#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 -2.92 -1.76 0.00 0.00 -1.26 -4.81 120.51 109.76 1fad n ALA 90 Ca 0.00 -1.19 -0.43 0.00 0.00 0.00 0.00 53.44 51.82 1fad n ALA 90 Cb 0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 19.45 19.33 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 -4.77 3.41 0.65 0.00 0.04 -1.26 -4.82 135.00 128.25 1fad s PRO 91 Ca 0.52 1.96 0.39 0.00 0.04 0.00 0.00 61.00 63.91 1fad s PRO 91 Cb -0.06 -4.26 2.16 0.00 0.04 0.00 0.00 34.50 32.38 1fad s PRO 91 CO 0.41 -1.78 2.26 -1.00 0.04 0.00 0.00 177.00 176.93 1fad h PRO 92 N 13.41 0.00 -1.77 0.56 0.13 -1.92 -2.52 132.00 139.89 1fad h PRO 92 Ca -0.40 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.37 1fad h PRO 92 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 1fad h PRO 92 CO 0.98 0.00 0.31 0.41 -0.23 0.00 0.00 178.00 179.47 1fad n GLY 93 N -1.16 4.00 0.26 1.56 0.00 -1.26 -4.55 105.19 104.04 1fad n GLY 93 Ca -0.02 -1.34 -0.01 0.00 0.00 0.00 0.00 46.02 44.65 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 2.15 0.51 -0.82 1.61 4.81 -1.85 -2.74 114.58 118.25 1fad h GLU 94 Ca 0.30 -0.12 0.04 0.00 -0.13 0.00 0.00 59.36 59.45 1fad h GLU 94 Cb 0.90 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.17 1fad h GLU 94 CO 0.71 0.58 0.54 0.00 -0.73 0.00 0.00 179.01 180.11 1fad h ALA 95 N 1.47 1.51 0.67 2.92 0.00 -1.89 0.36 119.26 124.29 1fad h ALA 95 Ca 0.10 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1fad h ALA 95 Cb 0.39 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1fad h ALA 95 CO 0.02 0.40 -0.32 -0.92 0.00 0.00 0.00 179.25 178.43 1fad h TYR 96 N 1.00 -0.83 0.00 0.00 3.20 -1.86 -2.33 116.97 116.15 1fad h TYR 96 Ca 0.33 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.15 1fad h TYR 96 Cb 0.07 0.27 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 1fad h TYR 96 CO -0.00 -0.52 -0.14 1.37 -1.64 0.00 0.00 178.16 177.24 1fad h LEU 97 N -1.22 0.00 -0.79 2.82 8.10 -1.52 -2.05 115.31 120.65 1fad h LEU 97 Ca -0.09 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.85 1fad h LEU 97 Cb 0.68 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.87 1fad h LEU 97 CO 0.15 0.14 0.29 1.56 -4.11 0.00 0.00 178.44 176.47 1fad h GLN 98 N 0.00 1.19 -0.50 0.17 4.20 -0.23 1.11 115.11 121.05 1fad h GLN 98 Ca -0.00 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 1fad h GLN 98 Cb 0.25 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1fad h GLN 98 CO 0.02 0.98 0.27 0.28 -0.67 0.00 0.00 178.83 179.70 1fad h VAL 99 N 1.16 1.18 -0.08 -0.54 2.07 -0.80 0.33 116.25 119.56 1fad h VAL 99 Ca 0.26 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1fad h VAL 99 Cb 0.25 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1fad h VAL 99 CO -0.02 0.19 -0.02 0.00 0.02 0.00 0.00 177.57 177.75 1fad h ALA 100 N 1.11 0.11 0.00 1.67 0.00 -1.16 -2.35 119.26 118.64 1fad h ALA 100 Ca 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1fad h ALA 100 Cb 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1fad h ALA 100 CO -0.03 -0.18 0.18 0.74 0.00 0.00 0.00 179.25 179.97 1fad h PHE 101 N -0.18 0.00 0.00 0.00 -1.00 0.16 -2.15 116.94 113.78 1fad h PHE 101 Ca 0.02 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.77 