#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2do8 n PHE 2 N 0.00 -0.10 -2.78 1.12 3.72 -1.26 -2.64 117.46 115.52 2do8 n PHE 2 Ca 0.00 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.24 2do8 n PHE 2 Cb 0.00 -2.88 0.02 0.00 -0.94 0.00 0.00 39.48 35.68 2do8 n PHE 2 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2do8 n GLY 3 N -0.99 -0.17 1.28 1.37 0.00 -1.26 -4.59 105.19 100.83 2do8 n GLY 3 Ca -0.17 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2do8 n GLY 3 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2do8 n ASN 4 N -1.24 -5.88 0.00 1.61 2.85 -1.08 -4.82 115.26 106.69 2do8 n ASN 4 Ca -0.08 0.75 0.11 0.00 -0.11 0.00 0.00 54.58 55.24 2do8 n ASN 4 Cb 0.59 -3.01 0.49 0.00 1.24 0.00 0.00 39.78 39.08 2do8 n ASN 4 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2do8 n LEU 5 N 0.81 0.00 -4.73 1.20 4.77 -1.26 -4.77 117.00 113.02 2do8 n LEU 5 Ca 0.00 0.44 -0.42 0.00 -0.03 0.00 0.00 56.01 56.01 2do8 n LEU 5 Cb 0.00 -0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 40.62 2do8 n LEU 5 CO 0.00 -0.11 1.11 -1.58 -1.33 0.00 0.00 177.39 175.48 2do8 s GLN 6 N -2.89 4.28 -0.01 3.23 0.74 -1.26 -1.94 119.66 121.82 2do8 s GLN 6 Ca 0.13 2.24 0.00 0.00 0.05 0.00 0.00 55.36 57.79 2do8 s GLN 6 Cb 0.14 -3.16 0.00 0.00 1.10 0.00 0.00 33.01 31.10 2do8 s GLN 6 CO 0.38 -0.45 0.00 0.41 -0.55 0.00 0.00 175.29 175.08 2do8 n GLY 7 N 2.83 0.48 3.71 2.59 0.00 -1.17 -5.02 105.19 108.61 2do8 n GLY 7 Ca 0.09 -0.18 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 2do8 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2do8 s LYS 8 N -0.37 2.12 0.03 1.61 3.01 -0.82 -1.64 119.74 123.68 2do8 s LYS 8 Ca 0.00 -2.06 -0.06 0.00 -1.01 0.00 0.00 55.97 52.84 2do8 s LYS 8 Cb 0.00 -1.78 -0.01 0.00 -1.01 0.00 0.00 37.83 35.04 2do8 s LYS 8 CO 0.00 -0.17 0.11 -0.59 0.51 0.00 0.00 175.35 175.22 2do8 s PHE 9 N -2.70 0.13 0.12 3.18 -0.71 0.29 -0.59 117.98 117.70 2do8 s PHE 9 Ca 0.32 -0.36 0.06 0.00 -1.04 0.00 0.00 56.93 55.91 2do8 s PHE 9 Cb 0.05 -0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 2do8 s PHE 9 CO 0.17 -0.34 -0.00 0.96 -1.34 0.00 0.00 175.22 174.67 2do8 s ILE 10 N -2.13 3.87 -0.33 -4.49 -4.36 -1.25 -0.64 121.20 111.86 2do8 s ILE 10 Ca -0.09 -1.17 -0.12 0.00 -0.26 0.00 0.00 60.65 59.00 2do8 s ILE 10 Cb -0.04 -2.88 -0.02 0.00 1.25 0.00 0.00 42.46 40.78 2do8 s ILE 10 CO -0.02 0.03 0.23 -0.63 0.24 0.00 0.00 174.94 174.78 2do8 s ILE 11 N -1.46 5.18 -0.04 8.37 -1.09 0.15 -4.75 121.20 127.56 2do8 s ILE 11 Ca 0.26 -0.24 -0.14 0.00 -2.23 0.00 0.00 60.65 58.30 2do8 s ILE 11 Cb -0.11 -3.65 0.03 0.00 -1.58 0.00 0.00 42.46 37.14 2do8 s ILE 11 CO 0.18 0.01 0.32 0.00 -1.23 0.00 0.00 174.94 174.22 2do8 s ALA 12 N 1.71 -0.81 -0.41 9.38 0.00 -1.26 -3.20 121.76 127.17 2do8 s ALA 12 Ca 0.06 0.48 -0.16 0.00 0.00 0.00 0.00 51.96 52.34 2do8 s ALA 12 Cb -0.17 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 22.89 2do8 s ALA 12 CO 0.10 -0.24 0.53 2.41 0.00 0.00 0.00 175.76 178.56 2do8 n THR 13 N 1.65-10.62 0.66 0.00 -1.04 -1.26 -4.67 114.28 99.00 2do8 n THR 13 Ca -0.20 0.95 0.13 0.00 -2.04 0.00 0.00 64.05 62.89 2do8 n THR 13 Cb 0.56 -6.95 0.31 0.00 -1.82 0.00 0.00 70.33 62.44 2do8 n THR 13 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2do8 n PRO 14 N -0.15 0.23 -3.98 -2.82 -0.04 -1.26 -4.78 135.00 122.19 2do8 n PRO 14 Ca 0.09 0.13 -0.26 0.00 -0.04 0.00 0.00 63.50 63.41 2do8 n PRO 14 Cb 0.42 -1.71 -0.17 0.00 -0.04 0.00 0.00 33.50 32.01 2do8 n PRO 14 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2do8 s GLU 15 N -3.11 1.51 -0.14 0.54 0.41 -1.26 -5.10 118.70 111.55 2do8 s GLU 15 Ca 0.09 -0.26 -0.04 0.00 -0.41 0.00 0.00 54.97 54.35 2do8 s GLU 15 Cb 0.14 -1.54 0.05 0.00 -1.78 0.00 0.00 34.13 31.00 2do8 s GLU 15 CO 0.65 -0.23 0.07 1.41 -0.49 0.00 0.00 175.26 176.67 2do8 s MET 16 N 1.58 0.13 -0.04 1.61 1.75 -1.26 -5.04 119.30 118.03 2do8 s MET 16 Ca 0.02 -0.01 -0.01 0.00 -1.25 0.00 0.00 55.69 54.44 2do8 s MET 16 Cb -0.13 -1.52 -0.27 0.00 2.84 0.00 0.00 34.83 35.75 2do8 s MET 16 CO -0.07 -0.57 0.70 0.38 -0.65 0.00 0.00 175.02 174.81 2do8 h ASP 17 N 8.40 0.33 0.00 1.11 2.03 -1.99 -3.30 116.42 122.99 2do8 h ASP 17 Ca -0.15 -0.55 0.00 0.00 -0.73 0.00 0.00 57.03 55.60 2do8 h ASP 17 Cb 1.14 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 39.53 2do8 h ASP 17 CO 0.26 1.48 0.00 -0.67 -1.03 0.00 0.00 179.24 179.28 2do8 n ASP 18 N -3.39 0.00 -4.49 4.15 2.03 -1.26 -4.28 116.55 109.31 2do8 n ASP 18 Ca -0.20 0.56 -0.43 0.00 0.52 0.00 0.00 54.79 55.24 2do8 n ASP 18 Cb 1.05 -0.34 -0.03 0.00 -0.72 0.00 0.00 41.12 41.07 2do8 n ASP 18 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2do8 s GLU 19 N -1.41 3.38 0.35 -0.67 8.01 -1.26 -4.88 118.70 122.22 2do8 s GLU 19 Ca 0.00 -1.10 0.08 0.00 0.01 0.00 0.00 54.97 53.96 2do8 s GLU 19 Cb 0.00 -4.69 0.66 0.00 -4.31 0.00 0.00 34.13 25.78 2do8 s GLU 19 CO 0.00 -1.94 1.84 0.10 0.01 0.00 0.00 175.26 175.27 2do8 h TYR 20 N 9.47 0.31 -2.18 1.61 -0.00 -1.74 -3.18 116.97 121.26 2do8 h TYR 20 Ca -0.04 -0.05 -0.57 0.00 -0.00 0.00 0.00 58.73 58.07 2do8 h TYR 20 Cb 1.04 -0.08 -0.41 0.00 -0.00 0.00 0.00 36.73 37.27 2do8 h TYR 20 CO 1.12 0.47 -0.76 0.34 -0.00 0.00 0.00 178.16 179.34 2do8 n PHE 21 N -4.20 2.85 -2.59 0.10 7.35 -1.26 -4.81 117.46 114.89 2do8 n PHE 21 Ca -0.01 -3.98 -0.23 0.00 -0.76 0.00 0.00 57.45 52.48 2do8 n PHE 21 Cb 0.33 -0.49 0.04 0.00 0.35 0.00 0.00 39.48 39.71 2do8 n PHE 21 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2do8 s ASP 22 N -2.73 5.35 -1.32 -2.13 2.15 -1.20 -4.98 116.67 111.80 2do8 s ASP 22 Ca 0.43 0.25 -0.17 0.00 0.43 0.00 0.00 52.55 53.48 2do8 s ASP 22 Cb 0.23 -1.18 0.07 0.00 -0.30 0.00 0.00 42.92 41.74 2do8 s ASP 22 CO -0.08 -1.13 1.81 0.54 -0.17 0.00 0.00 175.17 176.14 2do8 n ARG 23 N -2.43 3.14 -2.31 4.34 3.00 -1.26 -4.90 116.66 116.24 2do8 n ARG 23 Ca 0.06 -3.18 -0.36 0.00 -0.01 0.00 0.00 57.85 54.37 2do8 n ARG 23 Cb 0.59 -3.47 -0.03 0.00 0.00 0.00 0.00 32.46 29.55 2do8 n ARG 23 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2do8 n THR 24 N 6.21 2.92 -0.69 0.55 -2.24 -1.26 -4.29 114.28 115.48 2do8 n THR 24 Ca 0.49 -3.04 0.00 0.00 -2.27 0.00 0.00 64.05 59.24 2do8 n THR 24 Cb 0.45 -2.26 0.00 0.00 -2.10 0.00 0.00 70.33 66.42 2do8 n THR 24 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2do8 n VAL 25 N 7.09 -2.79 0.00 2.28 