#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d53 h ILE 3 N 0.00 1.16 -0.21 1.97 2.04 -1.96 -1.27 117.51 119.24 3d53 h ILE 3 Ca 0.00 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.44 3d53 h ILE 3 Cb 0.00 -0.18 0.00 0.00 -0.74 0.00 0.00 36.82 35.90 3d53 h ILE 3 CO 0.00 0.22 0.00 0.29 0.00 0.00 0.00 178.15 178.66 3d53 n LYS 4 N -4.44 1.75 0.00 2.37 5.02 -1.26 -3.38 118.16 118.21 3d53 n LYS 4 Ca 0.13 -0.88 0.00 0.00 -2.02 0.00 0.00 58.31 55.55 3d53 n LYS 4 Cb 0.11 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 3d53 n LYS 4 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3d53 n LYS 5 N 0.18 5.62 -3.40 1.97 4.01 -0.50 -5.02 118.16 121.02 3d53 n LYS 5 Ca 0.08 -0.05 -0.38 0.00 -0.51 0.00 0.00 58.31 57.45 3d53 n LYS 5 Cb 0.30 -0.51 -0.06 0.00 -0.51 0.00 0.00 35.03 34.25 3d53 n LYS 5 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3d53 s ILE 6 N -0.82 5.10 0.40 -0.18 1.01 -1.11 -5.07 121.20 120.54 3d53 s ILE 6 Ca 0.00 0.89 -0.24 0.00 0.00 0.00 0.00 60.65 61.30 3d53 s ILE 6 Cb 0.00 -3.76 -0.09 0.00 0.01 0.00 0.00 42.46 38.61 3d53 s ILE 6 CO 0.00 0.45 1.03 -0.54 0.00 0.00 0.00 174.94 175.88 3d53 s LYS 7 N -0.17 4.17 0.24 2.79 1.02 -1.26 -4.47 119.74 122.06 3d53 s LYS 7 Ca 0.24 1.46 -0.07 0.00 0.02 0.00 0.00 55.97 57.62 3d53 s LYS 7 Cb -0.16 -2.50 0.22 0.00 -0.52 0.00 0.00 37.83 34.87 3d53 s LYS 7 CO 0.11 -0.13 1.89 0.00 -0.92 0.00 0.00 175.35 176.31 3d53 h ALA 8 N 2.43 1.17 -3.60 5.17 0.00 -1.86 -3.40 119.26 119.18 3d53 h ALA 8 Ca -0.48 -0.09 -0.35 0.00 0.00 0.00 0.00 54.91 53.99 3d53 h ALA 8 Cb 1.21 -0.37 -0.32 0.00 0.00 0.00 0.00 17.79 18.31 3d53 h ALA 8 CO 0.62 0.61 -0.75 0.15 0.00 0.00 0.00 179.25 179.88 3d53 s LYS 9 N -6.02 0.43 -0.04 0.00 1.02 -1.26 -0.79 119.74 113.07 3d53 s LYS 9 Ca -0.13 -0.03 -0.15 0.00 0.02 0.00 0.00 55.97 55.68 3d53 s LYS 9 Cb 0.17 -0.51 -0.31 0.00 -0.52 0.00 0.00 37.83 36.66 3d53 s LYS 9 CO 0.82 -0.06 0.76 0.00 -0.92 0.00 0.00 175.35 175.95 3d53 h ALA 10 N 6.87 0.03 -4.10 5.17 0.00 -1.85 -3.49 119.26 121.90 3d53 h ALA 10 Ca -0.37 -0.98 -0.29 0.00 0.00 0.00 0.00 54.91 53.26 3d53 h ALA 10 Cb 1.16 0.33 -0.08 0.00 0.00 0.00 0.00 17.79 19.20 3d53 h ALA 10 CO 0.49 0.77 -0.26 0.27 0.00 0.00 0.00 179.25 180.52 3d53 n ASN 11 N -3.80 -0.67 -0.27 0.00 6.94 -1.26 -5.03 115.26 111.17 3d53 n ASN 11 Ca -0.21 -2.50 0.17 0.00 -0.02 0.00 0.00 54.58 52.02 3d53 n ASN 11 Cb 1.00 1.41 0.45 0.00 -2.36 0.00 0.00 39.78 40.28 3d53 n ASN 11 CO 0.00 0.00 0.00 -1.13 -1.03 0.00 0.00 177.26 175.10 3d53 h ASN 12 N 1.45 0.52 -0.39 0.53 -0.73 -2.04 -2.76 115.58 112.16 3d53 h ASN 12 Ca -0.18 0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.04 3d53 h ASN 12 Cb 0.86 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.40 3d53 h ASN 12 CO 0.25 0.22 0.00 -3.20 -0.37 0.00 0.00 177.43 174.33 3d53 n ASN 13 N -4.56 3.39 -3.99 1.15 2.85 -1.26 -4.97 115.26 107.87 3d53 n ASN 13 Ca 0.20 -1.98 -0.16 0.00 -0.11 0.00 0.00 54.58 52.52 3d53 n ASN 13 Cb 0.63 -0.25 -0.14 0.00 1.24 0.00 0.00 39.78 41.26 3d53 n ASN 13 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 3d53 s GLU 14 N -1.49 0.50 0.03 1.20 -6.30 -1.04 -4.48 118.70 107.12 3d53 s GLU 14 Ca 0.39 -0.31 0.09 0.00 -2.50 0.00 0.00 54.97 52.63 3d53 s GLU 14 Cb 0.23 -0.45 -0.03 0.00 0.00 0.00 0.00 34.13 33.88 3d53 s GLU 14 CO 0.32 0.12 -0.25 0.96 0.02 0.00 0.00 175.26 176.43 3d53 s ILE 15 N -0.35 1.99 -0.19 -3.70 -4.36 0.13 -3.69 121.20 111.02 3d53 s ILE 15 Ca 0.00 -1.28 -0.17 0.00 -0.26 0.00 0.00 60.65 58.94 3d53 s ILE 15 Cb -0.04 -1.70 -0.04 0.00 1.25 0.00 0.00 42.46 41.94 3d53 s ILE 15 CO -0.00 0.36 0.45 0.20 0.24 0.00 0.00 174.94 176.18 3d53 s ASN 16 N -1.11 6.51 -0.21 4.36 0.01 0.03 -0.45 114.94 124.07 3d53 s ASN 16 Ca 0.10 0.60 0.01 0.00 -0.71 0.00 0.00 52.86 52.87 3d53 s ASN 16 Cb -0.10 -2.26 0.04 0.00 0.41 0.00 0.00 41.25 39.35 3d53 s ASN 16 CO 0.01 -0.10 -0.13 -0.69 -1.51 0.00 0.00 177.10 174.68 3d53 s VAL 17 N 1.33 1.91 -0.23 1.60 1.01 -0.54 -4.02 120.40 121.46 3d53 s VAL 17 Ca 0.21 -1.15 -0.26 0.00 0.00 0.00 0.00 61.98 60.78 3d53 s VAL 17 Cb -0.15 -1.91 -0.00 0.00 0.00 0.00 0.00 36.38 34.32 3d53 s VAL 17 CO 0.09 0.23 0.90 -0.63 0.00 0.00 0.00 175.10 175.69 3d53 s ILE 18 N 1.29 4.78 -0.07 2.22 1.01 0.08 -0.96 121.20 129.55 3d53 s ILE 18 Ca -0.01 1.73 -0.29 0.00 0.00 0.00 0.00 60.65 62.08 3d53 s ILE 18 Cb -0.16 -4.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.10 3d53 s ILE 18 CO -0.09 -0.10 0.95 -0.63 0.00 0.00 0.00 174.94 175.07 3d53 s ILE 19 N 2.93 4.84 -0.26 2.92 -1.09 -0.31 -1.65 121.20 128.59 3d53 s ILE 19 Ca 0.38 1.96 -0.05 0.00 -2.23 0.00 0.00 60.65 60.72 3d53 s ILE 19 Cb -0.15 -4.28 -0.16 0.00 -1.58 0.00 0.00 42.46 36.29 3d53 s ILE 19 CO 0.07 0.08 -0.22 -0.62 -1.23 0.00 0.00 174.94 173.03 3d53 n GLU 20 N 4.55 0.64 -3.92 2.79 1.02 0.11 0.16 120.64 125.98 3d53 n GLU 20 Ca 0.07 0.21 -0.28 0.00 -0.02 0.00 0.00 57.16 57.13 3d53 n GLU 20 Cb 0.50 -1.53 -0.16 0.00 -0.02 0.00 0.00 31.44 30.22 3d53 n GLU 20 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3d53 s ILE 21 N -2.51 1.19 0.51 -3.67 1.01 -0.12 -4.47 121.20 113.14 3d53 s ILE 21 Ca -0.35 -0.60 -0.20 0.00 0.00 0.00 0.00 60.65 59.50 3d53 s ILE 21 Cb 0.11 -1.30 -0.07 0.00 0.01 0.00 0.00 42.46 41.20 3d53 s ILE 21 CO 0.58 0.21 1.08 -2.84 0.00 0.00 0.00 174.94 173.97 3d53 s PRO 22 N 1.61 3.59 0.49 2.79 0.02 -1.26 -0.04 135.00 142.21 3d53 s PRO 22 Ca 0.02 1.49 -0.24 0.00 0.02 0.00 0.00 61.00 62.29 3d53 s PRO 22 Cb -0.15 -2.06 -0.07 0.00 0.02 0.00 0.00 34.50 32.25 3d53 s PRO 22 CO -0.08 -0.63 1.37 0.00 -0.33 0.00 0.00 177.00 177.34 3d53 s MET 23 N -3.24 3.45 -1.53 5.54 0.23 -1.22 -3.44 119.30 119.09 3d53 s MET 23 Ca 0.70 2.28 -0.07 0.00 -1.03 0.00 0.00 55.69 57.57 