#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1on4 s MET 2 N 0.00 0.71 -0.36 -1.40 -2.45 -1.26 -5.11 119.30 109.44 1on4 s MET 2 Ca 0.00 -0.34 0.02 0.00 -1.25 0.00 0.00 55.69 54.12 1on4 s MET 2 Cb 0.00 0.06 0.11 0.00 1.25 0.00 0.00 34.83 36.25 1on4 s MET 2 CO 0.00 -1.00 0.12 -0.48 1.05 0.00 0.00 175.02 174.71 1on4 s LEU 3 N 1.69 3.33 -0.01 4.11 2.34 -1.26 -4.99 118.68 123.88 1on4 s LEU 3 Ca 0.18 -2.09 -0.23 0.00 0.06 0.00 0.00 54.13 52.06 1on4 s LEU 3 Cb -0.01 -1.21 -0.14 0.00 -0.56 0.00 0.00 46.19 44.26 1on4 s LEU 3 CO -0.08 -0.36 1.02 -0.33 -1.06 0.00 0.00 176.35 175.54 1on4 h GLU 4 N 7.58 -0.49 -2.64 1.48 5.08 -2.06 -3.40 114.58 120.13 1on4 h GLU 4 Ca -0.08 0.03 -0.59 0.00 -1.00 0.00 0.00 59.36 57.72 1on4 h GLU 4 Cb 0.99 0.11 -0.39 0.00 0.50 0.00 0.00 28.75 29.96 1on4 h GLU 4 CO 0.51 -0.18 -0.85 0.42 -1.00 0.00 0.00 179.01 177.91 1on4 s ILE 5 N -4.17 0.66 -0.44 3.13 -1.09 -1.26 -4.99 121.20 113.04 1on4 s ILE 5 Ca -0.13 -2.35 0.08 0.00 -2.23 0.00 0.00 60.65 56.01 1on4 s ILE 5 Cb 0.01 -1.47 0.32 0.00 -1.58 0.00 0.00 42.46 39.74 1on4 s ILE 5 CO 0.45 -1.05 0.98 1.17 -1.23 0.00 0.00 174.94 175.26 1on4 n LYS 6 N 3.43 0.97 -3.17 2.79 4.81 -1.26 -5.06 118.16 120.66 1on4 n LYS 6 Ca 0.17 -2.31 -0.22 0.00 -0.87 0.00 0.00 58.31 55.09 1on4 n LYS 6 Cb 0.40 -1.25 -0.05 0.00 0.02 0.00 0.00 35.03 34.15 1on4 n LYS 6 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1on4 n ASP 7 N 0.53 1.51 -4.85 3.14 5.68 -1.26 -4.91 116.55 116.38 1on4 n ASP 7 Ca 0.11 -3.07 -0.31 0.00 -0.50 0.00 0.00 54.79 51.03 1on4 n ASP 7 Cb 0.68 -0.62 0.03 0.00 -1.14 0.00 0.00 41.12 40.07 1on4 n ASP 7 CO 0.00 0.00 0.00 -2.16 -1.33 0.00 0.00 177.20 173.71 1on4 s PRO 8 N -2.26 3.15 0.31 0.11 0.04 -1.26 -4.66 135.00 130.43 1on4 s PRO 8 Ca 0.40 0.75 0.03 0.00 0.04 0.00 0.00 61.00 62.21 1on4 s PRO 8 Cb 0.27 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.73 1on4 s PRO 8 CO -0.09 -0.90 0.10 -0.48 0.04 0.00 0.00 177.00 175.68 1on4 s LEU 9 N -5.37 1.87 -0.40 -3.56 2.34 -1.17 -4.71 118.68 107.69 1on4 s LEU 9 Ca 0.57 -1.47 0.10 0.00 0.06 0.00 0.00 54.13 53.40 1on4 s LEU 9 Cb -0.12 -0.09 0.37 0.00 -0.56 0.00 0.00 46.19 45.79 1on4 s LEU 9 CO 0.54 -0.76 1.05 0.59 -1.06 0.00 0.00 176.35 176.71 1on4 n ASN 10 N -0.77 -0.76 -4.57 1.48 3.02 0.18 -4.08 115.26 109.75 1on4 n ASN 10 Ca -0.02 -3.04 -0.41 0.00 -0.03 0.00 0.00 54.58 51.08 1on4 n ASN 10 Cb 0.66 0.63 -0.01 0.00 -0.61 0.00 0.00 39.78 40.45 1on4 n ASN 10 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1on4 s TYR 11 N -1.03 2.63 -0.42 3.10 2.02 -1.17 -4.76 117.35 117.71 1on4 s TYR 11 Ca 0.27 -1.21 -0.28 0.00 -0.37 0.00 0.00 57.07 55.48 1on4 s TYR 11 Cb 0.36 -4.66 0.00 0.00 -0.40 0.00 0.00 41.96 37.26 1on4 s TYR 11 CO -0.05 -1.79 1.53 -2.00 -1.57 0.00 0.00 175.55 171.67 1on4 s GLU 12 N 4.67 3.44 0.04 -0.62 2.12 -1.26 -2.37 118.70 124.70 1on4 s GLU 12 Ca 0.54 0.98 -0.30 0.00 0.36 0.00 0.00 54.97 56.54 1on4 s GLU 12 Cb 0.02 -4.10 -0.04 0.00 0.26 0.00 0.00 34.13 30.28 1on4 s GLU 12 CO 0.04 -1.74 1.00 0.14 -0.54 0.00 0.00 175.26 174.16 1on4 s VAL 13 N 6.04 4.68 0.17 3.70 -7.23 0.15 -4.85 120.40 123.06 1on4 s VAL 13 Ca 0.65 2.00 -0.34 0.00 -1.81 0.00 0.00 61.98 62.48 1on4 s VAL 13 Cb -0.15 -4.28 -0.14 0.00 0.56 0.00 0.00 36.38 32.36 1on4 s VAL 13 CO 0.31 0.20 1.52 -0.62 -0.31 0.00 0.00 175.10 176.20 1on4 n GLU 14 N 3.58 2.02 -1.58 4.82 4.71 -1.26 -4.90 120.64 128.04 1on4 n GLU 14 Ca 0.05 0.73 -0.45 0.00 -0.01 0.00 0.00 57.16 57.48 1on4 n GLU 14 Cb 0.50 -2.46 -0.01 0.00 -1.01 0.00 0.00 31.44 28.46 1on4 n GLU 14 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 1on4 n PRO 15 N 3.07 1.25 -3.64 3.49 -0.02 -1.26 -4.94 135.00 132.95 1on4 n PRO 15 Ca 0.16 0.44 -0.05 0.00 -2.02 0.00 0.00 63.50 62.03 1on4 n PRO 15 Cb 0.28 -1.79 -0.02 0.00 -0.02 0.00 0.00 33.50 31.96 1on4 n PRO 15 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1on4 s PHE 16 N -1.07 -0.20 -0.06 6.00 5.36 -1.26 -4.99 117.98 121.76 1on4 s PHE 16 Ca 0.59 -0.02 0.06 0.00 -0.96 0.00 0.00 56.93 56.60 1on4 s PHE 16 Cb -0.71 0.59 -0.01 0.00 -0.34 0.00 0.00 43.02 42.55 1on4 s PHE 16 CO 0.60 -0.64 -0.24 0.99 -1.46 0.00 0.00 175.22 174.47 1on4 s THR 17 N -3.09 2.00 0.29 0.12 2.01 -1.26 -1.88 115.64 113.83 1on4 s THR 17 Ca 0.10 -1.03 0.06 0.00 0.31 0.00 0.00 61.69 61.13 1on4 s THR 17 Cb -0.01 -1.70 -0.06 0.00 0.01 0.00 0.00 72.50 70.75 1on4 s THR 17 CO -0.03 0.55 -0.04 -0.36 -0.69 0.00 0.00 174.62 174.06 1on4 s PHE 18 N -0.05 1.97 -0.05 4.92 0.08 0.45 -4.99 117.98 120.30 1on4 s PHE 18 Ca -0.06 -0.73 0.05 0.00 0.12 0.00 0.00 56.93 56.31 1on4 s PHE 18 Cb -0.14 -1.16 -0.02 0.00 -0.57 0.00 0.00 43.02 41.13 1on4 s PHE 18 CO 0.04 0.25 -0.20 -0.65 -0.10 0.00 0.00 175.22 174.57 1on4 s GLN 19 N -3.75 2.53 0.97 0.44 -0.21 -1.26 -1.00 119.66 117.38 1on4 s GLN 19 Ca 0.30 -0.81 -0.15 0.00 0.02 0.00 0.00 55.36 54.72 1on4 s GLN 19 Cb 0.05 -2.27 0.18 0.00 1.00 0.00 0.00 33.01 31.97 1on4 s GLN 19 CO 0.13 0.49 1.23 0.54 -2.12 0.00 0.00 175.29 175.56 1on4 s ASN 20 N -0.41 3.06 0.57 5.90 2.20 0.20 -1.42 114.94 125.03 1on4 s ASN 20 Ca 0.04 0.54 0.26 0.00 -0.94 0.00 0.00 52.86 52.76 1on4 s ASN 20 Cb -0.12 -0.78 1.58 0.00 -2.00 0.00 0.00 41.25 39.92 1on4 s ASN 20 CO 0.02 -2.79 2.13 0.06 -2.94 0.00 0.00 177.10 173.58 1on4 h GLN 21 N -1.67 0.00 -0.00 3.55 -0.00 -1.01 0.15 115.11 116.13 1on4 h GLN 21 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 1on4 h GLN 21 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 1on4 h GLN 21 CO 0.46 0.00 -0.00 -3.47 -0.00 0.00 0.00 178.83 175.82 1on4 n ASP 22 N -4.05 0.00 0.00 0.06 2.03 -1.26 -4.87 116.55 108.45 1on4 n ASP 22 Ca 0.01 -0.97 0.00 0.00 0.52 0.00 0.00 54.79 54.34 1on4 n ASP 22 Cb 0.25 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.65 1on4 n ASP 22 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1on4 n GLY 23 N 1.01 0.83 3.70 0.27 0.00 0.52 -5.00 105.19 106.53 1on4 n GLY 23 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1on4 