#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fad n ALA 90 N 0.00 -3.63 -1.61 0.00 0.00 -1.26 -4.79 120.51 109.23 1fad n ALA 90 Ca 0.00 -1.37 -0.43 0.00 0.00 0.00 0.00 53.44 51.64 1fad n ALA 90 Cb 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 19.45 19.31 1fad n ALA 90 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1fad n PRO 91 N -4.77 2.08 -0.04 0.00 -0.04 -1.26 -4.85 135.00 126.12 1fad n PRO 91 Ca 0.13 0.60 -0.10 0.00 -0.04 0.00 0.00 63.50 64.08 1fad n PRO 91 Cb 0.51 -3.21 -0.04 0.00 -0.04 0.00 0.00 33.50 30.72 1fad n PRO 91 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1fad h PRO 92 N 14.52 0.25 -2.46 0.54 0.13 -1.90 -2.77 132.00 140.32 1fad h PRO 92 Ca -0.42 -0.03 -0.61 0.00 -0.87 0.00 0.00 66.00 64.07 1fad h PRO 92 Cb 1.24 -0.05 -0.11 0.00 0.13 0.00 0.00 31.00 32.21 1fad h PRO 92 CO 0.96 0.24 1.86 0.41 -0.23 0.00 0.00 178.00 181.24 1fad n GLY 93 N -0.96 4.62 0.35 1.56 0.00 -1.26 -4.65 105.19 104.85 1fad n GLY 93 Ca -0.04 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.15 1fad n GLY 93 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1fad h GLU 94 N 4.10 1.01 -0.28 1.61 4.81 -1.88 -1.62 114.58 122.32 1fad h GLU 94 Ca 0.60 -0.07 0.08 0.00 -0.13 0.00 0.00 59.36 59.84 1fad h GLU 94 Cb 0.53 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1fad h GLU 94 CO 1.25 0.68 0.20 0.00 -0.73 0.00 0.00 179.01 180.41 1fad h ALA 95 N 1.50 2.26 0.37 2.92 0.00 -1.89 0.73 119.26 125.15 1fad h ALA 95 Ca 0.28 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1fad h ALA 95 Cb -0.10 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1fad h ALA 95 CO -0.06 -0.34 -0.18 -0.92 0.00 0.00 0.00 179.25 177.75 1fad h TYR 96 N 0.00 -0.46 0.00 0.00 3.20 -1.68 -2.11 116.97 115.92 1fad h TYR 96 Ca 0.13 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 1fad h TYR 96 Cb 0.53 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.95 1fad h TYR 96 CO 0.00 -0.29 -0.13 1.37 -1.64 0.00 0.00 178.16 177.47 1fad h LEU 97 N -1.00 0.00 -0.49 2.82 8.10 -1.50 -2.13 115.31 121.11 1fad h LEU 97 Ca -0.05 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.89 1fad h LEU 97 Cb 0.38 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.58 1fad h LEU 97 CO 0.08 0.13 0.11 -0.61 -4.11 0.00 0.00 178.44 174.04 1fad h GLN 98 N 0.00 0.80 -0.17 0.17 4.15 0.45 1.06 115.11 121.57 1fad h GLN 98 Ca -0.00 -0.20 -0.01 0.00 0.77 0.00 0.00 58.65 59.21 1fad h GLN 98 Cb 0.27 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 1fad h GLN 98 CO 0.02 0.78 0.08 0.28 -1.93 0.00 0.00 178.83 178.05 1fad h VAL 99 N 0.68 1.13 -0.12 2.39 2.07 -0.73 -0.79 116.25 120.88 1fad h VAL 99 Ca 0.15 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 1fad h VAL 99 Cb 0.35 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1fad h VAL 99 CO 0.00 0.12 0.05 0.00 0.02 0.00 0.00 177.57 177.77 1fad h ALA 100 N 0.94 0.16 0.00 1.67 0.00 -1.26 -1.72 119.26 119.05 1fad h ALA 100 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1fad h ALA 100 Cb 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1fad h ALA 100 CO -0.01 -0.25 0.18 0.74 0.00 0.00 0.00 179.25 179.91 1fad h PHE 101 N 0.04 0.00 0.00 0.00 -1.00 0.14 -1.82 116.94 114.30 1fad h PHE 101 Ca 0.04 