3d53 s MET 23 Cb -0.20 -2.46 0.06 0.00 -1.53 0.00 0.00 34.83 30.70 3d53 s MET 23 CO 0.24 -0.96 0.54 0.09 -2.03 0.00 0.00 175.02 172.90 3d53 n ASN 24 N -0.58 -1.46 -1.16 -1.18 3.02 0.17 -4.59 115.26 109.48 3d53 n ASN 24 Ca 0.08 -1.02 -0.04 0.00 -0.03 0.00 0.00 54.58 53.56 3d53 n ASN 24 Cb 0.44 -2.88 0.19 0.00 -0.61 0.00 0.00 39.78 36.92 3d53 n ASN 24 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3d53 n SER 25 N -2.86 2.48 0.00 6.41 3.41 -1.22 -4.98 113.62 116.87 3d53 n SER 25 Ca -0.16 -3.81 0.00 0.00 -0.26 0.00 0.00 58.87 54.64 3d53 n SER 25 Cb 0.61 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 3d53 n SER 25 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d53 n GLY 26 N -1.12 -1.61 0.14 5.00 0.00 -1.26 -4.48 105.19 101.86 3d53 n GLY 26 Ca 0.33 -1.47 0.13 0.00 0.00 0.00 0.00 46.02 45.01 3d53 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d53 h PRO 27 N 0.00 0.00 -6.16 1.61 0.13 -1.89 -3.41 132.00 122.28 3d53 h PRO 27 Ca 0.00 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.56 3d53 h PRO 27 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 3d53 h PRO 27 CO 0.00 0.00 0.85 0.42 -0.23 0.00 0.00 178.00 179.04 3d53 s ILE 28 N -3.16 4.38 -0.35 -3.56 -1.09 -1.26 -1.33 121.20 114.83 3d53 s ILE 28 Ca 0.09 1.67 -0.11 0.00 -2.23 0.00 0.00 60.65 60.07 3d53 s ILE 28 Cb 0.10 -4.08 0.01 0.00 -1.58 0.00 0.00 42.46 36.92 3d53 s ILE 28 CO 0.59 -0.12 0.20 -0.75 -1.23 0.00 0.00 174.94 173.63 3d53 s LYS 29 N 3.23 3.06 0.12 2.79 2.20 -0.51 -4.96 119.74 125.68 3d53 s LYS 29 Ca 0.52 -0.92 0.02 0.00 -0.36 0.00 0.00 55.97 55.23 3d53 s LYS 29 Cb -0.21 -3.70 -0.04 0.00 -1.51 0.00 0.00 37.83 32.38 3d53 s LYS 29 CO 0.14 -0.59 0.25 0.71 -0.36 0.00 0.00 175.35 175.50 3d53 s TYR 30 N 1.60 3.49 -0.08 4.03 2.02 -1.26 -0.52 117.35 126.63 3d53 s TYR 30 Ca 0.03 0.16 -0.05 0.00 -0.37 0.00 0.00 57.07 56.84 3d53 s TYR 30 Cb -0.18 -1.70 0.03 0.00 -0.40 0.00 0.00 41.96 39.71 3d53 s TYR 30 CO 0.07 0.54 0.19 -2.00 -1.57 0.00 0.00 175.55 172.79 3d53 s GLU 31 N -2.96 0.19 0.15 -0.62 2.12 0.52 -4.68 118.70 113.42 3d53 s GLU 31 Ca 0.35 0.34 -0.30 0.00 0.36 0.00 0.00 54.97 55.72 3d53 s GLU 31 Cb -0.12 -0.00 -0.08 0.00 0.26 0.00 0.00 34.13 34.19 3d53 s GLU 31 CO 0.28 -0.09 1.24 -0.06 -0.54 0.00 0.00 175.26 176.09 3d53 s PHE 32 N 0.58 3.38 -0.34 5.30 0.08 -1.26 -0.25 117.98 125.48 3d53 s PHE 32 Ca -0.04 1.31 -0.22 0.00 0.12 0.00 0.00 56.93 58.11 3d53 s PHE 32 Cb -0.05 -3.48 0.00 0.00 -0.57 0.00 0.00 43.02 38.92 3d53 s PHE 32 CO -0.03 -1.45 0.70 0.34 -0.10 0.00 0.00 175.22 174.68 3d53 s ASP 33 N 0.47 6.52 0.39 1.36 3.68 0.26 -4.92 116.67 124.43 3d53 s ASP 33 Ca 0.56 0.35 0.21 0.00 2.13 0.00 0.00 52.55 55.80 3d53 s ASP 33 Cb -0.33 -2.36 0.59 0.00 -1.45 0.00 0.00 42.92 39.37 3d53 s ASP 33 CO 0.34 -0.61 1.68 0.11 0.13 0.00 0.00 175.17 176.83 3d53 h LYS 34 N 8.35 0.00 -0.88 4.34 6.56 -1.95 0.42 116.57 133.41 3d53 h LYS 34 Ca -0.26 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.31 3d53 h LYS 34 Cb 1.10 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.72 3d53 h LYS 34 CO 0.86 0.29 0.46 1.49 -2.06 0.00 0.00 179.45 180.49 3d53 h GLU 35 N 0.00 1.23 0.00 3.15 4.81 -1.97 -3.35 114.58 118.46 3d53 h GLU 35 Ca -0.00 -0.16 -0.09 0.00 -0.13 0.00 0.00 59.36 58.98 3d53 h GLU 35 Cb 0.97 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 30.10 3d53 h GLU 35 CO 0.04 0.92 -1.64 -1.13 -0.73 0.00 0.00 179.01 176.47 3d53 n SER 36 N -4.33 2.28 0.00 1.04 3.41 -1.14 -5.01 113.62 109.86 3d53 n SER 36 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 3d53 n SER 36 Cb 0.11 1.20 0.00 0.00 -0.26 0.00 0.00 64.21 65.26 3d53 n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d53 n GLY 37 N 2.04 0.78 3.86 5.00 0.00 0.15 -5.05 105.19 111.97 3d53 n GLY 37 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 3d53 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d53 s ALA 38 N -2.90 3.31 -0.40 4.61 0.00 -1.23 -4.82 121.76 120.34 3d53 s ALA 38 Ca 0.00 -0.06 -0.20 0.00 0.00 0.00 0.00 51.96 51.70 3d53 s ALA 38 Cb 0.00 -2.77 0.01 0.00 0.00 0.00 0.00 23.12 20.36 3d53 s ALA 38 CO 0.00 0.13 0.62 -1.17 0.00 0.00 0.00 175.76 175.34 3d53 s LEU 39 N -3.47 4.39 -0.02 0.00 2.96 -1.26 -0.57 118.68 120.72 3d53 s LEU 39 Ca 0.53 -0.13 -0.04 0.00 -0.22 0.00 0.00 54.13 54.27 3d53 s LEU 39 Cb -0.10 -2.73 -0.04 0.00 0.50 0.00 0.00 46.19 43.82 3d53 s LEU 39 CO 0.25 -0.67 0.20 -0.36 -1.32 0.00 0.00 176.35 174.44 3d53 s PHE 40 N 2.72 3.56 -0.12 5.38 0.40 0.65 -4.93 117.98 125.65 3d53 s PHE 40 Ca 0.23 0.43 -0.29 0.00 -0.60 0.00 0.00 56.93 56.69 3d53 s PHE 40 Cb -0.14 -1.88 -0.03 0.00 0.51 0.00 0.00 43.02 41.48 3d53 s PHE 40 CO 0.17 0.65 1.33 0.08 0.70 0.00 0.00 175.22 178.14 3d53 s VAL 41 N -1.29 4.11 -0.06 -0.44 1.01 -1.26 -0.36 120.40 122.11 3d53 s VAL 41 Ca 0.26 1.37 0.06 0.00 0.00 0.00 0.00 61.98 63.68 3d53 s VAL 41 Cb -0.13 -3.89 -0.24 0.00 0.00 0.00 0.00 36.38 32.13 3d53 s VAL 41 CO 0.17 -0.10 0.60 -0.78 0.00 0.00 0.00 175.10 174.99 3d53 h ASP 42 N 8.29 0.14 -2.99 3.32 3.58 -1.12 -3.47 116.42 124.17 3d53 h ASP 42 Ca -0.30 -0.30 0.08 0.00 0.42 0.00 0.00 57.03 56.93 3d53 h ASP 42 Cb 1.13 -0.05 -0.27 0.00 1.72 0.00 0.00 39.33 41.86 3d53 h ASP 42 CO 0.95 1.27 0.52 -0.60 -2.88 0.00 0.00 179.24 178.50 3d53 s ARG 43 N -2.59 0.43 -0.53 0.28 3.52 -1.14 -5.03 118.95 113.88 3d53 s ARG 43 Ca -0.10 0.52 -0.19 0.00 -0.13 0.00 0.00 55.73 55.84 3d53 s ARG 43 Cb 0.08 0.20 0.08 0.00 -1.56 0.00 0.00 34.95 33.74 3d53 s ARG 43 CO 0.81 -0.05 0.63 -0.06 -0.81 0.00 0.00 175.30 175.82 3d53 s PHE 44 N 0.27 3.05 0.53 5.12 0.08 -1.26 -1.42 117.98 124.35 3d53 s PHE 44 Ca 0.03 -0.74 -0.22 0.00 0.12 0.00 0.00 56.93 56.12 3d53 s PHE 44 Cb -0.05 -3.68 -0.05 0.00 -0.57 0.00 0.00 43.02 