n GLY 23 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1on4 s LYS 24 N -0.04 4.47 0.05 1.61 2.20 -1.25 -4.63 119.74 122.16 1on4 s LYS 24 Ca 0.00 1.48 -0.30 0.00 -0.36 0.00 0.00 55.97 56.79 1on4 s LYS 24 Cb 0.00 -3.49 -0.05 0.00 -1.51 0.00 0.00 37.83 32.79 1on4 s LYS 24 CO 0.00 -0.22 1.02 0.54 -0.36 0.00 0.00 175.35 176.34 1on4 s ASN 25 N 1.10 7.34 -0.08 1.43 4.22 -1.26 -0.63 114.94 127.06 1on4 s ASN 25 Ca 0.52 1.79 -0.09 0.00 -2.14 0.00 0.00 52.86 52.94 1on4 s ASN 25 Cb -0.21 -2.58 0.02 0.00 1.28 0.00 0.00 41.25 39.76 1on4 s ASN 25 CO 0.24 -0.25 0.25 0.68 -2.04 0.00 0.00 177.10 175.98 1on4 s VAL 26 N 0.67 0.01 0.38 3.54 -7.23 -0.17 -4.97 120.40 112.62 1on4 s VAL 26 Ca 0.52 -0.06 0.08 0.00 -1.81 0.00 0.00 61.98 60.70 1on4 s VAL 26 Cb -0.24 -0.37 -0.07 0.00 0.56 0.00 0.00 36.38 36.26 1on4 s VAL 26 CO 0.29 -0.04 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.57 1on4 s SER 27 N -0.03 3.83 0.37 4.85 0.01 -1.26 -0.41 113.70 121.05 1on4 s SER 27 Ca -0.02 -1.29 0.11 0.00 1.31 0.00 0.00 55.95 56.06 1on4 s SER 27 Cb -0.02 -0.38 0.87 0.00 0.21 0.00 0.00 66.02 66.70 1on4 s SER 27 CO 0.01 -0.34 1.86 0.25 0.41 0.00 0.00 173.24 175.43 1on4 h LEU 28 N 1.87 0.61 -1.05 2.44 5.85 -1.74 0.11 115.31 123.40 1on4 h LEU 28 Ca -0.43 0.04 0.30 0.00 0.84 0.00 0.00 57.88 58.63 1on4 h LEU 28 Cb 1.24 -0.07 -0.14 0.00 0.37 0.00 0.00 40.66 42.06 1on4 h LEU 28 CO 0.76 0.29 0.60 -0.33 -0.34 0.00 0.00 178.44 179.42 1on4 h GLU 29 N 0.63 0.39 0.00 1.25 5.08 -1.91 0.53 114.58 120.55 1on4 h GLU 29 Ca 0.46 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1on4 h GLU 29 Cb 0.81 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1on4 h GLU 29 CO -0.21 0.26 0.00 0.43 -1.00 0.00 0.00 179.01 178.49 1on4 n SER 30 N -4.94 0.00 0.00 1.42 7.64 0.03 -3.77 113.62 113.99 1on4 n SER 30 Ca 0.30 0.02 0.00 0.00 1.01 0.00 0.00 58.87 60.20 1on4 n SER 30 Cb 0.92 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.84 1on4 n SER 30 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1on4 n LEU 31 N -1.28 0.00 -4.62 -3.43 4.77 0.65 -4.97 117.00 108.12 1on4 n LEU 31 Ca 0.08 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.63 1on4 n LEU 31 Cb 0.14 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 1on4 n LEU 31 CO 0.13 0.00 1.07 -0.75 -1.33 0.00 0.00 177.39 176.51 1on4 s LYS 32 N -0.94 3.83 0.00 3.23 2.20 0.15 -0.70 119.74 127.51 1on4 s LYS 32 Ca 0.00 0.91 0.00 0.00 -0.36 0.00 0.00 55.97 56.52 1on4 s LYS 32 Cb 0.00 -3.88 0.00 0.00 -1.51 0.00 0.00 37.83 32.44 1on4 s LYS 32 CO 0.00 -1.24 0.00 0.41 -0.36 0.00 0.00 175.35 174.16 1on4 n GLY 33 N 4.53 2.42 3.85 5.54 0.00 0.15 -4.92 105.19 116.76 1on4 n GLY 33 Ca 0.13 -0.54 -0.26 0.00 0.00 0.00 0.00 46.02 45.35 1on4 n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1on4 s GLU 34 N 0.00 3.08 -1.09 1.61 8.01 0.13 -4.59 118.70 125.86 1on4 s GLU 34 Ca 0.00 -0.78 -0.14 0.00 0.01 0.00 0.00 54.97 54.06 1on4 s GLU 34 Cb 0.00 -2.75 0.18 0.00 -4.31 0.00 0.00 34.13 27.25 1on4 s GLU 34 CO 0.00 0.50 1.24 0.54 0.01 0.00 0.00 175.26 177.54 1on4 s VAL 35 N -1.75 5.19 0.02 2.63 0.11 -1.26 -3.09 120.40 122.25 1on4 s VAL 35 Ca 0.32 -2.50 -0.15 0.00 -2.93 0.00 0.00 61.98 56.73 1on4 s VAL 35 Cb -0.10 -4.78 -0.06 0.00 -1.53 0.00 0.00 36.38 29.90 1on4 s VAL 35 CO 0.25 -1.46 0.43 -1.66 -3.33 0.00 0.00 175.10 169.33 1on4 s TRP 36 N 1.22 3.72 0.45 1.54 1.48 0.06 -4.68 118.94 122.72 1on4 s TRP 36 Ca 0.36 1.00 -0.12 0.00 -1.06 0.00 0.00 56.10 56.28 1on4 s TRP 36 Cb -0.05 -2.30 -0.07 0.00 -1.16 0.00 0.00 33.47 29.89 1on4 s TRP 36 CO -0.05 0.62 0.85 -0.51 -4.06 0.00 0.00 176.95 173.81 1on4 s LEU 37 N -1.20 3.73 0.02 -4.66 1.43 -0.06 -0.30 118.68 117.64 1on4 s LEU 37 Ca 0.26 1.28 -0.10 0.00 -1.03 0.00 0.00 54.13 54.54 1on4 s LEU 37 Cb -0.17 -4.19 0.01 0.00 0.03 0.00 0.00 46.19 41.87 1on4 s LEU 37 CO 0.15 -0.49 0.19 0.00 0.23 0.00 0.00 176.35 176.43 1on4 s ALA 38 N -2.50 -0.41 0.30 4.21 0.00 -0.61 -0.92 121.76 121.83 1on4 s ALA 38 Ca 0.54 -0.15 -0.17 0.00 0.00 0.00 0.00 51.96 52.18 1on4 s ALA 38 Cb -0.10 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.24 1on4 s ALA 38 CO 0.33 -0.30 0.66 0.16 0.00 0.00 0.00 175.76 176.61 1on4 s ASP 39 N -1.77 -0.09 -0.27 0.00 1.47 -1.15 0.00 116.67 114.86 1on4 s ASP 39 Ca -0.09 -0.85 -0.11 0.00 1.18 0.00 0.00 52.55 52.67 1on4 s ASP 39 Cb -0.04 0.72 0.10 0.00 -0.34 0.00 0.00 42.92 43.37 1on4 s ASP 39 CO -0.01 -1.37 0.61 0.72 0.68 0.00 0.00 175.17 175.80 1on4 s PHE 40 N -3.56 -1.13 0.19 2.11 -0.71 -1.26 -2.53 117.98 111.10 1on4 s PHE 40 Ca 0.16 2.08 -0.01 0.00 -1.04 0.00 0.00 56.93 58.12 1on4 s PHE 40 Cb -0.04 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.37 1on4 s PHE 40 CO 0.09 -0.57 0.10 0.96 -1.34 0.00 0.00 175.22 174.46 1on4 s ILE 41 N 2.34 0.13 0.45 -4.49 -5.25 -1.24 -3.77 121.20 109.37 1on4 s ILE 41 Ca -0.07 -1.98 0.07 0.00 -0.99 0.00 0.00 60.65 57.68 1on4 s ILE 41 Cb -0.10 -2.40 -0.01 0.00 2.95 0.00 0.00 42.46 42.91 1on4 s ILE 41 CO -0.18 -0.12 0.38 0.72 -1.79 0.00 0.00 174.94 173.95 1on4 s PHE 42 N -4.06 2.40 0.00 1.37 -0.12 -1.26 -1.10 117.98 115.21 1on4 s PHE 42 Ca 0.35 -0.59 0.00 0.00 -0.05 0.00 0.00 56.93 56.64 1on4 s PHE 42 Cb 0.07 -2.10 0.00 0.00 -0.63 0.00 0.00 43.02 40.36 1on4 s PHE 42 CO 0.10 -0.22 0.00 -2.37 -0.05 0.00 0.00 175.22 172.68 1on4 n THR 43 N -1.60 0.00 0.00 -4.49 5.66 -1.26 -4.96 114.28 107.63 1on4 n THR 43 Ca 0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 1on4 n THR 43 Cb 0.63 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.41 1on4 n THR 43 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1on4 n ASN 44 N 0.00 0.00 -4.52 1.09 2.85 -1.26 -4.94 115.26 108.48 1on4 n ASN 44 Ca 0.00 0.00 -0.44 0.00 -0.11 0.00 0.00 54.58 54.03 1on4 n ASN 44 Cb 0.00 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.01 1on4 n ASN 44 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1on4 n GLU 46 N 0.71 0.00 -2.47 0.00 1.02 -1.26 -4.37 