0.31 -1.26 -4.74 118.33 119.23 2do8 n VAL 25 Ca 0.47 1.00 0.00 0.00 -0.01 0.00 0.00 64.34 65.80 2do8 n VAL 25 Cb 0.46 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 2do8 n VAL 25 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2do8 n ILE 26 N -0.34 0.00 -4.47 2.52 0.13 -1.14 -4.99 119.36 111.06 2do8 n ILE 26 Ca 0.00 0.00 -0.23 0.00 -1.10 0.00 0.00 62.75 61.42 2do8 n ILE 26 Cb 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 39.64 38.71 2do8 n ILE 26 CO 0.00 0.00 0.00 -0.72 2.80 0.00 0.00 176.55 178.63 2do8 s TYR 27 N 1.36 1.84 -0.21 9.51 1.13 -1.26 -3.83 117.35 125.90 2do8 s TYR 27 Ca 0.00 -1.12 -0.10 0.00 -1.41 0.00 0.00 57.07 54.44 2do8 s TYR 27 Cb 0.00 -1.20 -0.05 0.00 -1.10 0.00 0.00 41.96 39.61 2do8 s TYR 27 CO 0.00 -0.16 0.13 0.42 -2.51 0.00 0.00 175.55 173.44 2do8 s ILE 28 N -3.29 5.31 -0.11 -3.49 -1.09 0.24 -2.48 121.20 116.30 2do8 s ILE 28 Ca 0.30 0.16 -0.07 0.00 -2.23 0.00 0.00 60.65 58.81 2do8 s ILE 28 Cb 0.06 -3.44 -0.06 0.00 -1.58 0.00 0.00 42.46 37.44 2do8 s ILE 28 CO 0.15 0.41 0.18 0.00 -1.23 0.00 0.00 174.94 174.45 2do8 s GLU 30 N -1.74 0.76 -0.18 0.00 -1.05 -0.89 -4.48 118.70 111.12 2do8 s GLU 30 Ca -0.04 -0.83 -0.02 0.00 -0.15 0.00 0.00 54.97 53.92 2do8 s GLU 30 Cb -0.01 0.31 0.05 0.00 -0.44 0.00 0.00 34.13 34.05 2do8 s GLU 30 CO 0.16 -0.23 0.01 -1.58 0.95 0.00 0.00 175.26 174.57 2do8 s HIS 31 N -3.31 1.21 0.40 4.83 5.65 -1.26 -0.38 115.29 122.43 2do8 s HIS 31 Ca 0.01 -0.89 0.02 0.00 0.25 0.00 0.00 55.06 54.44 2do8 s HIS 31 Cb 0.02 -1.09 -0.01 0.00 -1.18 0.00 0.00 32.58 30.32 2do8 s HIS 31 CO -0.08 -0.59 0.59 -0.80 -0.65 0.00 0.00 174.74 173.21 2do8 s ASN 32 N 1.80 5.99 0.45 9.88 0.02 0.19 -4.97 114.94 128.30 2do8 s ASN 32 Ca -0.00 0.23 0.13 0.00 -1.02 0.00 0.00 52.86 52.20 2do8 s ASN 32 Cb -0.16 -1.61 1.02 0.00 0.02 0.00 0.00 41.25 40.51 2do8 s ASN 32 CO -0.07 -0.53 2.03 -0.78 0.02 0.00 0.00 177.10 177.76 2do8 h ASP 33 N 0.60 0.10 0.12 -1.22 3.58 -2.02 -2.96 116.42 114.63 2do8 h ASP 33 Ca -0.47 -0.01 -0.36 0.00 0.42 0.00 0.00 57.03 56.61 2do8 h ASP 33 Cb 1.24 -0.03 -0.06 0.00 1.72 0.00 0.00 39.33 42.21 2do8 h ASP 33 CO 0.58 0.19 -2.22 -3.20 -2.88 0.00 0.00 179.24 171.71 2do8 n ASN 34 N -4.39 0.99 -4.00 2.28 5.15 -1.26 -4.03 115.26 109.99 2do8 n ASN 34 Ca -0.02 0.08 -0.28 0.00 -0.60 0.00 0.00 54.58 53.76 2do8 n ASN 34 Cb 0.18 0.16 -0.17 0.00 -0.53 0.00 0.00 39.78 39.43 2do8 n ASN 34 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2do8 s GLY 35 N -5.69 0.95 -0.28 8.20 0.00 -1.12 -2.25 107.32 107.13 2do8 s GLY 35 Ca -0.17 -0.66 -0.06 0.00 0.00 0.00 0.00 44.72 43.83 2do8 s GLY 35 CO 0.76 0.44 0.06 -1.59 0.00 0.00 0.00 173.10 172.77 2do8 s THR 36 N 1.25 3.89 -0.26 0.90 2.01 -1.16 0.55 115.64 122.82 2do8 s THR 36 Ca -0.02 -0.60 -0.08 0.00 0.31 0.00 0.00 61.69 61.29 2do8 s THR 36 Cb -0.14 -2.95 -0.03 0.00 0.01 0.00 0.00 72.50 69.39 2do8 s THR 36 CO -0.05 0.17 0.11 -0.63 -0.69 0.00 0.00 174.62 173.53 2do8 s ILE 37 N 1.51 4.61 0.15 1.82 1.09 0.49 -1.49 121.20 129.37 2do8 s ILE 37 Ca 0.03 -0.07 -0.11 0.00 -1.10 0.00 0.00 60.65 59.40 2do8 s ILE 37 Cb -0.16 -3.17 0.00 0.00 -1.06 0.00 0.00 42.46 38.07 2do8 s ILE 37 CO 0.02 0.31 0.32 -0.83 -0.10 0.00 0.00 174.94 174.66 2do8 s GLY 38 N 1.64 0.22 -0.63 6.18 0.00 -0.49 -0.54 107.32 113.70 2do8 s GLY 38 Ca 0.07 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.16 2do8 s GLY 38 CO 0.06 -0.68 0.43 -1.34 0.00 0.00 0.00 173.10 171.57 2do8 s VAL 39 N -3.91 3.35 -0.07 1.40 -7.23 -1.03 -1.77 120.40 111.13 2do8 s VAL 39 Ca 0.12 -3.32 0.16 0.00 -1.81 0.00 0.00 61.98 57.13 2do8 s VAL 39 Cb 0.03 -3.20 0.33 0.00 0.56 0.00 0.00 36.38 34.09 2do8 s VAL 39 CO -0.04 -0.89 1.15 2.30 -0.31 0.00 0.00 175.10 177.31 2do8 n ILE 40 N 3.07 0.82 -0.09 -0.62 -0.00 -1.26 -2.88 119.36 118.39 2do8 n ILE 40 Ca 0.10 -1.57 -0.03 0.00 -0.00 0.00 0.00 62.75 61.24 2do8 n ILE 40 Cb 0.36 0.43 0.19 0.00 -0.00 0.00 0.00 39.64 40.61 2do8 n ILE 40 CO 0.00 0.00 0.00 -0.29 -0.00 0.00 0.00 176.55 176.26 2do8 h ILE 41 N 4.56 1.23 -5.01 7.28 6.09 -1.86 -3.42 117.51 126.38 2do8 h ILE 41 Ca -0.10 -0.94 -0.13 0.00 -1.37 0.00 0.00 64.86 62.33 2do8 h ILE 41 Cb 1.46 0.85 0.10 0.00 0.47 0.00 0.00 36.82 39.71 2do8 h ILE 41 CO 0.04 0.33 -0.44 -3.20 -3.07 0.00 0.00 178.15 171.82 2do8 n ASN 42 N -4.24 -6.24 0.00 2.19 4.05 -1.26 -4.98 115.26 104.78 2do8 n ASN 42 Ca 0.03 -0.38 0.00 0.00 0.45 0.00 0.00 54.58 54.67 2do8 n ASN 42 Cb 0.28 -4.49 0.00 0.00 1.23 0.00 0.00 39.78 36.80 2do8 n ASN 42 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 177.26 175.28 2do8 n THR 43 N -2.43 0.00 -3.35 -0.44 5.66 -1.26 -5.00 114.28 107.45 2do8 n THR 43 Ca -0.04 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.69 2do8 n THR 43 Cb 0.56 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.31 2do8 n THR 43 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2do8 s PRO 44 N -0.00 3.59 0.68 1.09 0.04 -1.26 -3.04 135.00 136.10 2do8 s PRO 44 Ca 0.00 -0.09 -0.05 0.00 0.04 0.00 0.00 61.00 60.89 2do8 s PRO 44 Cb 0.00 -2.66 0.14 0.00 0.04 0.00 0.00 34.50 32.03 2do8 s PRO 44 CO 0.00 0.20 0.93 0.25 0.04 0.00 0.00 177.00 178.42 2do8 n THR 45 N -1.13 0.00 1.15 1.26 -2.24 -0.20 -4.78 114.28 108.33 2do8 n THR 45 Ca -0.03 -1.10 0.12 0.00 -2.27 0.00 0.00 64.05 60.78 2do8 n THR 45 Cb 0.54 -1.22 0.21 0.00 -2.10 0.00 0.00 70.33 67.76 2do8 n THR 45 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2do8 n ASP 46 N -3.23 1.91 -4.91 3.42 2.03 -1.26 -4.69 116.55 109.82 2do8 n ASP 46 Ca 0.14 -1.47 -0.27 0.00 0.52 0.00 0.00 54.79 53.71 2do8 n ASP 46 Cb 0.48 0.19 -0.01 0.00 -0.72 0.00 0.00 41.12 41.06 2do8 n ASP 46 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2do8 s LEU 47 N -2.29 3.86 0.16 -2.67 2.96 -1.26 -4.97 118.68 114.46 2do8 s LEU 47 Ca 0.26 0.76 0.09 0.00 -0.22 0.00 0.00 54.13 55.01 2do8 s LEU 47 Cb 0.19 -3.65 -0.04 0.00 0.50 0.00 0.00 46.19 43.19 2do8 s LEU 47 CO 0.45 -0.39 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.54 2do8 s SER 48 N -3.78 4.22 0.26 3.68 0.01 -1.26 -0.57 113.70 116.26 2do8 s SER 48 Ca 0.45 -0.54 -0.03 0.00 1.31 0.00 0.00 55.95 57.14 2do8 s SER 48 Cb -0.10 -0.71 0.33 0.00 0.21 0.00 0.00 66.02 65.74 2do8 s SER 48 CO 0.38 0.13 1.79 1.62 0.41 0.00 0.00 173.24 177.57 2do8 h VAL 49 N 2.97 1.24 -0.33 3.43 3.04 -1.01 -2.03 116.25 123.56 2do8 h VAL 49 Ca -0.48 -0.88 -0.04 