#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u02 s LEU 3 N 0.00 4.38 -0.03 1.04 1.43 -1.21 -1.24 118.68 123.04 1u02 s LEU 3 Ca 0.00 0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 1u02 s LEU 3 Cb 0.00 -2.42 0.03 0.00 0.03 0.00 0.00 46.19 43.83 1u02 s LEU 3 CO 0.00 0.32 0.04 -0.51 0.23 0.00 0.00 176.35 176.43 1u02 s ILE 4 N -1.21 -0.05 -0.21 -0.59 2.07 -0.94 -1.40 121.20 118.88 1u02 s ILE 4 Ca 0.23 0.29 -0.02 0.00 -1.41 0.00 0.00 60.65 59.73 1u02 s ILE 4 Cb -0.12 -0.13 0.01 0.00 0.13 0.00 0.00 42.46 42.34 1u02 s ILE 4 CO 0.13 0.13 -0.10 -0.36 -1.91 0.00 0.00 174.94 172.83 1u02 s PHE 5 N 1.51 2.92 -0.11 3.50 0.08 0.55 -0.77 117.98 125.65 1u02 s PHE 5 Ca -0.03 -1.29 0.03 0.00 0.12 0.00 0.00 56.93 55.76 1u02 s PHE 5 Cb -0.13 -2.03 0.01 0.00 -0.57 0.00 0.00 43.02 40.30 1u02 s PHE 5 CO -0.03 -0.67 -0.20 -0.51 -0.10 0.00 0.00 175.22 173.71 1u02 s LEU 6 N 1.39 1.97 0.73 -0.37 1.43 0.39 -1.57 118.68 122.65 1u02 s LEU 6 Ca 0.05 -0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 52.52 1u02 s LEU 6 Cb -0.14 -1.29 0.03 0.00 0.03 0.00 0.00 46.19 44.82 1u02 s LEU 6 CO -0.07 0.09 1.08 -0.62 0.23 0.00 0.00 176.35 177.06 1u02 s ASP 7 N 0.65 4.88 0.00 2.29 2.15 -0.64 -0.34 116.67 125.67 1u02 s ASP 7 Ca -0.12 1.76 0.00 0.00 0.43 0.00 0.00 52.55 54.62 1u02 s ASP 7 Cb -0.16 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 1u02 s ASP 7 CO 0.03 -1.78 0.00 0.00 -0.17 0.00 0.00 175.17 173.25 1u02 n TYR 8 N -3.27 0.00 -1.87 -5.34 9.36 -1.24 -3.90 117.16 110.90 1u02 n TYR 8 Ca 0.09 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.89 1u02 n TYR 8 Cb 0.53 -0.01 -0.03 0.00 -0.63 0.00 0.00 39.34 39.20 1u02 n TYR 8 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 1u02 s ASP 9 N -2.99 6.55 0.00 2.98 1.01 -1.26 -0.59 116.67 122.35 1u02 s ASP 9 Ca 0.00 2.60 0.00 0.00 0.71 0.00 0.00 52.55 55.86 1u02 s ASP 9 Cb 0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1u02 s ASP 9 CO 0.00 -0.90 0.00 0.61 0.21 0.00 0.00 175.17 175.09 1u02 n GLY 10 N 3.99 1.67 0.84 0.21 0.00 0.15 -4.78 105.19 107.27 1u02 n GLY 10 Ca 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.13 1u02 n GLY 10 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1u02 n THR 11 N -2.00 0.63 -0.05 2.61 -1.04 -0.72 -4.49 114.28 109.22 1u02 n THR 11 Ca 0.00 0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 1u02 n THR 11 Cb 0.00 -1.63 -0.15 0.00 -1.82 0.00 0.00 70.33 66.73 1u02 n THR 11 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1u02 n LEU 12 N -3.39 0.00 -4.21 -4.42 4.77 0.24 -4.26 117.00 105.73 1u02 n LEU 12 Ca -0.08 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.76 1u02 n LEU 12 Cb 0.42 0.24 -0.11 0.00 -2.33 0.00 0.00 43.42 41.64 1u02 n LEU 12 CO 0.02 0.24 -0.42 0.68 -1.33 0.00 0.00 177.39 176.58 1u02 s VAL 13 N -2.90 1.04 0.67 4.08 -7.23 -1.07 -4.90 120.40 110.08 1u02 s VAL 13 Ca -0.08 -1.80 -0.11 0.00 -1.81 0.00 0.00 61.98 58.18 1u02 s VAL 13 Cb 0.09 -1.55 -0.01 0.00 0.56 0.00 0.00 36.38 35.47 1u02 s VAL 13 CO 0.80 -0.62 1.05 -2.16 -0.31 0.00 0.00 175.10 173.85 1u02 s PRO 14 N -3.15 3.15 -0.03 4.82 0.04 -1.26 0.33 135.00 138.90 1u02 s PRO 14 Ca 0.10 0.89 -0.28 0.00 0.04 0.00 0.00 61.00 61.74 1u02 s PRO 14 Cb -0.01 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1u02 s PRO 14 CO 0.00 -0.93 0.92 0.42 0.04 0.00 0.00 177.00 177.45 1u02 s ILE 15 N -3.09 4.90 0.00 0.56 -1.09 -1.26 -4.37 121.20 116.86 1u02 s ILE 15 Ca 0.57 1.92 0.00 0.00 -2.23 0.00 0.00 60.65 60.91 1u02 s ILE 15 Cb -0.13 -4.26 0.00 0.00 -1.58 0.00 0.00 42.46 36.49 1u02 s ILE 15 CO 0.55 0.16 0.00 2.30 -1.23 0.00 0.00 174.94 176.72 1u02 n ILE 16 N 3.95 0.00 0.00 2.92 -5.35 -1.26 -5.03 119.36 114.59 1u02 n ILE 16 Ca 0.05 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.53 1u02 n ILE 16 Cb 0.51 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.41 1u02 n ILE 16 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1u02 n ASN 18 N 0.00 0.00 0.31 7.28 3.02 -1.26 -5.01 115.26 119.60 1u02 n ASN 18 Ca 0.00 0.00 0.17 0.00 -0.03 0.00 0.00 54.58 54.72 1u02 n ASN 18 Cb 0.00 0.00 0.90 0.00 -0.61 0.00 0.00 39.78 40.07 1u02 n ASN 18 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1u02 h PRO 19 N 0.00 0.00 0.00 3.52 0.13 -2.00 -1.26 132.00 132.39 1u02 h PRO 19 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1u02 h PRO 19 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1u02 h PRO 19 CO 0.00 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 178.82 1u02 h GLU 20 N 0.00 0.00 -0.02 0.86 9.09 -2.04 -3.02 114.58 119.45 1u02 h GLU 20 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.43 1u02 h GLU 20 Cb 0.55 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.65 1u02 h GLU 20 CO -0.00 0.00 -0.05 0.39 0.05 0.00 0.00 179.01 179.40 1u02 n GLU 21 N -2.34 1.64 -0.47 1.06 1.02 -0.48 -4.72 120.64 116.35 1u02 n GLU 21 Ca 0.03 -1.04 -0.05 0.00 -0.02 0.00 0.00 57.16 56.07 1u02 n GLU 21 Cb 0.28 -1.48 -0.08 0.00 -0.02 0.00 0.00 31.44 30.15 1u02 n GLU 21 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1u02 n SER 22 N 0.23 2.60 -4.79 1.62 7.64 -1.14 -4.89 113.62 114.89 1u02 n SER 22 Ca 0.17 -1.96 -0.36 0.00 1.01 0.00 0.00 58.87 57.73 1u02 n SER 22 Cb 0.39 -0.69 -0.04 0.00 -1.01 0.00 0.00 64.21 62.86 1u02 n SER 22 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1u02 s TYR 23 N 1.91 3.29 0.18 1.43 2.02 -1.26 -4.89 117.35 120.03 1u02 s TYR 23 Ca 0.30 1.65 -0.30 0.00 -0.37 0.00 0.00 57.07 58.35 1u02 s TYR 23 Cb 0.14 -3.08 -0.08 0.00 -0.40 0.00 0.00 41.96 38.55 1u02 s TYR 23 CO 0.00 -0.51 1.22 0.00 -1.57 0.00 0.00 175.55 174.69 1u02 s ALA 24 N -1.73 3.45 0.76 3.71 0.00 -0.47 -5.03 121.76 122.45 1u02 s ALA 24 Ca 0.58 0.98 -0.10 0.00 0.00 0.00 0.00 51.96 53.43 1u02 s ALA 24 Cb -0.20 -3.43 0.07 0.00 0.00 0.00 0.00 23.12 19.56 1u02 s ALA 24 CO 0.25 -0.41 1.10 0.16 0.00 0.00 0.00 175.76 176.87 1u02 s ASP 25 N 0.22 4.69 0.34 0.00 1.47 -1.26 -4.81 116.67 117.32 1u02 s ASP 25 Ca 0.54 0.67 0.10 0.00 1.18 0.00 0.00 52.55 55.04 1u02 s ASP 25 Cb -0.33 -1.25 0.87 0.00 -0.34 0.00 0.00 42.92 41.87 1u02 s ASP 25 CO 0.37 -1.74 1.79 0.00 0.68 0.00 0.00 175.17 176.26 1u02 h ALA 26 N -0.84 1.86 -0.40 2.11 0.00 -1.99 -1.30 119.26 118.70 1u02 h ALA 26 Ca -0.45 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1u02 h ALA 26 Cb 1.32 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1u02 h ALA 26 CO 0.64 -0.23 0.26 0.78 0.00 0.00 0.00 179.25 180.69 1u02 h GLY 27 N 0.63 0.56 1.24 0.00 0.00 -2.00 -1.11 103.07 102.40 1u02 h GLY 27 Ca 0.57 -0.22 -0.14 0.00 0.00 0.00 0.00 47.33 47.54 1u02 h GLY 27 CO -0.34 0.21 -0.33 -2.00 0.00 0.00 0.00 176.54 174.08 1u02 h LEU 28 N 0.54 0.88 -0.77 3.11 5.85 -1.68 -2.11 115.31 121.14 1u02 h LEU 28 Ca 0.15 -0.38 0.02 0.00 0.84 0.00 0.00 57.88 58.51 1u02 h LEU 28 Cb -0.05 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.69 1u02 h LEU 28 CO -0.03 1.13 0.50 -0.07 -0.34 0.00 0.00 178.44 179.63 1u02 h LEU 29 N 0.70 0.85 -0.18 2.25 3.38 -0.97 -1.08 115.31 120.26 1u02 h LEU 29 Ca 0.07 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1u02 h LEU 29 Cb 0.89 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1u02 h LEU 29 CO 0.08 0.60 -0.00 -1.28 0.09 0.00 0.00 178.44 177.93 1u02 h SER 30 N 1.00 0.32 -0.13 -0.43 0.87 -1.07 -0.72 113.55 113.39 1u02 h SER 30 Ca 0.29 -0.31 0.02 0.00 -1.23 0.00 0.00 61.79 60.56 1u02 h SER 30 Cb -0.07 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 1u02 h SER 30 CO -0.08 0.55 -0.01 -0.07 -0.53 0.00 0.00 176.83 176.69 1u02 h LEU 31 N 0.08 -0.07 -0.47 2.23 3.38 -1.09 -0.88 115.31 118.49 1u02 h LEU 31 