#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fm1 s LEU 8 N 0.00 4.26 0.14 -4.42 1.43 -1.26 -5.03 118.68 113.81 1fm1 s LEU 8 Ca 0.00 2.41 -0.24 0.00 -1.03 0.00 0.00 54.13 55.27 1fm1 s LEU 8 Cb 0.00 -3.92 0.07 0.00 0.03 0.00 0.00 46.19 42.37 1fm1 s LEU 8 CO 0.00 -0.61 0.63 -1.59 0.23 0.00 0.00 176.35 175.00 1fm1 s LYS 9 N -2.13 1.24 -0.05 1.70 -2.85 -1.26 -4.17 119.74 112.22 1fm1 s LYS 9 Ca 0.55 -0.45 -0.30 0.00 -1.00 0.00 0.00 55.97 54.76 1fm1 s LYS 9 Cb -0.33 0.57 -0.03 0.00 -2.06 0.00 0.00 37.83 35.98 1fm1 s LYS 9 CO 0.42 -0.54 1.21 -1.58 0.10 0.00 0.00 175.35 174.95 1fm1 s TRP 10 N -3.69 3.19 0.24 1.78 0.52 -1.26 -4.90 118.94 114.81 1fm1 s TRP 10 Ca 0.01 1.21 0.11 0.00 0.02 0.00 0.00 56.10 57.45 1fm1 s TRP 10 Cb -0.01 -3.43 0.33 0.00 -1.15 0.00 0.00 33.47 29.21 1fm1 s TRP 10 CO -0.13 -1.34 1.59 0.66 0.02 0.00 0.00 176.95 177.75 1fm1 h SER 11 N 7.45 0.00 -3.10 2.95 4.64 -2.00 -3.43 113.55 120.06 1fm1 h SER 11 Ca -0.34 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.38 1fm1 h SER 11 Cb 1.16 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.20 1fm1 h SER 11 CO 0.88 0.63 -0.15 -1.59 -0.87 0.00 0.00 176.83 175.73 1fm1 s LYS 12 N -3.50 4.03 0.00 4.77 -2.85 -1.26 -4.96 119.74 115.97 1fm1 s LYS 12 Ca -0.01 0.50 0.28 0.00 -1.00 0.00 0.00 55.97 55.74 1fm1 s LYS 12 Cb 0.12 -3.25 0.99 0.00 -2.06 0.00 0.00 37.83 33.64 1fm1 s LYS 12 CO 0.76 0.63 1.71 -1.33 0.10 0.00 0.00 175.35 177.22 1fm1 n MET 13 N 1.96 1.71 -3.58 1.78 2.81 -1.26 -4.81 117.12 115.72 1fm1 n MET 13 Ca -0.12 -1.03 -0.37 0.00 -1.81 0.00 0.00 57.70 54.37 1fm1 n MET 13 Cb 0.52 -1.48 -0.09 0.00 -0.71 0.00 0.00 33.22 31.46 1fm1 n MET 13 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1fm1 s ASN 14 N -1.99 6.23 0.04 7.83 0.01 -1.26 -1.59 114.94 124.20 1fm1 s ASN 14 Ca 0.37 0.26 0.01 0.00 -0.71 0.00 0.00 52.86 52.79 1fm1 s ASN 14 Cb 0.21 -2.14 -0.03 0.00 0.41 0.00 0.00 41.25 39.70 1fm1 s ASN 14 CO 0.33 0.04 -0.04 -0.76 -1.51 0.00 0.00 177.10 175.15 1fm1 s LEU 15 N 1.03 2.30 0.09 0.60 1.43 -0.72 -4.97 118.68 118.44 1fm1 s LEU 15 Ca 0.11 -0.63 0.04 0.00 -1.03 0.00 0.00 54.13 52.63 1fm1 s LEU 15 Cb -0.14 0.04 -0.03 0.00 0.03 0.00 0.00 46.19 46.09 1fm1 s LEU 15 CO 0.05 -0.33 -0.10 0.42 0.23 0.00 0.00 176.35 176.61 1fm1 s THR 16 N -1.97 0.93 0.07 5.49 -4.23 -1.26 -2.34 115.64 112.33 1fm1 s THR 16 Ca -0.09 -1.55 -0.06 0.00 -1.18 0.00 0.00 61.69 58.82 1fm1 s THR 16 Cb -0.06 -1.25 -0.02 0.00 1.34 0.00 0.00 72.50 72.51 1fm1 s THR 16 CO -0.02 -0.50 0.11 -0.72 -0.54 0.00 0.00 174.62 172.94 1fm1 s TYR 17 N -2.20 0.29 -0.04 3.99 1.13 -1.06 -2.43 117.35 117.04 1fm1 s TYR 17 Ca 0.03 -0.77 -0.02 0.00 -1.41 0.00 0.00 57.07 54.90 1fm1 s TYR 17 Cb -0.04 -0.19 0.02 0.00 -1.10 0.00 0.00 41.96 40.65 1fm1 s TYR 17 CO 0.00 -0.48 0.09 0.50 -2.51 0.00 0.00 175.55 173.15 1fm1 s ARG 18 N -3.88 0.06 -0.29 -3.49 3.52 -1.02 -2.47 118.95 111.38 1fm1 s ARG 18 Ca 0.06 0.21 -0.22 0.00 -0.13 0.00 0.00 55.73 55.65 1fm1 s ARG 18 Cb 0.06 -0.09 -0.01 0.00 -1.56 0.00 0.00 34.95 33.35 1fm1 s ARG 18 CO -0.11 -0.10 0.72 0.42 -0.81 0.00 0.00 175.30 175.43 1fm1 s ILE 19 N 0.64 4.87 0.17 4.11 1.01 -1.26 -1.28 121.20 129.46 1fm1 s ILE 19 Ca -0.05 1.13 -0.08 0.00 0.00 0.00 0.00 60.65 61.65 1fm1 s ILE 19 Cb -0.07 -4.07 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 1fm1 s ILE 19 CO -0.03 -0.16 1.53 0.58 0.00 0.00 0.00 174.94 176.86 1fm1 h VAL 20 N 5.54 1.28 -2.84 2.92 2.07 -0.60 -3.47 116.25 121.15 1fm1 h VAL 20 Ca -0.25 -1.52 -0.03 0.00 0.82 0.00 0.00 66.70 65.72 1fm1 h VAL 20 Cb 1.11 1.37 -0.14 0.00 -1.52 0.00 0.00 31.29 32.11 1fm1 h VAL 20 CO 0.84 0.50 0.17 0.54 0.02 0.00 0.00 177.57 179.65 1fm1 s ASN 21 N -6.82 -0.55 -0.85 0.57 4.22 -1.26 -5.06 114.94 105.19 1fm1 s ASN 21 Ca -0.10 0.11 0.00 0.00 -2.14 0.00 0.00 52.86 50.73 1fm1 s ASN 21 Cb 0.12 0.57 0.23 0.00 1.28 0.00 0.00 41.25 43.45 1fm1 s ASN 21 CO 0.86 -0.88 0.83 -1.22 -2.04 0.00 0.00 177.10 174.66 1fm1 n TYR 22 N -0.08 3.78 -0.56 1.54 4.01 -1.26 -4.80 117.16 119.79 1fm1 n TYR 22 Ca -0.17 -3.97 -0.18 0.00 -0.16 0.00 0.00 57.90 53.41 1fm1 n TYR 22 Cb 0.63 -0.99 0.01 0.00 -0.31 0.00 0.00 39.34 38.68 1fm1 n TYR 22 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 1fm1 n THR 23 N 1.87 0.00 0.35 -0.72 5.66 -1.26 -4.69 114.28 115.48 1fm1 n THR 23 Ca 0.24 -0.23 0.04 0.00 -3.05 0.00 0.00 64.05 61.05 1fm1 n THR 23 Cb 0.37 0.00 0.19 0.00 -1.55 0.00 0.00 70.33 69.34 1fm1 n THR 23 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1fm1 n PRO 24 N 0.72 0.09 -0.25 1.09 -0.04 -1.26 -2.97 135.00 132.39 1fm1 n PRO 24 Ca 0.03 0.24 0.02 0.00 -0.04 0.00 0.00 63.50 63.75 1fm1 n PRO 24 Cb 0.22 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.42 1fm1 n PRO 24 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1fm1 h ASP 25 N 0.00 0.88 -5.13 3.54 3.32 -1.91 -3.44 116.42 113.68 1fm1 h ASP 25 Ca 0.00 -0.01 -0.18 0.00 0.02 0.00 0.00 57.03 56.86 1fm1 h ASP 25 Cb 0.08 -0.21 -0.15 0.00 0.22 0.00 0.00 39.33 39.28 1fm1 h ASP 25 CO 0.00 0.61 -0.67 -0.04 -1.72 0.00 0.00 179.24 177.42 1fm1 s MET 26 N -5.87 0.83 0.76 3.56 -1.94 -1.16 -4.89 119.30 110.59 1fm1 s MET 26 Ca -0.11 -1.36 -0.11 0.00 -1.71 0.00 0.00 55.69 52.40 1fm1 s MET 26 Cb 0.18 0.10 0.05 0.00 2.01 0.00 0.00 34.83 37.17 1fm1 s MET 26 CO 0.79 -0.16 1.08 0.95 -0.01 0.00 0.00 175.02 177.67 1fm1 s THR 27 N -3.89 3.49 0.24 2.05 -4.23 -1.26 -4.74 115.64 107.29 