#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 -1.11 -1.86 0.00 0.00 -1.26 -4.78 120.51 111.50 1fad n ALA 90 Ca 0.00 -0.41 -0.43 0.00 0.00 0.00 0.00 53.44 52.60 1fad n ALA 90 Cb 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.39 1fad n ALA 90 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1fad s PRO 91 N -3.59 3.33 0.06 0.00 0.04 -1.26 -4.86 135.00 128.71 1fad s PRO 91 Ca 0.18 1.70 -0.26 0.00 0.04 0.00 0.00 61.00 62.67 1fad s PRO 91 Cb -0.02 -4.24 -0.17 0.00 0.04 0.00 0.00 34.50 30.11 1fad s PRO 91 CO 0.14 -1.86 1.57 -1.00 0.04 0.00 0.00 177.00 175.89 1fad h PRO 92 N 13.37 -0.22 -2.35 0.56 0.13 -1.88 -2.93 132.00 138.69 1fad h PRO 92 Ca -0.37 0.01 -0.47 0.00 -0.87 0.00 0.00 66.00 64.31 1fad h PRO 92 Cb 1.19 0.05 -0.08 0.00 0.13 0.00 0.00 31.00 32.29 1fad h PRO 92 CO 1.00 -0.05 1.30 0.41 -0.23 0.00 0.00 178.00 180.43 1fad n GLY 93 N -0.85 3.99 0.26 1.56 0.00 -1.26 -4.56 105.19 104.33 1fad n GLY 93 Ca -0.09 -1.58 0.13 0.00 0.00 0.00 0.00 46.02 44.49 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 3.75 0.00 -0.22 1.61 4.81 -1.92 -3.10 114.58 119.52 1fad h GLU 94 Ca 0.49 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.73 1fad h GLU 94 Cb 0.83 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.19 1fad h GLU 94 CO 0.97 0.12 0.11 0.00 -0.73 0.00 0.00 179.01 179.47 1fad h ALA 95 N 1.88 0.26 0.16 2.92 0.00 -1.89 1.00 119.26 123.58 1fad h ALA 95 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1fad h ALA 95 Cb 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1fad h ALA 95 CO 0.02 -0.31 -0.07 -0.92 0.00 0.00 0.00 179.25 177.97 1fad h TYR 96 N 0.23 -0.19 -0.97 0.00 3.20 -1.94 -2.02 116.97 115.28 1fad h TYR 96 Ca 0.09 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 1fad h TYR 96 Cb 0.02 0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.31 1fad h TYR 96 CO -0.10 0.01 0.60 1.25 -1.64 0.00 0.00 178.16 178.29 1fad h LEU 97 N -0.37 1.14 -1.00 2.82 5.85 -1.53 -2.27 115.31 119.95 1fad h LEU 97 Ca -0.02 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1fad h LEU 97 Cb 0.29 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 1fad h LEU 97 CO 0.04 0.86 0.63 -0.61 -0.34 0.00 0.00 178.44 179.01 1fad h GLN 98 N 1.33 1.31 -0.08 1.25 4.15 0.12 0.38 115.11 123.56 1fad h GLN 98 Ca 0.35 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.68 1fad h GLN 98 Cb -0.09 -0.29 -0.00 0.00 0.21 0.00 0.00 27.48 27.31 1fad h GLN 98 CO -0.07 0.88 0.05 0.28 -1.93 0.00 0.00 178.83 178.05 1fad h VAL 99 N 1.34 1.02 -0.24 2.39 2.07 -0.78 -0.53 116.25 121.52 1fad h VAL 99 Ca 0.36 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.81 1fad h VAL 99 Cb -0.12 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1fad h VAL 99 CO -0.07 0.02 0.08 0.00 0.02 0.00 0.00 177.57 177.62 1fad h ALA 100 N 1.03 0.31 -0.05 1.67 0.00 -1.19 -1.72 119.26 119.31 1fad h ALA 100 Ca 0.03 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1fad h ALA 100 Cb -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1fad h ALA 100 CO -0.01 -0.07 0.28 0.74 0.00 0.00 0.00 179.25 180.19 1fad h PHE 101 N 0.23 0.00 0.00 0.00 -1.00 0.13 -1.11 116.94 115.19 1fad h PHE 101 Ca 0.08 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.82 