#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ok1 n GLN 2 N 0.00 0.00 -3.85 3.17 3.00 -1.26 -4.45 117.38 113.99 1ok1 n GLN 2 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 1ok1 n GLN 2 Cb 0.00 -1.25 -0.14 0.00 0.00 0.00 0.00 30.24 28.85 1ok1 n GLN 2 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1ok1 s ASP 3 N 0.39 -0.01 0.36 1.08 -0.00 -1.26 -2.07 116.67 115.16 1ok1 s ASP 3 Ca 0.00 0.04 -0.02 0.00 -0.00 0.00 0.00 52.55 52.58 1ok1 s ASP 3 Cb 0.00 0.03 -0.04 0.00 -0.00 0.00 0.00 42.92 42.91 1ok1 s ASP 3 CO 0.00 -0.02 0.60 0.00 -0.00 0.00 0.00 175.17 175.75 1ok1 n GLY 5 N -1.70 1.17 3.71 0.00 0.00 -1.26 -1.64 105.19 105.47 1ok1 n GLY 5 Ca -0.03 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 1ok1 n GLY 5 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ok1 n LEU 6 N 0.00 3.97 -4.74 0.99 4.77 -1.25 -4.68 117.00 116.06 1ok1 n LEU 6 Ca 0.00 1.14 -0.29 0.00 -0.03 0.00 0.00 56.01 56.83 1ok1 n LEU 6 Cb 0.00 -1.50 0.14 0.00 -2.33 0.00 0.00 43.42 39.73 1ok1 n LEU 6 CO 0.00 -0.56 0.68 -2.16 -1.33 0.00 0.00 177.39 174.02 1ok1 s PRO 7 N -2.13 1.07 0.70 3.23 0.04 -1.26 -5.00 135.00 131.65 1ok1 s PRO 7 Ca 0.59 0.54 -0.15 0.00 0.04 0.00 0.00 61.00 62.02 1ok1 s PRO 7 Cb -0.52 -1.81 0.02 0.00 0.04 0.00 0.00 34.50 32.23 1ok1 s PRO 7 CO 0.59 -2.30 1.18 -2.14 0.04 0.00 0.00 177.00 174.37 1ok1 s PRO 8 N -5.07 2.40 -0.24 0.56 0.02 -1.26 -4.98 135.00 126.43 1ok1 s PRO 8 Ca 0.64 1.65 -0.23 0.00 0.02 0.00 0.00 61.00 63.08 1ok1 s PRO 8 Cb -0.17 -1.88 -0.01 0.00 0.02 0.00 0.00 34.50 32.47 1ok1 s PRO 8 CO 0.56 -1.61 0.77 0.34 -0.33 0.00 0.00 177.00 176.72 1ok1 s ASP 9 N -2.16 6.77 -0.18 2.53 3.68 -1.26 -4.98 116.67 121.07 1ok1 s ASP 9 Ca 0.72 0.95 -0.04 0.00 2.13 0.00 0.00 52.55 56.32 1ok1 s ASP 9 Cb -0.26 -2.41 -0.02 0.00 -1.45 0.00 0.00 42.92 38.78 1ok1 s ASP 9 CO 0.43 -0.46 -0.04 -0.69 0.13 0.00 0.00 175.17 174.54 1ok1 s VAL 10 N 2.66 3.70 0.18 1.11 1.01 -1.26 -5.07 120.40 122.72 1ok1 s VAL 10 Ca 0.33 -0.41 -0.32 0.00 0.00 0.00 0.00 61.98 61.58 1ok1 s VAL 10 Cb -0.15 -2.64 -0.11 0.00 0.00 0.00 0.00 36.38 33.47 1ok1 s VAL 10 CO 0.08 0.46 1.75 -2.84 0.00 0.00 0.00 175.10 174.55 1ok1 s PRO 11 N 0.75 4.13 -1.02 2.72 0.02 -1.26 -2.33 135.00 138.02 1ok1 s PRO 11 Ca -0.02 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.59 1ok1 s PRO 11 Cb -0.15 -3.25 0.00 0.00 0.02 0.00 0.00 34.50 31.13 1ok1 s PRO 11 CO 0.02 -0.77 0.00 0.09 -0.33 0.00 0.00 177.00 176.01 1ok1 n ASN 12 N 4.53 -4.09 -3.95 2.53 3.02 -1.26 -4.78 115.26 111.26 1ok1 n ASN 12 Ca 0.16 0.22 -0.09 0.00 -0.03 0.00 0.00 54.58 54.84 1ok1 n ASN 12 Cb 0.36 -2.54 -0.10 0.00 -0.61 0.00 0.00 39.78 36.89 1ok1 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ok1 s ALA 13 N -2.38 0.01 -0.06 5.41 0.00 -0.98 -0.83 121.76 122.94 1ok1 s ALA 13 Ca 0.00 -0.53 0.03 0.00 0.00 0.00 0.00 51.96 51.46 1ok1 s ALA 13 Cb 0.00 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.30 1ok1 s ALA 13 CO 0.00 -0.23 -0.15 -0.65 0.00 0.00 0.00 175.76 174.74 1ok1 s GLN 14 N -1.93 1.77 0.35 0.00 -1.52 -0.71 -4.53 119.66 113.10 1ok1 s GLN 14 Ca -0.11 -0.52 -0.14 0.00 -1.95 0.00 0.00 55.36 52.63 1ok1 s GLN 14 Cb -0.06 -1.49 -0.09 0.00 -0.22 0.00 0.00 33.01 31.16 1ok1 s GLN 14 CO -0.02 0.14 0.77 -1.25 -0.25 0.00 0.00 175.29 174.67 1ok1 s PRO 15 N 0.33 3.97 -0.48 2.91 0.04 -1.26 -0.74 135.00 139.78 1ok1 s PRO 15 Ca -0.09 0.67 -0.19 0.00 0.04 0.00 0.00 61.00 61.42 1ok1 s PRO 15 Cb -0.13 -2.39 0.04 0.00 0.04 0.00 0.00 34.50 32.06 1ok1 s PRO 15 CO 0.03 0.09 0.60 0.00 0.04 0.00 0.00 177.00 177.76 1ok1 s ALA 16 N -2.10 3.38 -0.13 8.56 0.00 -0.80 -4.88 121.76 125.78 1ok1 s ALA 16 Ca 0.54 -1.57 0.22 0.00 0.00 0.00 0.00 51.96 51.16 1ok1 s ALA 16 Cb -0.10 -3.29 -0.30 0.00 0.00 0.00 0.00 23.12 19.43 1ok1 s ALA 16 CO 0.20 -1.89 0.57 1.28 0.00 0.00 0.00 175.76 175.92 1ok1 n LEU 17 N 6.11 0.15 -3.74 0.00 4.77 -1.26 -4.61 117.00 118.43 1ok1 n LEU 17 Ca -0.05 -0.02 -0.26 0.00 -0.03 0.00 0.00 56.01 55.65 1ok1 n LEU 17 Cb 0.46 -0.01 0.05 0.00 -2.33 0.00 0.00 43.42 41.60 1ok1 n LEU 17 CO 0.53 0.01 0.17 -0.62 -1.33 0.00 0.00 177.39 176.14 1ok1 n GLU 18 N -2.22 -6.72 -0.48 3.23 1.02 -1.26 -3.06 120.64 111.15 1ok1 n GLU 18 Ca -0.03 0.72 0.00 0.00 -0.02 0.00 0.00 57.16 57.83 1ok1 n GLU 18 Cb 0.55 -5.68 0.00 0.00 -0.02 0.00 0.00 31.44 26.29 1ok1 n GLU 18 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ok1 n GLY 19 N -1.82 0.75 3.37 0.62 0.00 -1.26 -5.07 105.19 101.79 1ok1 n GLY 19 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 1ok1 n GLY 19 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ok1 s ARG 20 N -0.52 1.41 0.00 1.61 1.70 -1.17 -5.04 118.95 116.94 1ok1 s ARG 20 Ca 0.00 -1.67 0.00 0.00 -0.47 0.00 0.00 55.73 53.59 1ok1 s ARG 20 Cb 0.00 -1.09 0.00 0.00 -0.57 0.00 0.00 34.95 33.29 1ok1 s ARG 20 CO 0.00 0.11 0.13 0.25 -1.08 0.00 0.00 175.30 174.71 1ok1 n THR 21 N -0.46 0.00 -4.62 4.99 -2.24 -1.26 -4.89 114.28 105.80 1ok1 n THR 21 Ca -0.07 -0.41 -0.23 0.00 -2.27 0.00 0.00 64.05 61.06 1ok1 n THR 21 Cb 0.62 1.05 -0.16 0.00 -2.10 0.00 0.00 70.33 69.74 1ok1 n THR 21 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ok1 s SER 22 N -0.58 1.71 -0.02 3.42 0.15 -1.26 -3.82 113.70 113.29 1ok1 s SER 22 Ca 0.00 -0.27 0.03 0.00 0.70 0.00 0.00 55.95 56.41 1ok1 s SER 22 Cb 0.00 -0.46 -0.00 0.00 -1.71 0.00 0.00 66.02 63.85 1ok1 s SER 22 CO 0.00 0.11 -0.11 -0.36 1.20 0.00 0.00 173.24 174.08 1ok1 s PHE 23 N 0.11 1.12 0.57 3.44 0.08 -0.65 -4.97 117.98 117.68 1ok1 s PHE 23 Ca -0.03 -0.27 -0.15 0.00 0.12 0.00 0.00 56.93 56.59 1ok1 s PHE 23 Cb -0.10 -0.77 -0.05 0.00 -0.57 0.00 0.00 43.02 41.53 1ok1 s PHE 23 CO 0.01 -0.09 1.03 -1.25 -0.10 0.00 0.00 175.22 174.82 1ok1 s PRO 24 N 0.04 3.56 0.32 0.24 0.04 -1.26 0.61 135.00 138.55 1ok1 s PRO 24 Ca -0.01 1.04 -0.26 0.00 0.04 0.00 0.00 61.00 61.81 1ok1 s PRO 24 Cb -0.08 -2.07 -0.14 0.00 0.04 0.00 0.00 34.50 32.25 1ok1 s PRO 24 CO 0.00 -0.60 0.75 -1.91 0.04 0.00 0.00 177.00 175.29 1ok1 n GLU 25 N -2.01 0.81 -0.97 4.56 2.13 -0.88 -1.64 120.64 122.64 1ok1 n GLU 25 Ca 0.08 0.29 0.00 0.00 0.66 0.00 0.00 57.16 58.18 1ok1 n GLU 25 Cb 0.53 -1.56 0.00 0.00 0.27 0.00 0.00 31.44 30.68 1ok1 n GLU 25 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1ok1 n ASP 26 N 1.37 -1.60 -4.72 4.31 8.00 0.86 -4.98 116.55 119.80 1ok1 n ASP 26 Ca 0.12 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.20 1ok1 n ASP 26 Cb 0.33 -0.56 -0.03 0.00 -0.02 0.00 0.00 41.12 40.84 1ok1 n ASP 26 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ok1 s THR 27 N -2.80 3.48 -0.23 -3.53 2.01 -0.65 -4.76 115.64 109.16 1ok1 s THR 27 Ca 0.00 1.11 -0.05 0.00 0.31 0.00 0.00 61.69 63.05 1ok1 s THR 27 Cb 0.00 -3.71 -0.02 0.00 0.01 0.00 0.00 72.50 68.78 1ok1 s THR 27 CO 0.00 0.11 0.01 -0.69 -0.69 0.00 0.00 174.62 173.36 1ok1 s VAL 28 N 0.79 3.81 -0.14 3.82 1.01 -1.26 -1.56 120.40 126.87 1ok1 s VAL 28 Ca 0.61 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 62.22 1ok1 s VAL 28 Cb -0.35 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 1ok1 s VAL 28 CO 0.32 0.39 -0.09 -0.63 0.00 0.00 0.00 175.10 175.09 1ok1 s ILE 29 N 1.47 3.37 -0.05 2.22 1.01 -0.40 -4.95 121.20 123.88 1ok1 s ILE 29 Ca 0.05 -0.54 -0.03 0.00 0.00 0.00 0.00 60.65 60.14 1ok1 s ILE 29 Cb -0.15 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 1ok1 s ILE 29 CO 0.00 0.51 0.10 -0.89 0.00 0.00 0.00 174.94 174.65 1ok1 s THR 30 N 0.42 4.95 0.07 2.92 2.01 -1.26 -0.23 115.64 124.53 1ok1 s THR 30 Ca -0.07 -0.18 0.03 0.00 0.31 0.00 0.00 61.69 61.78 1ok1 s THR 30 Cb -0.15 -3.21 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 1ok1 s THR 30 CO 0.04 0.46 0.04 -0.31 -0.69 0.00 0.00 174.62 174.16 1ok1 s TYR 31 N -1.11 3.10 -0.14 4.92 2.02 0.11 -1.90 117.35 124.35 1ok1 s TYR 31 Ca 0.20 0.04 0.02 0.00 -0.37 0.00 0.00 57.07 56.96 1ok1 s TYR 31 Cb -0.12 -1.60 0.01 0.00 -0.40 0.00 0.00 41.96 39.86 1ok1 s TYR 31 CO 0.10 0.50 -0.19 0.15 -1.57 0.00 0.00 175.55 174.54 1ok1 s LYS 32 N -2.24 2.73 0.57 -0.62 -0.14 0.08 -4.88 119.74 115.24 1ok1 s LYS 32 Ca 0.27 -0.74 -0.19 0.00 -1.36 0.00 0.00 55.97 53.95 1ok1 s LYS 32 Cb -0.12 -2.28 -0.07 0.00 -1.68 0.00 0.00 37.83 33.68 1ok1 s LYS 32 CO 0.19 -0.08 0.71 0.00 -0.76 0.00 0.00 175.35 175.41 1ok1 s GLU 34 N -2.30 2.09 0.24 0.00 2.02 -0.01 -4.82 118.70 115.92 1ok1 s GLU 34 Ca 0.71 -0.21 -0.31 0.00 0.02 0.00 0.00 54.97 55.18 1ok1 s GLU 34 Cb -0.45 -2.12 -0.14 0.00 0.10 0.00 0.00 34.13 31.52 1ok1 s GLU 34 CO 0.52 -1.35 1.18 -1.91 0.02 0.00 0.00 175.26 173.72 1ok1 n GLU 35 N -3.02 1.50 -1.25 1.61 2.13 -1.26 -1.11 120.64 119.23 1ok1 n GLU 35 Ca 0.08 0.53 -0.06 0.00 0.66 0.00 0.00 57.16 58.38 1ok1 n GLU 35 Cb 0.61 -2.03 -0.02 0.00 0.27 0.00 0.00 31.44 30.26 1ok1 n GLU 35 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1ok1 n SER 36 N 1.72 -3.56 -3.88 4.31 7.64 -1.26 -5.02 113.62 113.58 1ok1 n SER 36 Ca 0.12 0.13 -0.15 0.00 1.01 0.00 0.00 58.87 59.98 1ok1 n SER 36 Cb 0.29 -1.69 -0.15 0.00 -1.01 0.00 0.00 64.21 61.65 1ok1 n SER 36 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ok1 s PHE 37 N -2.22 0.24 0.04 1.43 0.40 -0.27 -3.31 117.98 114.29 1ok1 s PHE 37 Ca 0.00 -0.02 0.08 0.00 -0.60 0.00 0.00 56.93 56.39 1ok1 s PHE 37 Cb 0.00 -0.23 -0.03 0.00 0.51 0.00 0.00 43.02 43.27 1ok1 s PHE 37 CO 0.00 -0.05 -0.24 0.08 0.70 0.00 0.00 175.22 175.71 1ok1 s VAL 38 N 0.33 2.32 0.29 -0.44 1.01 2.35 -4.55 120.40 121.71 1ok1 s VAL 38 Ca -0.03 -1.30 -0.28 0.00 0.00 0.00 0.00 61.98 60.37 1ok1 s VAL 38 Cb -0.06 -1.91 -0.09 0.00 0.00 0.00 0.00 36.38 34.32 1ok1 s VAL 38 CO -0.01 0.38 1.04 -1.59 0.00 0.00 0.00 175.10 174.92 1ok1 s LYS 39 N -1.22 4.61 -0.34 2.72 -2.85 -1.26 -0.21 119.74 121.19 1ok1 s LYS 39 Ca 0.12 1.63 -0.27 0.00 -1.00 0.00 0.00 55.97 56.46 1ok1 s LYS 39 Cb -0.10 -3.06 0.01 0.00 -2.06 0.00 0.00 37.83 32.62 1ok1 s LYS 39 CO 0.03 0.24 0.96 0.42 0.10 0.00 0.00 175.35 177.09 1ok1 s ILE 40 N -1.29 4.58 0.22 3.79 1.01 0.85 -4.89 121.20 125.47 1ok1 s ILE 40 Ca 0.46 1.40 -0.31 0.00 0.00 0.00 0.00 60.65 62.21 1ok1 s ILE 40 Cb -0.27 -4.34 -0.15 0.00 0.01 0.00 0.00 42.46 37.70 1ok1 s ILE 40 CO 0.35 -0.48 1.03 -2.65 0.00 0.00 0.00 174.94 173.19 1ok1 n PRO 41 N 6.74 1.08 -2.16 2.79 -0.02 -1.26 -2.82 135.00 139.35 1ok1 n PRO 41 Ca 0.08 0.38 -0.01 0.00 -2.02 0.00 0.00 63.50 61.93 1ok1 n PRO 41 Cb 0.48 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1ok1 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ok1 n GLY 42 N 1.70 0.45 3.06 -1.23 0.00 -1.26 -5.06 105.19 102.84 1ok1 n GLY 42 Ca 0.13 -0.78 -0.14 0.00 0.00 0.00 0.00 46.02 45.24 1ok1 n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ok1 s GLU 43 N -4.32 0.54 0.51 1.61 2.02 -1.13 -5.14 118.70 112.79 1ok1 s GLU 43 Ca 0.01 -0.70 -0.22 0.00 0.02 0.00 0.00 54.97 54.08 1ok1 s GLU 43 Cb -0.00 -0.34 -0.06 0.00 0.10 0.00 0.00 34.13 33.82 1ok1 s GLU 43 CO 0.01 0.07 1.26 0.15 0.02 0.00 0.00 175.26 176.76 1ok1 s LYS 44 N -1.41 3.41 -0.05 1.61 1.02 -1.26 -4.95 119.74 118.11 1ok1 s LYS 44 Ca -0.08 1.99 0.07 0.00 0.02 0.00 0.00 55.97 57.96 1ok1 s LYS 44 Cb -0.09 -2.30 0.10 0.00 -0.52 0.00 0.00 37.83 35.03 1ok1 s LYS 44 CO 0.00 -0.90 1.00 -0.40 -0.92 0.00 0.00 175.35 174.14 1ok1 n ASP 45 N -0.83 1.00 -3.95 2.83 3.85 -1.26 -4.79 116.55 113.40 1ok1 n ASP 45 Ca 0.09 -2.28 -0.10 0.00 -0.71 0.00 0.00 54.79 51.80 1ok1 n ASP 45 Cb 0.47 -0.24 -0.07 0.00 -1.35 0.00 0.00 41.12 39.93 1ok1 n ASP 45 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1ok1 s SER 46 N -1.56 0.04 0.25 -1.12 1.04 -1.26 0.10 113.70 111.19 1ok1 s SER 46 Ca 0.11 -0.85 0.05 0.00 0.48 0.00 0.00 55.95 55.74 1ok1 s SER 46 Cb 0.10 0.44 -0.05 0.00 0.10 0.00 0.00 66.02 66.60 1ok1 s SER 46 CO 0.01 -0.89 -0.04 0.68 0.98 0.00 0.00 173.24 173.98 1ok1 s VAL 47 N -3.96 1.37 -0.01 5.02 -7.23 0.68 -4.89 120.40 111.37 1ok1 s VAL 47 Ca 0.16 -2.09 0.01 0.00 -1.81 0.00 0.00 61.98 58.26 1ok1 s VAL 47 Cb 0.03 -2.36 0.01 0.00 0.56 0.00 0.00 36.38 34.62 1ok1 s VAL 47 CO -0.01 -0.34 -0.02 -0.51 -0.31 0.00 0.00 175.10 173.92 1ok1 s ILE 48 N -3.20 0.21 -0.49 -0.62 2.07 -1.26 -1.27 121.20 116.64 1ok1 s ILE 48 Ca 0.28 -0.04 -0.28 0.00 -1.41 0.00 0.00 60.65 59.19 1ok1 s ILE 48 Cb 0.04 -0.23 0.02 0.00 0.13 0.00 0.00 42.46 42.42 1ok1 s ILE 48 CO 0.10 0.10 1.35 0.00 -1.91 0.00 0.00 174.94 174.57 1ok1 s LEU 50 N 5.46 3.00 0.52 0.00 1.43 0.20 -0.10 118.68 129.20 1ok1 s LEU 50 Ca 0.54 -0.61 -0.22 0.00 -1.03 0.00 0.00 54.13 52.81 1ok1 s LEU 50 Cb -0.11 -1.74 -0.06 0.00 0.03 0.00 0.00 46.19 44.32 1ok1 s LEU 50 CO 0.29 -1.70 1.27 -0.54 0.23 0.00 0.00 176.35 175.90 1ok1 s LYS 51 N -4.97 3.36 0.00 1.70 -0.14 -1.26 -2.87 119.74 115.55 1ok1 s LYS 51 Ca 0.65 2.02 0.00 0.00 -1.36 0.00 0.00 55.97 57.28 1ok1 s LYS 51 Cb -0.05 -2.28 0.00 0.00 -1.68 0.00 0.00 37.83 33.82 1ok1 s LYS 51 CO 0.43 -0.95 0.00 0.41 -0.76 0.00 0.00 175.35 174.48 1ok1 n GLY 52 N 0.60 0.73 2.95 -3.33 0.00 -1.26 -4.04 105.19 100.84 1ok1 n GLY 52 Ca 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 1ok1 n GLY 52 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ok1 n SER 53 N 0.00 -2.21 -4.13 1.61 2.88 -1.17 -4.90 113.62 105.71 1ok1 n SER 53 Ca 0.00 -0.49 -0.25 0.00 -1.33 0.00 0.00 58.87 56.80 1ok1 n SER 53 Cb 0.00 -4.19 -0.16 0.00 -0.75 0.00 0.00 64.21 59.11 1ok1 n SER 53 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1ok1 s GLN 54 N -5.13 1.52 0.26 -1.46 0.74 -1.14 -4.75 119.66 109.70 1ok1 s GLN 54 Ca 0.02 -0.58 -0.13 0.00 0.05 0.00 0.00 55.36 54.73 1ok1 s GLN 54 Cb -0.01 -1.39 -0.08 0.00 1.10 0.00 0.00 33.01 32.63 1ok1 s GLN 54 CO 0.58 0.28 0.65 -1.58 -0.55 0.00 0.00 175.29 174.67 1ok1 s TRP 55 N -0.14 3.43 0.79 1.67 0.52 -1.26 0.63 118.94 124.58 1ok1 s TRP 55 Ca 0.01 1.08 -0.11 0.00 0.02 0.00 0.00 56.10 57.10 1ok1 s TRP 55 Cb -0.09 -2.42 0.07 0.00 -1.15 0.00 0.00 33.47 29.88 1ok1 s TRP 55 CO 0.01 0.21 1.09 -1.54 0.02 0.00 0.00 176.95 176.73 1ok1 s SER 56 N -2.22 4.34 0.49 2.95 1.04 -0.21 -4.88 113.70 115.21 1ok1 s SER 56 Ca 0.49 1.74 -0.19 0.00 0.48 0.00 0.00 55.95 58.47 1ok1 s SER 56 Cb -0.11 -2.44 -0.08 0.00 0.10 0.00 0.00 66.02 63.48 1ok1 s SER 56 CO 0.19 -2.13 1.01 -1.81 0.98 0.00 0.00 173.24 171.49 1ok1 s ASP 57 N -3.43 6.45 -0.14 7.02 1.01 -1.26 -4.65 116.67 121.67 1ok1 s ASP 57 Ca 0.61 1.81 -0.10 0.00 0.71 0.00 0.00 52.55 55.58 1ok1 s ASP 57 Cb -0.17 -2.54 0.04 0.00 1.01 0.00 0.00 42.92 41.26 1ok1 s ASP 57 CO 0.56 -0.71 0.35 -0.51 0.21 0.00 0.00 175.17 175.08 1ok1 s ILE 58 N -2.18 -0.01 0.23 0.77 2.07 -1.26 -4.95 121.20 115.86 1ok1 s ILE 58 Ca 0.64 0.05 0.08 0.00 -1.41 0.00 0.00 60.65 60.01 1ok1 s ILE 58 Cb -0.14 -0.51 -0.04 0.00 0.13 0.00 0.00 42.46 41.90 1ok1 s ILE 58 CO 0.22 0.02 0.08 -1.61 -1.91 0.00 0.00 174.94 171.74 1ok1 s GLU 59 N 0.68 2.61 0.12 3.50 8.01 -1.26 -5.03 118.70 127.33 1ok1 s GLU 59 Ca -0.04 -1.15 -0.36 0.00 0.01 0.00 0.00 54.97 53.44 1ok1 s GLU 59 Cb -0.05 -2.41 -0.16 0.00 -4.31 0.00 0.00 34.13 27.20 1ok1 s GLU 59 CO -0.05 0.41 1.38 0.39 0.01 0.00 0.00 175.26 177.41 1ok1 n GLU 60 N -0.73 1.41 -0.02 1.61 1.02 -1.26 -4.86 120.64 117.81 1ok1 n GLU 60 Ca -0.08 0.51 0.01 0.00 -0.02 0.00 0.00 57.16 57.57 1ok1 n GLU 60 Cb 0.57 -2.17 0.01 0.00 -0.02 0.00 0.00 31.44 29.83 1ok1 n GLU 60 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 1ok1 n PHE 61 N 2.62 0.00 -4.38 -0.32 -1.74 -1.26 -5.06 117.46 107.33 1ok1 n PHE 61 Ca 0.18 -0.30 -0.30 0.00 -0.56 0.00 0.00 57.45 56.46 1ok1 n PHE 61 Cb 0.22 -0.04 -0.11 0.00 1.52 0.00 0.00 39.48 41.07 1ok1 n PHE 61 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1ok1 s ASN 63 N -1.96 0.34 -0.44 0.00 3.84 0.71 -4.92 114.94 112.51 1ok1 s ASN 63 Ca 0.18 -0.88 -0.02 0.00 0.21 0.00 0.00 52.86 52.35 1ok1 s ASN 63 Cb -0.11 0.26 -0.03 0.00 -0.55 0.00 0.00 41.25 40.83 1ok1 s ASN 63 CO 0.10 -0.66 0.38 0.54 -2.79 0.00 0.00 177.10 174.67 1ok1 n ARG 64 N 0.03 -1.05 -4.10 0.43 3.00 -1.21 0.57 116.66 114.34 1ok1 n ARG 64 Ca -0.14 0.36 -0.09 0.00 -0.01 0.00 0.00 57.85 57.97 1ok1 n ARG 64 Cb 0.62 -3.34 -0.09 0.00 0.00 0.00 0.00 32.46 29.64 1ok1 n ARG 64 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1ok1 s SER 65 N -3.19 0.27 0.96 0.55 1.04 -1.26 -4.13 113.70 107.94 