0.00 -1.01 0.00 0.00 66.70 64.29 2do8 h VAL 49 Cb 1.19 0.67 -0.02 0.00 -2.01 0.00 0.00 31.29 31.13 2do8 h VAL 49 CO 0.52 0.33 0.03 -0.07 -1.01 0.00 0.00 177.57 177.37 2do8 h LEU 50 N 0.85 0.47 -0.47 3.16 3.38 -1.96 -0.13 115.31 120.60 2do8 h LEU 50 Ca 0.18 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2do8 h LEU 50 Cb 0.34 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2do8 h LEU 50 CO 0.00 0.51 0.17 -0.33 0.09 0.00 0.00 178.44 178.89 2do8 h GLU 51 N 0.49 0.72 -0.24 1.13 5.08 -1.72 -2.15 114.58 117.89 2do8 h GLU 51 Ca 0.11 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2do8 h GLU 51 Cb 0.27 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2do8 h GLU 51 CO 0.00 0.66 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.59 2do8 h LEU 52 N 0.62 0.43 -0.28 1.33 3.38 -0.90 -1.02 115.31 118.87 2do8 h LEU 52 Ca 0.16 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.84 2do8 h LEU 52 Cb 0.22 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2do8 h LEU 52 CO -0.01 0.66 0.02 -0.07 0.09 0.00 0.00 178.44 179.13 2do8 h LEU 53 N 0.20 -0.06 -0.62 1.67 3.38 -0.94 0.99 115.31 119.93 2do8 h LEU 53 Ca 0.07 0.06 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 2do8 h LEU 53 Cb 0.44 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2do8 h LEU 53 CO 0.02 0.00 -0.67 0.71 0.09 0.00 0.00 178.44 178.59 2do8 h THR 54 N 0.11 1.44 0.14 0.22 1.35 -1.41 -2.85 112.91 111.92 2do8 h THR 54 Ca 0.13 -2.20 -0.01 0.00 -0.55 0.00 0.00 66.41 63.78 2do8 h THR 54 Cb 0.16 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 2do8 h THR 54 CO -0.21 0.64 -0.07 -0.09 -0.25 0.00 0.00 175.52 175.55 2do8 h ARG 55 N 0.08 -0.18 0.00 4.72 2.43 -0.63 -3.43 114.38 117.38 2do8 h ARG 55 Ca -0.01 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2do8 h ARG 55 Cb 1.19 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2do8 h ARG 55 CO 0.10 0.21 0.00 -1.33 -1.51 0.00 0.00 179.97 177.44 2do8 n MET 56 N -4.98 0.00 -3.61 0.20 2.81 0.29 -5.08 117.12 106.75 2do8 n MET 56 Ca -0.09 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.68 2do8 n MET 56 Cb 0.24 0.00 -0.07 0.00 -0.71 0.00 0.00 33.22 32.69 2do8 n MET 56 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2do8 s ASP 57 N -1.00 -0.58 -0.02 7.83 -1.08 -1.08 -5.04 116.67 115.71 2do8 s ASP 57 Ca 0.00 1.02 0.06 0.00 -0.52 0.00 0.00 52.55 53.10 2do8 s ASP 57 Cb 0.00 1.00 0.10 0.00 -1.46 0.00 0.00 42.92 42.56 2do8 s ASP 57 CO 0.00 -0.26 1.04 2.22 0.52 0.00 0.00 175.17 178.69 2do8 n PHE 58 N 2.07 0.00 -1.76 -5.34 -1.74 -1.24 -4.84 117.46 104.61 2do8 n PHE 58 Ca -0.14 -0.20 0.00 0.00 -0.56 0.00 0.00 57.45 56.55 2do8 n PHE 58 Cb 0.56 -0.08 0.00 0.00 1.52 0.00 0.00 39.48 41.48 2do8 n PHE 58 CO 0.00 0.00 0.00 1.04 -0.56 0.00 0.00 176.76 177.24 2do8 n GLN 59 N -0.10 -3.41 -1.09 3.97 3.00 -1.26 -4.86 117.38 113.63 2do8 n GLN 59 Ca 0.03 2.64 -0.30 0.00 -0.01 0.00 0.00 57.00 59.36 2do8 n GLN 59 Cb 0.76 -3.08 0.14 0.00 0.00 0.00 0.00 30.24 28.07 2do8 n GLN 59 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.06 178.47 2do8 s MET 60 N -1.23 1.18 0.00 -1.09 1.75 -1.26 -3.33 119.30 115.33 2do8 s MET 60 Ca 0.00 0.97 0.00 0.00 -1.25 0.00 0.00 55.69 55.41 2do8 s MET 60 Cb 0.00 -1.79 0.00 0.00 2.84 0.00 0.00 34.83 35.88 2do8 s MET 60 CO 0.00 -2.34 0.00 0.00 -0.65 0.00 0.00 175.02 172.03 2do8 n ALA 61 N -3.97 0.00 -2.70 4.11 0.00 -1.26 -5.02 120.51 111.68 2do8 n ALA 61 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.14 2do8 n ALA 61 Cb 0.54 -0.17 -0.08 0.00 0.00 0.00 0.00 19.45 19.75 2do8 n ALA 61 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2do8 s LYS 62 N -0.20 4.20 0.17 0.00 2.20 -1.21 -5.05 119.74 119.85 2do8 s LYS 62 Ca 0.00 0.09 -0.31 0.00 -0.36 0.00 0.00 55.97 55.38 2do8 s LYS 62 Cb 0.00 -3.49 -0.10 0.00 -1.51 0.00 0.00 37.83 32.74 2do8 s LYS 62 CO 0.00 0.10 1.53 -1.25 -0.36 0.00 0.00 175.35 175.37 2do8 s PRO 63 N 0.88 4.24 0.03 4.03 0.04 -1.26 -5.02 135.00 137.94 2do8 s PRO 63 Ca 0.16 2.32 -0.05 0.00 0.04 0.00 0.00 61.00 63.47 2do8 s PRO 63 Cb -0.14 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.23 2do8 s PRO 63 CO 0.06 -0.56 0.08 -0.98 0.04 0.00 0.00 177.00 175.63 2do8 s ARG 64 N 0.95 0.55 0.52 4.56 1.04 -1.26 -5.08 118.95 120.23 2do8 s ARG 64 Ca 0.68 -0.72 0.01 0.00 -1.04 0.00 0.00 55.73 54.66 2do8 s ARG 64 Cb -0.43 0.21 -0.00 0.00 -2.04 0.00 0.00 34.95 32.69 2do8 s ARG 64 CO 0.32 -0.13 0.05 0.96 -0.04 0.00 0.00 175.30 176.47 2do8 s ILE 65 N -2.41 1.19 -0.50 4.99 -4.36 -1.26 -5.11 121.20 113.74 2do8 s ILE 65 Ca -0.07 -1.93 0.04 0.00 -0.26 0.00 0.00 60.65 58.43 2do8 s ILE 65 Cb -0.02 -2.12 0.16 0.00 1.25 0.00 0.00 42.46 41.73 2do8 s ILE 65 CO -0.04 0.00 0.37 -0.47 0.24 0.00 0.00 174.94 175.04 2do8 s TYR 66 N -2.87 1.93 0.00 1.37 5.04 -1.26 -5.08 117.35 116.48 2do8 s TYR 66 Ca 0.08 -2.61 0.00 0.00 -2.44 0.00 0.00 57.07 52.10 2do8 s TYR 66 Cb 0.01 -1.58 0.00 0.00 0.35 0.00 0.00 41.96 40.74 2do8 s TYR 66 CO 0.05 -0.74 0.00 -2.37 -1.34 0.00 0.00 175.55 171.15 2do8 n THR 67 N 2.73 0.00 -3.13 4.34 5.66 -1.26 -5.07 114.28 117.55 2do8 n THR 67 Ca 0.23 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 61.15 2do8 n THR 67 Cb 0.42 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.20 2do8 n THR 67 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 2do8 n GLN 68 N -0.07 -1.67 -2.24 1.09 7.27 -1.26 -4.88 117.38 115.62 2do8 n GLN 68 Ca 0.00 1.56 -0.42 0.00 0.07 0.00 0.00 57.00 58.21 2do8 n GLN 68 Cb 0.00 -5.06 -0.03 0.00 2.41 0.00 0.00 30.24 27.56 2do8 n GLN 68 CO 0.00 0.00 0.00 0.16 0.07 0.00 0.00 177.06 177.29 2do8 s ASP 69 N -2.80 6.89 -0.35 1.69 -4.77 -1.26 -5.00 116.67 111.07 2do8 s ASP 69 Ca 0.09 2.20 -0.11 0.00 -3.30 0.00 0.00 52.55 51.42 2do8 s ASP 69 Cb -0.02 -2.58 0.01 0.00 -1.09 0.00 0.00 42.92 39.24 2do8 s ASP 69 CO 0.78 -0.63 0.20 -1.10 0.70 0.00 0.00 175.17 175.13 2do8 s GLN 70 N 1.42 3.13 0.30 2.11 -1.52 -1.26 -5.07 119.66 118.77 2do8 s GLN 70 Ca 0.63 -0.88 -0.23 0.00 -1.95 0.00 0.00 55.36 52.94 2do8 s GLN 70 Cb -0.34 -3.71 -0.09 0.00 -0.22 0.00 0.00 33.01 28.65 2do8 s GLN 70 CO 0.29 -0.56 0.86 -1.64 -0.25 0.00 0.00 175.29 173.98 2do8 s MET 71 N 1.62 4.40 -0.04 2.91 -1.94 -1.26 -0.43 119.30 124.55 2do8 s MET 71 Ca 0.04 1.11 -0.06 0.00 -1.71 0.00 0.00 55.69 55.07 2do8 s MET 71 Cb -0.18 -2.75 -0.04 0.00 2.01 0.00 0.00 34.83 33.87 2do8 s