1fad h PHE 101 Cb 0.21 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.77 1fad h PHE 101 CO -0.00 0.00 -0.25 0.22 -1.61 0.00 0.00 178.31 176.66 1fad h ASP 102 N 0.00 0.00 -0.66 2.17 1.82 -0.16 -1.94 116.42 117.65 1fad h ASP 102 Ca 0.03 -0.60 -0.02 0.00 -0.39 0.00 0.00 57.03 56.04 1fad h ASP 102 Cb 0.59 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.57 1fad h ASP 102 CO -0.00 0.94 0.32 0.16 -1.61 0.00 0.00 179.24 179.05 1fad h ILE 103 N -1.00 1.22 -0.32 2.25 3.07 -1.24 -2.21 117.51 119.29 1fad h ILE 103 Ca -0.06 -0.63 -0.16 0.00 1.55 0.00 0.00 64.86 65.57 1fad h ILE 103 Cb 0.77 0.42 -0.01 0.00 -0.27 0.00 0.00 36.82 37.73 1fad h ILE 103 CO -0.04 0.26 -0.42 -0.37 -1.05 0.00 0.00 178.15 176.54 1fad h VAL 104 N 0.92 1.28 0.01 0.16 -1.51 -1.37 -2.53 116.25 113.21 1fad h VAL 104 Ca 0.23 -1.60 -0.00 0.00 -1.23 0.00 0.00 66.70 64.10 1fad h VAL 104 Cb 0.12 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 30.75 1fad h VAL 104 CO -0.03 0.52 -0.00 0.00 -1.23 0.00 0.00 177.57 176.83 1fad n ASP 106 N -5.08 0.43 -0.01 0.00 8.00 -0.86 0.07 116.55 119.10 1fad n ASP 106 Ca -0.07 0.62 -0.01 0.00 0.71 0.00 0.00 54.79 56.04 1fad n ASP 106 Cb 0.05 -0.71 -0.00 0.00 -0.02 0.00 0.00 41.12 40.44 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 -1.99 0.30 -1.80 -2.24 2.85 -0.42 -4.65 115.26 107.32 1fad n ASN 107 Ca 0.02 0.23 -0.20 0.00 -0.11 0.00 0.00 54.58 54.52 1fad n ASN 107 Cb 0.18 -0.55 0.11 0.00 1.24 0.00 0.00 39.78 40.75 1fad n ASN 107 CO 0.00 0.00 0.00 0.55 -2.11 0.00 0.00 177.26 175.70 1fad n VAL 108 N -2.70 2.86 -0.32 3.44 3.14 0.67 -4.85 118.33 120.56 1fad n VAL 108 Ca -0.02 -3.25 0.03 0.00 -2.96 0.00 0.00 64.34 58.15 1fad n VAL 108 Cb 0.06 -0.81 0.09 0.00 -1.06 0.00 0.00 33.84 32.12 1fad n VAL 108 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1fad n GLY 109 N -0.94 -1.58 0.26 7.55 0.00 0.11 0.34 105.19 110.94 1fad n GLY 109 Ca 0.46 0.95 0.12 0.00 0.00 0.00 0.00 46.02 47.55 1fad n GLY 109 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1fad h ARG 110 N 0.00 0.00 0.00 1.61 2.47 -1.89 -2.46 114.38 114.11 1fad h ARG 110 Ca 0.38 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.10 1fad h ARG 110 Cb 0.60 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.92 1fad h ARG 110 CO -0.89 0.13 0.00 -0.25 0.56 0.00 0.00 179.97 179.52 1fad n ASP 111 N -3.62 0.46 0.06 7.04 9.92 0.15 -2.17 116.55 128.40 1fad n ASP 111 Ca -0.02 0.61 -0.10 0.00 -0.53 0.00 0.00 54.79 54.75 1fad n ASP 111 Cb 0.26 -0.71 0.02 0.00 -0.64 0.00 0.00 41.12 40.05 1fad n ASP 111 CO 0.00 0.00 0.00 -0.50 0.13 0.00 0.00 177.20 176.83 1fad h TRP 112 N 0.00 0.49 -0.63 1.24 -0.00 -1.47 -1.51 115.95 114.07 1fad h TRP 112 Ca 0.00 -0.23 -0.08 0.00 -0.00 0.00 0.00 58.89 58.58 1fad h TRP 112 Cb 0.35 -0.07 -0.03 0.00 -0.00 0.00 0.00 29.16 29.41 1fad h TRP 112 CO 0.00 1.00 0.08 0.87 -0.00 0.00 0.00 178.44 180.40 1fad h LYS 113 N 0.23 1.05 -0.12 0.49 1.57 -1.59 1.28 116.57 119.47 1fad h LYS 113 Ca -0.04 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1fad h LYS 113 Cb 1.37 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 1fad h LYS 113 CO 0.13 0.97 0.08 -0.09 -0.57 0.00 0.00 179.45 179.97 1fad h ARG 114 N 0.98 0.16 -0.00 3.15 2.43 -1.44 -1.55 114.38 118.11 1fad h ARG 114 Ca 0.19 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.24 1fad h ARG 114 Cb 0.45 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1fad h ARG 114 CO 0.01 0.10 -0.55 -0.07 -1.51 0.00 0.00 179.97 177.96 1fad h LEU 115 N 0.16 0.01 -0.14 3.80 3.38 -0.83 -2.87 115.31 118.82 1fad h LEU 115 Ca 0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1fad h LEU 115 Cb -0.02 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1fad h LEU 115 CO -0.01 0.56 0.09 0.00 0.09 0.00 0.00 178.44 179.17 1fad h ALA 116 N 1.45 0.18 -1.01 1.53 0.00 0.23 0.52 119.26 122.16 1fad h ALA 116 Ca -0.01 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1fad h ALA 116 Cb 0.97 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 1fad h ALA 116 CO 0.07 -0.34 0.67 0.00 0.00 0.00 0.00 179.25 179.65 1fad h ARG 117 N 0.19 1.33 -0.74 0.00 3.08 -1.25 -0.55 114.38 116.44 1fad h ARG 117 Ca 0.05 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1fad h ARG 117 Cb -0.02 -0.30 -0.03 0.00 0.08 0.00 0.00 29.97 29.70 1fad h ARG 117 CO -0.01 0.88 0.28 0.93 -1.07 0.00 0.00 179.97 180.98 1fad h GLU 118 N 1.37 1.10 0.00 0.04 5.08 -1.08 -0.43 114.58 120.65 1fad h GLU 118 Ca 0.37 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1fad h GLU 118 Cb -0.16 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 28.92 1fad h GLU 118 CO -0.08 0.90 0.00 1.28 -1.00 0.00 0.00 179.01 180.11 1fad n LEU 119 N -4.28 0.00 -3.32 1.33 4.77 0.17 -4.89 117.00 110.78 1fad n LEU 119 Ca 0.06 0.30 -0.16 0.00 -0.03 0.00 0.00 56.01 56.18 1fad n LEU 119 Cb 0.19 -0.30 0.09 0.00 -2.33 0.00 0.00 43.42 41.06 1fad n LEU 119 CO 0.40 -0.10 0.11 1.17 -1.33 0.00 0.00 177.39 177.65 1fad n LYS 120 N -1.30 -6.38 -1.56 3.23 3.00 -0.17 -4.99 118.16 109.99 1fad n LYS 120 Ca 0.09 0.81 -0.30 0.00 -0.00 0.00 0.00 58.31 58.91 1fad n LYS 120 Cb 0.17 -5.71 0.07 0.00 0.00 0.00 0.00 35.03 29.56 1fad n LYS 120 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1fad s VAL 121 N -3.34 3.50 -0.17 3.15 -7.23 -1.08 -4.89 120.40 110.33 1fad s VAL 121 Ca 0.03 0.49 -0.36 0.00 -1.81 0.00 0.00 61.98 60.32 1fad s VAL 121 Cb -0.01 -3.23 -0.13 0.00 0.56 0.00 0.00 36.38 33.57 1fad s VAL 121 CO 0.70 -0.63 1.86 -0.24 -0.31 0.00 0.00 175.10 176.47 1fad n SER 122 N -3.30 3.04 -0.10 4.85 2.88 -1.26 -4.82 113.62 114.91 1fad n SER 122 Ca 0.07 0.96 0.03 0.00 -1.33 0.00 0.00 58.87 58.61 1fad n SER 122 Cb 0.55 -1.29 0.35 0.00 -0.75 0.00 0.00 64.21 63.07 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 8.85 0.73 -0.60 -1.46 4.81 -2.00 -2.13 114.58 122.77 1fad h GLU 123 Ca -0.47 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 58.75 1fad h GLU 123 Cb 1.29 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.47 1fad h GLU 123 CO 0.96 0.48 0.36 0.00 -0.73 0.00 0.00 179.01 180.08 1fad h ALA 124 N 1.65 0.78 -0.23 2.92 0.00 -2.00 -2.06 119.26 120.32 1fad h ALA 124 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1fad h ALA 124 Cb -0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1fad h ALA 124 CO -0.05 0.10 0.15 0.87 0.00 0.00 0.00 179.25 180.32 1fad h LYS 125 N 0.72 0.30 -0.87 0.00 1.79 -1.76 -2.19 116.57 114.55 1fad h LYS 125 Ca 0.24 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.70 