1fad h PHE 101 Cb 0.41 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.96 1fad h PHE 101 CO 0.05 0.00 -0.21 0.22 -1.61 0.00 0.00 178.31 176.76 1fad h ASP 102 N 0.00 0.00 -0.70 2.17 1.82 -0.39 -2.12 116.42 117.20 1fad h ASP 102 Ca 0.00 -0.54 -0.01 0.00 -0.39 0.00 0.00 57.03 56.09 1fad h ASP 102 Cb 0.36 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.34 1fad h ASP 102 CO 0.00 0.89 0.40 0.16 -1.61 0.00 0.00 179.24 179.09 1fad h ILE 103 N -1.00 1.21 -0.39 2.25 3.07 -1.26 -2.30 117.51 119.09 1fad h ILE 103 Ca -0.05 -0.50 -0.16 0.00 1.55 0.00 0.00 64.86 65.71 1fad h ILE 103 Cb 0.69 0.27 -0.01 0.00 -0.27 0.00 0.00 36.82 37.50 1fad h ILE 103 CO -0.03 0.22 -0.38 -0.37 -1.05 0.00 0.00 178.15 176.54 1fad h VAL 104 N 0.96 1.27 0.00 0.16 -1.51 -1.55 -2.72 116.25 112.87 1fad h VAL 104 Ca 0.25 -1.56 -0.00 0.00 -1.23 0.00 0.00 66.70 64.16 1fad h VAL 104 Cb 0.01 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 30.54 1fad h VAL 104 CO -0.04 0.52 -0.00 0.00 -1.23 0.00 0.00 177.57 176.82 1fad n ASP 106 N -5.09 0.53 -0.01 0.00 8.00 -0.89 0.13 116.55 119.22 1fad n ASP 106 Ca -0.07 0.66 -0.22 0.00 0.71 0.00 0.00 54.79 55.88 1fad n ASP 106 Cb 0.03 -0.76 -0.14 0.00 -0.02 0.00 0.00 41.12 40.23 1fad n ASP 106 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 1fad h ASN 107 N 0.00 0.35 0.00 -2.24 -1.24 -0.63 -3.44 115.58 108.37 1fad h ASN 107 Ca 0.00 -0.85 -0.15 0.00 0.71 0.00 0.00 56.30 56.01 1fad h ASN 107 Cb 0.24 -0.11 -0.13 0.00 0.73 0.00 0.00 38.32 39.05 1fad h ASN 107 CO 0.00 1.74 -0.23 0.55 -1.29 0.00 0.00 177.43 178.21 1fad n VAL 108 N -3.76 0.00 -0.54 2.57 3.14 0.16 -4.99 118.33 114.91 1fad n VAL 108 Ca -0.30 -0.97 0.44 0.00 -2.96 0.00 0.00 64.34 60.55 1fad n VAL 108 Cb 0.95 0.91 0.75 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 1.11 0.43 2.00 7.55 0.00 0.11 0.68 103.07 114.95 1fad h GLY 109 Ca -0.36 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1fad h GLY 109 CO -0.14 -0.13 0.00 3.21 0.00 0.00 0.00 176.54 179.48 1fad h ARG 110 N 0.03 0.00 0.00 4.80 2.47 -1.88 -0.48 114.38 119.33 1fad h ARG 110 Ca 0.82 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.54 1fad h ARG 110 Cb 3.07 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 31.39 1fad h ARG 110 CO -0.14 0.00 0.00 -0.44 0.56 0.00 0.00 179.97 179.95 1fad h ASP 111 N 0.00 0.00 0.49 7.04 3.32 -0.01 -2.56 116.42 124.71 1fad h ASP 111 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 1fad h ASP 111 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1fad h ASP 111 CO 0.00 0.00 -1.48 -0.50 -1.72 0.00 0.00 179.24 175.54 1fad h TRP 112 N 0.00 0.44 -0.00 4.55 -0.00 -1.26 -2.63 115.95 117.04 1fad h TRP 112 Ca 0.00 -0.32 -0.00 0.00 -0.00 0.00 0.00 58.89 58.57 1fad h TRP 112 Cb 0.39 -0.02 -0.00 0.00 -0.00 0.00 0.00 29.16 29.53 1fad h TRP 112 CO 0.00 1.35 0.00 -0.22 -0.00 0.00 0.00 178.44 179.57 1fad h LYS 113 N 0.07 0.01 -0.52 0.49 3.64 -1.56 1.06 116.57 119.75 1fad h LYS 113 Ca -0.22 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.10 1fad h LYS 113 Cb 2.00 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.80 1fad h LYS 113 CO 0.17 0.06 0.11 0.07 -2.27 0.00 0.00 179.45 177.58 1fad h ARG 114 N -0.05 