 1ok3 s LEU 111 CO 0.03 0.20 -0.17 -0.89 0.23 0.00 0.00 176.35 175.74 1ok3 s THR 112 N -0.63 2.81 -0.30 5.49 2.01 -1.26 -1.24 115.64 122.52 1ok3 s THR 112 Ca 0.07 -0.82 -0.29 0.00 0.31 0.00 0.00 61.69 60.96 1ok3 s THR 112 Cb -0.08 -2.07 0.01 0.00 0.01 0.00 0.00 72.50 70.37 1ok3 s THR 112 CO 0.00 0.59 1.09 0.00 -0.69 0.00 0.00 174.62 175.61 1ok3 s LEU 114 N 3.61 3.13 0.55 0.00 1.02 0.14 -0.75 118.68 126.39 1ok3 s LEU 114 Ca 0.46 0.80 0.29 0.00 0.02 0.00 0.00 54.13 55.70 1ok3 s LEU 114 Cb -0.13 -3.61 1.46 0.00 0.02 0.00 0.00 46.19 43.93 1ok3 s LEU 114 CO 0.14 -1.16 1.93 1.56 0.02 0.00 0.00 176.35 178.85 1ok3 h GLN 115 N -0.31 0.00 -0.18 1.70 4.20 -1.96 0.13 115.11 118.69 1ok3 h GLN 115 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1ok3 h GLN 115 Cb 1.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.04 1ok3 h GLN 115 CO 0.61 0.00 0.00 0.27 -0.67 0.00 0.00 178.83 179.04 1ok3 n ASN 116 N -4.14 1.06 -0.97 1.46 0.23 -1.26 -4.88 115.26 106.76 1ok3 n ASN 116 Ca 0.12 -1.90 -0.08 0.00 -0.53 0.00 0.00 54.58 52.19 1ok3 n ASN 116 Cb 0.75 -0.12 -0.00 0.00 -2.08 0.00 0.00 39.78 38.33 1ok3 n ASN 116 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1ok3 n LEU 117 N 0.04 -1.42 -4.22 -4.53 4.77 0.44 -5.04 117.00 107.04 1ok3 n LEU 117 Ca 0.09 -0.02 -0.21 0.00 -0.03 0.00 0.00 56.01 55.84 1ok3 n LEU 117 Cb 0.18 -1.47 -0.12 0.00 -2.33 0.00 0.00 43.42 39.68 1ok3 n LEU 117 CO 0.06 -0.07 -0.49 -0.54 -1.33 0.00 0.00 177.39 175.02 1ok3 s LYS 118 N -4.45 0.99 0.36 3.23 1.02 -1.24 -4.38 119.74 115.25 1ok3 s LYS 118 Ca 0.01 -1.02 -0.25 0.00 0.02 0.00 0.00 55.97 54.72 1ok3 s LYS 118 Cb -0.00 -1.11 -0.10 0.00 -0.52 0.00 0.00 37.83 36.10 1ok3 s LYS 118 CO 0.01 0.26 1.00 -1.58 -0.92 0.00 0.00 175.35 174.12 1ok3 s TRP 119 N -1.16 3.49 1.13 3.18 0.52 -1.26 0.24 118.94 125.08 1ok3 s TRP 119 Ca 0.02 1.71 -0.16 0.00 0.02 0.00 0.00 56.10 57.69 1ok3 s TRP 119 Cb -0.10 -3.03 0.16 0.00 -1.15 0.00 0.00 33.47 29.35 1ok3 s TRP 119 CO 0.03 -0.21 0.35 -1.13 0.02 0.00 0.00 176.95 176.01 1ok3 n SER 120 N 0.30 -2.14 -4.74 2.95 3.41 0.63 -4.87 113.62 109.15 1ok3 n SER 120 Ca 0.03 -0.11 -0.41 0.00 -0.26 0.00 0.00 58.87 58.12 1ok3 n SER 120 Cb 0.50 -1.07 -0.02 0.00 -0.26 0.00 0.00 64.21 63.35 1ok3 n SER 120 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ok3 s THR 121 N -2.30 2.56 0.02 6.66 2.01 -1.26 -4.85 115.64 118.48 1ok3 s THR 121 Ca 0.60 0.47 -0.26 0.00 0.31 0.00 0.00 61.69 62.81 1ok3 s THR 121 Cb -0.17 -3.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.00 1ok3 s THR 121 CO 0.66 0.07 0.81 0.00 -0.69 0.00 0.00 174.62 175.47 1ok3 s ALA 122 N 0.10 3.31 0.35 7.40 0.00 -1.26 -5.04 121.76 126.61 1ok3 s ALA 122 Ca 0.61 0.33 0.09 0.00 0.00 0.00 0.00 51.96 52.99 1ok3 s ALA 122 Cb -0.43 -3.08 -0.06 0.00 0.00 0.00 0.00 23.12 19.55 1ok3 s ALA 122 CO 0.43 -0.04 -0.03 0.14 0.00 0.00 0.00 175.76 176.26 1ok3 s VAL 123 N 0.36 2.42 -1.50 0.00 -7.23 -1.26 -5.04 120.40 108.14 1ok3 s VAL 123 Ca 0.42 -2.06 -0.09 0.00 -1.81 0.00 0.00 61.98 58.43 1ok3 s VAL 123 Cb -0.20 -2.75 0.00 0.00 0.56 0.00 0.00 36.38 33.99 1ok3 s VAL 123 CO 0.24 -0.18 2.63 -0.62 -0.31 0.00 0.00 175.10 176.85 1ok3 n GLU 124 N -0.90 3.78 0.22 4.82 4.71 -1.26 -4.61 120.64 127.40 1ok3 n GLU 124 Ca -0.04 -2.67 0.15 0.00 -0.01 0.00 0.00 57.16 54.59 1ok3 n GLU 124 Cb 0.63 -2.85 0.57 0.00 -1.01 0.00 0.00 31.44 28.79 1ok3 n GLU 124 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1ok3 h PHE 125 N 5.12 0.00 -3.49 -0.32 -5.15 -1.87 -3.39 116.94 107.83 1ok3 h PHE 125 Ca 0.75 0.00 -0.65 0.00 -0.20 0.00 0.00 57.97 57.88 1ok3 h PHE 125 Cb 0.37 0.00 -0.37 0.00 0.22 0.00 0.00 35.95 36.17 1ok3 h PHE 125 CO 1.71 0.00 -0.82 0.00 -2.00 0.00 0.00 178.31 177.20 1ok3 s LYS 127 N 1.28 2.86 0.09 0.00 -2.85 0.16 -4.81 119.74 116.47 1ok3 s LYS 127 Ca -0.02 -1.15 -0.31 0.00 -1.00 0.00 0.00 55.97 53.49 1ok3 s LYS 127 Cb -0.17 -2.55 -0.08 0.00 -2.06 0.00 0.00 37.83 32.98 1ok3 s LYS 127 CO -0.08 0.25 1.42 0.15 0.10 0.00 0.00 175.35 177.19 1ok3 s LYS 128 N -3.93 4.30 0.80 1.78 1.02 -1.26 0.23 119.74 122.68 1ok3 s LYS 128 Ca 0.37 2.09 -0.11 0.00 0.02 0.00 0.00 55.97 58.34 1ok3 s LYS 128 Cb -0.07 -3.32 0.08 0.00 -0.52 0.00 0.00 37.83 33.99 1ok3 s LYS 128 CO 0.26 -0.49 1.11 0.15 -0.92 0.00 0.00 175.35 175.47 1ok3 s LYS 129 N 1.43 1.93 -0.06 1.68 1.02 0.14 -4.65 119.74 121.24 1ok3 s LYS 129 Ca 0.65 1.33 -0.02 0.00 0.02 0.00 0.00 55.97 57.95 1ok3 s LYS 129 Cb -0.36 -1.85 -0.04 0.00 -0.52 0.00 0.00 37.83 