120.64 114.26 1on4 n GLU 46 Ca 0.12 0.03 -0.43 0.00 -0.02 0.00 0.00 57.16 56.86 1on4 n GLU 46 Cb 0.33 -0.92 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 1on4 n GLU 46 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1on4 n THR 47 N -0.60 3.95 -1.11 2.62 -2.24 -1.26 -4.86 114.28 110.78 1on4 n THR 47 Ca 0.00 -4.05 -0.37 0.00 -2.27 0.00 0.00 64.05 57.36 1on4 n THR 47 Cb 0.00 -2.43 -0.04 0.00 -2.10 0.00 0.00 70.33 65.77 1on4 n THR 47 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1on4 n ILE 48 N 5.52 2.24 0.01 2.28 2.08 -1.26 -4.57 119.36 125.66 1on4 n ILE 48 Ca 0.46 -1.74 -0.13 0.00 0.56 0.00 0.00 62.75 61.91 1on4 n ILE 48 Cb 0.43 -2.31 -0.09 0.00 -0.75 0.00 0.00 39.64 36.92 1on4 n ILE 48 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1on4 s PRO 50 N -4.75 3.66 -1.13 0.00 0.04 -1.26 -4.85 135.00 126.71 1on4 s PRO 50 Ca -0.15 2.25 -0.20 0.00 0.04 0.00 0.00 61.00 62.94 1on4 s PRO 50 Cb 0.03 -2.58 -0.06 0.00 0.04 0.00 0.00 34.50 31.93 1on4 s PRO 50 CO 0.66 -0.78 1.93 -0.35 0.04 0.00 0.00 177.00 178.50 1on4 n PRO 51 N -0.30 2.10 0.00 0.56 -0.04 -1.26 -4.83 135.00 131.23 1on4 n PRO 51 Ca 0.06 -2.49 0.00 0.00 -0.04 0.00 0.00 63.50 61.03 1on4 n PRO 51 Cb 0.43 -3.39 0.00 0.00 -0.04 0.00 0.00 33.50 30.50 1on4 n PRO 51 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1on4 n MET 52 N 7.64 0.00 -1.09 0.54 2.81 -1.26 -4.00 117.12 121.75 1on4 n MET 52 Ca 0.48 0.00 -0.19 0.00 -1.81 0.00 0.00 57.70 56.18 1on4 n MET 52 Cb 0.44 -0.42 -0.01 0.00 -0.71 0.00 0.00 33.22 32.51 1on4 n MET 52 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1on4 n THR 53 N 0.00 2.94 -0.05 2.03 -1.04 -1.26 -4.00 114.28 112.90 1on4 n THR 53 Ca 0.00 -2.05 -0.06 0.00 -2.04 0.00 0.00 64.05 59.91 1on4 n THR 53 Cb 0.00 -1.49 -0.02 0.00 -1.82 0.00 0.00 70.33 67.00 1on4 n THR 53 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1on4 n ALA 54 N 0.76 1.08 -0.00 2.41 0.00 -1.26 -3.75 120.51 119.76 1on4 n ALA 54 Ca 0.36 -0.56 -0.10 0.00 0.00 0.00 0.00 53.44 53.13 1on4 n ALA 54 Cb 0.59 0.05 -0.05 0.00 0.00 0.00 0.00 19.45 20.05 1on4 n ALA 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1on4 h HIS 55 N -0.63 -0.01 -1.00 0.00 3.86 -1.75 -0.30 115.15 115.33 1on4 h HIS 55 Ca 0.00 0.01 0.17 0.00 -1.16 0.00 0.00 60.37 59.39 1on4 h HIS 55 Cb 0.63 0.02 -0.17 0.00 1.06 0.00 0.00 27.41 28.95 1on4 h HIS 55 CO -0.27 -0.02 -0.34 0.52 0.86 0.00 0.00 177.93 178.68 1on4 h MET 56 N 0.03 -0.00 -0.17 2.45 2.86 -1.81 0.35 114.93 118.63 1on4 h MET 56 Ca 0.05 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.52 1on4 h MET 56 Cb 0.06 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.73 1on4 h MET 56 CO -0.09 -0.00 -0.56 0.00 1.06 0.00 0.00 176.91 177.32 1on4 h THR 57 N -0.00 1.32 -0.03 2.22 1.03 -1.29 0.36 112.91 116.51 1on4 h THR 57 Ca 0.39 -1.80 -0.05 0.00 -0.01 0.00 0.00 66.41 64.95 1on4 h THR 57 Cb 0.65 1.97 -0.01 0.00 -1.07 0.00 0.00 68.15 69.69 1on4 h THR 57 CO -1.00 0.56 -0.22 -0.78 -0.01 0.00 0.00 175.52 174.07 1on4 h ASP 58 N 0.36 0.04 0.71 0.00 1.82 -0.65 0.10 116.42 118.81 1on4 h ASP 58 Ca -0.02 -0.01 -0.12 0.00 -0.39 0.00 0.00 57.03 56.49 1on4 h ASP 58 Cb 1.18 -0.01 -0.02 0.00 0.68 0.00 0.00 39.33 41.16 1on4 h ASP 58 CO 0.12 0.27 -0.56 -0.07 -1.61 0.00 0.00 179.24 177.39 1on4 h LEU 59 N 0.04 0.00 -0.76 2.28 4.07 0.02 -1.03 115.31 119.93 1on4 h LEU 59 Ca 0.01 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.91 1on4 h LEU 59 Cb 0.42 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.13 1on4 h LEU 59 CO 0.03 0.56 0.25 -0.61 -1.08 0.00 0.00 178.44 177.60 1on4 h GLN 60 N 0.00 1.17 0.84 1.13 -0.00 0.19 0.34 115.11 118.78 1on4 h GLN 60 Ca -0.01 -0.24 -0.04 0.00 -0.00 0.00 0.00 58.65 58.36 1on4 h GLN 60 Cb 1.07 -0.17 -0.00 0.00 0.00 0.00 0.00 27.48 28.38 1on4 h GLN 60 CO 0.07 0.98 -0.49 -0.22 0.00 0.00 0.00 178.83 179.17 1on4 h LYS 61 N 1.13 -1.19 -0.92 1.69 3.64 -0.70 -2.61 116.57 117.59 1on4 h LYS 61 Ca 0.25 0.08 0.26 0.00 -1.27 0.00 0.00 60.65 59.97 1on4 h LYS 61 Cb 0.29 0.27 -0.14 0.00 -0.41 0.00 0.00 32.23 32.24 1on4 h LYS 61 CO -0.01 -0.80 0.36 -0.22 -2.27 0.00 0.00 179.45 176.52 1on4 h LYS 62 N -1.24 0.26 -1.10 1.90 1.63 -0.99 0.81 116.57 117.85 1on4 h LYS 62 Ca -0.11 -0.02 0.33 0.00 -0.85 0.00 0.00 60.65 60.00 1on4 h LYS 62 Cb 0.98 -0.06 -0.12 0.00 -0.60 0.00 0.00 32.23 32.43 1on4 h LYS 62 CO 0.13 0.18 0.68 1.25 -3.45 0.00 0.00 179.45 178.23 1on4 h LEU 63 N 0.27 0.43 -1.01 5.20 7.12 0.07 0.24 115.31 127.63 1on4 h LEU 63 Ca 0.61 0.14 0.24 0.00 0.13 0.00 0.00 57.88 59.00 1on4 h LEU 63 Cb 1.28 0.09 -0.12 0.00 -0.53 0.00 0.00 40.66 41.38 1on4 h LEU 63 CO -0.63 -0.07 0.60 0.11 -0.13 0.00 0.00 178.44 178.32 1on4 h LYS 64 N 0.29 0.60 0.00 1.25 1.79 -0.76 0.83 116.57 120.57 1on4 h LYS 64 Ca 0.71 -0.04 -0.13 0.00 -2.18 0.00 0.00 60.65 59.01 1on4 h LYS 64 Cb 1.85 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 32.35 1on4 h LYS 64 CO -0.45 0.39 -0.62 0.00 -1.08 0.00 0.00 179.45 177.69 1on4 h ALA 65 N 1.72 0.86 -0.01 3.86 0.00 -0.69 -3.21 119.26 121.78 1on4 h ALA 65 Ca 0.63 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1on4 h ALA 65 Cb 1.