#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ok2 s ASP 3 N 0.00 6.90 0.72 2.61 -0.00 -1.26 -3.91 116.67 121.73 1ok2 s ASP 3 Ca 0.00 1.08 -0.12 0.00 -0.00 0.00 0.00 52.55 53.51 1ok2 s ASP 3 Cb 0.00 -2.37 0.03 0.00 -0.00 0.00 0.00 42.92 40.58 1ok2 s ASP 3 CO 0.00 -0.03 1.08 0.00 -0.00 0.00 0.00 175.17 176.22 1ok2 n GLY 5 N -1.27 1.44 3.72 0.00 0.00 -1.26 -1.50 105.19 106.32 1ok2 n GLY 5 Ca 0.09 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 1ok2 n GLY 5 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ok2 n LEU 6 N 0.00 4.11 -4.77 0.99 4.77 -1.25 -4.65 117.00 116.21 1ok2 n LEU 6 Ca 0.00 1.18 -0.30 0.00 -0.03 0.00 0.00 56.01 56.87 1ok2 n LEU 6 Cb 0.00 -1.53 0.11 0.00 -2.33 0.00 0.00 43.42 39.67 1ok2 n LEU 6 CO 0.00 -0.33 0.69 -2.16 -1.33 0.00 0.00 177.39 174.26 1ok2 s PRO 7 N -2.06 1.66 0.69 3.23 0.04 -1.26 -4.99 135.00 132.30 1ok2 s PRO 7 Ca 0.57 0.67 -0.17 0.00 0.04 0.00 0.00 61.00 62.10 1ok2 s PRO 7 Cb -0.52 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.17 1ok2 s PRO 7 CO 0.61 -1.92 1.28 -2.30 0.04 0.00 0.00 177.00 174.70 1ok2 n PRO 8 N -3.64 0.89 -2.87 0.56 -0.02 -1.26 -4.96 135.00 123.70 1ok2 n PRO 8 Ca 0.07 0.37 -0.42 0.00 -2.02 0.00 0.00 63.50 61.49 1ok2 n PRO 8 Cb 0.56 -2.52 -0.04 0.00 -0.02 0.00 0.00 33.50 31.48 1ok2 n PRO 8 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1ok2 s ASP 9 N -1.56 6.72 -0.18 2.55 3.68 -1.26 -4.98 116.67 121.63 1ok2 s ASP 9 Ca 0.81 0.73 -0.06 0.00 2.13 0.00 0.00 52.55 56.16 1ok2 s ASP 9 Cb -0.36 -2.44 -0.03 0.00 -1.45 0.00 0.00 42.92 38.64 1ok2 s ASP 9 CO 0.43 -0.69 0.02 -0.69 0.13 0.00 0.00 175.17 174.37 1ok2 s VAL 10 N 3.15 4.37 0.20 1.11 1.01 -1.26 -5.06 120.40 123.91 1ok2 s VAL 10 Ca 0.36 -0.18 -0.32 0.00 0.00 0.00 0.00 61.98 61.83 1ok2 s VAL 10 Cb -0.14 -2.96 -0.12 0.00 0.00 0.00 0.00 36.38 33.17 1ok2 s VAL 10 CO 0.14 0.46 1.74 -2.84 0.00 0.00 0.00 175.10 174.59 1ok2 s PRO 11 N 0.53 4.12 -0.66 2.72 0.02 -1.26 -2.51 135.00 137.96 1ok2 s PRO 11 Ca 0.01 2.61 0.00 0.00 0.02 0.00 0.00 61.00 63.64 1ok2 s PRO 11 Cb -0.13 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.26 1ok2 s PRO 11 CO 0.02 -0.76 0.00 0.09 -0.33 0.00 0.00 177.00 176.01 1ok2 n ASN 12 N 4.15 -4.43 -4.12 2.53 3.02 -1.26 -4.80 115.26 110.36 1ok2 n ASN 12 Ca 0.16 0.15 -0.13 0.00 -0.03 0.00 0.00 54.58 54.74 1ok2 n ASN 12 Cb 0.35 -2.47 -0.11 0.00 -0.61 0.00 0.00 39.78 36.94 1ok2 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ok2 s ALA 13 N -2.01 0.80 -0.04 5.41 0.00 -1.04 -0.21 121.76 124.68 1ok2 s ALA 13 Ca 0.00 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 50.99 1ok2 s ALA 13 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1ok2 s ALA 13 CO 0.00 -0.07 -0.15 -0.65 0.00 0.00 0.00 175.76 174.89 1ok2 s GLN 14 N -2.41 1.60 0.34 0.00 -1.52 -0.40 -4.56 119.66 112.71 1ok2 s GLN 14 Ca -0.01 -0.51 -0.15 0.00 -1.95 0.00 0.00 55.36 52.74 1ok2 s GLN 14 Cb -0.05 -1.39 -0.09 0.00 -0.22 0.00 0.00 33.01 31.27 1ok2 s GLN 14 CO -0.01 0.17 0.76 -1.25 -0.25 0.00 0.00 175.29 174.71 1ok2 s PRO 15 N 0.19 3.98 -0.46 2.91 0.04 -1.26 -0.43 135.00 139.96 1ok2 s PRO 15 Ca -0.06 0.67 -0.20 0.00 0.04 0.00 0.00 61.00 61.46 1ok2 s PRO 15 Cb -0.12 -2.40 0.04 0.00 0.04 0.00 0.00 34.50 32.06 1ok2 s PRO 15 CO 0.02 0.11 0.61 0.00 0.04 0.00 0.00 177.00 177.78 1ok2 s ALA 16 N -2.07 3.37 -0.06 8.56 0.00 -0.94 -4.91 121.76 125.72 1ok2 s ALA 16 Ca 0.54 -1.46 0.22 0.00 0.00 0.00 0.00 51.96 51.26 1ok2 s ALA 16 Cb -0.10 -3.28 -0.32 0.00 0.00 0.00 0.00 23.12 19.42 1ok2 s ALA 16 CO 0.19 -1.84 0.45 1.28 0.00 0.00 0.00 175.76 175.84 1ok2 n LEU 17 N 6.14 0.03 -2.78 0.00 4.77 -1.26 -4.65 117.00 119.25 1ok2 n LEU 17 Ca -0.04 0.01 -0.18 0.00 -0.03 0.00 0.00 56.01 55.77 1ok2 n LEU 17 Cb 0.47 0.05 0.06 0.00 -2.33 0.00 0.00 43.42 41.67 1ok2 n LEU 17 CO 0.53 0.05 0.16 -0.62 -1.33 0.00 0.00 177.39 176.18 1ok2 n GLU 18 N -2.33 -5.75 -1.18 3.23 1.02 -1.26 -2.74 120.64 111.63 1ok2 n GLU 18 Ca -0.07 0.64 -0.06 0.00 -0.02 0.00 0.00 57.16 57.64 1ok2 n GLU 18 Cb 0.64 -5.07 -0.03 0.00 -0.02 0.00 0.00 31.44 26.96 1ok2 n GLU 18 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ok2 n GLY 19 N -1.61 0.74 3.92 0.62 0.00 -1.26 -4.98 105.19 102.62 1ok2 n GLY 19 Ca -0.01 -0.15 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 1ok2 n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ok2 s ARG 20 N -2.19 3.55 0.00 1.61 0.52 -1.11 -5.00 118.95 116.33 1ok2 s ARG 20 Ca 0.00 -0.27 0.00 0.00 -0.52 0.00 0.00 55.73 54.94 1ok2 s ARG 20 Cb 0.00 -2.82 0.00 0.00 0.52 0.00 0.00 34.95 32.65 1ok2 s ARG 20 CO 0.00 0.39 0.00 0.25 0.02 0.00 0.00 175.30 175.96 1ok2 n THR 21 N -0.58 0.00 -4.59 0.02 -2.24 -1.26 -4.92 114.28 100.71 1ok2 n THR 21 Ca -0.04 -0.45 -0.22 0.00 -2.27 0.00 0.00 64.05 61.07 1ok2 n THR 21 Cb 0.53 0.99 -0.15 0.00 -2.10 0.00 0.00 70.33 69.61 1ok2 n THR 21 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ok2 s SER 22 N -0.93 1.53 -0.02 3.42 0.15 -1.26 -3.82 113.70 112.77 1ok2 s SER 22 Ca 0.00 -0.24 0.02 0.00 0.70 0.00 0.00 55.95 56.43 1ok2 s SER 22 Cb 0.00 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.13 1ok2 s SER 22 CO 0.00 0.16 -0.07 -0.36 1.20 0.00 0.00 173.24 174.17 1ok2 s PHE 23 N -0.28 0.71 0.53 3.44 0.08 -0.56 -4.99 117.98 116.91 1ok2 s PHE 23 Ca 0.04 -0.16 -0.17 0.00 0.12 0.00 0.00 56.93 56.77 1ok2 s PHE 23 Cb -0.05 -0.52 -0.07 0.00 -0.57 0.00 0.00 43.02 41.81 1ok2 s PHE 23 CO -0.00 -0.07 1.01 -1.25 -0.10 0.00 0.00 175.22 174.80 1ok2 s PRO 24 N 0.18 3.76 0.38 0.24 0.04 -1.26 0.21 135.00 138.55 1ok2 s PRO 24 Ca -0.02 1.06 -0.24 0.00 0.04 0.00 0.00 61.00 61.84 1ok2 s PRO 24 Cb -0.07 -2.10 -0.14 0.00 0.04 0.00 0.00 34.50 32.23 1ok2 s PRO 24 CO -0.00 -0.43 0.56 -1.91 0.04 0.00 0.00 177.00 175.25 1ok2 n GLU 25 N -1.65 0.54 -0.91 4.56 2.13 -1.25 -1.57 120.64 122.48 1ok2 n GLU 25 Ca 0.07 0.20 0.00 0.00 0.66 0.00 0.00 57.16 58.09 1ok2 n GLU 25 Cb 0.54 -1.44 0.00 0.00 0.27 0.00 0.00 31.44 30.81 1ok2 n GLU 25 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1ok2 n ASP 26 N 1.46 -1.39 -4.73 4.31 8.00 0.28 -4.96 116.55 119.52 1ok2 n ASP 26 Ca 0.12 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.20 1ok2 n ASP 26 Cb 0.37 -0.92 -0.03 0.00 -0.02 0.00 0.00 41.12 40.52 1ok2 n ASP 26 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ok2 s THR 27 N -2.65 3.10 -0.24 -3.53 2.01 -0.61 -4.71 115.64 109.01 1ok2 s THR 27 Ca 0.00 0.87 -0.04 0.00 0.31 0.00 0.00 61.69 62.83 1ok2 s THR 27 Cb 0.00 -3.56 -0.00 0.00 0.01 0.00 0.00 72.50 68.95 1ok2 s THR 27 CO 0.00 0.11 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.34 1ok2 s VAL 28 N 0.38 3.47 -0.18 3.82 1.01 -1.26 -0.79 120.40 126.85 1ok2 s VAL 28 Ca 0.60 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 1ok2 s VAL 28 Cb -0.38 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.32 1ok2 s VAL 28 CO 0.37 0.31 -0.03 -0.63 0.00 0.00 0.00 175.10 175.12 1ok2 s ILE 29 N 1.47 3.81 -0.08 2.22 1.01 -0.04 -4.95 121.20 124.63 1ok2 s ILE 29 Ca 0.04 -0.37 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 1ok2 s ILE 29 Cb -0.15 -2.70 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 1ok2 s ILE 29 CO -0.02 0.46 0.14 -0.89 0.00 0.00 0.00 174.94 174.62 1ok2 s THR 30 N 0.79 5.35 0.03 2.92 2.01 -1.26 -0.97 115.64 124.50 1ok2 s THR 30 Ca -0.01 0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.05 1ok2 s THR 30 Cb -0.14 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 1ok2 s THR 30 CO 0.02 0.53 0.06 -0.31 -0.69 0.00 0.00 174.62 174.24 1ok2 s TYR 31 N -1.10 3.21 -0.11 4.92 2.02 0.35 -2.22 117.35 124.42 1ok2 s TYR 31 Ca 0.18 0.13 0.02 0.00 -0.37 0.00 0.00 57.07 57.04 1ok2 s TYR 31 Cb -0.12 -1.68 -0.01 0.00 -0.40 0.00 0.00 41.96 39.75 1ok2 s TYR 31 CO 0.08 0.52 -0.19 0.15 -1.57 0.00 0.00 175.55 174.55 1ok2 s LYS 32 N -1.95 3.16 0.58 -0.62 -0.14 0.43 -4.90 119.74 116.31 1ok2 s LYS 32 Ca 0.25 -0.79 -0.20 0.00 -1.36 0.00 0.00 55.97 53.87 1ok2 s LYS 32 Cb -0.12 -2.45 -0.04 0.00 -1.68 0.00 0.00 37.83 33.55 1ok2 s LYS 32 CO 0.16 0.22 1.33 0.00 -0.76 0.00 0.00 175.35 176.30 