35.06 1ok3 s LYS 129 CO 0.30 -1.91 0.05 0.45 -0.92 0.00 0.00 175.35 173.31 1ok3 s SER 130 N -3.06 5.52 0.63 2.83 0.15 -1.26 0.31 113.70 118.82 1ok3 s SER 130 Ca 0.64 0.17 -0.09 0.00 0.70 0.00 0.00 55.95 57.38 1ok3 s SER 130 Cb -0.20 -1.59 -0.00 0.00 -1.71 0.00 0.00 66.02 62.52 1ok3 s SER 130 CO 0.55 0.34 0.99 0.00 1.20 0.00 0.00 173.24 176.31 1ok3 s PRO 132 N -5.14 1.29 0.12 0.00 0.02 -1.26 -4.90 135.00 125.13 1ok3 s PRO 132 Ca 0.55 1.56 -0.33 0.00 0.02 0.00 0.00 61.00 62.80 1ok3 s PRO 132 Cb -0.11 -1.76 -0.13 0.00 0.02 0.00 0.00 34.50 32.53 1ok3 s PRO 132 CO 0.49 -2.43 1.69 -1.71 -0.33 0.00 0.00 177.00 174.70 1ok3 n ASN 133 N -3.94 3.40 0.27 2.53 2.85 -1.26 -4.85 115.26 114.26 1ok3 n ASN 133 Ca 0.12 1.05 0.14 0.00 -0.11 0.00 0.00 54.58 55.78 1ok3 n ASN 133 Cb 0.52 -1.45 0.76 0.00 1.24 0.00 0.00 39.78 40.85 1ok3 n ASN 133 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ok3 h PRO 134 N 6.99 0.00 0.00 1.20 0.11 -2.00 -3.48 132.00 134.82 1ok3 h PRO 134 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ok3 h PRO 134 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1ok3 h PRO 134 CO 0.92 0.10 0.00 0.41 -0.21 0.00 0.00 178.00 179.21 1ok3 n GLY 135 N -0.57 0.50 3.23 -0.55 0.00 -1.26 -4.94 105.19 101.60 1ok3 n GLY 135 Ca -0.01 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.87 1ok3 n GLY 135 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ok3 s GLU 136 N 0.00 0.69 -0.22 1.61 2.56 -1.26 -4.97 118.70 117.11 1ok3 s GLU 136 Ca 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 54.97 54.63 1ok3 s GLU 136 Cb 0.00 0.30 -0.00 0.00 2.00 0.00 0.00 34.13 36.43 1ok3 s GLU 136 CO 0.00 -0.20 -0.06 0.42 -0.56 0.00 0.00 175.26 174.87 1ok3 s ILE 137 N -1.70 3.23 0.05 -3.70 1.01 -1.26 -5.07 121.20 113.75 1ok3 s ILE 137 Ca -0.11 -0.57 -0.30 0.00 0.00 0.00 0.00 60.65 59.66 1ok3 s ILE 137 Cb -0.04 -2.48 -0.08 0.00 0.01 0.00 0.00 42.46 39.88 1ok3 s ILE 137 CO 0.02 0.41 1.62 -0.60 0.00 0.00 0.00 174.94 176.39 1ok3 s ARG 138 N 1.45 4.21 -0.58 2.79 3.52 -1.26 -2.01 118.95 127.07 1ok3 s ARG 138 Ca 0.05 2.26 0.00 0.00 -0.13 0.00 0.00 55.73 57.92 1ok3 s ARG 138 Cb -0.14 -3.64 0.00 0.00 -1.56 0.00 0.00 34.95 29.60 1ok3 s ARG 138 CO -0.04 -0.72 0.00 0.09 -0.81 0.00 0.00 175.30 173.81 1ok3 n ASN 139 N 5.75 -3.95 -0.58 -2.12 3.02 -1.26 -4.44 115.26 111.68 1ok3 n ASN 139 Ca 0.16 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.84 1ok3 n ASN 139 Cb 0.41 -1.93 0.00 0.00 -0.61 0.00 0.00 39.78 37.66 1ok3 n ASN 139 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ok3 n GLY 140 N -1.93 4.10 3.21 7.41 0.00 -0.85 -0.53 105.19 116.59 1ok3 n GLY 140 Ca -0.05 -1.43 -0.10 0.00 0.00 0.00 0.00 46.02 44.44 1ok3 n GLY 140 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ok3 s GLN 141 N -0.74 0.78 -0.14 1.61 -0.21 0.74 -4.63 119.66 117.07 1ok3 s GLN 141 Ca 0.00 -0.71 0.02 0.00 0.02 0.00 0.00 55.36 54.68 1ok3 s GLN 141 Cb 0.00 0.33 0.00 0.00 1.00 0.00 0.00 33.01 34.34 1ok3 s GLN 141 CO 0.00 -0.24 -0.19 0.42 -2.12 0.00 0.00 175.29 173.16 1ok3 s ILE 142 N -3.04 2.40 -0.29 1.08 1.01 -1.26 -1.39 121.20 119.71 1ok3 s ILE 142 Ca -0.01 -0.87 -0.15 0.00 0.00 0.00 0.00 60.65 59.62 1ok3 s ILE 142 Cb 0.01 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.47 1ok3 s ILE 142 CO -0.06 0.53 0.37 -0.62 0.00 0.00 0.00 174.94 175.16 1ok3 s ASP 143 N 0.71 6.24 -0.66 3.58 -1.08 0.20 -4.94 116.67 120.72 1ok3 s ASP 143 Ca -0.08 0.18 0.03 0.00 -0.52 0.00 0.00 52.55 52.15 1ok3 s ASP 143 Cb -0.16 -2.21 0.16 0.00 -1.46 0.00 0.00 42.92 39.25 1ok3 s ASP 143 CO 0.01 -0.22 0.45 -0.69 0.52 0.00 0.00 175.17 175.23 1ok3 s VAL 144 N 2.07 3.09 0.29 1.11 1.01 -1.26 -1.26 120.40 125.46 1ok3 s VAL 144 Ca 0.14 -3.75 0.06 0.00 0.00 0.00 0.00 61.98 58.43 1ok3 s VAL 144 Cb -0.16 -3.04 0.05 0.00 0.00 0.00 0.00 36.38 33.23 1ok3 s VAL 144 CO 0.10 -0.93 1.71 1.55 0.00 0.00 0.00 175.10 177.54 1ok3 h PRO 145 N 6.04 0.30 -1.29 2.72 0.13 -1.96 -3.38 132.00 134.56 1ok3 h PRO 145 Ca 0.05 -0.13 -0.39 0.00 -0.87 0.00 0.00 66.00 64.66 1ok3 h PRO 145 Cb 0.83 -0.01 -0.33 0.00 0.13 0.00 0.00 31.00 31.62 1ok3 h PRO 145 CO 0.73 0.63 -0.99 0.41 -0.23 0.00 0.00 178.00 178.54 1ok3 n GLY 146 N -0.26 2.49 4.50 1.56 0.00 -1.26 -5.14 105.19 107.08 1ok3 n GLY 146 Ca -0.01 -1.17 0.03 0.00 0.00 0.00 0.00 46.02 44.87 1ok3 n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ok3 n GLY 147 N 0.18 -1.83 0.75 -0.02 0.00 -1.26 -4.69 105.19 98.32 1ok3 n GLY 147 Ca 0.17 -1.31 0.05 