1fm1 s THR 27 Ca 0.16 0.48 -0.07 0.00 -1.18 0.00 0.00 61.69 61.09 1fm1 s THR 27 Cb 0.07 -3.05 0.24 0.00 1.34 0.00 0.00 72.50 71.10 1fm1 s THR 27 CO -0.03 -0.63 1.92 0.45 -0.54 0.00 0.00 174.62 175.79 1fm1 h HIS 28 N -1.03 1.21 -0.76 3.99 3.86 -1.91 -1.89 115.15 118.62 1fm1 h HIS 28 Ca -0.44 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 58.81 1fm1 h HIS 28 Cb 1.23 -0.41 -0.04 0.00 1.06 0.00 0.00 27.41 29.25 1fm1 h HIS 28 CO 0.58 0.76 0.50 0.77 0.86 0.00 0.00 177.93 181.41 1fm1 h SER 29 N 1.31 0.87 -0.50 2.45 0.02 -2.00 0.14 113.55 115.85 1fm1 h SER 29 Ca 0.35 -0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 61.15 1fm1 h SER 29 Cb -0.15 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.16 1fm1 h SER 29 CO -0.08 0.63 -0.20 -0.33 -1.14 0.00 0.00 176.83 175.71 1fm1 h GLU 30 N 1.03 1.01 -0.27 3.45 5.08 -1.80 -2.72 114.58 120.35 1fm1 h GLU 30 Ca 0.28 -0.43 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 1fm1 h GLU 30 Cb -0.12 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1fm1 h GLU 30 CO -0.06 1.11 -0.08 0.28 -1.00 0.00 0.00 179.01 179.26 1fm1 h VAL 31 N 0.88 1.28 -0.06 3.13 2.07 -0.96 -2.75 116.25 119.84 1fm1 h VAL 31 Ca 0.12 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.53 1fm1 h VAL 31 Cb 0.79 1.44 -0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1fm1 h VAL 31 CO 0.07 0.35 0.04 -0.33 0.02 0.00 0.00 177.57 177.71 1fm1 h GLU 32 N 0.29 0.08 -0.34 1.57 5.08 -0.95 -2.28 114.58 118.02 1fm1 h GLU 32 Ca 0.07 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1fm1 h GLU 32 Cb 0.56 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1fm1 h GLU 32 CO 0.03 0.05 0.20 1.57 -1.00 0.00 0.00 179.01 179.86 1fm1 h LYS 33 N 0.08 0.45 -0.00 2.33 2.10 -1.52 -1.79 116.57 118.22 1fm1 h LYS 33 Ca 0.02 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1fm1 h LYS 33 Cb -0.01 -0.10 -0.00 0.00 -0.90 0.00 0.00 32.23 31.22 1fm1 h LYS 33 CO -0.00 0.33 0.00 0.00 -2.00 0.00 0.00 179.45 177.77 1fm1 h ALA 34 N 1.76 0.00 -0.52 0.07 0.00 -1.10 -0.97 119.26 118.49 1fm1 h ALA 34 Ca 0.12 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1fm1 h ALA 34 Cb -0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1fm1 h ALA 34 CO -0.02 -0.50 -0.07 0.74 0.00 0.00 0.00 179.25 179.40 1fm1 h PHE 35 N 0.00 1.04 -0.77 0.00 0.04 -1.22 -2.82 116.94 113.22 1fm1 h PHE 35 Ca 0.00 -0.19 0.01 0.00 2.80 0.00 0.00 57.97 60.59 1fm1 h PHE 35 Cb -0.00 -0.27 -0.04 0.00 2.20 0.00 0.00 35.95 37.85 1fm1 h PHE 35 CO -0.08 0.97 0.51 0.87 -0.60 0.00 0.00 178.31 179.97 1fm1 h LYS 36 N 0.85 1.01 -1.00 1.51 1.57 -1.01 -1.57 116.57 117.93 1fm1 h LYS 36 Ca 0.14 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1fm1 h LYS 36 Cb 0.60 -0.23 -0.05 0.00 0.08 0.00 0.00 32.23 32.64 1fm1 h LYS 36 CO 0.04 0.67 0.66 0.87 -0.57 0.00 0.00 179.45 181.11 1fm1 h LYS 37 N 1.04 1.32 -0.17 3.15 1.57 -0.98 -0.09 116.57 122.41 1fm1 h LYS 37 Ca 0.28 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1fm1 h LYS 37 Cb -0.12 -0.30 -0.01 0.00 0.08 0.00 0.00 32.23 31.89 1fm1 h LYS 37 CO -0.06 0.88 0.11 0.00 -0.57 0.00 0.00 179.45 179.81 1fm1 h ALA 38 N 1.37 0.21 -0.56 3.86 0.00 -1.07 -1.46 119.26 121.61 1fm1 h ALA 38 Ca 0.37 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.17 1fm1 h ALA 38 Cb -0.15 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1fm1 h ALA 38 CO -0.08 -0.31 -0.03 0.74 0.00 0.00 0.00 179.25 179.57 1fm1 h PHE 39 N 0.22 1.09 -0.12 0.00 0.04 -0.97 -2.58 116.94 114.62 1fm1 h PHE 39 Ca 0.06 -0.19 0.00 0.00 2.80 0.00 0.00 57.97 60.64 1fm1 h PHE 39 Cb -0.02 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 37.84 1fm1 h PHE 39 CO -0.07 0.98 0.08 -0.22 -0.60 0.00 0.00 178.31 178.49 1fm1 h LYS 40 N 0.91 0.16 -1.01 1.51 1.63 -0.68 1.05 116.57 120.15 1fm1 h LYS 40 Ca 0.16 -0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.96 1fm1 h LYS 40 Cb 0.57 -0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 32.11 1fm1 h LYS 40 CO 0.03 0.11 0.67 0.28 -3.45 0.00 0.00 179.45 177.09 1fm1 h VAL 41 N 0.17 1.26 0.09 2.00 2.07 -1.17 0.13 116.25 120.80 1fm1 h VAL 41 Ca 0.05 -0.47 -0.27 0.00 0.82 0.00 0.00 66.70 66.83 1fm1 h VAL 41 Cb -0.02 -0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 29.52 1fm1 h VAL 41 CO -0.01 0.25 -1.27 -0.50 0.02 0.00 0.00 177.57 176.06 1fm1 h TRP 42 N 1.36 0.34 0.00 1.57 4.06 -1.06 -3.24 115.95 118.98 1fm1 h TRP 42 Ca 0.37 -0.25 -0.01 0.00 2.06 0.00 0.00 58.89 61.06 1fm1 h TRP 42 Cb -0.16 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 27.99 1fm1 h TRP 42 CO -0.00 1.22 -0.07 0.66 -3.56 0.00 0.00 178.44 176.69 1fm1 h SER 43 N 0.05 0.00 -1.01 -3.49 4.64 0.15 -3.01 113.55 110.88 1fm1 h SER 43 Ca -0.14 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.20 1fm1 h SER 43 Cb 1.93 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.97 1fm1 h SER 43 CO 0.17 0.07 0.67 0.44 -0.87 0.00 0.00 176.83 177.31 1fm1 h ASP 44 N 0.00 1.16 -0.35 4.97 3.32 -1.00 -2.83 116.42 121.69 1fm1 h ASP 44 Ca -0.00 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 56.91 1fm1 h ASP 44 Cb 0.66 -0.29 -0.06 0.00 0.22 0.00 0.00 39.33 39.85 1fm1 h ASP 44 CO 0.01 0.84 0.01 1.33 -1.72 0.00 0.00 179.24 179.71 1fm1 n VAL 45 N -4.38 2.46 -3.74 -1.35 0.24 -1.17 -4.97 118.33 105.42 1fm1 n VAL 45 Ca 0.12 -2.23 -0.12 0.00 -2.04 0.00 0.00 64.34 60.07 1fm1 n VAL 45 Cb 0.01 -0.30 -0.11 0.00 -1.47 0.00 0.00 33.84 31.97 