1fad h LYS 125 Cb 0.03 -0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 30.57 1fad h LYS 125 CO -0.10 0.20 0.58 0.52 -1.08 0.00 0.00 179.45 179.56 1fad h MET 126 N 0.30 1.14 -1.00 3.15 2.86 -1.37 -1.19 114.93 118.82 1fad h MET 126 Ca 0.08 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1fad h MET 126 Cb -0.03 -0.26 -0.05 0.00 0.06 0.00 0.00 31.60 31.32 1fad h MET 126 CO -0.02 0.76 0.65 -0.44 1.06 0.00 0.00 176.91 178.92 1fad h ASP 127 N 1.18 1.16 -0.02 1.22 3.32 -1.06 -2.27 116.42 119.95 1fad h ASP 127 Ca 0.32 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.28 1fad h ASP 127 Cb -0.12 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.14 1fad h ASP 127 CO -0.07 0.85 -0.20 1.23 -1.72 0.00 0.00 179.24 179.32 1fad h GLY 128 N 1.36 0.20 0.98 2.75 0.00 -0.77 -2.61 103.07 104.98 1fad h GLY 128 Ca 0.36 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 1fad h GLY 128 CO -0.08 0.27 0.21 0.16 0.00 0.00 0.00 176.54 177.10 1fad h ILE 129 N -0.44 1.12 -0.27 2.60 3.07 -1.19 -0.98 117.51 121.42 1fad h ILE 129 Ca -0.02 -0.28 -0.01 0.00 1.55 0.00 0.00 64.86 66.10 1fad h ILE 129 Cb 0.91 0.67 -0.01 0.00 -0.27 0.00 0.00 36.82 38.12 1fad h ILE 129 CO 0.04 0.12 0.13 -0.33 -1.05 0.00 0.00 178.15 177.06 1fad h GLU 130 N 0.45 0.39 -0.25 0.16 5.08 -1.52 0.34 114.58 119.23 1fad h GLU 130 Ca 0.12 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1fad h GLU 130 Cb 0.01 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1fad h GLU 130 CO -0.02 0.39 0.06 0.93 -1.00 0.00 0.00 179.01 179.37 1fad h GLU 131 N 0.30 0.40 -0.34 2.33 4.39 -1.31 0.32 114.58 120.67 1fad h GLU 131 Ca 0.09 -0.10 -0.11 0.00 0.34 0.00 0.00 59.36 59.58 1fad h GLU 131 Cb 0.13 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 1fad h GLU 131 CO -0.01 0.50 -0.25 0.87 -1.16 0.00 0.00 179.01 178.95 1fad h LYS 132 N 0.24 0.69 -2.82 2.33 1.57 -1.16 -3.34 116.57 114.07 1fad h LYS 132 Ca 0.08 -0.28 -0.61 0.00 -1.87 0.00 0.00 60.65 57.97 1fad h LYS 132 Cb 0.27 -0.03 -0.40 0.00 0.08 0.00 0.00 32.23 32.15 1fad h LYS 132 CO 0.00 0.88 -0.73 0.71 -0.57 0.00 0.00 179.45 179.73 1fad s TYR 133 N -4.53 2.54 -1.68 -1.35 2.02 0.11 -4.95 117.35 109.50 1fad s TYR 133 Ca -0.09 -2.90 0.19 0.00 -0.37 0.00 0.00 57.07 53.91 1fad s TYR 133 Cb 0.13 -1.99 1.03 0.00 -0.40 0.00 0.00 41.96 40.73 1fad s TYR 133 CO 0.83 -0.67 1.56 -0.35 -1.57 0.00 0.00 175.55 175.34 1fad n PRO 134 N 2.43 0.41 -0.03 -1.71 -0.04 0.09 -3.71 135.00 132.45 1fad n PRO 134 Ca 0.22 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 1fad n PRO 134 Cb 0.40 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 1fad n PRO 134 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1fad n ARG 135 N -1.16 0.00 -3.37 0.54 3.00 -1.26 -5.05 116.66 109.35 1fad n ARG 135 Ca 0.11 -0.37 -0.42 0.00 -0.00 0.00 0.00 57.85 57.17 1fad n ARG 135 Cb 0.11 -0.35 -0.09 0.00 0.00 0.00 0.00 32.46 32.13 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 -0.04 6.18 0.19 6.15 0.01 -1.24 -4.93 113.70 120.02 1fad s SER 136 Ca 0.00 -0.42 -0.12 0.00 1.31 0.00 0.00 55.95 56.72 1fad s SER 136 Cb 0.00 -2.20 0.10 0.00 0.21 0.00 0.00 66.02 64.12 1fad s SER 136 CO 0.00 -0.43 1.83 0.25 0.41 0.00 0.00 173.24 175.30 1fad h