0.00 0.00 0.00 0.00 46.02 44.93 1ok3 n GLY 147 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ok3 n ILE 148 N -1.38 0.94 -1.89 -0.61 -5.35 -1.26 -4.68 119.36 105.13 1ok3 n ILE 148 Ca 0.00 -1.59 -0.29 0.00 -0.27 0.00 0.00 62.75 60.59 1ok3 n ILE 148 Cb 0.10 0.32 0.07 0.00 -1.74 0.00 0.00 39.64 38.39 1ok3 n ILE 148 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1ok3 s LEU 149 N -1.40 2.67 -0.15 7.28 1.43 -1.26 -0.69 118.68 126.55 1ok3 s LEU 149 Ca 0.27 0.94 -0.39 0.00 -1.03 0.00 0.00 54.13 53.91 1ok3 s LEU 149 Cb 0.27 -3.56 -0.16 0.00 0.03 0.00 0.00 46.19 42.77 1ok3 s LEU 149 CO -0.06 -1.66 1.58 0.33 0.23 0.00 0.00 176.35 176.76 1ok3 n PHE 150 N -3.19 1.81 0.00 0.29 -0.00 0.15 -0.76 117.46 115.76 1ok3 n PHE 150 Ca 0.08 0.61 0.00 0.00 -0.00 0.00 0.00 57.45 58.14 1ok3 n PHE 150 Cb 0.59 -2.39 0.00 0.00 -0.00 0.00 0.00 39.48 37.68 1ok3 n PHE 150 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ok3 n GLY 151 N 3.52 0.09 3.80 7.13 0.00 0.37 -4.93 105.19 115.17 1ok3 n GLY 151 Ca 0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 1ok3 n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ok3 s ALA 152 N -2.00 2.69 0.00 4.61 0.00 0.06 -4.78 121.76 122.35 1ok3 s ALA 152 Ca 0.00 0.35 0.07 0.00 0.00 0.00 0.00 51.96 52.39 1ok3 s ALA 152 Cb 0.00 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 1ok3 s ALA 152 CO 0.00 -0.94 -0.22 0.99 0.00 0.00 0.00 175.76 175.58 1ok3 s THR 153 N -2.55 1.78 0.10 0.00 2.01 -1.26 -1.05 115.64 114.67 1ok3 s THR 153 Ca 0.63 -1.06 0.04 0.00 0.31 0.00 0.00 61.69 61.61 1ok3 s THR 153 Cb -0.16 -1.50 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 1ok3 s THR 153 CO 0.41 0.42 -0.11 0.27 -0.69 0.00 0.00 174.62 174.92 1ok3 s ILE 154 N -0.62 1.00 0.15 1.82 -4.36 0.15 -4.41 121.20 114.93 1ok3 s ILE 154 Ca 0.09 -1.62 0.07 0.00 -0.26 0.00 0.00 60.65 58.93 1ok3 s ILE 154 Cb -0.09 -1.35 -0.04 0.00 1.25 0.00 0.00 42.46 42.23 1ok3 s ILE 154 CO 0.00 -0.51 -0.16 -0.94 0.24 0.00 0.00 174.94 173.57 1ok3 s SER 155 N -2.38 2.36 0.06 4.36 1.04 -0.39 -0.83 113.70 117.92 1ok3 s SER 155 Ca 0.05 -0.84 0.09 0.00 0.48 0.00 0.00 55.95 55.73 1ok3 s SER 155 Cb -0.04 -0.11 -0.03 0.00 0.10 0.00 0.00 66.02 65.94 1ok3 s SER 155 CO 0.01 -0.09 -0.25 -0.36 0.98 0.00 0.00 173.24 173.52 1ok3 s PHE 156 N -2.12 2.35 0.06 5.02 2.99 -0.40 0.62 117.98 126.49 1ok3 s PHE 156 Ca 0.13 -0.39 -0.04 0.00 0.00 0.00 0.00 56.93 56.63 1ok3 s PHE 156 Cb -0.05 -1.37 -0.02 0.00 0.00 0.00 0.00 43.02 41.58 1ok3 s PHE 156 CO 0.05 0.19 0.05 -1.54 -0.00 0.00 0.00 175.22 173.97 1ok3 s SER 157 N -1.46 0.33 -0.06 1.36 1.04 -0.49 -4.84 113.70 109.58 1ok3 s SER 157 Ca 0.13 -0.82 0.04 0.00 0.48 0.00 0.00 55.95 55.77 1ok3 s SER 157 Cb -0.10 0.24 -0.02 0.00 0.10 0.00 0.00 66.02 66.24 1ok3 s SER 157 CO 0.03 -0.62 -0.16 0.00 0.98 0.00 0.00 173.24 173.47 1ok3 s ASN 159 N -0.55 2.37 0.04 0.00 0.02 0.31 -4.83 114.94 112.31 1ok3 s ASN 159 Ca 0.08 1.80 -0.34 0.00 -1.02 0.00 0.00 52.86 53.37 1ok3 s ASN 159 Cb -0.11 -2.40 -0.13 0.00 0.02 0.00 0.00 41.25 38.63 1ok3 s ASN 159 CO 0.01 -3.38 1.70 0.41 0.02 0.00 0.00 177.10 175.85 1ok3 n THR 160 N -4.39 0.25 0.00 1.60 -1.04 -1.26 -1.34 114.28 108.10 1ok3 n THR 160 Ca 0.08 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1ok3 n THR 160 Cb 0.53 -1.63 0.00 0.00 -1.82 0.00 0.00 70.33 67.41 1ok3 n THR 160 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ok3 n GLY 161 N 3.80 0.50 3.21 3.41 0.00 -1.26 -5.02 105.19 109.82 1ok3 n GLY 161 Ca 0.20 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.00 1ok3 n GLY 161 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ok3 s TYR 162 N -2.00 1.49 -0.10 1.61 1.51 -0.45 -0.69 117.35 118.72 1ok3 s TYR 162 Ca 0.00 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 55.67 1ok3 s TYR 162 Cb 0.00 -0.86 -0.02 0.00 -0.11 0.00 0.00 41.96 40.97 1ok3 s TYR 162 CO 0.00 0.10 -0.12 0.21 -1.11 0.00 0.00 175.55 174.63 1ok3 s LYS 163 N -1.49 3.11 0.03 -0.62 2.20 1.04 -4.63 119.74 119.38 1ok3 s LYS 163 Ca 0.03 -0.66 -0.30 0.00 -0.36 0.00 0.00 55.97 54.68 1ok3 s LYS 163 Cb -0.09 -2.58 -0.04 0.00 -1.51 0.00 0.00 37.83 33.61 1ok3 s LYS 163 CO 0.02 0.37 1.07 -1.17 -0.36 0.00 0.00 175.35 175.28 1ok3 s LEU 164 N -0.05 4.38 -0.17 5.43 0.20 -1.26 0.32 118.68 127.53 1ok3 s LEU 164 Ca -0.02 1.82 0.00 0.00 0.69 0.00 0.00 54.13 56.61 1ok3 s LEU 164 Cb -0.14 -3.57 0.04 0.00 -0.43 0.00 0.00 46.19 42.09 1ok3 s LEU 164 CO 0.04 -0.34 -0.08 -0.36 -0.29 0.00 0.00 176.35 175.32 