0.81 0.00 1.90 -0.00 -1.63 -1.76 114.38 113.65 1fad h ARG 114 Ca 0.00 -0.17 -0.11 0.00 -0.00 0.00 0.00 59.98 59.70 1fad h ARG 114 Cb 0.06 -0.12 -0.02 0.00 -0.00 0.00 0.00 29.97 29.89 1fad h ARG 114 CO -0.00 0.74 -0.54 -0.07 -0.00 0.00 0.00 179.97 180.10 1fad h LEU 115 N 0.77 0.00 -0.16 0.08 3.38 -1.03 -2.89 115.31 115.46 1fad h LEU 115 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1fad h LEU 115 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1fad h LEU 115 CO 0.00 0.54 0.11 0.00 0.09 0.00 0.00 178.44 179.18 1fad h ALA 116 N 1.46 0.21 -0.97 1.53 0.00 0.21 0.46 119.26 122.15 1fad h ALA 116 Ca -0.01 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1fad h ALA 116 Cb 1.05 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 1fad h ALA 116 CO 0.07 -0.31 0.64 0.00 0.00 0.00 0.00 179.25 179.65 1fad h ARG 117 N 0.22 1.28 -0.47 0.00 3.08 -1.44 -0.15 114.38 116.90 1fad h ARG 117 Ca 0.06 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1fad h ARG 117 Cb -0.02 -0.29 -0.02 0.00 0.08 0.00 0.00 29.97 29.72 1fad h ARG 117 CO -0.01 0.85 0.08 0.93 -1.07 0.00 0.00 179.97 180.75 1fad h GLU 118 N 1.32 0.73 0.00 0.04 5.08 -1.12 -0.34 114.58 120.28 1fad h GLU 118 Ca 0.35 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1fad h GLU 118 Cb -0.15 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 28.99 1fad h GLU 118 CO -0.08 0.68 0.00 1.28 -1.00 0.00 0.00 179.01 179.90 1fad n LEU 119 N -4.27 0.00 -2.52 1.33 4.77 0.15 -4.90 117.00 111.56 1fad n LEU 119 Ca 0.03 0.29 -0.12 0.00 -0.03 0.00 0.00 56.01 56.18 1fad n LEU 119 Cb 0.24 -0.29 0.06 0.00 -2.33 0.00 0.00 43.42 41.09 1fad n LEU 119 CO 0.40 -0.07 0.09 1.17 -1.33 0.00 0.00 177.39 177.64 1fad n LYS 120 N -1.29 -4.37 -1.66 3.23 3.00 -0.14 -5.01 118.16 111.93 1fad n LYS 120 Ca 0.11 0.53 -0.32 0.00 -0.00 0.00 0.00 58.31 58.63 1fad n LYS 120 Cb 0.18 -4.63 0.05 0.00 0.00 0.00 0.00 35.03 30.63 1fad n LYS 120 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1fad s VAL 121 N -3.22 3.61 0.20 3.15 1.01 -1.04 -4.93 120.40 119.18 1fad s VAL 121 Ca 0.08 0.63 -0.33 0.00 0.00 0.00 0.00 61.98 62.37 1fad s VAL 121 Cb -0.03 -3.20 -0.13 0.00 0.00 0.00 0.00 36.38 33.01 1fad s VAL 121 CO 0.46 -0.58 1.55 -1.20 0.00 0.00 0.00 175.10 175.34 1fad n SER 122 N -2.78 3.17 0.17 3.32 7.64 -1.26 -4.84 113.62 119.03 1fad n SER 122 Ca 0.09 1.10 0.08 0.00 1.01 0.00 0.00 58.87 61.15 1fad n SER 122 Cb 0.53 -1.46 0.58 0.00 -1.01 0.00 0.00 64.21 62.85 1fad n SER 122 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1fad h GLU 123 N 5.46 0.16 -0.47 1.43 5.08 -2.01 -2.13 114.58 122.10 1fad h GLU 123 Ca -0.45 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 57.91 1fad h GLU 123 Cb 1.25 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 1fad h GLU 123 CO 0.85 0.11 0.31 0.00 -1.00 0.00 0.00 179.01 179.28 1fad h ALA 124 N 1.91 0.59 -0.14 3.43 0.00 -2.00 -1.78 119.26 121.28 1fad h ALA 124 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1fad h ALA 124 Cb 0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1fad h ALA 124 CO -0.01 0.03 0.08 0.87 0.00 0.00 0.00 179.25 180.22 1fad h LYS 125 N 0.62 0.16 -0.88 0.00 1.79 -1.76 -2.30 116.57 114.21 1fad h LYS 125 Ca 0.17 -0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.64 1fad h LYS 125 Cb -0.06 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.51 1fad h LYS 125 CO -0.04 0.11 0.57 0.52 -1.08 0.00 0.00 179.45 179.52 1fad h MET 126 N 0.17 1.16 -0.85 3.15 2.86 -1.48 -1.27 114.93 118.67 1fad h MET 126 Ca 0.05 -0.08 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1fad h MET 126 Cb -0.01 -0.26 -0.04 0.00 0.06 0.00 0.00 31.60 31.35 1fad h MET 126 CO -0.02 0.78 0.56 0.22 1.06 0.00 0.00 176.91 179.51 1fad h ASP 127 N 1.19 0.96 0.00 1.22 1.82 -0.83 -0.51 116.42 120.28 1fad h ASP 127 Ca 0.32 -0.02 -0.16 0.00 -0.39 0.00 0.00 57.03 56.78 1fad h ASP 127 Cb -0.12 -0.23 0.01 0.00 0.68 0.00 0.00 39.33 39.67 1fad h ASP 127 CO -0.07 0.69 -0.63 1.23 -1.61 0.00 0.00 179.24 178.85 1fad h GLY 128 N 1.13 0.47 0.91 -0.78 0.00 -0.90 -2.78 103.07 101.13 1fad h GLY 128 Ca 0.32 -0.83 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 1fad h GLY 128 CO -0.08 0.73 0.09 1.19 0.00 0.00 0.00 176.54 178.47 1fad h ILE 129 N -0.09 1.14 -0.31 2.60 6.09 -1.14 -1.42 117.51 124.38 1fad h ILE 129 Ca -0.08 -0.41 -0.00 0.00 -1.37 0.00 0.00 64.86 63.00 1fad h ILE 129 Cb 1.34 1.07 -0.02 0.00 0.47 0.00 0.00 36.82 39.68 1fad h ILE 129 CO 0.12 0.13 0.19 -0.33 -3.07 0.00 0.00 178.15 175.20 1fad h GLU 130 N 0.17 0.43 0.25 2.19 5.08 -1.20 0.29 114.58 121.79 1fad h GLU 130 Ca 0.06 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1fad h GLU 130 Cb 0.13 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1fad h GLU 130 CO -0.01 0.33 -0.12 1.49 -1.00 0.00 0.00 179.01 179.70 1fad h GLU 131 N 0.41 -0.33 -0.12 2.33 4.57 -1.42 -2.88 114.58 117.14 1fad h GLU 131 Ca 0.11 0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.19 1fad h GLU 131 Cb 0.01 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 1fad h GLU 131 CO -0.02 -0.04 -0.47 0.87 -1.18 0.00 0.00 179.01 178.17 1fad h LYS 132 N -0.62 0.31 -2.89 1.92 1.57 -1.28 -3.37 116.57 112.21 1fad h LYS 132 Ca -0.03 -0.17 -0.61 0.00 -1.87 0.00 0.00 60.65 57.97 1fad h LYS 132 Cb 0.45 0.01 -0.41 0.00 0.08 0.00 0.00 32.23 32.36 1fad h LYS 132 CO 0.06 0.72 -0.69 0.71 -0.57 0.00 0.00 179.45 179.67 1fad s TYR 133 N -4.05 2.82 -1.15 -1.35 2.02 0.10 -4.92 117.35 110.83 1fad s TYR 133 Ca -0.05 -3.03 0.28 0.00 -0.37 0.00 0.00 57.07 53.91 1fad s TYR 133 Cb 0.13 -2.19 1.28 0.00 -0.40 0.00 0.00 41.96 40.78 1fad s TYR 133 CO 0.79 -0.64 1.93 -0.35 -1.57 0.00 0.00 175.55 175.71 1fad n PRO 134 N 2.29 0.15 -0.03 -1.71 -0.04 -1.09 -4.12 135.00 130.45 1fad n PRO 134 Ca 0.22 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 1fad n PRO 134 Cb 0.38 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 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 -1.42 0.00 -3.20 0.54 3.00 -1.26 -5.06 116.66 109.26 1fad n ARG 135 Ca 0.09 -0.37 -0.43 0.00 -0.00 0.00 0.00 57.85 57.15 1fad n ARG 135 Cb 0.29 -0.35 -0.08 0.00 0.00 0.00 0.00 32.46 32.33 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 6.29 0.17 6.15 0.01 -1.26 -4.92 113.70 120.10 1fad s SER 136 Ca 0.00 -0.36 -0.14 0.00 1.31 0.00 0.00 55.95 56.76 1fad s SER 136 Cb 0.00 -2.28 0.07 0.00 0.21 0.00 0.00 66.02 64.02 1fad s SER 136 CO 0.00 -0.65 1.82 0.25 0.41 0.00 0.00 173.24 