1ok2 s GLU 34 N -3.08 1.65 0.19 0.00 2.02 0.71 -4.84 118.70 115.34 1ok2 s GLU 34 Ca 0.76 -0.11 -0.32 0.00 0.02 0.00 0.00 54.97 55.31 1ok2 s GLU 34 Cb -0.39 -1.97 -0.15 0.00 0.10 0.00 0.00 34.13 31.72 1ok2 s GLU 34 CO 0.44 -1.75 1.13 -1.91 0.02 0.00 0.00 175.26 173.19 1ok2 n GLU 35 N -3.36 1.19 0.00 1.61 2.13 -1.26 -1.55 120.64 119.40 1ok2 n GLU 35 Ca 0.10 0.42 0.00 0.00 0.66 0.00 0.00 57.16 58.34 1ok2 n GLU 35 Cb 0.60 -1.89 0.00 0.00 0.27 0.00 0.00 31.44 30.42 1ok2 n GLU 35 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1ok2 n SER 36 N 1.88 0.00 -4.75 4.31 7.64 -1.26 -5.03 113.62 116.42 1ok2 n SER 36 Ca 0.14 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.71 1ok2 n SER 36 Cb 0.26 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.39 1ok2 n SER 36 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ok2 s PHE 37 N -2.64 3.17 -0.03 1.43 0.40 -0.60 -1.27 117.98 118.45 1ok2 s PHE 37 Ca 0.00 0.10 0.02 0.00 -0.60 0.00 0.00 56.93 56.45 1ok2 s PHE 37 Cb 0.00 -1.65 0.01 0.00 0.51 0.00 0.00 43.02 41.88 1ok2 s PHE 37 CO 0.00 0.51 -0.09 0.08 0.70 0.00 0.00 175.22 176.43 1ok2 s VAL 38 N -1.27 0.78 0.45 -0.44 1.01 -0.07 -4.66 120.40 116.19 1ok2 s VAL 38 Ca 0.25 -0.34 -0.25 0.00 0.00 0.00 0.00 61.98 61.65 1ok2 s VAL 38 Cb -0.12 -0.71 -0.09 0.00 0.00 0.00 0.00 36.38 35.46 1ok2 s VAL 38 CO 0.17 0.25 1.26 2.29 0.00 0.00 0.00 175.10 179.08 1ok2 n LYS 39 N 3.43 1.84 -2.82 2.72 2.85 -1.26 -2.04 118.16 122.88 1ok2 n LYS 39 Ca -0.19 0.66 -0.42 0.00 -1.05 0.00 0.00 58.31 57.30 1ok2 n LYS 39 Cb 0.54 -2.39 -0.04 0.00 -0.65 0.00 0.00 35.03 32.48 1ok2 n LYS 39 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1ok2 s ILE 40 N -1.23 4.74 0.18 0.58 1.01 0.17 -4.87 121.20 121.78 1ok2 s ILE 40 Ca 0.63 1.55 -0.33 0.00 0.00 0.00 0.00 60.65 62.50 1ok2 s ILE 40 Cb -0.49 -4.21 -0.15 0.00 0.01 0.00 0.00 42.46 37.61 1ok2 s ILE 40 CO 0.56 -0.22 1.24 -2.65 0.00 0.00 0.00 174.94 173.87 1ok2 n PRO 41 N 6.28 1.36 -0.87 2.79 -0.02 -1.26 -1.92 135.00 141.35 1ok2 n PRO 41 Ca 0.07 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1ok2 n PRO 41 Cb 0.47 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1ok2 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ok2 n GLY 42 N 2.13 0.50 3.45 -1.23 0.00 -1.26 -5.05 105.19 103.72 1ok2 n GLY 42 Ca 0.15 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1ok2 n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ok2 s GLU 43 N -1.15 1.62 0.16 1.61 2.02 -0.81 -5.12 118.70 117.04 1ok2 s GLU 43 Ca 0.00 -1.27 -0.30 0.00 0.02 0.00 0.00 54.97 53.42 1ok2 s GLU 43 Cb 0.00 -2.01 -0.08 0.00 0.10 0.00 0.00 34.13 32.14 1ok2 s GLU 43 CO 0.00 0.46 1.18 0.15 0.02 0.00 0.00 175.26 177.08 1ok2 s LYS 44 N -2.14 4.50 -0.00 1.61 1.02 -1.26 -4.93 119.74 118.53 1ok2 s LYS 44 Ca 0.17 1.83 0.00 0.00 0.02 0.00 0.00 55.97 57.99 1ok2 s LYS 44 Cb -0.10 -3.26 0.00 0.00 -0.52 0.00 0.00 37.83 33.95 1ok2 s LYS 44 CO 0.08 -0.09 0.93 -0.40 -0.92 0.00 0.00 175.35 174.96 1ok2 n ASP 45 N 2.70 1.71 -4.04 2.83 3.85 -1.26 -4.73 116.55 117.61 1ok2 n ASP 45 Ca 0.05 -1.87 -0.07 0.00 -0.71 0.00 0.00 54.79 52.18 1ok2 n ASP 45 Cb 0.45 -0.01 -0.09 0.00 -1.35 0.00 0.00 41.12 40.12 1ok2 n ASP 45 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1ok2 s SER 46 N -0.88 0.41 0.24 -1.12 1.04 -1.26 -0.50 113.70 111.63 1ok2 s SER 46 Ca 0.00 -0.92 0.08 0.00 0.48 0.00 0.00 55.95 55.59 1ok2 s SER 46 Cb 0.00 0.23 -0.05 0.00 0.10 0.00 0.00 66.02 66.30 1ok2 s SER 46 CO 0.00 -0.62 -0.14 0.68 0.98 0.00 0.00 173.24 174.14 1ok2 s VAL 47 N -3.87 1.88 -0.03 5.02 -7.23 -0.14 -4.89 120.40 111.13 1ok2 s VAL 47 Ca 0.06 -2.23 0.02 0.00 -1.81 0.00 0.00 61.98 58.02 1ok2 s VAL 47 Cb 0.07 -2.20 0.01 0.00 0.56 0.00 0.00 36.38 34.82 1ok2 s VAL 47 CO -0.10 -0.48 -0.08 -0.51 -0.31 0.00 0.00 175.10 173.61 1ok2 s ILE 48 N -2.88 0.74 -0.25 -0.62 1.10 -1.26 -0.86 121.20 117.18 1ok2 s ILE 48 Ca 0.26 -0.32 -0.29 0.00 -0.51 0.00 0.00 60.65 59.78 1ok2 s ILE 48 Cb -0.01 -0.68 -0.01 0.00 0.15 0.00 0.00 42.46 41.92 1ok2 s ILE 48 CO 0.10 0.24 1.36 0.00 -2.11 0.00 0.00 174.94 174.53 1ok2 n LEU 50 N 7.53 0.00 -4.76 0.00 4.77 0.21 1.00 117.00 125.75 1ok2 n LEU 50 Ca 0.15 -1.35 -0.36 0.00 -0.03 0.00 0.00 56.01 54.42 1ok2 n LEU 50 Cb 0.46 -0.11 0.02 0.00 -2.33 0.00 0.00 43.42 41.46 1ok2 n LEU 50 CO 0.62 -0.50 0.84 -0.54 -1.33 0.00 0.00 177.39 176.48 1ok2 s LYS 51 N -3.21 3.22 0.00 3.23 1.02 -1.26 -3.24 119.74 119.50 1ok2 s LYS 51 Ca 0.22 1.82 0.00 0.00 0.02 0.00 0.00 55.97 58.03 1ok2 s LYS 51 Cb -0.02 -2.07 0.00 0.00 -0.52 0.00 0.00 37.83 35.22 1ok2 s LYS 51 CO 0.14 -1.00 0.00 0.41 -0.92 0.00 0.00 175.35 173.98 1ok2 n GLY 52 N 0.45 0.55 4.07 -3.33 0.00 -1.26 -3.91 105.19 101.77 1ok2 n GLY 52 Ca 0.12 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 1ok2 n GLY 52 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ok2 n SER 53 N 1.59 -2.06 -4.21 1.61 2.88 -1.20 -4.94 113.62 107.29 1ok2 n SER 53 Ca 0.00 -0.99 -0.29 0.00 -1.33 0.00 0.00 58.87 56.26 1ok2 n SER 53 Cb 0.09 -2.99 -0.16 0.00 -0.75 0.00 0.00 64.21 60.40 1ok2 n SER 53 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1ok2 s GLN 54 N -6.74 2.23 0.28 -1.46 0.74 -1.21 -4.72 119.66 108.78 1ok2 s GLN 54 Ca 0.39 -0.77 -0.17 0.00 0.05 0.00 0.00 55.36 54.86 1ok2 s GLN 54 Cb -0.21 -1.89 -0.09 0.00 1.10 0.00 0.00 33.01 31.92 1ok2 s GLN 54 CO 0.90 0.31 0.73 -1.58 -0.55 0.00 0.00 175.29 175.10 1ok2 s TRP 55 N -0.05 3.49 0.57 1.67 0.52 -1.26 -0.62 118.94 123.26 1ok2 s TRP 55 Ca -0.04 1.29 -0.18 0.00 0.02 0.00 0.00 56.10 57.19 1ok2 s TRP 55 Cb -0.13 -2.57 -0.04 0.00 -1.15 0.00 0.00 33.47 29.57 1ok2 s TRP 55 CO 0.03 0.19 1.11 -1.54 0.02 0.00 0.00 176.95 176.77 1ok2 s SER 56 N -2.01 5.63 0.55 2.95 1.04 -0.67 -4.92 113.70 116.27 1ok2 s SER 56 Ca 0.50 2.08 -0.20 0.00 0.48 0.00 0.00 55.95 58.80 1ok2 s SER 56 Cb -0.13 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.37 1ok2 s SER 56 CO 0.19 -1.28 1.21 -1.81 0.98 0.00 0.00 173.24 172.53 1ok2 s ASP 57 N -2.07 5.52 -0.12 7.02 1.01 -1.26 -4.65 116.67 122.11 1ok2 s ASP 57 Ca 0.70 2.39 -0.09 0.00 0.71 0.00 0.00 52.55 56.26 1ok2 s ASP 57 Cb -0.22 -2.60 0.04 0.00 1.01 0.00 0.00 42.92 41.15 1ok2 s ASP 57 CO 0.31 -1.37 0.30 -0.51 0.21 0.00 0.00 175.17 174.11 1ok2 s ILE 58 N -1.57 -0.01 0.23 0.77 2.07 -1.26 -4.92 121.20 116.50 1ok2 s ILE 58 Ca 0.73 0.05 0.08 0.00 -1.41 0.00 0.00 60.65 60.09 1ok2 s ILE 58 Cb -0.30 -0.44 -0.04 0.00 0.13 0.00 0.00 42.46 41.81 1ok2 s ILE 58 CO 0.34 0.02 0.09 -1.61 -1.91 0.00 0.00 174.94 171.87 1ok2 s GLU 59 N 0.58 2.63 0.14 3.50 8.01 -1.26 -5.04 118.70 127.26 1ok2 s GLU 59 Ca -0.03 -1.16 -0.35 0.00 0.01 0.00 0.00 54.97 53.44 1ok2 s GLU 59 Cb -0.05 -2.41 -0.15 0.00 -4.31 0.00 0.00 34.13 27.21 1ok2 s GLU 59 CO -0.03 0.41 1.48 0.39 0.01 0.00 0.00 175.26 177.51 1ok2 n GLU 60 N -0.80 1.76 0.00 1.61 1.02 -1.26 -4.85 120.64 118.11 1ok2 n GLU 60 Ca -0.08 0.64 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 1ok2 n GLU 60 Cb 0.57 -2.35 0.00 0.00 -0.02 0.00 0.00 31.44 29.64 1ok2 n GLU 60 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 1ok2 n PHE 61 N 3.00 0.00 -4.36 -0.32 -1.74 -1.26 -5.04 117.46 107.74 1ok2 n PHE 61 Ca 0.17 -0.21 -0.34 0.00 -0.56 0.00 0.00 57.45 56.51 1ok2 n PHE 61 Cb 0.25 -0.02 -0.11 0.00 1.52 0.00 0.00 39.48 41.12 1ok2 n PHE 61 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1ok2 s ASN 63 N 0.01 2.75 0.26 0.00 3.84 -0.86 -4.91 114.94 116.02 1ok2 s ASN 63 Ca 0.02 -0.43 -0.30 0.00 0.21 0.00 0.00 52.86 52.36 1ok2 s ASN 63 Cb -0.13 -0.31 -0.11 0.00 -0.55 0.00 0.00 41.25 40.15 1ok2 s ASN 63 CO 0.02 0.29 1.58 0.00 -2.79 0.00 0.00 177.10 176.20 1ok2 s ARG 64 N -0.56 4.16 0.03 0.43 1.70 -1.26 -0.89 118.95 122.55 1ok2 s ARG 64 Ca 0.09 2.51 -0.00 0.00 -0.47 0.00 0.00 55.73 57.85 1ok2 s ARG 64 Cb -0.09 -3.06 -0.03 0.00 -0.57 0.00 0.00 34.95 31.20 1ok2 s ARG 64 CO -0.01 -0.61 -0.03 0.45 -1.08 0.00 0.00 175.30 174.03 1ok2 s SER 65 N 0.64 0.33 0.91 -2.89 0.15 -0.40 -4.01 113.70 108.43 1ok2 s SER 65 Ca 0.65 -0.67 -0.12 0.00 0.70 0.00 0.00 55.95 56.51 