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1on4 h ALA 65 CO -0.46 0.78 -0.37 0.39 0.00 0.00 0.00 179.25 179.59 1on4 n GLU 66 N -3.64 1.12 -0.18 0.00 -0.58 0.55 -4.71 120.64 113.22 1on4 n GLU 66 Ca -0.01 -0.84 0.15 0.00 -0.42 0.00 0.00 57.16 56.04 1on4 n GLU 66 Cb 0.65 -1.48 0.49 0.00 -0.57 0.00 0.00 31.44 30.53 1on4 n GLU 66 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 1on4 h ASN 67 N 2.06 0.42 0.00 1.62 -0.00 0.51 -3.40 115.58 116.79 1on4 h ASN 67 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.32 1on4 h ASN 67 Cb 0.66 -0.06 0.00 0.00 -0.00 0.00 0.00 38.32 38.92 1on4 h ASN 67 CO 0.00 0.22 0.00 -0.38 -0.00 0.00 0.00 177.43 177.27 1on4 n ILE 68 N -4.49 0.00 -2.63 2.57 -0.00 -1.26 -0.12 119.36 113.44 1on4 n ILE 68 Ca 0.15 0.00 -0.00 0.00 -0.00 0.00 0.00 62.75 62.90 1on4 n ILE 68 Cb 0.52 0.00 0.04 0.00 -0.00 0.00 0.00 39.64 40.20 1on4 n ILE 68 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1on4 n ASP 69 N 0.00 0.57 -4.93 4.38 2.03 -1.26 -5.13 116.55 112.21 1on4 n ASP 69 Ca 0.00 -2.05 -0.27 0.00 0.52 0.00 0.00 54.79 52.99 1on4 n ASP 69 Cb 0.00 -0.13 -0.03 0.00 -0.72 0.00 0.00 41.12 40.24 1on4 n ASP 69 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1on4 s VAL 70 N -1.65 5.17 0.14 5.18 -7.23 0.84 -4.95 120.40 117.89 1on4 s VAL 70 Ca 0.23 -0.35 0.01 0.00 -1.81 0.00 0.00 61.98 60.05 1on4 s VAL 70 Cb 0.33 -3.76 -0.04 0.00 0.56 0.00 0.00 36.38 33.47 1on4 s VAL 70 CO -0.09 -0.25 -0.00 -0.13 -0.31 0.00 0.00 175.10 174.32 1on4 s ARG 71 N -3.52 0.96 -0.31 4.82 0.52 -1.26 -4.76 118.95 115.40 1on4 s ARG 71 Ca 0.39 -1.44 -0.11 0.00 -0.52 0.00 0.00 55.73 54.05 1on4 s ARG 71 Cb -0.11 -0.09 -0.02 0.00 0.52 0.00 0.00 34.95 35.25 1on4 s ARG 71 CO 0.30 -0.13 0.19 -1.50 0.02 0.00 0.00 175.30 174.18 1on4 s ILE 72 N -3.76 5.03 -0.27 1.52 2.07 -1.25 -0.88 121.20 123.66 1on4 s ILE 72 Ca 0.20 -0.19 -0.09 0.00 -1.41 0.00 0.00 60.65 59.16 1on4 s ILE 72 Cb 0.06 -3.52 -0.03 0.00 0.13 0.00 0.00 42.46 39.10 1on4 s ILE 72 CO 0.00 0.09 0.12 -0.63 -1.91 0.00 0.00 174.94 172.62 1on4 s ILE 73 N 1.69 4.68 -0.39 2.00 1.09 -0.09 -1.39 121.20 128.79 1on4 s ILE 73 Ca 0.06 -0.08 -0.02 0.00 -1.10 0.00 0.00 60.65 59.50 1on4 s ILE 73 Cb -0.17 -3.23 0.10 0.00 -1.06 0.00 0.00 42.46 38.10 1on4 s ILE 73 CO 0.09 0.28 0.17 -0.44 -0.10 0.00 0.00 174.94 174.93 1on4 s SER 74 N 1.66 5.18 0.33 3.58 0.01 -0.09 -2.93 113.70 121.44 1on4 s SER 74 Ca 0.06 -1.93 -0.21 0.00 1.31 0.00 0.00 55.95 55.19 1on4 s SER 74 Cb -0.16 -1.80 -0.10 0.00 0.21 0.00 0.00 66.02 64.18 1on4 s SER 74 CO 0.06 -0.49 0.85 0.72 0.41 0.00 0.00 173.24 174.79 1on4 s PHE 75 N 1.14 3.50 0.04 2.43 -0.12 -1.05 -0.49 117.98 123.42 1on4 s PHE 75 Ca 0.07 1.51 -0.30 0.00 -0.05 0.00 0.00 56.93 58.15 1on4 s PHE 75 Cb -0.22 -2.74 -0.05 0.00 -0.63 0.00 0.00 43.02 39.38 1on4 s PHE 75 CO -0.04 0.12 1.17 0.45 -0.05 0.00 0.00 175.22 176.87 1on4 s SER 76 N -1.94 7.12 -0.81 1.98 0.15 0.28 -3.61 113.70 116.87 1on4 s SER 76 Ca 0.53 1.93 -0.26 0.00 0.70 0.00 0.00 55.95 58.85 1on4 s SER 76 Cb -0.13 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 61.63 1on4 s SER 76 CO 0.19 -0.45 1.37 -0.69 1.20 0.00 0.00 173.24 174.85 1on4 s VAL 77 N 1.22 3.74 -0.26 4.45 1.01 -0.26 -4.14 120.40 126.16 1on4 s VAL 77 Ca 0.57 0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.60 1on4 s VAL 77 Cb -0.27 -4.88 0.01 0.00 0.00 0.00 0.00 36.38 31.23 1on4 s VAL 77 CO 0.28 -1.81 0.30 -0.67 0.00 0.00 0.00 175.10 173.20 1on4 n ASP 78 N 9.55 -4.74 0.01 3.32 -0.08 -1.26 -4.44 116.55 118.91 1on4 n ASP 78 Ca 0.12 0.13 0.09 0.00 -1.51 0.00 0.00 54.79 53.62 1on4 n ASP 78 Cb 0.50 -3.03 0.41 0.00 2.34 0.00 0.00 41.12 41.34 1on4 n ASP 78 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1on4 n PRO 79 N -0.83 0.02 -0.04 -0.67 -0.04 -1.26 -0.73 135.00 131.46 1on4 n PRO 79 Ca 0.03 0.19 -0.15 0.00 -0.04 0.00 0.00 63.50 63.54 1on4 n PRO 79 Cb 0.34 -1.54 -0.08 0.00 -0.04 0.00 0.00 33.50 32.18 1on4 n PRO 79 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1on4 h GLU 80 N 0.00 0.41 0.00 0.54 4.81 -1.93 -2.52 114.58 115.89 1on4 h GLU 80 Ca 0.00 -0.29 -0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1on4 h GLU 80 Cb 0.34 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 1on4 h GLU 80 CO 0.00 0.91 -0.02 -0.91 -0.73 0.00 0.00 179.01 178.26 1on4 h ASN 81 N -0.02 0.00 0.41 1.04 2.35 -1.94 -3.42 115.58 114.01 1on4 h ASN 81 Ca -0.01 -0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 55.58 1on4 h ASN 81 Cb 0.93 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.30 1on4 h ASN 81 CO 0.07 0.58 -0.20 -0.78 -1.65 0.00 0.00 177.43 175.45 1on4 h ASP 82 N -1.00 -0.47 -4.00 5.81 1.82 -1.07 -3.50 116.42 114.02 1on4 h ASP 82 Ca -0.00 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.54 1on4 h ASP 82 Cb 0.16 0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.29 1on4 h ASP 82 CO -0.00 -0.15 -0.08 0.29 -1.61 0.00 0.00 179.24 177.69 1on4 n LYS 83 N -5.23 -0.36 0.00 0.28 5.02 -0.95 -4.04 118.16 112.89 1on4 n LYS 83 Ca -0.10 0.27 0.21 0.00 -2.02 0.00 0.00 58.31 56.67 1on4 n LYS 83 Cb 0.28 -0.32 0.71 0.00 -0.02 0.00 0.00 35.03 35.68 1on4 n LYS 83 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1on4 h PRO 84 N 0.07 0.00 -0.63 1.97 0.13 -1.96 0.92 132.00 132.50 1on4 h PRO 84 Ca 0.00 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.21 1on4 h PRO 84 Cb 0.04 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.11 1on4 h PRO 84 CO 0.00 0.00 0.30 -0.22 -0.23 0.00 0.00 178.00 177.85 1on4 h LYS 85 N 0.00 0.53 -0.09 0.86 1.63 -1.94 0.21 116.57 117.77 1on4 h LYS 85 Ca 0.26 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 60.02 1on4 h LYS 85 Cb 1.07 -0.12 -0.00 0.00 -0.60 0.00 0.00 32.23 32.57 1on4 h LYS 85 CO -0.00 0.35 0.03 1.96 -3.45 0.00 0.00 179.45 178.34 1on4 h GLN 86 N 0.55 0.14 -0.88 1.90 1.08 -0.96 -0.40 115.11 116.54 1on4 h GLN 86 Ca 0.30 -0.03 0.03 0.00 -1.45 0.00 0.00 58.65 57.50 1on4 h GLN 86 Cb 0.28 -0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 27.64 1on4 h GLN 86 CO -0.24 0.27 0.57 -0.07 -0.95 0.00 0.00 178.83 178.41 1on4 h LEU 87 N -0.02 0.95 -0.40 1.46 4.07 -1.28 0.10 115.31 120.20 1on4 h LEU 87 Ca 0.03 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.93 1on4 h LEU 87 Cb 0.18 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 41.69 1on4 h LEU 87 CO -0.00 0.66 0.05 0.50 -1.08 0.00 0.00 178.44 178.57 1on4 h LYS 88 N 1.12 0.67 -0.23 1.13 3.64 -0.32 0.27 116.57 122.84 1on4 h LYS 88 Ca 0.35 -0.19 0.05 0.00 -1.27 0.00 0.00 60.65 59.58 1on4 h LYS 88 Cb -0.01 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 1on4 h LYS 88 CO -0.11 0.73 -0.05 0.87 -2.27 0.00 0.00 179.45 178.62 1on4 h LYS 89 N 0.51 0.01 -0.88 1.90 1.57 -0.58 0.13 116.57 119.24 1on4 h LYS 89 Ca 0.12 