#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 0.51 -0.22 1.97 2.04 -1.97 -0.25 117.51 119.59 3d53 h ILE 3 Ca 0.00 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.71 3d53 h ILE 3 Cb 0.00 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.12 3d53 h ILE 3 CO 0.00 0.08 0.00 0.29 0.00 0.00 0.00 178.15 178.52 3d53 n LYS 4 N -4.70 1.97 0.00 2.37 5.02 -1.26 -3.72 118.16 117.84 3d53 n LYS 4 Ca 0.26 -0.99 0.00 0.00 -2.02 0.00 0.00 58.31 55.56 3d53 n LYS 4 Cb 0.86 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.39 3d53 n LYS 4 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 3d53 n LYS 5 N 0.23 -0.50 -4.33 1.97 3.00 -0.11 -5.03 118.16 113.39 3d53 n LYS 5 Ca 0.09 -0.26 -0.34 0.00 -0.00 0.00 0.00 58.31 57.80 3d53 n LYS 5 Cb 0.40 -0.76 -0.12 0.00 0.00 0.00 0.00 35.03 34.55 3d53 n LYS 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3d53 s ILE 6 N -0.00 4.08 0.73 3.15 1.01 -1.21 -5.11 121.20 123.85 3d53 s ILE 6 Ca 0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 60.65 60.24 3d53 s ILE 6 Cb 0.00 -2.80 0.03 0.00 0.01 0.00 0.00 42.46 39.71 3d53 s ILE 6 CO 0.00 0.49 1.09 -0.54 0.00 0.00 0.00 174.94 175.98 3d53 s LYS 7 N 0.30 2.54 0.11 2.79 1.02 -1.26 -4.55 119.74 120.69 3d53 s LYS 7 Ca -0.02 1.18 -0.14 0.00 0.02 0.00 0.00 55.97 57.01 3d53 s LYS 7 Cb -0.14 -1.93 -0.06 0.00 -0.52 0.00 0.00 37.83 35.18 3d53 s LYS 7 CO 0.02 -1.43 1.46 0.00 -0.92 0.00 0.00 175.35 174.49 3d53 h ALA 8 N -0.74 0.47 -3.55 5.17 0.00 -1.87 -3.42 119.26 115.33 3d53 h ALA 8 Ca -0.44 -0.37 -0.51 0.00 0.00 0.00 0.00 54.91 53.59 3d53 h ALA 8 Cb 1.23 -0.11 -0.33 0.00 0.00 0.00 0.00 17.79 18.58 3d53 h ALA 8 CO 0.53 0.44 -0.81 0.15 0.00 0.00 0.00 179.25 179.55 3d53 s LYS 9 N -4.51 1.58 0.08 0.00 1.02 -1.26 -1.05 119.74 115.61 3d53 s LYS 9 Ca -0.12 -0.42 0.01 0.00 0.02 0.00 0.00 55.97 55.46 3d53 s LYS 9 Cb 0.09 -1.34 -0.25 0.00 -0.52 0.00 0.00 37.83 35.82 3d53 s LYS 9 CO 0.83 0.07 1.16 0.00 -0.92 0.00 0.00 175.35 176.48 3d53 h ALA 10 N 6.78 0.25 -2.90 5.17 0.00 -1.87 -3.48 119.26 123.21 3d53 h ALA 10 Ca -0.32 -0.94 -0.12 0.00 0.00 0.00 0.00 54.91 53.54 3d53 h ALA 10 Cb 1.18 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.88 3d53 h ALA 10 CO 0.48 1.13 -0.06 0.54 0.00 0.00 0.00 179.25 181.34 3d53 s ASN 11 N -6.90 0.26 0.54 0.00 4.22 -1.26 -5.03 114.94 106.77 3d53 s ASN 11 Ca -0.02 -1.14 0.31 0.00 -2.14 0.00 0.00 52.86 49.86 3d53 s ASN 11 Cb 0.08 0.67 1.48 0.00 1.28 0.00 0.00 41.25 44.75 3d53 s ASN 11 CO 0.85 -1.30 1.89 0.78 -2.04 0.00 0.00 177.10 177.28 3d53 h ASN 12 N 2.15 0.00 -0.02 3.54 2.35 -2.04 -2.45 115.58 119.11 3d53 h ASN 12 Ca -0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 3d53 h ASN 12 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 3d53 h ASN 12 CO 0.37 0.00 -0.10 0.59 -1.65 0.00 0.00 177.43 176.64 3d53 n ASN 13 N -4.21 2.60 -4.26 5.81 3.02 -1.26 -4.99 115.26 111.96 3d53 n ASN 13 Ca 0.17 -1.80 -0.15 0.00 -0.03 0.00 0.00 54.58 52.78 3d53 n ASN 13 Cb 0.92 0.11 -0.10 0.00 -0.61 0.00 0.00 39.78 40.10 3d53 n ASN 13 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 3d53 s GLU 14 N -1.91 1.10 -0.00 3.52 4.04 -0.92 -4.65 118.70 119.88 3d53 s GLU 14 Ca 0.23 -1.47 0.06 0.00 0.04 0.00 0.00 54.97 53.83 3d53 s GLU 14 Cb 0.18 -0.66 -0.02 0.00 0.02 0.00 0.00 34.13 33.65 3d53 s GLU 14 CO 0.32 0.07 -0.18 0.96 -1.84 0.00 0.00 175.26 174.60 3d53 s ILE 15 N -3.31 1.41 -0.07 1.83 -4.36 -0.13 -3.89 121.20 112.68 3d53 s ILE 15 Ca 0.18 -0.84 -0.25 0.00 -0.26 0.00 0.00 60.65 59.48 3d53 s ILE 15 Cb 0.02 -1.19 -0.03 0.00 1.25 0.00 0.00 42.46 42.51 3d53 s ILE 15 CO 0.01 0.34 0.76 0.20 0.24 0.00 0.00 174.94 176.49 3d53 s ASN 16 N -0.58 7.05 -0.26 4.36 0.01 -0.21 -0.54 114.94 124.77 3d53 s ASN 16 Ca 0.06 1.27 0.02 0.00 -0.71 0.00 0.00 52.86 53.51 3d53 s ASN 16 Cb -0.07 -2.44 0.06 0.00 0.41 0.00 0.00 41.25 39.20 3d53 s ASN 16 CO -0.00 -0.17 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.62 3d53 s VAL 17 N 0.98 2.23 -0.17 1.60 1.01 -0.01 -4.25 120.40 121.79 3d53 s VAL 17 Ca 0.40 -1.58 -0.29 0.00 0.00 0.00 0.00 61.98 60.51 3d53 s VAL 17 Cb -0.18 -2.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 3d53 s VAL 17 CO 0.19 -0.00 1.18 -0.63 0.00 0.00 0.00 175.10 175.83 3d53 s ILE 18 N 1.12 4.43 -0.00 2.22 1.01 -0.39 -1.07 121.20 128.52 3d53 s ILE 18 Ca -0.08 1.72 -0.25 0.00 0.00 0.00 0.00 60.65 62.04 3d53 s ILE 18 Cb -0.20 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 3d53 s ILE 18 CO -0.05 -0.13 0.78 -0.63 0.00 0.00 0.00 174.94 174.91 3d53 s ILE 19 N 3.22 4.87 -0.19 2.92 -1.09 -0.06 -1.67 121.20 129.19 3d53 s ILE 19 Ca 0.51 1.65 -0.10 0.00 -2.23 0.00 0.00 60.65 60.49 3d53 s ILE 19 Cb -0.20 -4.13 -0.08 0.00 -1.58 0.00 0.00 42.46 36.47 3d53 s ILE 19 CO 0.13 0.29 -0.24 -0.62 -1.23 0.00 0.00 174.94 173.26 3d53 n GLU 20 N 3.36 0.40 -4.06 2.79 1.02 0.10 0.32 120.64 124.57 3d53 n GLU 20 Ca -0.00 0.18 -0.32 0.00 -0.02 0.00 0.00 57.16 56.99 3d53 n GLU 20 Cb 0.51 -1.17 -0.15 0.00 -0.02 0.00 0.00 31.44 30.60 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 -2.35 2.00 0.68 -3.67 1.01 -0.27 -4.52 121.20 114.08 3d53 s ILE 21 Ca -0.26 -1.31 -0.16 0.00 0.00 0.00 0.00 60.65 58.91 3d53 s ILE 21 Cb 0.10 -2.03 0.01 0.00 0.01 0.00 0.00 42.46 40.55 3d53 s ILE 21 CO 0.33 0.15 1.21 -2.84 0.00 0.00 0.00 174.94 173.79 3d53 s PRO 22 N 1.22 2.43 0.49 2.79 0.02 -1.26 -0.28 135.00 140.41 3d53 s PRO 22 Ca -0.04 1.80 -0.23 0.00 0.02 0.00 0.00 61.00 62.55 3d53 s PRO 22 Cb -0.17 -1.86 -0.06 0.00 0.02 0.00 0.00 34.50 32.42 3d53 s PRO 22 CO -0.08 -1.62 1.25 0.00 -0.33 0.00 0.00 177.00 176.23 3d53 s MET 23 N -3.71 3.53 -1.51 5.54 0.23 -1.23 -3.94 119.30 