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.77 1fad h PHE 101 Cb 0.17 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.72 1fad h PHE 101 CO -0.02 0.00 -0.31 0.22 -1.61 0.00 0.00 178.31 176.59 1fad h ASP 102 N 0.00 0.00 -0.64 2.17 3.58 -0.22 -2.27 116.42 119.04 1fad h ASP 102 Ca 0.00 -0.52 -0.01 0.00 0.42 0.00 0.00 57.03 56.92 1fad h ASP 102 Cb 0.37 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.39 1fad h ASP 102 CO 0.00 0.94 0.37 0.16 -2.88 0.00 0.00 179.24 177.82 1fad h ILE 103 N -1.00 1.20 -0.44 2.25 3.07 -1.21 -1.01 117.51 120.37 1fad h ILE 103 Ca -0.07 -0.47 -0.14 0.00 1.55 0.00 0.00 64.86 65.73 1fad h ILE 103 Cb 0.74 0.35 -0.01 0.00 -0.27 0.00 0.00 36.82 37.62 1fad h ILE 103 CO -0.04 0.21 -0.27 -0.37 -1.05 0.00 0.00 178.15 176.63 1fad h VAL 104 N 0.87 1.27 -0.08 0.16 -1.51 -1.50 -2.43 116.25 113.04 1fad h VAL 104 Ca 0.23 -1.44 -0.00 0.00 -1.23 0.00 0.00 66.70 64.26 1fad h VAL 104 Cb 0.02 1.23 -0.00 0.00 -2.13 0.00 0.00 31.29 30.40 1fad h VAL 104 CO -0.04 0.49 0.04 0.00 -1.23 0.00 0.00 177.57 176.83 1fad n ASP 106 N -4.98 0.63 -0.02 0.00 8.00 -0.41 0.12 116.55 119.89 1fad n ASP 106 Ca -0.06 0.71 -0.22 0.00 0.71 0.00 0.00 54.79 55.93 1fad n ASP 106 Cb 0.08 -0.82 -0.13 0.00 -0.02 0.00 0.00 41.12 40.23 1fad n ASP 106 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1fad n ASN 107 N -2.25 2.06 -2.53 -2.24 5.15 -0.34 -4.77 115.26 110.34 1fad n ASN 107 Ca 0.01 0.27 -0.02 0.00 -0.60 0.00 0.00 54.58 54.23 1fad n ASN 107 Cb 0.15 -0.89 0.11 0.00 -0.53 0.00 0.00 39.78 38.62 1fad n ASN 107 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 1fad n VAL 108 N -3.74 0.00 -0.52 3.44 3.14 0.73 -4.99 118.33 116.39 1fad n VAL 108 Ca -0.32 -0.92 0.43 0.00 -2.96 0.00 0.00 64.34 60.57 1fad n VAL 108 Cb 0.95 0.96 0.71 0.00 -1.06 0.00 0.00 33.84 35.40 1fad n VAL 108 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1fad h GLY 109 N 0.92 1.14 2.00 7.55 0.00 0.98 0.80 103.07 116.46 1fad h GLY 109 Ca -0.46 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 1fad h GLY 109 CO -0.20 -0.40 -0.01 3.21 0.00 0.00 0.00 176.54 179.14 1fad h ARG 110 N 0.00 0.00 0.00 4.80 2.47 -1.89 -0.29 114.38 119.47 1fad h ARG 110 Ca 0.90 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.61 1fad h ARG 110 Cb 3.03 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 31.35 1fad h ARG 110 CO -0.39 0.01 -0.05 -0.44 0.56 0.00 0.00 179.97 179.67 1fad h ASP 111 N 0.00 0.00 0.51 7.04 5.19 0.25 -0.48 116.42 128.92 1fad h ASP 111 Ca -0.00 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.31 1fad h ASP 111 Cb 0.05 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.54 1fad h ASP 111 CO 0.00 0.05 -0.48 -0.50 -3.12 0.00 0.00 179.24 175.19 1fad h TRP 112 N 0.00 0.00 -0.65 4.55 -0.00 -1.20 -0.24 115.95 118.41 1fad h TRP 112 Ca -0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 58.89 58.80 1fad h TRP 112 Cb 0.29 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.43 1fad h TRP 112 CO 0.00 0.48 0.06 0.87 -0.00 0.00 0.00 178.44 179.85 1fad h LYS 113 N 0.00 1.11 0.11 0.49 1.57 -1.21 1.39 116.57 120.03 1fad h LYS 113 Ca -0.00 -0.32 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 1fad h LYS 113 Cb 0.86 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1fad h LYS 113 CO 