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.93 1on4 h LYS 89 Cb 0.40 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.65 1on4 h LYS 89 CO 0.01 0.01 0.57 0.35 -0.57 0.00 0.00 179.45 179.82 1on4 h PHE 90 N 0.01 1.07 0.00 -1.35 3.57 -0.45 -0.80 116.94 119.00 1on4 h PHE 90 Ca 0.11 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.57 1on4 h PHE 90 Cb 0.17 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 1on4 h PHE 90 CO -0.23 0.62 -0.34 0.00 -2.23 0.00 0.00 178.31 176.13 1on4 h ALA 91 N 1.36 1.22 0.00 2.41 0.00 -0.04 0.14 119.26 124.36 1on4 h ALA 91 Ca 0.35 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1on4 h ALA 91 Cb -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1on4 h ALA 91 CO -0.11 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.56 1on4 h ALA 92 N 1.66 1.00 0.00 0.00 0.00 0.70 -3.34 119.26 119.28 1on4 h ALA 92 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1on4 h ALA 92 Cb 0.70 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1on4 h ALA 92 CO 0.04 0.00 -1.05 0.09 0.00 0.00 0.00 179.25 178.33 1on4 n ASN 93 N -2.41 1.88 -4.68 0.00 5.03 0.25 -4.87 115.26 110.46 1on4 n ASN 93 Ca 0.02 0.47 -0.42 0.00 0.87 0.00 0.00 54.58 55.52 1on4 n ASN 93 Cb 0.26 -0.84 -0.03 0.00 -1.02 0.00 0.00 39.78 38.15 1on4 n ASN 93 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1on4 s TYR 94 N -2.51 2.16 -0.59 3.10 2.02 0.20 -4.88 117.35 116.85 1on4 s TYR 94 Ca -0.25 0.10 -0.26 0.00 -0.37 0.00 0.00 57.07 56.28 1on4 s TYR 94 Cb 0.05 -4.07 -0.03 0.00 -0.40 0.00 0.00 41.96 37.51 1on4 s TYR 94 CO 0.38 -4.43 1.93 -1.25 -1.57 0.00 0.00 175.55 170.61 1on4 s PRO 95 N 2.97 2.57 0.33 -1.71 0.04 -1.26 -4.74 135.00 133.20 1on4 s PRO 95 Ca 0.78 0.73 -0.01 0.00 0.04 0.00 0.00 61.00 62.55 1on4 s PRO 95 Cb -0.42 -4.41 -0.00 0.00 0.04 0.00 0.00 34.50 29.70 1on4 s PRO 95 CO 0.35 -2.79 0.43 -0.48 0.04 0.00 0.00 177.00 174.54 1on4 s LEU 96 N 9.46 1.14 0.07 -3.56 0.05 -1.26 -4.89 118.68 119.69 1on4 s LEU 96 Ca 0.72 -1.52 0.04 0.00 0.05 0.00 0.00 54.13 53.41 1on4 s LEU 96 Cb -0.13 1.27 -0.03 0.00 -2.05 0.00 0.00 46.19 45.25 1on4 s LEU 96 CO 0.22 -1.24 -0.11 -0.55 -0.55 0.00 0.00 176.35 174.12 1on4 s SER 97 N -3.26 1.35 0.41 1.48 0.15 -1.26 -5.03 113.70 107.55 1on4 s SER 97 Ca 0.32 -0.69 0.22 0.00 0.70 0.00 0.00 55.95 56.51 1on4 s SER 97 Cb 0.00 0.00 0.40 0.00 -1.71 0.00 0.00 66.02 64.72 1on4 s SER 97 CO 0.21 -0.20 1.62 -0.26 1.20 0.00 0.00 173.24 175.81 1on4 h PHE 98 N 4.01 0.00 0.00 3.44 0.04 -1.99 -3.42 116.94 119.03 1on4 h PHE 98 Ca -0.38 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.39 1on4 h PHE 98 Cb 1.19 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.34 1on4 h PHE 98 CO 0.64 0.13 0.00 -3.47 -0.60 0.00 0.00 178.31 175.01 1on4 n ASP 99 N -3.15 0.00 -2.95 2.17 -0.08 -1.26 -0.87 116.55 110.42 1on4 n ASP 99 Ca 0.03 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.18 1on4 n ASP 99 Cb 0.55 0.00 0.02 0.00 2.34 0.00 0.00 41.12 44.04 1on4 n ASP 99 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1on4 n ASN 100 N -1.76 -0.29 -3.44 1.67 5.15 -1.26 -5.05 115.26 110.28 1on4 n ASN 100 Ca 0.00 -3.16 -0.13 0.00 -0.60 0.00 0.00 54.58 50.70 1on4 n ASN 100 Cb 0.00 0.31 -0.10 0.00 -0.53 0.00 0.00 39.78 39.45 1on4 n ASN 100 CO 0.00 0.00 0.00 0.86 1.40 0.00 0.00 177.26 179.52 1on4 s TRP 101 N -1.48 -0.60 -0.49 1.20 -0.11 -0.05 -3.89 118.94 113.54 1on4 s TRP 101 Ca 0.32 0.66 -0.16 0.00 1.22 0.00 0.00 56.10 58.14 1on4 s TRP 101 Cb 0.35 -0.11 0.08 0.00 -1.50 0.00 0.00 33.47 32.29 1on4 s TRP 101 CO -0.06 -0.64 0.45 -0.51 -4.62 0.00 0.00 176.95 171.57 1on4 s ASP 102 N 2.46 6.16 -0.48 5.86 1.01 -0.49 -4.70 116.67 126.50 1on4 s ASP 102 Ca 0.09 -1.30 -0.29 0.00 0.71 0.00 0.00 52.55 51.76 1on4 s ASP 102 Cb -0.15 -2.21 0.03 0.00 1.01 0.00 0.00 42.92 41.60 1on4 s ASP 102 CO -0.14 -0.72 1.16 -0.36 0.21 0.00 0.00 175.17 175.33 1on4 s PHE 103 N 1.82 2.77 0.02 4.23 0.40 -1.26 -0.92 117.98 125.05 1on4 s PHE 103 Ca 0.06 0.69 -0.17 0.00 -0.60 0.00 0.00 56.93 56.91 1on4 s PHE 103 Cb -0.24 -4.45 -0.06 0.00 0.51 0.00 0.00 43.02 38.78 1on4 s PHE 103 CO 0.07 -1.34 0.48 -0.51 0.70 0.00 0.00 175.22 174.62 1on4 s LEU 104 N 4.56 4.49 0.00 -0.37 1.43 0.35 -0.32 118.68 128.82 1on4 s LEU 104 Ca 0.49 1.08 0.00 0.00 -1.03 0.00 0.00 54.13 54.67 1on4 s LEU 104 Cb -0.07 -2.72 0.00 0.00 0.03 0.00 0.00 46.19 43.43 1on4 s LEU 104 CO 0.32 0.29 0.40 0.35 0.23 0.00 0.00 176.35 177.94 1on4 n THR 105 N 1.87 0.00 -0.21 5.49 -2.24 -0.51 -0.56 114.28 118.13 1on4 n THR 105 Ca -0.12 0.77 0.00 0.00 -2.27 0.00 0.00 64.05 62.43 1on4 n THR 105 Cb 0.52 -1.50 0.00 0.00 -2.10 0.00 0.00 70.33 67.25 1on4 n THR 105 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1on4 n GLY 106 N 0.41 0.70 7.00 3.38 0.00 -1.26 -3.36 105.19 112.05 1on4 n GLY 106 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1on4 n GLY 106 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1on4 n TYR 107 N -2.07 -1.43 -1.07 1.61 4.02 -1.26 -1.77 117.16 115.19 1on4 n TYR 107 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.52 1on4 n TYR 107 Cb 0.00 0.20 0.04 0.00 -0.02 0.00 0.00 39.34 39.56 1on4 n TYR 107 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1on4 n SER 108 N -3.26 -4.68 -0.37 7.72 2.88 -1.26 -4.29 113.62 110.36 1on4 n SER 108 Ca 0.00 0.35 0.02 0.00 -1.33 0.00 0.00 58.87 57.91 1on4 n SER 108 Cb 0.00 -0.86 0.08 0.00 -0.75 0.00 0.00 64.21 62.68 1on4 n SER 108 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1on4 n GLN 109 N 1.61 -0.18 -0.29 -1.46 1.13 -1.26 -0.34 117.38 116.60 1on4 n GLN 109 Ca 0.02 1.50 0.04 0.00 -1.94 0.00 0.00 57.00 56.62 1on4 n GLN 109 Cb 0.53 -2.24 0.12 0.00 0.11 0.00 0.00 30.24 28.76 1on4 n GLN 109 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 1on4 h SER 110 N 0.00 -0.72 0.33 1.08 0.02 -1.93 0.31 113.55 112.64 1on4 h SER 110 Ca 0.39 0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 61.56 1on4 h SER 110 Cb 0.63 0.50 0.00 0.00 