1fm1 n VAL 45 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1fm1 s THR 46 N -3.03 -0.02 -1.36 3.34 -4.23 -1.07 -4.79 115.64 104.49 1fm1 s THR 46 Ca 0.44 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 61.01 1fm1 s THR 46 Cb 0.38 -0.48 0.00 0.00 1.34 0.00 0.00 72.50 73.74 1fm1 s THR 46 CO 0.05 0.02 0.47 -0.81 -0.54 0.00 0.00 174.62 173.82 1fm1 n PRO 47 N 3.54 0.69 -2.18 3.99 -0.04 -1.26 -4.61 135.00 135.13 1fm1 n PRO 47 Ca -0.18 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.87 1fm1 n PRO 47 Cb 0.56 -1.22 -0.03 0.00 -0.04 0.00 0.00 33.50 32.77 1fm1 n PRO 47 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fm1 s LEU 48 N -0.36 4.45 -0.22 1.53 1.43 -1.26 -4.93 118.68 119.32 1fm1 s LEU 48 Ca 0.00 2.59 -0.04 0.00 -1.03 0.00 0.00 54.13 55.65 1fm1 s LEU 48 Cb 0.00 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.57 1fm1 s LEU 48 CO 0.00 -0.47 -0.02 0.20 0.23 0.00 0.00 176.35 176.28 1fm1 s ASN 49 N -0.45 4.48 -0.21 2.29 0.02 -0.62 -4.88 114.94 115.56 1fm1 s ASN 49 Ca 0.49 -0.34 -0.05 0.00 -1.02 0.00 0.00 52.86 51.94 1fm1 s ASN 49 Cb -0.38 -1.77 -0.02 0.00 0.02 0.00 0.00 41.25 39.09 1fm1 s ASN 49 CO 0.49 -0.01 0.01 -0.36 0.02 0.00 0.00 177.10 177.25 1fm1 s PHE 50 N 1.41 3.04 -0.10 2.20 0.08 -1.26 -1.76 117.98 121.60 1fm1 s PHE 50 Ca 0.05 -0.49 0.04 0.00 0.12 0.00 0.00 56.93 56.65 1fm1 s PHE 50 Cb -0.14 -2.11 0.00 0.00 -0.57 0.00 0.00 43.02 40.19 1fm1 s PHE 50 CO -0.01 -0.28 -0.24 0.99 -0.10 0.00 0.00 175.22 175.57 1fm1 s THR 51 N 1.14 2.06 0.02 0.64 2.01 -0.99 -5.02 115.64 115.50 1fm1 s THR 51 Ca 0.03 -1.02 -0.26 0.00 0.31 0.00 0.00 61.69 60.75 1fm1 s THR 51 Cb -0.14 -1.78 -0.05 0.00 0.01 0.00 0.00 72.50 70.54 1fm1 s THR 51 CO 0.02 0.56 0.80 -0.60 -0.69 0.00 0.00 174.62 174.71 1fm1 s ARG 52 N 0.34 4.51 -0.11 4.92 3.52 -1.26 -2.55 118.95 128.32 1fm1 s ARG 52 Ca -0.19 1.12 -0.05 0.00 -0.13 0.00 0.00 55.73 56.47 1fm1 s ARG 52 Cb -0.18 -3.40 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 1fm1 s ARG 52 CO 0.09 0.18 0.10 -0.51 -0.81 0.00 0.00 175.30 174.34 1fm1 s LEU 53 N 0.30 4.13 0.15 -0.88 1.43 -1.03 -4.96 118.68 117.81 1fm1 s LEU 53 Ca 0.41 0.36 -0.11 0.00 -1.03 0.00 0.00 54.13 53.76 1fm1 s LEU 53 Cb -0.20 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 1fm1 s LEU 53 CO 0.23 0.39 1.49 0.45 0.23 0.00 0.00 176.35 179.15 1fm1 h HIS 54 N 5.08 1.14 -3.63 0.29 3.86 -1.97 -3.45 115.15 116.48 1fm1 h HIS 54 Ca -0.53 -0.33 -0.18 0.00 -1.16 0.00 0.00 60.37 58.17 1fm1 h HIS 54 Cb 1.22 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 29.40 1fm1 h HIS 54 CO 0.72 1.17 0.03 -0.51 0.86 0.00 0.00 177.93 180.19 1fm1 s ASP 55 N -6.82 0.59 0.00 2.45 1.01 -1.26 -5.04 116.67 107.60 1fm1 s ASP 55 Ca -0.11 -1.39 0.00 0.00 0.71 0.00 0.00 52.55 51.76 1fm1 s ASP 55 Cb 0.11 0.77 0.00 0.00 1.01 0.00 0.00 42.92 44.81 1fm1 s ASP 55 CO 0.88 -1.51 0.00 0.61 0.21 0.00 0.00 175.17 175.36 1fm1 n GLY 56 N -0.57 -1.99 3.75 0.21 0.00 -1.26 -4.90 105.19 100.43 1fm1 n GLY 56 Ca -0.03 -1.83 -0.36 0.00 0.00 0.00 0.00 46.02 43.80 1fm1 n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fm1 s ILE 57 N -0.08 5.33 0.35 -0.61 1.01 -1.26 -5.04 121.20 120.90 1fm1 s ILE 57 Ca 0.00 0.46 0.08 0.00 0.00 0.00 0.00 60.65 61.19 1fm1 s ILE 57 Cb 0.00 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 38.85 1fm1 s ILE 57 CO 0.00 0.43 0.23 0.00 0.00 0.00 0.00 174.94 175.60 1fm1 s ALA 58 N 0.25 3.70 0.10 9.38 0.00 -1.26 -5.03 121.76 128.90 1fm1 s ALA 58 Ca 0.15 -1.80 -0.22 0.00 0.00 0.00 0.00 51.96 50.10 1fm1 s ALA 58 Cb -0.13 -0.90 -0.12 0.00 0.00 0.00 0.00 23.12 21.98 1fm1 s ALA 58 CO 0.03 -0.03 1.75 -0.44 0.00 0.00 0.00 175.76 177.08 1fm1 h ASP 59 N 1.36 0.09 -3.54 0.00 3.32 -1.85 -3.39 116.42 112.41 1fm1 h ASP 59 Ca -0.44 -0.00 -0.67 0.00 0.02 0.00 0.00 57.03 55.94 1fm1 h ASP 59 Cb 1.25 -0.02 -0.36 0.00 0.22 0.00 0.00 39.33 40.42 1fm1 h ASP 59 CO 0.61 0.07 -0.82 -0.63 -1.72 0.00 0.00 179.24 176.74 1fm1 s ILE 60 N -6.18 2.13 -0.13 0.35 1.01 -1.02 -4.49 121.20 112.87 1fm1 s ILE 60 Ca -0.13 -1.35 -0.06 0.00 0.00 0.00 0.00 60.65 59.11 1fm1 s ILE 60 Cb 0.07 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1fm1 s ILE 60 CO 0.67 0.20 0.10 0.00 0.00 0.00 0.00 174.94 175.92 1fm1 s MET 61 N 1.18 3.46 -0.14 2.79 0.23 -1.26 -2.42 119.30 123.15 1fm1 s MET 61 Ca -0.03 -0.21 -0.02 0.00 -1.03 0.00 0.00 55.69 54.39 1fm1 s MET 61 Cb -0.17 -3.13 -0.03 0.00 -1.53 0.00 0.00 34.83 29.97 1fm1 s MET 61 CO -0.08 0.68 -0.06 0.42 -2.03 0.00 0.00 175.02 173.95 1fm1 s ILE 62 N -0.76 3.74 0.11 3.16 1.01 -0.40 -1.97 121.20 126.09 1fm1 s ILE 62 Ca 0.13 -0.42 -0.12 0.00 0.00 0.00 0.00 60.65 60.24 1fm1 s ILE 62 Cb -0.12 -2.61 0.01 0.00 0.01 0.00 0.00 42.46 39.75 1fm1 s ILE 62 CO 0.03 0.52 0.29 -0.94 0.00 0.00 0.00 174.94 174.84 1fm1 s SER 63 N 0.13 -0.04 -0.22 3.58 1.04 -1.01 0.23 113.70 117.41 1fm1 s SER 63 Ca -0.02 -0.53 -0.06 0.00 0.48 0.00 0.00 55.95 55.81 1fm1 s SER 63 Cb -0.14 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.37 1fm1 s SER 63 CO 0.03 -0.81 0.04 -0.36 0.98 0.00 0.00 173.24 173.12 1fm1 s PHE 64 N -3.85 3.07 0.45 5.02 0.08 -1.26 -0.29 117.98 121.20 1fm1 s PHE 64 Ca 0.05 -0.42 0.04 0.00 0.12 0.00 0.00 56.93 56.72 1fm1 s PHE 64 Cb 0.03 -2.16 0.01 0.00 -0.57 0.00 0.00 43.02 40.33 1fm1 s PHE 64 CO -0.10 -0.28 0.63 0.20 -0.10 0.00 0.00 175.22 175.57 1fm1 s GLY 65 N 1.27 1.75 0.56 4.36 0.00 0.46 -4.69 107.32 