0.06 1.04 -0.05 -0.09 -0.57 0.00 0.00 179.45 179.84 1fad h ARG 114 N 1.02 -0.15 0.00 3.15 2.43 -1.32 -2.67 114.38 116.85 1fad h ARG 114 Ca 0.19 0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.29 1fad h ARG 114 Cb 0.50 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 1fad h ARG 114 CO 0.02 0.11 -0.39 -0.07 -1.51 0.00 0.00 179.97 178.13 1fad h LEU 115 N -0.40 0.00 -0.49 3.80 3.38 -0.88 -2.93 115.31 117.79 1fad h LEU 115 Ca -0.02 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1fad h LEU 115 Cb 0.33 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1fad h LEU 115 CO 0.03 0.39 0.32 0.00 0.09 0.00 0.00 178.44 179.27 1fad h ALA 116 N 1.61 0.62 -0.92 1.53 0.00 0.21 0.39 119.26 122.69 1fad h ALA 116 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1fad h ALA 116 Cb 0.82 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1fad h ALA 116 CO 0.05 0.05 0.55 0.00 0.00 0.00 0.00 179.25 179.90 1fad h ARG 117 N 0.65 1.26 -0.57 0.00 3.08 -1.30 -0.76 114.38 116.73 1fad h ARG 117 Ca 0.18 -0.12 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 1fad h ARG 117 Cb -0.06 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 29.70 1fad h ARG 117 CO -0.05 0.89 0.11 0.93 -1.07 0.00 0.00 179.97 180.78 1fad h GLU 118 N 1.27 0.91 0.00 0.04 5.08 -1.12 -1.12 114.58 119.63 1fad h GLU 118 Ca 0.33 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1fad h GLU 118 Cb -0.04 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.09 1fad h GLU 118 CO -0.06 0.83 0.00 1.28 -1.00 0.00 0.00 179.01 180.06 1fad n LEU 119 N -4.25 0.00 -3.46 1.33 4.77 0.13 -4.89 117.00 110.62 1fad n LEU 119 Ca 0.04 0.25 -0.18 0.00 -0.03 0.00 0.00 56.01 56.09 1fad n LEU 119 Cb 0.25 -0.25 0.08 0.00 -2.33 0.00 0.00 43.42 41.18 1fad n LEU 119 CO 0.41 -0.07 0.09 0.29 -1.33 0.00 0.00 177.39 176.78 1fad n LYS 120 N -1.25 -6.32 -2.20 3.23 5.02 -0.43 -4.96 118.16 111.25 1fad n LYS 120 Ca 0.11 0.82 -0.34 0.00 -2.02 0.00 0.00 58.31 56.89 1fad n LYS 120 Cb 0.16 -5.78 0.00 0.00 -0.02 0.00 0.00 35.03 29.40 1fad n LYS 120 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1fad s VAL 121 N -3.40 3.58 0.12 -0.18 -7.23 -1.06 -4.92 120.40 107.31 1fad s VAL 121 Ca 0.01 0.87 -0.34 0.00 -1.81 0.00 0.00 61.98 60.70 1fad s VAL 121 Cb -0.00 -3.34 -0.14 0.00 0.56 0.00 0.00 36.38 33.46 1fad s VAL 121 CO 0.74 -0.33 1.58 -0.24 -0.31 0.00 0.00 175.10 176.55 1fad n SER 122 N -1.60 2.95 0.26 4.85 2.88 -1.26 -4.82 113.62 116.89 1fad n SER 122 Ca 0.10 1.08 0.17 0.00 -1.33 0.00 0.00 58.87 58.88 1fad n SER 122 Cb 0.52 -1.39 0.92 0.00 -0.75 0.00 0.00 64.21 63.51 1fad n SER 122 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1fad h GLU 123 N 6.13 0.00 0.22 -1.46 4.81 -1.99 -2.59 114.58 119.69 1fad h GLU 123 Ca -0.46 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 58.78 1fad h GLU 123 Cb 1.27 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.62 1fad h GLU 123 CO 0.88 0.00 -0.26 0.00 -0.73 0.00 0.00 179.01 178.90 1fad h ALA 124 N 1.85 -0.51 -0.36 2.92 0.00 -1.99 0.72 119.26 121.89 1fad h ALA 124 Ca 0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1fad h ALA 124 Cb 0.27 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1fad h ALA 124 CO -0.00 -0.82 0.17 0.87 0.00 0.00 0.00 179.25 179.46 