175.07 1fad h LEU 137 N 9.37 0.63 -0.11 2.44 5.85 -1.97 -1.92 115.31 129.61 1fad h LEU 137 Ca -0.26 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 1fad h LEU 137 Cb 1.11 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.97 1fad h LEU 137 CO 0.84 0.48 0.01 -1.28 -0.34 0.00 0.00 178.44 178.15 1fad h SER 138 N 0.73 0.18 -0.66 1.25 0.87 -1.93 -2.79 113.55 111.20 1fad h SER 138 Ca 0.20 -0.28 -0.09 0.00 -1.23 0.00 0.00 61.79 60.39 1fad h SER 138 Cb -0.05 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 61.84 1fad h SER 138 CO -0.04 0.42 0.08 -0.33 -0.53 0.00 0.00 176.83 176.43 1fad h GLU 139 N -0.06 1.11 0.03 2.24 4.39 -1.94 -2.31 114.58 118.05 1fad h GLU 139 Ca 0.03 -0.32 -0.00 0.00 0.34 0.00 0.00 59.36 59.42 1fad h GLU 139 Cb 0.32 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1fad h GLU 139 CO 0.00 1.04 -0.02 -0.09 -1.16 0.00 0.00 179.01 178.78 1fad h ARG 140 N 1.03 -0.04 -0.58 2.33 2.43 -1.40 -3.31 114.38 114.83 1fad h ARG 140 Ca 0.20 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.28 1fad h ARG 140 Cb 0.48 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 1fad h ARG 140 CO 0.02 0.45 -0.00 -0.39 -1.51 0.00 0.00 179.97 178.53 1fad h VAL 141 N -0.56 1.26 -0.19 0.20 -1.51 -1.55 -3.28 116.25 110.63 1fad h VAL 141 Ca -0.00 -1.13 0.05 0.00 -1.23 0.00 0.00 66.70 64.38 1fad h VAL 141 Cb 0.51 0.82 -0.07 0.00 -2.13 0.00 0.00 31.29 30.42 1fad h VAL 141 CO 0.01 0.41 -0.37 0.03 -1.23 0.00 0.00 177.57 176.42 1fad h ARG 142 N 0.93 -0.39 -0.03 5.19 3.08 -1.50 1.13 114.38 122.78 1fad h ARG 142 Ca 0.17 0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 1fad h ARG 142 Cb 0.54 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 1fad h ARG 142 CO 0.03 -0.26 0.02 1.49 -1.07 0.00 0.00 179.97 180.17 1fad h GLU 143 N -0.41 0.04 -0.59 0.04 4.81 -1.68 0.30 114.58 117.09 1fad h GLU 143 Ca 0.10 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1fad h GLU 143 Cb 0.58 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1fad h GLU 143 CO -0.41 0.12 0.30 0.77 -0.73 0.00 0.00 179.01 179.05 1fad h SER 144 N -0.04 0.74 -0.38 1.04 0.02 -1.54 -2.23 113.55 111.15 1fad h SER 144 Ca 0.01 -0.07 -0.16 0.00 -0.84 0.00 0.00 61.79 60.74 1fad h SER 144 Cb 0.09 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 1fad h SER 144 CO -0.00 0.62 -0.38 -0.07 -1.14 0.00 0.00 176.83 175.86 1fad h LEU 145 N 0.83 1.00 0.02 5.07 3.38 0.18 -2.94 115.31 122.84 1fad h LEU 145 Ca 0.21 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1fad h LEU 145 Cb 0.07 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.54 1fad h LEU 145 CO -0.03 1.26 -0.01 0.50 0.09 0.00 0.00 178.44 180.25 1fad h LYS 146 N 0.75 -0.02 -0.48 1.13 3.64 0.16 0.21 116.57 121.96 1fad h LYS 146 Ca 0.06 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1fad h LYS 146 Cb 0.98 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 1fad h LYS 146 CO 0.09 0.03 0.32 -0.39 -2.27 0.00 0.00 179.45 177.23 1fad h VAL 147 N -0.07 1.12 -0.28 2.00 -1.51 -1.50 0.29 116.25 116.31 1fad h VAL 147 Ca -0.00 -0.22 -0.04 0.00 -1.23 0.00 0.00 66.70 65.20 1fad h VAL 147 Cb 0.06 0.41 -0.01 0.00 -2.13 0.00 0.00 31.29 29.63 1fad h VAL 147 CO 0.00 0.12 0.02 -0.25 -1.23 0.00 