38.67 3d53 s PHE 44 CO -0.08 -1.10 1.35 -1.64 -0.10 0.00 0.00 175.22 173.64 3d53 s MET 45 N 2.54 3.27 0.00 0.44 -1.94 -0.44 -4.95 119.30 118.22 3d53 s MET 45 Ca 0.13 2.22 0.17 0.00 -1.71 0.00 0.00 55.69 56.49 3d53 s MET 45 Cb -0.22 -2.32 -0.04 0.00 2.01 0.00 0.00 34.83 34.26 3d53 s MET 45 CO 0.09 -1.08 0.86 1.04 -0.01 0.00 0.00 175.02 175.92 3d53 n GLN 46 N -0.87 1.61 -2.11 2.03 1.13 -1.26 -4.86 117.38 113.06 3d53 n GLN 46 Ca 0.09 -0.69 -0.23 0.00 -1.94 0.00 0.00 57.00 54.23 3d53 n GLN 46 Cb 0.45 -1.30 0.14 0.00 0.11 0.00 0.00 30.24 29.64 3d53 n GLN 46 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3d53 n THR 47 N -0.33 0.00 1.00 5.09 -2.24 -1.26 -4.99 114.28 111.55 3d53 n THR 47 Ca 0.06 -1.21 0.10 0.00 -2.27 0.00 0.00 64.05 60.74 3d53 n THR 47 Cb 0.34 -1.18 0.32 0.00 -2.10 0.00 0.00 70.33 67.71 3d53 n THR 47 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3d53 n THR 48 N -3.08 0.30 -2.75 4.28 -2.24 -1.26 -4.96 114.28 104.57 3d53 n THR 48 Ca 0.15 -0.44 -0.33 0.00 -2.27 0.00 0.00 64.05 61.16 3d53 n THR 48 Cb 0.53 0.47 -0.06 0.00 -2.10 0.00 0.00 70.33 69.17 3d53 n THR 48 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3d53 s MET 49 N -1.70 4.12 0.10 -0.78 -1.94 -1.26 -5.02 119.30 112.82 3d53 s MET 49 Ca 0.33 1.01 -0.01 0.00 -1.71 0.00 0.00 55.69 55.31 3d53 s MET 49 Cb 0.18 -2.20 -0.04 0.00 2.01 0.00 0.00 34.83 34.78 3d53 s MET 49 CO 0.26 -0.07 0.01 -1.54 -0.01 0.00 0.00 175.02 173.67 3d53 s SER 50 N -2.44 0.53 0.32 3.03 1.04 -1.26 -4.58 113.70 110.33 3d53 s SER 50 Ca 0.60 -1.11 -0.29 0.00 0.48 0.00 0.00 55.95 55.63 3d53 s SER 50 Cb -0.09 0.23 -0.11 0.00 0.10 0.00 0.00 66.02 66.14 3d53 s SER 50 CO 0.19 -0.64 1.57 -0.31 0.98 0.00 0.00 173.24 175.02 3d53 s TYR 51 N -3.93 2.69 -1.08 5.02 1.51 -1.26 -4.65 117.35 115.64 3d53 s TYR 51 Ca 0.16 0.88 0.27 0.00 -1.01 0.00 0.00 57.07 57.38 3d53 s TYR 51 Cb 0.07 -4.07 0.91 0.00 -0.11 0.00 0.00 41.96 38.76 3d53 s TYR 51 CO -0.03 -3.47 1.69 -0.35 -1.11 0.00 0.00 175.55 172.28 3d53 n PRO 52 N 1.65 0.09 -4.20 -1.71 -0.04 -1.26 0.42 135.00 129.96 3d53 n PRO 52 Ca 0.06 -0.03 -0.12 0.00 -0.04 0.00 0.00 63.50 63.37 3d53 n PRO 52 Cb 0.38 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.24 3d53 n PRO 52 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d53 s ASN 54 N -3.10 6.70 -0.08 0.00 0.01 -0.93 -3.42 114.94 114.13 3d53 s ASN 54 Ca 0.21 2.33 0.04 0.00 -0.71 0.00 0.00 52.86 54.73 3d53 s ASN 54 Cb 0.07 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.15 3d53 s ASN 54 CO 0.01 -0.82 -0.21 -0.47 -1.51 0.00 0.00 177.10 174.11 3d53 s TYR 55 N 2.58 2.58 0.00 2.20 5.04 0.94 0.14 117.35 130.83 3d53 s TYR 55 Ca 0.70 -0.67 0.00 0.00 -2.44 0.00 0.00 57.07 54.66 3d53 s TYR 55 Cb -0.36 -1.67 0.00 0.00 0.35 0.00 0.00 41.96 40.28 3d53 s TYR 55 CO 0.30 -0.19 0.00 0.41 -1.34 0.00 0.00 175.55 174.73 3d53 n GLY 56 N 3.06 1.96 3.16 8.97 0.00 -0.63 0.05 105.19 121.76 3d53 n GLY 56 Ca -0.18 -0.32 -0.08 0.00 0.00 0.00 0.00 46.02 45.44 3d53 n GLY 56 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3d53 s PHE 57 N -0.92 0.48 -0.31 1.61 -0.12 -0.66 -0.62 117.98 117.44 3d53 s PHE 57 Ca 0.00 -0.94 -0.22 0.00 -0.05 0.00 0.00 56.93 55.72 3d53 s PHE 57 Cb 0.00 -0.28 -0.00 0.00 -0.63 0.00 0.00 43.02 42.10 3d53 s PHE 57 CO 0.00 -0.49 0.72 0.42 -0.05 0.00 0.00 175.22 175.82 3d53 s ILE 58 N -3.94 4.85 0.74 -4.49 1.01 -0.44 -0.74 121.20 118.19 3d53 s ILE 58 Ca 0.11 0.99 -0.14 0.00 0.00 0.00 0.00 60.65 61.62 3d53 s ILE 58 Cb 0.07 -4.09 0.05 0.00 0.01 0.00 0.00 42.46 38.49 3d53 s ILE 58 CO -0.07 -0.23 1.16 -2.16 0.00 0.00 0.00 174.94 173.64 3d53 s PRO 59 N 2.83 2.18 -1.32 2.79 0.04 -1.26 -3.50 135.00 136.76 3d53 s PRO 59 Ca 0.29 1.56 -0.02 0.00 0.04 0.00 0.00 61.00 62.86 3d53 s PRO 59 Cb -0.14 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.54 3d53 s PRO 59 CO 0.13 -1.76 0.31 -3.47 0.04 0.00 0.00 177.00 172.25 3d53 n ASP 60 N -2.94 -5.14 -4.28 6.66 2.03 -1.26 -3.32 116.55 108.30 3d53 n ASP 60 Ca 0.12 -0.15 -0.20 0.00 0.52 0.00 0.00 54.79 55.08 3d53 n ASP 60 Cb 0.51 -4.08 -0.11 0.00 -0.72 0.00 0.00 41.12 36.72 3d53 n ASP 60 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 3d53 s THR 61 N -2.97 1.55 -0.12 5.18 -4.23 -1.23 -4.51 115.64 109.31 3d53 s THR 61 Ca 0.15 -1.74 -0.03 0.00 -1.18 0.00 0.00 61.69 58.89 3d53 s THR 61 Cb -0.07 -1.63 0.05 0.00 1.34 0.00 0.00 72.50 72.19 3d53 s THR 61 CO 0.19 -0.32 0.06 -0.22 -0.54 0.00 0.00 174.62 173.79 3d53 s LEU 62 N -2.42 0.48 0.96 4.79 2.96 0.34 -3.88 118.68 121.92 3d53 s LEU 62 Ca 0.10 -0.36 -0.15 0.00 -0.22 0.00 0.00 54.13 53.50 3d53 s LEU 62 Cb -0.06 -0.31 0.18 0.00 0.50 0.00 0.00 46.19 46.50 3d53 s LEU 62 CO 0.04 -0.28 1.25 -0.44 -1.32 0.00 0.00 176.35 175.60 3d53 s SER 63 N 2.07 3.13 0.45 3.68 0.01 0.13 -4.12 113.70 119.04 3d53 s SER 63 Ca 0.03 0.48 0.12 0.00 1.31 0.00 0.00 55.95 57.89 3d53 s SER 63 Cb -0.14 -0.69 1.02 0.00 0.21 0.00 0.00 66.02 66.42 3d53 s SER 63 CO -0.06 -2.74 2.05 0.78 0.41 0.00 0.00 173.24 173.67 3d53 h ASN 64 N -1.64 0.32 -0.31 2.44 2.35 -1.98 -2.86 115.58 113.89 3d53 h ASN 64 Ca -0.45 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 3d53 h ASN 64 Cb 1.27 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.57 3d53 h ASN 64 CO 0.45 0.22 0.00 -0.90 -1.65 0.00 0.00 177.43 175.55 3d53 n ASP 65 N -4.48 2.06 0.00 5.81 5.75 -1.26 -4.93 116.55 119.49 3d53 n ASP 65 Ca 0.04 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 52.94 3d53 n ASP 65 Cb 0.19 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 3d53 n ASP 65 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d53 n GLY 66 N 1.16 1.17 3.94 6.12 0.00 -1.08 -5.06 105.19 111.45 3d53 n GLY 66 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 