1fad h LYS 125 N -0.53 0.53 -0.98 0.00 6.56 -1.84 -2.24 116.57 118.07 1fad h LYS 125 Ca 0.00 -0.08 0.01 0.00 -1.06 0.00 0.00 60.65 59.52 1fad h LYS 125 Cb 0.51 -0.09 -0.05 0.00 -0.57 0.00 0.00 32.23 32.02 1fad h LYS 125 CO -0.09 0.49 0.65 0.52 -2.06 0.00 0.00 179.45 178.96 1fad h MET 126 N 0.45 1.28 -0.58 3.15 2.86 -1.40 0.14 114.93 120.82 1fad h MET 126 Ca 0.12 -0.08 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 1fad h MET 126 Cb 0.14 -0.29 -0.03 0.00 0.06 0.00 0.00 31.60 31.48 1fad h MET 126 CO -0.01 0.85 0.37 0.22 1.06 0.00 0.00 176.91 179.39 1fad h ASP 127 N 1.32 0.62 0.26 1.22 1.82 0.91 -2.65 116.42 119.91 1fad h ASP 127 Ca 0.36 -0.01 -0.23 0.00 -0.39 0.00 0.00 57.03 56.76 1fad h ASP 127 Cb -0.14 -0.14 0.01 0.00 0.68 0.00 0.00 39.33 39.73 1fad h ASP 127 CO -0.08 0.44 -0.95 1.23 -1.61 0.00 0.00 179.24 178.27 1fad h GLY 128 N 0.74 0.53 0.27 -0.78 0.00 -0.85 -2.59 103.07 100.40 1fad h GLY 128 Ca 0.22 -0.92 -0.00 0.00 0.00 0.00 0.00 47.33 46.63 1fad h GLY 128 CO -0.07 0.81 -0.34 -2.22 0.00 0.00 0.00 176.54 174.72 1fad h ILE 129 N 0.27 0.00 -0.53 2.60 2.04 -0.45 0.33 117.51 121.78 1fad h ILE 129 Ca -0.09 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 1fad h ILE 129 Cb 1.59 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1fad h ILE 129 CO 0.17 0.00 0.18 -0.08 0.00 0.00 0.00 178.15 178.42 1fad h GLU 130 N -0.63 0.81 0.44 2.37 4.81 -1.61 -1.66 114.58 119.11 1fad h GLU 130 Ca -0.03 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 59.01 1fad h GLU 130 Cb 0.56 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1fad h GLU 130 CO -0.08 0.73 -0.21 1.49 -0.73 0.00 0.00 179.01 180.21 1fad h GLU 131 N 0.72 -0.57 -0.47 1.92 4.22 -1.33 -3.33 114.58 115.73 1fad h GLU 131 Ca 0.17 0.04 -0.13 0.00 0.08 0.00 0.00 59.36 59.52 1fad h GLU 131 Cb 0.25 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1fad h GLU 131 CO -0.01 -0.27 -0.24 0.87 -2.18 0.00 0.00 179.01 177.19 1fad h LYS 132 N -0.98 0.98 -4.72 1.92 1.57 -0.43 -3.41 116.57 111.50 1fad h LYS 132 Ca -0.06 -0.43 -0.68 0.00 -1.87 0.00 0.00 60.65 57.61 1fad h LYS 132 Cb 0.57 -0.03 -0.23 0.00 0.08 0.00 0.00 32.23 32.62 1fad h LYS 132 CO 0.10 1.10 -0.54 0.71 -0.57 0.00 0.00 179.45 180.25 1fad s TYR 133 N -4.64 3.20 -0.23 -1.35 2.02 -0.62 -4.94 117.35 110.79 1fad s TYR 133 Ca -0.11 -0.69 0.21 0.00 -0.37 0.00 0.00 57.07 56.11 1fad s TYR 133 Cb 0.12 -2.38 0.01 0.00 -0.40 0.00 0.00 41.96 39.31 1fad s TYR 133 CO 0.87 -0.51 1.07 -1.00 -1.57 0.00 0.00 175.55 174.41 1fad h PRO 134 N 8.38 0.00 0.00 -1.71 0.13 -1.80 -3.40 132.00 133.59 1fad h PRO 134 Ca -0.30 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1fad h PRO 134 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 1fad h PRO 134 CO 0.63 0.09 -0.13 -2.13 -0.23 0.00 0.00 178.00 176.23 1fad n ARG 135 N -2.80 0.00 -3.22 0.86 3.00 -1.26 -5.07 116.66 108.16 1fad n ARG 135 Ca -0.02 -0.26 -0.43 0.00 -0.00 0.00 0.00 57.85 57.14 1fad n ARG 135 Cb 0.62 -0.11 -0.07 0.00 0.00 0.00 0.00 32.46 32.90 1fad n ARG 135 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1fad s SER 136 N -0.26 6.23 0.16 6.15 0.01 -1.26 -4.92 113.70 119.80 1fad s SER 136 Ca 0.00 -0.76 -0.15 0.00 1.31 0.00 0.00 55.95 56.36 1fad s SER 136 Cb 0.00 -2.26 0.04 0.00 