Ca 0.05 0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.88 1u02 h LEU 31 Cb 0.39 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1u02 h LEU 31 CO 0.01 -0.02 -0.59 0.40 0.09 0.00 0.00 178.44 178.33 1u02 h ILE 32 N 0.03 1.33 -0.45 1.22 1.08 -1.24 -0.82 117.51 118.65 1u02 h ILE 32 Ca 0.06 -1.86 0.05 0.00 -0.39 0.00 0.00 64.86 62.72 1u02 h ILE 32 Cb 0.08 1.83 -0.05 0.00 -3.07 0.00 0.00 36.82 35.61 1u02 h ILE 32 CO -0.11 0.58 0.19 -1.28 -0.69 0.00 0.00 178.15 176.84 1u02 h SER 33 N 0.42 0.24 -0.04 1.72 0.87 -0.88 -0.30 113.55 115.57 1u02 h SER 33 Ca -0.00 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 1u02 h SER 33 Cb 1.15 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1u02 h SER 33 CO 0.11 0.17 -0.01 0.44 -0.53 0.00 0.00 176.83 177.01 1u02 h ASP 34 N 0.38 0.07 -0.70 6.23 3.32 -1.04 -3.28 116.42 121.41 1u02 h ASP 34 Ca 0.21 -0.39 0.09 0.00 0.02 0.00 0.00 57.03 56.96 1u02 h ASP 34 Cb 0.17 -0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.63 1u02 h ASP 34 CO -0.18 0.44 0.35 0.25 -1.72 0.00 0.00 179.24 178.38 1u02 h LEU 35 N -0.30 0.47 -1.28 1.55 5.85 -0.83 -1.73 115.31 119.04 1u02 h LEU 35 Ca 0.01 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1u02 h LEU 35 Cb 0.41 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1u02 h LEU 35 CO 0.00 0.27 0.00 0.07 -0.34 0.00 0.00 178.44 178.45 1u02 h LYS 36 N 0.61 0.00 0.00 1.25 5.09 -1.11 -0.43 116.57 121.98 1u02 h LYS 36 Ca 0.34 0.00 -0.12 0.00 0.09 0.00 0.00 60.65 60.96 1u02 h LYS 36 Cb 0.34 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.66 1u02 h LYS 36 CO -0.26 0.00 -0.57 0.93 -2.09 0.00 0.00 179.45 177.46 1u02 h GLU 37 N 0.00 0.00 0.00 0.07 4.39 -1.37 -3.35 114.58 114.32 1u02 h GLU 37 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1u02 h GLU 37 Cb 0.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1u02 h GLU 37 CO 0.00 0.57 -1.66 0.54 -1.16 0.00 0.00 179.01 177.30 1u02 n ARG 38 N -3.37 0.63 -4.16 2.33 1.74 -0.59 -5.02 116.66 108.22 1u02 n ARG 38 Ca 0.01 -0.11 -0.16 0.00 -0.77 0.00 0.00 57.85 56.82 1u02 n ARG 38 Cb 0.70 -1.33 -0.12 0.00 -1.02 0.00 0.00 32.46 30.70 1u02 n ARG 38 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1u02 s PHE 39 N -2.86 0.94 -0.64 -1.55 0.40 -0.27 -4.39 117.98 109.60 1u02 s PHE 39 Ca -0.05 -0.42 -0.27 0.00 -0.60 0.00 0.00 56.93 55.59 1u02 s PHE 39 Cb 0.08 -0.55 -0.00 0.00 0.51 0.00 0.00 43.02 43.06 1u02 s PHE 39 CO 0.56 -0.01 1.66 0.34 0.70 0.00 0.00 175.22 178.48 1u02 s ASP 40 N -1.42 5.60 -0.13 1.36 -1.08 -0.38 -4.34 116.67 116.28 1u02 s ASP 40 Ca -0.04 0.13 -0.12 0.00 -0.52 0.00 0.00 52.55 51.99 1u02 s ASP 40 Cb -0.09 -2.54 -0.05 0.00 -1.46 0.00 0.00 42.92 38.78 1u02 s ASP 40 CO 0.01 -2.16 0.27 -0.89 0.52 0.00 0.00 175.17 172.91 1u02 s THR 41 N 7.87 5.31 -0.06 1.71 2.01 -1.26 -2.20 115.64 129.01 1u02 s THR 41 Ca 0.57 0.50 0.04 0.00 0.31 0.00 0.00 61.69 63.11 1u02 s THR 41 Cb -0.11 -3.59 0.00 0.00 0.01 0.00 0.00 72.50 68.81 1u02 s THR 41 CO 0.20 0.47 -0.17 -0.31 -0.69 0.00 0.00 174.62 174.11 1u02 s TYR 42 N -0.09 1.83 -0.17 4.92 2.02 0.05 -2.57 117.35 123.34 1u02 s TYR 42 Ca 0.17 -0.64 -0.15 0.00 -0.37 0.00 0.00 57.07 56.07 1u02 s TYR 42 Cb -0.13 -1.26 -0.04 0.00 -0.40 0.00 0.00 41.96 40.12 1u02 s TYR 42 CO 0.05 -0.26 0.36 0.42 -1.57 0.00 0.00 175.55 174.55 1u02 s ILE 43 N 0.33 5.25 -0.20 2.71 -1.09 -0.61 -0.47 121.20 127.11 1u02 s ILE 43 Ca -0.11 0.67 -0.00 0.00 -2.23 0.00 0.00 60.65 58.98 1u02 s ILE 43 Cb -0.15 -3.70 0.02 0.00 -1.58 0.00 0.00 42.46 37.05 1u02 s ILE 43 CO 0.04 0.33 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.25 1u02 s VAL 44 N 0.81 2.46 0.26 2.92 1.01 0.53 -0.62 120.40 127.77 1u02 s VAL 44 Ca 0.19 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.17 1u02 s VAL 44 Cb -0.14 -2.12 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 1u02 s VAL 44 CO 0.07 0.43 0.45 0.28 0.00 0.00 0.00 175.10 176.32 1u02 s THR 45 N 1.32 0.00 -1.23 3.92 -1.32 -0.30 -3.69 115.64 114.35 1u02 s THR 45 Ca 0.04 -1.50 0.24 0.00 -1.21 0.00 0.00 61.69 59.25 1u02 s THR 45 Cb -0.14 -2.33 -0.04 0.00 -1.51 0.00 0.00 72.50 68.48 1u02 s THR 45 CO -0.09 0.00 1.22 0.61 -2.21 0.00 0.00 174.62 174.15 1u02 n GLY 46 N -0.40 -0.93 3.70 6.08 0.00 -1.26 -0.86 105.19 111.52 1u02 n GLY 46 Ca -0.01 -0.48 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 1u02 n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u02 s ARG 47 N -2.87 0.87 0.58 1.61 1.81 -1.26 -3.58 118.95 116.12 1u02 s ARG 47 Ca 0.13 0.71 -0.04 0.00 -1.72 0.00 0.00 55.73 54.80 1u02 s ARG 47 Cb 0.17 -1.77 0.02 0.00 -0.45 0.00 0.00 34.95 32.92 1u02 s ARG 47 CO 0.72 -2.48 0.87 -1.54 -0.68 0.00 0.00 175.30 172.19 1u02 s SER 48 N -3.41 5.46 0.32 0.23 1.04 -1.26 -1.40 113.70 114.68 1u02 s SER 48 Ca 0.64 0.51 0.06 0.00 0.48 0.00 0.00 55.95 57.64 1u02 s SER 48 Cb -0.18 -1.48 0.55 0.00 0.10 0.00 0.00 66.02 65.01 1u02 s SER 48 CO 0.57 -1.10 1.79 -0.65 0.98 0.00 0.00 173.24 174.83 1u02 h PRO 49 N -0.12 0.35 -0.59 4.02 0.11 -1.96 -2.16 132.00 131.65 1u02 h PRO 49 Ca -0.45 -0.12 -0.06 0.00 0.11 0.00 0.00 66.00 65.49 1u02 h PRO 49 Cb 1.27 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 1u02 h PRO 49 CO 0.59 0.57 0.14 0.93 -0.21 0.00 0.00 178.00 180.02 1u02 h GLU 50 N 0.32 0.93 0.22 1.05 3.07 -1.98 -0.18 114.58 117.99 1u02 h GLU 50 Ca 0.05 -0.20 -0.01 0.00 -0.50 0.00 0.00 59.36 58.70 1u02 h GLU 50 Cb 0.59 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 1u02 h GLU 50 CO 0.04 0.83 -0.11 0.93 -1.40 0.00 0.00 179.01 179.31 1u02 h GLU 51 N 0.89 -0.28 -0.65 2.33 5.08 -1.82 -2.86 114.58 117.27 1u02 h GLU 51 Ca 0.19 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.54 1u02 h GLU 51 Cb 0.33 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1u02 h GLU 51 CO 0.00 0.08 0.30 0.82 -1.00 0.00 0.00 179.01 179.21 1u02 h ILE 52 N -0.73 1.21 -0.73 3.13 1.08 -1.38 0.11 117.51 120.20 1u02 h ILE 52 Ca -0.03 -0.62 0.02 0.00 -0.39 0.00 0.00 64.86 63.83 1u02 h ILE 52 Cb 0.50 0.40 -0.04 0.00 -3.07 0.00 0.00 36.82 34.61 1u02 h ILE 52 CO 0.05 0.26 0.48 0.28 -0.69 0.00 0.00 178.15 178.53 1u02 h SER 53 N 0.92 0.82 0.48 1.72 0.02 -1.06 0.38 113.55 116.83 1u02 h SER 53 Ca 0.22 -0.02 -0.30 0.00 -0.84 0.00 0.00 61.79 60.86 1u02 h SER 53 Cb 0.12 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.42 1u02 h SER 53 CO -0.03 0.58 -1.65 0.08 -1.14 0.00 0.00 176.83 174.67 1u02 h ARG 54 N 0.96 0.08 -0.42 3.45 0.11 -1.20 -3.04 114.38 114.32 1u02 h ARG 54 Ca 0.27 -0.14 -0.07 0.00 0.10 0.00 0.00 59.98 60.14 1u02 h ARG 54 Cb -0.06 0.05 -0.02 0.00 1.11 0.00 0.00 29.97 31.05 1u02 h ARG 54 CO -0.07 0.77 0.00 0.74 0.10 0.00 0.00 179.97 181.51 1u02 h PHE 55 N 0.02 0.80 -2.46 4.08 0.04 -0.45 -3.37 116.94 115.60 1u02 h PHE 55 Ca -0.27 -0.14 -0.59 0.00 2.80 0.00 0.00 57.97 59.77 1u02 h PHE 55 Cb 1.99 -0.21 -0.40 0.00 2.20 0.00 0.00 35.95 39.53 1u02 h PHE 55 CO 0.02 0.80 -0.83 -0.11 -0.60 0.00 0.00 178.31 177.60 1u02 n LEU 56 N -4.43 1.34 -2.99 1.54 7.94 0.13 -1.37 117.00 119.17 1u02 n LEU 56 Ca -0.01 -4.85 -0.19 0.00 -1.11 0.00 0.00 56.01 49.86 1u02 n LEU 56 Cb 0.29 -0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.21 1u02 n LEU 56 CO 0.41 1.91 2.10 -0.81 -1.11 0.00 0.00 177.39 179.89 1u02 n PRO 57 N 1.96 1.87 -4.34 1.96 -0.04 -1.15 -4.61 135.00 130.65 1u02 n PRO 57 Ca 0.25 -1.27 -0.24 0.00 -0.04 0.00 0.00 63.50 62.20 1u02 n PRO 57 Cb 0.44 -2.31 -0.08 0.00 -0.04 0.00 0.00 33.50 31.50 1u02 n PRO 57 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1u02 s LEU 58 N 0.08 2.97 -1.17 1.53 1.43 -1.26 -5.05 118.68 117.20 1u02 s LEU 58 Ca 0.38 -0.95 -0.18 0.00 -1.03 0.00 0.00 54.13 52.35 1u02 s LEU 58 Cb 0.11 -1.37 0.09 0.00 0.03 0.00 0.00 46.19 45.05 1u02 s LEU 58 CO -0.03 -0.19 1.54 -0.62 0.23 0.00 0.00 176.35 177.28 1u02 s ASP 59 N -3.69 6.78 0.07 2.29 2.15 -1.26 -4.92 116.67 118.09 1u02 s ASP 59 Ca 0.34 -2.26 -0.02 0.00 0.43 0.00 0.00 52.55 51.04 1u02 s ASP 59 Cb -0.01 -2.52 -0.04 0.00 -0.30 0.00 0.00 42.92 40.05 1u02 s ASP 59 CO 0.19 -1.16 0.02 0.27 -0.17 0.00 0.00 175.17 174.32 1u02 s ILE 60 N 3.71 0.18 0.00 4.11 -5.25 -1.26 -5.01 121.20 117.69 1u02 s ILE 60 Ca 0.47 -1.76 0.00 0.00 -0.99 0.00 0.00 60.65 58.37 1u02 s ILE 60 Cb 0.01 -1.62 0.00 0.00 2.95 0.00 0.00 42.46 43.79 1u02 s ILE 60 CO -0.00 -0.83 0.00 0.59 -1.79 0.00 0.00 174.94 172.91 1u02 n ASN 61 N 0.04 0.00 -3.33 4.36 3.02 -1.06 -4.87 115.26 113.41 1u02 n ASN 61 Ca -0.12 -0.97 -0.08 0.00 -0.03 0.00 0.00 54.58 53.38 1u02 n ASN 61 Cb 0.62 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.71 1u02 n ASN 61 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1u02 s ILE 63 N -0.16 -0.64 0.40 2.41 1.01 0.21 -1.58 121.20 122.86 1u02 s ILE 63 Ca 0.00 -0.06 0.08 0.00 0.00 0.00 0.00 60.65 60.66 1u02 s ILE 63 Cb 0.00 -0.83 -0.03 0.00 0.01 0.00 0.00 42.46 41.62 1u02 s ILE 63 CO 0.00 -0.11 0.34 0.00 0.00 0.00 0.00 174.94 175.17 1u02 n TYR 65 N -1.48 -2.08 -1.71 0.00 4.01 -0.50 -0.18 117.16 115.23 1u02 n TYR 65 Ca 0.02 0.71 -0.20 0.00 -0.16 0.00 0.00 57.90 58.27 1u02 n TYR 65 Cb 0.62 -3.68 -0.07 0.00 -0.31 0.00 0.00 39.34 35.89 1u02 n TYR 65 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1u02 n HIS 66 N -4.41 -0.23 0.00 -0.72 8.25 -0.04 -2.45 115.22 115.62 1u02 n HIS 66 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1u02 n HIS 66 Cb 0.54 -3.43 0.00 0.00 1.12 0.00 0.00 29.99 28.22 1u02 n HIS 66 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1u02 n GLY 67 N -0.47 1.33 0.21 -1.41 0.00 0.75 -1.87 105.19 103.73 1u02 n GLY 67 Ca -0.20 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.87 1u02 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u02 h ALA 68 N 0.00 1.45 -2.88 4.61 0.00 -1.13 -3.42 119.26 117.89 1u02 h ALA 68 Ca 0.00 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 1u02 h ALA 68 Cb 0.00 -0.04 -0.23 0.00 0.00 0.00 0.00 17.79 17.51 1u02 h ALA 68 CO 0.00 0.32 -0.36 0.00 0.00 0.00 0.00 179.25 179.21 1u02 s SER 70 N -0.35 2.53 -0.26 0.00 0.01 0.54 0.07 113.70 116.23 1u02 s SER 70 Ca -0.05 -1.01 0.01 0.00 1.31 0.00 0.00 55.95 56.21 1u02 s SER 70 Cb -0.03 -0.13 0.07 0.00 0.21 0.00 0.00 66.02 66.14 1u02 s SER 70 CO 0.01 -0.17 -0.00 -0.75 0.41 0.00 0.00 173.24 172.74 1u02 s LYS 71 N -3.59 1.36 -0.15 12.44 2.20 -1.26 0.29 119.74 131.04 1u02 s LYS 71 Ca 0.22 -1.12 0.02 0.00 -0.36 0.00 0.00 55.97 54.73 1u02 s LYS 71 Cb -0.01 -2.54 0.01 0.00 -1.51 0.00 0.00 37.83 33.78 1u02 s LYS 71 CO 0.06 -0.73 -0.21 0.42 -0.36 0.00 0.00 175.35 174.53 1u02 s ILE 72 N 1.39 2.13 -1.44 5.43 -1.09 -0.46 -4.52 121.20 122.64 1u02 s ILE 72 Ca 0.00 -0.95 -0.02 0.00 -2.23 0.00 0.00 60.65 57.45 1u02 s ILE 72 Cb -0.18 -1.86 0.01 0.00 -1.58 0.00 0.00 42.46 38.85 1u02 s ILE 72 CO -0.10 0.54 0.18 0.59 -1.23 0.00 0.00 174.94 174.93 1u02 n ASN 73 N 4.14 -5.03 0.00 3.58 3.02 -1.26 -0.65 115.26 119.06 1u02 n ASN 73 Ca -0.20 -0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.30 1u02 n ASN 73 Cb 0.51 -4.17 0.00 0.00 -0.61 0.00 0.00 39.78 35.51 1u02 n ASN 73 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1u02 n GLY 74 N -1.07 2.22 3.72 7.41 0.00 -1.26 -5.02 105.19 111.18 1u02 n GLY 74 Ca -0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 1u02 n GLY 74 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1u02 s GLN 75 N -0.36 4.42 -0.44 1.61 0.74 0.18 -5.01 119.66 120.80 1u02 s GLN 75 Ca 0.00 0.82 -0.29 0.00 0.05 0.00 0.00 55.36 55.94 1u02 s GLN 75 Cb 0.00 -3.45 0.02 0.00 1.10 0.00 0.00 33.01 30.68 1u02 s GLN 75 CO 0.00 0.07 1.19 0.42 -0.55 0.00 0.00 175.29 176.42 1u02 s ILE 76 N 0.81 4.18 -0.30 -2.34 -1.09 -1.26 -1.36 121.20 119.85 1u02 s ILE 76 Ca 0.36 1.23 -0.03 0.00 -2.23 0.00 0.00 60.65 59.98 1u02 s ILE 76 Cb -0.17 -4.49 0.04 0.00 -1.58 0.00 0.00 42.46 36.26 1u02 s ILE 76 CO 0.17 -0.88 0.02 -0.69 -1.23 0.00 0.00 174.94 172.33 1u02 s VAL 77 N 4.55 3.23 0.11 2.92 1.01 0.14 -4.98 120.40 127.38 1u02 s VAL 77 Ca 0.51 -1.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 1u02 s VAL 77 Cb -0.09 -2.79 -0.06 0.00 0.00 0.00 0.00 36.38 33.44 1u02 s VAL 77 CO 0.30 -0.04 1.03 -0.31 0.00 0.00 0.00 175.10 176.08 1u02 s TYR 78 N 1.32 3.69 0.07 5.22 2.02 -1.26 -0.34 117.35 128.07 1u02 s TYR 78 Ca -0.03 1.67 0.03 0.00 -0.37 0.00 0.00 57.07 58.38 1u02 s TYR 78 Cb -0.19 -3.17 -0.04 0.00 -0.40 0.00 0.00 41.96 38.16 1u02 s TYR 78 CO -0.01 -0.23 0.06 -0.80 -1.57 0.00 0.00 175.55 173.01 1u02 s ASN 79 N 0.22 5.41 -1.39 2.29 0.02 0.10 -4.55 114.94 117.04 1u02 s ASN 79 Ca 0.50 -0.04 -0.04 0.00 -1.02 0.00 0.00 52.86 52.26 1u02 s ASN 79 Cb -0.25 -1.42 0.02 0.00 0.02 0.00 0.00 41.25 39.62 1u02 s ASN 79 CO 0.31 0.18 0.32 0.59 0.02 0.00 0.00 177.10 178.52 1u02 n ASN 80 N 0.55 -4.86 -2.60 -1.22 5.03 -1.26 -1.55 115.26 109.36 1u02 n ASN 80 Ca -0.09 -0.15 -0.20 0.00 0.87 0.00 0.00 54.58 55.01 1u02 n ASN 80 Cb 0.52 -4.01 0.00 0.00 -1.02 0.00 0.00 39.78 35.27 1u02 n ASN 80 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1u02 n GLY 81 N -1.16 -0.50 0.31 7.41 0.00 -1.26 -4.86 105.19 105.11 1u02 n GLY 81 Ca -0.12 0.04 0.19 0.00 0.00 0.00 0.00 46.02 46.13 1u02 n GLY 81 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1u02 h SER 82 N -0.37 0.00 0.25 1.61 4.64 -1.54 -2.26 113.55 115.88 1u02 h SER 82 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1u02 h SER 82 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1u02 h SER 82 CO 0.54 0.02 0.00 -0.90 -0.87 0.00 0.00 176.83 175.62 1u02 n ASP 83 N -3.23 0.34 0.29 4.97 5.75 -1.26 -1.00 116.55 122.41 1u02 n ASP 83 Ca -0.02 0.63 0.19 0.00 -0.01 0.00 0.00 54.79 55.58 1u02 n ASP 83 Cb 0.17 -0.68 0.87 0.00 -1.03 0.00 0.00 41.12 40.44 1u02 n ASP 83 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1u02 h ARG 84 N 0.00 0.00 -0.05 0.11 3.08 -1.79 -2.59 114.38 113.13 1u02 h ARG 84 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1u02 h ARG 84 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1u02 h ARG 84 CO 0.00 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.09 1u02 n PHE 85 N -3.04 0.04 -0.18 3.04 3.72 -0.17 -4.48 117.46 116.39 1u02 n PHE 85 Ca -0.01 -0.02 -0.03 0.00 -0.05 0.00 0.00 57.45 57.34 1u02 n PHE 85 Cb 0.22 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.83 1u02 n PHE 85 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1u02 h LEU 86 N 3.08 0.32 -1.07 4.37 3.38 -1.61 -1.92 115.31 121.85 1u02 h LEU 86 Ca 0.00 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1u02 h LEU 86 Cb 0.66 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1u02 h LEU 86 CO 0.00 0.21 -0.36 1.23 0.09 0.00 0.00 178.44 179.61 1u02 h GLY 87 N 0.47 0.20 0.93 0.83 0.00 -1.83 -3.05 103.07 100.62 1u02 h GLY 87 Ca 0.25 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 1u02 h GLY 87 CO -0.20 0.16 -0.14 -2.08 0.00 0.00 0.00 176.54 174.28 1u02 h VAL 88 N 0.16 0.73 0.00 4.60 2.07 -1.64 -2.27 116.25 119.90 1u02 h VAL 88 Ca 0.02 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 1u02 h VAL 88 Cb 0.72 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1u02 h VAL 88 CO 0.05 0.03 -0.14 -0.26 0.02 0.00 0.00 177.57 177.28 1u02 h PHE 89 N -0.47 0.00 -0.28 1.57 0.04 -1.46 0.38 116.94 116.72 1u02 h PHE 89 Ca -0.04 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.67 1u02 h PHE 