3d53 n GLY 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3d53 s ASP 67 N -2.80 6.32 0.85 1.61 1.01 -1.26 -4.78 116.67 117.62 3d53 s ASP 67 Ca 0.00 0.37 -0.12 0.00 0.71 0.00 0.00 52.55 53.51 3d53 s ASP 67 Cb 0.00 -2.00 0.11 0.00 1.01 0.00 0.00 42.92 42.05 3d53 s ASP 67 CO 0.00 -0.20 1.17 -2.16 0.21 0.00 0.00 175.17 174.20 3d53 s PRO 68 N -4.04 1.37 0.05 8.23 0.04 -1.25 0.18 135.00 139.57 3d53 s PRO 68 Ca 0.39 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 62.76 3d53 s PRO 68 Cb -0.10 -1.76 -0.08 0.00 0.04 0.00 0.00 34.50 32.61 3d53 s PRO 68 CO 0.33 -2.39 1.63 0.08 0.04 0.00 0.00 177.00 176.69 3d53 s VAL 69 N -2.40 3.18 0.15 -0.36 1.01 -1.26 -4.68 120.40 116.03 3d53 s VAL 69 Ca 0.70 0.57 -0.17 0.00 0.00 0.00 0.00 61.98 63.08 3d53 s VAL 69 Cb -0.26 -3.37 -0.07 0.00 0.00 0.00 0.00 36.38 32.69 3d53 s VAL 69 CO 0.54 -0.01 0.61 -1.81 0.00 0.00 0.00 175.10 174.43 3d53 s ASP 70 N 2.50 6.96 -0.02 3.32 1.01 -1.26 -1.33 116.67 127.86 3d53 s ASP 70 Ca 0.73 1.23 0.02 0.00 0.71 0.00 0.00 52.55 55.23 3d53 s ASP 70 Cb -0.38 -2.35 0.00 0.00 1.01 0.00 0.00 42.92 41.21 3d53 s ASP 70 CO 0.31 0.13 -0.05 -0.69 0.21 0.00 0.00 175.17 175.08 3d53 s VAL 71 N -1.38 0.49 -0.37 -1.27 1.01 0.21 -0.75 120.40 118.34 3d53 s VAL 71 Ca 0.37 -0.21 -0.12 0.00 0.00 0.00 0.00 61.98 62.02 3d53 s VAL 71 Cb -0.17 -0.45 0.01 0.00 0.00 0.00 0.00 36.38 35.78 3d53 s VAL 71 CO 0.20 0.16 0.22 -0.76 0.00 0.00 0.00 175.10 174.92 3d53 s LEU 72 N 0.18 4.67 -0.45 3.92 1.43 0.83 -1.60 118.68 127.67 3d53 s LEU 72 Ca -0.02 -0.81 -0.22 0.00 -1.03 0.00 0.00 54.13 52.05 3d53 s LEU 72 Cb -0.06 -2.07 0.03 0.00 0.03 0.00 0.00 46.19 44.12 3d53 s LEU 72 CO -0.00 -0.34 0.70 -0.69 0.23 0.00 0.00 176.35 176.24 3d53 s VAL 73 N 1.62 4.75 0.11 -1.59 1.01 0.12 -1.54 120.40 124.88 3d53 s VAL 73 Ca 0.04 0.22 -0.31 0.00 0.00 0.00 0.00 61.98 61.92 3d53 s VAL 73 Cb -0.18 -4.26 -0.09 0.00 0.00 0.00 0.00 36.38 31.85 3d53 s VAL 73 CO 0.08 -0.66 1.55 -0.69 0.00 0.00 0.00 175.10 175.38 3d53 s VAL 74 N 3.01 2.97 0.24 2.92 1.01 0.05 -2.18 120.40 128.41 3d53 s VAL 74 Ca 0.25 0.59 -0.13 0.00 0.00 0.00 0.00 61.98 62.70 3d53 s VAL 74 Cb -0.13 -3.38 -0.00 0.00 0.00 0.00 0.00 36.38 32.86 3d53 s VAL 74 CO 0.20 0.03 0.46 0.00 0.00 0.00 0.00 175.10 175.79 3d53 s ALA 75 N 1.75 -0.28 -0.79 5.51 0.00 -1.26 -4.04 121.76 122.66 3d53 s ALA 75 Ca 0.70 -0.82 0.24 0.00 0.00 0.00 0.00 51.96 52.07 3d53 s ALA 75 Cb -0.40 1.03 0.24 0.00 0.00 0.00 0.00 23.12 23.99 3d53 s ALA 75 CO 0.31 -0.83 1.20 0.72 0.00 0.00 0.00 175.76 177.16 3d53 n HIS 76 N -0.36 0.20 -3.84 0.00 8.25 -1.26 -4.96 115.22 113.25 3d53 n HIS 76 Ca -0.03 0.06 -0.11 0.00 -0.26 0.00 0.00 57.72 57.38 3d53 n HIS 76 Cb 0.62 -0.37 -0.09 0.00 1.12 0.00 0.00 29.99 31.27 3d53 n HIS 76 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3d53 s HIS 77 N -3.11 0.03 0.91 4.41 3.76 -1.26 -5.17 115.29 114.86 3d53 s HIS 77 Ca 0.07 -0.20 -0.12 0.00 -0.15 0.00 0.00 55.06 54.66 3d53 s HIS 77 Cb 0.15 -0.02 0.13 0.00 1.11 0.00 0.00 32.58 33.96 3d53 s HIS 77 CO 0.76 -0.40 1.10 -1.25 -0.85 0.00 0.00 174.74 174.09 3d53 s PRO 78 N -2.26 1.18 0.02 8.40 0.04 -1.26 -4.85 135.00 136.27 3d53 s PRO 78 Ca -0.07 0.67 -0.00 0.00 0.04 0.00 0.00 61.00 61.64 3d53 s PRO 78 Cb -0.03 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.69 3d53 s PRO 78 CO -0.02 -2.25 -0.02 0.08 0.04 0.00 0.00 177.00 174.82 3d53 s VAL 79 N -3.01 0.09 0.41 -0.36 1.01 -1.26 -5.00 120.40 112.29 3d53 s VAL 79 Ca 0.63 -0.76 -0.26 0.00 0.00 0.00 0.00 61.98 61.60 3d53 s VAL 79 Cb -0.17 -0.22 -0.09 0.00 0.00 0.00 0.00 36.38 35.90 3d53 s VAL 79 CO 0.56 -0.42 1.37 0.68 0.00 0.00 0.00 175.10 177.30 3d53 s VAL 80 N -1.21 2.35 0.34 2.92 -7.23 -1.26 -4.48 120.40 111.82 3d53 s VAL 80 Ca -0.13 0.32 -0.28 0.00 -1.81 0.00 0.00 61.98 60.07 3d53 s VAL 80 Cb -0.08 -3.19 -0.12 0.00 0.56 0.00 0.00 36.38 33.54 3d53 s VAL 80 CO -0.01 0.05 1.31 -2.65 -0.31 0.00 0.00 175.10 173.50 3d53 n PRO 81 N 0.09 2.17 -0.09 4.82 -0.02 -1.26 -2.32 135.00 138.38 3d53 n PRO 81 Ca 0.04 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3d53 n PRO 81 Cb 0.42 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 3d53 n PRO 81 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d53 n GLY 82 N 0.84 1.31 3.87 -1.23 0.00 0.12 -5.01 105.19 105.10 3d53 n GLY 82 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 3d53 n GLY 82 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d53 s SER 83 N -2.97 6.54 -0.18 1.61 1.04 -0.98 -4.78 113.70 113.98 3d53 s SER 83 Ca 0.00 1.11 -0.04 0.00 0.48 0.00 0.00 55.95 57.49 3d53 s SER 83 Cb 0.00 -2.31 -0.03 0.00 0.10 0.00 0.00 66.02 63.78 3d53 s SER 83 CO 0.00 -0.35 -0.02 -0.69 0.98 0.00 0.00 173.24 173.16 3d53 s VAL 84 N -2.29 3.95 -0.18 5.02 1.01 -1.26 -1.16 120.40 125.49 3d53 s VAL 84 Ca 0.51 -0.33 -0.07 0.00 0.00 0.00 0.00 61.98 62.09 3d53 s VAL 84 Cb -0.10 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 3d53 s VAL 84 CO 0.29 0.46 0.06 -0.63 0.00 0.00 0.00 175.10 175.28 3d53 s ILE 85 N 0.69 4.76 -0.24 2.22 1.01 -0.14 -4.93 121.20 124.57 3d53 s ILE 85 Ca -0.01 -0.04 -0.22 0.00 0.00 0.00 0.00 60.65 60.38 3d53 s ILE 85 Cb -0.14 -3.14 -0.01 0.00 0.01 0.00 0.00 42.46 39.17 3d53 s ILE 85 CO 0.02 0.47 0.71 -0.54 0.00 0.00 0.00 174.94 175.60 3d53 s LYS 86 N 0.31 4.15 0.30 2.79 1.02 -1.26 -1.46 119.74 125.58 3d53 s LYS 86 Ca 0.03 0.71 0.03 0.00 0.02 0.00 0.00 55.97 56.76 3d53 s LYS 86 Cb -0.12 -3.64 -0.05 0.00 -0.52 0.00 0.00 37.83 33.49 3d53 s LYS 86 CO 0.00 -0.43 0.08 0.00 -0.92 0.00 0.00 175.35 174.08 3d53 s ARG 88 N -3.94 1.70 0.26 0.00 1.70 -0.45 0.19 118.95 118.41 3d53 s ARG 88 Ca 0.36 -0.68 -0.30 0.00 -0.47 0.00 0.00 55.73 54.64 3d53 s ARG 88 Cb 0.08 -1.57 -0.09 0.00 -0.57 