1ok1 s SER 65 Ca 0.18 -1.10 -0.13 0.00 0.48 0.00 0.00 55.95 55.38 1ok1 s SER 65 Cb -0.02 0.31 0.17 0.00 0.10 0.00 0.00 66.02 66.57 1ok1 s SER 65 CO 0.31 -0.74 1.13 0.00 0.98 0.00 0.00 173.24 174.91 1ok1 s GLU 67 N -5.20 1.96 0.24 0.00 8.01 -1.26 -4.53 118.70 117.92 1ok1 s GLU 67 Ca 0.65 -0.07 -0.31 0.00 0.01 0.00 0.00 54.97 55.25 1ok1 s GLU 67 Cb -0.16 -2.03 -0.11 0.00 -4.31 0.00 0.00 34.13 27.53 1ok1 s GLU 67 CO 0.55 -1.52 1.61 0.08 0.01 0.00 0.00 175.26 175.99 1ok1 s VAL 68 N -3.47 2.24 0.20 2.63 1.01 -1.26 -4.86 120.40 116.88 1ok1 s VAL 68 Ca 0.62 0.18 -0.31 0.00 0.00 0.00 0.00 61.98 62.47 1ok1 s VAL 68 Cb -0.10 -3.12 -0.16 0.00 0.00 0.00 0.00 36.38 33.00 1ok1 s VAL 68 CO 0.48 0.02 1.03 -2.65 0.00 0.00 0.00 175.10 173.98 1ok1 n PRO 69 N 3.06 1.00 -1.93 2.72 -0.02 -1.26 -4.88 135.00 133.68 1ok1 n PRO 69 Ca 0.11 0.35 -0.36 0.00 -2.02 0.00 0.00 63.50 61.58 1ok1 n PRO 69 Cb 0.37 -1.75 0.04 0.00 -0.02 0.00 0.00 33.50 32.15 1ok1 n PRO 69 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1ok1 s THR 70 N -0.53 2.45 -0.17 3.45 2.01 -1.26 -4.93 115.64 116.66 1ok1 s THR 70 Ca 0.69 0.28 -0.29 0.00 0.31 0.00 0.00 61.69 62.68 1ok1 s THR 70 Cb -0.84 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 68.53 1ok1 s THR 70 CO 0.55 -0.06 1.51 -0.60 -0.69 0.00 0.00 174.62 175.34 1ok1 s ARG 71 N -3.34 4.02 0.06 4.92 3.52 -1.26 -5.02 118.95 121.84 1ok1 s ARG 71 Ca 0.79 1.77 -0.03 0.00 -0.13 0.00 0.00 55.73 58.13 1ok1 s ARG 71 Cb -0.33 -3.94 -0.05 0.00 -1.56 0.00 0.00 34.95 29.08 1ok1 s ARG 71 CO 0.35 -1.02 0.25 -0.51 -0.81 0.00 0.00 175.30 173.57 1ok1 s LEU 72 N 4.40 4.34 0.22 -0.88 1.43 -1.26 -5.00 118.68 121.94 1ok1 s LEU 72 Ca 0.67 0.42 0.23 0.00 -1.03 0.00 0.00 54.13 54.41 1ok1 s LEU 72 Cb -0.26 -2.92 0.08 0.00 0.03 0.00 0.00 46.19 43.12 1ok1 s LEU 72 CO 0.25 0.18 1.14 0.78 0.23 0.00 0.00 176.35 178.92 1ok1 h ASN 73 N 3.34 0.00 0.28 2.29 2.35 -2.02 -3.37 115.58 118.45 1ok1 h ASN 73 Ca -0.47 -0.03 -0.29 0.00 -0.55 0.00 0.00 56.30 54.96 1ok1 h ASN 73 Cb 1.17 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.49 1ok1 h ASN 73 CO 0.72 0.01 -1.98 -1.54 -1.65 0.00 0.00 177.43 173.00 1ok1 n SER 74 N -2.65 0.44 -3.97 5.81 3.41 -1.26 -4.83 113.62 110.56 1ok1 n SER 74 Ca 0.01 0.20 -0.10 0.00 -0.26 0.00 0.00 58.87 58.73 1ok1 n SER 74 Cb 0.53 0.56 -0.11 0.00 -0.26 0.00 0.00 64.21 64.93 1ok1 n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ok1 s ALA 75 N -2.66 0.14 0.01 7.33 0.00 -1.26 -0.69 121.76 124.63 1ok1 s ALA 75 Ca -0.07 -0.54 0.07 0.00 0.00 0.00 0.00 51.96 51.42 1ok1 s ALA 75 Cb 0.08 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 1ok1 s ALA 75 CO 0.83 -0.13 -0.20 -1.54 0.00 0.00 0.00 175.76 174.72 1ok1 s SER 76 N -1.30 3.64 0.40 0.00 1.04 0.33 -4.21 113.70 113.60 1ok1 s SER 76 Ca -0.14 -0.40 -0.26 0.00 0.48 0.00 0.00 55.95 55.63 1ok1 s SER 76 Cb -0.09 -0.58 -0.11 0.00 0.10 0.00 0.00 66.02 65.35 1ok1 s SER 76 CO -0.01 0.29 1.16 0.18 0.98 0.00 0.00 173.24 175.84 1ok1 n LEU 77 N 1.90 3.28 -4.91 2.42 4.32 -1.26 -0.79 117.00 121.96 1ok1 n LEU 77 Ca -0.16 1.11 -0.27 0.00 -0.02 0.00 0.00 56.01 56.66 1ok1 n LEU 77 Cb 0.52 -1.43 0.03 0.00 -1.62 0.00 0.00 43.42 40.92 1ok1 n LEU 77 CO 0.25 -0.96 0.54 -0.54 -1.22 0.00 0.00 177.39 175.46 1ok1 s LYS 78 N -2.03 3.05 0.32 3.23 1.02 -0.19 -4.59 119.74 120.55 1ok1 s LYS 78 Ca 0.61 0.09 -0.27 0.00 0.02 0.00 0.00 55.97 56.41 1ok1 s LYS 78 Cb -0.55 -2.26 -0.09 0.00 -0.52 0.00 0.00 37.83 34.40 1ok1 s LYS 78 CO 0.58 -0.64 1.04 -1.14 -0.92 0.00 0.00 175.35 174.28 1ok1 s GLN 79 N -4.98 4.49 0.00 1.68 2.00 -1.26 -1.59 119.66 119.99 1ok1 s GLN 79 Ca 0.53 1.61 0.23 0.00 -2.00 0.00 0.00 55.36 55.73 1ok1 s GLN 79 Cb -0.11 -2.92 0.32 0.00 0.80 0.00 0.00 33.01 31.10 1ok1 s GLN 79 CO 0.46 0.13 1.33 -0.35 -0.50 0.00 0.00 175.29 176.36 1ok1 n PRO 80 N 0.70 2.41 -0.09 1.67 -0.04 -1.26 -4.90 135.00 133.49 1ok1 n PRO 80 Ca 0.01 -2.12 0.18 0.00 -0.04 0.00 0.00 63.50 61.53 1ok1 n PRO 80 Cb 0.47 -1.49 0.59 0.00 -0.04 0.00 0.00 33.50 33.04 1ok1 n PRO 80 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1ok1 h TYR 81 N 4.55 0.26 0.00 0.54 -1.99 -1.67 -2.16 116.97 116.51 1ok1 h TYR 81 Ca 0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 1ok1 h TYR 81 Cb 0.99 -0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.63 1ok1 h TYR 81 CO 0.14 0.10 0.00 0.97 -0.00 0.00 0.00 178.16 179.37 1ok1 h ILE 82 N 0.23 0.00 -0.18 -2.88 2.10 -1.66 -1.99 117.51 113.13 1ok1 h ILE 82 Ca 0.32 -0.11 0.00 0.00 1.08 0.00 0.00 64.86 66.14 1ok1 h ILE 82 Cb 0.92 1.03 0.00 0.00 -1.09 0.00 0.00 36.82 37.69 1ok1 h ILE 82 CO -0.06 0.00 0.00 0.35 -1.08 0.00 0.00 178.15 177.36 1ok1 n THR 83 N -2.94 0.42 -3.46 2.19 -2.24 -0.81 -5.03 114.28 102.41 1ok1 n THR 83 Ca -0.02 -0.71 -0.24 0.00 -2.27 0.00 0.00 64.05 60.81 1ok1 n THR 83 Cb 0.12 0.95 -0.02 0.00 -2.10 0.00 0.00 70.33 69.28 1ok1 n THR 83 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1ok1 s GLN 84 N -1.05 3.50 0.00 -0.78 -0.21 -0.75 -5.01 119.66 115.36 1ok1 s GLN 84 Ca 0.20 -0.34 0.00 0.00 0.02 0.00 0.00 55.36 55.24 1ok1 s GLN 84 Cb 0.12 -2.70 0.00 0.00 1.00 0.00 0.00 33.01 31.43 1ok1 s GLN 84 CO 0.17 0.21 0.01 0.27 -2.12 0.00 0.00 175.29 173.83 1ok1 n ASN 85 N -1.56 0.02 -4.44 5.90 0.23 -1.26 -4.96 115.26 109.19 1ok1 n ASN 85 Ca -0.05 -0.40 -0.42 0.00 -0.53 0.00 0.00 54.58 53.18 1ok1 n ASN 85 Cb 0.56 0.04 -0.11 0.00 -2.08 0.00 0.00 39.78 38.19 1ok1 n ASN 85 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1ok1 s TYR 86 N -0.04 3.24 -0.46 -2.53 6.04 -1.26 -4.86 117.35 117.47 1ok1 s TYR 86 Ca 0.00 -0.67 0.06 0.00 0.04 0.00 0.00 57.07 56.51 1ok1 s TYR 86 Cb 0.00 -2.52 0.22 0.00 -1.04 0.00 0.00 41.96 38.62 1ok1 s TYR 86 CO 0.00 -0.58 0.50 1.19 -1.54 0.00 0.00 175.55 175.12 1ok1 n PHE 87 N 5.09 0.41 -0.80 4.97 3.01 -1.26 -5.04 117.46 123.85 1ok1 n PHE 87 Ca -0.12 -3.65 -0.31 0.00 1.01 0.00 0.00 57.45 54.39 1ok1 n PHE 87 Cb 0.47 -0.22 0.17 0.00 -0.01 0.00 0.00 39.48 39.88 1ok1 n PHE 87 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1ok1 s PRO 88 N -1.04 0.94 0.17 -1.08 0.04 -1.26 -0.60 135.00 132.17 1ok1 s PRO 88 Ca 0.34 1.34 -0.33 0.00 0.04 0.00 0.00 61.00 62.39 1ok1 s PRO 88 Cb 0.11 -1.73 -0.15 0.00 0.04 0.00 0.00 34.50 32.76 1ok1 s PRO 88 CO -0.13 -2.61 1.32 0.28 0.04 0.00 0.00 177.00 175.90 1ok1 n VAL 89 N -4.20 0.60 0.00 -0.36 0.31 -1.26 -1.68 118.33 111.74 1ok1 n VAL 89 Ca 0.10 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1ok1 n VAL 89 Cb 0.53 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 1ok1 n VAL 89 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ok1 n GLY 90 N 2.36 3.06 3.71 2.92 0.00 -0.19 -5.01 105.19 112.03 1ok1 n GLY 90 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1ok1 n GLY 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ok1 s THR 91 N -2.78 2.48 -0.11 2.61 2.01 -0.68 -4.69 115.64 114.48 1ok1 s THR 91 Ca 0.00 0.25 0.03 0.00 0.31 0.00 0.00 61.69 62.28 1ok1 s THR 91 Cb 0.00 -3.16 -0.00 0.00 0.01 0.00 0.00 72.50 69.35 1ok1 s THR 91 CO 0.00 0.01 -0.22 0.54 -0.69 0.00 0.00 174.62 174.27 1ok1 s VAL 92 N 1.64 2.22 0.26 3.82 0.11 -1.26 -0.55 120.40 126.64 1ok1 s VAL 92 Ca 0.74 -0.95 0.09 0.00 -2.93 0.00 0.00 61.98 58.93 1ok1 s VAL 92 Cb -0.45 -1.87 -0.04 0.00 -1.53 0.00 0.00 36.38 32.48 1ok1 s VAL 92 CO 0.32 0.55 0.03 0.68 -3.33 0.00 0.00 175.10 173.35 1ok1 s VAL 93 N 0.44 3.62 0.09 2.04 -7.23 -0.39 -4.96 120.40 114.01 1ok1 s VAL 93 Ca -0.15 -1.79 0.09 0.00 -1.81 0.00 0.00 61.98 58.31 1ok1 s VAL 93 Cb -0.17 -2.93 -0.04 0.00 0.56 0.00 0.00 36.38 33.80 1ok1 s VAL 93 CO 0.06 -0.35 -0.21 -0.70 -0.31 0.00 0.00 175.10 173.60 1ok1 s GLU 94 N -3.63 1.80 0.32 4.82 2.12 -1.26 -2.03 118.70 120.84 1ok1 s GLU 94 Ca 0.31 -1.14 0.09 0.00 0.36 0.00 0.00 54.97 54.59 1ok1 s GLU 94 Cb -0.07 -2.08 -0.05 0.00 0.26 0.00 0.00 34.13 32.19 1ok1 s GLU 94 CO 0.20 0.50 0.05 0.71 -0.54 0.00 0.00 175.26 176.18 1ok1 s TYR 95 N -1.02 2.64 0.01 5.30 1.51 0.29 -1.02 117.35 125.06 1ok1 s TYR 95 Ca 0.15 -0.36 0.01 0.00 -1.01 0.00 0.00 57.07 55.87 1ok1 s TYR 95 Cb -0.10 -1.45 -0.01 