0.21 0.00 0.00 66.02 64.01 1fad s SER 136 CO -0.00 -0.74 1.77 0.25 0.41 0.00 0.00 173.24 174.93 1fad h LEU 137 N 9.40 0.59 -0.24 2.44 5.85 -1.97 -2.42 115.31 128.95 1fad h LEU 137 Ca -0.27 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.35 1fad h LEU 137 Cb 1.10 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 1fad h LEU 137 CO 0.88 0.50 0.07 -1.28 -0.34 0.00 0.00 178.44 178.27 1fad h SER 138 N 0.63 0.36 -0.71 1.25 0.87 -1.93 -2.85 113.55 111.18 1fad h SER 138 Ca 0.17 -0.22 -0.06 0.00 -1.23 0.00 0.00 61.79 60.46 1fad h SER 138 Cb 0.03 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 1fad h SER 138 CO -0.03 0.48 0.22 -0.33 -0.53 0.00 0.00 176.83 176.65 1fad h GLU 139 N 0.22 1.11 0.21 2.24 4.39 -1.94 -2.26 114.58 118.55 1fad h GLU 139 Ca 0.08 -0.24 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 1fad h GLU 139 Cb 0.26 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1fad h GLU 139 CO -0.00 0.95 -0.10 0.00 -1.16 0.00 0.00 179.01 178.70 1fad h ARG 140 N 1.05 -0.27 -0.53 2.33 3.08 -1.46 -3.33 114.38 115.26 1fad h ARG 140 Ca 0.23 0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.20 1fad h ARG 140 Cb 0.31 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1fad h ARG 140 CO -0.01 0.12 -0.06 -0.39 -1.07 0.00 0.00 179.97 178.57 1fad h VAL 141 N -0.82 1.27 -0.68 2.04 -1.51 -1.57 -3.21 116.25 111.77 1fad h VAL 141 Ca -0.03 -1.19 0.12 0.00 -1.23 0.00 0.00 66.70 64.38 1fad h VAL 141 Cb 0.51 0.97 -0.09 0.00 -2.13 0.00 0.00 31.29 30.56 1fad h VAL 141 CO 0.05 0.42 0.24 0.03 -1.23 0.00 0.00 177.57 177.08 1fad h ARG 142 N 0.84 0.39 0.01 5.19 2.47 -1.54 0.78 114.38 122.52 1fad h ARG 142 Ca 0.14 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.84 1fad h ARG 142 Cb 0.61 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.84 1fad h ARG 142 CO 0.04 0.26 -0.01 1.49 0.56 0.00 0.00 179.97 182.31 1fad h GLU 143 N 0.40 -0.01 -0.89 0.04 4.57 -1.66 0.28 114.58 117.29 1fad h GLU 143 Ca 0.36 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.53 1fad h GLU 143 Cb 0.51 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.06 1fad h GLU 143 CO -0.37 0.12 0.51 0.66 -1.18 0.00 0.00 179.01 178.75 1fad h SER 144 N -0.15 1.10 0.16 1.04 4.64 -1.33 -1.74 113.55 117.27 1fad h SER 144 Ca -0.00 -0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 61.14 1fad h SER 144 Cb 0.14 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 1fad h SER 144 CO 0.00 0.86 -0.34 -0.07 -0.87 0.00 0.00 176.83 176.42 1fad h LEU 145 N 1.24 0.26 0.13 5.97 4.07 0.88 -2.28 115.31 125.59 1fad h LEU 145 Ca 0.32 -0.10 -0.00 0.00 0.08 0.00 0.00 57.88 58.18 1fad h LEU 145 Cb -0.01 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 41.66 1fad h LEU 145 CO -0.06 0.59 -0.07 0.50 -1.08 0.00 0.00 178.44 178.33 1fad h LYS 146 N 0.23 -0.18 -0.36 1.13 3.64 0.48 0.19 116.57 121.70 1fad h LYS 146 Ca 0.03 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 1fad h LYS 146 Cb 0.71 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1fad h LYS 146 CO 0.05 -0.12 -0.23 -0.39 -2.27 0.00 0.00 179.45 176.49 1fad h VAL 147 N -0.18 1.29 0.20 2.00 -1.51 -1.48 -0.75 116.25 115.80 1fad h VAL 147 Ca -0.01 -1.38 -0.01 0.00 -1.23 0.00 0.00 66.70 64.07 1fad h VAL 147 Cb 0.15 