118.20 3d53 s MET 23 Ca 0.76 1.99 -0.07 0.00 -1.03 0.00 0.00 55.69 57.34 3d53 s MET 23 Cb -0.30 -2.37 0.06 0.00 -1.53 0.00 0.00 34.83 30.68 3d53 s MET 23 CO 0.41 -0.80 0.59 0.09 -2.03 0.00 0.00 175.02 173.28 3d53 n ASN 24 N -0.66 -1.65 -2.43 -1.18 3.02 0.17 -4.60 115.26 107.93 3d53 n ASN 24 Ca 0.08 -0.99 -0.21 0.00 -0.03 0.00 0.00 54.58 53.44 3d53 n ASN 24 Cb 0.46 -3.05 0.01 0.00 -0.61 0.00 0.00 39.78 36.60 3d53 n ASN 24 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3d53 n SER 25 N -2.87 3.89 -0.01 6.41 7.64 -1.25 -4.97 113.62 122.46 3d53 n SER 25 Ca -0.16 -3.39 0.00 0.00 1.01 0.00 0.00 58.87 56.33 3d53 n SER 25 Cb 0.61 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 3d53 n SER 25 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d53 n GLY 26 N -0.47 -1.13 0.33 0.23 0.00 -1.26 -4.41 105.19 98.47 3d53 n GLY 26 Ca 0.32 -1.24 0.14 0.00 0.00 0.00 0.00 46.02 45.24 3d53 n GLY 26 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d53 n PRO 27 N -0.01 1.23 -2.61 1.61 -0.04 -1.26 -4.55 135.00 129.37 3d53 n PRO 27 Ca 0.00 -0.67 -0.42 0.00 -0.04 0.00 0.00 63.50 62.37 3d53 n PRO 27 Cb 0.00 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 31.95 3d53 n PRO 27 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3d53 s ILE 28 N -2.23 4.59 -0.29 0.52 -1.09 -1.26 -0.10 121.20 121.34 3d53 s ILE 28 Ca 0.33 1.87 -0.05 0.00 -2.23 0.00 0.00 60.65 60.56 3d53 s ILE 28 Cb 0.20 -4.20 0.02 0.00 -1.58 0.00 0.00 42.46 36.91 3d53 s ILE 28 CO 0.42 0.09 0.05 -0.75 -1.23 0.00 0.00 174.94 173.51 3d53 s LYS 29 N 1.46 2.87 0.19 2.79 2.20 -0.12 -4.96 119.74 124.17 3d53 s LYS 29 Ca 0.53 -0.99 0.05 0.00 -0.36 0.00 0.00 55.97 55.20 3d53 s LYS 29 Cb -0.22 -3.29 -0.04 0.00 -1.51 0.00 0.00 37.83 32.77 3d53 s LYS 29 CO 0.25 -0.50 0.18 0.71 -0.36 0.00 0.00 175.35 175.63 3d53 s TYR 30 N 1.42 3.20 -0.15 4.03 2.02 -1.26 0.11 117.35 126.72 3d53 s TYR 30 Ca 0.00 -0.02 -0.11 0.00 -0.37 0.00 0.00 57.07 56.57 3d53 s TYR 30 Cb -0.18 -1.51 0.05 0.00 -0.40 0.00 0.00 41.96 39.92 3d53 s TYR 30 CO 0.01 0.51 0.38 -2.00 -1.57 0.00 0.00 175.55 172.88 3d53 s GLU 31 N -3.34 0.40 0.05 -0.62 2.12 -0.03 -4.57 118.70 112.71 3d53 s GLU 31 Ca 0.32 0.62 -0.31 0.00 0.36 0.00 0.00 54.97 55.97 3d53 s GLU 31 Cb -0.10 0.09 -0.06 0.00 0.26 0.00 0.00 34.13 34.32 3d53 s GLU 31 CO 0.25 -0.10 1.31 -0.06 -0.54 0.00 0.00 175.26 176.11 3d53 s PHE 32 N 0.76 3.20 -0.20 5.30 0.08 -1.26 -0.80 117.98 125.07 3d53 s PHE 32 Ca -0.05 1.06 -0.29 0.00 0.12 0.00 0.00 56.93 57.78 3d53 s PHE 32 Cb -0.06 -3.56 0.00 0.00 -0.57 0.00 0.00 43.02 38.83 3d53 s PHE 32 CO -0.05 -1.93 1.01 0.34 -0.10 0.00 0.00 175.22 174.48 3d53 s ASP 33 N 1.32 7.11 0.38 1.36 2.15 -0.62 -4.94 116.67 123.44 3d53 s ASP 33 Ca 0.62 1.38 0.16 0.00 0.43 0.00 0.00 52.55 55.14 3d53 s ASP 33 Cb -0.32 -2.53 0.78 0.00 -0.30 0.00 0.00 42.92 40.55 3d53 s ASP 33 CO 0.28 -0.59 1.82 0.11 -0.17 0.00 0.00 175.17 176.62 3d53 h LYS 34 N 7.37 0.00 0.03 4.34 6.56 -1.95 0.78 116.57 133.70 3d53 h LYS 34 Ca -0.23 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.36 3d53 h LYS 34 Cb 1.09 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.75 3d53 h LYS 34 CO 0.93 0.36 -0.02 0.93 -2.06 0.00 0.00 179.45 179.60 3d53 h GLU 35 N 0.00 -0.04 0.00 3.15 5.08 -1.97 -3.35 114.58 117.45 3d53 h GLU 35 Ca -0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 3d53 h GLU 35 Cb 0.72 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 3d53 h GLU 35 CO 0.05 0.58 -1.15 0.66 -1.00 0.00 0.00 179.01 178.15 3d53 h SER 36 N -0.72 0.00 0.00 1.42 4.64 -2.00 -3.48 113.55 113.41 3d53 h SER 36 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d53 h SER 36 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3d53 h SER 36 CO 0.01 0.73 0.00 0.61 -0.87 0.00 0.00 176.83 177.31 3d53 n GLY 37 N 1.37 0.89 3.83 -0.77 0.00 0.27 -5.03 105.19 105.75 3d53 n GLY 37 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.55 3.21 -0.39 4.61 0.00 -1.25 -4.83 121.76 119.55 3d53 s ALA 38 Ca 0.00 0.22 -0.23 0.00 0.00 0.00 0.00 51.96 51.95 3d53 s ALA 38 Cb 0.00 -2.95 0.01 0.00 0.00 0.00 0.00 23.12 20.19 3d53 s ALA 38 CO 0.00 0.24 0.76 -1.17 0.00 0.00 0.00 175.76 175.60 3d53 s LEU 39 N -2.96 4.19 0.10 0.00 2.96 -1.26 -1.58 118.68 120.13 3d53 s LEU 39 Ca 0.56 0.15 -0.06 0.00 -0.22 0.00 0.00 54.13 54.57 3d53 s LEU 39 Cb -0.11 -2.97 -0.05 0.00 0.50 0.00 0.00 46.19 43.56 3d53 s LEU 39 CO 0.16 -0.78 0.36 -0.36 -1.32 0.00 0.00 176.35 174.41 3d53 s PHE 40 N 3.11 3.52 -0.13 5.38 0.40 0.02 -4.91 117.98 125.38 3d53 s PHE 40 Ca 0.30 0.60 -0.29 0.00 -0.60 0.00 0.00 56.93 56.94 3d53 s PHE 40 Cb -0.13 -2.03 -0.01 0.00 0.51 0.00 0.00 43.02 41.36 3d53 s PHE 40 CO 0.19 0.49 1.13 0.08 0.70 0.00 0.00 175.22 177.81 3d53 s VAL 41 N -1.53 4.48 -0.13 -0.44 1.01 -1.26 -0.85 120.40 121.69 3d53 s VAL 41 Ca 0.36 1.78 -0.08 0.00 0.00 0.00 0.00 61.98 64.05 3d53 s VAL 41 Cb -0.13 -4.15 -0.25 0.00 0.00 0.00 0.00 36.38 31.85 3d53 s VAL 41 CO 0.22 -0.07 0.35 -0.67 0.00 0.00 0.00 175.10 174.92 3d53 n ASP 42 N 5.71 2.10 -3.59 3.32 2.03 0.29 -4.93 116.55 121.49 3d53 n ASP 42 Ca 0.11 0.23 -0.15 0.00 0.52 0.00 0.00 54.79 55.51 3d53 n ASP 42 Cb 0.46 -0.88 -0.06 0.00 -0.72 0.00 0.00 41.12 39.92 3d53 n ASP 42 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 3d53 s ARG 43 N -2.54 0.86 -0.52 -0.67 3.52 -0.97 -4.99 118.95 113.64 3d53 s ARG 43 Ca -0.23 0.61 -0.18 0.00 -0.13 0.00 0.00 55.73 55.80 3d53 s ARG 43 Cb 0.07 0.41 0.08 0.00 -1.56 0.00 0.00 34.95 33.94 3d53 s ARG 43 CO 0.75 -0.19 0.59 -0.06 -0.81 0.00 0.00 175.30 175.58 3d53 s PHE 44 N -0.33 3.09 0.46 5.12 0.08 -1.26 -0.94 117.98 124.20 3d53 s PHE 44 Ca -0.04 -0.77 -0.24 0.00 0.12 0.00 0.00 56.93 56.00 3d53 s PHE 44 Cb -0.03 -3.59 -0.07 0.00 -0.57 0.00 0.00 43.02 38.75 3d53 s PHE 44 CO 0.03 -1.05 1.36 -1.64 -0.10 0.00 0.00 175.22 173.82 3d53 s MET 45 N 2.36 3.62 0.01 0.44 -1.94 0.86 -4.94 119.30 119.71 3d53 s MET 45 Ca 0.11 2.25 0.22 0.00 -1.71 0.00 0.00 55.69 56.56 3d53 s MET 45 Cb -0.22 -2.56 -0.12 0.00 2.01 0.00 0.00 34.83 33.95 3d53 s MET 45 CO 0.09 -0.81 0.89 1.04 -0.01 0.00 0.00 175.02 176.22 3d53 n GLN 46 N -0.36 0.23 -1.47 2.03 1.13 -1.26 -4.84 117.38 112.83 3d53 n GLN 46 Ca 0.06 -0.04 -0.20 0.00 -1.94 0.00 0.00 57.00 54.88 3d53 n GLN 46 Cb 0.44 -1.53 0.14 0.00 0.11 0.00 0.00 30.24 29.39 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 -1.80 0.00 0.25 5.09 -2.24 -1.26 -4.97 114.28 109.35 3d53 n THR 47 Ca 0.02 -0.78 0.09 0.00 -2.27 0.00 0.00 64.05 61.11 3d53 n THR 47 Cb 0.41 -1.54 0.25 0.00 -2.10 0.00 0.00 70.33 67.36 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 -3.15 0.72 -2.58 4.28 -2.24 -1.26 -4.96 114.28 105.09 3d53 n THR 48 Ca 0.12 -0.74 -0.30 0.00 -2.27 0.00 0.00 64.05 60.86 3d53 n THR 48 Cb 0.41 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 69.03 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 -1.28 3.70 0.10 -0.78 -1.94 -1.26 -5.03 119.30 112.81 3d53 s MET 49 Ca 0.38 0.50 -0.08 0.00 -1.71 0.00 0.00 55.69 54.78 3d53 s MET 49 Cb 0.20 -2.31 -0.01 0.00 2.01 0.00 0.00 34.83 34.72 3d53 s MET 49 CO 0.26 -0.20 0.19 -1.54 -0.01 0.00 0.00 175.02 173.72 3d53 s SER 50 N -3.58 0.14 0.29 3.03 1.04 -1.26 -4.52 113.70 108.84 3d53 s SER 50 Ca 0.52 -0.74 -0.29 0.00 0.48 0.00 0.00 55.95 55.91 3d53 s SER 50 Cb -0.10 0.35 -0.10 0.00 0.10 0.00 0.00 66.02 66.26 3d53 s SER 50 CO 0.39 -0.75 1.39 -0.31 0.98 0.00 0.00 173.24 174.93 3d53 s TYR 51 N -3.89 2.99 -0.71 5.02 1.51 -1.26 -4.69 117.35 116.32 3d53 s TYR 51 Ca 0.08 1.20 0.26 0.00 -1.01 0.00 0.00 57.07 57.60 3d53 s TYR 51 Cb 0.05 -3.78 0.69 0.00 -0.11 0.00 0.00 41.96 38.81 3d53 s TYR 51 CO -0.08 -2.36 1.65 -0.35 -1.11 0.00 0.00 175.55 173.30 3d53 n PRO 52 N 1.56 0.27 -4.20 -1.71 -0.04 -1.26 0.46 135.00 130.08 3d53 n PRO 52 Ca 0.04 0.18 -0.12 0.00 -0.04 0.00 0.00 63.50 63.55 3d53 n PRO 52 Cb 0.41 -1.77 -0.10 0.00 -0.04 0.00 0.00 33.50 32.00 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 -3.14 6.81 -0.09 0.00 0.01 -0.87 -3.54 114.94 114.13 3d53 s ASN 54 Ca 0.32 2.46 0.04 0.00 -0.71 0.00 0.00 52.86 54.97 3d53 s ASN 54 Cb 0.07 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 39.13 3d53 s ASN 54 CO 0.08 -0.60 -0.21 -0.47 -1.51 0.00 0.00 177.10 174.39 3d53 s TYR 55 N 0.29 2.28 0.00 2.20 5.04 0.61 0.00 117.35 127.77 3d53 s TYR 55 Ca 0.59 -0.91 0.00 0.00 -2.44 0.00 0.00 57.07 54.31 3d53 s TYR 55 Cb -0.38 -1.54 0.00 0.00 0.35 0.00 0.00 41.96 40.38 3d53 s TYR 55 CO 0.38 -0.38 0.00 0.41 -1.34 0.00 0.00 175.55 174.62 3d53 n GLY 56 N 3.58 3.35 3.13 8.97 0.00 -0.96 0.02 105.19 123.27 3d53 n GLY 56 Ca -0.20 -0.51 -0.09 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.29 0.74 -0.25 1.61 -0.12 -0.67 -0.43 117.98 117.57 3d53 s PHE 57 Ca 0.00 -1.12 -0.18 0.00 -0.05 0.00 0.00 56.93 55.59 3d53 s PHE 57 Cb 0.00 -0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 41.90 3d53 s PHE 57 CO 0.00 -0.40 0.50 0.42 -0.05 0.00 0.00 175.22 175.69 3d53 s ILE 58 N -3.92 5.09 0.72 -4.49 1.01 0.13 -1.26 121.20 118.48 3d53 s ILE 58 Ca 0.15 0.86 -0.15 0.00 0.00 0.00 0.00 60.65 61.52 3d53 s ILE 58 Cb 0.07 -3.82 0.03 0.00 0.01 0.00 0.00 42.46 38.76 3d53 s ILE 58 CO -0.04 0.11 1.19 -2.16 0.00 0.00 0.00 174.94 174.04 3d53 s PRO 59 N 2.13 2.24 -1.48 2.79 0.04 -1.26 -3.67 135.00 135.79 3d53 s PRO 59 Ca 0.21 1.69 -0.07 0.00 0.04 0.00 0.00 61.00 62.87 3d53 s PRO 59 Cb -0.16 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.55 3d53 s PRO 59 CO 0.09 -1.75 0.83 -0.25 0.04 0.00 0.00 177.00 175.97 3d53 n ASP 60 N -2.69 -6.10 -4.12 6.66 8.00 -1.26 -3.60 116.55 113.43 3d53 n ASP 60 Ca 0.13 -0.40 -0.16 0.00 0.71 0.00 0.00 54.79 55.06 3d53 n ASP 60 Cb 0.51 -4.88 -0.12 0.00 -0.02 0.00 0.00 41.12 36.60 3d53 n ASP 60 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3d53 s THR 61 N -3.23 0.86 -0.12 -3.53 -4.23 -1.24 -4.45 115.64 99.70 3d53 s THR 61 Ca 0.43 -1.14 -0.00 0.00 -1.18 0.00 0.00 61.69 59.80 3d53 s THR 61 Cb -0.19 -0.85 0.02 0.00 1.34 0.00 0.00 72.50 72.82 3d53 s THR 61 CO 0.53 -0.25 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.51 3d53 s LEU 62 N -1.54 1.28 0.93 4.79 1.02 -0.21 -3.98 118.68 120.97 3d53 s LEU 62 Ca -0.05 -0.34 -0.14 0.00 0.02 0.00 0.00 54.13 53.62 3d53 s LEU 62 Cb -0.09 -0.91 0.16 0.00 0.02 0.00 0.00 46.19 45.37 3d53 s LEU 62 CO 0.01 -0.11 1.20 -0.94 0.02 0.00 0.00 176.35 176.53 3d53 s SER 63 N 1.67 3.35 0.17 2.29 1.04 0.22 -4.15 113.70 118.28 3d53 s SER 63 Ca 0.05 0.68 -0.00 0.00 0.48 0.00 0.00 55.95 57.15 3d53 s SER 63 Cb -0.13 -1.04 0.38 0.00 0.10 0.00 0.00 66.02 65.33 3d53 s SER 63 CO -0.09 -2.62 0.86 -0.46 0.98 0.00 0.00 173.24 171.92 3d53 n ASN 64 N -3.77 -0.10 -1.68 7.02 0.23 -1.26 -0.42 115.26 115.27 3d53 n ASN 64 Ca 0.10 0.94 0.07 0.00 -0.53 0.00 0.00 54.58 55.16 3d53 n ASN 64 Cb 0.60 -0.33 0.36 0.00 -2.08 0.00 0.00 39.78 38.33 3d53 n ASN 64 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3d53 n ASP 65 N -4.74 5.04 0.00 0.53 5.75 -1.26 -4.94 116.55 116.93 3d53 n ASP 65 Ca 0.12 -2.70 0.00 0.00 -0.01 0.00 0.00 54.79 52.20 3d53 n ASP 65 Cb 0.38 -0.63 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 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 0.76 2.54 3.81 6.12 0.00 0.43 -5.03 105.19 113.82 3d53 n GLY 66 Ca 0.25 0.00 -0.33 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 -3.15 