0.14 0.00 0.00 62.40 63.67 1on4 h SER 110 CO -0.98 -0.27 -0.16 -0.33 -1.14 0.00 0.00 176.83 173.96 1on4 h GLU 111 N 0.01 -0.42 -0.58 3.45 4.39 -0.92 -3.31 114.58 117.19 1on4 h GLU 111 Ca 0.41 0.03 0.06 0.00 0.34 0.00 0.00 59.36 60.19 1on4 h GLU 111 Cb 0.64 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.35 1on4 h GLU 111 CO -0.84 -0.28 0.39 0.97 -1.16 0.00 0.00 179.01 178.09 1on4 h ILE 112 N -0.95 1.00 0.00 3.13 6.09 -0.23 -3.06 117.51 123.49 1on4 h ILE 112 Ca -0.04 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 63.25 1on4 h ILE 112 Cb 0.34 0.38 0.00 0.00 0.47 0.00 0.00 36.82 38.01 1on4 h ILE 112 CO 0.07 0.10 0.00 -0.62 -3.07 0.00 0.00 178.15 174.64 1on4 n GLU 113 N -4.47 0.00 0.02 2.19 1.02 0.11 -0.32 120.64 119.18 1on4 n GLU 113 Ca 0.08 0.75 -0.10 0.00 -0.02 0.00 0.00 57.16 57.87 1on4 n GLU 113 Cb 0.23 -1.48 -0.04 0.00 -0.02 0.00 0.00 31.44 30.13 1on4 n GLU 113 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1on4 h GLU 114 N 0.00 -0.19 -0.45 3.49 4.81 -1.62 0.23 114.58 120.84 1on4 h GLU 114 Ca 0.00 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1on4 h GLU 114 Cb 0.00 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.34 1on4 h GLU 114 CO 0.00 -0.13 -0.52 0.35 -0.73 0.00 0.00 179.01 177.98 1on4 h PHE 115 N -0.20 -1.62 -0.00 0.92 3.57 -1.55 0.70 116.94 118.76 1on4 h PHE 115 Ca 0.07 0.08 -0.11 0.00 3.53 0.00 0.00 57.97 61.55 1on4 h PHE 115 Cb 0.30 0.76 -0.02 0.00 2.79 0.00 0.00 35.95 39.79 1on4 h PHE 115 CO -0.23 -0.44 -0.50 0.00 -2.23 0.00 0.00 178.31 174.90 1on4 h ALA 116 N -0.07 1.17 0.75 2.41 0.00 0.10 0.71 119.26 124.33 1on4 h ALA 116 Ca 0.08 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 1on4 h ALA 116 Cb 0.53 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.25 1on4 h ALA 116 CO -0.60 0.63 -0.36 1.25 0.00 0.00 0.00 179.25 180.17 1on4 h LEU 117 N 0.00 -0.86 -0.40 0.00 7.12 -0.16 0.26 115.31 121.28 1on4 h LEU 117 Ca -0.00 0.03 0.07 0.00 0.13 0.00 0.00 57.88 58.11 1on4 h LEU 117 Cb 0.89 0.22 -0.09 0.00 -0.53 0.00 0.00 40.66 41.15 1on4 h LEU 117 CO 0.07 -0.52 -0.39 0.11 -0.13 0.00 0.00 178.44 177.58 1on4 h LYS 118 N -1.20 -0.29 -0.05 1.25 1.79 -0.74 -1.26 116.57 116.07 1on4 h LYS 118 Ca -0.10 0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.38 1on4 h LYS 118 Cb 0.77 0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 31.49 1on4 h LYS 118 CO 0.17 -0.19 0.01 0.77 -1.08 0.00 0.00 179.45 179.13 1on4 h SER 119 N -0.30 0.08 0.00 0.86 0.02 -0.91 -3.44 113.55 109.85 1on4 h SER 119 Ca 0.15 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1on4 h SER 119 Cb 0.57 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1on4 h SER 119 CO -0.56 0.30 0.00 0.49 -1.14 0.00 0.00 176.83 175.92 1on4 n PHE 120 N -4.92 -0.67 -0.66 3.45 3.72 0.48 -4.72 117.46 114.14 1on4 n PHE 120 Ca -0.07 0.12 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 1on4 n PHE 120 Cb 0.15 0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 1on4 n PHE 120 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1on4 n LYS 121 N -3.24 0.00 -3.18 -1.08 0.00 0.61 -4.92 118.16 106.35 1on4 n LYS 121 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 58.31 58.13 1on4 n LYS 121 Cb 0.00 -0.78 -0.03 0.00 -0.00 0.00 0.00 35.03 34.22 1on4 n LYS 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1on4 n ALA 122 N -0.42 2.08 -2.01 0.58 0.00 -1.14 -4.93 120.51 114.66 1on4 n ALA 122 Ca 0.00 -3.43 -0.22 0.00 0.00 0.00 0.00 53.44 49.79 1on4 n ALA 122 Cb 0.18 -0.92 0.19 0.00 0.00 0.00 0.00 19.45 18.90 1on4 n ALA 122 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1on4 n ILE 123 N 0.28 0.00 -4.33 0.00 -5.35 -1.26 -4.82 119.36 103.88 1on4 n ILE 123 Ca 0.25 -1.06 -0.18 0.00 -0.27 0.00 0.00 62.75 61.49 1on4 n ILE 123 Cb 0.65 -1.43 -0.10 0.00 -1.74 0.00 0.00 39.64 37.02 1on4 n ILE 123 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1on4 s VAL 124 N -3.78 1.64 0.00 7.28 -7.23 -1.26 -5.01 120.40 112.05 1on4 s VAL 124 Ca 0.74 -2.15 0.00 0.00 -1.81 0.00 0.00 61.98 58.75 1on4 s VAL 124 Cb -0.02 -1.98 0.00 0.00 0.56 0.00 0.00 36.38 34.94 1on4 s VAL 124 CO 0.51 -0.59 0.00 1.17 -0.31 0.00 0.00 175.10 175.88 1on4 n LYS 125 N -0.27 0.00 -3.22 4.82 3.00 -1.26 -4.90 118.16 116.32 1on4 n LYS 125 Ca -0.09 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 57.92 1on4 n LYS 125 Cb 0.60 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 35.59 1on4 n LYS 125 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1on4 s LYS 126 N -1.86 3.71 1.06 1.64 1.02 -1.26 -5.11 119.74 118.94 1on4 s LYS 126 Ca 0.00 0.18 -0.13 0.00 0.02 0.00 0.00 55.97 56.04 1on4 s LYS 126 Cb 0.00 -2.58 0.22 0.00 -0.52 0.00 0.00 37.83 34.96 1on4 s LYS 126 CO 0.00 0.17 1.08 -1.25 -0.92 0.00 0.00 175.35 174.42 1on4 s PRO 127 N -3.49 -0.10 0.00 -1.68 0.04 -1.26 -5.09 135.00 123.42 1on4 s PRO 127 Ca 0.47 0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.99 1on4 s PRO 127 Cb -0.11 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 32.76 1on4 s PRO 127 CO 0.29 -3.08 0.00 -0.85 0.04 0.00 0.00 177.00 173.39 1on4 n GLU 128 N -4.42 0.46 0.00 4.56 0.00 -1.26 -5.09 120.64 114.89 1on4 n GLU 128 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.21 1on4 n GLU 128 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.01 1on4 n GLU 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1on4 n GLY 129 N 5.00 0.63 3.76 -1.84 0.00 -1.26 -5.06 105.19 106.42 1on4 n GLY 129 Ca 0.00 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 1on4 n GLY 129 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1on4 n GLU 130 N 0.00 2.54 -0.91 1.61 1.02 -1.26 -4.85 120.64 118.79 1on4 n GLU 130 Ca 0.00 0.89 -0.10 0.00 -0.02 0.00 0.00 57.16 57.93 1on4 n GLU 130 Cb 0.00 -2.59 -0.13 0.00 -0.02 0.00 0.00 31.44 28.70 1on4 n GLU 130 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1on4 n ASP 131 N 0.50 5.32 -2.26 1.62 5.75 -1.26 -2.75 116.55 123.48 1on4 n ASP 131 Ca 0.02 -2.50 -0.02 