MET 71 CO 0.07 0.28 0.20 0.54 -0.01 0.00 0.00 175.02 176.11 2do8 s VAL 72 N -1.66 5.41 0.49 -6.03 0.11 0.27 -4.63 120.40 114.36 2do8 s VAL 72 Ca 0.49 0.10 -0.02 0.00 -2.93 0.00 0.00 61.98 59.63 2do8 s VAL 72 Cb -0.16 -3.51 -0.00 0.00 -1.53 0.00 0.00 36.38 31.18 2do8 s VAL 72 CO 0.21 0.45 0.74 -0.76 -3.33 0.00 0.00 175.10 172.42 2do8 s LEU 73 N -1.53 3.53 -0.49 2.54 1.02 -1.01 -1.04 118.68 121.70 2do8 s LEU 73 Ca 0.23 0.46 -0.15 0.00 0.02 0.00 0.00 54.13 54.69 2do8 s LEU 73 Cb -0.13 -3.33 0.09 0.00 0.02 0.00 0.00 46.19 42.85 2do8 s LEU 73 CO 0.13 -0.79 0.42 0.21 0.02 0.00 0.00 176.35 176.34 2do8 s ASN 74 N -4.23 6.14 0.56 2.29 3.84 -1.17 -1.44 114.94 120.93 2do8 s ASN 74 Ca 0.50 -1.49 0.24 0.00 0.21 0.00 0.00 52.86 52.32 2do8 s ASN 74 Cb -0.10 -2.18 1.52 0.00 -0.55 0.00 0.00 41.25 39.93 2do8 s ASN 74 CO 0.40 -0.71 2.15 1.23 -2.79 0.00 0.00 177.10 177.38 2do8 h GLY 75 N 8.78 0.00 0.00 1.21 0.00 -0.98 -3.45 103.07 108.64 2do8 h GLY 75 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2do8 h GLY 75 CO 0.93 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.08 2do8 n GLY 76 N -1.47 1.19 0.08 4.60 0.00 -1.21 -1.63 105.19 106.75 2do8 n GLY 76 Ca -0.00 -1.11 0.11 0.00 0.00 0.00 0.00 46.02 45.02 2do8 n GLY 76 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2do8 n PRO 77 N -0.85 0.14 -4.07 1.61 -0.04 -1.26 -4.17 135.00 126.36 2do8 n PRO 77 Ca 0.00 0.31 -0.33 0.00 -0.04 0.00 0.00 63.50 63.44 2do8 n PRO 77 Cb 0.00 -1.73 -0.07 0.00 -0.04 0.00 0.00 33.50 31.66 2do8 n PRO 77 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2do8 s VAL 78 N -3.18 4.83 -1.62 0.52 1.01 -1.17 -4.47 120.40 116.32 2do8 s VAL 78 Ca 0.07 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.68 2do8 s VAL 78 Cb 0.11 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.27 2do8 s VAL 78 CO 0.40 0.35 0.00 0.59 0.00 0.00 0.00 175.10 176.44 2do8 n ASN 79 N 1.17 -5.00 0.03 3.32 3.02 -1.26 0.36 115.26 116.89 2do8 n ASN 79 Ca -0.13 0.21 0.07 0.00 -0.03 0.00 0.00 54.58 54.71 2do8 n ASN 79 Cb 0.53 -4.04 0.32 0.00 -0.61 0.00 0.00 39.78 35.98 2do8 n ASN 79 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 2do8 n GLN 80 N -2.56 0.04 0.09 3.52 7.27 -1.26 -0.77 117.38 123.70 2do8 n GLN 80 Ca -0.18 0.30 0.12 0.00 0.07 0.00 0.00 57.00 57.31 2do8 n GLN 80 Cb 0.60 -1.57 0.45 0.00 2.41 0.00 0.00 30.24 32.13 2do8 n GLN 80 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2do8 n ASP 81 N -1.64 0.59 -4.43 1.69 2.03 -1.26 -4.30 116.55 109.23 2do8 n ASP 81 Ca 0.03 0.59 -0.33 0.00 0.52 0.00 0.00 54.79 55.60 2do8 n ASP 81 Cb 0.17 -0.73 -0.14 0.00 -0.72 0.00 0.00 41.12 39.70 2do8 n ASP 81 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2do8 s ARG 82 N -3.15 3.01 -0.23 -0.67 0.52 0.05 -5.02 118.95 113.46 2do8 s ARG 82 Ca 0.09 -0.67 -0.29 0.00 -0.52 0.00 0.00 55.73 54.33 2do8 s ARG 82 Cb 0.12 -2.54 0.00 0.00 0.52 0.00 0.00 34.95 33.06 2do8 s ARG 82 CO 0.50 0.40 1.12 0.20 0.02 0.00 0.00 175.30 177.54 2do8 s GLY 83 N -0.15 1.65 -0.24 -3.53 0.00 -1.26 -2.43 107.32 101.36 2do8 s GLY 83 Ca -0.00 0.21 -0.07 0.00 0.00 0.00 0.00 44.72 44.85 2do8 s GLY 83 CO 0.03 2.30 0.07 -0.12 0.00 0.00 0.00 173.10 175.38 2do8 s PHE 84 N 3.40 3.10 -0.09 1.90 2.19 -0.16 -4.51 117.98 123.81 2do8 s PHE 84 Ca 0.48 -0.35 -0.03 0.00 0.33 0.00 0.00 56.93 57.36 2do8 s PHE 84 Cb -0.16 -2.21 0.05 0.00 -1.31 0.00 0.00 43.02 39.38 2do8 s PHE 84 CO 0.10 -0.28 0.12 0.42 1.83 0.00 0.00 175.22 177.41 2do8 s ILE 85 N 1.43 -0.19 -0.22 3.12 1.09 -1.18 -0.19 121.20 125.06 2do8 s ILE 85 Ca 0.05 0.27 -0.04 0.00 -1.10 0.00 0.00 60.65 59.83 2do8 s ILE 85 Cb -0.15 -0.32 -0.01 0.00 -1.06 0.00 0.00 42.46 40.93 2do8 s ILE 85 CO 0.04 0.07 -0.05 -0.69 -0.10 0.00 0.00 174.94 174.21 2do8 s VAL 86 N 2.23 3.34 0.17 2.92 1.01 -0.09 -0.03 120.40 129.95 2do8 s VAL 86 Ca 0.04 -0.52 0.06 0.00 0.00 0.00 0.00 61.98 61.56 2do8 s VAL 86 Cb -0.13 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 2do8 s VAL 86 CO -0.06 0.42 -0.12 -1.38 0.00 0.00 0.00 175.10 173.96 2do8 s HIS 87 N 1.47 1.44 0.72 5.22 -3.43 0.11 -0.18 115.29 120.64 2do8 s HIS 87 Ca 0.06 -0.67 -0.09 0.00 -0.80 0.00 0.00 55.06 53.55 2do8 s HIS 87 Cb -0.14 -0.71 0.05 0.00 -1.43 0.00 0.00 32.58 30.35 2do8 s HIS 87 CO -0.03 0.19 1.07 -1.12 -2.00 0.00 0.00 174.74 172.85 2do8 s SER 88 N -3.18 5.01 -0.17 7.38 0.01 0.06 -0.95 113.70 121.87 2do8 s SER 88 Ca 0.18 0.78 0.01 0.00 1.31 0.00 0.00 55.95 58.23 2do8 s SER 88 Cb 0.01 -1.47 0.01 0.00 0.21 0.00 0.00 66.02 64.78 2do8 s SER 88 CO 0.03 -1.54 -0.19 -0.54 0.41 0.00 0.00 173.24 171.41 2do8 s LYS 89 N -5.34 3.04 0.08 12.44 3.01 -0.32 -4.68 119.74 127.97 2do8 s LYS 89 Ca 0.59 -0.82 0.21 0.00 -1.01 0.00 0.00 55.97 54.95 2do8 s LYS 89 Cb -0.11 -2.56 -0.15 0.00 -1.01 0.00 0.00 37.83 34.00 2do8 s LYS 89 CO 0.48 -0.13 0.77 -2.37 0.51 0.00 0.00 175.35 174.61 2do8 n THR 90 N 4.41 0.49 0.30 2.17 5.66 -1.26 -4.05 114.28 122.01 2do8 n THR 90 Ca -0.20 -0.56 0.03 0.00 -3.05 0.00 0.00 64.05 60.27 2do8 n THR 90 Cb 0.51 -0.27 -0.00 0.00 -1.55 0.00 0.00 70.33 69.02 2do8 n THR 90 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2do8 n ASP 91 N -2.55 0.98 -1.94 1.09 -0.08 -1.26 -4.98 116.55 107.81 2do8 n ASP 91 Ca -0.04 -0.99 -0.14 0.00 -1.51 0.00 0.00 54.79 52.11 2do8 n ASP 91 Cb 0.62 0.48 0.02 0.00 2.34 0.00 0.00 41.12 44.57 2do8 n ASP 91 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2do8 n HIS 92 N -0.34 -1.16 -2.50 -0.67 8.25 -1.26 -5.03 115.22 112.51 2do8 n HIS 92 Ca 0.03 0.28 -0.25 0.00 -0.26 0.00 0.00 57.72 57.52 2do8 n HIS 92 Cb 0.14 -3.20 0.03 0.00 1.12 0.00 0.00 29.99 28.08 2do8 n HIS 92 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 2do8 s GLU 93 N -5.18 2.83 -0.29 -0.41 4.04 -1.26 -5.11 118.70 113.32 2do8 s GLU 93 Ca 0.16 -0.18 -0.07 0.00 0.04 0.00 0.00 54.97 54.93 2do8 s GLU 93 Cb -0.07 -2.33 0.15 0.00 0.02 0.00 0.00 34.13 31.89 2do8 s GLU 93 CO 0.20 -0.69 0.61 -0.59 -1.84 0.00 0.00 175.26 172.95 2do8 s PHE 94 N -2.92 -1.37 -0.13 4.83 -0.71 -1.26 -4.97 117.98 111.46 2do8 s PHE 94 Ca 0.54 2.03 -0.07 0.00 -1.04 0.00 0.00 56.93 58.39 2do8 s PHE 94 Cb -0.10 0.67 -0.02 0.00 -1.21 0.00 0.00 43.02 42.35 2do8 s PHE 94 CO 0.43 -0.72 -0.14 1.15 -1.34 0.00 0.00 175.22 174.60 2do8 h THR 95 N 6.02 0.00 -0.17 -4.49 2.02 -1.98 -3.44 112.91 110.87 2do8 h THR 95 Ca -0.19 -0.94 -0.20 0.00 0.77 0.00 0.00 