LEU 137 N 8.85 0.74 -0.51 2.44 5.85 -1.97 -2.84 115.31 127.89 1fad h LEU 137 Ca -0.28 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.36 1fad h LEU 137 Cb 1.13 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1fad h LEU 137 CO 0.73 0.58 0.24 -1.28 -0.34 0.00 0.00 178.44 178.37 1fad h SER 138 N 0.85 0.67 0.01 1.25 0.87 -1.92 -2.76 113.55 112.52 1fad h SER 138 Ca 0.22 -0.13 -0.00 0.00 -1.23 0.00 0.00 61.79 60.65 1fad h SER 138 Cb -0.03 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 1fad h SER 138 CO -0.04 0.61 -0.01 -0.33 -0.53 0.00 0.00 176.83 176.54 1fad h GLU 139 N 0.68 -0.01 -0.27 2.24 4.39 -1.89 -2.46 114.58 117.25 1fad h GLU 139 Ca 0.17 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.75 1fad h GLU 139 Cb 0.13 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1fad h GLU 139 CO -0.02 0.20 -0.32 0.07 -1.16 0.00 0.00 179.01 177.79 1fad h ARG 140 N -0.23 0.69 -0.39 2.33 0.11 -1.57 -3.31 114.38 112.00 1fad h ARG 140 Ca -0.00 -0.38 -0.16 0.00 0.10 0.00 0.00 59.98 59.54 1fad h ARG 140 Cb 0.23 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.32 1fad h ARG 140 CO 0.00 1.00 -0.37 -0.39 0.10 0.00 0.00 179.97 180.30 1fad h VAL 141 N 0.41 1.27 -0.53 0.08 -1.51 -1.57 -3.24 116.25 111.16 1fad h VAL 141 Ca 0.04 -1.55 0.05 0.00 -1.23 0.00 0.00 66.70 64.01 1fad h VAL 141 Cb 0.90 1.36 -0.05 0.00 -2.13 0.00 0.00 31.29 31.37 1fad h VAL 141 CO 0.08 0.52 0.27 0.03 -1.23 0.00 0.00 177.57 177.23 1fad h ARG 142 N 0.77 0.50 -0.13 5.19 2.47 -1.52 0.32 114.38 121.97 1fad h ARG 142 Ca 0.06 -0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.75 1fad h ARG 142 Cb 0.97 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 29.17 1fad h ARG 142 CO 0.09 0.33 0.07 1.49 0.56 0.00 0.00 179.97 182.51 1fad h GLU 143 N 0.51 0.18 -0.55 0.04 4.57 -1.64 0.16 114.58 117.86 1fad h GLU 143 Ca 0.24 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.36 1fad h GLU 143 Cb 0.16 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 1fad h GLU 143 CO -0.17 0.22 0.20 0.66 -1.18 0.00 0.00 179.01 178.74 1fad h SER 144 N 0.10 0.73 0.06 1.04 4.64 -1.50 -2.24 113.55 116.38 1fad h SER 144 Ca 0.05 -0.10 -0.14 0.00 -0.47 0.00 0.00 61.79 61.13 1fad h SER 144 Cb 0.10 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 1fad h SER 144 CO -0.01 0.67 -0.46 -0.07 -0.87 0.00 0.00 176.83 176.09 1fad h LEU 145 N 0.78 0.51 0.04 5.97 3.38 0.07 -2.69 115.31 123.37 1fad h LEU 145 Ca 0.18 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1fad h LEU 145 Cb 0.18 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1fad h LEU 145 CO -0.01 0.89 -0.02 0.50 0.09 0.00 0.00 178.44 179.89 1fad h LYS 146 N 0.38 -0.06 -0.49 1.13 3.64 -0.07 0.66 116.57 121.76 1fad h LYS 146 Ca 0.02 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.34 1fad h LYS 146 Cb 0.95 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1fad h LYS 146 CO 0.08 -0.04 0.03 -0.39 -2.27 0.00 0.00 179.45 176.86 1fad h VAL 147 N -0.06 1.26 0.17 2.00 -1.51 -1.55 -2.17 116.25 114.39 1fad h VAL 147 Ca -0.01 -1.03 -0.01 0.00 -1.23 0.00 0.00 66.70 64.43 1fad h VAL 147 Cb 0.05 0.95 0.00 0.00 -2.13 0.00 0.00 31.29 30.16 1fad h VAL 147 CO 0.01 0.36 -0.08 -0.25 -1.23 0.00 0.00 177.57 176.38 1fad h