0.00 -0.01 0.00 0.00 54.79 52.28 1on4 n ASP 131 Cb 0.38 -1.35 0.06 0.00 -1.03 0.00 0.00 41.12 39.19 1on4 n ASP 131 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 1on4 n GLN 132 N 2.20 0.69 -0.14 0.11 7.27 -1.26 -4.67 117.38 121.57 1on4 n GLN 132 Ca 0.34 -0.78 -0.05 0.00 0.07 0.00 0.00 57.00 56.58 1on4 n GLN 132 Cb 0.81 0.16 0.01 0.00 2.41 0.00 0.00 30.24 33.63 1on4 n GLN 132 CO 0.00 0.00 0.00 -0.39 0.07 0.00 0.00 177.06 176.74 1on4 h VAL 133 N 1.79 0.36 -1.88 1.69 -1.51 -1.87 -3.30 116.25 111.52 1on4 h VAL 133 Ca -0.29 0.00 -0.49 0.00 -1.23 0.00 0.00 66.70 64.69 1on4 h VAL 133 Cb 1.19 0.36 -0.38 0.00 -2.13 0.00 0.00 31.29 30.32 1on4 h VAL 133 CO -0.11 0.00 -1.13 -0.38 -1.23 0.00 0.00 177.57 174.71 1on4 n ILE 134 N -5.40 -0.29 -3.80 7.19 5.41 -1.26 -5.00 119.36 116.22 1on4 n ILE 134 Ca 0.03 -4.27 -0.33 0.00 1.00 0.00 0.00 62.75 59.18 1on4 n ILE 134 Cb 0.31 -0.57 0.02 0.00 -0.71 0.00 0.00 39.64 38.69 1on4 n ILE 134 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1on4 n HIS 135 N 0.58 -1.84 -2.74 1.39 8.25 -1.24 -4.80 115.22 114.81 1on4 n HIS 135 Ca 0.23 0.46 -0.09 0.00 -0.26 0.00 0.00 57.72 58.06 1on4 n HIS 135 Cb 0.63 -3.09 0.06 0.00 1.12 0.00 0.00 29.99 28.71 1on4 n HIS 135 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1on4 n GLN 136 N -3.92 1.13 -2.73 -0.41 10.64 -1.26 -4.83 117.38 116.00 1on4 n GLN 136 Ca -0.15 -2.61 -0.08 0.00 -1.83 0.00 0.00 57.00 52.33 1on4 n GLN 136 Cb 0.60 -0.82 0.10 0.00 -0.86 0.00 0.00 30.24 29.25 1on4 n GLN 136 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 1on4 n SER 137 N -0.18 -2.00 -3.83 2.61 3.41 -1.25 -4.46 113.62 107.92 1on4 n SER 137 Ca 0.06 -3.15 -0.12 0.00 -0.26 0.00 0.00 58.87 55.40 1on4 n SER 137 Cb 0.80 1.44 -0.11 0.00 -0.26 0.00 0.00 64.21 66.08 1on4 n SER 137 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1on4 s SER 138 N -1.31 -0.12 0.02 4.04 0.01 -1.26 -4.76 113.70 110.32 1on4 s SER 138 Ca 0.23 0.16 -0.00 0.00 1.31 0.00 0.00 55.95 57.64 1on4 s SER 138 Cb 0.34 0.31 -0.04 0.00 0.21 0.00 0.00 66.02 66.85 1on4 s SER 138 CO -0.07 -0.18 0.12 0.12 0.41 0.00 0.00 173.24 173.64 1on4 s PHE 139 N -0.46 3.35 0.09 2.43 2.19 0.54 -4.03 117.98 122.09 1on4 s PHE 139 Ca -0.06 0.22 0.03 0.00 0.33 0.00 0.00 56.93 57.46 1on4 s PHE 139 Cb -0.04 -1.74 -0.03 0.00 -1.31 0.00 0.00 43.02 39.90 1on4 s PHE 139 CO 0.01 0.57 -0.10 0.71 1.83 0.00 0.00 175.22 178.24 1on4 s TYR 140 N -1.30 1.02 -0.23 10.12 1.51 0.10 -1.04 117.35 127.53 1on4 s TYR 140 Ca 0.27 -0.64 0.02 0.00 -1.01 0.00 0.00 57.07 55.71 1on4 s TYR 140 Cb -0.12 -0.56 0.05 0.00 -0.11 0.00 0.00 41.96 41.21 1on4 s TYR 140 CO 0.18 -0.01 -0.14 -1.17 -1.11 0.00 0.00 175.55 173.30 1on4 s LEU 141 N -2.32 2.97 -0.35 -1.29 0.20 -0.25 -1.57 118.68 116.07 1on4 s LEU 141 Ca 0.03 -1.13 -0.18 0.00 0.69 0.00 0.00 54.13 53.54 1on4 s LEU 141 Cb -0.04 -1.52 -0.00 0.00 -0.43 0.00 0.00 46.19 44.20 1on4 s LEU 141 CO -0.00 -0.12 0.51 -0.69 -0.29 0.00 0.00 176.35 175.75 1on4 s VAL 142 N 1.17 5.02 0.99 1.68 1.01 0.59 -2.50 120.40 128.36 1on4 s VAL 142 Ca -0.04 0.32 -0.17 0.00 0.00 0.00 0.00 61.98 62.10 1on4 s VAL 142 Cb -0.18 -3.96 0.25 0.00 0.00 0.00 0.00 36.38 32.49 1on4 s VAL 142 CO -0.08 -0.21 0.79 0.61 0.00 0.00 0.00 175.10 176.21 1on4 n GLY 143 N 4.80 -3.02 0.22 4.51 0.00 0.11 -0.76 105.19 111.05 1on4 n GLY 143 Ca -0.05 -1.43 -0.08 0.00 0.00 0.00 0.00 46.02 44.46 1on4 n GLY 143 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1on4 h PRO 144 N 0.00 0.70 -0.07 1.61 0.13 -1.79 -1.97 132.00 130.61 1on4 h PRO 144 Ca -0.31 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1on4 h PRO 144 Cb 0.97 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1on4 h PRO 144 CO 0.20 0.63 0.00 -0.25 -0.23 0.00 0.00 178.00 178.35 1on4 n ASP 145 N -4.59 0.07 -2.10 1.44 9.92 -1.26 0.35 116.55 120.38 1on4 n ASP 145 Ca 0.01 -0.56 -0.17 0.00 -0.53 0.00 0.00 54.79 53.54 1on4 n ASP 145 Cb 0.15 -0.04 -0.03 0.00 -0.64 0.00 0.00 41.12 40.56 1on4 n ASP 145 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1on4 n GLY 146 N -0.07 0.26 3.44 0.44 0.00 -0.74 -4.69 105.19 103.83 1on4 n GLY 146 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1on4 n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1on4 s LYS 147 N -4.49 3.58 0.06 1.61 -2.85 -1.24 -0.68 119.74 115.73 1on4 s LYS 147 Ca 0.00 -0.55 -0.31 0.00 -1.00 0.00 0.00 55.97 54.11 1on4 s LYS 147 Cb 0.00 -2.96 -0.05 0.00 -2.06 0.00 0.00 37.83 32.76 1on4 s LYS 147 CO 0.00 0.09 1.18 0.14 0.10 0.00 0.00 175.35 176.86 1on4 s VAL 148 N 0.76 4.11 -0.22 1.79 -7.23 -1.00 0.09 120.40 118.70 1on4 s VAL 148 Ca -0.01 1.52 0.15 0.00 -1.81 0.00 0.00 61.98 61.82 1on4 s VAL 148 Cb -0.14 -3.97 -0.21 0.00 0.56 0.00 0.00 36.38 32.62 1on4 s VAL 148 CO 0.02 0.12 0.41 0.18 -0.31 0.00 0.00 175.10 175.52 1on4 n LEU 149 N 3.90 0.20 -3.79 1.32 4.77 -1.04 -2.49 117.00 119.87 1on4 n LEU 149 Ca 0.09 -0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.79 1on4 n LEU 149 Cb 0.47 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.46 1on4 n LEU 149 CO 0.55 0.05 -0.06 -0.54 -1.33 0.00 0.00 177.39 176.07 1on4 s LYS 150 N -2.83 0.48 0.02 3.23 1.02 -1.23 -3.04 119.74 117.39 1on4 s LYS 150 Ca -0.02 0.02 0.04 0.00 0.02 0.00 0.00 55.97 56.03 1on4 s LYS 150 Cb 0.10 0.21 -0.02 0.00 -0.52 0.00 0.00 37.83 37.61 1on4 s LYS 150 CO 0.61 -0.10 -0.13 -0.51 -0.92 0.00 0.00 175.35 174.30 1on4 s ASP 151 N -0.69 1.48 -0.26 2.83 1.11 -1.26 -1.09 116.67 118.80 1on4 s ASP 151 Ca -0.08 -0.38 -0.13 0.00 0.18 0.00 0.00 52.55 52.14 1on4 s ASP 151 Cb -0.04 -0.11 0.08 0.00 1.07 0.00 0.00 42.92 43.92 1on4 s ASP 151 CO 0.02 0.05 0.62 -0.72 1.18 0.00 0.00 175.17 176.32 1on4 s TYR 152 N -0.68 -1.00 -0.09 4.23 1.13 -0.20 -0.48 117.35 120.25 1on4 s TYR 152 Ca 0.02 1.97 -0.27 0.00 -1.41 0.00 0.00 57.07 57.38 1on4 s TYR 152 Cb -0.07 0.57 -0.25 0.00 -1.10 0.00 0.00 41.96 41.12 1on4 s TYR 152 CO 0.01 -0.51 0.94 -0.97 -2.51 0.00 0.00 175.55 172.50 1on4 h ASN 153 