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 1fad h VAL 147 CO 0.02 0.45 -0.09 -0.25 -1.23 0.00 0.00 177.57 176.47 1fad h TRP 148 N 0.59 -0.24 -0.68 5.19 7.01 -1.28 0.47 115.95 127.01 1fad h TRP 148 Ca 0.07 -0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.03 1fad h TRP 148 Cb 0.79 0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.90 1fad h TRP 148 CO 0.06 -0.11 0.29 1.57 -2.79 0.00 0.00 178.44 177.46 1fad h LYS 149 N -0.31 1.01 -0.73 2.65 2.10 -0.63 -0.05 116.57 120.60 1fad h LYS 149 Ca -0.03 -0.17 -0.01 0.00 -2.00 0.00 0.00 60.65 58.44 1fad h LYS 149 Cb 0.24 -0.17 -0.03 0.00 -0.90 0.00 0.00 32.23 31.37 1fad h LYS 149 CO 0.04 0.82 0.41 -0.97 -2.00 0.00 0.00 179.45 177.76 1fad h ASN 150 N 0.96 0.90 -0.17 7.07 -0.00 -0.94 -2.73 115.58 120.66 1fad h ASN 150 Ca 0.23 -0.09 -0.03 0.00 -0.00 0.00 0.00 56.30 56.41 1fad h ASN 150 Cb 0.18 -0.23 -0.01 0.00 -0.00 0.00 0.00 38.32 38.26 1fad h ASN 150 CO -0.02 0.73 -0.02 0.00 -0.00 0.00 0.00 177.43 178.12 1fad h ALA 151 N 1.21 0.24 -2.64 1.57 0.00 -0.58 -3.41 119.26 115.65 1fad h ALA 151 Ca 0.26 -0.22 -0.50 0.00 0.00 0.00 0.00 54.91 54.45 1fad h ALA 151 Cb 0.01 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 17.78 1fad h ALA 151 CO -0.04 -0.03 0.46 -1.21 0.00 0.00 0.00 179.25 178.43 1fad s GLU 152 N -4.87 4.14 0.00 0.00 0.41 -0.06 -5.00 118.70 113.31 1fad s GLU 152 Ca -0.14 1.69 0.00 0.00 -0.41 0.00 0.00 54.97 56.11 1fad s GLU 152 Cb 0.06 -2.65 0.00 0.00 -1.78 0.00 0.00 34.13 29.76 1fad s GLU 152 CO 0.73 -0.21 0.00 0.36 -0.49 0.00 0.00 175.26 175.65 1fad n LYS 153 N 0.08 0.00 0.20 1.61 2.85 -1.26 -4.31 118.16 117.32 1fad n LYS 153 Ca 0.04 0.00 0.04 0.00 -1.05 0.00 0.00 58.31 57.34 1fad n LYS 153 Cb 0.48 0.00 0.40 0.00 -0.65 0.00 0.00 35.03 35.26 1fad n LYS 153 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 1fad h LYS 154 N 0.00 0.00 0.00 -1.58 2.10 -1.96 -1.99 116.57 113.13 1fad h LYS 154 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1fad h LYS 154 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1fad h LYS 154 CO 0.00 0.34 0.00 0.09 -2.00 0.00 0.00 179.45 177.88 1fad n ASN 155 N -4.01 0.47 0.13 7.07 5.03 -1.26 -2.85 115.26 119.83 1fad n ASN 155 Ca -0.02 0.58 0.10 0.00 0.87 0.00 0.00 54.58 56.11 1fad n ASN 155 Cb 0.39 -0.69 0.49 0.00 -1.02 0.00 0.00 39.78 38.95 1fad n ASN 155 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1fad n ALA 156 N -1.68 1.34 -1.93 5.41 0.00 -0.75 -3.77 120.51 119.14 1fad n ALA 156 Ca 0.04 0.12 -0.28 0.00 0.00 0.00 0.00 53.44 53.32 1fad n ALA 156 Cb 0.30 -1.32 0.14 0.00 0.00 0.00 0.00 19.45 18.57 1fad n ALA 156 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1fad s SER 157 N -3.99 3.78 0.13 0.00 1.04 -1.13 -4.56 113.70 108.96 1fad s SER 157 Ca 0.01 0.31 -0.18 0.00 0.48 0.00 0.00 55.95 56.57 1fad s SER 157 Cb 0.07 -0.57 -0.04 0.00 0.10 0.00 0.00 66.02 65.58 1fad s SER 157 CO 0.27 -2.30 1.78 -0.37 0.98 0.00 0.00 173.24 173.60 1fad h VAL 158 N -1.24 1.08 -1.19 5.02 -1.51 -1.90 -2.17 116.25 114.34 1fad h VAL 158 Ca -0.44 -0.15 0.34 0.00 -1.23 0.00 0.00 66.70 65.23 1fad h VAL 158 Cb 1.27 0.69 -0.09 0.00 -2.13 0.00 0.00 31.29 31.02 1fad h VAL 158 CO 0.47 0.07 0.80 0.00 -1.23 0.00 0.00 177.57 177.68 1fad h ALA 159 N 1.09 2.65 0.37 5.19 0.00 -1.91 