6.59 0.77 1.61 1.01 -1.26 -4.65 116.67 117.59 3d53 s ASP 67 Ca 0.00 1.81 -0.14 0.00 0.71 0.00 0.00 52.55 54.94 3d53 s ASP 67 Cb 0.00 -2.55 0.06 0.00 1.01 0.00 0.00 42.92 41.45 3d53 s ASP 67 CO 0.00 -0.61 1.18 -2.84 0.21 0.00 0.00 175.17 173.12 3d53 s PRO 68 N -3.26 1.90 0.09 8.23 0.02 -1.26 0.69 135.00 141.42 3d53 s PRO 68 Ca 0.65 1.67 -0.31 0.00 0.02 0.00 0.00 61.00 63.02 3d53 s PRO 68 Cb -0.13 -1.82 -0.09 0.00 0.02 0.00 0.00 34.50 32.49 3d53 s PRO 68 CO 0.18 -2.00 1.64 0.08 -0.33 0.00 0.00 177.00 176.57 3d53 s VAL 69 N -2.20 2.94 0.18 3.83 1.01 -1.26 -4.63 120.40 120.27 3d53 s VAL 69 Ca 0.72 0.47 -0.05 0.00 0.00 0.00 0.00 61.98 63.11 3d53 s VAL 69 Cb -0.27 -3.30 -0.06 0.00 0.00 0.00 0.00 36.38 32.75 3d53 s VAL 69 CO 0.49 0.01 0.43 -1.81 0.00 0.00 0.00 175.10 174.22 3d53 s ASP 70 N 2.15 6.50 -0.01 3.32 1.01 -1.26 -0.70 116.67 127.68 3d53 s ASP 70 Ca 0.73 0.65 0.01 0.00 0.71 0.00 0.00 52.55 54.65 3d53 s ASP 70 Cb -0.41 -2.12 0.00 0.00 1.01 0.00 0.00 42.92 41.41 3d53 s ASP 70 CO 0.32 -0.01 -0.03 -0.69 0.21 0.00 0.00 175.17 174.97 3d53 s VAL 71 N -1.76 0.27 -0.41 -1.27 1.01 0.43 -1.09 120.40 117.57 3d53 s VAL 71 Ca 0.42 -0.10 -0.13 0.00 0.00 0.00 0.00 61.98 62.18 3d53 s VAL 71 Cb -0.12 -0.26 0.04 0.00 0.00 0.00 0.00 36.38 36.05 3d53 s VAL 71 CO 0.25 0.10 0.28 -0.76 0.00 0.00 0.00 175.10 174.96 3d53 s LEU 72 N 0.19 5.06 -0.53 3.92 1.43 0.35 -2.26 118.68 126.84 3d53 s LEU 72 Ca -0.02 -1.10 -0.20 0.00 -1.03 0.00 0.00 54.13 51.78 3d53 s LEU 72 Cb -0.04 -2.09 0.06 0.00 0.03 0.00 0.00 46.19 44.15 3d53 s LEU 72 CO -0.00 -0.47 0.72 -0.69 0.23 0.00 0.00 176.35 176.13 3d53 s VAL 73 N 1.59 4.73 0.10 -1.59 1.01 0.10 -1.08 120.40 125.25 3d53 s VAL 73 Ca 0.03 -0.34 -0.31 0.00 0.00 0.00 0.00 61.98 61.36 3d53 s VAL 73 Cb -0.21 -4.39 -0.08 0.00 0.00 0.00 0.00 36.38 31.70 3d53 s VAL 73 CO 0.07 -0.93 1.49 -0.69 0.00 0.00 0.00 175.10 175.04 3d53 s VAL 74 N 3.02 3.16 0.30 2.92 1.01 0.07 -2.05 120.40 128.83 3d53 s VAL 74 Ca 0.19 0.75 -0.16 0.00 0.00 0.00 0.00 61.98 62.75 3d53 s VAL 74 Cb -0.18 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.74 3d53 s VAL 74 CO 0.13 0.03 0.66 0.00 0.00 0.00 0.00 175.10 175.92 3d53 s ALA 75 N 1.69 -0.69 -0.73 5.51 0.00 -1.26 -4.16 121.76 122.12 3d53 s ALA 75 Ca 0.68 -0.66 0.23 0.00 0.00 0.00 0.00 51.96 52.21 3d53 s ALA 75 Cb -0.38 0.89 0.05 0.00 0.00 0.00 0.00 23.12 23.68 3d53 s ALA 75 CO 0.30 -0.96 1.04 0.72 0.00 0.00 0.00 175.76 176.86 3d53 n HIS 76 N -0.47 0.16 -3.78 0.00 8.25 -1.26 -4.95 115.22 113.16 3d53 n HIS 76 Ca -0.04 0.05 -0.13 0.00 -0.26 0.00 0.00 57.72 57.34 3d53 n HIS 76 Cb 0.60 -0.32 -0.09 0.00 1.12 0.00 0.00 29.99 31.30 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 -3.14 -0.16 0.76 4.41 3.76 -1.26 -5.16 115.29 114.50 3d53 s HIS 77 Ca 0.05 0.26 -0.11 0.00 -0.15 0.00 0.00 55.06 55.12 3d53 s HIS 77 Cb 0.15 0.07 0.05 0.00 1.11 0.00 0.00 32.58 33.96 3d53 s HIS 77 CO 0.80 -0.33 1.08 -1.25 -0.85 0.00 0.00 174.74 174.19 3d53 s PRO 78 N -1.11 2.41 0.30 8.40 0.04 -1.26 -4.87 135.00 138.91 3d53 s PRO 78 Ca -0.12 1.05 0.08 0.00 0.04 0.00 0.00 61.00 62.05 3d53 s PRO 78 Cb -0.05 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.50 3d53 s PRO 78 CO 0.03 -1.50 -0.09 0.14 0.04 0.00 0.00 177.00 175.63 3d53 s VAL 79 N -2.97 1.94 0.29 -0.36 -7.23 -1.26 -4.98 120.40 105.84 3d53 s VAL 79 Ca 0.60 -2.18 -0.30 0.00 -1.81 0.00 0.00 61.98 58.29 3d53 s VAL 79 Cb -0.16 -2.50 -0.12 0.00 0.56 0.00 0.00 36.38 34.16 3d53 s VAL 79 CO 0.56 -0.28 1.58 0.55 -0.31 0.00 0.00 175.10 177.20 3d53 n VAL 80 N -0.66 1.02 -1.70 1.32 3.14 -1.26 -4.47 118.33 115.72 3d53 n VAL 80 Ca -0.05 -0.26 -0.43 0.00 -2.96 0.00 0.00 64.34 60.64 3d53 n VAL 80 Cb 0.63 -1.93 -0.02 0.00 -1.06 0.00 0.00 33.84 31.46 3d53 n VAL 80 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 3d53 n PRO 81 N 2.13 2.26 0.00 1.45 -0.02 -1.26 -2.18 135.00 137.38 3d53 n PRO 81 Ca 0.09 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 3d53 n PRO 81 Cb 0.36 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 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 1.57 1.88 3.83 -1.23 0.00 0.15 -5.01 105.19 106.38 3d53 n GLY 82 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.54 5.96 -0.19 1.61 1.04 -0.93 -4.71 113.70 113.94 3d53 s SER 83 Ca 0.00 1.63 -0.04 0.00 0.48 0.00 0.00 55.95 58.02 3d53 s SER 83 Cb 0.00 -2.51 -0.02 0.00 0.10 0.00 0.00 66.02 63.60 3d53 s SER 83 CO 0.00 -1.05 -0.04 -0.69 0.98 0.00 0.00 173.24 172.44 3d53 s VAL 84 N -2.79 3.59 -0.18 5.02 1.01 -1.26 -0.88 120.40 124.91 3d53 s VAL 84 Ca 0.59 -0.44 -0.10 0.00 0.00 0.00 0.00 61.98 62.04 3d53 s VAL 84 Cb -0.13 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 3d53 s VAL 84 CO 0.44 0.44 0.14 -0.63 0.00 0.00 0.00 175.10 175.49 3d53 s ILE 85 N 1.05 5.42 -0.16 2.22 1.01 -0.23 -4.92 121.20 125.59 3d53 s ILE 85 Ca 0.01 0.21 -0.26 0.00 0.00 0.00 0.00 60.65 60.61 3d53 s ILE 85 Cb -0.15 -3.46 -0.01 0.00 0.01 0.00 0.00 42.46 38.85 3d53 s ILE 85 CO 0.00 0.48 0.88 -0.54 0.00 0.00 0.00 174.94 175.76 3d53 s LYS 86 N 0.05 4.32 0.30 2.79 1.02 -1.26 -0.83 119.74 126.13 3d53 s LYS 86 Ca 0.10 1.11 0.03 0.00 0.02 0.00 0.00 55.97 57.23 3d53 s LYS 86 Cb -0.11 -3.57 -0.04 0.00 -0.52 0.00 0.00 37.83 33.59 3d53 s LYS 86 CO -0.00 -0.33 0.13 0.00 -0.92 0.00 0.00 175.35 174.23 3d53 s ARG 88 N -3.87 0.56 0.25 0.00 1.70 -0.19 -0.96 118.95 116.44 3d53 s ARG 88 Ca 0.35 -0.26 -0.30 0.00 -0.47 0.00 0.00 55.73 55.05 3d53 s ARG 88 Cb 0.06 -0.54 -0.09 0.00 -0.57 0.00 0.00 34.95 33.80 3d53 s ARG 88 CO 0.16 0.15 1.20 0.00 -1.08 0.00 0.00 175.30 175.73 3d53 s ALA 89 N -0.19 3.45 0.00 7.88 0.00 -1.26 -2.01 121.76 129.63 