1ok2 s SER 65 Cb -0.46 0.13 0.14 0.00 -1.71 0.00 0.00 66.02 64.12 1ok2 s SER 65 CO 0.43 -0.40 1.10 0.00 1.20 0.00 0.00 173.24 175.57 1ok2 s GLU 67 N -5.07 2.94 0.18 0.00 2.02 -1.26 -4.48 118.70 113.03 1ok2 s GLU 67 Ca 0.64 -0.16 -0.33 0.00 0.02 0.00 0.00 54.97 55.14 1ok2 s GLU 67 Cb -0.17 -2.35 -0.13 0.00 0.10 0.00 0.00 34.13 31.58 1ok2 s GLU 67 CO 0.56 -0.59 1.61 0.28 0.02 0.00 0.00 175.26 177.13 1ok2 n VAL 68 N -2.45 0.10 -1.51 2.63 0.31 -1.26 -4.85 118.33 111.30 1ok2 n VAL 68 Ca 0.04 -0.03 -0.45 0.00 -0.01 0.00 0.00 64.34 63.90 1ok2 n VAL 68 Cb 0.58 -1.67 -0.01 0.00 -0.91 0.00 0.00 33.84 31.82 1ok2 n VAL 68 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1ok2 n PRO 69 N 3.42 0.85 -2.15 5.55 -0.02 -1.26 -4.91 135.00 136.47 1ok2 n PRO 69 Ca 0.16 0.30 -0.36 0.00 -2.02 0.00 0.00 63.50 61.58 1ok2 n PRO 69 Cb 0.31 -1.57 0.01 0.00 -0.02 0.00 0.00 33.50 32.23 1ok2 n PRO 69 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1ok2 s THR 70 N -1.15 2.91 0.19 3.45 2.01 -1.26 -4.96 115.64 116.83 1ok2 s THR 70 Ca 0.61 0.60 -0.30 0.00 0.31 0.00 0.00 61.69 62.91 1ok2 s THR 70 Cb -0.73 -3.26 -0.09 0.00 0.01 0.00 0.00 72.50 68.43 1ok2 s THR 70 CO 0.58 -0.09 1.37 -0.60 -0.69 0.00 0.00 174.62 175.20 1ok2 s ARG 71 N -3.12 4.34 0.07 4.92 3.52 -1.26 -5.03 118.95 122.39 1ok2 s ARG 71 Ca 0.72 2.13 0.06 0.00 -0.13 0.00 0.00 55.73 58.52 1ok2 s ARG 71 Cb -0.28 -3.18 -0.04 0.00 -1.56 0.00 0.00 34.95 29.89 1ok2 s ARG 71 CO 0.32 -0.35 -0.11 -0.51 -0.81 0.00 0.00 175.30 173.84 1ok2 s LEU 72 N 0.14 2.98 0.09 -0.88 1.43 -1.26 -5.03 118.68 116.15 1ok2 s LEU 72 Ca 0.60 -0.35 0.24 0.00 -1.03 0.00 0.00 54.13 53.59 1ok2 s LEU 72 Cb -0.38 -1.77 0.28 0.00 0.03 0.00 0.00 46.19 44.35 1ok2 s LEU 72 CO 0.37 0.21 1.25 0.59 0.23 0.00 0.00 176.35 179.00 1ok2 n ASN 73 N 1.03 0.66 0.03 2.29 3.02 -1.26 -4.12 115.26 116.91 1ok2 n ASN 73 Ca -0.14 0.01 0.02 0.00 -0.03 0.00 0.00 54.58 54.43 1ok2 n ASN 73 Cb 0.52 0.34 -0.08 0.00 -0.61 0.00 0.00 39.78 39.95 1ok2 n ASN 73 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ok2 n SER 74 N -2.03 0.72 -3.78 6.41 3.41 -1.26 -4.82 113.62 112.27 1ok2 n SER 74 Ca 0.03 0.31 -0.10 0.00 -0.26 0.00 0.00 58.87 58.85 1ok2 n SER 74 Cb 0.43 0.43 -0.05 0.00 -0.26 0.00 0.00 64.21 64.76 1ok2 n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ok2 s ALA 75 N -3.01 -0.65 0.11 7.33 0.00 -1.26 -1.58 121.76 122.69 1ok2 s ALA 75 Ca -0.04 -0.38 0.07 0.00 0.00 0.00 0.00 51.96 51.62 1ok2 s ALA 75 Cb 0.09 0.80 -0.03 0.00 0.00 0.00 0.00 23.12 23.97 1ok2 s ALA 75 CO 0.82 -0.71 -0.18 -1.54 0.00 0.00 0.00 175.76 174.15 1ok2 s SER 76 N -2.88 2.25 0.43 0.00 1.04 0.11 -4.32 113.70 110.33 1ok2 s SER 76 Ca 0.10 -0.71 -0.26 0.00 0.48 0.00 0.00 55.95 55.56 1ok2 s SER 76 Cb 0.01 -0.11 -0.09 0.00 0.10 0.00 0.00 66.02 65.93 1ok2 s SER 76 CO -0.05 -0.02 1.38 -0.11 0.98 0.00 0.00 173.24 175.42 1ok2 n LEU 77 N 0.95 4.69 -4.94 2.42 7.94 -1.26 -0.30 117.00 126.49 1ok2 n LEU 77 Ca -0.18 1.12 -0.25 0.00 -1.11 0.00 0.00 56.01 55.59 1ok2 n LEU 77 Cb 0.55 -1.57 0.06 0.00 0.53 0.00 0.00 43.42 42.99 1ok2 n LEU 77 CO 0.24 -0.31 0.56 -0.54 -1.11 0.00 0.00 177.39 176.22 1ok2 s LYS 78 N -2.33 2.29 0.20 1.96 1.02 -0.52 -4.61 119.74 117.75 1ok2 s LYS 78 Ca 0.60 -0.37 -0.30 0.00 0.02 0.00 0.00 55.97 55.92 1ok2 s LYS 78 Cb -0.47 -2.25 -0.08 0.00 -0.52 0.00 0.00 37.83 34.51 1ok2 s LYS 78 CO 0.58 -1.11 0.94 -0.65 -0.92 0.00 0.00 175.35 174.19 1ok2 s GLN 79 N -5.13 4.80 0.00 1.68 -1.52 -1.26 -1.74 119.66 116.50 1ok2 s GLN 79 Ca 0.59 1.47 0.23 0.00 -1.95 0.00 0.00 55.36 55.70 1ok2 s GLN 79 Cb -0.11 -3.31 0.06 0.00 -0.22 0.00 0.00 33.01 29.43 1ok2 s GLN 79 CO 0.43 0.44 1.13 -0.35 -0.25 0.00 0.00 175.29 176.69 1ok2 n PRO 80 N 1.86 1.60 -0.31 2.91 -0.04 -1.26 -4.92 135.00 134.83 1ok2 n PRO 80 Ca -0.01 -1.30 0.22 0.00 -0.04 0.00 0.00 63.50 62.37 1ok2 n PRO 80 Cb 0.48 -1.46 0.51 0.00 -0.04 0.00 0.00 33.50 32.99 1ok2 n PRO 80 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1ok2 h TYR 81 N 3.16 0.63 0.00 0.54 -1.99 -1.76 -1.78 116.97 115.76 1ok2 h TYR 81 Ca 0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1ok2 h TYR 81 Cb 0.82 -0.18 0.00 0.00 2.00 0.00 0.00 36.73 39.37 1ok2 h TYR 81 CO 0.00 0.08 0.09 0.97 -0.00 0.00 0.00 178.16 179.29 1ok2 h ILE 82 N 0.40 0.00 -0.18 -2.88 2.10 -1.59 -0.99 117.51 114.36 1ok2 h ILE 82 Ca 0.57 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.51 1ok2 h ILE 82 Cb 1.45 0.88 0.00 0.00 -1.09 0.00 0.00 36.82 38.07 1ok2 h ILE 82 CO -0.27 0.00 0.00 0.35 -1.08 0.00 0.00 178.15 177.15 1ok2 n THR 83 N -2.98 0.43 -3.51 2.19 -2.24 -0.67 -5.03 114.28 102.47 1ok2 n THR 83 Ca -0.03 -0.71 -0.25 0.00 -2.27 0.00 0.00 64.05 60.79 1ok2 n THR 83 Cb 0.15 0.94 -0.02 0.00 -2.10 0.00 0.00 70.33 69.30 1ok2 n THR 83 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1ok2 s GLN 84 N -1.04 3.50 0.00 -0.78 -0.21 -0.38 -5.01 119.66 115.75 1ok2 s GLN 84 Ca 0.20 -0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.23 1ok2 s GLN 84 Cb 0.12 -2.72 0.00 0.00 1.00 0.00 0.00 33.01 31.41 1ok2 s GLN 84 CO 0.17 0.24 0.00 0.27 -2.12 0.00 0.00 175.29 173.85 1ok2 n ASN 85 N -1.42 0.24 -4.53 5.90 0.23 -1.26 -4.93 115.26 109.49 1ok2 n ASN 85 Ca -0.05 -0.08 -0.42 0.00 -0.53 0.00 0.00 54.58 53.50 1ok2 n ASN 85 Cb 0.56 0.20 -0.08 0.00 -2.08 0.00 0.00 39.78 38.38 1ok2 n ASN 85 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1ok2 s TYR 86 N -0.25 3.16 -0.44 -2.53 6.04 -1.26 -4.78 117.35 117.29 1ok2 s TYR 86 Ca 0.00 -0.06 0.06 0.00 0.04 0.00 0.00 57.07 57.11 1ok2 s TYR 86 Cb 0.00 -2.96 0.22 0.00 -1.04 0.00 0.00 41.96 38.18 1ok2 s TYR 86 CO 0.00 -0.63 0.47 1.19 -1.54 0.00 0.00 175.55 175.04 1ok2 n PHE 87 N 5.74 -0.07 -0.80 4.97 3.01 -1.26 -5.05 117.46 124.01 1ok2 n PHE 87 Ca -0.06 -3.55 -0.30 0.00 1.01 0.00 0.00 57.45 54.55 1ok2 n PHE 87 Cb 0.48 -0.15 0.17 0.00 -0.01 0.00 0.00 39.48 39.98 1ok2 n PHE 87 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1ok2 s PRO 88 N -0.83 0.75 0.17 -1.08 0.04 -1.26 -0.97 135.00 131.82 1ok2 s PRO 88 Ca 0.34 1.24 -0.33 0.00 0.04 0.00 0.00 61.00 62.29 1ok2 s PRO 88 Cb 0.11 -1.72 -0.15 0.00 0.04 0.00 0.00 34.50 32.78 1ok2 s PRO 88 CO -0.14 -2.72 1.40 0.28 0.04 0.00 0.00 177.00 175.86 1ok2 n VAL 89 N -4.26 0.46 0.00 -0.36 0.31 -1.26 -1.69 118.33 111.53 1ok2 n VAL 89 Ca 0.09 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1ok2 n VAL 89 Cb 0.53 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.23 1ok2 n VAL 89 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ok2 n GLY 90 N 2.57 1.82 3.71 2.92 0.00 -0.89 -5.02 105.19 110.31 1ok2 n GLY 90 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1ok2 n GLY 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ok2 s THR 91 N -2.50 2.57 -0.12 2.61 2.01 -0.68 -4.73 115.64 114.79 1ok2 s THR 91 Ca 0.00 0.36 0.02 0.00 0.31 0.00 0.00 61.69 62.38 1ok2 s THR 91 Cb 0.00 -3.23 -0.01 0.00 0.01 0.00 0.00 72.50 69.27 1ok2 s THR 91 CO 0.00 0.02 -0.19 0.54 -0.69 0.00 0.00 174.62 174.30 1ok2 s VAL 92 N 1.39 2.50 0.24 3.82 0.11 -1.26 -1.45 120.40 125.74 1ok2 s VAL 92 Ca 0.72 -0.86 0.09 0.00 -2.93 0.00 0.00 61.98 59.00 1ok2 s VAL 92 Cb -0.44 -2.00 -0.04 0.00 -1.53 0.00 0.00 36.38 32.36 1ok2 s VAL 92 CO 0.32 0.54 0.01 0.68 -3.33 0.00 0.00 175.10 173.31 1ok2 s VAL 93 N 0.39 3.57 0.09 2.04 -7.23 -0.29 -4.96 120.40 114.02 1ok2 s VAL 93 Ca -0.14 -1.74 0.08 0.00 -1.81 0.00 0.00 61.98 58.37 1ok2 s VAL 93 Cb -0.17 -2.87 -0.04 0.00 0.56 0.00 0.00 36.38 33.86 1ok2 s VAL 93 CO 0.07 -0.29 -0.18 -0.70 -0.31 0.00 0.00 175.10 173.69 1ok2 s GLU 94 N -3.45 1.89 0.32 4.82 2.12 -1.26 -1.74 118.70 121.41 1ok2 s GLU 94 Ca 0.30 -1.11 0.09 0.00 0.36 0.00 0.00 54.97 54.61 1ok2 s GLU 94 Cb -0.07 -2.15 -0.05 0.00 0.26 0.00 0.00 34.13 32.12 1ok2 s GLU 94 CO 0.20 0.50 0.03 0.71 -0.54 0.00 0.00 175.26 176.16 1ok2 s TYR 95 N -1.08 2.60 0.02 5.30 1.51 0.60 -1.43 117.35 124.87 1ok2 s TYR 95 Ca 0.17 -0.38 0.00 0.00 -1.01 0.00 0.00 57.07 55.86 1ok2 s TYR 95 Cb -0.11 -1.44 -0.02 0.00 -0.11 0.00 0.00 41.96 40.28 1ok2 s TYR 95 CO 0.09 0.48 -0.03 -1.83 -1.11 0.00 0.00 175.55 173.15 1ok2 s GLU 96 N -3.73 0.29 0.44 -0.62 -1.05 0.58 -4.79 118.70 109.83 1ok2 s GLU 96 Ca 0.35 -0.48 -0.25 0.00 -0.15 0.00 0.00 54.97 54.43 1ok2 s GLU 96 Cb -0.02 -0.01 -0.08 0.00 -0.44 0.00 0.00 34.13 33.57 1ok2 s GLU 96 CO 0.20 -0.01 1.36 0.00 0.95 0.00 0.00 175.26 177.76 1ok2 s ARG 98 N -2.41 1.29 -0.11 0.00 0.52 -0.62 -4.70 118.95 112.92 1ok2 s ARG 98 Ca 0.60 -0.92 -0.06 0.00 -0.52 0.00 0.00 55.73 54.84 1ok2 s ARG 98 Cb -0.41 -2.17 -0.04 0.00 0.52 0.00 0.00 34.95 32.86 1ok2 s ARG 98 CO 0.52 -1.80 0.10 -1.25 0.02 0.00 0.00 175.30 172.89 1ok2 s PRO 99 N -5.40 3.36 -0.86 3.54 0.04 -1.26 -1.29 135.00 133.13 1ok2 s PRO 99 Ca 0.69 -0.21 -0.04 0.00 0.04 0.00 0.00 61.00 61.48 1ok2 s PRO 99 Cb -0.04 -3.10 0.22 0.00 0.04 0.00 0.00 34.50 31.61 1ok2 s PRO 99 CO 0.47 0.74 0.75 0.20 0.04 0.00 0.00 177.00 179.20 1ok2 s GLY 100 N -0.93 2.93 0.17 0.56 0.00 -1.26 -5.08 107.32 103.71 1ok2 s GLY 100 Ca 0.14 -3.66 0.09 0.00 0.00 0.00 0.00 44.72 41.29 1ok2 s GLY 100 CO 0.03 1.20 -0.20 -0.19 0.00 0.00 0.00 173.10 173.94 1ok2 s TYR 101 N -0.90 1.98 0.22 1.90 2.02 -0.41 -1.35 117.35 120.81 1ok2 s TYR 101 Ca 0.25 -0.43 0.10 0.00 -0.37 0.00 0.00 57.07 56.61 1ok2 s TYR 101 Cb -0.11 -0.99 -0.05 0.00 -0.40 0.00 0.00 41.96 40.42 1ok2 s TYR 101 CO -0.09 0.38 -0.17 0.50 -1.57 0.00 0.00 175.55 174.59 1ok2 s ARG 102 N -2.70 1.45 0.31 -0.62 3.52 0.57 -4.67 118.95 116.81 1ok2 s ARG 102 Ca 0.17 -1.62 -0.28 0.00 -0.13 0.00 0.00 55.73 53.87 1ok2 s ARG 102 Cb -0.07 -1.42 -0.09 0.00 -1.56 0.00 0.00 34.95 31.81 1ok2 s ARG 102 CO 0.08 0.26 1.07 1.03 -0.81 0.00 0.00 175.30 176.93 1ok2 s ARG 103 N -3.41 4.53 -0.81 5.12 1.81 -1.26 0.11 118.95 125.04 1ok2 s ARG 103 Ca 0.24 1.70 -0.15 0.00 -1.72 0.00 0.00 55.73 55.81 1ok2 s ARG 103 Cb -0.03 -3.03 0.20 0.00 -0.45 0.00 0.00 34.95 31.64 1ok2 s ARG 103 CO 0.10 0.14 0.78 -2.00 -0.68 0.00 0.00 175.30 173.64 1ok2 s GLU 104 N -1.70 3.55 0.40 3.54 2.56 0.12 -4.80 118.70 122.37 1ok2 s GLU 104 Ca 0.48 -2.33 0.25 0.00 0.00 0.00 0.00 54.97 53.37 1ok2 s GLU 104 Cb -0.29 -4.46 1.37 0.00 2.00 0.00 0.00 34.13 32.76 1ok2 s GLU 104 CO 0.37 -1.34 1.59 -1.00 -0.56 0.00 0.00 175.26 174.32 1ok2 h PRO 105 N 7.98 0.05 0.00 4.30 0.13 -1.94 0.18 132.00 142.69 1ok2 h PRO 105 Ca 0.07 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1ok2 h PRO 105 Cb 1.04 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1ok2 h PRO 105 CO 0.81 0.03 0.00 -1.13 -0.23 0.00 0.00 178.00 177.48 1ok2 n SER 106 N -5.02 0.00 -4.57 1.44 3.41 -1.26 -4.80 113.62 102.82 1ok2 n SER 106 Ca 0.38 0.18 -0.24 0.00 -0.26 0.00 0.00 58.87 58.93 1ok2 n SER 106 Cb 1.35 -0.34 -0.09 0.00 -0.26 0.00 0.00 64.21 64.88 1ok2 n SER 106 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ok2 s LEU 107 N -2.68 2.90 -0.05 1.04 1.43 0.62 -5.13 118.68 116.82 1ok2 s LEU 107 Ca 0.13 -0.89 -0.13 0.00 -1.03 0.00 0.00 54.13 52.20 1ok2 s LEU 107 Cb 0.10 -1.37 -0.05 0.00 0.03 0.00 0.00 46.19 44.90 1ok2 s LEU 107 CO 0.24 -0.05 0.34 -0.55 0.23 0.00 0.00 176.35 176.56 1ok2 s SER 108 N -3.62 6.68 -0.67 2.29 0.15 -1.26 -4.88 113.70 112.38 1ok2 s SER 108 Ca 0.32 0.81 -0.02 0.00 0.70 0.00 0.00 55.95 57.75 1ok2 s SER 108 Cb -0.04 -2.21 0.43 0.00 -1.71 0.00 0.00 66.02 62.50 1ok2 s SER 108 CO 0.18 0.31 2.04 -0.81 1.20 0.00 0.00 173.24 176.16 1ok2 n PRO 109 N 2.12 2.67 -4.49 5.44 -0.04 -1.26 -4.66 135.00 134.77 1ok2 n PRO 109 Ca -0.15 -3.25 -0.23 0.00 -0.04 0.00 0.00 63.50 59.83 1ok2 n PRO 109 Cb 0.53 -2.27 -0.14 0.00 -0.04 0.00 0.00 33.50 31.59 1ok2 n PRO 109 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1ok2 s LYS 110 N -3.78 1.15 0.06 0.54 1.02 -1.26 -0.29 119.74 117.18 1ok2 s LYS 110 Ca 0.63 -0.84 0.08 0.00 0.02 0.00 0.00 55.97 55.86 1ok2 s LYS 110 Cb 0.49 -1.21 -0.03 0.00 -0.52 0.00 0.00 37.83 36.57 1ok2 s LYS 110 CO -0.05 0.30 -0.22 -0.51 -0.92 0.00 0.00 175.35 173.96 1ok2 s LEU 111 N -1.14 2.20 -0.02 3.17 1.43 -0.71 -4.98 118.68 118.63 1ok2 s LEU 111 Ca 0.04 -0.58 0.07 0.00 -1.03 0.00 0.00 54.13 52.64 1ok2 s LEU 111 Cb -0.08 -1.00 -0.02 0.00 0.03 0.00 0.00 46.19 45.12 1ok2 s LEU 111 CO 0.01 0.15 -0.23 -0.89 0.23 0.00 0.00 176.35 175.63 1ok2 s THR 112 N -0.89 1.81 -0.17 5.49 2.01 -1.26 -1.14 115.64 121.50 1ok2 s THR 112 Ca 0.08 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 60.81 1ok2 s THR 112 Cb -0.09 -1.51 -0.01 0.00 0.01 0.00 0.00 72.50 70.90 1ok2 s THR 112 CO 0.03 0.51 1.11 0.00 -0.69 0.00 0.00 174.62 175.57 1ok2 s LEU 114 N 2.90 3.09 0.54 0.00 1.02 0.69 -2.10 118.68 124.82 1ok2 s LEU 114 Ca 0.49 0.81 0.25 0.00 0.02 0.00 0.00 54.13 55.70 1ok2 s LEU 114 Cb -0.18 -3.60 1.43 0.00 0.02 0.00 0.00 46.19 43.85 1ok2 s LEU 114 CO 0.12 -1.21 2.01 1.56 0.02 0.00 0.00 176.35 178.86 1ok2 h GLN 115 N -0.37 0.00 -0.15 1.70 4.20 -1.96 0.34 115.11 118.87 1ok2 h GLN 115 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1ok2 h GLN 115 Cb 1.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.04 1ok2 h GLN 115 CO 0.62 0.00 0.00 0.27 -0.67 0.00 0.00 178.83 179.05 1ok2 n ASN 116 N -4.27 0.77 -1.34 1.46 0.23 -1.26 -4.85 115.26 106.01 1ok2 n ASN 116 Ca 0.08 -2.00 -0.09 0.00 -0.53 0.00 0.00 54.58 52.04 1ok2 n ASN 116 Cb 0.54 -0.10 0.01 0.00 -2.08 0.00 0.00 39.78 38.15 1ok2 n ASN 116 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1ok2 n LEU 117 N -0.08 -1.97 -4.07 -4.53 4.77 0.12 -5.04 117.00 106.20 1ok2 n LEU 117 Ca 0.05 -0.11 -0.17 0.00 -0.03 0.00 0.00 56.01 55.74 1ok2 n LEU 117 Cb 0.12 -1.49 -0.13 0.00 -2.33 0.00 0.00 43.42 39.59 1ok2 n LEU 117 CO 0.03 0.09 -0.43 -0.54 -1.33 0.00 0.00 177.39 175.21 1ok2 s LYS 118 N -4.97 0.71 0.38 3.23 1.02 -1.21 -4.59 119.74 114.31 1ok2 s LYS 118 Ca 0.12 -0.57 -0.26 0.00 0.02 0.00 0.00 55.97 55.28 1ok2 s LYS 118 Cb -0.05 -0.65 -0.09 0.00 -0.52 0.00 0.00 37.83 36.53 1ok2 s LYS 118 CO 0.14 0.16 1.13 -1.58 -0.92 0.00 0.00 175.35 174.28 1ok2 s TRP 119 N -0.73 3.19 1.09 3.18 0.52 -1.26 0.25 118.94 125.19 1ok2 s TRP 119 Ca -0.01 1.60 -0.14 0.00 0.02 0.00 0.00 56.10 57.57 1ok2 s TRP 119 Cb -0.06 -3.31 0.19 0.00 -1.15 0.00 0.00 33.47 29.13 1ok2 s TRP 119 CO 0.00 -1.03 0.73 -1.13 0.02 0.00 0.00 176.95 175.54 1ok2 n SER 120 N 0.21 -1.54 -4.74 2.95 3.41 0.14 -4.84 113.62 109.20 1ok2 n SER 120 Ca 0.04 0.02 -0.41 0.00 -0.26 0.00 0.00 58.87 58.25 1ok2 n SER 120 Cb 0.47 -1.22 -0.02 0.00 -0.26 0.00 0.00 64.21 63.17 1ok2 n SER 120 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ok2 s THR 121 N -2.41 2.39 0.05 6.66 2.01 -1.26 -4.85 115.64 118.23 1ok2 s THR 121 Ca 0.64 0.32 -0.24 0.00 0.31 0.00 0.00 61.69 62.72 1ok2 s THR 121 Cb -0.21 -3.20 -0.06 0.00 0.01 0.00 0.00 72.50 69.03 1ok2 s THR 121 CO 0.64 0.05 0.73 0.00 -0.69 0.00 0.00 174.62 175.35 1ok2 s ALA 122 N 0.10 3.41 0.42 7.40 0.00 -1.26 -5.04 121.76 126.78 1ok2 s ALA 122 Ca 0.62 0.24 0.06 0.00 0.00 0.00 0.00 51.96 52.88 1ok2 s ALA 122 Cb -0.45 -2.93 -0.07 0.00 0.00 0.00 0.00 23.12 19.68 1ok2 s ALA 122 CO 0.44 0.13 0.05 0.14 0.00 0.00 0.00 175.76 176.52 1ok2 s VAL 123 N -0.28 1.98 -1.33 0.00 -7.23 -1.26 -5.05 120.40 107.23 1ok2 s VAL 123 Ca 0.36 -1.93 -0.07 0.00 -1.81 0.00 0.00 61.98 58.54 1ok2 s VAL 123 Cb -0.20 -2.90 0.12 0.00 0.56 0.00 0.00 36.38 33.95 1ok2 s VAL 123 CO 0.22 0.00 2.27 -0.62 -0.31 0.00 0.00 175.10 176.66 1ok2 n GLU 124 N -1.07 4.22 0.27 4.82 4.71 -1.26 -4.67 120.64 127.66 1ok2 n GLU 124 Ca -0.05 -3.38 0.16 0.00 -0.01 0.00 0.00 57.16 53.87 1ok2 n GLU 124 Cb 0.66 -2.74 0.64 0.00 -1.01 0.00 0.00 31.44 29.00 1ok2 n GLU 124 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1ok2 h PHE 125 N 4.99 0.00 -3.84 -0.32 -5.15 -1.90 -3.38 116.94 107.34 1ok2 h PHE 125 Ca 0.62 0.00 -0.67 0.00 -0.20 0.00 0.00 57.97 57.72 1ok2 h PHE 125 Cb 0.40 0.00 -0.37 0.00 0.22 0.00 0.00 35.95 36.20 1ok2 h PHE 125 CO 1.52 0.03 -0.79 0.00 -2.00 0.00 0.00 178.31 177.06 1ok2 s LYS 127 N 1.09 3.24 0.36 0.00 -2.85 0.31 -4.79 119.74 117.09 1ok2 s LYS 127 Ca -0.07 -0.70 -0.28 0.00 -1.00 0.00 0.00 55.97 53.92 1ok2 s LYS 127 Cb -0.20 -2.85 -0.11 0.00 -2.06 0.00 0.00 37.83 32.61 1ok2 s LYS 