111.04 1fm1 s GLY 65 Ca 0.04 -1.38 0.05 0.00 0.00 0.00 0.00 44.72 43.43 1fm1 s GLY 65 CO 0.02 -1.19 0.41 -1.50 0.00 0.00 0.00 173.10 170.84 1fm1 s ILE 66 N -2.48 1.50 0.00 0.90 2.07 -1.26 0.30 121.20 122.23 1fm1 s ILE 66 Ca 0.52 -1.50 0.00 0.00 -1.41 0.00 0.00 60.65 58.26 1fm1 s ILE 66 Cb -0.10 -2.00 0.00 0.00 0.13 0.00 0.00 42.46 40.49 1fm1 s ILE 66 CO 0.35 0.00 0.19 1.17 -1.91 0.00 0.00 174.94 174.74 1fm1 n LYS 67 N -1.81 0.00 -0.35 3.50 3.00 -1.26 0.91 118.16 122.14 1fm1 n LYS 67 Ca -0.03 0.19 -0.03 0.00 -0.00 0.00 0.00 58.31 58.44 1fm1 n LYS 67 Cb 0.65 -0.33 0.11 0.00 0.00 0.00 0.00 35.03 35.45 1fm1 n LYS 67 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.40 178.45 1fm1 h GLU 68 N 0.00 1.28 0.00 1.64 4.11 -1.96 -2.96 114.58 116.69 1fm1 h GLU 68 Ca 0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.36 59.32 1fm1 h GLU 68 Cb 0.00 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 28.98 1fm1 h GLU 68 CO 0.00 0.89 0.00 1.58 0.07 0.00 0.00 179.01 181.55 1fm1 n HIS 69 N -4.36 0.00 -4.00 2.06 -0.00 0.26 -4.09 115.22 105.10 1fm1 n HIS 69 Ca 0.11 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.17 1fm1 n HIS 69 Cb 0.05 0.00 -0.12 0.00 -0.12 0.00 0.00 29.99 29.80 1fm1 n HIS 69 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1fm1 s GLY 70 N 0.00 0.26 0.18 1.57 0.00 -1.26 -4.83 107.32 103.25 1fm1 s GLY 70 Ca 0.00 -0.48 -0.09 0.00 0.00 0.00 0.00 44.72 44.15 1fm1 s GLY 70 CO 0.00 -0.51 1.62 -0.55 0.00 0.00 0.00 173.10 173.66 1fm1 h ASP 71 N 5.07 1.06 -0.38 1.64 3.32 -2.01 -2.62 116.42 122.51 1fm1 h ASP 71 Ca -0.31 -0.32 -0.13 0.00 0.02 0.00 0.00 57.03 56.29 1fm1 h ASP 71 Cb 1.21 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 1fm1 h ASP 71 CO 0.44 1.13 -0.27 -0.26 -1.72 0.00 0.00 179.24 178.56 1fm1 h PHE 72 N 0.97 1.03 -2.68 4.55 0.04 -1.96 -3.37 116.94 115.52 1fm1 h PHE 72 Ca 0.16 -0.26 -0.60 0.00 2.80 0.00 0.00 57.97 60.07 1fm1 h PHE 72 Cb 0.61 -0.24 -0.40 0.00 2.20 0.00 0.00 35.95 38.12 1fm1 h PHE 72 CO 0.04 1.05 -0.78 2.48 -0.60 0.00 0.00 178.31 180.51 1fm1 n TYR 73 N -4.09 1.21 -2.73 -0.55 4.11 -1.16 -5.11 117.16 108.83 1fm1 n TYR 73 Ca -0.01 -3.82 -0.35 0.00 -0.00 0.00 0.00 57.90 53.73 1fm1 n TYR 73 Cb 0.48 -0.20 -0.06 0.00 -0.00 0.00 0.00 39.34 39.56 1fm1 n TYR 73 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 1fm1 s PRO 74 N -0.80 4.31 0.66 -3.48 0.04 -1.00 -3.99 135.00 130.74 1fm1 s PRO 74 Ca 0.30 1.28 -0.02 0.00 0.04 0.00 0.00 61.00 62.60 1fm1 s PRO 74 Cb 0.01 -2.46 0.08 0.00 0.04 0.00 0.00 34.50 32.17 1fm1 s PRO 74 CO -0.18 0.03 0.92 -0.06 0.04 0.00 0.00 177.00 177.75 1fm1 s PHE 75 N -1.87 2.44 -2.81 0.56 0.40 -1.12 -5.01 117.98 110.57 1fm1 s PHE 75 Ca 0.57 0.04 0.24 0.00 -0.60 0.00 0.00 56.93 57.18 1fm1 s PHE 75 Cb -0.15 -3.00 0.29 0.00 0.51 0.00 0.00 43.02 40.67 1fm1 s PHE 75 CO 0.20 -1.33 1.32 -0.40 0.70 0.00 0.00 175.22 175.71 1fm1 n ASP 76 N -2.70 3.15 0.00 1.36 5.75 -1.26 -4.82 116.55 118.03 1fm1 n ASP 76 Ca 0.10 -1.99 0.00 0.00 -0.01 0.00 0.00 54.79 52.89 1fm1 n ASP 76 Cb 0.60 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 1fm1 n ASP 76 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fm1 n GLY 77 N 1.41 0.61 0.00 6.12 0.00 -1.26 -4.82 105.19 107.24 1fm1 n GLY 77 Ca 0.16 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1fm1 n GLY 77 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fm1 n PRO 78 N 0.00 0.00 -1.77 1.61 -0.04 -1.26 -4.70 135.00 128.84 1fm1 n PRO 78 Ca 0.00 0.34 -0.29 0.00 -0.04 0.00 0.00 63.50 63.50 1fm1 n PRO 78 Cb 0.00 -1.00 0.15 0.00 -0.04 0.00 0.00 33.50 32.61 1fm1 n PRO 78 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1fm1 s SER 79 N -2.24 3.45 0.00 3.54 1.04 -1.26 -4.85 113.70 113.38 1fm1 s SER 79 Ca 0.00 0.60 0.00 0.00 0.48 0.00 0.00 55.95 57.03 1fm1 s SER 79 Cb 0.00 -0.90 0.00 0.00 0.10 0.00 0.00 66.02 65.22 1fm1 s SER 79 CO 0.00 -2.55 0.00 0.61 0.98 0.00 0.00 173.24 172.28 1fm1 n GLY 80 N -3.09 0.75 3.65 7.32 0.00 -1.26 -4.58 105.19 107.98 1fm1 n GLY 80 Ca 0.11 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 44.16 1fm1 n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fm1 s LEU 81 N 0.00 4.08 0.24 0.99 1.43 -1.26 -4.87 118.68 119.29 1fm1 s LEU 81 Ca 0.00 1.71 0.19 0.00 -1.03 0.00 0.00 54.13 55.00 1fm1 s LEU 81 Cb 0.00 -3.54 0.06 0.00 0.03 0.00 0.00 46.19 42.74 1fm1 s LEU 81 CO 0.00 -0.99 1.23 -0.07 0.23 0.00 0.00 176.35 176.74 1fm1 h LEU 82 N 10.59 0.00 -7.47 1.79 3.38 -1.91 -3.46 115.31 118.23 1fm1 h LEU 82 Ca -0.31 0.00 0.39 0.00 0.09 0.00 0.00 57.88 58.05 1fm1 h LEU 82 Cb 1.13 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.77 1fm1 h LEU 82 CO 0.99 0.28 0.98 0.00 0.09 0.00 0.00 178.44 180.77 1fm1 s ALA 83 N -3.11 -2.60 0.14 1.53 0.00 -1.26 -2.71 121.76 113.75 1fm1 s ALA 83 Ca 0.02 0.56 -0.24 0.00 0.00 0.00 0.00 51.96 52.30 1fm1 s ALA 83 Cb 0.08 0.57 0.07 0.00 0.00 0.00 0.00 23.12 23.83 1fm1 s ALA 83 CO 0.76 -1.11 0.74 -3.38 0.00 0.00 0.00 175.76 172.77 1fm1 s HIS 84 N -2.05 -0.37 0.15 0.00 -3.43 -0.98 -5.03 115.29 103.59 1fm1 s HIS 84 Ca 0.23 0.11 -0.16 0.00 -0.80 0.00 0.00 55.06 54.44 1fm1 s HIS 84 Cb 0.04 0.59 0.03 0.00 -1.43 0.00 0.00 32.58 31.81 1fm1 s HIS 84 CO -0.05 -0.85 0.43 0.00 -2.00 0.00 0.00 174.74 172.28 1fm1 s ALA 85 N -3.56 -0.83 0.10 -1.38 0.00 -1.26 -2.13 121.76 112.70 1fm1 s ALA 85 Ca 0.05 -0.20 0.04 0.00 0.00 0.00 0.00 51.96 51.85 1fm1 s ALA 85 Cb -0.02 