0.00 0.00 34.95 32.79 3d53 s ARG 88 CO 0.15 0.37 1.08 0.00 -1.08 0.00 0.00 175.30 175.82 3d53 s ALA 89 N -0.29 3.40 0.00 7.88 0.00 -1.26 -1.73 121.76 129.75 3d53 s ALA 89 Ca 0.04 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.86 3d53 s ALA 89 Cb -0.09 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.71 3d53 s ALA 89 CO 0.00 -0.13 0.00 0.44 0.00 0.00 0.00 175.76 176.08 3d53 n ILE 90 N 1.35 0.00 -3.06 0.00 -5.35 0.38 -4.95 119.36 107.73 3d53 n ILE 90 Ca -0.01 -0.28 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 3d53 n ILE 90 Cb 0.45 0.80 0.00 0.00 -1.74 0.00 0.00 39.64 39.15 3d53 n ILE 90 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d53 n GLY 91 N 1.34 -1.18 2.90 3.28 0.00 -1.06 -3.08 105.19 107.39 3d53 n GLY 91 Ca 0.00 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 45.08 3d53 n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d53 s VAL 92 N -3.00 0.16 -0.30 1.61 1.01 -0.60 -0.48 120.40 118.79 3d53 s VAL 92 Ca 0.00 -0.07 -0.15 0.00 0.00 0.00 0.00 61.98 61.76 3d53 s VAL 92 Cb 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.21 3d53 s VAL 92 CO 0.00 0.05 0.35 -0.22 0.00 0.00 0.00 175.10 175.28 3d53 s LEU 93 N 0.02 4.21 -0.15 3.92 2.96 0.83 -1.43 118.68 129.04 3d53 s LEU 93 Ca 0.00 0.02 -0.17 0.00 -0.22 0.00 0.00 54.13 53.77 3d53 s LEU 93 Cb -0.02 -2.35 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 3d53 s LEU 93 CO -0.00 -0.24 0.42 -0.04 -1.32 0.00 0.00 176.35 175.17 3d53 s MET 94 N 2.02 4.28 0.12 1.98 -1.94 0.69 -1.62 119.30 124.82 3d53 s MET 94 Ca 0.13 0.30 -0.03 0.00 -1.71 0.00 0.00 55.69 54.38 3d53 s MET 94 Cb -0.16 -3.46 -0.03 0.00 2.01 0.00 0.00 34.83 33.19 3d53 s MET 94 CO 0.11 0.12 0.10 -1.64 -0.01 0.00 0.00 175.02 173.69 3d53 s MET 95 N 0.79 0.91 -0.04 2.03 1.00 0.35 -0.33 119.30 124.02 3d53 s MET 95 Ca 0.22 -1.31 0.06 0.00 0.00 0.00 0.00 55.69 54.66 3d53 s MET 95 Cb -0.14 0.27 -0.01 0.00 0.00 0.00 0.00 34.83 34.95 3d53 s MET 95 CO 0.08 -0.27 -0.22 -2.00 0.00 0.00 0.00 175.02 172.61 3d53 s GLU 96 N -4.00 2.11 0.00 2.03 2.12 0.21 -0.91 118.70 120.26 3d53 s GLU 96 Ca 0.18 -0.80 0.00 0.00 0.36 0.00 0.00 54.97 54.72 3d53 s GLU 96 Cb 0.06 -1.87 0.00 0.00 0.26 0.00 0.00 34.13 32.58 3d53 s GLU 96 CO -0.02 0.38 0.00 -0.40 -0.54 0.00 0.00 175.26 174.69 3d53 n ASP 97 N 2.85 1.80 0.28 -1.70 5.68 0.08 -0.42 116.55 125.12 3d53 n ASP 97 Ca -0.17 -0.77 0.14 0.00 -0.50 0.00 0.00 54.79 53.49 3d53 n ASP 97 Cb 0.52 0.00 0.80 0.00 -1.14 0.00 0.00 41.12 41.30 3d53 n ASP 97 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3d53 h GLU 98 N 0.00 0.00 -0.41 0.11 9.09 -1.89 -2.43 114.58 119.06 3d53 h GLU 98 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3d53 h GLU 98 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3d53 h GLU 98 CO 0.00 0.07 0.00 -1.13 0.05 0.00 0.00 179.01 178.00 3d53 n SER 99 N -3.73 4.66 0.00 3.06 3.41 -1.26 -5.08 113.62 114.67 3d53 n SER 99 Ca -0.02 -2.94 0.00 0.00 -0.26 0.00 0.00 58.87 55.65 3d53 n SER 99 Cb 0.18 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 3d53 n SER 99 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d53 n GLY 100 N 0.03 0.09 3.68 5.00 0.00 -0.91 -5.05 105.19 108.04 3d53 n GLY 100 Ca 0.24 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.86 3d53 n GLY 100 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3d53 n LEU 101 N 0.00 4.57 -3.25 0.99 7.94 -1.26 -0.74 117.00 125.24 3d53 n LEU 101 Ca 0.00 0.93 -0.05 0.00 -1.11 0.00 0.00 56.01 55.78 3d53 n LEU 101 Cb 0.00 -1.49 -0.04 0.00 0.53 0.00 0.00 43.42 42.43 3d53 n LEU 101 CO 0.00 -1.13 -0.01 -0.62 -1.11 0.00 0.00 177.39 174.52 3d53 s ASP 102 N -1.01 -0.31 -0.06 1.96 2.15 -0.09 -4.75 116.67 114.56 3d53 s ASP 102 Ca 0.72 -0.25 0.02 0.00 0.43 0.00 0.00 52.55 53.48 3d53 s ASP 102 Cb -0.44 1.42 -0.03 0.00 -0.30 0.00 0.00 42.92 43.58 3d53 s ASP 102 CO 0.49 -0.33 -0.11 -1.61 -0.17 0.00 0.00 175.17 173.44 3d53 s GLU 103 N 2.59 2.61 -0.07 4.34 2.02 -1.26 -0.49 118.70 128.43 3d53 s GLU 103 Ca 0.10 -0.63 0.05 0.00 0.02 0.00 0.00 54.97 54.51 3d53 s GLU 103 Cb -0.11 -2.47 -0.00 0.00 0.10 0.00 0.00 34.13 31.64 3d53 s GLU 103 CO -0.27 0.64 -0.22 0.15 0.02 0.00 0.00 175.26 175.57 3d53 s LYS 104 N -0.77 2.51 0.35 1.61 -0.14 -0.64 -4.60 119.74 118.06 3d53 s LYS 104 Ca 0.12 -0.81 -0.28 0.00 -1.36 0.00 0.00 55.97 53.64 3d53 s LYS 104 Cb -0.11 -2.04 -0.09 0.00 -1.68 0.00 0.00 37.83 33.90 3d53 s LYS 104 CO 0.01 0.27 1.24 0.42 -0.76 0.00 0.00 175.35 176.53 3d53 s ILE 105 N 0.09 2.94 -0.26 2.17 -1.09 0.07 -0.12 121.20 124.99 3d53 s ILE 105 Ca -0.09 0.89 -0.09 0.00 -2.23 0.00 0.00 60.65 59.13 3d53 s ILE 105 Cb -0.15 -3.55 -0.04 0.00 -1.58 0.00 0.00 42.46 37.15 3d53 s ILE 105 CO 0.05 0.17 0.13 -0.63 -1.23 0.00 0.00 174.94 173.44 3d53 s ILE 106 N -1.23 4.85 0.25 2.92 -1.09 0.37 -0.12 121.20 127.15 3d53 s ILE 106 Ca 0.51 0.01 0.04 0.00 -2.23 0.00 0.00 60.65 58.99 3d53 s ILE 106 Cb -0.36 -3.29 -0.05 0.00 -1.58 0.00 0.00 42.46 37.18 3d53 s ILE 106 CO 0.47 0.30 -0.02 0.00 -1.23 0.00 0.00 174.94 174.46 3d53 s ALA 107 N 1.64 2.00 0.14 9.38 0.00 -0.59 -0.47 121.76 133.86 3d53 s ALA 107 Ca 0.07 -1.82 0.05 0.00 0.00 0.00 0.00 51.96 50.26 3d53 s ALA 107 Cb -0.15 0.40 -0.04 0.00 0.00 0.00 0.00 23.12 23.32 3d53 s ALA 107 CO 0.07 -0.20 -0.11 0.14 0.00 0.00 0.00 175.76 175.67 3d53 s VAL 108 N -3.29 1.20 0.65 0.00 -7.23 -0.71 -0.77 120.40 110.26 3d53 s VAL 108 Ca 0.29 -1.95 -0.17 0.00 -1.81 0.00 0.00 61.98 58.33 3d53 s VAL 108 Cb 0.05 -1.74 -0.01 0.00 0.56 0.00 0.00 36.38 35.25 3d53 s VAL 108 CO 0.10 -0.65 1.24 -2.84 -0.31 0.00 0.00 175.10 172.64 3d53 s PRO 109 N -3.42 2.58 1.01 4.82 0.02 -1.26 -1.34 135.00 137.40 3d53 s PRO 109 Ca 0.14 1.91 -0.12 0.00 0.02 0.00 0.00 61.00 62.95 3d53 s PRO 