3d53 s ALA 89 Ca 0.02 1.03 0.00 0.00 0.00 0.00 0.00 51.96 53.01 3d53 s ALA 89 Cb -0.03 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.68 3d53 s ALA 89 CO -0.00 -0.38 0.00 0.44 0.00 0.00 0.00 175.76 175.82 3d53 n ILE 90 N 1.66 0.00 -3.97 0.00 -5.35 -0.69 -4.94 119.36 106.07 3d53 n ILE 90 Ca 0.02 -0.19 0.01 0.00 -0.27 0.00 0.00 62.75 62.32 3d53 n ILE 90 Cb 0.44 0.69 0.00 0.00 -1.74 0.00 0.00 39.64 39.03 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 1.37 0.38 2.91 3.28 0.00 -1.10 -2.61 105.19 109.42 3d53 n GLY 91 Ca 0.00 -0.86 -0.12 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.04 0.11 -0.17 1.61 1.01 -0.38 -0.94 120.40 119.60 3d53 s VAL 92 Ca 0.08 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 61.72 3d53 s VAL 92 Cb -0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 36.38 36.19 3d53 s VAL 92 CO -0.01 -0.09 0.13 -0.22 0.00 0.00 0.00 175.10 174.91 3d53 s LEU 93 N -0.36 4.23 -0.19 3.92 2.96 0.13 -1.69 118.68 127.68 3d53 s LEU 93 Ca -0.03 0.29 -0.06 0.00 -0.22 0.00 0.00 54.13 54.11 3d53 s LEU 93 Cb -0.03 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.56 3d53 s LEU 93 CO -0.00 0.25 0.02 -0.04 -1.32 0.00 0.00 176.35 175.26 3d53 s MET 94 N -0.07 3.73 0.18 1.98 -1.94 0.30 -1.45 119.30 122.03 3d53 s MET 94 Ca 0.10 -0.47 -0.02 0.00 -1.71 0.00 0.00 55.69 53.59 3d53 s MET 94 Cb -0.11 -3.12 -0.04 0.00 2.01 0.00 0.00 34.83 33.57 3d53 s MET 94 CO -0.00 0.10 0.13 0.00 -0.01 0.00 0.00 175.02 175.24 3d53 s MET 95 N 0.79 1.12 -0.08 2.03 0.23 0.99 0.10 119.30 124.48 3d53 s MET 95 Ca 0.01 -1.52 0.04 0.00 -1.03 0.00 0.00 55.69 53.19 3d53 s MET 95 Cb -0.14 0.28 0.00 0.00 -1.53 0.00 0.00 34.83 33.44 3d53 s MET 95 CO 0.02 -0.36 -0.20 -1.21 -2.03 0.00 0.00 175.02 171.25 3d53 s GLU 96 N -4.10 2.47 0.19 3.16 2.02 0.12 -0.61 118.70 121.95 3d53 s GLU 96 Ca 0.32 -0.70 0.01 0.00 0.02 0.00 0.00 54.97 54.61 3d53 s GLU 96 Cb 0.07 -1.94 0.01 0.00 0.10 0.00 0.00 34.13 32.37 3d53 s GLU 96 CO 0.08 0.15 0.09 -0.40 0.02 0.00 0.00 175.26 175.19 3d53 n ASP 97 N 3.56 1.97 0.20 -0.19 5.68 0.11 -0.60 116.55 127.28 3d53 n ASP 97 Ca -0.20 -1.73 0.15 0.00 -0.50 0.00 0.00 54.79 52.50 3d53 n ASP 97 Cb 0.52 0.04 0.67 0.00 -1.14 0.00 0.00 41.12 41.22 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 -0.25 0.11 9.09 -1.88 -1.61 114.58 120.04 3d53 h GLU 98 Ca -0.14 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.25 3d53 h GLU 98 Cb 0.46 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.54 3d53 h GLU 98 CO 0.22 0.00 -0.00 -1.13 0.05 0.00 0.00 179.01 178.14 3d53 n SER 99 N -2.56 3.58 0.00 3.06 3.41 -1.26 -5.08 113.62 114.77 3d53 n SER 99 Ca 0.00 -3.12 0.00 0.00 -0.26 0.00 0.00 58.87 55.49 3d53 n SER 99 Cb 0.17 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 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 -0.67 0.48 3.71 5.00 0.00 -0.61 -5.02 105.19 108.08 3d53 n GLY 100 Ca 0.23 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 3d53 n GLY 100 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d53 s LEU 101 N 0.00 4.38 -0.05 0.99 1.02 -1.26 0.05 118.68 123.81 3d53 s LEU 101 Ca 0.00 1.93 0.01 0.00 0.02 0.00 0.00 54.13 56.08 3d53 s LEU 101 Cb 0.00 -3.58 0.02 0.00 0.02 0.00 0.00 46.19 42.65 3d53 s LEU 101 CO 0.00 -0.40 -0.04 -0.62 0.02 0.00 0.00 176.35 175.31 3d53 s ASP 102 N 1.00 0.98 -0.02 2.29 2.15 0.22 -4.87 116.67 118.41 3d53 s ASP 102 Ca 0.57 -0.12 0.03 0.00 0.43 0.00 0.00 52.55 53.45 3d53 s ASP 102 Cb -0.27 -0.44 0.00 0.00 -0.30 0.00 0.00 42.92 41.90 3d53 s ASP 102 CO 0.29 -0.06 -0.10 -1.61 -0.17 0.00 0.00 175.17 173.52 3d53 s GLU 103 N 0.99 0.99 -0.08 4.34 2.02 -1.26 -0.01 118.70 125.69 3d53 s GLU 103 Ca -0.10 -0.34 0.02 0.00 0.02 0.00 0.00 54.97 54.57 3d53 s GLU 103 Cb -0.14 -0.93 0.01 0.00 0.10 0.00 0.00 34.13 33.17 3d53 s GLU 103 CO -0.00 0.15 -0.15 0.15 0.02 0.00 0.00 175.26 175.43 3d53 s LYS 104 N 0.08 2.05 0.26 1.61 1.02 -0.53 -4.62 119.74 119.60 3d53 s LYS 104 Ca -0.01 -0.52 -0.30 0.00 0.02 0.00 0.00 55.97 55.16 3d53 s LYS 104 Cb -0.08 -1.67 -0.09 0.00 -0.52 0.00 0.00 37.83 35.47 3d53 s LYS 104 CO 0.00 0.03 1.15 0.42 -0.92 0.00 0.00 175.35 176.03 3d53 s ILE 105 N 0.69 3.43 -0.20 2.17 1.01 -0.25 0.20 121.20 128.25 3d53 s ILE 105 Ca -0.13 1.37 -0.11 0.00 0.00 0.00 0.00 60.65 61.78 3d53 s ILE 105 Cb -0.16 -3.87 -0.05 0.00 0.01 0.00 0.00 42.46 38.39 3d53 s ILE 105 CO 0.03 0.30 0.15 -0.63 0.00 0.00 0.00 174.94 174.80 3d53 s ILE 106 N -0.85 5.39 0.09 2.92 -1.09 -0.12 0.13 121.20 127.68 3d53 s ILE 106 Ca 0.47 0.23 -0.04 0.00 -2.23 0.00 0.00 60.65 59.08 3d53 s ILE 106 Cb -0.33 -3.49 -0.02 0.00 -1.58 0.00 0.00 42.46 37.03 3d53 s ILE 106 CO 0.41 0.42 0.09 0.00 -1.23 0.00 0.00 174.94 174.63 3d53 s ALA 107 N 0.49 0.31 0.08 9.38 0.00 -0.24 -1.71 121.76 130.08 3d53 s ALA 107 Ca 0.09 -1.05 0.05 0.00 0.00 0.00 0.00 51.96 51.04 3d53 s ALA 107 Cb -0.12 0.54 -0.03 0.00 0.00 0.00 0.00 23.12 23.51 3d53 s ALA 107 CO -0.00 -0.47 -0.12 0.14 0.00 0.00 0.00 175.76 175.30 3d53 s VAL 108 N -3.94 1.04 0.80 0.00 -7.23 -0.85 -0.75 120.40 109.48 3d53 s VAL 108 Ca 0.11 -1.45 -0.14 0.00 -1.81 0.00 0.00 61.98 58.70 3d53 s VAL 108 Cb 0.06 -1.19 0.07 0.00 0.56 0.00 0.00 36.38 35.88 3d53 s VAL 108 CO -0.06 -0.37 1.13 -2.65 -0.31 0.00 0.00 175.10 172.84 3d53 n PRO 109 N 0.96 0.20 -0.99 4.82 -0.02 -1.26 -1.03 135.00 137.68 3d53 n PRO 109 Ca -0.19 0.14 -0.30 0.00 -2.02 0.00 0.00 63.50 61.14 3d53 n PRO 109 Cb 0.56 -2.38 0.17 0.00 -0.02 0.00 0.00 33.50 31.82 3d53 n PRO 109 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3d53 s THR 110 N -2.10 2.41 0.11 3.45 -4.23 -0.57 -4.64 115.64 110.08 3d53 s THR 110 Ca 0.73 0.13 0.17 0.00 -1.18 