0.00 177.57 176.23 1fad h TRP 148 N 0.65 0.52 -0.83 5.19 7.01 -1.40 -1.56 115.95 125.53 1fad h TRP 148 Ca 0.18 -0.08 0.01 0.00 2.11 0.00 0.00 58.89 61.10 1fad h TRP 148 Cb -0.07 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 26.81 1fad h TRP 148 CO -0.04 0.61 0.55 -0.22 -2.79 0.00 0.00 178.44 176.55 1fad h LYS 149 N 0.28 1.09 -0.34 2.65 3.64 -0.20 -1.94 116.57 121.76 1fad h LYS 149 Ca 0.08 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 1fad h LYS 149 Cb 0.39 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1fad h LYS 149 CO 0.01 0.72 -0.17 -0.97 -2.27 0.00 0.00 179.45 176.77 1fad h ASN 150 N 1.12 0.62 0.67 4.20 -0.73 -0.27 -3.26 115.58 117.93 1fad h ASN 150 Ca 0.30 -0.19 -0.03 0.00 1.87 0.00 0.00 56.30 58.25 1fad h ASN 150 Cb -0.13 -0.17 0.01 0.00 0.27 0.00 0.00 38.32 38.30 1fad h ASN 150 CO -0.07 0.81 -0.32 0.00 -0.37 0.00 0.00 177.43 177.48 1fad h ALA 151 N 1.25 -0.90 -2.47 1.57 0.00 -0.62 -3.42 119.26 114.67 1fad h ALA 151 Ca 0.09 -0.21 -0.54 0.00 0.00 0.00 0.00 54.91 54.25 1fad h ALA 151 Cb 0.62 0.35 0.01 0.00 0.00 0.00 0.00 17.79 18.76 1fad h ALA 151 CO 0.04 -0.87 0.64 -1.83 0.00 0.00 0.00 179.25 177.23 1fad s GLU 152 N -4.85 4.38 0.00 0.00 -1.05 -0.79 -4.97 118.70 111.42 1fad s GLU 152 Ca -0.15 1.86 0.00 0.00 -0.15 0.00 0.00 54.97 56.53 1fad s GLU 152 Cb 0.02 -3.36 0.00 0.00 -0.44 0.00 0.00 34.13 30.34 1fad s GLU 152 CO 0.47 -0.35 0.00 1.63 0.95 0.00 0.00 175.26 177.96 1fad n LYS 153 N 4.19 0.00 0.02 -4.83 5.02 -1.26 -3.68 118.16 117.61 1fad n LYS 153 Ca 0.10 0.02 -0.03 0.00 -2.02 0.00 0.00 58.31 56.39 1fad n LYS 153 Cb 0.45 -0.30 0.22 0.00 -0.02 0.00 0.00 35.03 35.38 1fad n LYS 153 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1fad h LYS 154 N 0.00 0.47 0.00 1.97 1.57 -1.97 -2.00 116.57 116.61 1fad h LYS 154 Ca 0.00 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1fad h LYS 154 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1fad h LYS 154 CO 0.00 0.67 0.00 0.09 -0.57 0.00 0.00 179.45 179.64 1fad n ASN 155 N -4.14 0.00 0.15 0.86 3.02 -1.26 -2.93 115.26 110.96 1fad n ASN 155 Ca -0.00 -0.35 0.12 0.00 -0.03 0.00 0.00 54.58 54.32 1fad n ASN 155 Cb 0.39 -0.14 0.56 0.00 -0.61 0.00 0.00 39.78 39.97 1fad n ASN 155 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fad n ALA 156 N -1.14 1.35 -1.93 5.41 0.00 -0.75 -3.91 120.51 119.53 1fad n ALA 156 Ca 0.13 0.15 -0.27 0.00 0.00 0.00 0.00 53.44 53.45 1fad n ALA 156 Cb 0.12 -1.36 0.10 0.00 0.00 0.00 0.00 19.45 18.31 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 -4.20 4.31 0.15 0.00 1.04 -1.15 -4.60 113.70 109.25 1fad s SER 157 Ca 0.01 0.37 -0.17 0.00 0.48 0.00 0.00 55.95 56.65 1fad s SER 157 Cb 0.08 -0.82 0.01 0.00 0.10 0.00 0.00 66.02 65.38 1fad s SER 157 CO 0.30 -1.95 1.81 -0.37 0.98 0.00 0.00 173.24 174.01 1fad h VAL 158 N -0.91 1.08 -1.33 5.02 -1.51 -1.91 -2.23 116.25 114.46 1fad h VAL 158 Ca -0.44 -0.17 0.40 0.00 -1.23 0.00 0.00 66.70 65.26 1fad h VAL 158 Cb 1.29 0.54 -0.10 0.00 -2.13 0.00 0.00 31.29 30.90 1fad h VAL 158 CO 0.54 0.09 0.89 0.00 -1.23 0.00 0.00 177.57 177.86 1fad h ALA 159 N 1.15 2.87 0.31 5.19 0.00 -1.93 1.12 119.26 127.96 1fad h ALA 159 Ca 0.14 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1fad