89 Cb 0.36 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 1u02 h PHE 89 CO -0.04 0.14 -0.04 -0.44 -0.60 0.00 0.00 178.31 177.33 1u02 h ASP 90 N 0.00 0.52 -0.47 2.17 3.32 -1.39 -2.12 116.42 118.45 1u02 h ASP 90 Ca -0.00 -0.34 -0.10 0.00 0.02 0.00 0.00 57.03 56.60 1u02 h ASP 90 Cb 0.35 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1u02 h ASP 90 CO 0.02 0.74 -0.09 0.03 -1.72 0.00 0.00 179.24 178.22 1u02 h ARG 91 N 0.29 0.94 -0.53 3.56 3.08 -0.76 -1.82 114.38 119.15 1u02 h ARG 91 Ca 0.07 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 59.80 1u02 h ARG 91 Cb 0.50 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 1u02 h ARG 91 CO 0.02 0.98 0.33 0.82 -1.07 0.00 0.00 179.97 181.05 1u02 h ILE 92 N 0.85 1.15 -0.31 2.04 2.04 -0.85 -0.09 117.51 122.33 1u02 h ILE 92 Ca 0.14 -0.33 -0.04 0.00 1.00 0.00 0.00 64.86 65.63 1u02 h ILE 92 Cb 0.62 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1u02 h ILE 92 CO 0.04 0.15 0.05 0.22 0.00 0.00 0.00 178.15 178.62 1u02 h TYR 93 N 0.71 0.55 -0.91 1.37 3.20 -1.24 -1.45 116.97 119.21 1u02 h TYR 93 Ca 0.19 -0.08 0.01 0.00 3.14 0.00 0.00 58.73 62.00 1u02 h TYR 93 Cb -0.03 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.04 1u02 h TYR 93 CO -0.03 0.60 0.60 1.49 -1.64 0.00 0.00 178.16 179.18 1u02 h GLU 94 N 0.35 1.17 0.00 1.82 4.57 -1.02 0.22 114.58 121.69 1u02 h GLU 94 Ca 0.10 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1u02 h GLU 94 Cb 0.34 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1u02 h GLU 94 CO 0.01 0.78 -0.04 -0.44 -1.18 0.00 0.00 179.01 178.14 1u02 h ASP 95 N 1.21 0.00 -0.00 1.04 3.32 -0.87 -3.35 116.42 117.76 1u02 h ASP 95 Ca 0.34 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1u02 h ASP 95 Cb -0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1u02 h ASP 95 CO -0.08 0.01 -0.08 0.35 -1.72 0.00 0.00 179.24 177.72 1u02 n THR 96 N -2.35 0.00 0.09 0.35 -2.24 -0.56 -4.71 114.28 104.86 1u02 n THR 96 Ca 0.05 -0.46 0.16 0.00 -2.27 0.00 0.00 64.05 61.53 1u02 n THR 96 Cb 0.44 1.01 0.68 0.00 -2.10 0.00 0.00 70.33 70.36 1u02 n THR 96 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1u02 h ARG 97 N 0.07 0.00 0.00 -0.78 0.11 -0.71 -0.83 114.38 112.24 1u02 h ARG 97 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1u02 h ARG 97 Cb 0.05 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.13 1u02 h ARG 97 CO 0.00 0.00 0.00 -1.13 0.10 0.00 0.00 179.97 178.94 1u02 n SER 98 N -4.41 0.12 0.20 0.08 3.41 -1.26 -2.99 113.62 108.77 1u02 n SER 98 Ca 0.05 0.53 0.14 0.00 -0.26 0.00 0.00 58.87 59.33 1u02 n SER 98 Cb 0.43 -0.55 0.68 0.00 -0.26 0.00 0.00 64.21 64.50 1u02 n SER 98 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1u02 h TRP 99 N 0.00 0.00 0.00 7.33 6.55 -1.49 -1.90 115.95 126.43 1u02 h TRP 99 Ca 0.00 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 1u02 h TRP 99 Cb 0.28 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.58 1u02 h TRP 99 CO 0.00 0.00 -0.07 -0.39 -1.05 0.00 0.00 178.44 176.93 1u02 h VAL 100 N 0.00 0.63 0.00 1.49 -1.51 -1.76 0.51 116.25 115.61 1u02 h VAL 100 Ca 0.00 -0.28 -0.31 0.00 -1.23 0.00 0.00 66.70 64.88 1u02 h VAL 100 Cb 0.19 1.17 -0.05 0.00 -2.13 0.00 0.00 31.29 30.47 1u02 h VAL 100 CO 0.00 0.07 -1.83 -1.54 -1.23 0.00 0.00 177.57 173.03 1u02 n SER 101 N -3.85 0.73 0.06 4.19 3.41 -0.72 -3.48 113.62 113.96 1u02 n SER 101 Ca -0.02 0.34 -0.04 0.00 -0.26 0.00 0.00 58.87 58.89 1u02 n SER 101 Cb 0.16 0.12 0.18 0.00 -0.26 0.00 0.00 64.21 64.41 1u02 n SER 101 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1u02 h ASP 102 N 0.00 0.36 -2.57 4.04 3.32 -1.36 -3.34 116.42 116.86 1u02 h ASP 102 Ca -0.33 -0.16 -0.60 0.00 0.02 0.00 0.00 57.03 55.96 1u02 h ASP 102 Cb 2.06 -0.10 -0.41 0.00 0.22 0.00 0.00 39.33 41.10 1u02 h ASP 102 CO 0.07 0.74 -0.74 0.49 -1.72 0.00 0.00 179.24 178.07 1u02 n PHE 103 N -4.02 1.85 -1.66 4.55 3.72 0.11 -5.09 117.46 116.91 1u02 n PHE 103 Ca -0.02 -3.94 -0.58 0.00 -0.05 0.00 0.00 57.45 52.87 1u02 n PHE 103 Cb 0.49 -0.36 -0.07 0.00 -0.94 0.00 0.00 39.48 38.60 1u02 n PHE 103 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1u02 n PRO 104 N 1.86 0.85 0.00 -1.08 -0.02 -1.23 -0.93 135.00 134.46 1u02 n PRO 104 Ca 0.25 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1u02 n PRO 104 Cb 0.42 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1u02 n PRO 104 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u02 n GLY 105 N 3.46 1.38 3.77 -1.23 0.00 -1.26 -4.28 105.19 107.02 1u02 n GLY 105 Ca 0.24 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1u02 n GLY 105 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1u02 s LEU 106 N 0.00 4.34 -0.03 0.99 2.96 -0.10 -4.14 118.68 122.69 1u02 s LEU 106 Ca 0.00 2.97 0.06 0.00 -0.22 0.00 0.00 54.13 56.95 1u02 s LEU 106 Cb 0.00 -3.65 -0.01 0.00 0.50 0.00 0.00 46.19 43.02 1u02 s LEU 106 CO 0.00 -0.86 -0.22 -0.13 -1.32 0.00 0.00 176.35 173.81 1u02 s ARG 107 N -1.39 2.06 -0.17 1.98 0.52 -0.90 -4.73 118.95 116.32 1u02 s ARG 107 Ca 0.57 -0.81 0.01 0.00 -0.52 0.00 0.00 55.73 54.98 1u02 s ARG 107 Cb -0.46 -1.86 0.02 0.00 0.52 0.00 0.00 34.95 33.16 1u02 s ARG 107 CO 0.56 0.41 -0.19 0.42 0.02 0.00 0.00 175.30 176.52 1u02 s ILE 108 N -0.31 1.95 -0.34 1.52 1.01 -1.26 -0.61 121.20 123.15 1u02 s ILE 108 Ca 0.03 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 59.71 1u02 s ILE 108 Cb -0.11 -1.77 0.02 0.00 0.01 0.00 0.00 42.46 40.62 1u02 s ILE 108 CO 0.01 0.52 0.15 -0.31 0.00 0.00 0.00 174.94 175.32 1u02 s TYR 109 N 1.27 3.22 0.07 3.97 2.02 0.05 -4.97 117.35 122.97 1u02 s TYR 109 Ca 0.03 -1.02 -0.24 0.00 -0.37 0.00 0.00 57.07 55.47 1u02 s TYR 109 Cb -0.13 -2.36 -0.06 0.00 -0.40 0.00 0.00 41.96 39.01 1u02 s TYR 109 CO -0.11 -0.63 0.72 0.50 -1.57 0.00 0.00 175.55 174.46 1u02 s ARG 110 N 1.52 4.46 0.05 -0.62 3.52 -1.26 -1.45 118.95 125.16 1u02 s ARG 110 Ca 0.02 1.01 -0.03 0.00 -0.13 0.00 0.00 55.73 56.60 1u02 s ARG 110 Cb -0.19 -3.32 -0.03 0.00 -1.56 0.00 0.00 34.95 29.85 1u02 s ARG 110 CO 0.05 0.40 0.02 0.15 -0.81 0.00 0.00 175.30 175.11 1u02 s LYS 111 N -0.43 0.62 0.41 5.12 1.02 -0.19 -5.01 119.74 121.26 1u02 s LYS 111 Ca 0.36 -1.08 0.08 0.00 0.02 0.00 0.00 55.97 55.35 1u02 s LYS 111 Cb -0.21 0.22 0.87 0.00 -0.52 0.00 0.00 37.83 38.20 1u02 s LYS 111 CO 0.22 -0.13 2.02 -0.91 -0.92 0.00 0.00 175.35 175.63 1u02 h ASN 112 N 3.27 0.49 0.00 2.83 2.35 -1.96 -3.08 115.58 119.47 1u02 h ASN 112 Ca -0.34 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.39 1u02 h ASN 112 Cb 1.16 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 39.38 1u02 h ASN 112 CO 0.61 0.33 -0.43 0.18 -1.65 0.00 0.00 177.43 176.47 1u02 n LEU 113 N -4.47 2.33 -3.61 1.61 4.77 -1.26 -4.58 117.00 111.78 1u02 n LEU 113 Ca 0.06 -3.39 -0.05 0.00 -0.03 0.00 0.00 56.01 52.60 1u02 n LEU 113 Cb 0.17 -0.43 -0.04 0.00 -2.33 0.00 0.00 43.42 40.79 1u02 n LEU 113 CO 0.35 1.10 1.02 0.00 -1.33 0.00 0.00 177.39 178.52 1u02 s ALA 114 N -2.68 -2.06 -0.12 -1.18 0.00 -1.17 -4.04 121.76 110.52 1u02 s ALA 114 Ca 0.35 1.74 -0.01 0.00 0.00 0.00 0.00 51.96 54.04 1u02 s ALA 114 Cb 0.33 -0.98 0.03 0.00 0.00 0.00 0.00 23.12 22.51 1u02 s ALA 114 CO -0.05 -0.34 -0.04 0.08 0.00 0.00 0.00 175.76 175.40 1u02 s VAL 115 N -1.37 0.84 -0.21 0.00 1.01 -0.93 -1.03 120.40 118.72 1u02 s VAL 115 Ca 0.06 -0.27 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 1u02 s VAL 115 Cb -0.01 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 1u02 s VAL 115 CO -0.05 0.25 0.08 -0.22 0.00 0.00 0.00 175.10 175.17 1u02 s LEU 116 N 1.77 3.73 -0.28 3.92 0.20 -0.53 -1.44 118.68 126.04 1u02 s LEU 116 Ca 0.04 -0.02 -0.09 