127 CO -0.05 0.51 1.45 1.63 0.10 0.00 0.00 175.35 178.98 1ok2 n LYS 128 N -0.46 2.55 -1.91 1.78 5.02 -1.26 0.21 118.16 124.09 1ok2 n LYS 128 Ca -0.07 0.89 -0.31 0.00 -2.02 0.00 0.00 58.31 56.80 1ok2 n LYS 128 Cb 0.54 -2.59 0.01 0.00 -0.02 0.00 0.00 35.03 32.97 1ok2 n LYS 128 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ok2 s LYS 129 N -1.95 3.45 -0.09 1.97 1.02 -0.46 -4.64 119.74 119.04 1ok2 s LYS 129 Ca 0.54 0.90 -0.01 0.00 0.02 0.00 0.00 55.97 57.43 1ok2 s LYS 129 Cb -0.50 -2.06 -0.03 0.00 -0.52 0.00 0.00 37.83 34.72 1ok2 s LYS 129 CO 0.63 -0.69 -0.06 0.45 -0.92 0.00 0.00 175.35 174.76 1ok2 s SER 130 N -3.69 4.73 0.81 2.83 0.15 -1.26 0.28 113.70 117.56 1ok2 s SER 130 Ca 0.58 -0.04 -0.11 0.00 0.70 0.00 0.00 55.95 57.08 1ok2 s SER 130 Cb -0.12 -1.36 0.08 0.00 -1.71 0.00 0.00 66.02 62.91 1ok2 s SER 130 CO 0.48 0.31 1.09 0.00 1.20 0.00 0.00 173.24 176.32 1ok2 s PRO 132 N -5.00 0.82 0.20 0.00 0.02 -1.26 -4.89 135.00 124.89 1ok2 s PRO 132 Ca 0.61 1.23 -0.33 0.00 0.02 0.00 0.00 61.00 62.54 1ok2 s PRO 132 Cb -0.16 -1.73 -0.13 0.00 0.02 0.00 0.00 34.50 32.50 1ok2 s PRO 132 CO 0.56 -2.66 1.57 -1.71 -0.33 0.00 0.00 177.00 174.43 1ok2 n ASN 133 N -4.22 3.27 -0.24 2.53 2.85 -1.26 -4.84 115.26 113.34 1ok2 n ASN 133 Ca 0.09 1.10 0.13 0.00 -0.11 0.00 0.00 54.58 55.78 1ok2 n ASN 133 Cb 0.53 -1.47 0.41 0.00 1.24 0.00 0.00 39.78 40.49 1ok2 n ASN 133 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ok2 h PRO 134 N 5.61 0.60 0.00 1.20 0.11 -2.00 -3.48 132.00 134.04 1ok2 h PRO 134 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1ok2 h PRO 134 Cb 1.25 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1ok2 h PRO 134 CO 0.86 0.40 0.00 0.41 -0.21 0.00 0.00 178.00 179.46 1ok2 n GLY 135 N -1.46 -0.55 3.18 -0.55 0.00 -1.26 -4.96 105.19 99.59 1ok2 n GLY 135 Ca 0.16 -1.83 -0.17 0.00 0.00 0.00 0.00 46.02 44.18 1ok2 n GLY 135 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ok2 s GLU 136 N 0.00 0.84 -0.21 1.61 0.41 -1.26 -4.98 118.70 115.11 1ok2 s GLU 136 Ca 0.00 -1.05 -0.01 0.00 -0.41 0.00 0.00 54.97 53.49 1ok2 s GLU 136 Cb 0.00 -0.72 0.01 0.00 -1.78 0.00 0.00 34.13 31.65 1ok2 s GLU 136 CO 0.00 0.14 -0.11 0.42 -0.49 0.00 0.00 175.26 175.22 1ok2 s ILE 137 N -1.79 2.70 0.08 -1.63 1.01 -1.26 -5.07 121.20 115.24 1ok2 s ILE 137 Ca 0.02 -0.84 -0.31 0.00 0.00 0.00 0.00 60.65 59.52 1ok2 s ILE 137 Cb -0.07 -2.24 -0.09 0.00 0.01 0.00 0.00 42.46 40.06 1ok2 s ILE 137 CO 0.02 0.40 1.82 -0.60 0.00 0.00 0.00 174.94 176.58 1ok2 s ARG 138 N 1.35 4.15 -1.33 2.79 3.52 -1.26 -1.76 118.95 126.41 1ok2 s ARG 138 Ca 0.04 2.53 0.00 0.00 -0.13 0.00 0.00 55.73 58.16 1ok2 s ARG 138 Cb -0.15 -3.76 0.00 0.00 -1.56 0.00 0.00 34.95 29.48 1ok2 s ARG 138 CO -0.07 -0.85 0.00 0.09 -0.81 0.00 0.00 175.30 173.65 1ok2 n ASN 139 N 6.23 -4.48 -1.59 -2.12 3.02 -1.26 -3.91 115.26 111.15 1ok2 n ASN 139 Ca 0.18 0.17 -0.05 0.00 -0.03 0.00 0.00 54.58 54.85 1ok2 n ASN 139 Cb 0.40 -3.42 -0.01 0.00 -0.61 0.00 0.00 39.78 36.13 1ok2 n ASN 139 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ok2 n GLY 140 N -1.15 3.19 3.11 7.41 0.00 -0.72 -1.75 105.19 115.28 1ok2 n GLY 140 Ca -0.15 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.21 1ok2 n GLY 140 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ok2 s GLN 141 N -2.29 0.55 -0.18 1.61 -0.21 0.84 -4.64 119.66 115.35 1ok2 s GLN 141 Ca 0.09 -0.62 -0.01 0.00 0.02 0.00 0.00 55.36 54.85 1ok2 s GLN 141 Cb 0.00 0.22 0.00 0.00 1.00 0.00 0.00 33.01 34.23 1ok2 s GLN 141 CO 0.07 -0.14 -0.14 0.42 -2.12 0.00 0.00 175.29 173.38 1ok2 s ILE 142 N -2.15 2.67 -0.30 1.08 1.01 -1.26 -1.64 121.20 120.61 1ok2 s ILE 142 Ca -0.09 -0.75 -0.13 0.00 0.00 0.00 0.00 60.65 59.69 1ok2 s ILE 142 Cb -0.04 -2.15 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 1ok2 s ILE 142 CO -0.02 0.50 0.26 -0.62 0.00 0.00 0.00 174.94 175.06 1ok2 s ASP 143 N 1.11 6.09 -0.74 3.58 -1.08 -0.17 -4.97 116.67 120.50 1ok2 s ASP 143 Ca 0.00 -0.08 -0.07 0.00 -0.52 0.00 0.00 52.55 51.88 1ok2 s ASP 143 Cb -0.14 -2.15 0.19 0.00 -1.46 0.00 0.00 42.92 39.36 1ok2 s ASP 143 CO -0.05 -0.16 0.61 -0.69 0.52 0.00 0.00 175.17 175.41 1ok2 s VAL 144 N 1.85 4.57 0.29 1.11 1.01 -1.26 -2.35 120.40 125.62 1ok2 s VAL 144 Ca 0.09 -2.85 0.07 0.00 0.00 0.00 0.00 61.98 59.29 1ok2 s VAL 144 Cb -0.16 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.35 1ok2 s VAL 144 CO 0.11 -0.96 1.68 1.55 0.00 0.00 0.00 175.10 177.48 1ok2 h PRO 145 N 7.24 0.19 -1.08 2.72 0.13 -1.96 -3.38 132.00 135.86 1ok2 h PRO 145 Ca 0.05 -0.10 -0.37 0.00 -0.87 0.00 0.00 66.00 64.72 1ok2 h PRO 145 Cb 0.98 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.80 1ok2 h PRO 145 CO 0.74 0.62 -0.92 0.41 -0.23 0.00 0.00 178.00 178.62 1ok2 n GLY 146 N -0.09 2.18 2.35 1.56 0.00 -1.26 -5.14 105.19 104.77 1ok2 n GLY 146 Ca -0.02 -1.02 0.04 0.00 0.00 0.00 0.00 46.02 45.03 1ok2 n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ok2 n GLY 147 N 0.12 -2.05 0.77 -0.02 0.00 -1.26 -4.72 105.19 98.04 1ok2 n GLY 147 Ca 0.14 -1.39 0.06 0.00 0.00 0.00 0.00 46.02 44.82 1ok2 n GLY 147 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ok2 n ILE 148 N -1.55 1.35 -2.07 -0.61 -5.35 -1.26 -4.66 119.36 105.21 1ok2 n ILE 148 Ca 0.00 -2.20 -0.28 0.00 -0.27 0.00 0.00 62.75 60.00 1ok2 n ILE 148 Cb 0.14 0.17 0.06 0.00 -1.74 0.00 0.00 39.64 38.27 1ok2 n ILE 148 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1ok2 s LEU 149 N -2.00 2.82 -0.20 7.28 1.43 -1.26 -1.23 118.68 125.52 1ok2 s LEU 149 Ca 0.33 0.76 -0.40 0.00 -1.03 0.00 0.00 54.13 53.79 1ok2 s LEU 149 Cb 0.33 -3.43 -0.16 0.00 0.03 0.00 0.00 46.19 42.96 1ok2 s LEU 149 CO -0.08 -1.53 1.64 0.33 0.23 0.00 0.00 176.35 176.94 1ok2 n PHE 150 N -3.00 1.91 0.00 0.29 -0.00 0.14 -1.00 117.46 115.80 1ok2 n PHE 150 Ca 0.07 0.58 0.00 0.00 -0.00 0.00 0.00 57.45 58.10 1ok2 n PHE 150 Cb 0.59 -2.42 0.00 0.00 -0.00 0.00 0.00 39.48 37.65 1ok2 n PHE 150 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ok2 n GLY 151 N 3.78 0.25 3.83 7.13 0.00 -0.73 -4.96 105.19 114.49 1ok2 n GLY 151 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 1ok2 n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ok2 s ALA 152 N -2.00 2.95 0.00 4.61 0.00 -0.17 -4.75 121.76 122.40 1ok2 s ALA 152 Ca 0.00 0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.23 1ok2 s ALA 152 Cb 0.00 -3.15 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 1ok2 s ALA 152 CO 0.00 -0.54 -0.23 0.99 0.00 0.00 0.00 175.76 175.98 1ok2 s THR 153 N -2.68 1.83 0.04 0.00 2.01 -1.26 -0.57 115.64 115.01 1ok2 s THR 153 Ca 0.60 -1.08 0.03 0.00 0.31 0.00 0.00 61.69 61.55 1ok2 s THR 153 Cb -0.12 -1.54 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 1ok2 s THR 153 CO 0.38 0.44 -0.10 0.27 -0.69 0.00 0.00 174.62 174.91 1ok2 s ILE 154 N -0.62 0.76 0.23 1.82 -4.36 0.20 -4.38 121.20 114.86 1ok2 s ILE 154 Ca 0.09 -1.05 0.11 0.00 -0.26 0.00 0.00 60.65 59.55 1ok2 s ILE 154 Cb -0.09 -0.76 -0.05 0.00 1.25 0.00 0.00 42.46 42.81 1ok2 s ILE 154 CO 0.00 -0.24 -0.20 -0.94 0.24 0.00 0.00 174.94 173.80 1ok2 s SER 155 N -1.42 3.62 0.09 4.36 1.04 -0.99 -0.52 113.70 119.88 1ok2 s SER 155 Ca -0.05 -0.90 0.10 0.00 0.48 0.00 0.00 55.95 55.58 1ok2 s SER 155 Cb -0.09 -0.34 -0.03 0.00 0.10 0.00 0.00 66.02 65.66 1ok2 s SER 155 CO 0.01 0.08 -0.26 -0.36 0.98 0.00 0.00 173.24 173.69 1ok2 s PHE 156 N -2.05 2.29 0.03 5.02 0.40 -0.42 -1.00 117.98 122.25 1ok2 s PHE 156 Ca 0.25 -0.40 -0.09 0.00 -0.60 0.00 0.00 56.93 56.10 1ok2 s PHE 156 Cb -0.07 -1.30 0.00 0.00 0.51 0.00 0.00 43.02 42.16 1ok2 s PHE 156 CO 0.13 0.24 0.18 -1.54 0.70 0.00 0.00 175.22 174.92 1ok2 s SER 157 N -1.67 0.04 -0.06 1.36 1.04 -0.65 -4.84 113.70 108.92 1ok2 s SER 157 Ca 0.13 -0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.24 1ok2 s SER 157 Cb -0.10 0.27 -0.03 0.00 0.10 0.00 0.00 66.02 66.26 1ok2 s SER 157 CO 0.04 -0.51 -0.10 0.00 0.98 0.00 0.00 173.24 173.64 1ok2 s ASN 159 N -0.78 2.28 0.08 0.00 0.02 -0.72 -4.82 114.94 111.00 1ok2 s ASN 159 Ca 0.12 1.87 -0.33 0.00 -1.02 0.00 0.00 52.86 53.50 