0.00 0.00 61.69 61.54 3d53 s THR 110 Cb -0.30 -2.46 0.10 0.00 1.34 0.00 0.00 72.50 71.18 3d53 s THR 110 CO 0.52 -0.18 1.65 0.28 -0.54 0.00 0.00 174.62 176.35 3d53 h SER 111 N -1.84 0.00 -0.18 3.99 0.02 -1.93 -0.61 113.55 113.01 3d53 h SER 111 Ca -0.51 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.49 3d53 h SER 111 Cb 1.29 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.83 3d53 h SER 111 CO 0.52 0.44 0.13 0.11 -1.14 0.00 0.00 176.83 176.89 3d53 h LYS 112 N 0.00 0.00 0.03 3.45 1.57 -1.97 -2.73 116.57 116.92 3d53 h LYS 112 Ca -0.00 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.46 3d53 h LYS 112 Cb 1.05 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.32 3d53 h LYS 112 CO 0.06 0.00 -1.75 1.28 -0.57 0.00 0.00 179.45 178.47 3d53 n LEU 113 N -4.42 2.15 -3.44 2.94 4.77 -0.77 -4.87 117.00 113.37 3d53 n LEU 113 Ca 0.01 0.32 -0.21 0.00 -0.03 0.00 0.00 56.01 56.10 3d53 n LEU 113 Cb 0.26 -0.98 -0.11 0.00 -2.33 0.00 0.00 43.42 40.27 3d53 n LEU 113 CO 0.34 0.52 -0.22 -0.62 -1.33 0.00 0.00 177.39 176.08 3d53 s ASP 114 N -6.99 2.22 0.58 -1.43 -1.08 -0.31 -5.02 116.67 104.64 3d53 s ASP 114 Ca -0.29 -0.93 0.28 0.00 -0.52 0.00 0.00 52.55 51.09 3d53 s ASP 114 Cb 0.08 0.26 1.69 0.00 -1.46 0.00 0.00 42.92 43.49 3d53 s ASP 114 CO 0.62 -0.40 2.18 -0.29 0.52 0.00 0.00 175.17 177.79 3d53 h ILE 115 N 6.28 0.55 0.00 4.11 6.09 -1.71 -2.23 117.51 130.60 3d53 h ILE 115 Ca -0.15 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 3d53 h ILE 115 Cb 1.06 0.93 0.00 0.00 0.47 0.00 0.00 36.82 39.27 3d53 h ILE 115 CO 0.36 0.00 0.00 0.35 -3.07 0.00 0.00 178.15 175.79 3d53 n THR 116 N -3.91 1.09 0.86 2.19 -2.24 -1.26 -1.39 114.28 109.62 3d53 n THR 116 Ca -0.01 0.40 0.11 0.00 -2.27 0.00 0.00 64.05 62.28 3d53 n THR 116 Cb 0.20 -1.32 0.30 0.00 -2.10 0.00 0.00 70.33 67.40 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 -1.98 0.32 -0.20 4.78 3.72 -0.84 -4.54 117.46 118.73 3d53 n PHE 117 Ca 0.01 -0.16 0.08 0.00 -0.05 0.00 0.00 57.45 57.33 3d53 n PHE 117 Cb 0.13 0.00 0.36 0.00 -0.94 0.00 0.00 39.48 39.03 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 3.19 0.66 -0.54 4.37 3.58 -1.41 -2.49 116.42 123.78 3d53 h ASP 118 Ca 0.00 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.46 3d53 h ASP 118 Cb 0.70 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.62 3d53 h ASP 118 CO 0.00 0.41 0.00 1.41 -2.88 0.00 0.00 179.24 178.18 3d53 n HIS 119 N -4.49 0.71 -3.08 0.28 8.25 -1.26 -4.70 115.22 110.93 3d53 n HIS 119 Ca 0.12 -0.35 -0.45 0.00 -0.26 0.00 0.00 57.72 56.78 3d53 n HIS 119 Cb 0.28 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.35 3d53 n HIS 119 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3d53 s ILE 120 N -1.29 4.80 -0.11 1.59 1.01 -0.94 -4.84 121.20 121.41 3d53 s ILE 120 Ca 0.43 -1.06 0.18 0.00 0.00 0.00 0.00 60.65 60.20 3d53 s ILE 120 Cb 0.24 -4.54 -0.26 0.00 0.01 0.00 0.00 42.46 37.91 3d53 s ILE 120 CO 0.32 -1.20 0.22 0.29 0.00 0.00 0.00 174.94 174.58 3d53 n LYS 121 N 6.38 0.84 -4.20 2.79 4.01 -1.26 -5.02 118.16 121.70 3d53 n LYS 121 Ca -0.05 -0.08 -0.13 0.00 -0.51 0.00 0.00 58.31 57.55 3d53 n LYS 121 Cb 0.44 -1.47 -0.09 0.00 -0.51 0.00 0.00 35.03 33.39 3d53 n LYS 121 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 3d53 s GLU 122 N -2.84 1.28 0.39 1.97 0.41 -1.26 -4.74 118.70 113.91 3d53 s GLU 122 Ca -0.08 -1.65 0.07 0.00 -0.41 0.00 0.00 54.97 52.90 3d53 s GLU 122 Cb 0.08 0.29 0.81 0.00 -1.78 0.00 0.00 34.13 33.54 3d53 s GLU 122 CO 0.78 -0.44 1.99 -0.07 -0.49 0.00 0.00 175.26 177.04 3d53 h LEU 123 N 2.55 0.57 -0.98 1.80 4.07 -1.94 -2.18 115.31 119.20 3d53 h LEU 123 Ca -0.34 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.62 3d53 h LEU 123 Cb 1.25 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.86 3d53 h LEU 123 CO 0.50 0.38 0.00 0.44 -1.08 0.00 0.00 178.44 178.68 3d53 h ASP 124 N 0.65 0.00 1.75 -0.43 5.19 -1.97 -1.26 116.42 120.35 3d53 h ASP 124 Ca 0.26 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 3d53 h ASP 124 Cb 0.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.71 3d53 h ASP 124 CO -0.08 0.00 0.00 0.44 -3.12 0.00 0.00 179.24 176.48 3d53 h ASP 125 N 0.00 0.00 -3.88 6.45 3.32 -1.77 -3.45 116.42 117.09 3d53 h ASP 125 Ca 0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 3d53 h ASP 125 Cb 0.29 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 3d53 h ASP 125 CO 0.00 0.00 0.39 -0.76 -1.72 0.00 0.00 179.24 177.15 3d53 s LEU 126 N -5.87 4.34 0.46 1.55 1.43 -0.48 -4.96 118.68 115.15 3d53 s LEU 126 Ca 0.07 2.00 -0.23 0.00 -1.03 0.00 0.00 54.13 54.93 3d53 s LEU 126 Cb 0.07 -3.96 -0.07 0.00 0.03 0.00 0.00 46.19 42.25 3d53 s LEU 126 CO 0.63 -0.20 1.22 0.00 0.23 0.00 0.00 176.35 178.23 3d53 h GLU 128 N 2.09 0.88 -0.01 0.00 4.81 -1.95 -2.60 114.58 117.79 3d53 h GLU 128 Ca -0.50 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 58.52 3d53 h GLU 128 Cb 1.26 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 3d53 h GLU 128 CO 0.60 0.58 -0.72 1.98 -0.73 0.00 0.00 179.01 180.72 3d53 h MET 129 N 0.90 0.08 -0.40 1.92 4.05 -1.99 -1.86 114.93 117.63 3d53 h MET 129 Ca 0.53 -0.07 -0.08 0.00 -0.28 0.00 0.00 59.70 59.80 3d53 h MET 129 Cb 0.65 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.46 3d53 h MET 129 CO -0.31 0.76 -0.07 1.25 0.23 0.00 0.00 176.91 178.77 3d53 h LEU 130 N 0.05 0.76 -1.02 3.39 5.85 -1.85 -1.40 115.31 121.09 3d53 h LEU 130 Ca -0.01 -0.35 -0.02 0.00 0.84 0.00 0.00 57.88 58.34 3d53 h LEU 130 Cb 1.27 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 3d53 h LEU 130 CO 0.10 0.94 0.45 0.11 -0.34 0.00 0.00 178.44 179.69 3d53 h LYS 131 N 0.58 1.14 -0.26 1.25 