0.00 -0.11 0.00 0.00 41.96 40.28 1ok1 s TYR 95 CO 0.07 0.47 -0.03 -1.83 -1.11 0.00 0.00 175.55 173.12 1ok1 s GLU 96 N -3.75 0.24 0.51 -0.62 -1.05 0.03 -4.78 118.70 109.29 1ok1 s GLU 96 Ca 0.35 -0.30 -0.23 0.00 -0.15 0.00 0.00 54.97 54.63 1ok1 s GLU 96 Cb -0.03 -0.10 -0.06 0.00 -0.44 0.00 0.00 34.13 33.50 1ok1 s GLU 96 CO 0.21 0.02 1.40 0.00 0.95 0.00 0.00 175.26 177.83 1ok1 s ARG 98 N -2.75 1.41 -0.12 0.00 0.52 0.13 -4.71 118.95 113.43 1ok1 s ARG 98 Ca 0.68 -1.16 -0.06 0.00 -0.52 0.00 0.00 55.73 54.67 1ok1 s ARG 98 Cb -0.42 -2.27 -0.04 0.00 0.52 0.00 0.00 34.95 32.74 1ok1 s ARG 98 CO 0.52 -1.67 0.12 -1.25 0.02 0.00 0.00 175.30 173.03 1ok1 s PRO 99 N -5.27 3.40 -0.92 3.54 0.04 -1.26 -0.97 135.00 133.57 1ok1 s PRO 99 Ca 0.69 -0.18 -0.02 0.00 0.04 0.00 0.00 61.00 61.52 1ok1 s PRO 99 Cb -0.04 -3.13 0.23 0.00 0.04 0.00 0.00 34.50 31.60 1ok1 s PRO 99 CO 0.46 0.74 0.87 0.41 0.04 0.00 0.00 177.00 179.52 1ok1 n GLY 100 N 2.10 4.24 3.39 0.56 0.00 -1.26 -5.03 105.19 109.19 1ok1 n GLY 100 Ca -0.20 -2.61 -0.26 0.00 0.00 0.00 0.00 46.02 42.95 1ok1 n GLY 100 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ok1 s TYR 101 N -1.54 2.19 0.12 1.61 2.02 -0.14 -0.77 117.35 120.84 1ok1 s TYR 101 Ca 0.29 -0.38 0.04 0.00 -0.37 0.00 0.00 57.07 56.65 1ok1 s TYR 101 Cb -0.05 -1.11 -0.04 0.00 -0.40 0.00 0.00 41.96 40.36 1ok1 s TYR 101 CO -0.10 0.43 -0.10 -0.98 -1.57 0.00 0.00 175.55 173.23 1ok1 s ARG 102 N -2.54 0.96 0.42 -0.62 1.70 0.11 -4.53 118.95 114.45 1ok1 s ARG 102 Ca 0.18 -1.34 -0.26 0.00 -0.47 0.00 0.00 55.73 53.85 1ok1 s ARG 102 Cb -0.08 -0.54 -0.08 0.00 -0.57 0.00 0.00 34.95 33.67 1ok1 s ARG 102 CO 0.08 0.07 1.31 1.03 -1.08 0.00 0.00 175.30 176.71 1ok1 s ARG 103 N -3.43 3.90 -0.78 3.89 1.81 -1.26 0.29 118.95 123.37 1ok1 s ARG 103 Ca 0.12 2.16 -0.11 0.00 -1.72 0.00 0.00 55.73 56.18 1ok1 s ARG 103 Cb 0.01 -2.71 0.21 0.00 -0.45 0.00 0.00 34.95 32.01 1ok1 s ARG 103 CO -0.00 -0.55 0.69 -2.00 -0.68 0.00 0.00 175.30 172.76 1ok1 s GLU 104 N -2.31 3.35 0.45 3.54 2.56 0.10 -4.79 118.70 121.60 1ok1 s GLU 104 Ca 0.58 -2.52 0.34 0.00 0.00 0.00 0.00 54.97 53.37 1ok1 s GLU 104 Cb -0.38 -4.24 1.50 0.00 2.00 0.00 0.00 34.13 33.01 1ok1 s GLU 104 CO 0.49 -1.26 1.60 -1.35 -0.56 0.00 0.00 175.26 174.17 1ok1 h PRO 105 N 7.52 0.03 0.00 4.30 0.11 -1.94 0.11 132.00 142.14 1ok1 h PRO 105 Ca 0.08 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1ok1 h PRO 105 Cb 1.01 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1ok1 h PRO 105 CO 0.75 0.02 0.00 -1.13 -0.21 0.00 0.00 178.00 177.43 1ok1 n SER 106 N -4.63 0.17 -4.43 -2.05 3.41 -1.26 -4.77 113.62 100.06 1ok1 n SER 106 Ca 0.40 0.55 -0.30 0.00 -0.26 0.00 0.00 58.87 59.26 1ok1 n SER 106 Cb 1.56 -0.58 -0.13 0.00 -0.26 0.00 0.00 64.21 64.81 1ok1 n SER 106 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ok1 s LEU 107 N -3.39 2.49 0.18 1.04 1.43 0.37 -5.12 118.68 115.68 1ok1 s LEU 107 Ca 0.05 -0.60 -0.29 0.00 -1.03 0.00 0.00 54.13 52.26 1ok1 s LEU 107 Cb 0.08 -1.40 -0.08 0.00 0.03 0.00 0.00 46.19 44.82 1ok1 s LEU 107 CO 0.26 0.21 0.92 -0.55 0.23 0.00 0.00 176.35 177.42 1ok1 s SER 108 N -1.85 7.55 -0.44 2.29 0.15 -1.26 -4.82 113.70 115.32 1ok1 s SER 108 Ca 0.15 1.84 0.02 0.00 0.70 0.00 0.00 55.95 58.66 1ok1 s SER 108 Cb -0.10 -2.58 0.50 0.00 -1.71 0.00 0.00 66.02 62.13 1ok1 s SER 108 CO 0.07 0.08 1.86 -0.81 1.20 0.00 0.00 173.24 175.64 1ok1 n PRO 109 N 1.99 2.17 -4.84 5.44 -0.04 -1.26 -4.66 135.00 133.80 1ok1 n PRO 109 Ca -0.01 -2.61 -0.29 0.00 -0.04 0.00 0.00 63.50 60.56 1ok1 n PRO 109 Cb 0.48 -2.02 -0.15 0.00 -0.04 0.00 0.00 33.50 31.77 1ok1 n PRO 109 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1ok1 s LYS 110 N -2.92 1.68 -0.00 0.54 1.02 -1.26 -0.55 119.74 118.25 1ok1 s LYS 110 Ca 0.50 -1.05 0.08 0.00 0.02 0.00 0.00 55.97 55.52 1ok1 s LYS 110 Cb 0.41 -1.82 -0.02 0.00 -0.52 0.00 0.00 37.83 35.88 1ok1 s LYS 110 CO 0.06 0.47 -0.24 -0.51 -0.92 0.00 0.00 175.35 174.21 1ok1 s LEU 111 N -1.19 2.08 -0.02 3.17 1.43 -0.86 -4.97 118.68 118.32 1ok1 s LEU 111 Ca 0.10 -0.47 0.05 0.00 -1.03 0.00 0.00 54.13 52.77 1ok1 s LEU 111 Cb -0.10 -1.22 -0.03 0.00 0.03 0.00 0.00 46.19 44.87 1ok1 s LEU 111 CO 0.02 0.28 -0.15 -0.89 0.23 0.00 0.00 176.35 175.84 1ok1 s THR 112 N -0.63 3.03 -0.32 5.49 2.01 -1.26 -1.26 115.64 122.70 1ok1 s THR 112 Ca 0.10 -0.85 -0.28 0.00 0.31 0.00 0.00 61.69 60.96 1ok1 s THR 112 Cb -0.09 -2.22 0.01 0.00 0.01 0.00 0.00 72.50 70.21 1ok1 s THR 112 CO -0.00 0.51 1.02 0.00 -0.69 0.00 0.00 174.62 175.46 1ok1 s LEU 114 N 3.54 2.86 0.57 0.00 1.02 0.13 -1.03 118.68 125.77 1ok1 s LEU 114 Ca 0.43 0.76 0.26 0.00 0.02 0.00 0.00 54.13 55.60 1ok1 s LEU 114 Cb -0.12 -3.45 1.56 0.00 0.02 0.00 0.00 46.19 44.20 1ok1 s LEU 114 CO 0.15 -1.48 2.09 1.56 0.02 0.00 0.00 176.35 178.69 1ok1 h GLN 115 N -0.62 0.00 -0.26 1.70 4.20 -1.96 -0.35 115.11 117.83 1ok1 h GLN 115 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1ok1 h GLN 115 Cb 1.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.07 1ok1 h GLN 115 CO 0.63 0.00 0.00 0.27 -0.67 0.00 0.00 178.83 179.06 1ok1 n ASN 116 N -4.01 1.40 -0.91 1.46 0.23 -1.26 -4.89 115.26 107.28 1ok1 n ASN 116 Ca 0.02 -1.98 -0.08 0.00 -0.53 0.00 0.00 54.58 52.01 1ok1 n ASN 116 Cb 0.34 -0.17 -0.01 0.00 -2.08 0.00 0.00 39.78 37.86 1ok1 n ASN 116 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1ok1 n LEU 117 N 0.26 -1.30 -4.26 -4.53 4.77 -0.14 -5.03 117.00 106.76 1ok1 n LEU 117 Ca 0.09 0.01 -0.21 0.00 -0.03 0.00 0.00 56.01 55.87 1ok1 n LEU 117 Cb 0.22 -1.46 -0.12 0.00 -2.33 0.00 0.00 43.42 39.73 1ok1 n LEU 117 CO 0.06 -0.12 -0.49 -0.54 -1.33 0.00 0.00 177.39 174.97 1ok1 s LYS 118 N -4.24 1.07 0.35 3.23 1.02 -1.25 -4.37 119.74 115.55 1ok1 s LYS 118 Ca 0.00 -1.18 -0.23 0.00 0.02 0.00 0.00 55.97 54.58 1ok1 s LYS 118 Cb 0.00 -1.19 -0.10 0.00 -0.52 0.00 0.00 37.83 36.02 1ok1 s LYS 118 CO 0.00 0.26 0.92 -1.58 -0.92 0.00 0.00 175.35 174.03 1ok1 s TRP 119 N -1.49 3.54 1.16 3.18 0.52 -1.26 0.20 118.94 124.79 1ok1 s TRP 119 Ca 0.07 1.67 -0.16 0.00 0.02 0.00 0.00 56.10 57.70 1ok1 s TRP 119 Cb -0.08 -2.86 0.19 0.00 -1.15 0.00 0.00 33.47 29.57 1ok1 s TRP 119 CO 0.04 0.10 0.45 -1.13 0.02 0.00 0.00 176.95 176.43 1ok1 n SER 120 N 0.12 -2.16 -4.75 2.95 3.41 0.43 -4.88 113.62 108.74 1ok1 n SER 120 Ca 0.03 -0.17 -0.41 0.00 -0.26 0.00 0.00 58.87 58.07 1ok1 n SER 120 Cb 0.52 -1.08 -0.02 0.00 -0.26 0.00 0.00 64.21 63.36 1ok1 n SER 120 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ok1 s THR 121 N -2.30 2.64 0.07 6.66 2.01 -1.26 -4.87 115.64 118.59 1ok1 s THR 121 Ca 0.62 0.54 -0.25 0.00 0.31 0.00 0.00 61.69 62.90 1ok1 s THR 121 Cb -0.18 -3.34 -0.06 0.00 0.01 0.00 0.00 72.50 68.93 1ok1 s THR 121 CO 0.66 0.09 0.78 0.00 -0.69 0.00 0.00 174.62 175.46 1ok1 s ALA 122 N -0.04 3.37 0.34 7.40 0.00 -1.26 -5.04 121.76 126.53 1ok1 s ALA 122 Ca 0.59 0.32 0.09 0.00 0.00 0.00 0.00 51.96 52.96 1ok1 s ALA 122 Cb -0.42 -3.01 -0.06 0.00 0.00 0.00 0.00 23.12 19.62 1ok1 s ALA 122 CO 0.44 0.09 -0.09 0.14 0.00 0.00 0.00 175.76 176.34 1ok1 s VAL 123 N -0.23 2.18 -1.48 0.00 -7.23 -1.26 -5.04 120.40 107.34 1ok1 s VAL 123 Ca 0.39 -2.19 -0.10 0.00 -1.81 0.00 0.00 61.98 58.27 1ok1 s VAL 123 Cb -0.21 -2.64 0.02 0.00 0.56 0.00 0.00 36.38 34.11 1ok1 s VAL 123 CO 0.24 -0.20 2.53 -0.62 -0.31 0.00 0.00 175.10 176.73 1ok1 n GLU 124 N -0.78 3.71 0.25 4.82 4.71 -1.26 -4.62 120.64 127.46 1ok1 n GLU 124 Ca -0.05 -2.75 0.16 0.00 -0.01 0.00 0.00 57.16 54.51 1ok1 n GLU 124 Cb 0.64 -2.89 0.55 0.00 -1.01 0.00 0.00 31.44 28.72 1ok1 n GLU 124 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1ok1 h PHE 125 N 5.23 0.00 -3.62 -0.32 -5.15 -1.88 -3.39 116.94 107.81 1ok1 h PHE 125 Ca 0.71 0.00 -0.66 0.00 -0.20 0.00 0.00 57.97 57.82 1ok1 h PHE 125 Cb 0.41 0.00 -0.37 0.00 0.22 0.00 0.00 35.95 36.22 1ok1 h PHE 125 CO 1.65 0.00 -0.81 0.00 -2.00 0.00 0.00 178.31 177.14 1ok1 s LYS 127 N 1.20 3.02 0.17 0.00 -2.85 0.15 -4.81 119.74 116.61 1ok1 s LYS 127 Ca -0.05 -1.08 -0.30 0.00 -1.00 0.00 0.00 55.97 53.54 1ok1 s LYS 127 Cb -0.18 -2.71 -0.08 0.00 -2.06 0.00 0.00 