TRP 148 N 0.72 -0.21 -0.35 5.19 7.01 -1.28 -2.57 115.95 124.46 1fad h TRP 148 Ca 0.14 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.13 1fad h TRP 148 Cb 0.47 0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.59 1fad h TRP 148 CO 0.04 -0.11 0.17 1.57 -2.79 0.00 0.00 178.44 177.32 1fad h LYS 149 N -0.25 0.47 -0.02 2.65 2.10 -0.84 -1.54 116.57 119.13 1fad h LYS 149 Ca -0.02 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.58 1fad h LYS 149 Cb 0.20 -0.10 -0.00 0.00 -0.90 0.00 0.00 32.23 31.43 1fad h LYS 149 CO 0.04 0.36 0.01 -0.97 -2.00 0.00 0.00 179.45 176.90 1fad h ASN 150 N 0.48 0.03 0.60 7.07 -0.73 -1.03 -2.20 115.58 119.80 1fad h ASN 150 Ca 0.12 -0.05 -0.05 0.00 1.87 0.00 0.00 56.30 58.19 1fad h ASN 150 Cb 0.04 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 38.61 1fad h ASN 150 CO -0.02 0.07 -0.26 0.00 -0.37 0.00 0.00 177.43 176.86 1fad h ALA 151 N 0.96 1.17 -0.74 1.57 0.00 -1.16 -2.94 119.26 118.12 1fad h ALA 151 Ca 0.01 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1fad h ALA 151 Cb 0.05 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1fad h ALA 151 CO -0.00 0.32 0.28 0.93 0.00 0.00 0.00 179.25 180.78 1fad h GLU 152 N 0.00 1.12 0.00 0.00 3.07 -0.68 -3.46 114.58 114.63 1fad h GLU 152 Ca -0.00 -0.21 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 1fad h GLU 152 Cb 0.63 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.36 1fad h GLU 152 CO 0.03 0.93 0.00 1.63 -1.40 0.00 0.00 179.01 180.20 1fad n LYS 153 N -4.31 0.00 0.22 2.33 4.76 -1.00 0.97 118.16 121.12 1fad n LYS 153 Ca 0.06 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.55 1fad n LYS 153 Cb 0.19 0.00 0.50 0.00 -1.84 0.00 0.00 35.03 33.88 1fad n LYS 153 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 1fad h LYS 154 N 0.00 0.01 0.00 1.97 1.57 -1.92 0.63 116.57 118.83 1fad h LYS 154 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fad h LYS 154 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1fad h LYS 154 CO 0.00 0.19 0.00 -1.71 -0.57 0.00 0.00 179.45 177.36 1fad n ASN 155 N -4.32 0.00 0.00 0.86 5.15 0.27 -3.09 115.26 114.13 1fad n ASN 155 Ca -0.02 -0.76 0.08 0.00 -0.60 0.00 0.00 54.58 53.27 1fad n ASN 155 Cb 0.24 0.00 0.41 0.00 -0.53 0.00 0.00 39.78 39.90 1fad n ASN 155 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1fad n ALA 156 N -0.95 1.93 -1.91 5.20 0.00 0.21 -4.26 120.51 120.73 1fad n ALA 156 Ca 0.15 -0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.22 1fad n ALA 156 Cb 0.07 -1.25 0.07 0.00 0.00 0.00 0.00 19.45 18.34 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 -2.37 4.81 0.22 0.00 1.04 -1.18 -4.72 113.70 111.50 1fad s SER 157 Ca 0.17 0.79 -0.10 0.00 0.48 0.00 0.00 55.95 57.30 1fad s SER 157 Cb 0.10 -1.40 0.17 0.00 0.10 0.00 0.00 66.02 64.99 1fad s SER 157 CO 0.21 -1.69 1.89 -0.37 0.98 0.00 0.00 173.24 174.26 1fad h VAL 158 N -0.85 1.20 -1.13 5.02 -1.51 -1.94 -1.69 116.25 115.36 1fad h VAL 158 Ca -0.45 -0.36 0.32 0.00 -1.23 0.00 0.00 66.70 64.97 1fad h VAL 158 Cb 1.31 0.04 -0.07 0.00 -2.13 0.00 0.00 31.29 30.44 1fad h VAL 158 CO 0.64 0.19 0.77 0.00 -1.23 0.00 0.00 177.57 177.95 1fad h ALA 159 N 1.29 2.70 0.33 5.19 0.00 -1.93 1.04 119.26 127.88 1fad h ALA 159 Ca 0.29 