0.97 119.26 127.63 1fad h ALA 159 Ca 0.10 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1fad h ALA 159 Cb -0.03 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1fad h ALA 159 CO -0.02 -1.11 -0.18 0.78 0.00 0.00 0.00 179.25 178.72 1fad h GLY 160 N 0.20 -0.52 0.89 0.00 0.00 -1.52 -2.80 103.07 99.32 1fad h GLY 160 Ca 0.66 0.19 -0.03 0.00 0.00 0.00 0.00 47.33 48.15 1fad h GLY 160 CO -0.25 -0.19 -0.34 -2.00 0.00 0.00 0.00 176.54 173.76 1fad h LEU 161 N -0.76 -0.81 -0.92 3.11 5.85 -0.90 -2.76 115.31 118.12 1fad h LEU 161 Ca -0.05 0.00 0.23 0.00 0.84 0.00 0.00 57.88 58.90 1fad h LEU 161 Cb 0.38 0.21 -0.13 0.00 0.37 0.00 0.00 40.66 41.49 1fad h LEU 161 CO 0.08 -0.50 0.43 -0.37 -0.34 0.00 0.00 178.44 177.74 1fad h VAL 162 N -1.08 0.46 -0.30 1.05 -1.51 0.75 0.77 116.25 116.40 1fad h VAL 162 Ca -0.10 -0.14 0.01 0.00 -1.23 0.00 0.00 66.70 65.24 1fad h VAL 162 Cb 0.76 0.01 -0.02 0.00 -2.13 0.00 0.00 31.29 29.91 1fad h VAL 162 CO 0.16 0.08 0.19 0.50 -1.23 0.00 0.00 177.57 177.27 1fad h LYS 163 N 0.41 0.38 -0.63 5.19 3.64 -1.47 -2.47 116.57 121.62 1fad h LYS 163 Ca 0.59 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.86 1fad h LYS 163 Cb 1.13 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.84 1fad h LYS 163 CO -0.53 0.25 0.08 0.00 -2.27 0.00 0.00 179.45 176.98 1fad h ALA 164 N 1.12 0.96 0.78 5.00 0.00 0.51 -2.10 119.26 125.53 1fad h ALA 164 Ca 0.11 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1fad h ALA 164 Cb -0.03 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.52 1fad h ALA 164 CO -0.03 0.65 -0.39 -0.07 0.00 0.00 0.00 179.25 179.41 1fad h LEU 165 N 0.97 -0.93 -1.46 0.00 3.38 0.65 1.20 115.31 119.12 1fad h LEU 165 Ca 0.19 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 1fad h LEU 165 Cb 0.44 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1fad h LEU 165 CO 0.01 -0.65 -0.06 -0.09 0.09 0.00 0.00 178.44 177.75 1fad h ARG 166 N -1.07 0.28 -0.11 1.13 2.43 -1.58 0.71 114.38 116.17 1fad h ARG 166 Ca -0.11 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 58.82 1fad h ARG 166 Cb 0.82 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1fad h ARG 166 CO 0.17 0.36 -0.72 1.15 -1.51 0.00 0.00 179.97 179.42 1fad h THR 167 N 0.27 1.35 -0.45 0.20 2.02 -1.20 -3.13 112.91 111.97 1fad h THR 167 Ca 0.06 -2.06 0.00 0.00 0.77 0.00 0.00 66.41 65.18 1fad h THR 167 Cb 0.28 2.04 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 1fad h THR 167 CO 0.01 0.63 0.00 0.00 0.37 0.00 0.00 175.52 176.53 1fad n ARG 169 N 0.82 -0.30 -2.74 0.00 0.63 0.17 -5.00 116.66 110.23 1fad n ARG 169 Ca 0.15 0.31 -0.05 0.00 -0.92 0.00 0.00 57.85 57.35 1fad n ARG 169 Cb 0.40 -2.18 0.05 0.00 0.45 0.00 0.00 32.46 31.18 1fad n ARG 169 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1fad n LEU 170 N -1.55 1.02 -0.25 6.15 4.32 0.22 -4.94 117.00 121.97 1fad n LEU 170 Ca -0.01 -3.37 0.32 0.00 -0.02 0.00 0.00 56.01 52.93 1fad n LEU 170 Cb 0.51 0.39 0.74 0.00 -1.62 0.00 0.00 43.42 43.44 1fad n LEU 170 CO 0.09 1.38 1.29 -1.13 -1.22 0.00 0.00 177.39 177.80 1fad h ASN 171 N 2.61 0.00 0.39 -1.43 -0.73 -1.88 -2.34 115.58 112.20 1fad h ASN 171 Ca -0.16 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.01 1fad h ASN 171 Cb 1.24 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.80 1fad h ASN 171 CO 0.27 0.00 -0.49 -0.07 -0.37 0.00 0.00 177.43 176.77 1fad h LEU 172 N 0.00 -1.39 -0.61 0.34 3.38 -1.95 0.65 115.31 115.74 1fad h LEU 172 Ca 0.49 0.12 -0.12 0.00 0.09 0.00 0.00 57.88 58.47 1fad h LEU 172 Cb 1.98 0.47 -0.02 0.00 0.09 0.00 0.00 40.66 43.19 1fad h LEU 172 CO -0.01 -0.62 -0.17 -0.37 0.09 0.00 0.00 178.44 177.36 1fad h VAL 173 N -0.91 1.27 -0.79 1.22 -1.51 -1.78 -2.89 116.25 110.86 1fad h VAL 173 Ca -0.04 -1.