37.83 32.80 1ok1 s LYS 127 CO -0.07 0.12 1.26 0.15 0.10 0.00 0.00 175.35 176.90 1ok1 s LYS 128 N -4.09 4.43 0.76 1.78 1.02 -1.26 0.07 119.74 122.45 1ok1 s LYS 128 Ca 0.42 1.94 -0.11 0.00 0.02 0.00 0.00 55.97 58.25 1ok1 s LYS 128 Cb -0.08 -3.24 0.05 0.00 -0.52 0.00 0.00 37.83 34.04 1ok1 s LYS 128 CO 0.29 -0.20 1.08 0.15 -0.92 0.00 0.00 175.35 175.76 1ok1 s LYS 129 N 0.10 2.39 -0.09 1.68 1.02 0.05 -4.71 119.74 120.19 1ok1 s LYS 129 Ca 0.56 1.09 -0.02 0.00 0.02 0.00 0.00 55.97 57.63 1ok1 s LYS 129 Cb -0.34 -1.92 -0.03 0.00 -0.52 0.00 0.00 37.83 35.02 1ok1 s LYS 129 CO 0.36 -1.53 -0.01 0.45 -0.92 0.00 0.00 175.35 173.70 1ok1 s SER 130 N -3.50 5.14 0.60 2.83 0.15 -1.26 0.37 113.70 118.03 1ok1 s SER 130 Ca 0.60 0.11 -0.09 0.00 0.70 0.00 0.00 55.95 57.28 1ok1 s SER 130 Cb -0.16 -1.44 -0.02 0.00 -1.71 0.00 0.00 66.02 62.69 1ok1 s SER 130 CO 0.56 0.37 0.97 0.00 1.20 0.00 0.00 173.24 176.33 1ok1 n PRO 132 N -2.67 -1.13 -1.71 0.00 -0.02 -1.26 -4.89 135.00 123.31 1ok1 n PRO 132 Ca 0.05 -0.28 -0.42 0.00 -2.02 0.00 0.00 63.50 60.83 1ok1 n PRO 132 Cb 0.56 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1ok1 n PRO 132 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1ok1 n ASN 133 N -4.43 4.00 0.26 2.55 2.85 -1.26 -4.87 115.26 114.36 1ok1 n ASN 133 Ca 0.09 1.05 0.13 0.00 -0.11 0.00 0.00 54.58 55.74 1ok1 n ASN 133 Cb 0.53 -1.57 0.68 0.00 1.24 0.00 0.00 39.78 40.66 1ok1 n ASN 133 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ok1 h PRO 134 N 6.97 0.00 0.00 1.20 0.11 -2.00 -3.48 132.00 134.80 1ok1 h PRO 134 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ok1 h PRO 134 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1ok1 h PRO 134 CO 0.96 0.13 0.00 0.41 -0.21 0.00 0.00 178.00 179.29 1ok1 n GLY 135 N -0.42 0.39 3.14 -0.55 0.00 -1.26 -4.94 105.19 101.55 1ok1 n GLY 135 Ca -0.01 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 1ok1 n GLY 135 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ok1 s GLU 136 N 0.00 0.64 -0.21 1.61 2.56 -1.26 -4.96 118.70 117.07 1ok1 s GLU 136 Ca 0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 54.97 54.22 1ok1 s GLU 136 Cb 0.00 0.25 0.01 0.00 2.00 0.00 0.00 34.13 36.40 1ok1 s GLU 136 CO 0.00 -0.17 -0.10 0.42 -0.56 0.00 0.00 175.26 174.85 1ok1 s ILE 137 N -2.70 2.76 0.11 -3.70 1.01 -1.26 -5.07 121.20 112.35 1ok1 s ILE 137 Ca -0.04 -0.80 -0.31 0.00 0.00 0.00 0.00 60.65 59.49 1ok1 s ILE 137 Cb -0.01 -2.27 -0.10 0.00 0.01 0.00 0.00 42.46 40.10 1ok1 s ILE 137 CO -0.05 0.40 1.74 -0.60 0.00 0.00 0.00 174.94 176.43 1ok1 s ARG 138 N 1.37 4.16 -0.76 2.79 3.52 -1.26 -1.81 118.95 126.96 1ok1 s ARG 138 Ca 0.04 2.48 0.00 0.00 -0.13 0.00 0.00 55.73 58.12 1ok1 s ARG 138 Cb -0.14 -3.54 0.00 0.00 -1.56 0.00 0.00 34.95 29.71 1ok1 s ARG 138 CO -0.07 -0.78 0.00 0.09 -0.81 0.00 0.00 175.30 173.73 1ok1 n ASN 139 N 5.44 -4.19 -0.82 -2.12 3.02 -1.26 -4.45 115.26 110.88 1ok1 n ASN 139 Ca 0.17 0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.89 1ok1 n ASN 139 Cb 0.39 -2.32 0.00 0.00 -0.61 0.00 0.00 39.78 37.24 1ok1 n ASN 139 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ok1 n GLY 140 N -1.68 3.88 3.15 7.41 0.00 -0.75 -0.90 105.19 116.30 1ok1 n GLY 140 Ca -0.07 -1.51 -0.08 0.00 0.00 0.00 0.00 46.02 44.36 1ok1 n GLY 140 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ok1 s GLN 141 N -1.47 0.73 -0.08 1.61 -0.21 0.53 -4.63 119.66 116.14 1ok1 s GLN 141 Ca 0.00 -1.02 0.05 0.00 0.02 0.00 0.00 55.36 54.41 1ok1 s GLN 141 Cb 0.00 0.28 -0.01 0.00 1.00 0.00 0.00 33.01 34.28 1ok1 s GLN 141 CO 0.00 -0.20 -0.24 0.42 -2.12 0.00 0.00 175.29 173.16 1ok1 s ILE 142 N -3.70 2.13 -0.28 1.08 1.01 -1.26 -1.63 121.20 118.56 1ok1 s ILE 142 Ca 0.04 -1.02 -0.10 0.00 0.00 0.00 0.00 60.65 59.58 1ok1 s ILE 142 Cb 0.05 -1.80 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 1ok1 s ILE 142 CO -0.10 0.56 0.14 -0.62 0.00 0.00 0.00 174.94 174.93 1ok1 s ASP 143 N 0.07 5.59 -0.66 3.58 -1.08 0.16 -4.96 116.67 119.37 1ok1 s ASP 143 Ca -0.10 -0.25 0.03 0.00 -0.52 0.00 0.00 52.55 51.71 1ok1 s ASP 143 Cb -0.16 -2.02 0.16 0.00 -1.46 0.00 0.00 42.92 39.44 1ok1 s ASP 143 CO 0.06 -0.10 0.44 -0.69 0.52 0.00 0.00 175.17 175.40 1ok1 s VAL 144 N 1.67 3.02 0.20 1.11 1.01 -1.26 -1.50 120.40 124.65 1ok1 s VAL 144 Ca 0.06 -3.82 -0.08 0.00 0.00 0.00 0.00 61.98 58.14 1ok1 s VAL 144 Cb -0.16 -3.00 0.08 0.00 0.00 0.00 0.00 36.38 33.29 1ok1 s VAL 144 CO 0.07 -0.94 1.66 1.55 0.00 0.00 0.00 175.10 177.45 1ok1 h PRO 145 N 5.95 1.03 -1.77 2.72 0.13 -1.96 -3.39 132.00 134.71 1ok1 h PRO 145 Ca 0.06 -0.32 -0.48 0.00 -0.87 0.00 0.00 66.00 64.39 1ok1 h PRO 145 Cb 0.82 -0.10 -0.37 0.00 0.13 0.00 0.00 31.00 31.48 1ok1 h PRO 145 CO 0.72 1.01 -1.08 0.41 -0.23 0.00 0.00 178.00 178.83 1ok1 n GLY 146 N -0.46 2.97 2.54 1.56 0.00 -1.26 -5.13 105.19 105.41 1ok1 n GLY 146 Ca 0.03 -1.45 0.07 0.00 0.00 0.00 0.00 46.02 44.67 1ok1 n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ok1 n GLY 147 N 0.76 -1.93 0.90 -0.02 0.00 -1.26 -4.69 105.19 98.95 1ok1 n GLY 147 Ca 0.22 -1.31 0.05 0.00 0.00 0.00 0.00 46.02 44.98 1ok1 n GLY 147 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ok1 n ILE 148 N -2.14 1.41 -2.11 -0.61 -5.35 -1.26 -4.68 119.36 104.60 1ok1 n ILE 148 Ca 0.00 -2.40 -0.27 0.00 -0.27 0.00 0.00 62.75 59.81 1ok1 n ILE 148 Cb 0.23 0.20 0.07 0.00 -1.74 0.00 0.00 39.64 38.41 1ok1 n ILE 148 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1ok1 s LEU 149 N -2.06 2.75 -0.19 7.28 1.43 -1.26 -0.84 118.68 125.78 1ok1 s LEU 149 Ca 0.36 0.58 -0.39 0.00 -1.03 0.00 0.00 54.13 53.65 1ok1 s LEU 149 Cb 0.37 -3.20 -0.16 0.00 0.03 0.00 0.00 46.19 43.24 1ok1 s LEU 149 CO -0.10 -1.66 1.67 0.33 0.23 0.00 0.00 176.35 176.82 1ok1 n PHE 150 N -3.02 1.96 0.00 0.29 -0.00 0.16 -0.91 117.46 115.93 1ok1 n PHE 150 Ca 0.08 0.53 0.00 0.00 -0.00 0.00 0.00 57.45 58.06 1ok1 n PHE 150 Cb 0.60 -2.44 0.00 0.00 -0.00 0.00 0.00 39.48 37.64 1ok1 n PHE 150 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ok1 n GLY 151 N 3.85 0.22 3.81 7.13 0.00 0.31 -4.92 105.19 115.59 1ok1 n GLY 151 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.94 1ok1 n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ok1 s ALA 152 N -2.00 2.78 0.00 4.61 0.00 -0.09 -4.77 121.76 122.30 1ok1 s ALA 152 Ca 0.00 0.32 0.07 0.00 0.00 0.00 0.00 51.96 52.35 1ok1 s ALA 152 Cb 0.00 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 1ok1 s ALA 152 CO 0.00 -0.78 -0.23 0.99 0.00 0.00 0.00 175.76 175.74 1ok1 s THR 153 N -2.56 1.82 0.02 0.00 2.01 -1.26 -0.94 115.64 114.73 1ok1 s THR 153 Ca 0.62 -1.07 0.02 0.00 0.31 0.00 0.00 61.69 61.57 1ok1 s THR 153 Cb -0.15 -1.53 -0.01 0.00 0.01 0.00 0.00 72.50 70.82 1ok1 s THR 153 CO 0.39 0.43 -0.07 0.27 -0.69 0.00 0.00 174.62 174.95 1ok1 s ILE 154 N -0.62 0.49 0.24 1.82 -4.36 0.04 -4.41 121.20 114.40 1ok1 s ILE 154 Ca 0.09 -0.67 0.10 0.00 -0.26 0.00 0.00 60.65 59.91 1ok1 s ILE 154 Cb -0.09 -0.49 -0.04 0.00 1.25 0.00 0.00 42.46 43.08 1ok1 s ILE 154 CO 0.00 -0.14 -0.12 -0.94 0.24 0.00 0.00 174.94 173.98 1ok1 s SER 155 N -0.88 4.03 0.06 4.36 1.04 -0.56 -0.23 113.70 121.52 1ok1 s SER 155 Ca -0.04 -0.77 0.09 0.00 0.48 0.00 0.00 55.95 55.71 1ok1 s SER 155 Cb -0.06 -0.57 -0.03 0.00 0.10 0.00 0.00 66.02 65.46 1ok1 s SER 155 CO 0.00 0.06 -0.25 -0.36 0.98 0.00 0.00 173.24 173.67 1ok1 s PHE 156 N -2.13 2.19 0.06 5.02 2.99 0.04 0.37 117.98 126.51 1ok1 s PHE 156 Ca 0.28 -0.40 -0.06 0.00 0.00 0.00 0.00 56.93 56.75 1ok1 s PHE 156 Cb -0.07 -1.28 -0.01 0.00 0.00 0.00 0.00 43.02 41.66 1ok1 s PHE 156 CO 0.16 0.16 0.11 -1.54 -0.00 0.00 0.00 175.22 174.11 1ok1 s SER 157 N -1.41 0.20 -0.08 1.36 1.04 -0.65 -4.85 113.70 109.31 1ok1 s SER 157 Ca 0.11 -0.64 0.03 0.00 0.48 0.00 0.00 55.95 55.93 1ok1 s SER 157 Cb -0.10 0.27 -0.01 0.00 0.10 0.00 0.00 66.02 66.27 1ok1 s SER 157 CO 0.03 -0.60 -0.18 0.00 0.98 0.00 0.00 173.24 173.46 1ok1 n ASN 159 N 3.03 -0.97 -4.68 0.00 5.03 -0.08 -4.80 115.26 112.79 1ok1 n ASN 159 Ca -0.18 0.05 -0.45 0.00 0.87 0.00 0.00 54.58 54.88 1ok1 n ASN 159 Cb 0.52 -1.34 -0.04 0.00 -1.02 0.00 0.00 