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1fad h ALA 159 Cb -0.12 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1fad h ALA 159 CO -0.06 -1.09 -0.16 0.78 0.00 0.00 0.00 179.25 178.72 1fad h GLY 160 N 0.18 -0.46 0.89 0.00 0.00 -1.48 -2.72 103.07 99.47 1fad h GLY 160 Ca 0.60 0.17 -0.01 0.00 0.00 0.00 0.00 47.33 48.09 1fad h GLY 160 CO -0.17 -0.17 -0.07 -2.00 0.00 0.00 0.00 176.54 174.14 1fad h LEU 161 N -0.71 -0.16 -1.00 3.11 5.85 -1.07 -2.86 115.31 118.47 1fad h LEU 161 Ca -0.05 -0.09 0.14 0.00 0.84 0.00 0.00 57.88 58.72 1fad h LEU 161 Cb 0.34 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.32 1fad h LEU 161 CO 0.07 -0.01 0.62 -0.37 -0.34 0.00 0.00 178.44 178.41 1fad h VAL 162 N -0.31 0.86 0.58 1.05 -1.51 0.93 1.45 116.25 119.30 1fad h VAL 162 Ca -0.02 -0.32 -0.03 0.00 -1.23 0.00 0.00 66.70 65.10 1fad h VAL 162 Cb 0.24 -0.15 0.01 0.00 -2.13 0.00 0.00 31.29 29.26 1fad h VAL 162 CO 0.03 0.17 -0.28 0.50 -1.23 0.00 0.00 177.57 176.76 1fad h LYS 163 N 0.92 -0.76 -0.33 5.19 3.64 -1.39 -1.38 116.57 122.47 1fad h LYS 163 Ca 0.52 0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 59.82 1fad h LYS 163 Cb 0.60 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1fad h LYS 163 CO -0.30 -0.51 -0.30 0.00 -2.27 0.00 0.00 179.45 176.07 1fad h ALA 164 N -0.36 0.48 0.35 5.00 0.00 -1.14 -2.77 119.26 120.81 1fad h ALA 164 Ca -0.08 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1fad h ALA 164 Cb 0.60 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1fad h ALA 164 CO 0.13 0.51 -0.34 1.25 0.00 0.00 0.00 179.25 180.80 1fad h LEU 165 N 0.56 -0.93 -0.87 0.00 5.85 0.20 1.24 115.31 121.36 1fad h LEU 165 Ca 0.05 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1fad h LEU 165 Cb 0.88 0.30 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 1fad h LEU 165 CO 0.08 -0.45 0.45 -0.09 -0.34 0.00 0.00 178.44 178.09 1fad h ARG 166 N -0.69 1.23 -0.29 1.25 2.43 -1.38 -0.49 114.38 116.45 1fad h ARG 166 Ca -0.04 -0.16 -0.06 0.00 -0.81 0.00 0.00 59.98 58.90 1fad h ARG 166 Cb 0.59 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1fad h ARG 166 CO -0.03 0.92 -0.09 1.15 -1.51 0.00 0.00 179.97 180.40 1fad h THR 167 N 1.23 1.22 -0.00 0.20 2.02 -1.32 -2.08 112.91 114.16 1fad h THR 167 Ca 0.30 -0.93 0.00 0.00 0.77 0.00 0.00 66.41 66.55 1fad h THR 167 Cb 0.07 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1fad h THR 167 CO -0.04 0.31 0.00 0.00 0.37 0.00 0.00 175.52 176.15 1fad n ARG 169 N -0.79 0.00 -2.78 0.00 0.63 -0.62 -5.02 116.66 108.07 1fad n ARG 169 Ca 0.22 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 57.12 1fad n ARG 169 Cb 0.14 -1.21 0.04 0.00 0.45 0.00 0.00 32.46 31.89 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 -0.72 1.58 -0.07 6.15 4.32 -0.32 -4.92 117.00 123.01 1fad n LEU 170 Ca 0.00 -3.25 0.24 0.00 -0.02 0.00 0.00 56.01 52.98 1fad n LEU 170 Cb 0.30 0.45 0.72 0.00 -1.62 0.00 0.00 43.42 43.26 1fad n LEU 170 CO 0.00 1.20 1.22 -1.13 -1.22 0.00 0.00 177.39 177.46 1fad h ASN 171 N 2.72 0.00 0.00 -1.43 -0.73 -1.81 -2.79 115.58 111.54 1fad h ASN 171 Ca -0.12 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.05 1fad h ASN 171 Cb 1.24 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.83 