66.41 65.85 2do8 h THR 95 Cb 1.12 0.00 -0.33 0.00 -1.74 0.00 0.00 68.15 67.20 2do8 h THR 95 CO 0.16 0.00 -0.87 1.41 0.37 0.00 0.00 175.52 176.59 2do8 n HIS 96 N -4.50 0.20 -3.25 3.16 8.25 -1.26 -4.93 115.22 112.88 2do8 n HIS 96 Ca -0.06 -1.30 -0.33 0.00 -0.26 0.00 0.00 57.72 55.77 2do8 n HIS 96 Cb 0.21 0.14 -0.06 0.00 1.12 0.00 0.00 29.99 31.40 2do8 n HIS 96 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2do8 s SER 97 N -2.45 6.77 -0.14 0.41 1.04 -1.26 -4.65 113.70 113.42 2do8 s SER 97 Ca 0.24 1.15 -0.07 0.00 0.48 0.00 0.00 55.95 57.75 2do8 s SER 97 Cb 0.32 -2.32 -0.04 0.00 0.10 0.00 0.00 66.02 64.08 2do8 s SER 97 CO -0.09 -0.08 0.09 -0.47 0.98 0.00 0.00 173.24 173.67 2do8 s TYR 98 N -1.79 3.40 -0.33 5.02 6.14 0.20 -4.93 117.35 125.06 2do8 s TYR 98 Ca 0.48 0.32 -0.23 0.00 0.64 0.00 0.00 57.07 58.28 2do8 s TYR 98 Cb -0.12 -1.99 0.00 0.00 0.42 0.00 0.00 41.96 40.27 2do8 s TYR 98 CO 0.19 0.46 0.77 0.15 0.64 0.00 0.00 175.55 177.77 2do8 s LYS 99 N -0.40 3.87 -0.21 4.97 -0.14 -1.26 -0.49 119.74 126.07 2do8 s LYS 99 Ca 0.10 0.45 -0.16 0.00 -1.36 0.00 0.00 55.97 55.00 2do8 s LYS 99 Cb -0.12 -3.76 -0.11 0.00 -1.68 0.00 0.00 37.83 32.16 2do8 s LYS 99 CO 0.02 -0.73 -0.17 0.28 -0.76 0.00 0.00 175.35 173.99 2do8 n VAL 100 N 5.62 1.50 -2.84 3.17 0.31 -1.02 -4.95 118.33 120.11 2do8 n VAL 100 Ca 0.03 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2do8 n VAL 100 Cb 0.48 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 31.29 2do8 n VAL 100 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2do8 n THR 101 N -4.41 0.00 0.24 2.52 5.66 -1.03 -4.98 114.28 112.28 2do8 n THR 101 Ca -0.31 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.59 2do8 n THR 101 Cb 0.64 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.37 2do8 n THR 101 CO 0.00 0.00 0.00 -0.78 -3.05 0.00 0.00 175.07 171.24 2do8 h ASP 102 N 0.00 -0.58 0.51 1.09 1.82 -1.99 -3.34 116.42 113.93 2do8 h ASP 102 Ca 0.00 0.02 -0.13 0.00 -0.39 0.00 0.00 57.03 56.54 2do8 h ASP 102 Cb 0.00 0.16 -0.02 0.00 0.68 0.00 0.00 39.33 40.14 2do8 h ASP 102 CO 0.00 -0.39 -1.60 0.47 -1.61 0.00 0.00 179.24 176.11 2do8 n ASP 103 N -3.78 0.55 -4.66 2.28 8.00 -1.26 -4.89 116.55 112.79 2do8 n ASP 103 Ca -0.08 0.23 -0.41 0.00 0.71 0.00 0.00 54.79 55.25 2do8 n ASP 103 Cb 0.26 0.73 -0.05 0.00 -0.02 0.00 0.00 41.12 42.04 2do8 n ASP 103 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2do8 s ILE 104 N -3.08 4.94 -0.01 0.53 -1.09 -1.25 -1.18 121.20 120.05 2do8 s ILE 104 Ca -0.05 1.39 0.02 0.00 -2.23 0.00 0.00 60.65 59.78 2do8 s ILE 104 Cb 0.10 -4.04 -0.00 0.00 -1.58 0.00 0.00 42.46 36.94 2do8 s ILE 104 CO 0.83 0.04 -0.07 0.42 -1.23 0.00 0.00 174.94 174.93 2do8 s THR 105 N 2.23 0.59 -0.01 2.92 -4.23 -0.12 -2.44 115.64 114.58 2do8 s THR 105 Ca 0.32 -0.29 -0.17 0.00 -1.18 0.00 0.00 61.69 60.38 2do8 s THR 105 Cb -0.16 -0.52 -0.06 0.00 1.34 0.00 0.00 72.50 73.11 2do8 s THR 105 CO 0.10 0.18 0.47 -0.22 -0.54 0.00 0.00 174.62 174.61 2do8 s LEU 106 N 0.04 4.44 -0.00 4.79 2.96 0.35 -0.71 118.68 130.55 2do8 s LEU 106 Ca -0.00 1.01 0.00 0.00 -0.22 0.00 0.00 54.13 54.93 2do8 s LEU 106 Cb -0.05 -2.70 -0.00 0.00 0.50 0.00 0.00 46.19 43.94 2do8 s LEU 106 CO -0.00 0.24 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.36 2do8 s THR 107 N -0.69 0.12 -0.08 3.68 2.01 0.95 0.61 115.64 122.24 2do8 s THR 107 Ca 0.26 -0.07 0.08 0.00 0.31 0.00 0.00 61.69 62.26 2do8 s THR 107 Cb -0.17 -0.11 -0.11 0.00 0.01 0.00 0.00 72.50 72.12 2do8 s THR 107 CO 0.14 0.03 0.05 0.35 -0.69 0.00 0.00 174.62 174.50 2do8 n THR 108 N 3.04 0.53 -3.58 -0.82 -2.24 -1.26 -3.11 114.28 106.83 2do8 n THR 108 Ca -0.12 -0.35 -0.11 0.00 -2.27 0.00 0.00 64.05 61.20 2do8 n THR 108 Cb 0.59 -0.67 -0.04 0.00 -2.10 0.00 0.00 70.33 68.11 2do8 n THR 108 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2do8 s SER 109 N -3.95 -0.33 0.00 3.42 0.01 -1.26 -4.87 113.70 106.72 2do8 s SER 109 Ca -0.04 -0.24 0.00 0.00 1.31 0.00 0.00 55.95 56.98 2do8 s SER 109 Cb 0.03 0.52 0.00 0.00 0.21 0.00 0.00 66.02 66.77 2do8 s SER 109 CO 0.35 -0.90 0.00 0.61 0.41 0.00 0.00 173.24 173.71 2do8 n GLY 110 N -0.28 1.43 0.20 3.44 0.00 -1.26 -4.18 105.19 104.54 2do8 n GLY 110 Ca -0.16 0.36 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 2do8 n GLY 110 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2do8 h ASP 111 N 0.00 -0.20 -0.65 1.61 1.82 -1.92 -1.26 116.42 115.82 2do8 h ASP 111 Ca 0.00 0.12 -0.05 0.00 -0.39 0.00 0.00 57.03 56.71 2do8 h ASP 111 Cb 0.00 0.21 -0.03 0.00 0.68 0.00 0.00 39.33 40.19 2do8 h ASP 111 CO 0.00 -0.07 0.22 1.62 -1.61 0.00 0.00 179.24 179.40 2do8 h VAL 112 N 0.12 1.25 -0.13 2.25 3.04 -1.92 0.86 116.25 121.71 2do8 h VAL 112 Ca 0.25 -0.83 -0.12 0.00 -1.01 0.00 0.00 66.70 64.98 2do8 h VAL 112 Cb 0.37 0.49 -0.01 0.00 -2.01 0.00 0.00 31.29 30.13 2do8 h VAL 112 CO -0.41 0.33 -0.43 -0.07 -1.01 0.00 0.00 177.57 175.97 2do8 h LEU 113 N 0.99 0.33 -0.40 3.16 -0.00 -1.64 -2.74 115.31 115.02 2do8 h LEU 113 Ca 0.22 -0.15 -0.14 0.00 -0.00 0.00 0.00 57.88 57.81 2do8 h LEU 113 Cb 0.27 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 40.81 2do8 h LEU 113 CO -0.01 0.73 -0.67 -0.78 -0.00 0.00 0.00 178.44 177.71 2do8 h ASP 114 N 0.26 0.00 0.58 -0.43 3.58 -0.64 -3.36 116.42 116.41 2do8 h ASP 114 Ca 0.02 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.45 2do8 h ASP 114 Cb 0.87 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.92 2do8 h ASP 114 CO 0.07 0.67 -0.38 0.28 -2.88 0.00 0.00 179.24 177.00 2do8 h SER 115 N 0.00 -0.97 -0.29 2.28 0.02 -0.53 -3.09 113.55 110.97 2do8 h SER 115 Ca -0.01 0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 60.87 2do8 h SER 115 Cb 1.33 0.29 -0.08 0.00 0.14 0.00 0.00 62.40 64.09 2do8 h SER 115 CO 0.09 -0.57 0.16 2.22 -1.14 0.00 0.00 176.83 177.59 2do8 n PHE 116 N -4.78 0.91 -1.02 3.45 1.16 -1.23 -3.57 117.46 112.38 2do8 n PHE 116 Ca -0.11 -0.77 0.08 0.00 -1.87 0.00 0.00 57.45 54.78 2do8 n PHE 116 Cb 0.38 -0.42 0.26 0.00 -1.61 0.00 0.00 39.48 38.09 2do8 n PHE 116 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2do8 n GLY 117 N 0.03 4.09 3.82 4.97 0.00 -1.17 -5.01 105.19 111.92 2do8 n GLY 117 Ca 0.17 -1.05 -0.06 0.00 0.00 0.00 0.00 46.02 45.08 2do8 n GLY 117 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2do8 s THR 118 N -2.85 0.00 -0.02 2.61 -1.32 -1.24 -5.03 115.64 107.78 2do8 s THR 118 Ca 0.42 -0.85 0.32 0.00 -1.21 0.00 0.00 61.69 60.36 2do8 s THR 118 Cb 0.34 -2.27 0.37 0.00 -1.51 0.00 0.00 72.50 69.44 2do8 s THR 118 CO 0.08 0.00 1.92 1.56 -2.21 0.00 0.00 174.62 175.97 2do8 h GLN 119 N 2.00 0.00 -0.78 7.08 4.20 -1.95 -2.59 115.11 123.07 2do8 h GLN 119 Ca -0.24 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.47 2do8 h GLN 119 Cb 1.