1ok3 s PHE 165 N 0.97 1.96 -1.92 5.38 0.08 0.91 -4.91 117.98 120.45 1ok3 s PHE 165 Ca 0.54 -1.25 0.00 0.00 0.12 0.00 0.00 56.93 56.35 1ok3 s PHE 165 Cb -0.25 -1.44 0.00 0.00 -0.57 0.00 0.00 43.02 40.76 1ok3 s PHE 165 CO 0.29 -0.66 0.00 0.41 -0.10 0.00 0.00 175.22 175.16 1ok3 n GLY 166 N 4.81 0.56 3.79 4.36 0.00 -1.26 0.68 105.19 118.12 1ok3 n GLY 166 Ca -0.13 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.54 1ok3 n GLY 166 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ok3 s SER 167 N -4.00 6.96 0.00 1.61 0.01 -1.26 -4.97 113.70 112.05 1ok3 s SER 167 Ca 0.00 1.94 0.23 0.00 1.31 0.00 0.00 55.95 59.43 1ok3 s SER 167 Cb 0.00 -2.58 0.10 0.00 0.21 0.00 0.00 66.02 63.75 1ok3 s SER 167 CO 0.00 -0.34 1.16 0.35 0.41 0.00 0.00 173.24 174.82 1ok3 n THR 168 N 0.07 0.00 -3.64 1.44 -2.24 -1.26 -4.47 114.28 104.19 1ok3 n THR 168 Ca 0.04 -0.28 -0.09 0.00 -2.27 0.00 0.00 64.05 61.44 1ok3 n THR 168 Cb 0.50 1.21 -0.02 0.00 -2.10 0.00 0.00 70.33 69.93 1ok3 n THR 168 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ok3 s SER 169 N -2.40 -0.41 -0.02 3.42 1.04 -1.26 -1.28 113.70 112.79 1ok3 s SER 169 Ca 0.21 -0.30 -0.12 0.00 0.48 0.00 0.00 55.95 56.21 1ok3 s SER 169 Cb 0.18 0.66 0.02 0.00 0.10 0.00 0.00 66.02 66.98 1ok3 s SER 169 CO 0.53 -1.15 0.25 -0.55 0.98 0.00 0.00 173.24 173.30 1ok3 s SER 170 N -2.83 -0.13 -0.03 7.02 0.15 -0.01 -4.72 113.70 113.15 1ok3 s SER 170 Ca 0.06 0.03 0.06 0.00 0.70 0.00 0.00 55.95 56.81 1ok3 s SER 170 Cb -0.03 0.30 -0.01 0.00 -1.71 0.00 0.00 66.02 64.56 1ok3 s SER 170 CO -0.03 -0.39 -0.21 -0.36 1.20 0.00 0.00 173.24 173.45 1ok3 s PHE 171 N -1.21 1.98 -0.66 3.44 0.40 -1.26 -0.68 117.98 119.99 1ok3 s PHE 171 Ca -0.13 -0.44 -0.27 0.00 -0.60 0.00 0.00 56.93 55.49 1ok3 s PHE 171 Cb -0.06 -1.29 0.03 0.00 0.51 0.00 0.00 43.02 42.22 1ok3 s PHE 171 CO 0.03 -0.08 1.22 0.00 0.70 0.00 0.00 175.22 177.09 1ok3 s LEU 173 N 5.29 2.77 0.17 0.00 2.01 -0.46 -0.48 118.68 127.99 1ok3 s LEU 173 Ca 0.38 -0.85 -0.31 0.00 0.01 0.00 0.00 54.13 53.36 1ok3 s LEU 173 Cb -0.08 -1.33 -0.09 0.00 0.01 0.00 0.00 46.19 44.70 1ok3 s LEU 173 CO 0.20 0.05 1.39 -0.51 1.01 0.00 0.00 176.35 178.49 1ok3 s ILE 174 N -2.24 3.09 -0.36 -0.59 2.07 -1.26 -0.27 121.20 121.63 1ok3 s ILE 174 Ca 0.28 0.84 0.01 0.00 -1.41 0.00 0.00 60.65 60.37 1ok3 s ILE 174 Cb -0.06 -3.54 0.11 0.00 0.13 0.00 0.00 42.46 39.10 1ok3 s ILE 174 CO 0.16 0.10 0.14 -0.55 -1.91 0.00 0.00 174.94 172.87 1ok3 s SER 175 N 0.72 4.08 1.64 4.50 0.15 0.16 -4.78 113.70 120.17 1ok3 s SER 175 Ca 0.62 -2.09 0.00 0.00 0.70 0.00 0.00 55.95 55.18 1ok3 s SER 175 Cb -0.38 -1.10 0.00 0.00 -1.71 0.00 0.00 66.02 62.83 1ok3 s SER 175 CO 0.35 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 175.04 1ok3 n GLY 176 N 4.28 3.26 0.26 9.45 0.00 -1.26 -1.28 105.19 119.89 1ok3 n GLY 176 Ca 0.03 0.26 0.15 0.00 0.00 0.00 0.00 46.02 46.46 1ok3 n GLY 176 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ok3 h SER 177 N 0.00 0.00 -0.09 1.61 4.64 -2.02 -3.47 113.55 114.22 1ok3 h SER 177 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ok3 h SER 177 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ok3 h SER 177 CO 0.00 0.02 0.00 -1.54 -0.87 0.00 0.00 176.83 174.44 1ok3 n SER 178 N -3.11 0.18 -4.05 4.97 3.41 -0.41 -5.00 113.62 109.61 1ok3 n SER 178 Ca 0.02 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.42 1ok3 n SER 178 Cb 0.38 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.18 1ok3 n SER 178 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1ok3 s VAL 179 N 1.24 0.88 0.14 -3.33 -7.23 -1.26 0.36 120.40 111.20 1ok3 s VAL 179 Ca 0.00 -0.47 -0.02 0.00 -1.81 0.00 0.00 61.98 59.68 1ok3 s VAL 179 Cb 0.00 -0.74 -0.04 0.00 0.56 0.00 0.00 36.38 36.16 1ok3 s VAL 179 CO 0.00 0.25 0.08 -1.10 -0.31 0.00 0.00 175.10 174.02 1ok3 s GLN 180 N -0.20 0.97 0.08 4.82 -1.52 0.63 -4.71 119.66 119.73 1ok3 s GLN 180 Ca 0.03 -1.43 -0.31 0.00 -1.95 0.00 0.00 55.36 51.70 1ok3 s GLN 180 Cb -0.05 0.26 -0.07 0.00 -0.22 0.00 0.00 33.01 32.93 1ok3 s GLN 180 CO -0.00 -0.28 1.29 -1.58 -0.25 0.00 0.00 175.29 174.46 1ok3 s TRP 181 N -4.05 3.34 0.22 0.91 0.52 -1.26 -1.35 118.94 117.26 1ok3 s TRP 181 Ca 0.25 1.13 -0.08 0.00 0.02 0.00 0.00 56.10 57.41 1ok3 s TRP 181 Cb 0.07 -3.55 0.25 0.00 -1.15 0.00 0.00 33.47 29.10 1ok3 s TRP 181 CO 0.02 -1.82 1.83 0.66 0.02 0.00 0.00 176.95 177.66 1ok3 h SER 182 N 6.82 0.66 -4.28 2.95 4.64 -1.00 -3.44 113.55 119.90 1ok3 h SER 182 Ca -0.42 0.02 -0.51 0.00 -0.47 0.00 0.00 61.79 60.41 1ok3 h SER 182 Cb 1.21 -0.12 -0.23 0.00 -0.31 0.00 0.00 62.40 62.96 1ok3 h SER 182 CO 0.84 0.43 -0.81 -1.81 -0.87 0.00 0.00 176.83 174.61 1ok3 s ASP 183 N -5.67 2.22 0.68 4.97 1.11 -1.26 -4.98 116.67 113.74 1ok3 s ASP 183 Ca -0.13 -0.61 -0.11 0.00 0.18 0.00 0.00 52.55 51.88 1ok3 s ASP 183 Cb 0.17 -0.13 0.00 0.00 1.07 0.00 0.00 42.92 44.03 1ok3 s ASP 183 CO 0.77 0.04 1.06 -2.16 1.18 0.00 0.00 175.17 176.06 1ok3 s PRO 184 N -1.64 3.03 0.13 8.23 0.04 -1.26 -4.88 135.00 138.65 1ok3 s PRO 184 Ca 0.04 0.95 -0.31 0.00 0.04 0.00 0.00 61.00 61.72 1ok3 s PRO 184 Cb -0.09 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 32.34 1ok3 s PRO 184 CO 0.03 -1.03 1.84 1.28 0.04 0.00 0.00 177.00 179.17 1ok3 n LEU 185 N -3.02 4.08 0.00 -3.56 4.32 -1.26 -4.62 117.00 112.94 1ok3 n LEU 185 Ca 0.07 0.99 -0.05 0.00 -0.02 0.00 0.00 56.01 56.99 1ok3 n LEU 185 Cb 0.54 -1.55 0.04 0.00 -1.62 0.00 0.00 43.42 40.83 1ok3 n LEU 185 CO 0.55 0.19 0.13 -0.81 -1.22 0.00 0.00 177.39 176.23 1ok3 n PRO 186 N 5.67 -1.03 -4.91 3.23 -0.04 -1.26 -4.96 135.00 131.70 1ok3 n PRO 186 Ca 0.18 -0.34 -0.26 0.00 -0.04 0.00 0.00 63.50 63.04 1ok3 n PRO 186 Cb 0.38 -0.29 -0.16 0.00 -0.04 0.00 0.00 33.50 33.39 1ok3 n PRO 186 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1ok3 s GLU 187 N -3.48 1.58 -0.47 0.54 2.12 0.21 -4.94 118.70 114.26 1ok3 s GLU 187 Ca 0.13 -0.67 -0.17 0.00 0.36 0.00 0.00 54.97 54.63 1ok3 s GLU 187 Cb -0.01 -1.50 0.06 0.00 0.26 0.00 0.00 34.13 32.94 1ok3 s GLU 187 CO 0.10 0.38 0.46 0.00 -0.54 0.00 0.00 175.26 175.67 1ok3 s ARG 189 N 2.00 3.88 0.09 0.00 0.52 0.94 -4.72 118.95 121.67 1ok3 s ARG 189 Ca 0.08 -0.33 -0.34 0.00 -0.52 0.00 0.00 55.73 54.62 1ok3 s ARG 189 Cb -0.22 -3.19 -0.14 0.00 0.52 0.00 0.00 34.95 31.93 1ok3 s ARG 189 CO 0.09 0.34 1.63 -1.91 0.02 0.00 0.00 175.30 175.47 1ok3 n GLU 190 N 3.33 2.06 -2.99 3.54 2.13 -1.26 0.34 120.64 127.78 1ok3 n GLU 190 Ca -0.17 0.75 -0.40 0.00 0.66 0.00 0.00 57.16 58.00 1ok3 n GLU 190 Cb 0.52 -2.52 -0.05 0.00 0.27 0.00 0.00 31.44 29.67 1ok3 n GLU 190 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1ok3 s ILE 191 N 1.63 4.79 -0.07 6.31 1.01 0.13 -4.78 121.20 130.22 1ok3 s ILE 191 Ca 0.83 1.60 0.01 0.00 0.00 0.00 0.00 60.65 63.09 1ok3 s ILE 191 Cb -0.71 -4.10 -0.03 0.00 0.01 0.00 0.00 42.46 37.62 1ok3 s ILE 191 CO 0.42 0.34 -0.07 -0.31 0.00 0.00 0.00 174.94 175.33 1ok3 s TYR 192 N 0.11 2.94 0.68 3.97 2.02 -1.26 -4.12 117.35 121.69 1ok3 s TYR 192 Ca 0.39 0.01 -0.11 0.00 -0.37 0.00 0.00 57.07 56.98 1ok3 s TYR 192 Cb -0.20 -1.72 -0.00 0.00 -0.40 0.00 0.00 41.96 39.63 1ok3 s TYR 192 CO 0.22 0.31 1.06 0.00 -1.57 0.00 0.00 175.55 175.57 1ok3 s PRO 194 N -5.09 1.25 0.30 0.00 0.04 -1.26 -4.60 135.00 125.65 1ok3 s PRO 194 Ca 0.57 1.31 -0.29 0.00 0.04 0.00 0.00 61.00 62.63 1ok3 s PRO 194 Cb -0.13 -1.77 -0.12 0.00 0.04 0.00 0.00 34.50 32.51 1ok3 s PRO 194 CO 0.55 -2.39 1.44 0.00 0.04 0.00 0.00 177.00 176.63 1ok3 n ALA 195 N -4.05 1.74 -1.76 8.56 0.00 -1.26 -4.90 120.51 118.84 1ok3 n ALA 195 Ca 0.10 0.38 -0.38 0.00 0.00 0.00 0.00 53.44 53.53 1ok3 n ALA 195 Cb 0.53 -2.34 0.02 0.00 0.00 0.00 0.00 19.45 17.66 1ok3 n ALA 195 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ok3 s PRO 196 N -1.11 3.45 0.39 0.00 0.04 -1.26 -4.97 135.00 131.55 1ok3 s PRO 196 Ca 0.61 2.08 -0.25 0.00 0.04 0.00 0.00 61.00 63.49 1ok3 s PRO 196 Cb -0.56 -2.38 -0.09 0.00 0.04 0.00 0.00 34.50 31.52 1ok3 s PRO 196 CO 0.55 -0.89 1.08 -1.25 0.04 0.00 0.00 177.00 176.53 1ok3 s PRO 197 N -2.75 4.15 0.44 0.56 0.04 -1.26 -5.05 135.00 131.13 1ok3 s PRO 197 Ca 0.67 1.62 -0.05 0.00 0.04 0.00 0.00 61.00 63.27 1ok3 s PRO 197 Cb -0.36 -2.61 -0.04 0.00 0.04 0.00 0.00 34.50 31.53 1ok3 s PRO 197 CO 0.44 -0.18 0.73 -0.65 0.04 0.00 0.00 177.00 177.38 1ok3 s GLN 198 N -2.39 3.59 0.08 4.56 -1.52 -1.26 -4.98 119.66 117.74 1ok3 s GLN 198 Ca 0.57 0.17 0.07 0.00 -1.95 0.00 0.00 55.36 54.22 1ok3 s GLN 198 Cb -0.25 -2.44 -0.03 0.00 -0.22 0.00 0.00 33.01 30.07 1ok3 s GLN 198 CO 0.31 -0.10 -0.19 0.96 -0.25 0.00 0.00 175.29 176.03 1ok3 s ILE 199 N -2.57 1.51 0.21 1.08 -4.36 -1.26 -5.08 121.20 110.73 1ok3 s ILE 199 Ca 0.47 -1.39 -0.31 0.00 -0.26 0.00 0.00 60.65 59.16 1ok3 s ILE 199 Cb -0.10 -1.38 -0.10 0.00 1.25 0.00 0.00 42.46 42.13 1ok3 s ILE 199 CO 0.40 -0.05 1.50 -1.81 0.24 0.00 0.00 174.94 175.22 1ok3 s ASP 200 N -1.69 6.62 -1.76 4.36 1.01 -1.26 -3.17 116.67 120.78 1ok3 s ASP 200 Ca 0.04 2.64 0.00 0.00 0.71 0.00 