1ok2 s ASN 159 Cb -0.11 -2.44 -0.12 0.00 0.02 0.00 0.00 41.25 38.60 1ok2 s ASN 159 CO 0.01 -3.45 1.75 0.41 0.02 0.00 0.00 177.10 175.84 1ok2 n THR 160 N -4.44 0.28 0.00 1.60 -1.04 -1.26 -1.49 114.28 107.93 1ok2 n THR 160 Ca 0.08 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1ok2 n THR 160 Cb 0.53 -1.85 0.00 0.00 -1.82 0.00 0.00 70.33 67.19 1ok2 n THR 160 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ok2 n GLY 161 N 3.98 0.45 3.25 3.41 0.00 -1.26 -5.00 105.19 110.02 1ok2 n GLY 161 Ca 0.19 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 1ok2 n GLY 161 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ok2 s TYR 162 N -2.00 1.70 -0.10 1.61 1.51 -0.55 -0.55 117.35 118.97 1ok2 s TYR 162 Ca 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.67 1ok2 s TYR 162 Cb 0.00 -0.97 -0.02 0.00 -0.11 0.00 0.00 41.96 40.85 1ok2 s TYR 162 CO 0.00 0.13 -0.10 0.21 -1.11 0.00 0.00 175.55 174.68 1ok2 s LYS 163 N -1.52 3.03 -0.08 -0.62 2.20 -0.47 -4.63 119.74 117.65 1ok2 s LYS 163 Ca 0.06 -0.62 -0.29 0.00 -0.36 0.00 0.00 55.97 54.76 1ok2 s LYS 163 Cb -0.09 -2.61 -0.02 0.00 -1.51 0.00 0.00 37.83 33.60 1ok2 s LYS 163 CO 0.03 0.46 0.97 -1.17 -0.36 0.00 0.00 175.35 175.28 1ok2 s LEU 164 N -0.27 4.28 -0.22 5.43 0.20 -1.26 -2.39 118.68 124.46 1ok2 s LEU 164 Ca 0.03 1.53 0.01 0.00 0.69 0.00 0.00 54.13 56.38 1ok2 s LEU 164 Cb -0.13 -3.51 0.05 0.00 -0.43 0.00 0.00 46.19 42.17 1ok2 s LEU 164 CO 0.03 -0.37 -0.09 -0.36 -0.29 0.00 0.00 176.35 175.26 1ok2 s PHE 165 N 1.67 2.53 -1.53 5.38 0.08 -0.68 -4.98 117.98 120.45 1ok2 s PHE 165 Ca 0.48 -1.73 0.00 0.00 0.12 0.00 0.00 56.93 55.80 1ok2 s PHE 165 Cb -0.19 -1.67 0.00 0.00 -0.57 0.00 0.00 43.02 40.59 1ok2 s PHE 165 CO 0.20 -0.77 0.00 0.41 -0.10 0.00 0.00 175.22 174.96 1ok2 n GLY 166 N 4.65 0.48 3.78 4.36 0.00 -1.26 -0.53 105.19 116.67 1ok2 n GLY 166 Ca -0.14 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.53 1ok2 n GLY 166 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ok2 s SER 167 N -4.00 6.72 0.00 1.61 1.04 -1.26 -4.95 113.70 112.86 1ok2 s SER 167 Ca 0.00 2.05 0.23 0.00 0.48 0.00 0.00 55.95 58.71 1ok2 s SER 167 Cb 0.00 -2.59 0.02 0.00 0.10 0.00 0.00 66.02 63.56 1ok2 s SER 167 CO 0.00 -0.52 1.11 0.35 0.98 0.00 0.00 173.24 175.17 1ok2 n THR 168 N -0.10 0.00 -3.53 2.02 -2.24 -1.26 -4.37 114.28 104.80 1ok2 n THR 168 Ca 0.05 -0.28 -0.10 0.00 -2.27 0.00 0.00 64.05 61.46 1ok2 n THR 168 Cb 0.50 1.26 -0.02 0.00 -2.10 0.00 0.00 70.33 69.96 1ok2 n THR 168 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ok2 s SER 169 N -2.44 -0.45 0.00 3.42 1.04 -1.26 -1.30 113.70 112.70 1ok2 s SER 169 Ca 0.19 -0.13 -0.06 0.00 0.48 0.00 0.00 55.95 56.43 1ok2 s SER 169 Cb 0.18 0.57 -0.00 0.00 0.10 0.00 0.00 66.02 66.87 1ok2 s SER 169 CO 0.55 -0.96 0.11 -0.55 0.98 0.00 0.00 173.24 173.38 1ok2 s SER 170 N -2.74 0.05 -0.04 7.02 0.15 0.32 -4.62 113.70 113.83 1ok2 s SER 170 Ca 0.04 -0.22 0.03 0.00 0.70 0.00 0.00 55.95 56.50 1ok2 s SER 170 Cb -0.02 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 1ok2 s SER 170 CO -0.08 -0.34 -0.13 0.12 1.20 0.00 0.00 173.24 174.01 1ok2 s PHE 171 N -1.31 1.39 -0.68 3.44 2.19 -1.26 -0.62 117.98 121.13 1ok2 s PHE 171 Ca -0.14 -0.42 -0.27 0.00 0.33 0.00 0.00 56.93 56.44 1ok2 s PHE 171 Cb -0.08 -0.97 -0.00 0.00 -1.31 0.00 0.00 43.02 40.66 1ok2 s PHE 171 CO 0.01 -0.18 1.63 0.00 1.83 0.00 0.00 175.22 178.52 1ok2 s LEU 173 N 7.75 4.23 -0.05 0.00 1.02 0.43 -1.78 118.68 130.28 1ok2 s LEU 173 Ca 0.55 0.09 -0.26 0.00 0.02 0.00 0.00 54.13 54.52 1ok2 s LEU 173 Cb -0.10 -2.80 -0.03 0.00 0.02 0.00 0.00 46.19 43.28 1ok2 s LEU 173 CO 0.17 0.03 0.82 -0.51 0.02 0.00 0.00 176.35 176.88 1ok2 s ILE 174 N -1.79 4.96 -0.35 -0.59 2.07 -1.26 0.39 121.20 124.62 1ok2 s ILE 174 Ca 0.34 1.70 0.01 0.00 -1.41 0.00 0.00 60.65 61.28 1ok2 s ILE 174 Cb -0.10 -4.16 0.11 0.00 0.13 0.00 0.00 42.46 38.44 1ok2 s ILE 174 CO 0.28 0.19 0.13 -0.55 -1.91 0.00 0.00 174.94 173.08 1ok2 s SER 175 N 0.91 4.09 1.86 4.50 0.15 0.21 -4.86 113.70 120.57 1ok2 s SER 175 Ca 0.43 -2.03 0.00 0.00 0.70 0.00 0.00 55.95 55.05 1ok2 s SER 175 Cb -0.19 -1.08 0.00 0.00 -1.71 0.00 0.00 66.02 63.04 1ok2 s SER 175 CO 0.21 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.89 1ok2 n GLY 176 N 4.35 2.64 0.69 9.45 0.00 -1.26 -2.07 105.19 118.99 1ok2 n GLY 176 Ca 0.02 0.20 0.03 0.00 0.00 0.00 0.00 46.02 46.27 1ok2 n GLY 176 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ok2 n SER 177 N 10.45 1.91 0.00 1.61 3.41 -1.26 -4.93 113.62 124.81 1ok2 n SER 177 Ca 0.00 -2.14 0.00 0.00 -0.26 0.00 0.00 58.87 56.47 1ok2 n SER 177 Cb 0.00 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 1ok2 n SER 177 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ok2 n SER 178 N 0.22 0.00 -4.04 4.04 3.41 -0.88 -5.13 113.62 111.24 1ok2 n SER 178 Ca 0.09 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.48 1ok2 n SER 178 Cb 0.37 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.17 1ok2 n SER 178 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1ok2 s VAL 179 N -2.68 0.94 0.13 -3.33 -7.23 -1.26 0.68 120.40 107.65 1ok2 s VAL 179 Ca 0.00 -0.46 -0.01 0.00 -1.81 0.00 0.00 61.98 59.70 1ok2 s VAL 179 Cb 0.00 -0.82 -0.04 0.00 0.56 0.00 0.00 36.38 36.08 1ok2 s VAL 179 CO 0.00 0.28 0.05 0.00 -0.31 0.00 0.00 175.10 175.13 1ok2 s GLN 180 N 0.09 0.92 0.13 4.82 -2.07 0.16 -4.67 119.66 119.03 1ok2 s GLN 180 Ca -0.02 -1.43 -0.30 0.00 -1.82 0.00 0.00 55.36 51.78 1ok2 s GLN 180 Cb -0.09 0.23 -0.07 0.00 -1.09 0.00 0.00 33.01 32.00 1ok2 s GLN 180 CO 0.01 -0.25 1.26 -1.58 -1.32 0.00 0.00 175.29 173.40 1ok2 s TRP 181 N -4.04 3.36 0.47 9.60 0.52 -1.26 -0.43 118.94 127.17 1ok2 s TRP 181 Ca 0.24 1.24 0.18 0.00 0.02 0.00 0.00 56.10 57.78 1ok2 s TRP 181 Cb 0.07 -3.51 1.21 0.00 -1.15 0.00 0.00 33.47 30.10 1ok2 s TRP 181 CO 0.01 -1.61 2.06 0.66 0.02 0.00 0.00 176.95 178.10 1ok2 h SER 182 N 6.20 0.00 -4.29 2.95 4.64 -1.15 -3.44 113.55 118.47 1ok2 h SER 182 Ca -0.43 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.54 1ok2 h SER 182 Cb 1.21 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 63.05 1ok2 h SER 182 CO 0.80 0.12 -0.76 -1.81 -0.87 0.00 0.00 176.83 174.31 1ok2 s ASP 183 N -6.79 1.04 0.66 4.97 1.11 -1.26 -4.94 116.67 111.46 1ok2 s ASP 183 Ca -0.04 -0.33 -0.11 0.00 0.18 0.00 0.00 52.55 52.25 1ok2 s ASP 183 Cb 0.15 -0.06 -0.01 0.00 1.07 0.00 0.00 42.92 44.08 1ok2 s ASP 183 CO 0.66 -0.01 1.06 -2.16 1.18 0.00 0.00 175.17 175.89 1ok2 s PRO 184 N -0.82 3.20 0.44 8.23 0.04 -1.26 -4.82 135.00 140.00 1ok2 s PRO 184 Ca -0.01 0.57 -0.25 0.00 0.04 0.00 0.00 61.00 61.34 1ok2 s PRO 184 Cb -0.06 -2.06 -0.09 0.00 0.04 0.00 0.00 34.50 32.33 1ok2 s PRO 184 CO 0.00 -0.81 1.34 1.28 0.04 0.00 0.00 177.00 178.85 1ok2 n LEU 185 N -2.87 4.55 -4.95 -3.56 4.32 -1.26 -4.48 117.00 108.76 1ok2 n LEU 185 Ca 0.06 1.10 -0.24 0.00 -0.02 0.00 0.00 56.01 56.91 1ok2 n LEU 185 Cb 0.56 -1.54 0.07 0.00 -1.62 0.00 0.00 43.42 40.88 1ok2 n LEU 185 CO 0.58 -0.47 0.54 -2.16 -1.22 0.00 0.00 177.39 174.65 1ok2 s PRO 186 N -2.35 2.20 -0.08 3.23 0.04 -1.26 -4.81 135.00 131.97 1ok2 s PRO 186 Ca 0.62 -0.52 -0.02 0.00 0.04 0.00 0.00 61.00 61.12 1ok2 s PRO 186 Cb -0.48 -2.