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.02 2do8 h GLN 119 CO 0.29 0.00 0.00 0.25 -0.67 0.00 0.00 178.83 178.70 2do8 n THR 120 N -3.01 0.56 -1.89 -0.54 -2.24 -1.26 -4.87 114.28 101.03 2do8 n THR 120 Ca 0.01 -0.30 -0.42 0.00 -2.27 0.00 0.00 64.05 61.07 2do8 n THR 120 Cb 0.33 -0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.18 2do8 n THR 120 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2do8 s ALA 121 N -1.47 3.81 0.35 6.98 0.00 -0.98 -4.81 121.76 125.64 2do8 s ALA 121 Ca 0.12 1.41 -0.29 0.00 0.00 0.00 0.00 51.96 53.21 2do8 s ALA 121 Cb 0.09 -3.64 -0.11 0.00 0.00 0.00 0.00 23.12 19.46 2do8 s ALA 121 CO 0.04 -0.82 1.43 -1.25 0.00 0.00 0.00 175.76 175.16 2do8 s PRO 122 N 1.21 4.20 0.10 0.00 0.04 -1.26 -4.94 135.00 134.35 2do8 s PRO 122 Ca 0.71 2.43 -0.21 0.00 0.04 0.00 0.00 61.00 63.98 2do8 s PRO 122 Cb -0.45 -3.02 -0.10 0.00 0.04 0.00 0.00 34.50 30.98 2do8 s PRO 122 CO 0.31 -0.42 1.73 0.93 0.04 0.00 0.00 177.00 179.60 2do8 h GLU 123 N 3.43 0.18 -4.87 4.56 5.08 -1.92 -3.43 114.58 117.61 2do8 h GLU 123 Ca -0.50 -0.02 -0.65 0.00 -1.00 0.00 0.00 59.36 57.20 2do8 h GLU 123 Cb 1.23 -0.04 -0.18 0.00 0.50 0.00 0.00 28.75 30.26 2do8 h GLU 123 CO 0.67 0.16 -0.53 0.15 -1.00 0.00 0.00 179.01 178.46 2do8 s LYS 124 N -6.04 3.81 -0.22 2.33 -0.14 -1.26 -5.03 119.74 113.19 2do8 s LYS 124 Ca -0.13 -0.41 -0.11 0.00 -1.36 0.00 0.00 55.97 53.96 2do8 s LYS 124 Cb 0.07 -3.63 0.07 0.00 -1.68 0.00 0.00 37.83 32.67 2do8 s LYS 124 CO 0.68 -0.23 0.52 -0.59 -0.76 0.00 0.00 175.35 174.97 2do8 s PHE 125 N 1.73 -0.83 -0.12 3.18 -0.71 -1.26 -0.76 117.98 119.21 2do8 s PHE 125 Ca 0.07 1.66 -0.02 0.00 -1.04 0.00 0.00 56.93 57.60 2do8 s PHE 125 Cb -0.16 0.43 -0.03 0.00 -1.21 0.00 0.00 43.02 42.05 2do8 s PHE 125 CO 0.10 -0.44 -0.05 0.96 -1.34 0.00 0.00 175.22 174.45 2do8 s ILE 126 N 1.75 3.85 -0.13 -4.49 -4.36 0.75 -4.95 121.20 113.62 2do8 s ILE 126 Ca -0.08 -0.39 0.01 0.00 -0.26 0.00 0.00 60.65 59.93 2do8 s ILE 126 Cb -0.08 -2.65 -0.01 0.00 1.25 0.00 0.00 42.46 40.97 2do8 s ILE 126 CO -0.15 0.53 -0.17 0.54 0.24 0.00 0.00 174.94 175.93 2do8 s VAL 127 N -0.07 2.65 0.02 8.37 0.11 -1.26 -0.91 120.40 129.32 2do8 s VAL 127 Ca 0.01 -0.80 -0.05 0.00 -2.93 0.00 0.00 61.98 58.21 2do8 s VAL 127 Cb -0.13 -2.09 -0.01 0.00 -1.53 0.00 0.00 36.38 32.62 2do8 s VAL 127 CO 0.03 0.53 0.09 0.00 -3.33 0.00 0.00 175.10 172.42 2do8 s LEU 129 N -1.70 4.10 0.00 0.00 2.01 -0.52 -0.99 118.68 121.58 2do8 s LEU 129 Ca -0.11 -0.33 0.00 0.00 0.01 0.00 0.00 54.13 53.70 2do8 s LEU 129 Cb -0.05 -2.05 0.00 0.00 0.01 0.00 0.00 46.19 44.09 2do8 s LEU 129 CO -0.01 -0.15 0.00 0.61 1.01 0.00 0.00 176.35 177.81 2do8 n GLY 130 N 5.02 -2.40 3.32 -3.19 0.00 -1.02 -0.65 105.19 106.27 2do8 n GLY 130 Ca -0.14 -1.60 -0.09 0.00 0.00 0.00 0.00 46.02 44.18 2do8 n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2do8 s SER 132 N -2.93 6.13 -0.22 0.00 0.01 -0.65 -3.04 113.70 113.01 2do8 s SER 132 Ca 0.13 -0.36 -0.03 0.00 1.31 0.00 0.00 55.95 57.00 2do8 s SER 132 Cb 0.03 -2.17 -0.01 0.00 0.21 0.00 0.00 66.02 64.08 2do8 s SER 132 CO -0.03 -0.31 -0.05 0.42 0.41 0.00 0.00 173.24 173.67 2do8 s THR 133 N 1.89 3.28 -0.00 1.44 -4.23 -1.25 -1.39 115.64 115.38 2do8 s THR 133 Ca 0.09 -0.52 -0.23 0.00 -1.18 0.00 0.00 61.69 59.84 2do8 s THR 133 Cb -0.17 -2.49 -0.05 0.00 1.34 0.00 0.00 72.50 71.14 2do8 s THR 133 CO 0.11 0.43 0.71 0.86 -0.54 0.00 0.00 174.62 176.19 2do8 s TRP 134 N 1.46 3.68 0.68 3.99 -0.11 -0.56 -4.90 118.94 123.18 2do8 s TRP 134 Ca 0.06 1.34 -0.16 0.00 1.22 0.00 0.00 56.10 58.56 2do8 s TRP 134 Cb -0.14 -2.77 0.01 0.00 -1.50 0.00 0.00 33.47 29.07 2do8 s TRP 134 CO -0.04 0.23 1.18 0.15 -4.62 0.00 0.00 176.95 173.86 2do8 s LYS 135 N 0.18 2.51 -0.44 5.86 1.02 -1.26 -2.98 119.74 124.63 2do8 s LYS 135 Ca 0.37 1.68 -0.12 0.00 0.02 0.00 0.00 55.97 57.92 2do8 s LYS 135 Cb -0.19 -1.89 -0.10 0.00 -0.52 0.00 0.00 37.83 35.13 2do8 s LYS 135 CO 0.20 -1.53 1.13 -2.30 -0.92 0.00 0.00 175.35 171.93 2do8 n PRO 136 N -2.36 0.00 -0.58 -1.68 -0.02 -0.96 -0.64 135.00 128.77 2do8 n PRO 136 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 2do8 n PRO 136 Cb 0.50 -0.61 0.00 0.00 -0.02 0.00 0.00 33.50 33.37 2do8 n PRO 136 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 2do8 n HIS 137 N 4.19 0.00 0.23 6.00 -0.00 -1.26 -4.82 115.22 119.57 2do8 n HIS 137 Ca 0.29 0.00 0.06 0.00 -0.00 0.00 0.00 57.72 58.07 2do8 n HIS 137 Cb 0.02 -0.57 0.53 0.00 -0.00 0.00 0.00 29.99 29.97 2do8 n HIS 137 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.34 176.71 2do8 h GLN 138 N 1.58 0.01 0.00 1.57 4.15 -1.20 -2.29 115.11 118.93 2do8 h GLN 138 Ca 0.00 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 2do8 h GLN 138 Cb 0.00 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.69 2do8 h GLN 138 CO 0.00 0.15 -0.01 1.25 -1.93 0.00 0.00 178.83 178.29 2do8 h LEU 139 N 0.01 0.00 -0.82 -2.39 5.85 -1.88 -0.18 115.31 115.90 2do8 h LEU 139 Ca 0.00 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 2do8 h LEU 139 Cb 0.25 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2do8 h LEU 139 CO 0.02 0.01 0.07 -0.08 -0.34 0.00 0.00 178.44 178.11 2do8 h GLU 140 N 0.00 0.95 -0.25 1.25 4.81 -1.80 0.19 114.58 119.74 2do8 h GLU 140 Ca -0.00 -0.25 -0.15 0.00 -0.13 0.00 0.00 59.36 58.83 2do8 h GLU 140 Cb 0.01 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 2do8 h GLU 140 CO 0.00 0.90 -0.47 1.96 -0.73 0.00 0.00 179.01 180.66 2do8 h GLN 141 N 0.89 0.66 -0.50 1.92 7.50 -1.19 -0.21 115.11 124.18 2do8 h GLN 141 Ca 0.18 -0.38 -0.03 0.00 0.50 0.00 0.00 58.65 58.92 2do8 h GLN 141 Cb 0.43 0.03 -0.02 0.00 0.05 0.00 0.00 27.48 27.96 2do8 h GLN 141 CO 0.01 0.99 0.19 0.93 -1.50 0.00 0.00 178.83 179.45 2do8 h GLU 142 N 0.53 0.75 -0.06 1.46 4.39 -0.84 -2.24 114.58 118.57 2do8 h GLU 142 Ca 0.03 -0.14 -0.10 0.00 0.34 0.00 0.00 59.36 59.49 2do8 h GLU 142 Cb 1.02 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.54 2do8 h GLU 142 CO 0.10 0.68 -0.41 0.82 -1.16 0.00 0.00 179.01 179.04 2do8 h ILE 143 N 0.67 1.30 0.00 3.13 2.04 -0.86 -2.49 117.51 121.30 2do8 h ILE 143 Ca 0.17 -1.46 -0.02 0.00 1.00 0.00 0.00 64.86 64.54 2do8 h ILE 143 Cb 0.21 1.72 -0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2do8 h ILE 143 CO -0.01 0.43 -0.12 0.00 0.00 0.00 0.00 178.15 178.45 2do8 h ALA 144 N 1.48 1.25 -0.01 1.87 0.00 -0.49 0.61 119.26 123.97 2do8 h ALA 144 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2do8 h ALA 144 Cb 0.77 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2do8 h ALA 144 CO 0.06 0.15 -0.01 1.04 0.00 0.00 0.00 179.25 180.48 2do8 n GLN 145 N -3.59 1.17 -1.39 0.00 6.02 -0.89 -4.90 117.38 113.79 2do8 n GLN 145 Ca -0.02 -0.34 -0.14 0.00 -0.01 0.00 0.00 57.00 56.50 2do8 n GLN 145 Cb 0.25 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 2do8 n GLN 145 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2do8 n ASN 146 N -0.62 -5.36 -0.40 1.08 3.02 0.21 -4.80 115.26 108.39 2do8 n ASN 146 Ca 0.21 0.33 0.14 0.00 -0.03 0.00 0.00 54.58 55.23 2do8 n ASN 146 Cb 0.21 -4.05 0.57 0.00 -0.61 0.00 0.00 39.78 35.90 2do8 n ASN 146 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2do8 n TYR 147 N -2.36 0.03 -3.76 3.10 4.01 -1.24 -4.38 117.16 112.56 2do8 n TYR 147 Ca -0.14 -0.02 -0.20 0.00 -0.16 0.00 0.00 57.90 57.39 2do8 n TYR 147 Cb 0.57 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.42 2do8 n TYR 147 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 2do8 s TRP 148 N -1.97 0.31 0.00 -0.72 0.52 -1.26 -4.97 118.94 110.86 2do8 s TRP 148 Ca 0.38 0.06 -0.04 0.00 0.02 0.00 0.00 56.10 56.53 2do8 s TRP 148 Cb 0.20 -0.57 -0.04 0.00 -1.15 0.00 0.00 33.47 31.91 2do8 s TRP 148 CO 0.33 -0.22 0.22 -0.51 0.02 0.00 0.00 176.95 176.78 2do8 s LEU 149 N 1.86 4.37 -0.05 2.99 1.43 -1.19 -4.62 118.68 123.46 2do8 s LEU 149 Ca 0.02 0.44 0.05 0.00 -1.03 0.00 0.00 54.13 53.60 2do8 s LEU 149 Cb -0.12 -2.66 -0.00 0.00 0.03 0.00 0.00 46.19 43.44 2do8 s LEU 149 CO -0.04 0.25 -0.19 -0.22 0.23 0.00 0.00 176.35 176.39 2do8 s LEU 150 N -1.89 1.94 0.03 1.79 2.96 -1.26 0.32 118.68 122.56 2do8 s LEU 150 Ca 0.28 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 2do8 s LEU 150 Cb -0.13 -1.08 -0.02 0.00 0.50 0.00 0.00 46.19 45.47 2do8 s LEU 150 CO 0.18 0.17 -0.05 -0.55 -1.32 0.00 0.00 176.35 174.78 2do8 s SER 151 N 0.05 0.46 0.36 3.68 0.15 0.19 -4.96 113.70 113.62 2do8 s SER 151 Ca -0.05 -0.47 -0.11 0.00 0.70 0.00 0.00 55.95 56.02 2do8 s SER 151 Cb -0.13 0.06 -0.07 0.00 -1.71 0.00 0.00 66.02 64.18 2do8 s SER 151 CO 0.03 -0.23 0.71 -1.61 1.20 0.00 0.00 173.24 173.34 2do8 s GLU 152 N -1.36 3.81 -0.14 5.44 8.01 -1.26 -0.55 118.70 132.66 2do8 s GLU 152 Ca -0.12 0.43 0.00 0.00 0.01 0.00 0.00 54.97 55.29 2do8 s GLU 152 Cb -0.09 -2.46 -0.01 0.00 -4.31 0.00 0.00 34.13 27.26 2do8 s GLU 152 CO -0.00 0.07 -0.14 0.00 0.01 0.00 0.00 175.26 175.19 2do8 s ALA 153 N -2.20 2.56 0.03 5.21 0.00 -0.65 -4.82 121.76 121.88 2do8 s ALA 153 Ca 0.51 -0.94 -0.22 0.00 0.00 0.00 0.00 51.96 51.31 2do8 s ALA 153 Cb -0.10 -1.19 -0.12 0.00 0.00 0.00 0.00 23.12 21.70 2do8 s ALA 153 CO 0.27 0.17 1.20 -0.91 0.00 0.00 0.00 175.76 176.50 2do8 h ASN 154 N 6.87 -0.66 0.00 0.00 4.21 -1.97 -3.45 115.58 120.58 2do8 h ASN 154 Ca -0.27 0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.26 2do8 h ASN 154 Cb 1.21 0.17 0.00 0.00 -1.12 0.00 0.00 38.32 38.58 2do8 h ASN 154 CO 0.55 -0.43 0.00 -0.46 -1.29 0.00 0.00 177.43 175.80 2do8 n ASN 155 N -4.30 -0.33 0.26 5.81 6.94 -1.26 -4.94 115.26 117.44 2do8 n ASN 155 Ca -0.10 0.35 0.10 0.00 -0.02 0.00 0.00 54.58 54.91 2do8 n ASN 155 Cb 0.31 0.60 0.68 0.00 -2.36 0.00 0.00 39.78 39.01 2do8 n ASN 155 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 2do8 h GLN 156 N 0.00 0.00 -0.68 -3.83 4.20 -1.97 -2.69 115.11 110.14 2do8 h GLN 156 Ca 0.00 0.00 0.20 0.00 0.06 0.00 0.00 58.65 58.91 2do8 h GLN 156 Cb 0.00 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.75 2do8 h GLN 156 CO 0.00 0.10 0.53 1.15 -0.67 0.00 0.00 178.83 179.94 2do8 h THR 157 N 0.00 0.56 0.36 -0.54 2.02 -1.92 0.54 112.91 113.93 2do8 h THR 157 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 2do8 h THR 157 Cb 0.22 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 2do8 h THR 157 CO 0.01 0.00 -0.17 -0.07 0.37 0.00 0.00 175.52 175.66 2do8 h LEU 158 N 0.00 -0.40 0.00 2.58 3.38 -1.88 -3.37 115.31 115.61 2do8 h LEU 158 Ca 0.32 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2do8 h LEU 158 Cb 1.38 0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.23 2do8 h LEU 158 CO -0.00 -0.09 -0.21 0.49 0.09 0.00 0.00 178.44 178.71 2do8 n PHE 159 N -5.19 0.00 1.08 1.13 3.01 -1.03 -4.73 117.46 111.73 2do8 n PHE 159 Ca -0.10 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.48 2do8 n PHE 159 Cb 0.27 0.00 0.25 0.00 -0.01 0.00 0.00 39.48 39.99 2do8 n PHE 159 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2do8 n GLU 160 N -0.61 2.12 -1.98 -1.08 1.02 0.19 -4.91 120.64 115.38 2do8 n GLU 160 Ca 0.00 -1.64 -0.35 0.00 -0.02 0.00 0.00 57.16 55.15 2do8 n GLU 160 Cb 0.00 -1.47 0.03 0.00 -0.02 0.00 0.00 31.44 29.99 2do8 n GLU 160 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2do8 s THR 161 N -1.93 2.78 0.00 2.62 -1.32 -0.96 -3.00 115.64 113.83 2do8 s THR 161 Ca 0.32 0.46 0.00 0.00 -1.21 0.00 0.00 61.69 61.26 2do8 s THR 161 Cb 0.20 -3.14 0.00 0.00 -1.51 0.00 0.00 72.50 68.06 2do8 s THR 161 CO 0.31 -0.13 0.00 -0.24 -2.21 0.00 0.00 174.62 172.35 2do8 n SER 162 N -1.72 -2.17 0.09 8.08 2.88 -1.25 -4.79 113.62 114.73 2do8 n SER 162 Ca 0.13 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.80 2do8 n SER 162 Cb 0.50 -1.96 0.44 0.00 -0.75 0.00 0.00 64.21 62.43 2do8 n SER 162 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2do8 n TYR 163 N -2.16 0.80 -0.39 0.66 9.36 -1.16 -3.85 117.16 120.42 2do8 n TYR 163 Ca 0.00 0.24 0.00 0.00 3.32 0.00 0.00 57.90 61.46 2do8 n TYR 163 Cb 0.14 -0.88 0.00 0.00 -0.63 0.00 0.00 39.34 37.97 2do8 n TYR 163 CO 0.00 0.00 0.00 1.47 0.22 0.00 0.00 176.86 178.55 2do8 n LEU 164 N -2.16 0.11 0.00 2.98 -0.00 -1.26 -5.12 117.00 111.56 2do8 n LEU 164 Ca 0.06 -0.17 0.00 0.00 -0.00 0.00 0.00 56.01 55.90 2do8 n LEU 164 Cb 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.83 2do8 n LEU 164 CO 0.30 0.03 0.00 -0.67 -0.00 0.00 0.00 177.39 177.04 2do8 n ASP 165 N -0.11 0.00 -4.75 1.45 2.03 -1.25 -5.16 116.55 108.76 2do8 n ASP 165 Ca 0.00 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.98 2do8 n ASP 165 Cb 0.10 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 40.57 2do8 n ASP 165 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2do8 s ARG 166 N 1.36 2.43 0.37 -0.67 1.81 -1.26 -4.46 118.95 118.52 2do8 s ARG 166 Ca 0.00 1.50 0.26 0.00 -1.72 0.00 0.00 55.73 55.77 2do8 s ARG 166 Cb 0.00 -1.89 0.79 0.00 -0.45 0.00 0.00 34.95 33.40 2do8 s ARG 166 CO 0.00 -1.56 1.75 2.35 -0.68 0.00 0.00 175.30 177.16 2do8 h TRP 167 N -0.30 0.00 -0.36 -0.53 2.91 -1.95 -3.27 115.95 112.46 2do8 h TRP 167 Ca -0.46 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 59.54 2do8 h TRP 167 Cb 1.26 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.90 2do8 h TRP 167 CO 0.52 0.00 0.02 1.33 -1.03 0.00 0.00 178.44 179.28 2do8 n VAL 168 N -2.71 1.71 -0.28 2.65 0.24 -1.26 -4.45 118.33 114.23 2do8 n VAL 168 Ca 0.03 -0.86 0.04 0.00 -2.04 0.00 0.00 64.34 61.51 2do8 n VAL 168 Cb 0.41 -0.39 0.18 0.00 -1.47 0.00 0.00 33.84 32.57 2do8 n VAL 168 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2do8 h GLU 169 N 2.30 0.65 -0.61 7.34 5.08 -1.96 0.40 114.58 127.78 2do8 h GLU 169 Ca 0.02 -0.04 0.11 0.00 -1.00 0.00 0.00 59.36 58.45 2do8 h GLU 169 Cb 1.44 -0.15 -0.08 0.00 0.50 0.00 0.00 28.75 30.46 2do8 h GLU 169 CO 0.32 0.43 0.17 0.00 -1.00 0.00 0.00 179.01 178.93 2do8 h ALA 170 N 1.49 0.75 0.17 3.43 0.00 -1.92 -0.31 119.26 122.88 2do8 h ALA 170 Ca 0.41 0.11 -0.30 0.00 0.00 0.00 0.00 54.91 55.13 2do8 h ALA 170 Cb 0.47 0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.40 2do8 h ALA 170 CO -0.30 -0.26 -1.36 -0.97 0.00 0.00 0.00 179.25 176.36 2do8 h ASN 171 N 0.32 0.58 0.22 0.00 -0.73 -1.61 -3.31 115.58 111.05 2do8 h ASN 171 Ca 0.32 -0.63 -0.04 0.00 1.87 0.00 0.00 56.30 57.81 2do8 h ASN 171 Cb 0.44 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 38.84 2do8 h ASN 171 CO -0.36 1.50 -0.19 -0.08 -0.37 0.00 0.00 177.43 177.92 2do8 h GLU 172 N 0.10 0.00 0.00 6.67 4.81 0.35 0.21 114.58 126.72 2do8 h GLU 172 Ca -0.19 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.03 2do8 h GLU 172 Cb 2.05 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.43 2do8 h GLU 172 CO 0.23 0.19 -0.03 0.52 -0.73 0.00 0.00 179.01 179.19 2do8 h MET 173 N 0.00 0.00 0.00 1.92 2.86 -1.16 -3.25 114.93 115.30 2do8 h MET 173 Ca -0.00 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.27 2do8 h MET 173 Cb 0.36 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.96 2do8 h MET 173 CO 0.03 0.03 -2.22 -0.11 1.06 0.00 0.00 176.91 175.69 2do8 n LEU 174 N -4.41 1.86 0.00 1.22 0.00 -0.56 -5.09 117.00 110.03 2do8 n LEU 174 Ca -0.03 0.32 0.00 0.00 0.00 0.00 0.00 56.01 56.30 2do8 n LEU 174 Cb 0.12 -0.77 0.00 0.00 0.00 0.00 0.00 43.42 42.77 2do8 n LEU 174 CO 0.34 0.41 0.00 0.61 0.00 0.00 0.00 177.39 178.74 2do8 n GLY 175 N 1.38 2.77 0.21 -3.96 0.00 0.65 -5.00 105.19 101.24 2do8 n GLY 175 Ca -0.46 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 2do8 n GLY 175 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2do8 h ILE 176 N 0.00 1.22 -3.10 -0.61 5.03 -1.84 -3.39 117.51 114.83 2do8 h ILE 176 Ca 0.00 -0.71 -0.68 0.00 -0.12 0.00 0.00 64.86 63.36 2do8 h ILE 176 Cb 0.00 0.89 -0.17 0.00 -3.03 0.00 0.00 36.82 34.50 2do8 h ILE 176 CO 0.00 0.25 0.17 -0.55 -0.68 0.00 0.00 178.15 177.34 2do8 s SER 177 N -5.96 6.22 0.00 1.72 0.15 -1.26 -4.85 113.70 109.72 2do8 s SER 177 Ca -0.13 -0.99 0.00 0.00 0.70 0.00 0.00 55.95 55.52 2do8 s SER 177 Cb 0.10 -2.32 0.00 0.00 -1.71 0.00 0.00 66.02 62.09 2do8 s SER 177 CO 0.77 -1.04 0.00 0.61 1.20 0.00 0.00 173.24 174.77 2do8 n GLY 178 N 5.21 -0.35 1.36 9.45 0.00 -1.26 -5.15 105.19 114.44 2do8 n GLY 178 Ca -0.06 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2do8 n GLY 178 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2do8 n ILE 179 N 0.25 -8.19 -1.70 -0.61 5.41 -1.26 -4.76 119.36 108.50 2do8 n ILE 179 Ca 0.00 1.82 -0.41 0.00 1.00 0.00 0.00 62.75 65.17 2do8 n ILE 179 Cb 0.00 -3.95 -0.01 0.00 -0.71 0.00 0.00 39.64 34.97 2do8 n ILE 179 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2do8 n LEU 180 N 1.01 7.72 -3.77 1.39 4.32 -1.26 -4.83 117.00 121.58 2do8 n LEU 180 Ca 0.00 -4.41 -0.26 0.00 -0.02 0.00 0.00 56.01 51.32 2do8 n LEU 180 Cb 0.00 -1.55 -0.17 0.00 -1.62 0.00 0.00 43.42 40.08 2do8 n LEU 180 CO 0.00 1.65 -0.38 0.00 -1.22 0.00 0.00 177.39 177.44 2do8 s ALA 181 N 1.77 0.99 0.72 -1.18 0.00 -1.26 -4.38 121.76 118.42 2do8 s ALA 181 Ca 0.55 -0.56 -0.15 0.00 0.00 0.00 0.00 51.96 51.80 2do8 s ALA 181 Cb 0.15 -1.05 0.03 0.00 0.00 0.00 0.00 23.12 22.26 2do8 s ALA 181 CO -0.07 -0.92 1.23 -2.14 0.00 0.00 0.00 175.76 173.87 2do8 s PRO 182 N 1.86 2.14 -1.36 0.00 0.02 -1.26 -4.87 135.00 131.53 2do8 s PRO 182 Ca 0.01 1.85 -0.13 0.00 0.02 0.00 0.00 61.00 62.74 2do8 s PRO 182 Cb -0.15 -1.82 -0.03 0.00 0.02 0.00 0.00 34.50 32.51 2do8 s PRO 182 CO -0.07 -1.85 2.38 0.00 -0.33 0.00 0.00 177.00 177.12 2do8 n ALA 183 N -2.62 5.72 0.00 -1.55 0.00 -1.26 -3.34 120.51 117.46 2do8 n ALA 183 Ca 0.14 -3.54 0.00 0.00 0.00 0.00 0.00 53.44 50.04 2do8 n ALA 183 Cb 0.50 -3.46 0.00 0.00 0.00 0.00 0.00 19.45 16.48 2do8 n ALA 183 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2do8 n GLY 184 N 3.99 -0.23 3.55 0.00 0.00 -1.26 -5.09 105.19 106.15 2do8 n GLY 184 Ca 0.58 0.02 -0.37 0.00 0.00 0.00 0.00 46.02 46.25 2do8 n GLY 184 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2do8 s ARG 185 N 0.00 2.96 -1.26 1.61 1.70 -1.21 -4.89 118.95 117.85 2do8 s ARG 185 Ca 0.00 -0.20 -0.13 0.00 -0.47 0.00 0.00 55.73 54.94 2do8 s ARG 185 Cb 0.00 -4.70 0.15 0.00 -0.57 0.00 0.00 34.95 29.83 2do8 s ARG 185 CO 0.00 -2.63 1.68 0.00 -1.08 0.00 0.00 175.30 173.27 2do8 n ALA 186 N 11.35 4.49 -2.43 7.88 0.00 -1.26 -4.92 120.51 135.61 2do8 n ALA 186 Ca 0.23 -4.21 -0.38 0.00 0.00 0.00 0.00 53.44 49.08 2do8 n ALA 186 Cb 0.50 -3.12 -0.03 0.00 0.00 0.00 0.00 19.45 16.81 2do8 n ALA 186 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2do8 s LEU 187 N 1.26 3.52 0.00 0.00 1.43 -1.26 -5.28 118.68 118.34 2do8 s LEU 187 Ca 0.43 -1.75 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 2do8 s LEU 187 Cb 0.03 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.68 2do8 s LEU 187 CO 0.01 -1.77 0.32 -1.84 0.23 0.00 0.00 176.35 173.30