109 Cb 0.00 -1.87 0.19 0.00 0.02 0.00 0.00 34.50 32.85 3d53 s PRO 109 CO 0.01 -1.54 1.08 0.95 -0.33 0.00 0.00 177.00 177.18 3d53 s THR 110 N -1.61 2.24 0.03 0.99 -4.23 -0.35 -4.65 115.64 108.06 3d53 s THR 110 Ca 0.79 0.08 0.32 0.00 -1.18 0.00 0.00 61.69 61.69 3d53 s THR 110 Cb -0.33 -2.27 0.38 0.00 1.34 0.00 0.00 72.50 71.62 3d53 s THR 110 CO 0.39 -0.10 1.92 0.28 -0.54 0.00 0.00 174.62 176.57 3d53 h SER 111 N -2.06 0.00 0.87 3.99 0.02 -1.92 -1.53 113.55 112.92 3d53 h SER 111 Ca -0.52 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.35 3d53 h SER 111 Cb 1.30 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.83 3d53 h SER 111 CO 0.49 0.01 -0.37 0.11 -1.14 0.00 0.00 176.83 175.93 3d53 h LYS 112 N 0.00 0.00 0.11 3.45 1.57 -1.97 -2.93 116.57 116.80 3d53 h LYS 112 Ca -0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.44 3d53 h LYS 112 Cb 0.60 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 3d53 h LYS 112 CO 0.00 0.37 -1.83 -0.07 -0.57 0.00 0.00 179.45 177.35 3d53 h LEU 113 N 0.00 0.35 -6.46 2.94 3.38 -1.82 -3.46 115.31 110.24 3d53 h LEU 113 Ca -0.00 -0.87 -0.29 0.00 0.09 0.00 0.00 57.88 56.81 3d53 h LEU 113 Cb 0.91 -0.11 -0.32 0.00 0.09 0.00 0.00 40.66 41.22 3d53 h LEU 113 CO 0.05 1.78 -0.61 -0.62 0.09 0.00 0.00 178.44 179.13 3d53 s ASP 114 N -7.03 1.35 0.55 -0.43 -1.08 -0.61 -5.03 116.67 104.40 3d53 s ASP 114 Ca -0.23 -0.65 0.25 0.00 -0.52 0.00 0.00 52.55 51.40 3d53 s ASP 114 Cb 0.06 0.66 1.58 0.00 -1.46 0.00 0.00 42.92 43.76 3d53 s ASP 114 CO 0.74 -0.38 2.18 -0.29 0.52 0.00 0.00 175.17 177.94 3d53 h ILE 115 N 6.24 0.68 0.00 4.11 6.09 -1.75 -2.75 117.51 130.14 3d53 h ILE 115 Ca -0.12 -0.14 0.00 0.00 -1.37 0.00 0.00 64.86 63.23 3d53 h ILE 115 Cb 1.09 1.08 0.00 0.00 0.47 0.00 0.00 36.82 39.46 3d53 h ILE 115 CO 0.32 0.03 0.00 0.35 -3.07 0.00 0.00 178.15 175.78 3d53 n THR 116 N -4.00 1.03 0.91 2.19 -2.24 -1.26 -1.36 114.28 109.55 3d53 n THR 116 Ca -0.03 0.26 0.11 0.00 -2.27 0.00 0.00 64.05 62.12 3d53 n THR 116 Cb 0.12 -1.13 0.07 0.00 -2.10 0.00 0.00 70.33 67.29 3d53 n THR 116 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3d53 n PHE 117 N -1.34 0.00 -0.35 4.78 3.72 -1.04 -4.60 117.46 118.63 3d53 n PHE 117 Ca 0.03 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.53 3d53 n PHE 117 Cb 0.07 0.00 0.29 0.00 -0.94 0.00 0.00 39.48 38.89 3d53 n PHE 117 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 3d53 h ASP 118 N 3.91 0.84 0.63 4.37 3.58 -1.41 -2.01 116.42 126.34 3d53 h ASP 118 Ca 0.00 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.51 3d53 h ASP 118 Cb 0.87 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.82 3d53 h ASP 118 CO 0.00 0.40 -0.09 0.00 -2.88 0.00 0.00 179.24 176.67 3d53 n HIS 119 N -4.66 0.00 -3.09 0.28 1.44 -1.26 -4.68 115.22 103.25 3d53 n HIS 119 Ca 0.20 0.00 -0.44 0.00 -2.01 0.00 0.00 57.72 55.47 3d53 n HIS 119 Cb 0.45 -0.32 -0.05 0.00 0.12 0.00 0.00 29.99 30.19 3d53 n HIS 119 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3d53 s ILE 120 N -2.72 4.78 -0.16 0.61 1.01 -0.76 -4.86 121.20 119.10 3d53 s ILE 120 Ca 0.22 -0.65 0.05 0.00 0.00 0.00 0.00 60.65 60.27 3d53 s ILE 120 Cb 0.20 -4.43 -0.06 0.00 0.01 0.00 0.00 42.46 38.18 3d53 s ILE 120 CO 0.51 -1.02 0.17 0.29 0.00 0.00 0.00 174.94 174.89 3d53 n LYS 121 N 6.45 3.86 -3.63 2.79 5.02 -1.26 -5.03 118.16 126.36 3d53 n LYS 121 Ca -0.07 -0.01 -0.10 0.00 -2.02 0.00 0.00 58.31 56.10 3d53 n LYS 121 Cb 0.44 -0.84 -0.04 0.00 -0.02 0.00 0.00 35.03 34.58 3d53 n LYS 121 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 3d53 s GLU 122 N -1.71 1.21 0.46 1.97 -1.05 -1.26 -4.85 118.70 113.47 3d53 s GLU 122 Ca 0.01 -0.72 0.19 0.00 -0.15 0.00 0.00 54.97 54.30 3d53 s GLU 122 Cb 0.03 0.51 1.17 0.00 -0.44 0.00 0.00 34.13 35.40 3d53 s GLU 122 CO 0.19 -0.50 1.93 -0.07 0.95 0.00 0.00 175.26 177.76 3d53 h LEU 123 N 2.24 0.27 -2.86 1.83 4.07 -1.94 0.49 115.31 119.41 3d53 h LEU 123 Ca -0.32 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.65 3d53 h LEU 123 Cb 1.27 -0.04 -0.00 0.00 1.08 0.00 0.00 40.66 42.97 3d53 h LEU 123 CO 0.42 0.14 -0.00 0.44 -1.08 0.00 0.00 178.44 178.35 3d53 h ASP 124 N 0.29 0.00 1.61 -0.43 5.19 -1.97 -2.24 116.42 118.87 3d53 h ASP 124 Ca 0.35 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.71 3d53 h ASP 124 Cb 0.97 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.48 3d53 h ASP 124 CO -0.09 0.00 -0.40 0.44 -3.12 0.00 0.00 179.24 176.07 3d53 h ASP 125 N 0.00 0.00 -3.99 6.45 3.32 -1.28 -3.45 116.42 117.47 3d53 h ASP 125 Ca -0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 3d53 h ASP 125 Cb 0.03 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.62 3d53 h ASP 125 CO 0.00 0.23 0.42 -0.76 -1.72 0.00 0.00 179.24 177.41 3d53 s LEU 126 N -6.18 4.06 0.49 1.55 1.43 -0.84 -4.95 118.68 114.23 3d53 s LEU 126 Ca 0.04 2.09 -0.20 0.00 -1.03 0.00 0.00 54.13 55.03 3d53 s LEU 126 Cb 0.07 -4.26 -0.08 0.00 0.03 0.00 0.00 46.19 41.94 3d53 s LEU 126 CO 0.72 -0.65 1.04 0.00 0.23 0.00 0.00 176.35 177.70 3d53 h GLU 128 N 1.54 1.04 -0.21 0.00 4.39 -1.95 -2.68 114.58 116.71 3d53 h GLU 128 Ca -0.50 -0.06 -0.15 0.00 0.34 0.00 0.00 59.36 58.99 3d53 h GLU 128 Cb 1.22 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 29.63 3d53 h GLU 128 CO 0.59 0.69 -0.51 1.98 -1.16 0.00 0.00 179.01 180.60 3d53 h MET 129 N 1.07 0.59 -0.34 2.33 4.05 -1.98 -1.09 114.93 119.55 3d53 h MET 129 Ca 0.34 -0.35 0.04 0.00 -0.28 0.00 0.00 59.70 59.45 3d53 h MET 129 Cb 0.03 0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 30.82 3d53 h MET 129 CO -0.10 0.95 0.12 1.25 0.23 0.00 0.00 176.91 179.37 3d53 h LEU 130 N 0.46 0.14 -0.86 3.39 5.85 -1.87 0.92 115.31 123.33 3d53 h LEU 130 Ca 0.02 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.69 