0.00 0.69 0.00 0.00 54.13 54.75 1u02 s LEU 116 Cb -0.13 -1.97 -0.03 0.00 -0.43 0.00 0.00 46.19 43.63 1u02 s LEU 116 CO -0.07 0.09 0.14 -0.31 -0.29 0.00 0.00 176.35 175.90 1u02 s TYR 117 N 0.90 3.16 -0.29 5.38 2.02 0.50 -0.77 117.35 128.25 1u02 s TYR 117 Ca 0.04 -0.30 -0.10 0.00 -0.37 0.00 0.00 57.07 56.34 1u02 s TYR 117 Cb -0.14 -2.33 -0.03 0.00 -0.40 0.00 0.00 41.96 39.06 1u02 s TYR 117 CO 0.03 -0.33 0.16 -1.58 -1.57 0.00 0.00 175.55 172.26 1u02 s HIS 118 N 1.66 3.18 -2.17 2.71 2.46 0.22 -1.61 115.29 121.75 1u02 s HIS 118 Ca 0.06 -0.14 0.21 0.00 0.47 0.00 0.00 55.06 55.65 1u02 s HIS 118 Cb -0.16 -2.36 0.54 0.00 -0.13 0.00 0.00 32.58 30.47 1u02 s HIS 118 CO 0.07 -0.27 1.46 1.28 -2.47 0.00 0.00 174.74 174.80 1u02 n LEU 119 N 5.02 3.23 -0.27 8.88 4.32 -1.26 -2.12 117.00 134.80 1u02 n LEU 119 Ca -0.14 -1.53 0.06 0.00 -0.02 0.00 0.00 56.01 54.38 1u02 n LEU 119 Cb 0.51 -0.34 0.20 0.00 -1.62 0.00 0.00 43.42 42.17 1u02 n LEU 119 CO 0.33 0.77 1.06 1.23 -1.22 0.00 0.00 177.39 179.55 1u02 h GLY 120 N 4.64 1.25 -5.59 -0.72 0.00 -1.93 -3.45 103.07 97.27 1u02 h GLY 120 Ca 0.00 -0.20 -0.73 0.00 0.00 0.00 0.00 47.33 46.40 1u02 h GLY 120 CO 0.00 -0.06 1.52 1.04 0.00 0.00 0.00 176.54 179.03 1u02 n LEU 121 N -4.94 7.54 -4.63 3.11 4.77 -1.26 -5.11 117.00 116.48 1u02 n LEU 121 Ca 0.15 -4.92 -0.30 0.00 -0.03 0.00 0.00 56.01 50.92 1u02 n LEU 121 Cb 0.42 -1.25 -0.09 0.00 -2.33 0.00 0.00 43.42 40.17 1u02 n LEU 121 CO 0.20 1.98 -0.38 -0.83 -1.33 0.00 0.00 177.39 177.03 1u02 s GLY 123 N -0.33 1.85 0.11 -0.72 0.00 -1.26 -4.59 107.32 102.38 1u02 s GLY 123 Ca 0.50 -1.16 -0.18 0.00 0.00 0.00 0.00 44.72 43.88 1u02 s GLY 123 CO -0.16 -1.13 1.65 0.00 0.00 0.00 0.00 173.10 173.46 1u02 h ALA 124 N 3.63 0.39 0.00 3.20 0.00 -2.00 -3.37 119.26 121.11 1u02 h ALA 124 Ca -0.48 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1u02 h ALA 124 Cb 1.17 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1u02 h ALA 124 CO 0.56 -0.01 0.00 -0.25 0.00 0.00 0.00 179.25 179.54 1u02 n ASP 125 N -4.74 0.00 0.00 0.00 8.00 -1.26 -4.58 116.55 113.97 1u02 n ASP 125 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 1u02 n ASP 125 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 1u02 n ASP 125 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1u02 n LYS 127 N 0.34 0.00 -0.22 -1.24 5.02 -1.26 -4.73 118.16 116.06 1u02 n LYS 127 Ca 0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.26 1u02 n LYS 127 Cb 0.00 -0.16 0.16 0.00 -0.02 0.00 0.00 35.03 35.01 1u02 n LYS 127 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1u02 h PRO 128 N 0.00 1.03 -0.29 1.97 0.11 -1.97 0.44 132.00 133.28 1u02 h PRO 128 Ca 0.00 -0.15 -0.02 0.00 0.11 0.00 0.00 66.00 65.94 1u02 h PRO 128 Cb 0.00 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 30.91 1u02 h PRO 128 CO 0.00 0.80 0.09 -0.22 -0.21 0.00 0.00 178.00 178.46 1u02 h LYS 129 N 1.02 0.45 -0.51 1.05 3.64 -1.96 -2.02 116.57 118.24 1u02 h LYS 129 Ca 0.25 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1u02 h LYS 129 Cb 0.12 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1u02 h LYS 129 CO -0.03 0.51 0.24 1.25 -2.27 0.00 0.00 179.45 179.15 1u02 h LEU 130 N 0.31 0.67 -0.62 5.20 5.85 -1.89 -2.05 115.31 122.78 1u02 h LEU 130 Ca 0.09 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.75 1u02 h LEU 130 Cb 0.25 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 1u02 h LEU 130 CO -0.00 0.62 0.30 -0.09 -0.34 0.00 0.00 178.44 178.93 1u02 h ARG 131 N 0.68 0.53 -0.33 1.25 2.43 -0.74 -0.54 114.38 117.66 1u02 h ARG 131 Ca 0.17 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 1u02 h ARG 131 Cb 0.13 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1u02 h ARG 131 CO -0.02 0.35 -0.10 0.66 -1.51 0.00 0.00 179.97 179.36 1u02 h SER 132 N 0.55 0.54 -0.38 -3.80 4.64 -1.07 -1.52 113.55 112.51 1u02 h SER 132 Ca 0.29 -0.14 -0.05 0.00 -0.47 0.00 0.00 61.79 61.42 1u02 h SER 132 Cb 0.26 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1u02 h SER 132 CO -0.23 0.68 0.03 0.03 -0.87 0.00 0.00 176.83 176.47 1u02 h ARG 133 N 0.52 0.65 -0.55 4.77 3.08 -0.57 -1.65 114.38 120.64 1u02 h ARG 133 Ca 0.10 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1u02 h ARG 133 Cb 0.48 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 1u02 h ARG 133 CO 0.03 0.73 0.30 0.82 -1.07 0.00 0.00 179.97 180.77 1u02 h ILE 134 N 0.48 1.18 -0.26 2.04 2.04 -0.83 -1.57 117.51 120.60 1u02 h ILE 134 Ca 0.11 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.45 1u02 h ILE 134 Cb 0.42 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1u02 h ILE 134 CO 0.01 0.20 -0.04 -0.33 0.00 0.00 0.00 178.15 178.00 1u02 h GLU 135 N 0.73 0.40 -0.35 2.37 5.08 -1.16 -0.64 114.58 121.01 1u02 h GLU 135 Ca 0.19 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 1u02 h GLU 135 Cb 0.05 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1u02 h GLU 135 CO -0.03 0.46 -0.04 1.49 -1.00 0.00 0.00 179.01 179.89 1u02 h GLU 136 N 0.38 0.65 -0.88 2.33 4.81 -0.76 -1.52 114.58 119.59 1u02 h GLU 136 Ca 0.08 -0.23 -0.02 0.00 -0.13 0.00 0.00 59.36 59.06 1u02 h GLU 136 Cb 0.32 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 1u02 h GLU 136 CO 0.01 0.79 0.46 0.82 -0.73 0.00 0.00 179.01 180.36 1u02 h ILE 137 N 0.46 1.26 -0.72 2.32 1.08 -0.77 -0.67 117.51 120.47 1u02 h ILE 137 Ca 0.10 -0.69 0.00 0.00 -0.39 0.00 0.00 64.86 63.88 1u02 h ILE 137 Cb 0.52 0.10 -0.04 0.00 -3.07 0.00 0.00 36.82 34.34 1u02 h ILE 137 CO 0.03 0.30 0.46 0.00 -0.69 0.00 0.00 178.15 178.25 1u02 h ALA 138 N 1.25 0.91 -0.37 1.87 0.00 -0.81 -1.04 119.26 121.06 1u02 h ALA 138 Ca 0.31 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 1u02 h ALA 138 Cb 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1u02 h ALA 138 CO -0.04 0.35 -0.31 0.00 0.00 0.00 0.00 179.25 179.25 1u02 h ARG 139 N 0.97 0.87 -0.26 0.00 3.08 -0.87 0.56 114.38 118.73 1u02 h ARG 139 Ca 0.26 -0.44 0.01 0.00 0.07 0.00 0.00 59.98 59.88 1u02 h ARG 139 Cb -0.08 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 1u02 h ARG 139 CO -0.05 1.08 0.16 0.82 -1.07 0.00 0.00 179.97 180.91 1u02 h ILE 140 N 0.67 1.04 -0.01 2.04 2.04 -0.76 -2.99 117.51 119.56 1u02 h ILE 140 Ca 0.07 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1u02 h ILE 140 Cb 0.89 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 1u02 h ILE 140 CO 0.08 0.06 -0.22 0.49 0.00 0.00 0.00 178.15 178.56 1u02 n PHE 141 N -4.93 0.00 -2.92 1.37 3.72 -0.43 -4.96 117.46 109.31 1u02 n PHE 141 Ca -0.02 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.25 1u02 n PHE 141 Cb 0.04 -0.12 0.03 0.00 -0.94 0.00 0.00 39.48 38.50 1u02 n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1u02 n GLY 142 N 1.32 0.06 3.85 1.37 0.00 0.05 -5.04 105.19 106.80 1u02 n GLY 142 Ca 0.13 -0.21 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 1u02 n GLY 142 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1u02 s VAL 143 N -3.05 1.95 0.01 1.61 -7.23 -0.39 -4.78 120.40 108.51 1u02 s VAL 143 Ca 0.26 -1.55 -0.00 0.00 -1.81 0.00 0.00 61.98 58.87 1u02 s VAL 143 Cb -0.11 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 1u02 s VAL 143 CO 0.32 0.00 0.09 -0.70 -0.31 0.00 0.00 175.10 174.50 1u02 s GLU 144 N -4.13 3.08 -0.14 4.82 2.12 -0.41 -4.61 118.70 119.43 1u02 s GLU 144 Ca 0.36 -0.50 -0.03 0.00 0.36 0.00 0.00 54.97 55.17 1u02 s GLU 144 Cb -0.01 -2.86 -0.03 0.00 0.26 0.00 0.00 34.13 31.49 1u02 s GLU 144 CO 0.21 0.64 -0.04 0.99 -0.54 0.00 0.00 175.26 176.52 1u02 s THR 145 N -1.23 3.85 -0.08 -1.70 2.01 -1.26 -0.51 115.64 116.72 1u02 s THR 145 Ca 0.24 -0.38 0.04 0.00 0.31 0.00 0.00 