39.78 37.90 1ok1 n ASN 159 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 1ok1 n THR 160 N -4.72 0.49 0.00 3.41 -1.04 -1.26 -1.54 114.28 109.61 1ok1 n THR 160 Ca 0.06 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1ok1 n THR 160 Cb 0.53 -2.01 0.00 0.00 -1.82 0.00 0.00 70.33 67.04 1ok1 n THR 160 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ok1 n GLY 161 N 4.26 0.73 3.15 3.41 0.00 -1.26 -5.02 105.19 110.46 1ok1 n GLY 161 Ca 0.20 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 1ok1 n GLY 161 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ok1 s TYR 162 N -2.00 1.19 -0.11 1.61 1.51 -0.59 -1.15 117.35 117.81 1ok1 s TYR 162 Ca 0.00 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.67 1ok1 s TYR 162 Cb 0.00 -0.69 -0.02 0.00 -0.11 0.00 0.00 41.96 41.14 1ok1 s TYR 162 CO 0.00 0.04 -0.13 0.21 -1.11 0.00 0.00 175.55 174.55 1ok1 s LYS 163 N -1.37 3.14 -0.01 -0.62 2.20 0.94 -4.64 119.74 119.38 1ok1 s LYS 163 Ca -0.00 -0.69 -0.30 0.00 -0.36 0.00 0.00 55.97 54.62 1ok1 s LYS 163 Cb -0.09 -2.56 -0.03 0.00 -1.51 0.00 0.00 37.83 33.64 1ok1 s LYS 163 CO 0.02 0.33 1.06 -1.17 -0.36 0.00 0.00 175.35 175.23 1ok1 s LEU 164 N 0.04 4.34 -0.18 5.43 0.20 -1.26 0.29 118.68 127.55 1ok1 s LEU 164 Ca -0.05 1.73 0.00 0.00 0.69 0.00 0.00 54.13 56.51 1ok1 s LEU 164 Cb -0.14 -3.57 0.04 0.00 -0.43 0.00 0.00 46.19 42.09 1ok1 s LEU 164 CO 0.04 -0.38 -0.10 -0.36 -0.29 0.00 0.00 176.35 175.26 1ok1 s PHE 165 N 1.35 2.21 -2.04 5.38 0.08 0.73 -4.93 117.98 120.76 1ok1 s PHE 165 Ca 0.53 -1.41 0.00 0.00 0.12 0.00 0.00 56.93 56.18 1ok1 s PHE 165 Cb -0.23 -1.56 0.00 0.00 -0.57 0.00 0.00 43.02 40.66 1ok1 s PHE 165 CO 0.26 -0.70 0.00 0.41 -0.10 0.00 0.00 175.22 175.09 1ok1 n GLY 166 N 4.74 0.49 3.81 4.36 0.00 -1.26 0.92 105.19 118.26 1ok1 n GLY 166 Ca -0.14 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 43.63 1ok1 n GLY 166 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ok1 s SER 167 N -4.00 7.01 0.00 1.61 0.01 -1.26 -4.98 113.70 112.09 1ok1 s SER 167 Ca 0.00 1.69 0.21 0.00 1.31 0.00 0.00 55.95 59.16 1ok1 s SER 167 Cb 0.00 -2.53 -0.16 0.00 0.21 0.00 0.00 66.02 63.53 1ok1 s SER 167 CO 0.00 -0.29 0.95 0.35 0.41 0.00 0.00 173.24 174.67 1ok1 n THR 168 N -0.37 0.00 -3.84 1.44 -2.24 -1.26 -4.50 114.28 103.50 1ok1 n THR 168 Ca 0.06 -0.06 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 1ok1 n THR 168 Cb 0.53 1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.76 1ok1 n THR 168 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ok1 s SER 169 N -2.88 -0.21 -0.02 3.42 1.04 -1.26 -0.78 113.70 113.00 1ok1 s SER 169 Ca 0.10 -0.64 -0.12 0.00 0.48 0.00 0.00 55.95 55.78 1ok1 s SER 169 Cb 0.17 0.62 0.02 0.00 0.10 0.00 0.00 66.02 66.92 1ok1 s SER 169 CO 0.80 -1.15 0.25 -0.55 0.98 0.00 0.00 173.24 173.56 1ok1 s SER 170 N -2.93 -0.13 -0.04 7.02 0.15 0.68 -4.70 113.70 113.75 1ok1 s SER 170 Ca 0.13 0.06 0.06 0.00 0.70 0.00 0.00 55.95 56.90 1ok1 s SER 170 Cb -0.02 0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 64.59 1ok1 s SER 170 CO 0.03 -0.37 -0.21 -0.36 1.20 0.00 0.00 173.24 173.53 1ok1 s PHE 171 N -1.13 1.97 -0.66 3.44 0.40 -1.26 -0.78 117.98 119.96 1ok1 s PHE 171 Ca -0.12 -0.50 -0.27 0.00 -0.60 0.00 0.00 56.93 55.43 1ok1 s PHE 171 Cb -0.06 -1.30 0.02 0.00 0.51 0.00 0.00 43.02 42.20 1ok1 s PHE 171 CO 0.03 -0.13 1.32 0.00 0.70 0.00 0.00 175.22 177.14 1ok1 s LEU 173 N 5.80 2.99 0.12 0.00 2.01 -0.72 -0.53 118.68 128.35 1ok1 s LEU 173 Ca 0.42 -0.78 -0.31 0.00 0.01 0.00 0.00 54.13 53.47 1ok1 s LEU 173 Cb -0.09 -1.50 -0.08 0.00 0.01 0.00 0.00 46.19 44.53 1ok1 s LEU 173 CO 0.20 0.01 1.35 -0.51 1.01 0.00 0.00 176.35 178.40 1ok1 s ILE 174 N -2.39 3.39 -0.40 -0.59 2.07 -1.26 -0.51 121.20 121.51 1ok1 s ILE 174 Ca 0.31 1.02 0.02 0.00 -1.41 0.00 0.00 60.65 60.59 1ok1 s ILE 174 Cb -0.06 -3.66 0.12 0.00 0.13 0.00 0.00 42.46 39.00 1ok1 s ILE 174 CO 0.18 0.09 0.17 -0.55 -1.91 0.00 0.00 174.94 172.93 1ok1 s SER 175 N 0.94 3.99 1.79 4.50 0.15 0.77 -4.81 113.70 121.03 1ok1 s SER 175 Ca 0.62 -2.32 0.00 0.00 0.70 0.00 0.00 55.95 54.95 1ok1 s SER 175 Cb -0.36 -1.14 0.00 0.00 -1.71 0.00 0.00 66.02 62.82 1ok1 s SER 175 CO 0.32 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 175.04 1ok1 n GLY 176 N 3.97 2.76 0.24 9.45 0.00 -1.26 -1.52 105.19 118.84 1ok1 n GLY 176 Ca 0.04 0.30 0.15 0.00 0.00 0.00 0.00 46.02 46.52 1ok1 n GLY 176 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ok1 h SER 177 N 0.00 0.00 -0.06 1.61 4.64 -2.02 -3.47 113.55 114.24 1ok1 h SER 177 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ok1 h SER 177 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ok1 h SER 177 CO 0.00 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.42 1ok1 n SER 178 N -3.05 0.12 -4.00 4.97 3.41 -0.57 -5.01 113.62 109.50 1ok1 n SER 178 Ca 0.02 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.43 1ok1 n SER 178 Cb 0.41 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.21 1ok1 n SER 178 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1ok1 s VAL 179 N 1.32 0.75 0.15 -3.33 -7.23 -1.26 -0.16 120.40 110.64 1ok1 s VAL 179 Ca 0.00 -0.35 0.00 0.00 -1.81 0.00 0.00 61.98 59.83 1ok1 s VAL 179 Cb 0.00 -0.66 -0.04 0.00 0.56 0.00 0.00 36.38 36.23 1ok1 s VAL 179 CO 0.00 0.23 0.04 -1.10 -0.31 0.00 0.00 175.10 173.96 1ok1 s GLN 180 N 0.17 1.02 0.06 4.82 -1.52 0.34 -4.68 119.66 119.87 1ok1 s GLN 180 Ca -0.03 -1.49 -0.31 0.00 -1.95 0.00 0.00 55.36 51.59 1ok1 s GLN 180 Cb -0.08 0.02 -0.06 0.00 -0.22 0.00 0.00 33.01 32.67 1ok1 s GLN 180 CO 0.00 -0.21 1.32 -1.58 -0.25 0.00 0.00 175.29 174.57 1ok1 s TRP 181 N -3.88 3.21 0.21 0.91 0.52 -1.26 -1.75 118.94 116.90 1ok1 s TRP 181 Ca 0.25 1.05 -0.09 0.00 0.02 0.00 0.00 56.10 57.33 1ok1 s TRP 181 Cb 0.07 -3.58 0.27 0.00 -1.15 0.00 0.00 33.47 29.08 1ok1 s TRP 181 CO 0.03 -1.98 1.79 0.66 0.02 0.00 0.00 176.95 177.47 1ok1 h SER 182 N 7.08 0.48 -4.19 2.95 4.64 -1.29 -3.44 113.55 119.78 1ok1 h SER 182 Ca -0.41 0.04 -0.52 0.00 -0.47 0.00 0.00 61.79 60.44 1ok1 h SER 182 Cb 1.20 -0.04 -0.21 0.00 -0.31 0.00 0.00 62.40 63.04 1ok1 h SER 182 CO 0.86 0.30 -0.81 -1.81 -0.87 0.00 0.00 176.83 174.49 1ok1 s ASP 183 N -5.54 2.36 0.73 4.97 1.11 -1.26 -4.98 116.67 114.06 1ok1 s ASP 183 Ca -0.13 -0.69 -0.11 0.00 0.18 0.00 0.00 52.55 51.80 1ok1 s ASP 183 Cb 0.17 -0.12 0.03 0.00 1.07 0.00 0.00 42.92 44.06 1ok1 s ASP 183 CO 0.76 0.02 1.09 -2.16 1.18 0.00 0.00 175.17 176.05 1ok1 s PRO 184 N -1.97 2.67 0.04 8.23 0.04 -1.26 -4.88 135.00 137.86 1ok1 s PRO 184 Ca 0.06 0.61 -0.30 0.00 0.04 0.00 0.00 61.00 61.41 1ok1 s PRO 184 Cb -0.09 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.38 1ok1 s PRO 184 CO 0.04 -1.21 1.75 -0.51 0.04 0.00 0.00 177.00 177.12 1ok1 s LEU 185 N -5.51 4.38 0.00 -3.56 1.02 -1.26 -4.64 118.68 109.10 1ok1 s LEU 185 Ca 0.59 2.51 -0.09 0.00 0.02 0.00 0.00 54.13 57.15 1ok1 s LEU 185 Cb -0.13 -3.55 0.13 0.00 0.02 0.00 0.00 46.19 42.67 1ok1 s LEU 185 CO 0.53 -0.95 0.51 -0.81 0.02 0.00 0.00 176.35 175.65 1ok1 n PRO 186 N 6.46 -1.78 -5.12 1.29 -0.04 -1.26 -4.97 135.00 129.57 1ok1 n PRO 186 Ca 0.17 -0.82 -0.30 0.00 -0.04 0.00 0.00 63.50 62.52 1ok1 n PRO 186 Cb 0.41 -0.73 -0.16 0.00 -0.04 0.00 0.00 33.50 32.98 1ok1 n PRO 186 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1ok1 s GLU 187 N -4.16 2.30 -0.48 0.54 2.12 0.26 -4.94 118.70 114.33 1ok1 s GLU 187 Ca 0.33 -0.81 -0.18 0.00 0.36 0.00 0.00 54.97 54.67 1ok1 s GLU 187 Cb -0.03 -1.96 0.06 0.00 0.26 0.00 0.00 34.13 32.46 1ok1 s GLU 187 CO 0.25 0.33 0.54 0.00 -0.54 0.00 0.00 175.26 175.84 1ok1 s ARG 189 N 2.29 4.04 0.07 0.00 0.52 0.86 -4.72 118.95 122.01 1ok1 s ARG 189 Ca 0.12 -0.29 -0.35 0.00 -0.52 0.00 0.00 55.73 54.68 1ok1 s ARG 189 Cb -0.20 -3.29 -0.15 0.00 0.52 0.00 0.00 34.95 31.83 1ok1 s ARG 189 CO 0.11 0.30 1.56 -1.91 0.02 0.00 0.00 175.30 175.37 1ok1 n GLU 190 N 3.49 1.77 -2.99 3.54 2.13 -1.26 0.32 120.64 127.63 1ok1 n GLU 190 Ca -0.16 0.64 -0.40 0.00 0.66 0.00 0.00 57.16 57.90 1ok1 n GLU 190 Cb 0.52 -2.37 -0.05 0.00 0.27 0.00 0.00 31.44 29.81 1ok1 n GLU 190 