3d53 h LEU 130 Cb 1.04 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 3d53 h LEU 130 CO 0.10 0.11 -0.09 0.11 -0.34 0.00 0.00 178.44 178.33 3d53 h LYS 131 N 0.27 0.74 -0.34 1.25 1.57 -1.38 -1.17 116.57 117.51 3d53 h LYS 131 Ca 0.15 -0.23 -0.09 0.00 -1.87 0.00 0.00 60.65 58.61 3d53 h LYS 131 Cb 0.12 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 3d53 h LYS 131 CO -0.16 0.82 -0.15 0.87 -0.57 0.00 0.00 179.45 180.26 3d53 h LYS 132 N 0.68 0.61 -0.30 3.15 1.57 -0.90 -2.03 116.57 119.35 3d53 h LYS 132 Ca 0.12 -0.20 -0.15 0.00 -1.87 0.00 0.00 60.65 58.54 3d53 h LYS 132 Cb 0.55 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 3d53 h LYS 132 CO 0.03 0.74 -0.42 -0.09 -0.57 0.00 0.00 179.45 179.15 3d53 h ARG 133 N 0.55 0.81 -0.07 3.15 2.43 -0.36 -0.86 114.38 120.03 3d53 h ARG 133 Ca 0.09 -0.47 -0.00 0.00 -0.81 0.00 0.00 59.98 58.79 3d53 h ARG 133 Cb 0.58 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.16 3d53 h ARG 133 CO 0.04 1.11 0.04 0.82 -1.51 0.00 0.00 179.97 180.46 3d53 h ILE 134 N 0.58 1.08 -0.29 1.20 2.04 -1.16 -0.09 117.51 120.88 3d53 h ILE 134 Ca 0.03 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.70 3d53 h ILE 134 Cb 1.01 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 38.17 3d53 h ILE 134 CO 0.10 0.07 -0.01 0.58 0.00 0.00 0.00 178.15 178.89 3d53 h VAL 135 N 0.02 0.78 -0.78 1.67 2.07 -1.38 -2.36 116.25 116.26 3d53 h VAL 135 Ca 0.02 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 3d53 h VAL 135 Cb 0.08 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 3d53 h VAL 135 CO -0.00 0.01 0.39 -0.74 0.02 0.00 0.00 177.57 177.25 3d53 h HIS 136 N 0.08 1.11 0.40 1.57 -0.00 -1.03 -1.71 115.15 115.57 3d53 h HIS 136 Ca 0.14 -0.05 -0.01 0.00 -0.00 0.00 0.00 60.37 60.45 3d53 h HIS 136 Cb 0.19 -0.35 -0.01 0.00 -0.00 0.00 0.00 27.41 27.24 3d53 h HIS 136 CO -0.22 0.81 -0.26 0.35 -0.00 0.00 0.00 177.93 178.61 3d53 h PHE 137 N 1.10 -0.67 -0.44 5.26 3.57 -0.71 -2.81 116.94 122.22 3d53 h PHE 137 Ca 0.27 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.70 3d53 h PHE 137 Cb 0.10 0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 3d53 h PHE 137 CO 0.01 -0.39 -0.00 0.74 -2.23 0.00 0.00 178.31 176.43 3d53 h PHE 138 N -0.63 0.77 0.00 0.41 0.04 -1.32 0.20 116.94 116.41 3d53 h PHE 138 Ca -0.04 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.63 3d53 h PHE 138 Cb 0.53 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 38.46 3d53 h PHE 138 CO -0.10 0.72 0.00 0.39 -0.60 0.00 0.00 178.31 178.72 3d53 n GLU 139 N -4.23 0.17 0.00 1.51 1.02 -0.65 -3.92 120.64 114.54 3d53 n GLU 139 Ca 0.02 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.59 3d53 n GLU 139 Cb 0.29 -1.84 0.00 0.00 -0.02 0.00 0.00 31.44 29.87 3d53 n GLU 139 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3d53 n HIS 140 N -2.15 0.00 0.32 -0.32 8.25 -0.81 -4.74 115.22 115.77 3d53 n HIS 140 Ca 0.02 0.00 0.21 0.00 -0.26 0.00 0.00 57.72 57.69 3d53 n HIS 140 Cb 0.20 0.00 1.08 0.00 1.12 0.00 0.00 29.99 32.40 3d53 n HIS 140 CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 3d53 h TYR 141 N 0.00 0.00 -0.63 4.41 -0.00 -0.75 -0.79 116.97 119.21 3d53 h TYR 141 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3d53 h TYR 141 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 3d53 h TYR 141 CO 0.00 0.01 0.00 1.63 -0.00 0.00 0.00 178.16 179.80 3d53 n LYS 142 N -3.17 2.67 -0.02 0.10 5.02 -1.26 -4.64 118.16 116.86 3d53 n LYS 142 Ca -0.02 -2.55 0.15 0.00 -2.02 0.00 0.00 58.31 53.86 3d53 n LYS 142 Cb 0.12 -1.55 0.59 0.00 -0.02 0.00 0.00 35.03 34.17 3d53 n LYS 142 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3d53 h ASP 143 N 4.30 0.19 -0.27 4.39 3.32 -1.41 -0.84 116.42 126.09 3d53 h ASP 143 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3d53 h ASP 143 Cb 0.98 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.50 3d53 h ASP 143 CO 0.00 0.11 0.00 0.18 -1.72 0.00 0.00 179.24 177.81 3d53 n LEU 144 N -4.44 2.70 -4.39 1.55 4.77 -1.26 -4.84 117.00 111.09 3d53 n LEU 144 Ca 0.09 -1.13 -0.39 0.00 -0.03 0.00 0.00 56.01 54.55 3d53 n LEU 144 Cb 0.45 -0.17 -0.12 0.00 -2.33 0.00 0.00 43.42 41.25 3d53 n LEU 144 CO 0.35 0.57 -0.22 -0.70 -1.33 0.00 0.00 177.39 176.06 3d53 s GLU 145 N -1.65 3.10 0.26 3.23 2.12 -0.32 -5.02 118.70 120.41 3d53 s GLU 145 Ca 0.35 -0.87 -0.31 0.00 0.36 0.00 0.00 54.97 54.51 3d53 s GLU 145 Cb 0.20 -3.54 -0.11 0.00 0.26 0.00 0.00 34.13 30.94 3d53 s GLU 145 CO 0.29 -0.50 1.61 0.21 -0.54 0.00 0.00 175.26 176.33 3d53 s LYS 146 N 1.55 4.14 0.00 4.30 2.20 -1.26 -2.83 119.74 127.84 3d53 s LYS 146 Ca 0.03 2.55 0.00 0.00 -0.36 0.00 0.00 55.97 58.19 3d53 s LYS 146 Cb -0.18 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 33.09 3d53 s LYS 146 CO 0.05 -0.64 0.00 0.41 -0.36 0.00 0.00 175.35 174.81 3d53 n GLY 147 N 2.74 0.83 3.09 5.54 0.00 -1.26 -5.01 105.19 111.12 3d53 n GLY 147 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 3d53 n GLY 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d53 s LYS 148 N -0.13 1.47 0.15 1.61 1.02 -1.13 -4.89 119.74 117.84 3d53 s LYS 148 Ca 0.00 -0.50 -0.13 0.00 0.02 0.00 0.00 55.97 55.36 3d53 s LYS 148 Cb 0.00 -1.31 0.01 0.00 -0.52 0.00 0.00 37.83 36.01 3d53 s LYS 148 CO 0.00 0.21 0.36 1.67 -0.92 0.00 0.00 175.35 176.67 3d53 s TRP 149 N 0.06 0.08 -0.06 3.18 1.48 -1.26 -4.69 118.94 117.73 3d53 s TRP 149 Ca -0.03 -0.44 -0.03 0.00 -1.06 0.00 0.00 56.10 54.54 3d53 s TRP 149 Cb -0.10 0.14 0.03 0.00 -1.16 0.00 0.00 33.47 32.38 3d53 s TRP 149 CO 0.01 -0.74 0.13 0.08 -4.06 0.00 0.00 176.95 172.37 3d53 s VAL 150 N -3.89 -0.04 -0.08 -0.66 1.01 -1.26 -3.21 120.40 112.27 3d53 s VAL 150 Ca 0.10 0.16 0.05 0.00 0.00 0.00 0.00 61.98 62.28 3d53 s VAL 