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 23.83 1fm1 s ALA 85 CO -0.06 -0.70 0.07 -0.06 0.00 0.00 0.00 175.76 175.01 1fm1 s PHE 86 N -3.85 3.13 0.94 0.00 0.40 -1.21 -5.01 117.98 112.38 1fm1 s PHE 86 Ca 0.07 0.03 -0.11 0.00 -0.60 0.00 0.00 56.93 56.31 1fm1 s PHE 86 Cb 0.01 -1.57 0.16 0.00 0.51 0.00 0.00 43.02 42.12 1fm1 s PHE 86 CO -0.07 0.51 1.09 -1.25 0.70 0.00 0.00 175.22 176.20 1fm1 s PRO 87 N -2.53 0.86 -0.67 0.24 0.04 -1.26 -3.85 135.00 127.84 1fm1 s PRO 87 Ca 0.29 1.00 -0.16 0.00 0.04 0.00 0.00 61.00 62.16 1fm1 s PRO 87 Cb -0.12 -1.75 -0.15 0.00 0.04 0.00 0.00 34.50 32.52 1fm1 s PRO 87 CO 0.21 -2.56 1.75 -2.30 0.04 0.00 0.00 177.00 174.15 1fm1 n PRO 88 N -4.13 0.10 -0.96 0.56 -0.01 -1.26 -3.10 135.00 126.20 1fm1 n PRO 88 Ca 0.07 -0.90 0.00 0.00 -0.01 0.00 0.00 63.50 62.66 1fm1 n PRO 88 Cb 0.54 -2.68 0.00 0.00 -0.01 0.00 0.00 33.50 31.36 1fm1 n PRO 88 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1fm1 n GLY 89 N 5.58 1.88 0.00 -1.23 0.00 -1.26 -4.86 105.19 105.31 1fm1 n GLY 89 Ca 0.29 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 44.19 1fm1 n GLY 89 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1fm1 n PRO 90 N -0.97 2.95 -0.32 1.61 -0.02 -1.26 -3.97 135.00 133.01 1fm1 n PRO 90 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.43 1fm1 n PRO 90 Cb 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 33.50 33.56 1fm1 n PRO 90 CO 0.00 0.00 0.00 -2.95 1.98 0.00 0.00 175.50 174.53 1fm1 h ASN 91 N 0.00 1.13 1.04 2.55 -1.07 -2.00 -1.51 115.58 115.71 1fm1 h ASN 91 Ca 0.00 -0.13 0.00 0.00 0.07 0.00 0.00 56.30 56.24 1fm1 h ASN 91 Cb 0.00 -0.29 0.00 0.00 -2.07 0.00 0.00 38.32 35.96 1fm1 h ASN 91 CO 0.00 0.94 -0.00 0.00 0.07 0.00 0.00 177.43 178.44 1fm1 n TYR 92 N -4.31 0.08 -1.64 4.14 0.18 -1.26 -4.83 117.16 109.52 1fm1 n TYR 92 Ca 0.09 0.02 -0.29 0.00 1.88 0.00 0.00 57.90 59.60 1fm1 n TYR 92 Cb 0.13 -0.54 0.12 0.00 -0.38 0.00 0.00 39.34 38.67 1fm1 n TYR 92 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1fm1 s GLY 93 N -3.05 1.59 -0.35 -7.48 0.00 -0.57 -4.59 107.32 92.87 1fm1 s GLY 93 Ca 0.14 -0.52 -0.07 0.00 0.00 0.00 0.00 44.72 44.27 1fm1 s GLY 93 CO 0.54 0.01 0.42 0.61 0.00 0.00 0.00 173.10 174.67 1fm1 n GLY 94 N -2.50 -1.05 3.38 0.20 0.00 -1.18 -4.59 105.19 99.46 1fm1 n GLY 94 Ca 0.07 0.62 -0.10 0.00 0.00 0.00 0.00 46.02 46.62 1fm1 n GLY 94 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fm1 s ASP 95 N -2.27 -0.07 -0.14 1.61 -4.77 -1.26 -3.95 116.67 105.82 1fm1 s ASP 95 Ca 0.11 -0.69 -0.07 0.00 -3.30 0.00 0.00 52.55 48.60 1fm1 s ASP 95 Cb -0.03 0.48 0.05 0.00 -1.09 0.00 0.00 42.92 42.33 1fm1 s ASP 95 CO 0.51 -0.93 0.33 0.00 0.70 0.00 0.00 175.17 175.77 1fm1 s ALA 96 N -3.92 -0.80 -0.06 2.11 0.00 -0.83 -3.35 121.76 114.92 1fm1 s ALA 96 Ca 0.13 1.25 0.03 0.00 0.00 0.00 0.00 51.96 53.37 1fm1 s ALA 96 Cb 0.02 -0.79 0.01 0.00 0.00 0.00 0.00 23.12 22.35 1fm1 s ALA 96 CO -0.03 -0.25 -0.15 -1.01 0.00 0.00 0.00 175.76 174.33 1fm1 s HIS 97 N 1.37 1.61 0.21 0.00 3.76 -0.90 -2.39 115.29 118.95 1fm1 s HIS 97 Ca -0.09 -0.54 0.08 0.00 -0.15 0.00 0.00 55.06 54.35 1fm1 s HIS 97 Cb -0.10 -1.13 -0.04 0.00 1.11 0.00 0.00 32.58 32.43 1fm1 s HIS 97 CO -0.11 -0.24 0.04 -0.06 -0.85 0.00 0.00 174.74 173.53 1fm1 s PHE 98 N 0.37 2.89 0.00 1.40 0.40 0.60 -2.32 117.98 121.32 1fm1 s PHE 98 Ca -0.10 -0.14 -0.30 0.00 -0.60 0.00 0.00 56.93 55.79 1fm1 s PHE 98 Cb -0.14 -1.35 -0.03 0.00 0.51 0.00 0.00 43.02 42.01 1fm1 s PHE 98 CO 0.03 0.54 0.98 -0.51 0.70 0.00 0.00 175.22 176.96 1fm1 s ASP 99 N -3.27 7.37 0.00 1.36 1.01 -1.10 0.17 116.67 122.21 1fm1 s ASP 99 Ca 0.30 1.66 0.27 0.00 0.71 0.00 0.00 52.55 55.48 1fm1 s ASP 99 Cb -0.08 -2.57 0.86 0.00 1.01 0.00 0.00 42.92 42.13 1fm1 s ASP 99 CO 0.20 -0.25 1.64 -0.67 0.21 0.00 0.00 175.17 176.30 1fm1 n ASP 100 N 3.87 0.64 0.00 0.27 -0.08 0.88 -3.61 116.55 118.52 1fm1 n ASP 100 Ca 0.06 -0.50 0.13 0.00 -1.51 0.00 0.00 54.79 52.97 1fm1 n ASP 100 Cb 0.51 0.06 0.48 0.00 2.34 0.00 0.00 41.12 44.51 1fm1 n ASP 100 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1fm1 n ASP 101 N -1.04 0.20 -4.79 1.67 8.00 -1.26 -4.86 116.55 114.47 1fm1 n ASP 101 Ca 0.10 0.24 -0.23 0.00 0.71 0.00 0.00 54.79 55.61 1fm1 n ASP 101 Cb 0.32 -0.24 0.08 0.00 -0.02 0.00 0.00 41.12 41.26 1fm1 n ASP 101 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1fm1 s GLU 102 N -3.01 1.99 -0.40 -1.24 0.41 -1.24 -4.78 118.70 110.44 1fm1 s GLU 102 Ca 0.13 -0.82 -0.10 0.00 -0.41 0.00 0.00 54.97 53.76 1fm1 s GLU 102 Cb 0.18 -2.33 0.05 0.00 -1.78 0.00 0.00 34.13 30.26 1fm1 s GLU 102 CO 0.59 -1.22 0.24 0.99 -0.49 0.00 0.00 175.26 175.37 1fm1 s THR 103 N -3.08 4.44 -0.22 3.63 2.01 -1.26 -5.05 115.64 116.12 1fm1 s THR 103 Ca 0.63 -1.12 -0.23 0.00 0.31 0.00 0.00 61.69 61.27 1fm1 s THR 103 Cb -0.08 -3.60 -0.01 0.00 0.01 0.00 0.00 72.50 68.82 1fm1 s THR 103 CO 0.43 -0.38 0.75 0.26 -0.69 0.00 0.00 174.62 174.99 1fm1 s TRP 104 N 1.50 3.34 0.05 4.92 0.52 -1.26 -3.80 118.94 124.20 1fm1 s TRP 104 Ca 0.02 1.06 -0.05 0.00 0.02 0.00 0.00 56.10 57.16 1fm1 s TRP 104 Cb -0.21 -2.95 -0.02 0.00 -1.15 0.00 0.00 33.47 29.14 1fm1 s TRP 104 CO 0.05 -0.31 0.07 -0.08 0.02 0.00 0.00 176.95 176.70 1fm1 s THR 105 N 2.46 0.15 -1.48 2.01 -1.32 -1.26 -4.55 115.64 111.66 1fm1 s THR 105 Ca 0.33 -1.25 0.24 0.00 -1.21 0.00 0.00 61.69 59.80 1fm1 s THR 105 Cb -0.16 -1.05 0.01 0.00 -1.51 0.00 0.00 72.50 