h ALA 159 Cb -0.04 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1fad h ALA 159 CO -0.04 -1.38 -0.15 0.78 0.00 0.00 0.00 179.25 178.46 1fad h GLY 160 N 0.13 -0.43 0.91 0.00 0.00 -1.55 -2.89 103.07 99.23 1fad h GLY 160 Ca 0.74 0.16 -0.01 0.00 0.00 0.00 0.00 47.33 48.21 1fad h GLY 160 CO -0.25 -0.16 0.10 -2.00 0.00 0.00 0.00 176.54 174.24 1fad h LEU 161 N -0.80 0.35 -0.99 3.11 5.85 -0.93 -2.80 115.31 119.10 1fad h LEU 161 Ca -0.04 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.59 1fad h LEU 161 Cb 0.32 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 1fad h LEU 161 CO 0.07 0.42 0.63 -0.37 -0.34 0.00 0.00 178.44 178.86 1fad h VAL 162 N 0.26 1.04 0.36 1.05 -1.51 0.11 0.75 116.25 118.32 1fad h VAL 162 Ca 0.09 -0.38 -0.02 0.00 -1.23 0.00 0.00 66.70 65.15 1fad h VAL 162 Cb 0.18 -0.17 0.00 0.00 -2.13 0.00 0.00 31.29 29.17 1fad h VAL 162 CO -0.01 0.20 -0.17 0.50 -1.23 0.00 0.00 177.57 176.86 1fad h LYS 163 N 1.12 -0.47 0.16 5.19 3.64 -1.41 -1.96 116.57 122.84 1fad h LYS 163 Ca 0.44 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.85 1fad h LYS 163 Cb 0.24 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1fad h LYS 163 CO -0.20 -0.28 -0.07 0.00 -2.27 0.00 0.00 179.45 176.63 1fad h ALA 164 N 0.11 -0.21 -0.48 5.00 0.00 -1.13 -2.76 119.26 119.79 1fad h ALA 164 Ca -0.05 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.69 1fad h ALA 164 Cb 0.40 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1fad h ALA 164 CO 0.08 -0.43 0.28 1.37 0.00 0.00 0.00 179.25 180.56 1fad h LEU 165 N -0.59 0.46 -0.30 0.00 8.10 0.45 -2.67 115.31 120.75 1fad h LEU 165 Ca -0.02 0.00 -0.18 0.00 0.11 0.00 0.00 57.88 57.79 1fad h LEU 165 Cb 0.45 -0.09 -0.00 0.00 -0.44 0.00 0.00 40.66 40.58 1fad h LEU 165 CO 0.03 0.32 -0.51 -0.09 -4.11 0.00 0.00 178.44 174.09 1fad h ARG 166 N 0.57 0.88 -0.98 0.17 2.43 -1.45 0.76 114.38 116.76 1fad h ARG 166 Ca 0.19 -0.54 0.01 0.00 -0.81 0.00 0.00 59.98 58.83 1fad h ARG 166 Cb 0.02 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.58 1fad h ARG 166 CO -0.09 1.18 0.65 1.15 -1.51 0.00 0.00 179.97 181.35 1fad h THR 167 N 0.67 1.24 0.11 0.20 2.02 -1.39 -3.23 112.91 112.53 1fad h THR 167 Ca 0.02 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 1fad h THR 167 Cb 1.12 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1fad h THR 167 CO 0.12 0.24 -0.05 0.00 0.37 0.00 0.00 175.52 176.19 1fad n ARG 169 N -4.85 0.00 -0.82 0.00 0.63 -0.80 -5.02 116.66 105.80 1fad n ARG 169 Ca -0.05 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.80 1fad n ARG 169 Cb 0.20 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 33.00 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 0.00 5.12 0.13 6.15 4.32 0.26 -4.53 117.00 128.45 1fad n LEU 170 Ca 0.00 -2.86 0.18 0.00 -0.02 0.00 0.00 56.01 53.31 1fad n LEU 170 Cb 0.00 -1.29 0.77 0.00 -1.62 0.00 0.00 43.42 41.28 1fad n LEU 170 CO 0.00 1.43 1.16 -1.13 -1.22 0.00 0.00 177.39 177.63 1fad h ASN 171 N 2.46 0.00 0.38 -1.43 -0.73 -1.79 -2.92 115.58 111.55 1fad h ASN 171 Ca 0.13 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.28 1fad h ASN 171 Cb 1.32 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.90 1fad h ASN 171 CO 