N 7.20 0.09 0.00 -0.18 -0.00 0.25 0.15 115.58 123.10 1on4 h ASN 153 Ca -0.29 -0.85 0.00 0.00 -0.00 0.00 0.00 56.30 55.16 1on4 h ASN 153 Cb 1.20 -0.03 0.00 0.00 -0.00 0.00 0.00 38.32 39.49 1on4 h ASN 153 CO 0.18 0.93 0.00 0.61 -0.00 0.00 0.00 177.43 179.15 1on4 n GLY 154 N 1.22 0.93 0.35 1.57 0.00 -1.23 -3.92 105.19 104.11 1on4 n GLY 154 Ca -0.10 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.84 1on4 n GLY 154 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1on4 h VAL 155 N 0.00 0.19 -3.25 1.61 2.07 -1.85 0.96 116.25 115.98 1on4 h VAL 155 Ca 0.00 0.00 -0.67 0.00 0.82 0.00 0.00 66.70 66.85 1on4 h VAL 155 Cb 0.00 0.19 -0.38 0.00 -1.52 0.00 0.00 31.29 29.59 1on4 h VAL 155 CO 0.00 0.00 -0.29 -0.70 0.02 0.00 0.00 177.57 176.60 1on4 s GLU 156 N -5.97 2.91 0.00 1.57 2.12 -1.26 -4.49 118.70 113.58 1on4 s GLU 156 Ca -0.15 -3.24 0.00 0.00 0.36 0.00 0.00 54.97 51.94 1on4 s GLU 156 Cb 0.14 -3.74 0.00 0.00 0.26 0.00 0.00 34.13 30.79 1on4 s GLU 156 CO 0.68 -1.26 0.00 0.27 -0.54 0.00 0.00 175.26 174.40 1on4 n ASN 157 N 2.30 0.00 -1.13 -1.70 0.23 0.33 -4.85 115.26 110.43 1on4 n ASN 157 Ca 0.19 0.00 -0.12 0.00 -0.53 0.00 0.00 54.58 54.12 1on4 n ASN 157 Cb 0.36 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.06 1on4 n ASN 157 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 1on4 n THR 158 N 0.00 0.42 0.00 5.53 -1.04 -1.26 -4.06 114.28 113.87 1on4 n THR 158 Ca 0.00 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1on4 n THR 158 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1on4 n THR 158 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1on4 n PRO 159 N 0.28 0.00 0.00 -2.82 -0.04 -1.26 -0.24 135.00 130.92 1on4 n PRO 159 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1on4 n PRO 159 Cb 0.07 -0.05 0.00 0.00 -0.04 0.00 0.00 33.50 33.49 1on4 n PRO 159 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1on4 n TYR 160 N 0.00 0.00 -0.15 0.54 4.01 -1.26 -0.28 117.16 120.02 1on4 n TYR 160 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.71 1on4 n TYR 160 Cb 0.00 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.07 1on4 n TYR 160 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1on4 h ASP 161 N 0.00 -0.33 0.42 7.72 3.32 -1.12 0.34 116.42 126.76 1on4 h ASP 161 Ca 0.00 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1on4 h ASP 161 Cb 0.00 0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1on4 h ASP 161 CO 0.00 -0.12 -0.25 -2.24 -1.72 0.00 0.00 179.24 174.92 1on4 h ASP 162 N 0.05 -0.62 0.45 6.45 2.03 -1.86 -0.31 116.42 122.61 1on4 h ASP 162 Ca 0.23 0.03 -0.02 0.00 -0.73 0.00 0.00 57.03 56.54 1on4 h ASP 162 Cb 0.35 0.18 0.00 0.00 -0.83 0.00 0.00 39.33 39.04 1on4 h ASP 162 CO -0.44 -0.39 -0.22 0.40 -1.03 0.00 0.00 179.24 177.56 1on4 h ILE 163 N -0.62 0.56 -0.36 4.15 2.04 -1.85 -0.37 117.51 121.06 1on4 h ILE 163 Ca -0.06 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1on4 h ILE 163 Cb 0.49 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1on4 h ILE 163 CO 0.06 0.02 0.22 0.40 0.00 0.00 0.00 178.15 178.84 1on4 h ILE 164 N -0.65 1.12 -0.07 -0.67 5.03 -0.46 -0.83 117.51 120.99 1on4 h ILE 164 Ca -0.06 -0.28 0.04 0.00 -0.12 0.00 0.00 64.86 64.44 1on4 h ILE 164 Cb 0.49 0.66 -0.05 0.00 -3.03 0.00 0.00 36.82 34.89 1on4 h ILE 164 CO 0.10 0.12 -0.26 -1.28 -0.68 0.00 0.00 178.15 176.16 1on4 h SER 165 N 0.46 -0.77 -0.16 1.72 0.87 -0.76 0.27 113.55 115.18 1on4 h SER 165 Ca 0.13 0.11 0.05 0.00 -1.23 0.00 0.00 61.79 60.85 1on4 h SER 165 Cb 0.01 0.33 -0.06 0.00 -0.44 0.00 0.00 62.40 62.23 1on4 h SER 165 CO -0.02 -0.31 -0.29 -0.78 -0.53 0.00 0.00 176.83 174.89 1on4 h ASP 166 N -0.36 -0.91 -0.45 6.23 3.58 -0.77 0.11 116.42 123.84 1on4 h ASP 166 Ca 0.08 0.14 -0.05 0.00 0.42 0.00 0.00 57.03 57.62 1on4 h ASP 166 Cb 0.48 0.40 -0.02 0.00 1.72 0.00 0.00 39.33 41.90 1on4 h ASP 166 CO -0.27 -0.33 0.12 0.58 -2.88 0.00 0.00 179.24 176.45 1on4 h VAL 167 N -0.35 1.22 -0.66 2.25 2.07 -0.80 -0.06 116.25 119.93 1on4 h VAL 167 Ca 0.11 -0.80 -0.05 0.00 0.82 0.00 0.00 66.70 66.77 1on4 h VAL 167 Cb 0.51 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 1on4 h VAL 167 CO -0.36 0.30 0.20 0.11 0.02 0.00 0.00 177.57 177.84 1on4 h LYS 168 N 0.76 1.03 0.56 1.57 6.56 0.32 0.19 116.57 127.56 1on4 h LYS 168 Ca 0.17 -0.22 -0.02 0.00 -1.06 0.00 0.00 60.65 59.51 1on4 h LYS 168 Cb 0.29 -0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 31.80 1on4 h LYS 168 CO -0.00 0.90 -0.42 1.03 -2.06 0.00 0.00 179.45 178.90 1on4 h SER 169 N 0.96 -1.11 -0.86 0.86 0.87 0.10 -0.89 113.55 113.49 1on4 h SER 169 Ca 0.21 0.08 0.17 0.00 -1.23 0.00 0.00 61.79 61.02 1on4 h SER 169 Cb 0.30 0.35 -0.11 0.00 -0.44 0.00 0.00 62.40 62.50 1on4 h SER 169 CO -0.01 -0.60 0.40 0.00 -0.53 0.00 0.00 176.83 176.10 1on4 h ALA 170 N -1.18 1.31 0.31 6.23 0.00 -1.00 -1.33 119.26 123.60 1on4 h ALA 170 Ca -0.07 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1on4 h ALA 170 Cb 0.78 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1on4 h ALA 170 CO 0.02 -0.19 -0.23 1.03 0.00 0.00 0.00 179.25 179.88 1on4 h SER 171 N 0.52 -0.59 0.00 0.00 0.87 -0.32 -3.44 113.55 110.58 1on4 h SER 171 Ca 0.49 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 61.09 1on4 h SER 171 Cb 0.80 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1on4 h SER 171 CO -0.43 -0.33 0.00 1.07 -0.53 0.00 0.00 176.83 176.61 1on4 n THR 172 N -3.71 0.00 -3.98 2.23 5.66 -0.59 -5.03 114.28 108.86 1on4 n THR 172 Ca -0.06 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.55 1on4 n THR 172 Cb 0.22 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.02 1on4 n THR 172 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1on4 n LEU 173 N 0.00 -0.50 -0.56 1.09 4.32 -0.44 -4.96 117.00 115.96 1on4 n LEU 173 Ca 0.00 -1.15 0.14 0.00 -0.02 0.00 0.00 56.01 54.98 1on4 n LEU 173 Cb 0.00 -1.47 0.46 0.00 -1.62 0.00 0.00 43.42 40.78 1on4 n LEU 173 CO 0.00 0.68 0.83 0.29 -1.22 0.00 0.00 177.39 177.97