0.00 52.55 55.94 1ok3 s ASP 200 Cb -0.10 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1ok3 s ASP 200 CO 0.03 -0.76 0.00 0.59 0.21 0.00 0.00 175.17 175.24 1ok3 n ASN 201 N 3.14 -5.51 -3.86 0.27 3.02 -1.26 -4.33 115.26 106.74 1ok3 n ASN 201 Ca 0.10 0.11 -0.09 0.00 -0.03 0.00 0.00 54.58 54.67 1ok3 n ASN 201 Cb 0.39 -4.59 -0.04 0.00 -0.61 0.00 0.00 39.78 34.93 1ok3 n ASN 201 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ok3 s GLY 202 N -2.30 0.48 0.26 7.41 0.00 -1.19 -1.06 107.32 110.92 1ok3 s GLY 202 Ca 0.00 -0.82 0.02 0.00 0.00 0.00 0.00 44.72 43.92 1ok3 s GLY 202 CO 0.00 -0.54 0.09 -0.26 0.00 0.00 0.00 173.10 172.39 1ok3 s ILE 203 N -3.84 0.63 -0.21 0.90 -4.36 0.24 -4.48 121.20 110.09 1ok3 s ILE 203 Ca 0.21 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.48 1ok3 s ILE 203 Cb -0.02 -2.63 -0.05 0.00 1.25 0.00 0.00 42.46 41.02 1ok3 s ILE 203 CO 0.10 -0.02 0.22 -0.63 0.24 0.00 0.00 174.94 174.84 1ok3 s ILE 204 N -3.70 5.33 -0.55 8.37 1.01 -1.26 -1.51 121.20 128.89 1ok3 s ILE 204 Ca 0.37 0.34 -0.28 0.00 0.00 0.00 0.00 60.65 61.08 1ok3 s ILE 204 Cb 0.08 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 39.00 1ok3 s ILE 204 CO 0.13 0.36 1.54 -1.10 0.00 0.00 0.00 174.94 175.87 1ok3 s GLN 205 N 0.86 3.18 -0.85 2.79 -0.21 0.27 -4.02 119.66 121.68 1ok3 s GLN 205 Ca 0.11 0.59 -0.05 0.00 0.02 0.00 0.00 55.36 56.03 1ok3 s GLN 205 Cb -0.13 -4.18 -0.06 0.00 1.00 0.00 0.00 33.01 29.64 1ok3 s GLN 205 CO 0.04 -2.08 0.74 0.41 -2.12 0.00 0.00 175.29 172.28 1ok3 n GLY 206 N 5.36 -0.75 3.72 3.09 0.00 -1.26 -4.68 105.19 110.66 1ok3 n GLY 206 Ca 0.15 0.41 -0.43 0.00 0.00 0.00 0.00 46.02 46.15 1ok3 n GLY 206 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ok3 n GLU 207 N -2.91 2.63 -3.27 1.61 2.13 -1.26 -4.99 120.64 114.58 1ok3 n GLU 207 Ca -0.06 0.94 -0.24 0.00 0.66 0.00 0.00 57.16 58.46 1ok3 n GLU 207 Cb 0.60 -2.74 -0.01 0.00 0.27 0.00 0.00 31.44 29.56 1ok3 n GLU 207 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1ok3 s ARG 208 N 0.36 3.42 0.14 5.31 0.52 -1.26 -5.01 118.95 122.43 1ok3 s ARG 208 Ca 0.71 -0.33 -0.11 0.00 -0.52 0.00 0.00 55.73 55.47 1ok3 s ARG 208 Cb -0.53 -2.63 -0.03 0.00 0.52 0.00 0.00 34.95 32.28 1ok3 s ARG 208 CO 0.41 0.06 1.50 0.22 0.02 0.00 0.00 175.30 177.50 1ok3 h ASP 209 N 0.66 0.99 -3.83 0.23 -0.00 -2.05 -3.45 116.42 108.96 1ok3 h ASP 209 Ca -0.49 -0.44 -0.32 0.00 -0.00 0.00 0.00 57.03 55.78 1ok3 h ASP 209 Cb 1.22 -0.27 -0.29 0.00 -0.00 0.00 0.00 39.33 39.99 1ok3 h ASP 209 CO 0.61 1.21 -0.75 -1.00 -0.00 0.00 0.00 179.24 179.31 1ok3 s HIS 210 N -4.50 0.44 -0.17 0.28 3.76 -1.26 -5.00 115.29 108.84 1ok3 s HIS 210 Ca -0.11 -0.08 0.01 0.00 -0.15 0.00 0.00 55.06 54.72 1ok3 s HIS 210 Cb 0.11 -0.31 0.01 0.00 1.11 0.00 0.00 32.58 33.50 1ok3 s HIS 210 CO 0.87 -0.03 -0.18 0.71 -0.85 0.00 0.00 174.74 175.26 1ok3 s TYR 211 N 0.04 2.77 0.59 1.40 1.51 -1.26 -5.06 117.35 117.33 1ok3 s TYR 211 Ca 0.00 -1.40 0.08 0.00 -1.01 0.00 0.00 57.07 54.74 1ok3 s TYR 211 Cb -0.04 -1.90 0.08 0.00 -0.11 0.00 0.00 41.96 39.99 1ok3 s TYR 211 CO -0.00 -0.68 0.69 0.20 -1.11 0.00 0.00 175.55 174.65 1ok3 s GLY 212 N 1.11 1.93 -0.21 0.71 0.00 -1.26 -0.86 107.32 108.73 1ok3 s GLY 212 Ca 0.00 -1.86 -0.41 0.00 0.00 0.00 0.00 44.72 42.45 1ok3 s GLY 212 CO -0.07 -1.80 1.48 2.98 0.00 0.00 0.00 173.10 175.69 1ok3 n TYR 213 N -2.14 1.57 -0.63 1.90 9.36 -1.26 -1.06 117.16 124.90 1ok3 n TYR 213 Ca 0.10 0.84 0.00 0.00 3.32 0.00 0.00 57.90 62.16 1ok3 n TYR 213 Cb 0.63 -2.29 0.00 0.00 -0.63 0.00 0.00 39.34 37.05 1ok3 n TYR 213 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1ok3 n ARG 214 N 3.61 0.00 -2.33 2.98 5.12 0.13 -4.94 116.66 121.22 1ok3 n ARG 214 Ca 0.25 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.78 1ok3 n ARG 214 Cb 0.08 -3.29 -0.02 0.00 -1.16 0.00 0.00 32.46 28.06 1ok3 n ARG 214 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1ok3 s GLN 215 N -0.38 4.12 0.24 5.56 -0.21 -0.22 -4.61 119.66 124.15 1ok3 s GLN 215 Ca 0.00 1.81 0.10 0.00 0.02 0.00 0.00 55.36 57.30 1ok3 s GLN 215 Cb 0.00 -2.71 -0.04 0.00 1.00 0.00 0.00 33.01 31.25 1ok3 s GLN 215 CO 0.00 -0.26 -0.11 -1.54 -2.12 0.00 0.00 175.29 171.27 1ok3 s SER 216 N -1.14 4.10 -0.11 5.90 1.04 -1.26 -1.19 113.70 121.04 1ok3 s SER 216 Ca 0.56 -0.75 0.01 0.00 0.48 0.00 0.00 55.95 56.25 1ok3 s SER 216 Cb -0.30 -0.61 0.02 0.00 0.10 0.00 0.00 66.02 65.23 1ok3 s SER 216 CO 0.38 0.05 -0.12 0.54 0.98 0.00 0.00 173.24 175.07 1ok3 s VAL 217 N -2.11 1.29 -0.16 5.02 0.11 0.58 -4.98 120.40 120.15 1ok3 s VAL 217 Ca 0.28 -0.50 -0.08 0.00 -2.93 0.00 0.00 61.98 58.75 1ok3 s VAL 217 Cb -0.07 -1.22 -0.04 0.00 -1.53 0.00 0.00 36.38 33.52 1ok3 s VAL 217 CO 0.16 0.40 0.10 -0.89 -3.33 0.00 0.00 175.10 171.55 1ok3 s THR 218 N 1.23 5.19 0.22 5.04 2.01 -1.26 -1.29 115.64 126.78 1ok3 s THR 218 Ca -0.03 0.10 0.06 0.00 0.31 0.00 0.00 61.69 62.13 1ok3 s THR 218 Cb -0.14 -3.