0.16 0.00 -0.29 -0.07 -0.37 0.00 0.00 177.43 176.86 1fad h LEU 172 N 0.00 -0.77 -1.35 0.34 3.38 -1.94 -0.06 115.31 114.91 1fad h LEU 172 Ca 0.15 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 1fad h LEU 172 Cb 0.74 0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 1fad h LEU 172 CO -0.00 -0.41 0.15 -0.37 0.09 0.00 0.00 178.44 177.89 1fad h VAL 173 N -0.64 1.17 -0.63 1.22 -1.51 -1.89 -2.13 116.25 111.83 1fad h VAL 173 Ca -0.05 -0.54 0.01 0.00 -1.23 0.00 0.00 66.70 64.90 1fad h VAL 173 Cb 0.54 0.69 -0.03 0.00 -2.13 0.00 0.00 31.29 30.35 1fad h VAL 173 CO 0.01 0.20 0.41 0.00 -1.23 0.00 0.00 177.57 176.96 1fad h ALA 174 N 1.58 0.81 -0.90 5.19 0.00 -1.33 -2.47 119.26 122.13 1fad h ALA 174 Ca 0.14 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1fad h ALA 174 Cb 0.15 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1fad h ALA 174 CO -0.01 0.20 0.55 -0.44 0.00 0.00 0.00 179.25 179.54 1fad h ASP 175 N 0.82 1.08 0.30 0.00 3.32 -0.33 -0.79 116.42 120.83 1fad h ASP 175 Ca 0.24 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1fad h ASP 175 Cb -0.05 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.23 1fad h ASP 175 CO -0.07 0.82 -0.15 -0.07 -1.72 0.00 0.00 179.24 178.06 1fad h LEU 176 N 1.24 -0.34 -0.91 1.55 4.07 -1.23 0.20 115.31 119.88 1fad h LEU 176 Ca 0.32 -0.08 -0.01 0.00 0.08 0.00 0.00 57.88 58.19 1fad h LEU 176 Cb -0.06 0.09 -0.04 0.00 1.08 0.00 0.00 40.66 41.72 1fad h LEU 176 CO -0.06 -0.13 0.52 -0.37 -1.08 0.00 0.00 178.44 177.32 1fad h VAL 177 N -0.55 1.26 0.04 1.22 -1.51 -1.43 0.92 116.25 116.20 1fad h VAL 177 Ca -0.04 -0.61 -0.00 0.00 -1.23 0.00 0.00 66.70 64.82 1fad h VAL 177 Cb 0.40 0.00 -0.00 0.00 -2.13 0.00 0.00 31.29 29.57 1fad h VAL 177 CO 0.07 0.28 -0.02 -0.08 -1.23 0.00 0.00 177.57 176.59 1fad h GLU 178 N 1.27 -0.06 0.00 5.19 4.81 -0.94 -1.89 114.58 122.95 1fad h GLU 178 Ca 0.32 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.51 1fad h GLU 178 Cb -0.01 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1fad h GLU 178 CO -0.06 -0.04 -0.25 0.93 -0.73 0.00 0.00 179.01 178.87 1fad h GLU 179 N -0.06 0.00 0.00 1.92 5.08 -0.14 0.58 114.58 121.96 1fad h GLU 179 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1fad h GLU 179 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1fad h GLU 179 CO 0.01 0.25 0.00 0.00 -1.00 0.00 0.00 179.01 178.26 1fad h ALA 180 N 1.75 1.00 0.00 3.43 0.00 0.17 -3.30 119.26 122.31 1fad h ALA 180 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1fad h ALA 180 Cb 0.66 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.33 1fad h ALA 180 CO 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 179.25 178.89 1fad n GLN 181 N -2.84 0.00 0.00 0.00 10.64 -1.02 -5.04 117.38 119.13 1fad n GLN 181 Ca 0.00 -0.88 0.00 0.00 -1.83 0.00 0.00 57.00 54.29 1fad n GLN 181 Cb 0.23 0.05 0.00 0.00 -0.86 0.00 0.00 30.24 29.66 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 0.10 0.00 -0.35 2.61 1.02 0.20 -5.04 120.64 119.18 1fad n GLU 182 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 1fad n GLU 182 Cb 0.72 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.14 1fad n GLU 182 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74