69.80 1fm1 s THR 105 CO 0.09 -0.69 1.24 -0.24 -2.21 0.00 0.00 174.62 172.81 1fm1 n SER 106 N 0.57 1.18 -4.56 8.08 2.88 -1.26 -3.42 113.62 117.10 1fm1 n SER 106 Ca -0.18 -0.95 -0.24 0.00 -1.33 0.00 0.00 58.87 56.16 1fm1 n SER 106 Cb 0.59 0.47 0.13 0.00 -0.75 0.00 0.00 64.21 64.65 1fm1 n SER 106 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1fm1 s SER 107 N -2.73 4.03 -1.47 -3.46 0.01 -1.26 -4.94 113.70 103.88 1fm1 s SER 107 Ca 0.16 -0.43 -0.14 0.00 1.31 0.00 0.00 55.95 56.85 1fm1 s SER 107 Cb 0.18 0.20 0.02 0.00 0.21 0.00 0.00 66.02 66.62 1fm1 s SER 107 CO 0.66 -2.09 2.32 -1.54 0.41 0.00 0.00 173.24 173.00 1fm1 n SER 108 N -3.00 4.51 -3.90 2.44 3.41 -1.26 -4.77 113.62 111.05 1fm1 n SER 108 Ca 0.17 -2.80 -0.11 0.00 -0.26 0.00 0.00 58.87 55.87 1fm1 n SER 108 Cb 0.61 -1.64 -0.10 0.00 -0.26 0.00 0.00 64.21 62.82 1fm1 n SER 108 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1fm1 s LYS 109 N 3.09 0.41 1.43 4.33 1.02 -1.26 -5.10 119.74 123.67 1fm1 s LYS 109 Ca 0.50 -0.44 0.00 0.00 0.02 0.00 0.00 55.97 56.05 1fm1 s LYS 109 Cb 0.15 0.17 0.00 0.00 -0.52 0.00 0.00 37.83 37.62 1fm1 s LYS 109 CO -0.08 -0.09 0.00 0.41 -0.92 0.00 0.00 175.35 174.67 1fm1 n GLY 110 N 1.57 1.38 3.55 -3.33 0.00 -1.26 -4.11 105.19 102.99 1fm1 n GLY 110 Ca -0.23 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 1fm1 n GLY 110 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fm1 s TYR 111 N 0.00 3.22 0.23 1.61 2.02 -1.25 -5.04 117.35 118.15 1fm1 s TYR 111 Ca 0.00 -0.08 -0.31 0.00 -0.37 0.00 0.00 57.07 56.31 1fm1 s TYR 111 Cb 0.00 -2.43 -0.11 0.00 -0.40 0.00 0.00 41.96 39.02 1fm1 s TYR 111 CO 0.00 -0.28 1.59 1.21 -1.57 0.00 0.00 175.55 176.50 1fm1 s ASN 112 N 1.73 6.48 0.19 2.29 3.84 -1.26 -4.14 114.94 124.08 1fm1 s ASN 112 Ca 0.06 2.80 -0.12 0.00 0.21 0.00 0.00 52.86 55.81 1fm1 s ASN 112 Cb -0.17 -2.61 0.12 0.00 -0.55 0.00 0.00 41.25 38.04 1fm1 s ASN 112 CO 0.11 -0.87 1.86 0.25 -2.79 0.00 0.00 177.10 175.66 1fm1 h LEU 113 N 5.82 0.75 -0.90 3.21 5.85 -1.91 -2.72 115.31 125.41 1fm1 h LEU 113 Ca -0.45 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.26 1fm1 h LEU 113 Cb 1.21 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 1fm1 h LEU 113 CO 0.86 0.54 0.60 0.15 -0.34 0.00 0.00 178.44 180.25 1fm1 h PHE 114 N 0.89 1.13 -0.00 1.25 3.04 -1.89 0.39 116.94 121.74 1fm1 h PHE 114 Ca 0.24 0.03 0.01 0.00 3.98 0.00 0.00 57.97 62.23 1fm1 h PHE 114 Cb -0.10 -0.38 -0.01 0.00 2.56 0.00 0.00 35.95 38.01 1fm1 h PHE 114 CO -0.03 0.71 -0.06 -0.07 -2.02 0.00 0.00 178.31 176.84 1fm1 h LEU 115 N 1.22 -0.16 -0.37 0.59 -0.00 -1.87 0.60 115.31 115.31 1fm1 h LEU 115 Ca 0.33 0.03 -0.16 0.00 -0.00 0.00 0.00 57.88 58.07 1fm1 h LEU 115 Cb -0.14 0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 40.59 1fm1 h LEU 115 CO -0.07 -0.08 -0.41 0.58 -0.00 0.00 0.00 178.44 178.45 1fm1 h VAL 116 N -0.10 1.27 0.21 1.22 2.07 -1.37 -2.48 116.25 117.07 1fm1 h VAL 116 Ca 0.02 -1.59 -0.00 0.00 0.82 0.00 0.00 66.70 65.96 1fm1 h VAL 116 Cb 0.13 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1fm1 h VAL 116 CO -0.06 0.53 -0.14 0.00 0.02 0.00 0.00 177.57 177.92 1fm1 h ALA 117 N 0.75 -0.33 -0.49 1.67 0.00 0.08 -1.33 119.26 119.62 1fm1 h ALA 117 Ca 0.05 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1fm1 h ALA 117 Cb 1.01 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1fm1 h ALA 117 CO 0.10 -0.70 0.32 0.00 0.00 0.00 0.00 179.25 178.98 1fm1 h ALA 118 N 0.43 1.65 0.00 0.00 0.00 -0.91 -2.82 119.26 117.62 1fm1 h ALA 118 Ca -0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1fm1 h ALA 118 Cb 0.30 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1fm1 h ALA 118 CO 0.01 0.32 -0.00 1.25 0.00 0.00 0.00 179.25 180.83 1fm1 h HIS 119 N 0.66 -0.00 -1.01 0.00 6.17 -0.89 -2.47 115.15 117.61 1fm1 h HIS 119 Ca 0.18 -0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.27 1fm1 h HIS 119 Cb -0.08 0.00 -0.05 0.00 2.52 0.00 0.00 27.41 29.81 1fm1 h HIS 119 CO -0.00 0.26 0.67 1.05 0.71 0.00 0.00 177.93 180.62 1fm1 h GLU 120 N -0.27 1.33 -1.01 5.26 4.11 -1.09 -1.49 114.58 121.42 1fm1 h GLU 120 Ca -0.00 -0.08 0.01 0.00 0.07 0.00 0.00 59.36 59.36 1fm1 h GLU 120 Cb 0.27 -0.30 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 1fm1 h GLU 120 CO 0.00 0.88 0.67 0.74 0.07 0.00 0.00 179.01 181.37 1fm1 h PHE 121 N 1.37 1.27 -0.58 2.06 0.04 -1.42 -1.65 116.94 118.03 1fm1 h PHE 121 Ca 0.37 0.03 0.10 0.00 2.80 0.00 0.00 57.97 61.27 1fm1 h PHE 121 Cb -0.16 -0.43 -0.07 0.00 2.20 0.00 0.00 35.95 37.49 1fm1 h PHE 121 CO -0.00 0.80 0.17 0.78 -0.60 0.00 0.00 178.31 179.46 1fm1 h GLY 122 N 1.37 0.77 1.07 -1.45 0.00 -0.79 0.19 103.07 104.23 1fm1 h GLY 122 Ca 0.37 -0.07 -0.08 0.00 0.00 0.00 0.00 47.33 47.54 1fm1 h GLY 122 CO -0.08 -0.05 0.10 0.45 0.00 0.00 0.00 176.54 176.96 1fm1 h HIS 123 N 0.33 1.20 0.00 5.60 3.86 -1.17 -2.12 115.15 122.85 1fm1 h HIS 123 Ca 0.29 -0.17 -0.03 0.00 -1.16 0.00 0.00 60.37 59.31 1fm1 h HIS 123 Cb 0.39 -0.33 -0.00 0.00 1.06 0.00 0.00 27.41 28.53 1fm1 h HIS 123 CO -0.20 1.00 -0.13 0.66 0.86 0.00 0.00 177.93 180.12 1fm1 h SER 124 N 1.05 0.00 0.20 2.45 4.64 -0.21 -1.77 113.55 119.91 1fm1 h SER 124 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1fm1 h SER 124 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1fm1 h SER 124 CO 0.01 0.13 -0.03 0.18 -0.87 0.00 0.00 176.83 176.26 1fm1 n LEU 125 N -3.50 0.29 0.00 5.97 4.77 0.50 -4.70 117.00 120.33 1fm1 n LEU 125 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1fm1 n LEU 125 Cb 0.29 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1fm1 n LEU 125 CO 0.30 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1fm1 n GLY 126 N 1.14 0.75 3.84 -0.72 0.00 -0.66 -4.74 105.19 104.80 1fm1 n GLY 126 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1fm1 n GLY 126 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fm1 s LEU 127 N 0.00 4.09 0.42 0.99 1.43 -0.88 -3.99 118.68 120.75 1fm1 s LEU 127 Ca 0.00 1.38 0.08 0.00 -1.03 0.00 0.00 54.13 54.56 1fm1 s LEU 127 Cb 0.00 -4.09 -0.00 0.00 0.03 0.00 0.00 46.19 42.13 1fm1 s LEU 127 CO 0.00 -0.19 0.49 -0.62 0.23 0.00 0.00 176.35 176.25 1fm1 s ASP 128 N -2.16 5.35 0.28 2.29 -1.08 -1.26 -4.25 116.67 115.85 1fm1 s ASP 128 Ca 0.54 -0.59 -0.30 0.00 -0.52 0.00 0.00 52.55 51.67 1fm1 s ASP 128 Cb -0.11 -0.58 -0.12 0.00 -1.46 0.00 0.00 42.92 40.65 1fm1 s ASP 128 CO 0.17 -0.73 1.55 1.41 0.52 0.00 0.00 175.17 178.09 1fm1 n HIS 129 N -1.72 2.70 -3.80 -5.34 8.25 -1.26 -4.98 115.22 109.07 1fm1 n HIS 129 Ca 0.06 0.30 -0.26 0.00 -0.26 0.00 0.00 57.72 57.56 1fm1 n HIS 129 Cb 0.60 -2.56 -0.03 0.00 1.12 0.00 0.00 29.99 29.12 1fm1 n HIS 129 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1fm1 s SER 130 N 0.43 6.36 0.00 0.41 0.15 -0.98 -4.99 113.70 115.08 1fm1 s SER 130 Ca 0.65 0.29 0.23 0.00 0.70 0.00 0.00 55.95 57.81 1fm1 s SER 130 Cb -0.53 -1.96 0.49 0.00 -1.71 0.00 0.00 66.02 62.31 1fm1 s SER 130 CO 0.49 -0.02 1.43 0.29 1.20 0.00 0.00 173.24 176.64 1fm1 n LYS 131 N -0.71 2.40 -2.98 5.44 5.02 -1.26 -4.28 118.16 121.78 1fm1 n LYS 131 Ca -0.06 -2.12 -0.40 0.00 -2.02 0.00 0.00 58.31 53.70 1fm1 n LYS 131 Cb 0.54 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 34.01 1fm1 n LYS 131 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1fm1 s ASP 132 N -1.44 6.95 0.00 4.39 2.15 -1.26 -4.92 116.67 122.53 1fm1 s ASP 132 Ca 0.38 1.15 0.12 0.00 0.43 0.00 0.00 52.55 54.64 1fm1 s ASP 132 Cb 0.22 -2.42 0.56 0.00 -0.30 0.00 0.00 42.92 40.97 1fm1 s ASP 132 CO 0.31 -0.25 1.37 -0.81 -0.17 0.00 0.00 175.17 175.62 1fm1 n PRO 133 N 4.51 0.05 0.00 4.34 -0.04 -1.26 -1.84 135.00 140.76 1fm1 n PRO 133 Ca 0.01 0.25 0.11 0.00 -0.04 0.00 0.00 63.50 63.84 1fm1 n PRO 133 Cb 0.50 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.53 1fm1 n PRO 133 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fm1 n GLY 134 N -0.22 -0.66 3.77 0.55 0.00 -1.26 -4.90 105.19 102.47 1fm1 n GLY 134 Ca 0.04 -0.53 -0.39 0.00 0.00 0.00 0.00 46.02 45.13 1fm1 n GLY 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fm1 s ALA 135 N -2.75 3.44 0.25 4.61 0.00 -0.76 -4.76 121.76 121.79 1fm1 s ALA 135 Ca 0.15 0.23 -0.06 0.00 0.00 0.00 0.00 51.96 52.28 1fm1 s ALA 135 Cb 0.17 -2.89 0.28 0.00 0.00 0.00 0.00 23.12 20.68 1fm1 s ALA 135 CO 0.69 0.20 1.93 -0.07 0.00 0.00 0.00 175.76 178.51 1fm1 h LEU 136 N 5.09 1.14 -1.55 0.00 3.38 -1.90 -2.30 115.31 119.17 1fm1 h LEU 136 Ca -0.46 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1fm1 h LEU 136 Cb 1.21 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1fm1 h LEU 136 CO 0.68 0.83 0.00 0.23 0.09 0.00 0.00 178.44 180.27 1fm1 n MET 137 N -4.38 0.56 -2.21 1.13 2.81 -1.26 -4.80 117.12 108.97 1fm1 n MET 137 Ca 0.12 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.60 1fm1 n MET 137 Cb 0.01 -1.25 -0.03 0.00 -0.71 0.00 0.00 33.22 31.25 1fm1 n MET 137 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 1fm1 s PHE 138 N -0.21 3.23 -0.30 2.03 5.36 -0.87 -2.33 117.98 124.89 1fm1 s PHE 138 Ca 0.00 1.31 0.20 0.00 -0.96 0.00 0.00 56.93 57.48 1fm1 s PHE 138 Cb 0.00 -3.60 1.04 0.00 -0.34 0.00 0.00 43.02 40.12 1fm1 s PHE 138 CO 0.00 -1.77 1.60 -0.35 -1.46 0.00 0.00 175.22 173.24 1fm1 n PRO 139 N 2.00 0.13 -4.58 10.12 -0.04 -1.26 -4.60 135.00 136.76 1fm1 n PRO 139 Ca 0.04 0.61 -0.34 0.00 -0.04 0.00 0.00 63.50 63.77 1fm1 n PRO 139 Cb 0.43 -1.91 -0.11 0.00 -0.04 0.00 0.00 33.50 31.87 1fm1 n PRO 139 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1fm1 s ILE 140 N -3.48 3.78 -0.04 0.52 1.01 -1.26 -5.08 121.20 116.66 1fm1 s ILE 140 Ca -0.02 -0.44 -0.30 0.00 0.00 0.00 0.00 60.65 59.89 1fm1 s ILE 140 Cb 0.06 -2.56 -0.04 0.00 0.01 0.00 0.00 42.46 39.93 1fm1 s ILE 140 CO 0.19 0.59 1.25 -0.47 0.00 0.00 0.00 174.94 176.50 1fm1 s TYR 141 N -0.71 3.11 0.01 3.97 6.14 -1.26 -5.02 117.35 123.59 1fm1 s TYR 141 Ca 0.11 1.11 0.02 0.00 0.64 0.00 0.00 57.07 58.95 1fm1 s TYR 141 Cb -0.11 -3.49 -0.01 0.00 0.42 0.00 0.00 41.96 38.77 1fm1 s TYR 141 CO 0.02 -1.62 -0.05 -0.08 0.64 0.00 0.00 175.55 174.46 1fm1 s THR 142 N 2.21 0.39 0.29 4.34 -1.32 -1.26 -5.14 115.64 115.15 1fm1 s THR 142 Ca 0.58 -0.44 -0.26 0.00 -1.21 0.00 0.00 61.69 60.35 1fm1 s THR 142 Cb -0.27 -0.37 -0.09 0.00 -1.51 0.00 0.00 72.50 70.26 1fm1 s THR 142 CO 0.23 -0.05 0.92 -0.47 -2.21 0.00 0.00 174.62 173.04 1fm1 s TYR 143 N -0.48 3.76 -0.01 9.09 5.04 -1.26 -5.04 117.35 128.45 1fm1 s TYR 143 Ca -0.02 1.77 0.02 0.00 -2.44 0.00 0.00 57.07 56.40 1fm1 s TYR 143 Cb -0.04 -2.90 -0.00 0.00 0.35 0.00 0.00 41.96 39.37 1fm1 s TYR 143 CO -0.00 0.29 -0.06 0.99 -1.34 0.00 0.00 175.55 175.42 1fm1 s THR 144 N -1.50 0.54 -0.59 4.34 2.01 -1.26 -5.08 115.64 114.10 1fm1 s THR 144 Ca 0.47 -0.27 -0.26 0.00 0.31 0.00 0.00 61.69 61.94 1fm1 s THR 144 Cb -0.20 -0.47 -0.03 0.00 0.01 0.00 0.00 72.50 71.81 1fm1 s THR 144 