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.02 1ok3 s THR 218 CO -0.04 0.51 0.23 -0.31 -0.69 0.00 0.00 174.62 174.33 1ok3 s TYR 219 N -0.16 3.24 -0.09 4.92 1.51 0.29 -0.57 117.35 126.49 1ok3 s TYR 219 Ca 0.09 -0.05 -0.07 0.00 -1.01 0.00 0.00 57.07 56.03 1ok3 s TYR 219 Cb -0.12 -1.49 0.03 0.00 -0.11 0.00 0.00 41.96 40.28 1ok3 s TYR 219 CO 0.01 0.50 0.22 0.00 -1.11 0.00 0.00 175.55 175.17 1ok3 s ALA 220 N -2.00 -0.53 0.28 3.71 0.00 -0.57 -4.86 121.76 117.80 1ok3 s ALA 220 Ca 0.33 0.71 -0.14 0.00 0.00 0.00 0.00 51.96 52.86 1ok3 s ALA 220 Cb -0.09 -0.43 -0.08 0.00 0.00 0.00 0.00 23.12 22.52 1ok3 s ALA 220 CO 0.26 -0.13 0.68 0.00 0.00 0.00 0.00 175.76 176.57 1ok3 s ASN 222 N -2.22 4.92 -0.01 0.00 0.01 -0.23 -4.88 114.94 112.53 1ok3 s ASN 222 Ca 0.51 1.93 -0.37 0.00 -0.71 0.00 0.00 52.86 54.21 1ok3 s ASN 222 Cb -0.11 -2.54 -0.16 0.00 0.41 0.00 0.00 41.25 38.85 1ok3 s ASN 222 CO 0.19 -1.75 1.51 1.17 -1.51 0.00 0.00 177.10 176.70 1ok3 n LYS 223 N -2.80 1.34 -0.16 -0.60 4.81 -1.26 -1.35 118.16 118.13 1ok3 n LYS 223 Ca 0.10 0.48 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 1ok3 n LYS 223 Cb 0.52 -2.17 0.00 0.00 0.02 0.00 0.00 35.03 33.41 1ok3 n LYS 223 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ok3 n GLY 224 N 3.20 0.59 3.46 3.14 0.00 -1.26 -5.06 105.19 109.25 1ok3 n GLY 224 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1ok3 n GLY 224 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ok3 s PHE 225 N -2.35 2.64 0.00 1.61 0.40 -0.46 -4.61 117.98 115.22 1ok3 s PHE 225 Ca 0.00 -0.20 0.00 0.00 -0.60 0.00 0.00 56.93 56.13 1ok3 s PHE 225 Cb 0.00 -1.58 0.00 0.00 0.51 0.00 0.00 43.02 41.95 1ok3 s PHE 225 CO 0.00 0.19 0.00 2.41 0.70 0.00 0.00 175.22 178.52 1ok3 n THR 226 N 2.13 0.00 0.00 0.64 -1.04 -0.04 -4.73 114.28 111.24 1ok3 n THR 226 Ca -0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 1ok3 n THR 226 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 1ok3 n THR 226 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1ok3 n ILE 228 N 0.00 0.00 0.00 12.58 5.41 -0.11 -1.65 119.36 135.59 1ok3 n ILE 228 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1ok3 n ILE 228 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1ok3 n ILE 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ok3 n GLY 229 N 0.00 0.78 3.71 7.39 0.00 -1.26 -1.53 105.19 114.29 1ok3 n GLY 229 Ca 0.00 -2.02 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 1ok3 n GLY 229 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ok3 s GLU 230 N -1.42 4.34 0.62 1.61 0.41 -1.26 -4.89 118.70 118.11 1ok3 s GLU 230 Ca 0.00 2.00 0.41 0.00 -0.41 0.00 0.00 54.97 56.97 1ok3 s GLU 230 Cb 0.00 -3.28 2.10 0.00 -1.78 0.00 0.00 34.13 31.17 1ok3 s GLU 230 CO 0.00 -0.40 2.25 1.25 -0.49 0.00 0.00 175.26 177.86 1ok3 h HIS 231 N 6.83 0.00 -2.88 1.61 2.76 -1.96 -3.33 115.15 118.18 1ok3 h HIS 231 Ca -0.42 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 57.71 1ok3 h HIS 231 Cb 1.21 0.00 -0.14 0.00 1.55 0.00 0.00 27.41 30.03 1ok3 h HIS 231 CO 0.66 0.00 0.13 -1.54 -1.30 0.00 0.00 177.93 175.89 1ok3 s SER 232 N -5.26 -0.51 0.17 3.26 1.04 -1.26 -0.55 113.70 110.59 1ok3 s SER 232 Ca -0.03 0.08 0.05 0.00 0.48 0.00 0.00 55.95 56.53 1ok3 s SER 232 Cb 0.12 0.55 -0.05 0.00 0.10 0.00 0.00 66.02 66.74 1ok3 s SER 232 CO 0.44 -0.86 -0.10 0.27 0.98 0.00 0.00 173.24 173.98 1ok3 s ILE 233 N -3.17 1.26 0.15 -1.02 -4.36 -0.41 -4.96 121.20 108.69 1ok3 s ILE 233 Ca -0.02 -2.09 0.03 0.00 -0.26 0.00 0.00 60.65 58.32 1ok3 s ILE 233 Cb -0.00 -1.94 -0.04 0.00 1.25 0.00 0.00 42.46 41.72 1ok3 s ILE 233 CO -0.08 -0.67 -0.07 -0.72 0.24 0.00 0.00 174.94 173.64 1ok3 s TYR 234 N -3.27 1.22 -0.24 1.37 1.13 -1.26 -0.31 117.35 115.99 1ok3 s TYR 234 Ca 0.19 -0.84 -0.26 0.00 -1.41 0.00 0.00 57.07 54.75 1ok3 s TYR 234 Cb 0.02 -0.65 0.00 0.00 -1.10 0.00 0.00 41.96 40.23 1ok3 s TYR 234 CO 0.03 -0.02 0.89 0.00 -2.51 0.00 0.00 175.55 173.94 1ok3 s THR 236 N 2.97 5.35 -0.12 0.00 -4.23 0.17 0.17 115.64 119.95 1ok3 s THR 236 Ca 0.38 -0.27 -0.02 0.00 -1.18 0.00 0.00 61.69 60.60 1ok3 s THR 236 Cb -0.15 -3.62 0.04 0.00 1.34 0.00 0.00 72.50 70.11 1ok3 s THR 236 CO 0.07 0.14 0.01 -0.69 -0.54 0.00 0.00 174.62 173.61 1ok3 s VAL 237 N -1.52 0.46 0.00 2.29 1.01 -1.26 -0.50 120.40 120.89 1ok3 s VAL 237 Ca 0.35 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.21 1ok3 s VAL 237 Cb -0.13 -0.73 -0.00 0.00 0.00 0.00 0.00 36.38 35.52 1ok3 s VAL 237 CO 0.26 0.11 -0.02 0.20 0.00 0.00 0.00 175.10 175.65 1ok3 s ASN 238 N 1.92 0.24 -1.61 3.32 -0.87 -0.31 -4.83 114.94 112.80 1ok3 s ASN 238 Ca 0.03 -0.10 -0.12 0.00 -1.57 0.00 0.00 52.86 51.10 1ok3 s ASN 238 Cb -0.14 -0.01 0.10 0.00 -0.02 0.00 0.00 41.25 41.19 1ok3 s ASN 238 CO -0.06 -0.02 0.61 0.59 -2.57 0.00 0.00 177.10 175.65 1ok3 n ASN 239 N 2.81 -2.06 -0.14 -1.22 3.02 -1.26 -0.59 115.26 115.83 1ok3 n ASN 239 Ca -0.14 -1.04 -0.02 0.00 -0.03 0.00 0.00 54.58 53.36 1ok3 n ASN 239 Cb 0.59 -2.74 -0.01 0.00 -0.61 0.00 0.00 39.78 37.01 1ok3 n ASN 239 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ok3 n ASP 240 N -2.77 -4.89 -4.33 6.41 8.00 -1.26 -4.99 116.55 112.73 1ok3 n ASP 240 Ca -0.07 0.05 -0.32 0.00 0.71 0.00 0.00 54.79 55.16 1ok3 n ASP 240 Cb 0.56 -2.55 -0.15 0.00 -0.02 0.00 0.00 41.12 38.96 1ok3 n ASP 240 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1ok3 s GLU 241 N -1.55 2.53 0.28 -1.24 2.12 0.25 -4.98 118.70 116.11 1ok3 s GLU 241 Ca 0.00 -0.85 -0.12 0.00 0.36 0.00 0.00 54.97 54.36 1ok3 s GLU 241 Cb 0.00 -2.22 -0.08 0.00 0.26 0.00 0.00 34.13 32.09 1ok3 s GLU 241 CO 0.00 0.45 0.64 0.20 -0.54 0.00 0.00 175.26 176.01 1ok3 s GLY 242 N -0.32 2.29 -0.28 -1.50 0.00 -1.26 -1.16 107.32 105.08 1ok3 s GLY 242 Ca 0.02 -0.13 -0.20 0.00 0.00 0.00 0.00 44.72 44.40 1ok3 s GLY 242 CO 0.02 0.04 0.82 1.85 0.00 0.00 0.00 173.10 175.83 1ok3 s GLU 243 N -2.95 0.64 0.49 2.90 2.12 0.34 -4.64 118.70 117.62 1ok3 s GLU 243 Ca 0.51 0.94 -0.23 0.00 0.36 0.00 0.00 54.97 56.55 1ok3 s GLU 243 Cb -0.11 0.22 -0.06 0.00 0.26 0.00 0.00 34.13 34.44 1ok3 s GLU 243 CO 0.20 -0.11 1.30 -1.58 -0.54 0.00 0.00 175.26 174.53 1ok3 s TRP 244 N 0.97 2.56 0.56 5.30 0.52 -1.26 0.46 118.94 128.04 1ok3 s TRP 244 Ca -0.05 1.42 0.25 0.00 0.02 0.00 0.00 56.10 57.74 1ok3 s TRP 244 Cb -0.05 -3.66 1.60 0.00 -1.15 0.00 0.00 33.47 30.21 1ok3 s TRP 244 CO -0.11 -2.36 2.20 0.66 0.02 0.00 0.00 176.95 177.37 1ok3 h SER 245 N 1.88 0.00 0.00 2.95 4.64 -0.13 -3.44 113.55 119.45 1ok3 h SER 245 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1ok3 h SER 245 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1ok3 h SER 245 CO 0.59 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.16 1ok3 n GLY 246 N -1.42 -0.93 3.74 -0.77 0.00 -1.26 -5.00 105.19 99.55 1ok3 n GLY 246 Ca -0.02 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.66 1ok3 n GLY 246 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ok3 s PRO 247 N -2.00 2.62 0.63 1.61 0.04 -1.26 -4.94 135.00 131.69 1ok3 s PRO 247 Ca 0.00 1.74 -0.14 0.00 0.04 0.00 0.00 61.00 62.64 1ok3 s PRO 247 Cb 0.00 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 1ok3 s PRO 247 CO 0.00 -1.46 1.06 -1.25 0.04 0.00 0.00 177.00 175.39 1ok3 s PRO 248 N -3.67 3.18 1.21 0.56 0.04 -1.26 -4.79 135.00 130.27 1ok3 s PRO 248 Ca 0.75 1.14 -0.18 0.00 0.04 0.00 0.00 61.00 62.75 1ok3 s PRO 248 Cb -0.29 -2.02 0.29 0.00 0.04 0.00 0.00 34.50 32.52 1ok3 s PRO 248 CO 0.39 -0.91 1.06 -1.25 0.04 0.00 0.00 177.00 176.33 1ok3 s PRO 249 N -4.35 -1.27 0.13 0.56 0.04 -1.25 -4.91 135.00 123.95 1ok3 s PRO 249 Ca 0.62 0.18 0.09 0.00 0.04 0.00 0.00 61.00 61.93 1ok3 s PRO 249 Cb -0.16 -1.57 -0.04 0.00 0.04 0.00 0.00 34.50 32.78 1ok3 s PRO 249 CO 0.42 -3.80 -0.15 -1.83 0.04 0.00 0.00 177.00 171.69 1ok3 s GLU 250 N -5.14 1.90 -0.32 4.56 -1.05 -0.58 -4.95 118.70 113.11 1ok3 s GLU 250 Ca 0.69 -1.18 0.03 0.00 -0.15 0.00 0.00 54.97 54.36 1ok3 s GLU 250 Cb -0.14 -2.15 0.09 0.00 -0.44 0.00 0.00 34.13 31.49 1ok3 s GLU 250 CO 0.58 0.47 0.03 0.00 0.95 0.00 0.00 175.26 177.29 1ok3 s ARG 252 N 1.01 3.01 0.00 0.00 3.52 -0.66 -4.80 118.95 121.03 1ok3 s ARG 252 Ca 0.07 -0.48 0.00 0.00 -0.13 0.00 0.00 55.73 55.20 1ok3 s ARG 252 Cb -0.19 -2.74 0.00 0.00 -1.56 0.00 0.00 34.95 30.46 1ok3 s ARG 252 CO -0.09 0.62 0.00 0.41 -0.81 0.00 0.00 175.30 175.43 1ok3 n GLY 253 N 2.39 1.99 3.16 8.12 0.00 -1.26 -0.86 105.19 118.73 1ok3 n GLY 253 Ca -0.18 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.71 1ok3 n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32