61.69 61.89 1u02 s THR 145 Cb -0.12 -2.67 -0.02 0.00 0.01 0.00 0.00 72.50 69.71 1u02 s THR 145 CO 0.15 0.51 -0.18 -0.47 -0.69 0.00 0.00 174.62 173.94 1u02 s TYR 146 N 0.17 2.62 -0.24 4.92 5.04 0.58 -4.97 117.35 125.47 1u02 s TYR 146 Ca -0.02 -0.54 -0.03 0.00 -2.44 0.00 0.00 57.07 54.04 1u02 s TYR 146 Cb -0.14 -1.68 0.01 0.00 0.35 0.00 0.00 41.96 40.50 1u02 s TYR 146 CO 0.03 -0.10 -0.04 0.71 -1.34 0.00 0.00 175.55 174.81 1u02 s TYR 147 N -0.17 3.01 0.00 4.97 2.02 -1.26 -0.74 117.35 125.18 1u02 s TYR 147 Ca -0.02 -1.22 0.00 0.00 -0.37 0.00 0.00 57.07 55.46 1u02 s TYR 147 Cb -0.14 -2.10 0.00 0.00 -0.40 0.00 0.00 41.96 39.33 1u02 s TYR 147 CO 0.03 -0.64 0.00 0.41 -1.57 0.00 0.00 175.55 173.79 1u02 n GLY 148 N 4.75 7.62 1.20 0.71 0.00 -1.26 -5.01 105.19 113.21 1u02 n GLY 148 Ca -0.17 -2.02 -0.01 0.00 0.00 0.00 0.00 46.02 43.82 1u02 n GLY 148 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u02 n LYS 149 N 0.00 1.04 0.00 1.61 5.02 -1.26 -4.79 118.16 119.78 1u02 n LYS 149 Ca 0.00 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1u02 n LYS 149 Cb 0.00 -1.04 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 1u02 n LYS 149 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1u02 n ILE 151 N 0.78 0.00 -3.76 -0.18 2.08 -1.26 -4.99 119.36 112.03 1u02 n ILE 151 Ca 0.02 0.00 -0.22 0.00 0.56 0.00 0.00 62.75 63.11 1u02 n ILE 151 Cb 0.53 0.00 -0.18 0.00 -0.75 0.00 0.00 39.64 39.24 1u02 n ILE 151 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 1u02 s ILE 152 N -1.20 0.27 -0.03 1.39 1.01 -0.63 -4.45 121.20 117.55 1u02 s ILE 152 Ca 0.00 0.19 0.05 0.00 0.00 0.00 0.00 60.65 60.89 1u02 s ILE 152 Cb 0.00 -0.44 -0.01 0.00 0.01 0.00 0.00 42.46 42.02 1u02 s ILE 152 CO 0.00 0.24 -0.19 -0.70 0.00 0.00 0.00 174.94 174.29 1u02 s GLU 153 N 1.97 1.72 -0.17 2.79 2.12 0.08 -0.37 118.70 126.84 1u02 s GLU 153 Ca 0.04 -0.67 -0.14 0.00 0.36 0.00 0.00 54.97 54.57 1u02 s GLU 153 Cb -0.12 -1.57 -0.05 0.00 0.26 0.00 0.00 34.13 32.65 1u02 s GLU 153 CO -0.05 0.34 0.29 -0.51 -0.54 0.00 0.00 175.26 174.79 1u02 s LEU 154 N -0.22 4.23 0.00 2.70 1.43 -0.52 -0.31 118.68 125.99 1u02 s LEU 154 Ca 0.02 0.48 0.02 0.00 -1.03 0.00 0.00 54.13 53.61 1u02 s LEU 154 Cb -0.10 -2.36 -0.01 0.00 0.03 0.00 0.00 46.19 43.75 1u02 s LEU 154 CO 0.01 0.08 0.40 -2.11 0.23 0.00 0.00 176.35 174.96 1u02 n ARG 155 N 3.71 0.57 -2.15 1.70 1.85 0.33 -2.18 116.66 120.49 1u02 n ARG 155 Ca -0.12 -2.90 -0.42 0.00 -1.00 0.00 0.00 57.85 53.41 1u02 n ARG 155 Cb 0.52 2.62 -0.03 0.00 -1.05 0.00 0.00 32.46 34.52 1u02 n ARG 155 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1u02 s VAL 156 N -2.99 3.30 0.35 8.89 1.01 -1.26 -1.28 120.40 128.41 1u02 s VAL 156 Ca 0.32 0.91 -0.28 0.00 0.00 0.00 0.00 61.98 62.93 1u02 s VAL 156 Cb 0.00 -3.58 -0.12 0.00 0.00 0.00 0.00 36.38 32.68 1u02 s VAL 156 CO 0.23 0.06 1.33 -2.65 0.00 0.00 0.00 175.10 174.07 1u02 n PRO 157 N 4.13 2.24 -0.86 2.72 -0.02 -1.26 -3.09 135.00 138.85 1u02 n PRO 157 Ca 0.12 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 1u02 n PRO 157 Cb 0.42 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1u02 n PRO 157 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u02 n GLY 158 N 0.72 0.92 3.76 -1.23 0.00 -1.26 -5.02 105.19 103.07 1u02 n GLY 158 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1u02 n GLY 158 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1u02 n VAL 159 N -2.02 2.60 -3.39 1.61 0.24 -1.18 -5.00 118.33 111.19 1u02 n VAL 159 Ca 0.00 -0.50 -0.07 0.00 -2.04 0.00 0.00 64.34 61.73 1u02 n VAL 159 Cb 0.00 -1.83 -0.07 0.00 -1.47 0.00 0.00 33.84 30.47 1u02 n VAL 159 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1u02 s ASN 160 N -0.41 -0.18 0.17 -1.34 3.84 -0.78 -5.01 114.94 111.24 1u02 s ASN 160 Ca 0.59 0.55 -0.15 0.00 0.21 0.00 0.00 52.86 54.07 1u02 s ASN 160 Cb -0.46 1.38 0.14 0.00 -0.55 0.00 0.00 41.25 41.76 1u02 s ASN 160 CO 0.59 -0.28 1.71 0.11 -2.79 0.00 0.00 177.10 176.44 1u02 h LYS 161 N 8.14 0.17 -0.23 0.43 1.57 -1.79 -2.17 116.57 122.70 1u02 h LYS 161 Ca -0.19 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.63 1u02 h LYS 161 Cb 1.14 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.36 1u02 h LYS 161 CO 0.23 0.11 -0.11 0.78 -0.57 0.00 0.00 179.45 179.90 1u02 h GLY 162 N 0.18 0.10 1.00 3.86 0.00 -1.86 -0.37 103.07 105.97 1u02 h GLY 162 Ca 0.22 0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 1u02 h GLY 162 CO -0.31 -0.13 0.40 1.76 0.00 0.00 0.00 176.54 178.26 1u02 h SER 163 N -0.07 0.78 -0.35 0.19 0.02 -1.87 0.12 113.55 112.37 1u02 h SER 163 Ca 0.12 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1u02 h SER 163 Cb 0.26 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 1u02 h SER 163 CO -0.28 0.61 0.18 0.00 -1.14 0.00 0.00 176.83 176.20 1u02 h ALA 164 N 1.21 0.45 -0.05 3.77 0.00 -1.05 0.94 119.26 124.54 1u02 h ALA 164 Ca 0.24 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1u02 h ALA 164 Cb -0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1u02 h ALA 164 CO -0.05 -0.00 0.02 0.82 0.00 0.00 0.00 179.25 180.04 1u02 h ILE 165 N 0.44 1.15 -0.64 0.00 2.04 -0.79 -2.62 117.51 117.10 1u02 h ILE 165 Ca 0.12 -0.44 0.11 0.00 1.00 0.00 0.00 64.86 65.65 1u02 h ILE 165 Cb 0.09 1.35 -0.08 0.00 -0.74 0.00 0.00 36.82 37.44 1u02 h ILE 165 CO -0.02 0.12 0.19 -0.09 0.00 0.00 0.00 178.15 178.36 1u02 h ARG 166 N -0.09 0.33 -0.64 2.37 9.65 -0.54 -0.69 114.38 124.77 1u02 h ARG 166 Ca 0.02 -0.02 0.05 0.00 -1.10 0.00 0.00 59.98 58.93 1u02 h ARG 166 Cb 0.18 -0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 28.65 1u02 h ARG 166 CO -0.00 0.22 0.42 1.03 2.80 0.00 0.00 179.97 184.44 1u02 h SER 167 N 0.34 0.59 0.00 -3.80 0.87 -0.60 0.30 113.55 111.25 1u02 h SER 167 Ca 0.33 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1u02 h SER 167 Cb 0.48 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 1u02 h SER 167 CO -0.38 0.39 -0.00 0.58 -0.53 0.00 0.00 176.83 176.89 1u02 h VAL 168 N 0.68 1.66 0.00 2.23 2.07 -0.80 -3.38 116.25 118.71 1u02 h VAL 168 Ca 0.27 -2.16 -0.19 0.00 0.82 0.00 0.00 66.70 65.44 1u02 h VAL 168 Cb 0.20 3.10 -0.03 0.00 -1.52 0.00 0.00 31.29 33.04 1u02 h VAL 168 CO -0.08 0.55 -0.91 0.08 0.02 0.00 0.00 177.57 177.22 1u02 h ARG 169 N -0.95 0.00 0.00 1.57 0.11 -1.18 -3.49 114.38 110.44 1u02 h ARG 169 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1u02 h ARG 169 Cb 0.90 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.98 1u02 h ARG 169 CO 0.00 0.91 0.00 0.41 0.10 0.00 0.00 179.97 181.39 1u02 n GLY 170 N 1.30 3.43 0.47 0.08 0.00 0.10 -1.03 105.19 109.55 1u02 n GLY 170 Ca 0.00 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.16 1u02 n GLY 170 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1u02 n GLU 171 N 10.96 1.46 -1.69 1.61 -0.58 -1.26 -4.94 120.64 126.20 1u02 n GLU 171 Ca 0.00 -1.08 -0.38 0.00 -0.42 0.00 0.00 57.16 55.28 1u02 n GLU 171 Cb 0.00 -1.26 0.05 0.00 -0.57 0.00 0.00 31.44 29.66 1u02 n GLU 171 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1u02 n ARG 172 N 0.34 1.27 -1.86 3.49 1.74 -0.20 -4.93 116.66 116.51 1u02 n ARG 172 Ca 0.07 0.48 -0.41 0.00 -0.77 0.00 0.00 57.85 57.23 1u02 n ARG 172 Cb 0.34 -2.41 -0.01 0.00 -1.02 0.00 0.00 32.46 29.36 1u02 n ARG 172 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 1u02 s PRO 173 N -2.94 4.16 0.18 5.56 0.02 -1.26 -4.97 135.00 135.75 1u02 s PRO 173 Ca 0.76 2.50 -0.20 0.00 0.02 0.00 0.00 61.00 64.07 1u02 s PRO 173 Cb -0.41 -3.00 0.05 0.00 0.02 0.00 0.00 34.50 31.15 1u02 s PRO 173 CO 0.46 -0.48 0.56 0.00 -0.33 0.00 0.00 177.00 177.21 1u02 s ALA 174 N -0.87 -1.24 -0.08 -1.55 0.00 -1.26 -3.36 121.76 113.39 1u02 s ALA 174 Ca 0.54 0.08 0.02 0.00 0.00 0.00 0.00 51.96 52.60 1u02 s ALA 174 Cb -0.45 0.84 -0.02 0.00 0.00 0.00 0.00 23.12 23.49 1u02 s ALA 174 CO 0.58 -0.79 -0.13 0.42 0.00 0.00 0.00 175.76 175.83 1u02 s ILE 175 N -3.82 3.10 -0.07 0.00 1.01 -0.49 -0.90 121.20 120.03 1u02 s ILE 175 Ca 0.05 -0.68 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 1u02 s ILE 175 Cb -0.01 -2.25 0.03 0.00 0.01 0.00 0.00 42.46 40.23 1u02 s ILE 175 CO -0.07 0.57 -0.01 -0.63 0.00 0.00 0.00 174.94 174.79 1u02 s ILE 176 N -0.32 0.46 -0.03 2.92 1.01 -0.45 -0.33 121.20 124.46 1u02 s ILE 176 Ca 0.03 0.05 0.06 0.00 0.00 0.00 0.00 60.65 60.78 1u02 s ILE 176 Cb -0.13 -0.58 -0.01 0.00 0.01 0.00 0.00 42.46 41.75 1u02 s ILE 176 CO 0.03 0.26 -0.21 0.00 0.00 0.00 0.00 174.94 175.02 1u02 s ALA 177 N 1.77 1.77 0.24 9.38 0.00 -0.61 0.13 121.76 134.44 1u02 s ALA 177 Ca 0.02 -0.87 -0.22 0.00 0.00 0.00 0.00 51.96 50.89 1u02 s ALA 177 Cb -0.13 -0.51 0.03 0.00 0.00 0.00 0.00 23.12 22.52 1u02 s ALA 177 CO -0.05 0.38 0.78 0.20 0.00 0.00 0.00 175.76 177.07 1u02 s GLY 178 N -0.27 -0.16 -0.00 0.00 0.00 -0.75 -1.61 107.32 104.53 1u02 s GLY 178 Ca 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 44.72 44.60 1u02 s GLY 178 CO 0.01 -0.05 0.01 2.09 0.00 0.00 0.00 173.10 175.16 1u02 n ASP 179 N -0.46 2.02 -2.02 1.64 5.75 -1.26 -0.93 116.55 121.28 1u02 n ASP 179 Ca -0.05 -0.30 -0.05 0.00 -0.01 0.00 0.00 54.79 54.38 1u02 n ASP 179 Cb 0.60 1.01 -0.01 0.00 -1.03 0.00 0.00 41.12 41.68 1u02 n ASP 179 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1u02 n ASP 180 N -1.21 1.31 -0.35 -1.12 5.68 -1.26 -4.77 116.55 114.83 1u02 n ASP 180 Ca 0.00 -1.37 0.11 0.00 -0.50 0.00 0.00 54.79 53.04 1u02 n ASP 180 Cb 0.01 0.14 0.29 0.00 -1.14 0.00 0.00 41.12 40.42 1u02 n ASP 180 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1u02 h ALA 181 N 1.10 1.60 0.00 2.12 0.00 -1.99 0.56 119.26 122.65 1u02 h ALA 181 Ca -0.06 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1u02 h ALA 181 Cb 0.21 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1u02 h ALA 181 CO 0.09 0.01 -0.14 1.79 0.00 0.00 0.00 179.25 181.00 1u02 h THR 182 N 0.80 0.85 0.11 0.00 1.35 -1.99 0.12 112.91 114.16 1u02 h THR 182 Ca 0.55 -0.54 -0.31 0.00 -0.55 0.00 0.00 66.41 65.57 1u02 h THR 182 Cb 0.79 1.31 -0.01 0.00 -1.73 0.00 0.00 68.15 68.51 1u02 h THR 182 CO -0.36 0.14 -1.55 0.44 -0.25 0.00 0.00 175.52 173.94 1u02 h ASP 183 N 0.00 0.37 -0.96 5.36 3.32 -1.37 -2.65 116.42 120.49 1u02 h ASP 183 Ca -0.00 -0.53 0.01 0.00 0.02 0.00 0.00 57.03 56.53 1u02 h ASP 183 Cb 0.30 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.68 1u02 h ASP 183 CO 0.02 1.44 0.63 -0.08 -1.72 0.00 0.00 179.24 179.53 1u02 h GLU 184 N 0.06 1.27 -0.45 3.56 4.57 -0.17 0.94 114.58 124.36 1u02 h GLU 184 Ca -0.25 -0.08 -0.12 0.00 -1.18 0.00 0.00 59.36 57.73 1u02 h GLU 184 Cb 2.01 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 30.31 1u02 h GLU 184 CO 0.15 0.84 -0.19 0.00 -1.18 0.00 0.00 179.01 178.64 1u02 h ALA 185 N 1.39 0.82 -0.52 2.92 0.00 -0.84 -2.44 119.26 120.60 1u02 h ALA 185 Ca 0.35 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1u02 h ALA 185 Cb -0.14 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1u02 h ALA 185 CO -0.07 0.65 0.18 0.00 0.00 0.00 0.00 179.25 180.01 1u02 h ALA 186 N 1.01 1.34 -0.46 0.00 0.00 -0.73 -1.50 119.26 118.92 1u02 h ALA 186 Ca 0.11 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1u02 h ALA 186 Cb 0.72 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1u02 h ALA 186 CO 0.06 0.48 0.16 0.74 0.00 0.00 0.00 179.25 180.69 1u02 h PHE 187 N 0.75 0.74 -0.97 0.00 0.04 -0.53 -2.22 116.94 114.75 1u02 h PHE 187 Ca 0.18 -0.07 0.05 0.00 2.80 0.00 0.00 57.97 60.92 1u02 h PHE 187 Cb 0.19 -0.22 -0.06 0.00 2.20 0.00 0.00 35.95 38.07 1u02 h PHE 187 CO 0.01 0.65 0.63 1.49 -0.60 0.00 0.00 178.31 180.49 1u02 h GLU 188 N 0.61 1.16 -0.00 1.51 4.22 -0.92 0.43 114.58 121.59 1u02 h GLU 188 Ca 0.15 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.52 1u02 h GLU 188 Cb 0.25 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1u02 h GLU 188 CO -0.01 0.77 -0.02 0.00 -2.18 0.00 0.00 179.01 177.57 1u02 n ALA 189 N -2.36 2.61 -2.78 2.92 0.00 -0.63 -3.64 120.51 116.63 1u02 n ALA 189 Ca 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 53.44 53.36 1u02 n ALA 189 Cb 0.13 -1.46 0.06 0.00 0.00 0.00 0.00 19.45 18.18 1u02 n ALA 189 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1u02 n ASN 190 N -1.08 0.91 0.12 0.00 3.02 -0.43 -4.85 115.26 112.95 1u02 n ASN 190 Ca 0.18 -2.19 0.08 0.00 -0.03 0.00 0.00 54.58 52.62 1u02 n ASN 190 Cb 0.21 -0.24 0.42 0.00 -0.61 0.00 0.00 39.78 39.56 1u02 n ASN 190 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1u02 n ASP 191 N -0.66 0.40 -0.32 6.41 5.68 0.14 -1.00 116.55 127.19 1u02 n ASP 191 Ca 0.03 0.68 0.15 0.00 -0.50 0.00 0.00 54.79 55.14 1u02 n ASP 191 Cb 0.82 -0.72 0.65 0.00 -1.14 0.00 0.00 41.12 40.72 1u02 n ASP 191 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1u02 n ASP 192 N -2.04 1.01 -4.99 -1.12 5.75 -1.26 -4.88 116.55 109.01 1u02 n ASP 192 Ca -0.01 -1.30 -0.19 0.00 -0.01 0.00 0.00 54.79 53.28 1u02 n ASP 192 Cb 0.05 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.16 1u02 n ASP 192 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u02 s ALA 193 N -2.04 4.23 -0.97 2.12 0.00 -0.17 -4.89 121.76 120.03 1u02 s ALA 193 Ca 0.40 -1.48 -0.23 0.00 0.00 0.00 0.00 51.96 50.65 1u02 s ALA 193 Cb 0.21 -1.82 0.06 0.00 0.00 0.00 0.00 23.12 21.57 1u02 s ALA 193 CO 0.36 -0.41 1.39 -1.17 0.00 0.00 0.00 175.76 175.93 1u02 s LEU 194 N -4.48 3.63 0.02 0.00 0.20 -0.08 -4.86 118.68 113.12 1u02 s LEU 194 Ca 0.54 -1.39 -0.26 0.00 0.69 0.00 0.00 54.13 53.71 1u02 s LEU 194 Cb -0.10 -2.55 -0.05 0.00 -0.43 0.00 0.00 46.19 43.06 1u02 s LEU 194 CO 0.35 -1.50 0.80 0.42 -0.29 0.00 0.00 176.35 176.13 1u02 s THR 195 N 4.82 4.80 -0.15 3.68 -4.23 -1.26 -1.34 115.64 121.96 1u02 s THR 195 Ca 0.43 1.69 0.00 0.00 -1.18 0.00 0.00 61.69 62.64 1u02 s THR 195 Cb -0.02 -4.15 0.03 0.00 1.34 0.00 0.00 72.50 69.70 1u02 s THR 195 CO -0.07 0.30 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.56 1u02 s ILE 196 N 0.31 1.48 -0.10 2.99 1.01 0.12 -0.93 121.20 126.08 1u02 s ILE 196 Ca 0.41 -0.63 -0.13 0.00 0.00 0.00 0.00 60.65 60.30 1u02 s ILE 196 Cb -0.20 -1.43 -0.05 0.00 0.01 0.00 0.00 42.46 40.79 1u02 s ILE 196 CO 0.23 0.40 0.31 -0.75 0.00 0.00 0.00 174.94 175.13 1u02 s LYS 197 N 1.52 3.99 -0.15 2.79 2.47 -0.10 -1.81 119.74 128.45 1u02 s LYS 197 Ca 0.04 0.18 -0.02 0.00 -1.56 0.00 0.00 55.97 54.61 1u02 s LYS 197 Cb -0.13 -3.31 -0.02 0.00 -1.46 0.00 0.00 37.83 32.91 1u02 s LYS 197 CO -0.10 0.49 -0.08 0.08 0.16 0.00 0.00 175.35 175.90 1u02 s VAL 198 N -0.34 3.43 0.00 4.02 1.01 -0.11 -0.48 120.40 127.93 1u02 s VAL 198 Ca 0.19 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1u02 s VAL 198 Cb -0.14 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.76 1u02 s VAL 198 CO 0.07 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.28 1u02 n GLY 199 N 3.68 0.83 3.74 4.51 0.00 -0.20 -4.35 105.19 113.41 1u02 n GLY 199 Ca -0.18 -1.96 -0.30 0.00 0.00 0.00 0.00 46.02 43.58 1u02 n GLY 199 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1u02 s GLU 200 N -1.85 1.76 0.00 1.61 2.12 -1.26 -4.86 118.70 116.21 1u02 s GLU 200 Ca 0.00 1.02 0.00 0.00 0.36 0.00 0.00 54.97 56.35 1u02 s GLU 200 Cb 0.00 -1.85 0.00 0.00 0.26 0.00 0.00 34.13 32.54 1u02 s GLU 200 CO 0.00 -1.95 0.00 0.41 -0.54 0.00 0.00 175.26 173.18 1u02 n GLY 201 N -1.13 3.11 3.78 -1.50 0.00 -1.26 -5.05 105.19 103.13 1u02 n GLY 201 Ca 0.08 -1.88 -0.37 0.00 0.00 0.00 0.00 46.02 43.86 1u02 n GLY 201 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u02 s GLU 202 N -3.39 3.89 0.18 1.61 0.41 -1.26 -5.04 118.70 115.10 1u02 s GLU 202 Ca 0.00 1.64 -0.21 0.00 -0.41 0.00 0.00 54.97 55.99 1u02 s GLU 202 Cb 0.00 -2.42 0.05 0.00 -1.78 0.00 0.00 34.13 29.99 1u02 s GLU 202 CO 0.00 -0.41 0.60 -0.08 -0.49 0.00 0.00 175.26 174.88 1u02 s THR 203 N -1.63 0.01 -0.68 3.63 -1.32 -1.26 -5.03 115.64 109.37 1u02 s THR 203 Ca 0.62 -0.34 0.13 0.00 -1.21 0.00 0.00 61.69 60.88 1u02 s THR 203 Cb -0.25 -1.28 0.38 0.00 -1.51 0.00 0.00 72.50 69.83 1u02 s THR 203 CO 0.31 -0.04 1.31 1.41 -2.21 0.00 0.00 174.62 175.39 1u02 n HIS 204 N -0.38 0.62 -2.05 9.09 8.25 -1.26 -5.02 115.22 124.48 1u02 n HIS 204 Ca -0.13 -0.62 -0.35 0.00 -0.26 0.00 0.00 57.72 56.35 1u02 n HIS 204 Cb 0.63 -0.12 0.03 0.00 1.12 0.00 0.00 29.99 31.65 1u02 n HIS 204 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1u02 s ALA 205 N -1.60 2.57 0.25 -1.41 0.00 -1.26 -4.94 121.76 115.38 1u02 s ALA 205 Ca 0.29 0.88 0.10 0.00 0.00 0.00 0.00 51.96 53.23 1u02 s ALA 205 Cb 0.19 -3.40 0.29 0.00 0.00 0.00 0.00 23.12 20.20 1u02 s ALA 205 CO 0.13 -1.06 1.57 0.87 0.00 0.00 0.00 175.76 177.28 1u02 h LYS 206 N 0.86 0.00 -5.47 0.00 1.57 -1.58 -3.45 116.57 108.50 1u02 h LYS 206 Ca -0.50 -0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 57.84 1u02 h LYS 206 Cb 1.28 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.37 1u02 h LYS 206 CO 0.55 0.67 -0.79 0.12 -0.57 0.00 0.00 179.45 179.43 1u02 s PHE 207 N -3.51 1.31 -0.03 -1.35 5.36 -0.11 -5.01 117.98 114.64 1u02 s PHE 207 Ca -0.01 -0.43 0.01 0.00 -0.96 0.00 0.00 56.93 55.54 1u02 s PHE 207 Cb 0.12 -0.74 0.02 0.00 -0.34 0.00 0.00 43.02 42.08 1u02 s PHE 207 CO 0.77 0.07 -0.04 -1.58 -1.46 0.00 0.00 175.22 172.99 1u02 s HIS 208 N -1.16 0.59 0.21 10.12 5.65 -1.26 -0.92 115.29 128.52 1u02 s HIS 208 Ca 0.00 -0.13 0.10 0.00 0.25 0.00 0.00 55.06 55.28 1u02 s HIS 208 Cb -0.10 -0.53 -0.05 0.00 -1.18 0.00 0.00 32.58 30.73 1u02 s HIS 208 CO 0.02 -0.13 -0.20 0.14 -0.65 0.00 0.00 174.74 173.92 1u02 s VAL 209 N 0.69 2.15 0.02 0.89 -7.23 0.37 -4.95 120.40 112.35 1u02 s VAL 209 Ca -0.08 -2.11 -0.22 0.00 -1.81 0.00 0.00 61.98 57.76 1u02 s VAL 209 Cb -0.12 -2.07 -0.16 0.00 0.56 0.00 0.00 36.38 34.59 1u02 s VAL 209 CO -0.00 -0.30 1.30 0.00 -0.31 0.00 0.00 175.10 175.79 1u02 h ALA 210 N 2.91 0.16 -2.61 1.32 0.00 -1.89 -0.52 119.26 118.64 1u02 h ALA 210 Ca -0.43 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.12 1u02 h ALA 210 Cb 1.22 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1u02 h ALA 210 CO 0.53 0.04 0.01 -0.40 0.00 0.00 0.00 179.25 179.43 1u02 n ASP 211 N -4.60 -0.39 0.21 0.00 5.68 -1.26 -2.57 116.55 113.62 1u02 n ASP 211 Ca -0.07 -1.39 0.05 0.00 -0.50 0.00 0.00 54.79 52.88 1u02 n ASP 211 Cb 0.36 0.69 0.46 0.00 -1.14 0.00 0.00 41.12 41.49 1u02 n ASP 211 CO 0.00 0.00 0.00 0.10 -1.33 0.00 0.00 177.20 175.97 1u02 h TYR 212 N 1.22 0.00 -0.23 2.11 -0.00 -1.79 -2.69 116.97 115.60 1u02 h TYR 212 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.65 1u02 h TYR 212 Cb 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.99 1u02 h TYR 212 CO 0.00 0.25 0.07 0.82 -0.00 0.00 0.00 178.16 179.31 1u02 h ILE 213 N 0.00 1.19 0.00 -0.90 2.04 -1.90 0.58 117.51 118.52 1u02 h ILE 213 Ca -0.00 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1u02 h ILE 213 Cb 0.46 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1u02 h ILE 213 CO 0.03 0.19 0.00 1.21 0.00 0.00 0.00 178.15 179.59 1u02 n GLU 214 N -4.77 0.40 0.00 2.37 2.13 -1.01 -1.96 120.64 117.79 1u02 n GLU 214 Ca -0.03 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.79 1u02 n GLU 214 Cb 0.15 -1.30 0.00 0.00 0.27 0.00 0.00 31.44 30.56 1u02 n GLU 214 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1u02 n ARG 216 N 1.08 0.00 -0.18 5.31 1.74 0.20 -1.41 116.66 123.40 1u02 n ARG 216 Ca 0.00 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.02 1u02 n ARG 216 Cb 0.20 0.00 0.11 0.00 -1.02 0.00 0.00 32.46 31.75 1u02 n ARG 216 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1u02 h LYS 217 N 0.00 0.97 -0.48 5.56 3.64 -1.65 0.13 116.57 124.74 1u02 h LYS 217 Ca 0.00 -0.24 -0.07 0.00 -1.27 0.00 0.00 60.65 59.06 1u02 h LYS 217 Cb 0.00 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1u02 h LYS 217 CO 0.00 0.90 0.01 0.82 -2.27 0.00 0.00 179.45 178.91 1u02 h ILE 218 N 0.91 1.26 -0.59 2.00 1.08 -1.53 -0.83 117.51 119.81 1u02 h ILE 218 Ca 0.19 -1.05 -0.08 0.00 -0.39 0.00 0.00 64.86 63.52 1u02 h ILE 218 Cb 0.41 1.00 -0.02 0.00 -3.07 0.00 0.00 36.82 35.13 1u02 h ILE 218 CO 0.01 0.37 0.04 -0.07 -0.69 0.00 0.00 178.15 177.81 1u02 h LEU 219 N 0.69 0.96 -0.60 1.44 3.38 -1.75 -0.81 115.31 118.63 1u02 h LEU 219 Ca 0.14 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.88 1u02 h LEU 219 Cb 0.50 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1u02 h LEU 219 CO 0.02 0.99 0.37 0.50 0.09 0.00 0.00 178.44 180.42 1u02 h LYS 220 N 0.93 0.72 -0.29 1.13 3.64 -0.46 -2.20 116.57 120.04 1u02 h LYS 220 Ca 0.18 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1u02 h LYS 220 Cb 0.48 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1u02 h LYS 220 CO 0.02 0.48 0.05 0.35 -2.27 0.00 0.00 179.45 178.08 1u02 h PHE 221 N 0.75 0.50 -0.79 1.91 3.57 -0.65 -2.85 116.94 119.38 1u02 h PHE 221 Ca 0.24 -0.07 0.09 0.00 3.53 0.00 0.00 57.97 61.76 1u02 h PHE 221 Cb -0.01 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.54 1u02 h PHE 221 CO -0.05 0.57 0.51 0.82 -2.23 0.00 0.00 178.31 177.93 1u02 h ILE 222 N 0.29 0.95 0.00 1.41 2.04 -0.91 -1.29 117.51 120.01 1u02 h ILE 222 Ca 0.09 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1u02 h ILE 222 Cb 0.34 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1u02 h ILE 222 CO 0.01 0.13 0.00 1.21 0.00 0.00 0.00 178.15 179.50 1u02 n GLU 223 N -4.50 0.15 0.00 2.37 4.07 -0.85 -2.40 120.64 119.48 1u02 n GLU 223 Ca 0.13 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.23 1u02 n GLU 223 Cb 0.32 -1.23 0.00 0.00 -0.06 0.00 0.00 31.44 30.46 1u02 n GLU 223 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1u02 n LEU 225 N 0.65 0.00 -0.01 4.31 4.77 -0.49 -2.03 117.00 124.20 1u02 n LEU 225 Ca 0.00 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.95 1u02 n LEU 225 Cb 0.05 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.36 1u02 n LEU 225 CO 0.00 0.00 0.80 1.23 -1.33 0.00 0.00 177.39 178.09 1u02 h GLY 226 N 0.00 0.59 1.34 -0.72 0.00 -1.76 -0.16 103.07 102.36 1u02 h GLY 226 Ca 0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 1u02 h GLY 226 CO 0.00 0.40 0.36 -2.08 0.00 0.00 0.00 176.54 175.22 1u02 h VAL 227 N 0.50 1.19 0.21 4.60 2.07 -1.71 -2.66 116.25 120.44 1u02 h VAL 227 Ca 0.09 -0.46 -0.28 0.00 0.82 0.00 0.00 66.70 66.87 1u02 h VAL 227 Cb 0.56 0.32 0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1u02 h VAL 227 CO 0.04 0.21 -1.23 1.56 0.02 0.00 0.00 177.57 178.16 1u02 h GLN 228 N 0.88 0.46 -0.53 1.57 1.08 -1.79 -3.33 115.11 113.45 1u02 h GLN 228 Ca 0.23 -0.78 0.16 0.00 -1.45 0.00 0.00 58.65 56.80 1u02 h GLN 228 Cb 0.01 0.29 -0.02 0.00 -0.05 0.00 0.00 27.48 27.70 1u02 h GLN 228 CO -0.04 1.37 0.45 -0.22 -0.95 0.00 0.00 178.83 179.44 1u02 h LYS 229 N -0.03 0.00 -0.03 1.46 1.63 -0.70 -3.52 116.57 115.39 1u02 h LYS 229 Ca -0.21 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.59 1u02 h LYS 229 Cb 1.97 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.60 1u02 h LYS 229 CO 0.23 0.00 0.00 0.36 -3.45 0.00 0.00 179.45 176.59