150 Cb 0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 36.38 36.18 3d53 s VAL 150 CO -0.05 0.06 -0.23 -0.54 0.00 0.00 0.00 175.10 174.34 3d53 s LYS 151 N 1.00 2.75 -0.07 2.72 -0.14 0.45 -4.35 119.74 122.09 3d53 s LYS 151 Ca -0.08 -0.84 -0.24 0.00 -1.36 0.00 0.00 55.97 53.45 3d53 s LYS 151 Cb -0.10 -2.16 -0.04 0.00 -1.68 0.00 0.00 37.83 33.85 3d53 s LYS 151 CO -0.05 0.23 0.72 0.08 -0.76 0.00 0.00 175.35 175.57 3d53 s VAL 152 N 0.19 5.03 -0.09 3.17 1.01 -1.26 -0.62 120.40 127.83 3d53 s VAL 152 Ca -0.13 1.48 0.15 0.00 0.00 0.00 0.00 61.98 63.48 3d53 s VAL 152 Cb -0.16 -4.06 -0.23 0.00 0.00 0.00 0.00 36.38 31.94 3d53 s VAL 152 CO 0.07 0.24 0.20 0.35 0.00 0.00 0.00 175.10 175.95 3d53 n THR 153 N 3.84 0.58 -3.33 3.92 -2.24 0.55 -4.96 114.28 112.64 3d53 n THR 153 Ca -0.01 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 3d53 n THR 153 Cb 0.51 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 3d53 n THR 153 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d53 n GLY 154 N 1.80 -0.37 3.16 3.38 0.00 -1.12 -5.01 105.19 107.04 3d53 n GLY 154 Ca -0.15 -1.15 -0.20 0.00 0.00 0.00 0.00 46.02 44.52 3d53 n GLY 154 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3d53 s TRP 155 N -3.09 1.26 0.29 1.61 0.52 -1.26 -0.22 118.94 118.04 3d53 s TRP 155 Ca 0.00 -0.40 0.10 0.00 0.02 0.00 0.00 56.10 55.82 3d53 s TRP 155 Cb 0.00 -0.73 -0.05 0.00 -1.15 0.00 0.00 33.47 31.54 3d53 s TRP 155 CO 0.00 0.05 -0.04 0.20 0.02 0.00 0.00 176.95 177.18 3d53 s GLY 156 N -1.39 1.79 0.18 0.98 0.00 -0.51 -4.92 107.32 103.44 3d53 s GLY 156 Ca 0.01 -1.77 -0.02 0.00 0.00 0.00 0.00 44.72 42.94 3d53 s GLY 156 CO 0.02 -1.81 0.25 2.09 0.00 0.00 0.00 173.10 173.65 3d53 n ASP 157 N -0.85 0.13 -0.25 1.64 5.68 -1.26 -1.56 116.55 120.07 3d53 n ASP 157 Ca -0.06 -1.16 -0.06 0.00 -0.50 0.00 0.00 54.79 53.01 3d53 n ASP 157 Cb 0.60 -0.18 0.05 0.00 -1.14 0.00 0.00 41.12 40.45 3d53 n ASP 157 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3d53 h LYS 158 N 0.00 1.02 -0.70 0.11 3.64 -1.90 -2.22 116.57 116.52 3d53 h LYS 158 Ca -0.08 -0.16 0.02 0.00 -1.27 0.00 0.00 60.65 59.15 3d53 h LYS 158 Cb 0.25 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 31.85 3d53 h LYS 158 CO 0.07 0.82 0.46 0.28 -2.27 0.00 0.00 179.45 178.80 3d53 h VAL 159 N 0.98 1.15 -0.69 2.00 2.07 -1.94 -0.10 116.25 119.72 3d53 h VAL 159 Ca 0.24 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 3d53 h VAL 159 Cb 0.15 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.03 3d53 h VAL 159 CO -0.03 0.17 0.33 0.50 0.02 0.00 0.00 177.57 178.56 3d53 h LYS 160 N 0.92 1.00 -0.47 1.57 3.64 -1.86 -0.87 116.57 120.49 3d53 h LYS 160 Ca 0.27 -0.15 0.04 0.00 -1.27 0.00 0.00 60.65 59.54 3d53 h LYS 160 Cb -0.06 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 31.54 3d53 h LYS 160 CO -0.08 0.79 0.23 0.00 -2.27 0.00 0.00 179.45 178.12 3d53 h ALA 161 N 1.16 0.60 -0.17 5.00 0.00 -0.81 -1.40 119.26 123.63 3d53 h ALA 161 Ca 0.24 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 3d53 h ALA 161 Cb 0.12 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3d53 h ALA 161 CO -0.03 -0.13 -0.57 0.93 0.00 0.00 0.00 179.25 179.45 3d53 h GLU 162 N 0.45 0.54 0.04 0.00 5.08 -0.70 -1.49 114.58 118.50 3d53 h GLU 162 Ca 0.21 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3d53 h GLU 162 Cb 0.13 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3d53 h GLU 162 CO -0.16 0.96 -0.02 1.15 -1.00 0.00 0.00 179.01 179.95 3d53 h THR 163 N 0.41 1.13 -0.71 1.13 2.02 -1.05 -0.31 112.91 115.53 3d53 h THR 163 Ca 0.00 -0.53 0.09 0.00 0.77 0.00 0.00 66.41 66.74 3d53 h THR 163 Cb 1.12 1.48 -0.07 0.00 -1.74 0.00 0.00 68.15 68.94 3d53 h THR 163 CO 0.11 0.13 0.36 -0.07 0.37 0.00 0.00 175.52 176.42 3d53 h LEU 164 N -0.28 0.49 -0.12 2.58 3.38 -1.13 0.25 115.31 120.47 3d53 h LEU 164 Ca -0.01 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3d53 h LEU 164 Cb 0.26 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3d53 h LEU 164 CO 0.01 0.29 0.03 0.40 0.09 0.00 0.00 178.44 179.25 3d53 h ILE 165 N 0.62 1.20 -0.44 1.22 2.04 -1.22 -0.95 117.51 119.97 3d53 h ILE 165 Ca 0.34 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.61 3d53 h ILE 165 Cb 0.33 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 3d53 h ILE 165 CO -0.25 0.18 0.27 0.50 0.00 0.00 0.00 178.15 178.85 3d53 h LYS 166 N -0.01 0.53 -0.64 2.37 1.63 -0.65 0.02 116.57 119.81 3d53 h LYS 166 Ca 0.04 -0.03 0.06 0.00 -0.85 0.00 0.00 60.65 59.86 3d53 h LYS 166 Cb 0.25 -0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 31.71 3d53 h LYS 166 CO 0.00 0.35 0.35 0.93 -3.45 0.00 0.00 179.45 177.63 3d53 h GLU 167 N 0.54 0.63 -0.70 1.90 5.08 -0.47 -0.49 114.58 121.08 3d53 h GLU 167 Ca 0.17 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 3d53 h GLU 167 Cb -0.00 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 3d53 h GLU 167 CO -0.07 0.42 0.29 0.78 -1.00 0.00 0.00 179.01 179.43 3d53 h GLY 168 N 0.65 1.11 0.97 -3.84 0.00 -0.69 0.11 103.07 101.38 3d53 h GLY 168 Ca 0.29 -0.60 -0.09 0.00 0.00 0.00 0.00 47.33 46.93 3d53 h GLY 168 CO -0.18 0.56 -0.13 -2.22 0.00 0.00 0.00 176.54 174.57 3d53 h ILE 169 N 0.99 1.28 0.00 2.60 2.04 -0.76 1.00 117.51 124.66 3d53 h ILE 169 Ca 0.23 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 3d53 h ILE 169 Cb 0.19 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 3d53 h ILE 169 CO -0.02 0.41 -0.39 0.44 0.00 0.00 0.00 178.15 178.58 3d53 h ASP 170 N 0.52 0.00 0.00 1.72 3.32 -0.98 -3.47 116.42 117.53 3d53 h ASP 170 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3d53 h ASP 170 Cb 0.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.21 3d53 h ASP 170 CO 0.04 0.03 0.00 -1.14 -1.72 0.00 0.00 179.24 176.45