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1ok1 s ILE 191 N 1.43 4.75 -0.08 6.31 1.01 -0.30 -4.78 121.20 129.54 1ok1 s ILE 191 Ca 0.84 1.62 0.01 0.00 0.00 0.00 0.00 60.65 63.11 1ok1 s ILE 191 Cb -0.80 -4.11 -0.03 0.00 0.01 0.00 0.00 42.46 37.54 1ok1 s ILE 191 CO 0.45 0.36 -0.08 -0.31 0.00 0.00 0.00 174.94 175.36 1ok1 s TYR 192 N -0.03 2.90 0.63 3.97 2.02 -1.26 -4.15 117.35 121.43 1ok1 s TYR 192 Ca 0.38 -0.08 -0.14 0.00 -0.37 0.00 0.00 57.07 56.87 1ok1 s TYR 192 Cb -0.20 -1.73 -0.02 0.00 -0.40 0.00 0.00 41.96 39.61 1ok1 s TYR 192 CO 0.23 0.24 1.06 0.00 -1.57 0.00 0.00 175.55 175.50 1ok1 s PRO 194 N -4.41 0.80 0.26 0.00 0.04 -1.26 -4.60 135.00 125.83 1ok1 s PRO 194 Ca 0.61 1.41 -0.31 0.00 0.04 0.00 0.00 61.00 62.76 1ok1 s PRO 194 Cb -0.15 -1.71 -0.12 0.00 0.04 0.00 0.00 34.50 32.55 1ok1 s PRO 194 CO 0.43 -2.74 1.52 0.00 0.04 0.00 0.00 177.00 176.25 1ok1 n ALA 195 N -4.30 1.88 -1.76 8.56 0.00 -1.26 -4.90 120.51 118.74 1ok1 n ALA 195 Ca 0.10 0.39 -0.38 0.00 0.00 0.00 0.00 53.44 53.55 1ok1 n ALA 195 Cb 0.52 -2.38 0.03 0.00 0.00 0.00 0.00 19.45 17.63 1ok1 n ALA 195 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ok1 s PRO 196 N -0.35 3.32 0.38 0.00 0.04 -1.26 -4.96 135.00 132.18 1ok1 s PRO 196 Ca 0.67 2.17 -0.25 0.00 0.04 0.00 0.00 61.00 63.62 1ok1 s PRO 196 Cb -0.57 -2.33 -0.09 0.00 0.04 0.00 0.00 34.50 31.55 1ok1 s PRO 196 CO 0.48 -1.02 1.08 -1.25 0.04 0.00 0.00 177.00 176.33 1ok1 s PRO 197 N -2.81 4.21 0.42 0.56 0.04 -1.26 -5.04 135.00 131.11 1ok1 s PRO 197 Ca 0.69 1.63 -0.06 0.00 0.04 0.00 0.00 61.00 63.29 1ok1 s PRO 197 Cb -0.39 -2.67 -0.05 0.00 0.04 0.00 0.00 34.50 31.44 1ok1 s PRO 197 CO 0.46 -0.13 0.72 -0.65 0.04 0.00 0.00 177.00 177.45 1ok1 s GLN 198 N -2.29 3.61 0.07 4.56 -1.52 -1.26 -4.98 119.66 117.85 1ok1 s GLN 198 Ca 0.56 0.20 0.07 0.00 -1.95 0.00 0.00 55.36 54.23 1ok1 s GLN 198 Cb -0.25 -2.45 -0.03 0.00 -0.22 0.00 0.00 33.01 30.06 1ok1 s GLN 198 CO 0.32 -0.06 -0.18 0.96 -0.25 0.00 0.00 175.29 176.08 1ok1 s ILE 199 N -2.50 1.42 0.18 1.08 -4.36 -1.26 -5.08 121.20 110.67 1ok1 s ILE 199 Ca 0.47 -1.32 -0.31 0.00 -0.26 0.00 0.00 60.65 59.23 1ok1 s ILE 199 Cb -0.10 -1.30 -0.09 0.00 1.25 0.00 0.00 42.46 42.22 1ok1 s ILE 199 CO 0.38 -0.06 1.46 -1.81 0.24 0.00 0.00 174.94 175.16 1ok1 s ASP 200 N -1.61 6.69 -1.83 4.36 1.01 -1.26 -3.03 116.67 121.01 1ok1 s ASP 200 Ca 0.03 2.54 0.00 0.00 0.71 0.00 0.00 52.55 55.83 1ok1 s ASP 200 Cb -0.09 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1ok1 s ASP 200 CO 0.03 -0.72 0.00 0.59 0.21 0.00 0.00 175.17 175.28 1ok1 n ASN 201 N 3.36 -5.72 -3.87 0.27 3.02 -1.26 -4.31 115.26 106.75 1ok1 n ASN 201 Ca 0.10 0.09 -0.11 0.00 -0.03 0.00 0.00 54.58 54.64 1ok1 n ASN 201 Cb 0.40 -4.79 -0.06 0.00 -0.61 0.00 0.00 39.78 34.72 1ok1 n ASN 201 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ok1 s GLY 202 N -2.23 0.85 0.22 7.41 0.00 -1.17 -1.48 107.32 110.91 1ok1 s GLY 202 Ca 0.00 -1.12 0.01 0.00 0.00 0.00 0.00 44.72 43.61 1ok1 s GLY 202 CO 0.00 -0.81 0.09 -0.26 0.00 0.00 0.00 173.10 172.12 1ok1 s ILE 203 N -3.83 0.40 -0.23 0.90 -4.36 0.13 -4.50 121.20 109.69 1ok1 s ILE 203 Ca 0.26 -1.99 -0.09 0.00 -0.26 0.00 0.00 60.65 58.57 1ok1 s ILE 203 Cb 0.00 -2.47 -0.04 0.00 1.25 0.00 0.00 42.46 41.20 1ok1 s ILE 203 CO 0.12 -0.12 0.13 -0.63 0.24 0.00 0.00 174.94 174.67 1ok1 s ILE 204 N -3.87 5.06 -0.48 8.37 1.01 -1.26 -1.69 121.20 128.34 1ok1 s ILE 204 Ca 0.35 0.07 -0.28 0.00 0.00 0.00 0.00 60.65 60.79 1ok1 s ILE 204 Cb 0.07 -3.35 -0.00 0.00 0.01 0.00 0.00 42.46 39.19 1ok1 s ILE 204 CO 0.11 0.36 1.63 -1.10 0.00 0.00 0.00 174.94 175.93 1ok1 s GLN 205 N 1.06 3.21 -1.03 2.79 -0.21 0.06 -3.96 119.66 121.58 1ok1 s GLN 205 Ca 0.06 0.86 -0.06 0.00 0.02 0.00 0.00 55.36 56.24 1ok1 s GLN 205 Cb -0.14 -4.19 -0.07 0.00 1.00 0.00 0.00 33.01 29.62 1ok1 s GLN 205 CO 0.04 -2.03 0.90 0.41 -2.12 0.00 0.00 175.29 172.50 1ok1 n GLY 206 N 5.37 -1.16 3.70 3.09 0.00 -1.26 -4.67 105.19 110.26 1ok1 n GLY 206 Ca 0.18 0.58 -0.44 0.00 0.00 0.00 0.00 46.02 46.34 1ok1 n GLY 206 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ok1 n GLU 207 N -3.16 2.36 -3.55 1.61 2.13 -1.25 -4.99 120.64 113.78 1ok1 n GLU 207 Ca -0.07 0.84 -0.23 0.00 0.66 0.00 0.00 57.16 58.36 1ok1 n GLU 207 Cb 0.61 -2.58 -0.02 0.00 0.27 0.00 0.00 31.44 29.73 1ok1 n GLU 207 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1ok1 s ARG 208 N -0.15 3.48 0.12 5.31 0.52 -1.26 -5.03 118.95 121.94 1ok1 s ARG 208 Ca 0.68 -0.44 -0.16 0.00 -0.52 0.00 0.00 55.73 55.30 1ok1 s ARG 208 Cb -0.58 -2.73 -0.03 0.00 0.52 0.00 0.00 34.95 32.12 1ok1 s ARG 208 CO 0.46 0.24 1.57 0.22 0.02 0.00 0.00 175.30 177.81 1ok1 h ASP 209 N 0.98 0.62 -4.30 0.23 -0.00 -2.05 -3.45 116.42 108.45 1ok1 h ASP 209 Ca -0.50 -0.30 -0.39 0.00 -0.00 0.00 0.00 57.03 55.85 1ok1 h ASP 209 Cb 1.22 -0.17 -0.25 0.00 -0.00 0.00 0.00 39.33 40.13 1ok1 h ASP 209 CO 0.62 0.76 -0.77 -1.00 -0.00 0.00 0.00 179.24 178.85 1ok1 s HIS 210 N -5.05 0.94 -0.14 0.28 3.76 -1.26 -5.01 115.29 108.82 1ok1 s HIS 210 Ca -0.13 -0.31 0.01 0.00 -0.15 0.00 0.00 55.06 54.48 1ok1 s HIS 210 Cb 0.09 -0.57 0.02 0.00 1.11 0.00 0.00 32.58 33.23 1ok1 s HIS 210 CO 0.78 -0.00 -0.16 0.71 -0.85 0.00 0.00 174.74 175.22 1ok1 s TYR 211 N -0.73 2.19 0.49 1.40 1.51 -1.26 -5.06 117.35 115.90 1ok1 s TYR 211 Ca -0.00 -1.16 0.07 0.00 -1.01 0.00 0.00 57.07 54.96 1ok1 s TYR 211 Cb -0.07 -1.58 0.07 0.00 -0.11 0.00 0.00 41.96 40.27 1ok1 s TYR 211 CO 0.01 -0.61 0.54 0.41 -1.11 0.00 0.00 175.55 174.79 1ok1 n GLY 212 N 4.50 2.34 3.69 0.71 0.00 -1.26 -0.84 105.19 114.33 1ok1 n GLY 212 Ca -0.18 -2.25 -0.61 0.00 0.00 0.00 0.00 46.02 42.99 1ok1 n GLY 212 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1ok1 n TYR 213 N -1.88 1.76 -0.85 1.61 9.36 -1.26 -1.20 117.16 124.71 1ok1 n TYR 213 Ca 0.07 0.81 0.00 0.00 3.32 0.00 0.00 57.90 62.09 1ok1 n TYR 213 Cb 0.54 -2.33 0.00 0.00 -0.63 0.00 0.00 39.34 36.91 1ok1 n TYR 213 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1ok1 n ARG 214 N 4.22 -0.19 -2.63 2.98 5.12 0.54 -4.95 116.66 121.76 1ok1 n ARG 214 Ca 0.26 0.05 -0.38 0.00 -1.93 0.00 0.00 57.85 55.85 1ok1 n ARG 214 Cb 0.07 -3.42 -0.05 0.00 -1.16 0.00 0.00 32.46 27.89 1ok1 n ARG 214 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1ok1 s GLN 215 N -0.50 4.54 0.18 5.56 -0.21 -0.34 -4.63 119.66 124.27 1ok1 s GLN 215 Ca 0.00 1.54 0.08 0.00 0.02 0.00 0.00 55.36 57.00 1ok1 s GLN 215 Cb 0.00 -2.93 -0.04 0.00 1.00 0.00 0.00 33.01 31.04 1ok1 s GLN 215 CO 0.00 0.20 -0.07 -1.54 -2.12 0.00 0.00 175.29 171.76 1ok1 s SER 216 N -1.32 4.39 -0.13 5.90 1.04 -1.26 -1.45 113.70 120.87 1ok1 s SER 216 Ca 0.49 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 56.40 1ok1 s SER 216 Cb -0.25 -0.80 0.02 0.00 0.10 0.00 0.00 66.02 65.09 1ok1 s SER 216 CO 0.31 0.10 -0.17 0.54 0.98 0.00 0.00 173.24 175.00 1ok1 s VAL 217 N -1.73 1.70 -0.13 5.02 0.11 0.45 -4.98 120.40 120.84 1ok1 s VAL 217 Ca 0.26 -0.74 -0.11 0.00 -2.93 0.00 0.00 61.98 58.45 1ok1 s VAL 217 Cb -0.09 -1.55 -0.05 0.00 -1.53 0.00 0.00 36.38 33.16 1ok1 s VAL 217 CO 0.16 0.48 0.23 -0.89 -3.33 0.00 0.00 175.10 171.75 1ok1 s THR 218 N 1.13 5.35 0.24 5.04 2.01 -1.26 -1.60 115.64 126.56 1ok1 s THR 218 Ca -0.02 0.41 0.07 0.00 0.31 0.00 0.00 61.69 62.45 1ok1 s THR 218 Cb -0.14 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 1ok1 s THR 218 CO -0.06 0.51 0.22 -0.31 -0.69 0.00 0.00 174.62 174.29 1ok1 s TYR 219 N -0.30 3.17 -0.14 4.92 1.51 -0.18 -0.76 117.35 125.58 1ok1 s TYR 219 Ca 0.15 -0.09 -0.09 0.00 -1.01 0.00 0.00 57.07 56.04 1ok1 s TYR 219 Cb -0.13 -1.44 0.05 0.00 -0.11 0.00 0.00 41.96 40.33 1ok1 s TYR 219 CO 0.04 0.51 0.34 0.00 -1.11 0.00 0.00 175.55 175.33 1ok1 s ALA 220 N -2.08 -0.83 0.34 3.71 0.00 -0.68 -4.86 121.76 117.35 1ok1 s ALA 220 Ca 0.33 1.18 -0.15 0.00 0.00 0.00 0.00 51.96 53.31 1ok1 s ALA 220 Cb -0.08 -0.71 -0.09 0.00 0.00 0.00 0.00 23.12 22.23 1ok1 s ALA 220 CO 0.26 -0.21 0.76 0.00 0.00 0.00 0.00 175.76 176.57 1ok1 s ASN 222 N -2.33 4.98 -0.03 0.00 0.01 -0.55 -4.88 114.94 112.14 1ok1 s ASN 222 Ca 0.55 1.73 -0.37 0.00 -0.71 0.00 0.00 52.86 54.06 1ok1 s ASN 222 Cb -0.10 -2.51 -0.15 0.00 0.41 0.00 0.00 41.25 38.90 1ok1 s ASN 222 CO 0.18 -1.71 1.60 1.17 -1.51 0.00 0.00 177.10 176.83 1ok1 n LYS 223 N -3.25 1.54 -0.01 -0.60 4.81 -1.26 -1.23 118.16 118.16 1ok1 n LYS 223 Ca 0.08 0.56 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 1ok1 n LYS 223 Cb 0.53 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 33.31 1ok1 n LYS 223 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ok1 n GLY 224 N 3.52 0.26 3.73 3.14 0.00 -1.26 -5.06 105.19 109.52 1ok1 n GLY 224 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1ok1 n GLY 224 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ok1 s PHE 225 N -2.09 3.23 -0.14 1.61 0.40 -0.37 -4.70 117.98 115.92 1ok1 s PHE 225 Ca 0.00 0.21 -0.07 0.00 -0.60 0.00 0.00 56.93 56.47 1ok1 s PHE 225 Cb 0.00 -1.77 -0.04 0.00 0.51 0.00 0.00 43.02 41.72 1ok1 s PHE 225 CO 0.00 0.52 0.10 0.99 0.70 0.00 0.00 175.22 177.53 1ok1 s THR 226 N -1.02 5.17 0.11 0.64 2.01 -0.34 -4.72 115.64 117.49 1ok1 s THR 226 Ca 0.17 0.09 -0.27 0.00 0.31 0.00 0.00 61.69 61.99 1ok1 s THR 226 Cb -0.12 -3.28 -0.07 0.00 0.01 0.00 0.00 72.50 69.05 1ok1 s THR 226 CO 0.07 0.55 0.84 -0.32 -0.69 0.00 0.00 174.62 175.08 1ok1 s MET 227 N -0.49 4.61 -0.31 4.92 1.75 -1.26 -1.62 119.30 126.91 1ok1 s MET 227 Ca 0.11 1.25 -0.03 0.00 -1.25 0.00 0.00 55.69 55.77 1ok1 s MET 227 Cb -0.12 -3.33 0.11 0.00 2.84 0.00 0.00 34.83 34.33 1ok1 s MET 227 CO 0.02 0.36 0.15 0.42 -0.65 0.00 0.00 175.02 175.31 1ok1 s ILE 228 N -0.42 0.04 -5.00 10.11 1.01 -0.30 -5.00 121.20 121.64 1ok1 s ILE 228 Ca 0.41 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 60.04 1ok1 s ILE 228 Cb -0.23 -1.05 0.00 0.00 0.01 0.00 0.00 42.46 41.19 1ok1 s ILE 228 CO 0.27 -0.79 0.00 0.61 0.00 0.00 0.00 174.94 175.03 1ok1 n GLY 229 N 4.95 0.81 3.71 6.18 0.00 -1.26 -2.01 105.19 117.58 1ok1 n GLY 229 Ca -0.02 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 1ok1 n GLY 229 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ok1 s GLU 230 N -2.00 4.42 0.40 1.61 0.41 -1.26 -4.90 118.70 117.38 1ok1 s GLU 230 Ca 0.00 1.80 0.28 0.00 -0.41 0.00 0.00 54.97 56.64 1ok1 s GLU 230 Cb 0.00 -3.33 1.42 0.00 -1.78 0.00 0.00 34.13 30.44 1ok1 s GLU 230 CO 0.00 -0.27 1.84 1.25 -0.49 0.00 0.00 175.26 177.60 1ok1 h HIS 231 N 6.74 0.00 -2.33 1.61 2.76 -1.96 -3.34 115.15 118.63 1ok1 h HIS 231 Ca -0.42 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 1ok1 h HIS 231 Cb 1.21 0.00 -0.16 0.00 1.55 0.00 0.00 27.41 30.01 1ok1 h HIS 231 CO 0.67 0.00 0.30 -1.54 -1.30 0.00 0.00 177.93 176.06 1ok1 s SER 232 N -4.42 -0.53 0.16 3.26 1.04 -1.26 -1.01 113.70 110.94 1ok1 s SER 232 Ca -0.02 0.30 0.06 0.00 0.48 0.00 0.00 55.95 56.77 1ok1 s SER 232 Cb 0.08 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 1ok1 s SER 232 CO 0.30 -0.70 -0.14 0.27 0.98 0.00 0.00 173.24 173.95 1ok1 s ILE 233 N -2.41 1.47 0.19 -1.02 -4.36 -0.63 -4.97 121.20 109.48 1ok1 s ILE 233 Ca -0.03 -1.99 0.06 0.00 -0.26 0.00 0.00 60.65 58.43 1ok1 s ILE 233 Cb -0.01 -1.81 -0.05 0.00 1.25 0.00 0.00 42.46 41.85 1ok1 s ILE 233 CO -0.03 -0.55 -0.10 -0.72 0.24 0.00 0.00 174.94 173.79 1ok1 s TYR 234 N -2.71 1.53 -0.21 1.37 1.13 -1.26 -0.41 117.35 116.79 1ok1 s TYR 234 Ca 0.16 -0.72 -0.27 0.00 -1.41 0.00 0.00 57.07 54.83 1ok1 s TYR 234 Cb -0.02 -0.78 -0.00 0.00 -1.10 0.00 0.00 41.96 40.06 1ok1 s TYR 234 CO 0.04 0.17 0.95 0.00 -2.51 0.00 0.00 175.55 174.20 1ok1 s THR 236 N 2.80 5.04 -0.11 0.00 -4.23 0.22 -0.34 115.64 119.02 1ok1 s THR 236 Ca 0.41 -0.44 -0.01 0.00 -1.18 0.00 0.00 61.69 60.47 1ok1 s THR 236 Cb -0.16 -3.40 0.03 0.00 1.34 0.00 0.00 72.50 70.32 1ok1 s THR 236 CO 0.09 0.22 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.69 1ok1 s VAL 237 N -1.37 0.53 -0.00 2.29 1.01 -1.26 -0.51 120.40 121.08 1ok1 s VAL 237 Ca 0.29 -0.10 -0.00 0.00 0.00 0.00 0.00 61.98 62.17 1ok1 s VAL 237 Cb -0.12 -0.74 -0.00 0.00 0.00 0.00 0.00 36.38 35.52 1ok1 s VAL 237 CO 0.21 0.18 0.01 0.20 0.00 0.00 0.00 175.10 175.70 1ok1 s ASN 238 N 1.90 0.02 -1.70 3.32 -0.87 -0.47 -4.85 114.94 112.30 1ok1 s ASN 238 Ca 0.04 -0.04 -0.19 0.00 -1.57 0.00 0.00 52.86 51.10 1ok1 s ASN 238 Cb -0.13 0.03 0.16 0.00 -0.02 0.00 0.00 41.25 41.29 1ok1 s ASN 238 CO -0.06 -0.04 0.81 0.59 -2.57 0.00 0.00 177.10 175.83 1ok1 n ASN 239 N 2.88 -3.48 0.00 -1.22 3.02 -1.26 -0.91 115.26 114.29 1ok1 n ASN 239 Ca -0.14 -0.99 0.00 0.00 -0.03 0.00 0.00 54.58 53.42 1ok1 n ASN 239 Cb 0.59 -2.84 0.00 0.00 -0.61 0.00 0.00 39.78 36.92 1ok1 n ASN 239 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ok1 n ASP 240 N -2.66 -3.68 -4.34 6.41 8.00 -1.26 -5.00 116.55 114.02 1ok1 n ASP 240 Ca 0.08 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.26 1ok1 n ASP 240 Cb 0.49 -1.55 -0.15 0.00 -0.02 0.00 0.00 41.12 39.88 1ok1 n ASP 240 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1ok1 s GLU 241 N -0.71 2.53 0.36 -1.24 2.12 -0.09 -4.98 118.70 116.69 1ok1 s GLU 241 Ca 0.00 -0.84 -0.10 0.00 0.36 0.00 0.00 54.97 54.39 1ok1 s GLU 241 Cb 0.00 -2.23 -0.06 0.00 0.26 0.00 0.00 34.13 32.09 1ok1 s GLU 241 CO 0.00 0.46 0.71 0.20 -0.54 0.00 0.00 175.26 176.09 1ok1 s GLY 242 N -0.34 1.99 -0.28 -1.50 0.00 -1.26 -1.36 107.32 104.56 1ok1 s GLY 242 Ca 0.02 -0.26 -0.22 0.00 0.00 0.00 0.00 44.72 44.26 1ok1 s GLY 242 CO 0.02 -0.09 0.90 1.85 0.00 0.00 0.00 173.10 175.78 1ok1 s GLU 243 N -3.63 0.59 0.51 2.90 2.12 0.33 -4.69 118.70 116.83 1ok1 s GLU 243 Ca 0.50 0.79 -0.21 0.00 0.36 0.00 0.00 54.97 56.41 1ok1 s GLU 243 Cb -0.10 0.23 -0.06 0.00 0.26 0.00 0.00 34.13 34.46 1ok1 s GLU 243 CO 0.29 -0.09 1.20 -1.58 -0.54 0.00 0.00 175.26 174.55 1ok1 s TRP 244 N 0.69 2.65 0.50 5.30 0.52 -1.26 0.69 118.94 128.03 1ok1 s TRP 244 Ca -0.02 1.50 0.16 0.00 0.02 0.00 0.00 56.10 57.76 1ok1 s TRP 244 Cb -0.05 -3.46 1.21 0.00 -1.15 0.00 0.00 33.47 30.02 1ok1 s TRP 244 CO -0.08 -1.90 2.10 0.66 0.02 0.00 0.00 176.95 177.75 1ok1 h SER 245 N 1.60 0.09 -2.00 2.95 4.64 -0.65 -3.44 113.55 116.75 1ok1 h SER 245 Ca -0.50 -0.00 0.33 0.00 -0.47 0.00 0.00 61.79 61.15 1ok1 h SER 245 Cb 1.27 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 63.27 1ok1 h SER 245 CO 0.58 0.07 0.86 0.61 -0.87 0.00 0.00 176.83 178.08 1ok1 n GLY 246 N -1.54 0.22 3.75 -0.77 0.00 -1.26 -5.02 105.19 100.57 1ok1 n GLY 246 Ca 0.01 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 1ok1 n GLY 246 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ok1 s PRO 247 N -2.01 2.72 0.64 1.61 0.04 -1.26 -4.95 135.00 131.79 1ok1 s PRO 247 Ca 0.29 1.70 -0.14 0.00 0.04 0.00 0.00 61.00 62.89 1ok1 s PRO 247 Cb -0.01 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.61 1ok1 s PRO 247 CO -0.01 -1.37 1.06 -1.25 0.04 0.00 0.00 177.00 175.47 1ok1 s PRO 248 N -3.66 3.08 1.22 0.56 0.04 -1.26 -4.78 135.00 130.20 1ok1 s PRO 248 Ca 0.74 1.14 -0.18 0.00 0.04 0.00 0.00 61.00 62.74 1ok1 s PRO 248 Cb -0.27 -2.00 0.29 0.00 0.04 0.00 0.00 34.50 32.55 1ok1 s PRO 248 CO 0.38 -1.00 1.05 -1.25 0.04 0.00 0.00 177.00 176.22 1ok1 s PRO 249 N -4.44 -1.35 0.06 0.56 0.04 -1.25 -4.90 135.00 123.72 1ok1 s PRO 249 Ca 0.62 0.20 0.08 0.00 0.04 0.00 0.00 61.00 61.94 1ok1 s PRO 249 Cb -0.16 -1.56 -0.03 0.00 0.04 0.00 0.00 34.50 32.79 1ok1 s PRO 249 CO 0.44 -3.85 -0.22 -1.83 0.04 0.00 0.00 177.00 171.59 1ok1 s GLU 250 N -5.12 1.89 -0.39 4.56 -1.05 -0.85 -4.95 118.70 112.79 1ok1 s GLU 250 Ca 0.69 -1.08 -0.01 0.00 -0.15 0.00 0.00 54.97 54.43 1ok1 s GLU 250 Cb -0.14 -2.08 0.11 0.00 -0.44 0.00 0.00 34.13 31.57 1ok1 s GLU 250 CO 0.58 0.52 0.16 0.00 0.95 0.00 0.00 175.26 177.47 1ok1 s ARG 252 N 1.01 2.94 0.00 0.00 3.52 -0.64 -4.79 118.95 121.00 1ok1 s ARG 252 Ca 0.09 -0.47 0.00 0.00 -0.13 0.00 0.00 55.73 55.23 1ok1 s ARG 252 Cb -0.22 -2.72 0.00 0.00 -1.56 0.00 0.00 34.95 30.45 1ok1 s ARG 252 CO -0.05 0.65 0.00 0.41 -0.81 0.00 0.00 175.30 175.50 1ok1 n GLY 253 N 2.28 3.19 3.58 8.12 0.00 -1.26 -1.20 105.19 119.90 1ok1 n GLY 253 Ca -0.18 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.74 1ok1 n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32