1.57 -1.42 -1.22 116.57 118.20 3d53 h LYS 131 Ca 0.10 -0.13 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 3d53 h LYS 131 Cb 0.59 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 3d53 h LYS 131 CO 0.04 0.83 -0.27 0.87 -0.57 0.00 0.00 179.45 180.35 3d53 h LYS 132 N 1.14 0.51 -0.10 3.15 1.57 -1.20 -2.10 116.57 119.54 3d53 h LYS 132 Ca 0.29 -0.20 -0.21 0.00 -1.87 0.00 0.00 60.65 58.66 3d53 h LYS 132 Cb 0.02 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3d53 h LYS 132 CO -0.05 0.73 -0.79 -0.09 -0.57 0.00 0.00 179.45 178.69 3d53 h ARG 133 N 0.45 0.62 0.09 3.15 2.43 -0.84 -0.69 114.38 119.58 3d53 h ARG 133 Ca 0.06 -0.52 -0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3d53 h ARG 133 Cb 0.70 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 3d53 h ARG 133 CO 0.05 1.14 -0.04 0.82 -1.51 0.00 0.00 179.97 180.43 3d53 h ILE 134 N 0.41 1.02 -0.24 1.20 2.04 -1.12 -0.74 117.51 120.08 3d53 h ILE 134 Ca -0.05 -0.37 0.05 0.00 1.00 0.00 0.00 64.86 65.48 3d53 h ILE 134 Cb 1.40 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 38.70 3d53 h ILE 134 CO 0.15 0.09 -0.06 0.58 0.00 0.00 0.00 178.15 178.92 3d53 h VAL 135 N -0.29 0.76 -0.66 1.67 2.07 -1.39 -2.42 116.25 116.00 3d53 h VAL 135 Ca -0.01 -0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 3d53 h VAL 135 Cb 0.24 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3d53 h VAL 135 CO 0.02 0.00 0.25 -0.74 0.02 0.00 0.00 177.57 177.12 3d53 h HIS 136 N 0.00 0.99 0.62 1.57 -0.00 -1.04 -1.49 115.15 115.80 3d53 h HIS 136 Ca 0.11 -0.07 -0.02 0.00 -0.00 0.00 0.00 60.37 60.40 3d53 h HIS 136 Cb 0.17 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.28 3d53 h HIS 136 CO -0.24 0.76 -0.43 0.35 -0.00 0.00 0.00 177.93 178.37 3d53 h PHE 137 N 0.95 -1.16 -0.27 5.26 3.57 -0.91 -2.47 116.94 121.91 3d53 h PHE 137 Ca 0.22 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.66 3d53 h PHE 137 Cb 0.20 0.42 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 3d53 h PHE 137 CO 0.02 -0.63 -0.07 0.74 -2.23 0.00 0.00 178.31 176.14 3d53 h PHE 138 N -1.01 0.46 0.00 0.41 0.04 -1.30 0.18 116.94 115.71 3d53 h PHE 138 Ca -0.08 -0.05 -0.03 0.00 2.80 0.00 0.00 57.97 60.61 3d53 h PHE 138 Cb 0.83 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.85 3d53 h PHE 138 CO -0.14 0.50 -0.17 0.93 -0.60 0.00 0.00 178.31 178.84 3d53 h GLU 139 N 0.41 0.00 0.00 1.51 5.08 -1.28 -3.36 114.58 116.94 3d53 h GLU 139 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3d53 h GLU 139 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3d53 h GLU 139 CO 0.02 0.17 -0.31 0.72 -1.00 0.00 0.00 179.01 178.60 3d53 n HIS 140 N -3.54 0.00 0.39 4.33 8.25 -0.81 -4.65 115.22 119.19 3d53 n HIS 140 Ca -0.01 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.57 3d53 n HIS 140 Cb 0.31 0.00 0.51 0.00 1.12 0.00 0.00 29.99 31.93 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 -0.47 4.41 -0.00 -0.82 -1.78 116.97 118.31 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 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.79 3d53 n LYS 142 N -2.32 3.64 0.21 0.10 5.02 -1.26 -4.67 118.16 118.88 3d53 n LYS 142 Ca 0.02 -2.83 0.06 0.00 -2.02 0.00 0.00 58.31 53.54 3d53 n LYS 142 Cb 0.24 -1.88 0.54 0.00 -0.02 0.00 0.00 35.03 33.91 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 3.05 0.07 -0.49 4.39 3.32 -1.59 -2.25 116.42 122.92 3d53 h ASP 143 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3d53 h ASP 143 Cb 1.48 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.01 3d53 h ASP 143 CO 0.26 0.14 0.00 0.18 -1.72 0.00 0.00 179.24 178.10 3d53 n LEU 144 N -4.42 3.44 -4.39 1.55 4.77 -1.26 -4.89 117.00 111.78 3d53 n LEU 144 Ca -0.02 -1.76 -0.39 0.00 -0.03 0.00 0.00 56.01 53.81 3d53 n LEU 144 Cb 0.17 -0.32 -0.12 0.00 -2.33 0.00 0.00 43.42 40.82 3d53 n LEU 144 CO 0.35 0.81 -0.22 -0.70 -1.33 0.00 0.00 177.39 176.31 3d53 s GLU 145 N -1.16 3.14 0.19 3.23 2.12 -0.85 -5.01 118.70 120.36 3d53 s GLU 145 Ca 0.38 -0.85 -0.31 0.00 0.36 0.00 0.00 54.97 54.55 3d53 s GLU 145 Cb 0.21 -3.54 -0.09 0.00 0.26 0.00 0.00 34.13 30.96 3d53 s GLU 145 CO 0.28 -0.49 1.43 0.15 -0.54 0.00 0.00 175.26 176.09 3d53 s LYS 146 N 1.56 4.29 0.00 4.30 1.02 -1.26 -3.01 119.74 126.64 3d53 s LYS 146 Ca 0.03 2.22 0.00 0.00 0.02 0.00 0.00 55.97 58.24 3d53 s LYS 146 Cb -0.18 -3.17 0.00 0.00 -0.52 0.00 0.00 37.83 33.97 3d53 s LYS 146 CO 0.05 -0.43 0.00 0.41 -0.92 0.00 0.00 175.35 174.46 3d53 n GLY 147 N 2.88 3.26 3.24 -3.33 0.00 -1.26 -5.01 105.19 104.97 3d53 n GLY 147 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.56 3.12 0.17 1.61 1.02 -1.16 -4.85 119.74 119.09 3d53 s LYS 148 Ca 0.00 -0.83 -0.01 0.00 0.02 0.00 0.00 55.97 55.15 3d53 s LYS 148 Cb 0.00 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 3d53 s LYS 148 CO 0.00 0.14 0.09 1.67 -0.92 0.00 0.00 175.35 176.33 3d53 s TRP 149 N 0.46 1.01 -0.04 3.18 1.48 -1.26 -4.68 118.94 119.09 3d53 s TRP 149 Ca -0.14 -1.30 -0.03 0.00 -1.06 0.00 0.00 56.10 53.57 3d53 s TRP 149 Cb -0.17 -0.52 0.02 0.00 -1.16 0.00 0.00 33.47 31.64 3d53 s TRP 149 CO 0.06 -0.58 0.11 0.08 -4.06 0.00 0.00 176.95 172.56 3d53 s VAL 150 N -4.10 -0.03 -0.06 -0.66 1.01 -1.26 -3.39 120.40 111.92 3d53 s VAL 150 Ca 0.31 0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.42 3d53 s VAL 150 Cb 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 36.38 36.29 3d53 s VAL 150 CO 0.07 0.04 -0.16 -0.54 0.00 0.00 0.00 175.10 174.51 3d53 s LYS 151 N 0.60 1.90 -0.02 2.72 1.02 0.23 -4.41 119.74 121.79 3d53 s LYS 151 Ca -0.05 -0.56 -0.26 0.00 0.02 0.00 0.00 55.97 55.13 3d53 s LYS 151 Cb -0.06 -1.58 -0.04 0.00 -0.52 0.00 0.00 37.83 35.63 