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.12 1fad h VAL 173 Cb 0.82 1.08 -0.04 0.00 -2.13 0.00 0.00 31.29 31.03 1fad h VAL 173 CO -0.12 0.45 0.50 0.00 -1.23 0.00 0.00 177.57 177.17 1fad h ALA 174 N 0.98 1.00 -0.86 5.19 0.00 -1.13 -2.30 119.26 122.15 1fad h ALA 174 Ca 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1fad h ALA 174 Cb 0.72 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1fad h ALA 174 CO 0.06 0.44 0.51 -0.44 0.00 0.00 0.00 179.25 179.81 1fad h ASP 175 N 1.07 1.04 0.39 0.00 3.32 0.50 0.20 116.42 122.94 1fad h ASP 175 Ca 0.29 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.24 1fad h ASP 175 Cb -0.09 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.20 1fad h ASP 175 CO -0.06 0.81 -0.19 -0.07 -1.72 0.00 0.00 179.24 178.01 1fad h LEU 176 N 1.18 -0.44 -0.95 1.55 4.07 -1.25 0.34 115.31 119.81 1fad h LEU 176 Ca 0.31 -0.12 -0.00 0.00 0.08 0.00 0.00 57.88 58.14 1fad h LEU 176 Cb -0.03 0.11 -0.05 0.00 1.08 0.00 0.00 40.66 41.78 1fad h LEU 176 CO -0.06 -0.11 0.57 -0.37 -1.08 0.00 0.00 178.44 177.40 1fad h VAL 177 N -0.81 1.26 0.24 1.22 -1.51 -1.40 0.79 116.25 116.04 1fad h VAL 177 Ca -0.05 -0.56 -0.01 0.00 -1.23 0.00 0.00 66.70 64.85 1fad h VAL 177 Cb 0.53 -0.08 0.00 0.00 -2.13 0.00 0.00 31.29 29.61 1fad h VAL 177 CO 0.09 0.27 -0.13 -0.08 -1.23 0.00 0.00 177.57 176.49 1fad h GLU 178 N 1.30 -0.33 0.00 5.19 4.57 -0.53 -2.14 114.58 122.65 1fad h GLU 178 Ca 0.34 0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.50 1fad h GLU 178 Cb -0.06 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 1fad h GLU 178 CO -0.06 -0.22 -0.18 0.93 -1.18 0.00 0.00 179.01 178.29 1fad h GLU 179 N -0.34 0.00 0.00 1.92 5.08 -0.55 0.76 114.58 121.45 1fad h GLU 179 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1fad h GLU 179 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1fad h GLU 179 CO 0.04 0.18 0.00 0.00 -1.00 0.00 0.00 179.01 178.24 1fad n ALA 180 N -2.23 1.57 0.00 3.43 0.00 0.27 -4.49 120.51 119.07 1fad n ALA 180 Ca -0.00 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1fad n ALA 180 Cb 0.37 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1fad n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fad n GLN 181 N -2.03 0.00 -3.69 0.00 10.64 -1.06 -5.05 117.38 116.18 1fad n GLN 181 Ca 0.02 0.00 -0.22 0.00 -1.83 0.00 0.00 57.00 54.97 1fad n GLN 181 Cb 0.19 -0.03 0.04 0.00 -0.86 0.00 0.00 30.24 29.57 1fad n GLN 181 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1fad n GLU 182 N -1.13 -5.27 -0.33 2.61 1.02 0.26 -5.10 120.64 112.69 1fad n GLU 182 Ca 0.00 0.65 0.00 0.00 -0.02 0.00 0.00 57.16 57.79 1fad n GLU 182 Cb 0.00 -5.31 0.00 0.00 -0.02 0.00 0.00 31.44 26.11 1fad n GLU 182 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74