1fad h ASN 171 CO 0.28 0.00 0.00 0.18 -0.37 0.00 0.00 177.43 177.52 1fad n LEU 172 N -4.21 0.00 0.19 0.34 4.77 -1.26 -0.67 117.00 116.16 1fad n LEU 172 Ca 0.14 0.99 0.04 0.00 -0.03 0.00 0.00 56.01 57.14 1fad n LEU 172 Cb 0.78 -0.49 0.43 0.00 -2.33 0.00 0.00 43.42 41.82 1fad n LEU 172 CO 0.36 -0.49 0.83 -0.37 -1.33 0.00 0.00 177.39 176.40 1fad h VAL 173 N 0.00 1.19 -0.42 4.08 -1.51 -1.89 -2.64 116.25 115.06 1fad h VAL 173 Ca 0.00 -0.88 0.03 0.00 -1.23 0.00 0.00 66.70 64.61 1fad h VAL 173 Cb 0.00 1.44 -0.03 0.00 -2.13 0.00 0.00 31.29 30.57 1fad h VAL 173 CO 0.00 0.26 0.23 0.00 -1.23 0.00 0.00 177.57 176.82 1fad h ALA 174 N 1.72 0.53 -0.90 5.19 0.00 -1.19 -1.76 119.26 122.84 1fad h ALA 174 Ca 0.01 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1fad h ALA 174 Cb 0.45 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1fad h ALA 174 CO 0.03 -0.12 0.49 -0.44 0.00 0.00 0.00 179.25 179.21 1fad h ASP 175 N 0.46 1.13 0.33 0.00 3.32 -0.53 -0.78 116.42 120.34 1fad h ASP 175 Ca 0.17 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1fad h ASP 175 Cb 0.05 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.32 1fad h ASP 175 CO -0.10 0.91 -0.16 -0.07 -1.72 0.00 0.00 179.24 178.10 1fad h LEU 176 N 1.26 -0.37 -0.83 1.55 4.07 -1.17 0.49 115.31 120.32 1fad h LEU 176 Ca 0.32 -0.08 -0.02 0.00 0.08 0.00 0.00 57.88 58.18 1fad h LEU 176 Cb 0.04 0.10 -0.04 0.00 1.08 0.00 0.00 40.66 41.84 1fad h LEU 176 CO -0.05 -0.15 0.44 -0.37 -1.08 0.00 0.00 178.44 177.24 1fad h VAL 177 N -0.58 1.25 0.15 1.22 -1.51 -1.31 0.47 116.25 115.94 1fad h VAL 177 Ca -0.04 -0.62 -0.01 0.00 -1.23 0.00 0.00 66.70 64.79 1fad h VAL 177 Cb 0.42 0.15 0.00 0.00 -2.13 0.00 0.00 31.29 29.73 1fad h VAL 177 CO 0.07 0.28 -0.07 -0.08 -1.23 0.00 0.00 177.57 176.54 1fad h GLU 178 N 1.15 -0.19 0.00 5.19 4.81 -0.95 -2.40 114.58 122.19 1fad h GLU 178 Ca 0.29 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.49 1fad h GLU 178 Cb 0.05 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1fad h GLU 178 CO -0.04 -0.08 -0.18 0.93 -0.73 0.00 0.00 179.01 178.91 1fad h GLU 179 N -0.26 0.00 0.00 1.92 5.08 0.33 0.99 114.58 122.64 1fad h GLU 179 Ca -0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1fad h GLU 179 Cb 0.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 1fad h GLU 179 CO 0.03 0.18 -0.09 0.00 -1.00 0.00 0.00 179.01 178.13 1fad h ALA 180 N 1.82 1.08 -0.00 3.43 0.00 0.46 -3.36 119.26 122.70 1fad h ALA 180 Ca -0.00 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1fad h ALA 180 Cb 0.49 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.13 1fad h ALA 180 CO 0.02 0.11 -0.29 1.04 0.00 0.00 0.00 179.25 180.14 1fad n GLN 181 N -3.31 0.00 -4.05 0.00 3.00 -1.01 -5.00 117.38 107.02 1fad n GLN 181 Ca -0.01 -1.00 -0.33 0.00 -0.01 0.00 0.00 57.00 55.65 1fad n GLN 181 Cb 0.29 0.50 0.00 0.00 0.00 0.00 0.00 30.24 31.03 1fad n GLN 181 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1fad n GLU 182 N -0.00 -4.58 -0.28 -1.09 -0.58 0.33 -5.02 120.64 109.42 1fad n GLU 182 Ca -0.28 0.51 0.00 0.00 -0.42 0.00 0.00 57.16 56.97 1fad n GLU 182 Cb 0.70 -5.34 0.00 0.00 -0.57 0.00 0.00 31.44 26.23 1fad n GLU 182 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08