3d53 s LYS 151 CO -0.03 0.14 0.81 0.08 -0.92 0.00 0.00 175.35 175.44 3d53 s VAL 152 N 0.34 4.91 -0.20 3.17 1.01 -1.26 0.15 120.40 128.52 3d53 s VAL 152 Ca -0.10 1.70 -0.21 0.00 0.00 0.00 0.00 61.98 63.37 3d53 s VAL 152 Cb -0.14 -4.16 -0.18 0.00 0.00 0.00 0.00 36.38 31.90 3d53 s VAL 152 CO 0.04 0.24 0.23 0.74 0.00 0.00 0.00 175.10 176.35 3d53 h THR 153 N 4.63 0.91 0.00 3.92 2.02 0.35 -3.48 112.91 121.27 3d53 h THR 153 Ca -0.42 -2.11 0.00 0.00 0.77 0.00 0.00 66.41 64.66 3d53 h THR 153 Cb 1.21 2.15 0.00 0.00 -1.74 0.00 0.00 68.15 69.76 3d53 h THR 153 CO 0.74 0.31 0.00 0.61 0.37 0.00 0.00 175.52 177.55 3d53 n GLY 154 N 1.46 -0.60 3.33 2.16 0.00 -1.08 -5.02 105.19 105.45 3d53 n GLY 154 Ca -0.29 -0.63 -0.21 0.00 0.00 0.00 0.00 46.02 44.90 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 -3.28 1.78 0.15 1.61 0.52 -1.26 -0.54 118.94 117.91 3d53 s TRP 155 Ca 0.00 -0.49 0.08 0.00 0.02 0.00 0.00 56.10 55.71 3d53 s TRP 155 Cb 0.00 -0.87 -0.04 0.00 -1.15 0.00 0.00 33.47 31.41 3d53 s TRP 155 CO 0.00 0.33 -0.18 0.20 0.02 0.00 0.00 176.95 177.32 3d53 s GLY 156 N -2.78 1.30 0.38 0.98 0.00 -0.68 -4.93 107.32 101.59 3d53 s GLY 156 Ca 0.17 -1.41 -0.06 0.00 0.00 0.00 0.00 44.72 43.41 3d53 s GLY 156 CO 0.07 -1.45 0.40 2.09 0.00 0.00 0.00 173.10 174.21 3d53 n ASP 157 N 0.47 -0.80 -0.17 1.64 5.75 -1.26 -1.25 116.55 120.94 3d53 n ASP 157 Ca -0.15 -0.90 -0.04 0.00 -0.01 0.00 0.00 54.79 53.69 3d53 n ASP 157 Cb 0.56 -0.34 0.15 0.00 -1.03 0.00 0.00 41.12 40.47 3d53 n ASP 157 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 3d53 h LYS 158 N 0.00 0.92 -0.68 0.11 3.64 -1.84 -2.50 116.57 116.22 3d53 h LYS 158 Ca -0.14 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 58.98 3d53 h LYS 158 Cb 0.41 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 3d53 h LYS 158 CO 0.10 0.81 0.15 0.28 -2.27 0.00 0.00 179.45 178.52 3d53 h VAL 159 N 0.88 1.26 -0.25 2.00 2.07 -1.93 0.10 116.25 120.38 3d53 h VAL 159 Ca 0.19 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 3d53 h VAL 159 Cb 0.31 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3d53 h VAL 159 CO -0.00 0.37 0.03 0.11 0.02 0.00 0.00 177.57 178.10 3d53 h LYS 160 N 1.04 0.37 -0.13 1.57 1.57 -1.86 -1.66 116.57 117.45 3d53 h LYS 160 Ca 0.21 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.84 3d53 h LYS 160 Cb 0.38 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3d53 h LYS 160 CO 0.00 0.37 -0.29 0.00 -0.57 0.00 0.00 179.45 178.97 3d53 h ALA 161 N 1.68 0.22 -0.50 3.86 0.00 -0.85 -2.76 119.26 120.89 3d53 h ALA 161 Ca 0.09 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 3d53 h ALA 161 Cb 0.20 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3d53 h ALA 161 CO 0.00 0.23 0.08 0.93 0.00 0.00 0.00 179.25 180.49 3d53 h GLU 162 N 0.03 0.79 -0.47 0.00 5.08 -0.67 -0.47 114.58 118.88 3d53 h GLU 162 Ca 0.00 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.09 3d53 h GLU 162 Cb 0.88 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 3d53 h GLU 162 CO 0.06 0.75 -0.06 1.15 -1.00 0.00 0.00 179.01 179.92 3d53 h THR 163 N 0.76 1.27 -0.46 1.13 2.02 -1.38 -0.79 112.91 115.45 3d53 h THR 163 Ca 0.16 -1.15 -0.05 0.00 0.77 0.00 0.00 66.41 66.13 3d53 h THR 163 Cb 0.35 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 3d53 h THR 163 CO 0.01 0.40 0.09 0.25 0.37 0.00 0.00 175.52 176.63 3d53 h LEU 164 N 0.71 0.73 -0.44 2.58 5.85 -1.14 -0.18 115.31 123.41 3d53 h LEU 164 Ca 0.12 -0.25 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 3d53 h LEU 164 Cb 0.59 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3d53 h LEU 164 CO 0.04 0.80 -0.02 0.40 -0.34 0.00 0.00 178.44 179.31 3d53 h ILE 165 N 0.63 1.26 -0.11 4.05 2.04 -1.07 -2.11 117.51 122.20 3d53 h ILE 165 Ca 0.14 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 64.93 3d53 h ILE 165 Cb 0.37 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 3d53 h ILE 165 CO 0.01 0.37 0.07 0.50 0.00 0.00 0.00 178.15 179.10 3d53 h LYS 166 N 0.63 0.15 0.00 2.37 1.63 -0.94 -1.48 116.57 118.93 3d53 h LYS 166 Ca 0.12 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.89 3d53 h LYS 166 Cb 0.52 -0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.12 3d53 h LYS 166 CO 0.03 0.12 -0.10 0.93 -3.45 0.00 0.00 179.45 176.97 3d53 h GLU 167 N 0.14 0.00 -0.27 1.90 5.08 -1.03 -1.16 114.58 119.24 3d53 h GLU 167 Ca 0.04 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 3d53 h GLU 167 Cb -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3d53 h GLU 167 CO -0.01 0.10 -0.07 0.78 -1.00 0.00 0.00 179.01 178.81 3d53 h GLY 168 N 0.31 0.57 0.99 -3.84 0.00 -0.94 -1.06 103.07 99.09 3d53 h GLY 168 Ca -0.00 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 46.79 3d53 h GLY 168 CO 0.01 0.43 0.06 -2.22 0.00 0.00 0.00 176.54 174.82 3d53 h ILE 169 N 0.28 1.25 -0.63 2.60 2.04 -1.00 -0.36 117.51 121.69 3d53 h ILE 169 Ca 0.07 -0.97 -0.09 0.00 1.00 0.00 0.00 64.86 64.87 3d53 h ILE 169 Cb 0.55 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 3d53 h ILE 169 CO 0.03 0.34 0.06 0.44 0.00 0.00 0.00 178.15 179.02 3d53 h ASP 170 N 0.70 1.04 0.05 1.72 3.32 -1.26 -2.91 116.42 119.08 3d53 h ASP 170 Ca 0.15 -0.28 -0.10 0.00 0.02 0.00 0.00 57.03 56.82 3d53 h ASP 170 Cb 0.43 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3d53 h ASP 170 CO 0.01 1.06 -0.30 -0.09 -1.72 0.00 0.00 179.24 178.21 3d53 h ARG 171 N 0.98 0.38 0.00 3.56 2.43 -1.16 -3.51 114.38 117.05 3d53 h ARG 171 Ca 0.19 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3d53 h ARG 171 Cb 0.49 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 3d53 h ARG 171 CO 0.02 0.64 0.00 -1.71 -1.51 0.00 0.00 179.97 177.41