CO 0.25 0.16 1.96 -0.83 -0.69 0.00 0.00 174.62 175.48 1fm1 s GLY 145 N -0.01 0.08 0.00 4.40 0.00 -1.26 -4.78 107.32 105.74 1fm1 s GLY 145 Ca 0.01 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.19 1fm1 s GLY 145 CO -0.00 3.56 0.47 0.28 0.00 0.00 0.00 173.10 177.40 1fm1 n LYS 146 N 9.16 0.72 -0.13 2.90 4.76 -1.26 -3.95 118.16 130.35 1fm1 n LYS 146 Ca 0.24 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.62 1fm1 n LYS 146 Cb 0.53 -1.26 0.03 0.00 -1.84 0.00 0.00 35.03 32.49 1fm1 n LYS 146 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1fm1 h SER 147 N 0.20 0.29 -0.11 4.39 0.87 -2.04 -3.34 113.55 113.80 1fm1 h SER 147 Ca 0.00 0.02 -0.18 0.00 -1.23 0.00 0.00 61.79 60.40 1fm1 h SER 147 Cb 0.26 -0.03 -0.30 0.00 -0.44 0.00 0.00 62.40 61.89 1fm1 h SER 147 CO 0.00 0.21 -0.77 1.41 -0.53 0.00 0.00 176.83 177.15 1fm1 n HIS 148 N -4.92 -0.01 -1.95 2.24 8.25 -1.25 -5.11 115.22 112.46 1fm1 n HIS 148 Ca 0.02 -1.09 -0.41 0.00 -0.26 0.00 0.00 57.72 55.98 1fm1 n HIS 148 Cb 0.11 0.25 -0.01 0.00 1.12 0.00 0.00 29.99 31.45 1fm1 n HIS 148 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1fm1 s PHE 149 N -0.91 2.86 0.04 4.41 5.36 -1.25 -5.02 117.98 123.47 1fm1 s PHE 149 Ca 0.21 1.15 0.03 0.00 -0.96 0.00 0.00 56.93 57.36 1fm1 s PHE 149 Cb 0.29 -3.87 -0.02 0.00 -0.34 0.00 0.00 43.02 39.08 1fm1 s PHE 149 CO -0.09 -2.64 -0.10 -1.64 -1.46 0.00 0.00 175.22 169.29 1fm1 s MET 150 N -1.33 0.63 0.12 10.12 -1.94 -1.26 -5.07 119.30 120.56 1fm1 s MET 150 Ca 0.55 -0.75 -0.35 0.00 -1.71 0.00 0.00 55.69 53.43 1fm1 s MET 150 Cb -0.43 -0.50 -0.15 0.00 2.01 0.00 0.00 34.83 35.76 1fm1 s MET 150 CO 0.53 0.11 1.54 1.28 -0.01 0.00 0.00 175.02 178.46 1fm1 n LEU 151 N 1.62 2.72 -4.59 -0.03 4.77 -1.26 -4.94 117.00 115.28 1fm1 n LEU 151 Ca -0.21 1.09 -0.30 0.00 -0.03 0.00 0.00 56.01 56.56 1fm1 n LEU 151 Cb 0.55 -1.35 0.24 0.00 -2.33 0.00 0.00 43.42 40.52 1fm1 n LEU 151 CO 0.22 -0.47 0.62 -2.16 -1.33 0.00 0.00 177.39 174.26 1fm1 s PRO 152 N 1.07 -1.13 0.25 3.23 0.04 -1.26 -4.68 135.00 132.51 1fm1 s PRO 152 Ca 0.82 -0.01 -0.06 0.00 0.04 0.00 0.00 61.00 61.79 1fm1 s PRO 152 Cb -0.76 -1.60 0.26 0.00 0.04 0.00 0.00 34.50 32.43 1fm1 s PRO 152 CO 0.42 -3.66 1.92 -0.44 0.04 0.00 0.00 177.00 175.27 1fm1 h ASP 153 N -2.55 1.15 -0.31 6.66 3.32 -1.99 -1.27 116.42 121.44 1fm1 h ASP 153 Ca -0.46 -0.04 0.05 0.00 0.02 0.00 0.00 57.03 56.60 1fm1 h ASP 153 Cb 1.30 -0.29 -0.05 0.00 0.22 0.00 0.00 39.33 40.51 1fm1 h ASP 153 CO 0.36 0.85 0.02 -0.78 -1.72 0.00 0.00 179.24 177.97 1fm1 h ASP 154 N 1.34 -0.08 -0.37 6.45 1.82 -2.00 0.37 116.42 123.96 1fm1 h ASP 154 Ca 0.36 0.06 -0.17 0.00 -0.39 0.00 0.00 57.03 56.90 1fm1 h ASP 154 Cb -0.12 0.11 -0.00 0.00 0.68 0.00 0.00 39.33 39.99 1fm1 h ASP 154 CO -0.07 -0.01 -0.41 0.44 -1.61 0.00 0.00 179.24 177.58 1fm1 h ASP 155 N 0.11 1.01 -0.12 2.28 3.32 -1.83 -2.51 116.42 118.69 1fm1 h ASP 155 Ca 0.15 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.72 1fm1 h ASP 155 Cb 0.18 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1fm1 h ASP 155 CO -0.23 1.28 0.08 0.58 -1.72 0.00 0.00 179.24 179.23 1fm1 h VAL 156 N 0.76 1.03 -1.01 -1.35 2.07 -0.76 0.79 116.25 117.78 1fm1 h VAL 156 Ca 0.05 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.52 1fm1 h VAL 156 Cb 1.01 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.59 1fm1 h VAL 156 CO 0.10 0.03 0.67 1.56 0.02 0.00 0.00 177.57 179.95 1fm1 h GLN 157 N 0.16 1.33 0.19 1.57 4.20 -0.93 -0.90 115.11 120.73 1fm1 h GLN 157 Ca 0.04 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1fm1 h GLN 157 Cb -0.02 -0.30 0.00 0.00 0.30 0.00 0.00 27.48 27.47 1fm1 h GLN 157 CO -0.01 0.88 -0.09 0.78 -0.67 0.00 0.00 178.83 179.72 1fm1 h GLY 158 N 1.37 -0.26 1.01 3.46 0.00 -0.98 -1.28 103.07 106.39 1fm1 h GLY 158 Ca 0.37 0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.81 1fm1 h GLY 158 CO -0.08 -0.09 0.66 1.19 0.00 0.00 0.00 176.54 178.22 1fm1 h ILE 159 N -0.85 1.26 -0.59 2.60 6.09 -0.85 -1.99 117.51 123.18 1fm1 h ILE 159 Ca -0.03 -0.46 -0.11 0.00 -1.37 0.00 0.00 64.86 62.89 1fm1 h ILE 159 Cb 0.52 -0.22 -0.02 0.00 0.47 0.00 0.00 36.82 37.57 1fm1 h ILE 159 CO 0.04 0.25 -0.05 1.56 -3.07 0.00 0.00 178.15 176.88 1fm1 h GLN 160 N 1.35 1.07 -0.10 2.19 4.20 -1.22 -1.32 115.11 121.28 1fm1 h GLN 160 Ca 0.37 -0.36 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1fm1 h GLN 160 Cb -0.16 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.53 1fm1 h GLN 160 CO -0.08 1.06 -0.01 0.66 -0.67 0.00 0.00 178.83 179.79 1fm1 h SER 161 N 0.96 0.13 0.00 1.46 4.64 -0.50 2.54 113.55 122.77 1fm1 h SER 161 Ca 0.16 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.33 1fm1 h SER 161 Cb 0.61 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.65 1fm1 h SER 161 CO 0.04 0.17 -0.80 -0.07 -0.87 0.00 0.00 176.83 175.29 1fm1 h LEU 162 N 0.14 0.00 -0.09 5.97 3.38 -1.14 -3.37 115.31 120.21 1fm1 h LEU 162 Ca 0.04 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1fm1 h LEU 162 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1fm1 h LEU 162 CO 0.00 1.25 -0.50 -1.22 0.09 0.00 0.00 178.44 178.07 1fm1 n TYR 163 N -4.51 0.00 -0.45 1.13 4.02 -0.52 -5.05 117.16 111.78 1fm1 n TYR 163 Ca -0.23 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.66 1fm1 n TYR 163 Cb 0.56 -0.21 0.00 0.00 -0.02 0.00 0.00 39.34 39.67 1fm1 n TYR 163 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26