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.75 1ok2 s PRO 186 CO 0.57 -1.13 0.02 -2.00 0.04 0.00 0.00 177.00 174.50 1ok2 s GLU 187 N -5.10 3.01 -0.44 4.56 2.12 0.31 -4.89 118.70 118.26 1ok2 s GLU 187 Ca 0.60 -0.40 -0.11 0.00 0.36 0.00 0.00 54.97 55.42 1ok2 s GLU 187 Cb -0.10 -2.82 0.08 0.00 0.26 0.00 0.00 34.13 31.56 1ok2 s GLU 187 CO 0.43 0.70 0.31 0.00 -0.54 0.00 0.00 175.26 176.16 1ok2 s ARG 189 N 1.48 3.85 0.13 0.00 0.52 -1.01 -4.77 118.95 119.15 1ok2 s ARG 189 Ca 0.04 -0.31 -0.33 0.00 -0.52 0.00 0.00 55.73 54.60 1ok2 s ARG 189 Cb -0.24 -3.19 -0.13 0.00 0.52 0.00 0.00 34.95 31.91 1ok2 s ARG 189 CO 0.03 0.38 1.68 -1.91 0.02 0.00 0.00 175.30 175.50 1ok2 n GLU 190 N 3.21 2.36 -3.05 3.54 2.13 -1.26 -1.37 120.64 126.19 1ok2 n GLU 190 Ca -0.17 0.85 -0.40 0.00 0.66 0.00 0.00 57.16 58.11 1ok2 n GLU 190 Cb 0.53 -2.67 -0.05 0.00 0.27 0.00 0.00 31.44 29.52 1ok2 n GLU 190 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1ok2 s ILE 191 N 1.66 4.92 -0.05 6.31 1.01 0.29 -4.88 121.20 130.45 1ok2 s ILE 191 Ca 0.80 1.47 0.01 0.00 0.00 0.00 0.00 60.65 62.93 1ok2 s ILE 191 Cb -0.62 -4.04 -0.03 0.00 0.01 0.00 0.00 42.46 37.77 1ok2 s ILE 191 CO 0.39 0.32 -0.04 -0.31 0.00 0.00 0.00 174.94 175.29 1ok2 s TYR 192 N 0.34 3.01 0.64 3.97 1.51 -1.26 -3.91 117.35 121.65 1ok2 s TYR 192 Ca 0.37 0.07 -0.11 0.00 -1.01 0.00 0.00 57.07 56.38 1ok2 s TYR 192 Cb -0.19 -1.71 -0.03 0.00 -0.11 0.00 0.00 41.96 39.93 1ok2 s TYR 192 CO 0.20 0.39 1.04 0.00 -1.11 0.00 0.00 175.55 176.07 1ok2 s PRO 194 N -5.17 0.63 0.31 0.00 0.04 -1.26 -4.69 135.00 124.87 1ok2 s PRO 194 Ca 0.56 1.34 -0.30 0.00 0.04 0.00 0.00 61.00 62.65 1ok2 s PRO 194 Cb -0.12 -1.70 -0.12 0.00 0.04 0.00 0.00 34.50 32.61 1ok2 s PRO 194 CO 0.54 -2.83 1.50 0.00 0.04 0.00 0.00 177.00 176.26 1ok2 n ALA 195 N -4.35 2.13 -1.76 8.56 0.00 -1.26 -4.90 120.51 118.92 1ok2 n ALA 195 Ca 0.09 0.37 -0.39 0.00 0.00 0.00 0.00 53.44 53.52 1ok2 n ALA 195 Cb 0.53 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1ok2 n ALA 195 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ok2 s PRO 196 N -1.02 3.77 0.46 0.00 0.04 -1.26 -4.96 135.00 132.04 1ok2 s PRO 196 Ca 0.61 2.12 -0.23 0.00 0.04 0.00 0.00 61.00 63.54 1ok2 s PRO 196 Cb -0.52 -2.61 -0.07 0.00 0.04 0.00 0.00 34.50 31.34 1ok2 s PRO 196 CO 0.54 -0.64 1.17 -1.25 0.04 0.00 0.00 177.00 176.86 1ok2 s PRO 197 N -2.45 3.74 0.30 0.56 0.04 -1.26 -5.04 135.00 130.89 1ok2 s PRO 197 Ca 0.61 1.79 -0.02 0.00 0.04 0.00 0.00 61.00 63.41 1ok2 s PRO 197 Cb -0.37 -2.40 -0.04 0.00 0.04 0.00 0.00 34.50 31.73 1ok2 s PRO 197 CO 0.47 -0.57 0.53 -0.65 0.04 0.00 0.00 177.00 176.81 1ok2 s GLN 198 N -2.71 3.55 0.12 4.56 -1.52 -1.26 -5.00 119.66 117.40 1ok2 s GLN 198 Ca 0.64 -0.19 0.09 0.00 -1.95 0.00 0.00 55.36 53.95 1ok2 s GLN 198 Cb -0.29 -2.68 -0.04 0.00 -0.22 0.00 0.00 33.01 29.78 1ok2 s GLN 198 CO 0.35 0.21 -0.23 0.96 -0.25 0.00 0.00 175.29 176.33 1ok2 s ILE 199 N -2.16 1.92 0.16 1.08 -4.36 -1.26 -5.09 121.20 111.48 1ok2 s ILE 199 Ca 0.41 -1.67 -0.31 0.00 -0.26 0.00 0.00 60.65 58.82 1ok2 s ILE 199 Cb -0.10 -1.74 -0.09 0.00 1.25 0.00 0.00 42.46 41.77 1ok2 s ILE 199 CO 0.33 -0.05 1.46 -1.81 0.24 0.00 0.00 174.94 175.11 1ok2 s ASP 200 N -2.07 6.72 -1.47 4.36 1.01 -1.26 -3.26 116.67 120.69 1ok2 s ASP 200 Ca 0.10 2.49 -0.05 0.00 0.71 0.00 0.00 52.55 55.81 1ok2 s ASP 200 Cb -0.09 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.24 1ok2 s ASP 200 CO 0.05 -0.71 0.62 0.59 0.21 0.00 0.00 175.17 175.93 1ok2 n ASN 201 N 3.62 -5.95 -3.76 0.27 3.02 -1.26 -4.27 115.26 106.92 1ok2 n ASN 201 Ca 0.11 -0.29 -0.07 0.00 -0.03 0.00 0.00 54.58 54.30 1ok2 n ASN 201 Cb 0.41 -4.76 -0.02 0.00 -0.61 0.00 0.00 39.78 34.80 1ok2 n ASN 201 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ok2 s GLY 202 N -2.77 -0.21 0.26 7.41 0.00 -1.20 -1.56 107.32 109.25 1ok2 s GLY 202 Ca 0.31 -0.08 0.01 0.00 0.00 0.00 0.00 44.72 44.96 1ok2 s GLY 202 CO 0.38 -0.02 0.10 -0.26 0.00 0.00 0.00 173.10 173.30 1ok2 s ILE 203 N -3.78 0.48 -0.26 0.90 -4.36 0.48 -4.45 121.20 110.21 1ok2 s ILE 203 Ca 0.09 -2.00 -0.10 0.00 -0.26 0.00 0.00 60.65 58.39 1ok2 s ILE 203 Cb -0.04 -2.62 -0.04 0.00 1.25 0.00 0.00 42.46 41.01 1ok2 s ILE 203 CO 0.03 0.00 0.14 -0.63 0.24 0.00 0.00 174.94 174.72 1ok2 s ILE 204 N -3.79 4.95 -0.43 8.37 1.01 -1.26 -1.57 121.20 128.48 1ok2 s ILE 204 Ca 0.38 0.04 -0.28 0.00 0.00 0.00 0.00 60.65 60.79 1ok2 s ILE 204 Cb 0.08 -3.34 -0.01 0.00 0.01 0.00 0.00 42.46 39.20 1ok2 s ILE 204 CO 0.14 0.29 1.67 -1.10 0.00 0.00 0.00 174.94 175.94 1ok2 s GLN 205 N 1.61 3.26 -1.00 2.79 -0.21 0.27 -3.79 119.66 122.59 1ok2 s GLN 205 Ca 0.07 1.04 -0.08 0.00 0.02 0.00 0.00 55.36 56.41 1ok2 s GLN 205 Cb -0.15 -4.18 -0.04 0.00 1.00 0.00 0.00 33.01 29.63 1ok2 s GLN 205 CO 0.08 -1.95 0.84 0.41 -2.12 0.00 0.00 175.29 172.54 1ok2 n GLY 206 N 5.37 -1.15 3.75 3.09 0.00 -1.26 -4.65 105.19 110.33 1ok2 n GLY 206 Ca 0.20 0.54 -0.37 0.00 0.00 0.00 0.00 46.02 46.39 1ok2 n GLY 206 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ok2 s GLU 207 N -4.46 3.00 0.34 1.61 2.12 -1.25 -5.03 118.70 115.03 1ok2 s GLU 207 Ca 0.36 1.98 0.08 0.00 0.36 0.00 0.00 54.97 57.75 1ok2 s GLU 207 Cb -0.07 -2.04 -0.04 0.00 0.26 0.00 0.00 34.13 32.24 1ok2 s GLU 207 CO 0.77 -1.22 0.19 1.03 -0.54 0.00 0.00 175.26 175.49 1ok2 s ARG 208 N -3.17 2.46 0.35 4.30 0.52 -1.26 -5.03 118.95 117.12 1ok2 s ARG 208 Ca 0.76 -1.49 0.22 0.00 -0.52 0.00 0.00 55.73 54.69 1ok2 s ARG 208 Cb -0.34 -2.25 0.21 0.00 0.52 0.00 0.00 34.95 33.09 1ok2 s ARG 208 CO 0.38 0.09 1.42 -0.44 0.02 0.00 0.00 175.30 176.78 1ok2 h ASP 209 N 1.45 0.00 -4.28 0.23 3.45 -2.06 -3.45 116.42 111.76 1ok2 h ASP 209 Ca -0.44 0.00 -0.18 0.00 0.43 0.00 0.00 57.03 56.84 1ok2 h ASP 209 Cb 1.25 0.00 -0.24 0.00 -0.56 0.00 0.00 39.33 39.78 1ok2 h ASP 209 CO 0.62 0.06 -0.60 -1.00 -1.57 0.00 0.00 179.24 176.75 1ok2 s HIS 210 N -3.22 -0.00 -0.08 4.55 3.76 -1.26 -5.05 115.29 113.99 1ok2 s HIS 210 Ca 0.04 0.02 -0.00 0.00 -0.15 0.00 0.00 55.06 54.97 1ok2 s HIS 210 Cb 0.07 -0.03 0.02 0.00 1.11 0.00 0.00 32.58 33.75 1ok2 s HIS 210 CO 0.71 -0.13 -0.04 0.71 -0.85 0.00 0.00 174.74 175.14 1ok2 s TYR 211 N -0.57 0.94 0.18 1.40 1.51 -1.26 -5.09 117.35 114.45 1ok2 s TYR 211 Ca -0.06 -0.34 0.02 0.00 -1.01 0.00 0.00 57.07 55.67 1ok2 s TYR 211 Cb -0.04 -0.90 0.02 0.00 -0.11 0.00 0.00 41.96 40.93 1ok2 s TYR 211 CO 0.00 -0.34 0.17 0.41 -1.11 0.00 0.00 175.55 174.68 1ok2 n GLY 212 N 4.78 2.62 3.62 0.71 0.00 -1.26 -1.30 105.19 114.36 1ok2 n GLY 212 Ca -0.13 -2.20 -0.46 0.00 0.00 0.00 0.00 46.02 43.23 1ok2 n GLY 212 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1ok2 n TYR 213 N -1.08 1.66 -0.98 1.61 9.36 -1.25 -1.81 117.16 124.66 1ok2 n TYR 213 Ca 0.01 0.59 0.00 0.00 3.32 0.00 0.00 57.90 61.83 1ok2 n TYR 213 Cb 0.20 -2.34 0.00 0.00 -0.63 0.00 0.00 39.34 36.57 1ok2 n TYR 213 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1ok2 n ARG 214 N 1.47 -1.64 -3.36 2.98 1.74 0.13 -4.94 116.66 113.02 1ok2 n ARG 214 Ca 0.12 0.41 -0.36 0.00 -0.77 0.00 0.00 57.85 57.25 1ok2 n ARG 214 Cb 0.30 -4.69 -0.06 0.00 -1.02 0.00 0.00 32.46 26.99 1ok2 n ARG 214 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1ok2 s GLN 215 N -1.68 3.99 0.19 5.56 -0.21 -0.75 -4.78 119.66 121.99 1ok2 s GLN 215 Ca 0.00 0.50 0.11 0.00 0.02 0.00 0.00 55.36 55.99 1ok2 s GLN 215 Cb 0.00 -2.98 -0.04 0.00 1.00 0.00 0.00 33.01 30.98 1ok2 s GLN 215 CO 0.00 0.51 -0.20 -1.54 -2.12 0.00 0.00 175.29 171.94 1ok2 s SER 216 N -1.62 3.65 -0.13 5.90 1.04 -1.26 -0.19 113.70 121.08 1ok2 s SER 216 Ca 0.36 -0.80 0.02 0.00 0.48 0.00 0.00 55.95 56.01 1ok2 s SER 216 Cb -0.16 -0.37 0.01 0.00 0.10 0.00 0.00 66.02 65.61 1ok2 s SER 216 CO 0.19 0.11 -0.18 0.68 0.98 0.00 0.00 173.24 175.02 1ok2 s VAL 217 N -1.70 1.78 -0.15 5.02 -7.23 -0.14 -4.99 120.40 112.99 1ok2 s VAL 217 Ca 0.22 -0.80 -0.08 0.00 -1.81 0.00 0.00 61.98 59.51 1ok2 s VAL 217 Cb -0.08 -1.60 -0.04 0.00 0.56 0.00 0.00 36.38 35.21 1ok2 s VAL 217 CO 0.11 0.49 0.12 -0.89 -0.31 0.00 0.00 175.10 174.63 1ok2 s THR 218 N 1.03 5.33 0.27 5.32 2.01 -1.26 -1.60 115.64 126.74 1ok2 s THR 218 Ca -0.04 0.15 0.07 0.00 0.31 0.00 0.00 61.69 62.18 1ok2 s THR 218 Cb -0.15 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 68.97 1ok2 s THR 218 CO -0.04 0.54 0.27 -0.31 -0.69 0.00 0.00 174.62 174.38 1ok2 s TYR 219 N -0.40 3.16 -0.16 4.92 1.51 0.11 -0.57 117.35 125.92 1ok2 s TYR 219 Ca 0.11 -0.12 -0.13 0.00 -1.01 0.00 0.00 57.07 55.92 1ok2 s TYR 219 Cb -0.12 -1.54 0.05 0.00 -0.11 0.00 0.00 41.96 40.24 1ok2 s TYR 219 CO 0.01 0.42 0.42 0.00 -1.11 0.00 0.00 175.55 175.29 1ok2 s ALA 220 N -2.12 -1.05 0.29 3.71 0.00 -0.61 -4.85 121.76 117.13 1ok2 s ALA 220 Ca 0.35 1.32 -0.10 0.00 0.00 0.00 0.00 51.96 53.53 1ok2 s ALA 220 Cb -0.08 -0.78 -0.07 0.00 0.00 0.00 0.00 23.12 22.19 1ok2 s ALA 220 CO 0.27 -0.22 0.63 0.00 0.00 0.00 0.00 175.76 176.43 1ok2 s ASN 222 N -2.66 5.13 -0.14 0.00 0.01 -0.60 -4.90 114.94 111.78 1ok2 s ASN 222 Ca 0.49 1.94 -0.37 0.00 -0.71 0.00 0.00 52.86 54.20 1ok2 s ASN 222 Cb -0.11 -2.54 -0.14 0.00 0.41 0.00 0.00 41.25 38.87 1ok2 s ASN 222 CO 0.24 -1.62 1.75 1.17 -1.51 0.00 0.00 177.10 177.13 1ok2 n LYS 223 N -2.54 1.61 0.00 -0.60 4.81 -1.26 -1.82 118.16 118.36 1ok2 n LYS 223 Ca 0.10 0.59 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 1ok2 n LYS 223 Cb 0.52 -2.34 0.00 0.00 0.02 0.00 0.00 35.03 33.24 1ok2 n LYS 223 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ok2 n GLY 224 N 4.07 0.99 3.21 3.14 0.00 -1.26 -5.10 105.19 110.24 1ok2 n GLY 224 Ca 0.24 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 1ok2 n GLY 224 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ok2 s PHE 225 N -2.00 1.46 -0.16 1.61 0.40 -0.76 -2.40 117.98 116.14 1ok2 s PHE 225 Ca 0.00 -0.42 -0.04 0.00 -0.60 0.00 0.00 56.93 55.88 1ok2 s PHE 225 Cb 0.00 -0.83 -0.03 0.00 0.51 0.00 0.00 43.02 42.67 1ok2 s PHE 225 CO 0.00 0.10 -0.03 0.99 0.70 0.00 0.00 175.22 176.98 1ok2 s THR 226 N -1.10 3.93 0.13 0.64 2.01 0.50 -4.76 115.64 116.98 1ok2 s THR 226 Ca 0.02 -0.34 -0.30 0.00 0.31 0.00 0.00 61.69 61.38 1ok2 s THR 226 Cb -0.09 -2.72 -0.07 0.00 0.01 0.00 0.00 72.50 69.63 1ok2 s THR 226 CO 0.03 0.49 1.12 -0.32 -0.69 0.00 0.00 174.62 175.25 1ok2 s MET 227 N 0.36 4.54 -0.26 4.92 1.75 -1.26 -0.14 119.30 129.21 1ok2 s MET 227 Ca -0.04 1.71 0.02 0.00 -1.25 0.00 0.00 55.69 56.13 1ok2 s MET 227 Cb -0.14 -3.31 0.06 0.00 2.84 0.00 0.00 34.83 34.28 1ok2 s MET 227 CO 0.03 -0.04 -0.06 0.42 -0.65 0.00 0.00 175.02 174.72 1ok2 s ILE 228 N 0.27 1.85 0.00 10.11 -1.09 0.48 -4.90 121.20 127.91 1ok2 s ILE 228 Ca 0.52 -1.50 0.00 0.00 -2.23 0.00 0.00 60.65 57.44 1ok2 s ILE 228 Cb -0.29 -2.08 0.00 0.00 -1.58 0.00 0.00 42.46 38.52 1ok2 s ILE 228 CO 0.33 -0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.51 1ok2 n GLY 229 N 4.54 0.34 3.76 6.18 0.00 -1.26 0.12 105.19 118.86 1ok2 n GLY 229 Ca -0.11 -2.31 -0.41 0.00 0.00 0.00 0.00 46.02 43.19 1ok2 n GLY 229 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ok2 s GLU 230 N -0.37 4.27 0.23 1.61 0.41 -1.26 -4.81 118.70 118.78 1ok2 s GLU 230 Ca 0.00 2.33 0.02 0.00 -0.41 0.00 0.00 54.97 56.90 1ok2 s GLU 230 Cb 0.00 -3.06 0.25 0.00 -1.78 0.00 0.00 34.13 29.54 1ok2 s GLU 230 CO 0.00 -0.34 1.59 0.45 -0.49 0.00 0.00 175.26 176.46 1ok2 h HIS 231 N 3.88 0.49 -3.91 1.61 3.86 -1.96 -3.18 115.15 115.94 1ok2 h HIS 231 Ca -0.48 -0.16 -0.23 0.00 -1.16 0.00 0.00 60.37 58.34 1ok2 h HIS 231 Cb 1.23 -0.10 -0.17 0.00 1.06 0.00 0.00 27.41 29.42 1ok2 h HIS 231 CO 0.57 0.82 -0.71 -1.54 0.86 0.00 0.00 177.93 177.92 1ok2 s SER 232 N -6.89 0.94 0.23 2.45 1.04 -1.26 -0.71 113.70 109.51 1ok2 s SER 232 Ca -0.06 -0.81 0.05 0.00 0.48 0.00 0.00 55.95 55.61 1ok2 s SER 232 Cb 0.12 0.08 -0.05 0.00 0.10 0.00 0.00 66.02 66.27 1ok2 s SER 232 CO 0.81 -0.37 -0.06 0.27 0.98 0.00 0.00 173.24 174.87 1ok2 s ILE 233 N -2.72 1.38 0.07 -1.02 -4.36 -0.63 -4.97 121.20 108.95 1ok2 s ILE 233 Ca 0.02 -2.10 0.04 0.00 -0.26 0.00 0.00 60.65 58.35 1ok2 s ILE 233 Cb -0.01 -2.28 -0.03 0.00 1.25 0.00 0.00 42.46 41.39 1ok2 s ILE 233 CO -0.03 -0.41 -0.11 -0.72 0.24 0.00 0.00 174.94 173.91 1ok2 s TYR 234 N -3.19 0.99 -0.43 1.37 1.13 -1.26 -0.97 117.35 114.99 1ok2 s TYR 234 Ca 0.26 -0.53 -0.29 0.00 -1.41 0.00 0.00 57.07 55.10 1ok2 s TYR 234 Cb 0.04 -0.56 0.02 0.00 -1.10 0.00 0.00 41.96 40.35 1ok2 s TYR 234 CO 0.09 -0.01 1.24 0.00 -2.51 0.00 0.00 175.55 174.36 1ok2 s THR 236 N 4.74 2.95 -0.33 0.00 -4.23 0.13 0.17 115.64 119.07 1ok2 s THR 236 Ca 0.53 -0.98 0.03 0.00 -1.18 0.00 0.00 61.69 60.08 1ok2 s THR 236 Cb -0.11 -2.96 0.10 0.00 1.34 0.00 0.00 72.50 70.87 1ok2 s THR 236 CO 0.30 0.00 0.06 -0.69 -0.54 0.00 0.00 174.62 173.75 1ok2 s VAL 237 N -2.38 1.85 -0.90 2.29 1.01 -1.26 -0.91 120.40 120.11 1ok2 s VAL 237 Ca 0.55 -2.06 -0.18 0.00 0.00 0.00 0.00 61.98 60.29 1ok2 s VAL 237 Cb -0.10 -2.38 0.14 0.00 0.00 0.00 0.00 36.38 34.04 1ok2 s VAL 237 CO 0.34 -0.62 1.07 0.21 0.00 0.00 0.00 175.10 176.09 1ok2 s ASN 238 N 1.12 6.61 -0.19 3.32 3.84 0.31 -4.77 114.94 125.17 1ok2 s ASN 238 Ca 0.10 -2.04 -0.28 0.00 0.21 0.00 0.00 52.86 50.85 1ok2 s ASN 238 Cb -0.18 -2.38 -0.13 0.00 -0.55 0.00 0.00 41.25 38.01 1ok2 s ASN 238 CO -0.13 -1.03 0.89 0.59 -2.79 0.00 0.00 177.10 174.63 1ok2 n ASN 239 N 6.33 0.46 -3.44 -4.21 3.02 -1.26 -0.64 115.26 115.52 1ok2 n ASN 239 Ca 0.20 0.76 -0.38 0.00 -0.03 0.00 0.00 54.58 55.13 1ok2 n ASN 239 Cb 0.48 -0.58 0.01 0.00 -0.61 0.00 0.00 39.78 39.09 1ok2 n ASN 239 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ok2 n ASP 240 N 1.93 6.76 -4.41 6.41 2.03 -1.26 -5.11 116.55 122.89 1ok2 n ASP 240 Ca 0.17 -3.70 -0.29 0.00 0.52 0.00 0.00 54.79 51.49 1ok2 n ASP 240 Cb -0.00 -1.03 -0.13 0.00 -0.72 0.00 0.00 41.12 39.24 1ok2 n ASP 240 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1ok2 s GLU 241 N -4.14 1.50 -0.02 -0.67 2.12 0.19 -4.93 118.70 112.75 1ok2 s GLU 241 Ca 0.42 -1.30 -0.25 0.00 0.36 0.00 0.00 54.97 54.20 1ok2 s GLU 241 Cb 0.22 -1.95 -0.04 0.00 0.26 0.00 0.00 34.13 32.62 1ok2 s GLU 241 CO -0.15 0.46 0.76 0.20 -0.54 0.00 0.00 175.26 175.99 1ok2 s GLY 242 N -2.04 2.71 -0.12 -1.50 0.00 -1.26 0.12 107.32 105.23 1ok2 s GLY 242 Ca 0.15 0.23 -0.11 0.00 0.00 0.00 0.00 44.72 44.99 1ok2 s GLY 242 CO 0.07 1.22 0.32 1.85 0.00 0.00 0.00 173.10 176.55 1ok2 s GLU 243 N 0.55 0.38 0.31 2.90 2.12 -0.09 -4.35 118.70 120.52 1ok2 s GLU 243 Ca 0.40 0.43 -0.28 0.00 0.36 0.00 0.00 54.97 55.88 1ok2 s GLU 243 Cb -0.19 0.18 -0.09 0.00 0.26 0.00 0.00 34.13 34.29 1ok2 s GLU 243 CO 0.21 -0.05 1.06 -1.58 -0.54 0.00 0.00 175.26 174.37 1ok2 s TRP 244 N 0.14 3.55 0.46 5.30 0.52 -1.26 0.23 118.94 127.88 1ok2 s TRP 244 Ca -0.00 1.71 0.21 0.00 0.02 0.00 0.00 56.10 58.04 1ok2 s TRP 244 Cb -0.02 -3.20 1.20 0.00 -1.15 0.00 0.00 33.47 30.30 1ok2 s TRP 244 CO 0.00 -0.43 1.90 0.66 0.02 0.00 0.00 176.95 179.11 1ok2 h SER 245 N 3.49 0.26 -1.09 2.95 4.64 -1.44 -3.46 113.55 118.90 1ok2 h SER 245 Ca -0.47 0.02 0.13 0.00 -0.47 0.00 0.00 61.79 61.00 1ok2 h SER 245 Cb 1.21 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.25 1ok2 h SER 245 CO 0.66 0.12 0.36 0.61 -0.87 0.00 0.00 176.83 177.70 1ok2 n GLY 246 N -1.57 0.58 3.76 -0.77 0.00 -1.26 -5.02 105.19 100.89 1ok2 n GLY 246 Ca 0.16 -0.94 -0.34 0.00 0.00 0.00 0.00 46.02 44.90 1ok2 n GLY 246 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ok2 s PRO 247 N -2.01 2.78 0.61 1.61 0.04 -1.26 -4.97 135.00 131.80 1ok2 s PRO 247 Ca 0.12 1.59 -0.14 0.00 0.04 0.00 0.00 61.00 62.61 1ok2 s PRO 247 Cb -0.01 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1ok2 s PRO 247 CO 0.00 -1.30 1.04 -1.25 0.04 0.00 0.00 177.00 175.53 1ok2 s PRO 248 N -3.77 3.35 1.15 0.56 0.04 -1.26 -4.74 135.00 130.32 1ok2 s PRO 248 Ca 0.71 1.04 -0.15 0.00 0.04 0.00 0.00 61.00 62.65 1ok2 s PRO 248 Cb -0.25 -2.04 0.27 0.00 0.04 0.00 0.00 34.50 32.52 1ok2 s PRO 248 CO 0.38 -0.78 1.05 -1.25 0.04 0.00 0.00 177.00 176.45 1ok2 s PRO 249 N -4.46 -0.82 0.09 0.56 0.04 -1.20 -4.88 135.00 124.32 1ok2 s PRO 249 Ca 0.60 0.43 0.09 0.00 0.04 0.00 0.00 61.00 62.16 1ok2 s PRO 249 Cb -0.14 -1.60 -0.03 0.00 0.04 0.00 0.00 34.50 32.77 1ok2 s PRO 249 CO 0.43 -3.55 -0.24 -2.00 0.04 0.00 0.00 177.00 171.67 1ok2 s GLU 250 N -4.91 1.42 -0.30 4.56 2.12 0.12 -4.89 118.70 116.82 1ok2 s GLU 250 Ca 0.68 -1.19 -0.08 0.00 0.36 0.00 0.00 54.97 54.74 1ok2 s GLU 250 Cb -0.18 -1.73 0.00 0.00 0.26 0.00 0.00 34.13 32.48 1ok2 s GLU 250 CO 0.60 0.42 0.10 0.00 -0.54 0.00 0.00 175.26 175.84 1ok2 s ARG 252 N 1.55 4.05 0.25 0.00 3.52 0.80 -4.83 118.95 124.29 1ok2 s ARG 252 Ca 0.04 -0.28 -0.30 0.00 -0.13 0.00 0.00 55.73 55.06 1ok2 s ARG 252 Cb -0.17 -3.47 -0.09 0.00 -1.56 0.00 0.00 34.95 29.66 1ok2 s ARG 252 CO 0.04 0.10 1.18 0.20 -0.81 0.00 0.00 175.30 176.01 1ok2 s GLY 253 N 0.92 2.89 0.00 8.12 0.00 -1.26 -0.37 107.32 117.62 1ok2 s GLY 253 Ca 0.07 1.00 0.14 0.00 0.00 0.00 0.00 44.72 45.92 1ok2 s GLY 253 CO 0.03 1.72 0.94 0.00 0.00 0.00 0.00 173.10 175.80