#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 -3.26 -1.78 0.00 0.00 -1.26 -4.80 120.51 109.41 1fad n ALA 90 Ca 0.00 -1.27 -0.43 0.00 0.00 0.00 0.00 53.44 51.74 1fad n ALA 90 Cb 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 19.45 19.32 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 -4.86 3.32 0.54 0.00 0.04 -1.26 -4.82 135.00 127.95 1fad s PRO 91 Ca 0.55 1.85 0.20 0.00 0.04 0.00 0.00 61.00 63.64 1fad s PRO 91 Cb -0.07 -4.28 1.41 0.00 0.04 0.00 0.00 34.50 31.61 1fad s PRO 91 CO 0.44 -1.88 2.18 -1.00 0.04 0.00 0.00 177.00 176.77 1fad h PRO 92 N 13.72 0.00 -1.80 0.56 0.13 -1.93 -2.40 132.00 140.29 1fad h PRO 92 Ca -0.39 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.38 1fad h PRO 92 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 1fad h PRO 92 CO 0.98 0.00 0.29 0.41 -0.23 0.00 0.00 178.00 179.46 1fad n GLY 93 N -1.47 3.99 0.29 1.56 0.00 -1.26 -4.54 105.19 103.75 1fad n GLY 93 Ca -0.03 -1.36 0.16 0.00 0.00 0.00 0.00 46.02 44.79 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 2.23 0.00 -0.04 1.61 4.81 -1.83 -2.95 114.58 118.40 1fad h GLU 94 Ca 0.30 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.54 1fad h GLU 94 Cb 0.91 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 1fad h GLU 94 CO 0.70 0.06 -0.01 0.00 -0.73 0.00 0.00 179.01 179.03 1fad h ALA 95 N 1.94 0.03 -0.64 2.92 0.00 -1.89 0.51 119.26 122.13 1fad h ALA 95 Ca -0.00 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1fad h ALA 95 Cb 0.25 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1fad h ALA 95 CO 0.01 -0.50 0.04 -0.92 0.00 0.00 0.00 179.25 177.88 1fad h TYR 96 N -0.01 1.19 -0.27 0.00 3.20 -1.91 -2.40 116.97 116.77 1fad h TYR 96 Ca 0.02 -0.19 0.00 0.00 3.14 0.00 0.00 58.73 61.70 1fad h TYR 96 Cb 0.04 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 37.98 1fad h TYR 96 CO -0.11 1.02 0.18 1.25 -1.64 0.00 0.00 178.16 178.86 1fad h LEU 97 N 1.01 0.30 -1.09 2.82 5.85 -1.33 -2.43 115.31 120.45 1fad h LEU 97 Ca 0.18 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 1fad h LEU 97 Cb 0.53 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 1fad h LEU 97 CO 0.03 0.22 0.39 1.56 -0.34 0.00 0.00 178.44 180.30 1fad h GLN 98 N 0.36 1.03 -0.01 1.25 4.20 0.17 0.96 115.11 123.06 1fad h GLN 98 Ca 0.10 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1fad h GLN 98 Cb -0.04 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.54 1fad h GLN 98 CO -0.02 0.76 0.01 0.28 -0.67 0.00 0.00 178.83 179.19 1fad h VAL 99 N 1.03 1.00 -0.18 -0.54 2.07 -0.97 0.28 116.25 118.94 1fad h VAL 99 Ca 0.26 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.70 1fad h VAL 99 Cb 0.04 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1fad h VAL 99 CO -0.04 0.00 -0.16 0.00 0.02 0.00 0.00 177.57 177.39 1fad h ALA 100 N 1.00 0.27 0.00 1.67 0.00 -1.25 -2.45 119.26 118.49 1fad h ALA 100 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1fad h ALA 100 Cb -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1fad h ALA 100 CO -0.00 0.16 0.00 0.74 0.00 0.00 0.00 179.25 180.15 1fad h PHE 101 N 0.09 0.00 0.00 0.00 -1.00 -0.63 -2.36 116.94 113.04 1fad h PHE 101 Ca 0.03 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.74 1fad h PHE 101 Cb 0.69 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.24 1fad h PHE 101 CO 0.08 0.00 -0.45 0.22 -1.61 0.00 0.00 178.31 176.55 1fad h ASP 102 N 0.00 0.00 -0.66 2.17 1.82 0.04 -2.32 116.42 117.47 1fad h ASP 102 Ca 0.00 -0.57 -0.01 0.00 -0.39 0.00 0.00 57.03 56.06 1fad h ASP 102 Cb 0.00 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 39.98 1fad h ASP 102 CO 0.00 1.04 0.36 0.16 -1.61 0.00 0.00 179.24 179.19 1fad h ILE 103 N -1.00 1.21 -0.37 2.25 3.07 -1.34 -2.25 117.51 119.07 1fad h ILE 103 Ca -0.11 -0.53 -0.16 0.00 1.55 0.00 0.00 64.86 65.60 1fad h ILE 103 Cb 0.87 0.36 -0.01 0.00 -0.27 0.00 0.00 36.82 37.77 1fad h ILE 103 CO -0.07 0.23 -0.41 -0.37 -1.05 0.00 0.00 178.15 176.48 1fad h VAL 104 N 0.90 1.27 0.07 0.16 -1.51 -1.59 -2.71 116.25 112.84 1fad h VAL 104 Ca 0.23 -1.59 -0.00 0.00 -1.23 0.00 0.00 66.70 64.11 1fad h VAL 104 Cb 0.05 1.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.63 1fad h VAL 104 CO -0.04 0.53 -0.03 0.00 -1.23 0.00 0.00 177.57 176.80 1fad n ASP 106 N -5.13 0.60 0.01 0.00 8.00 -0.87 0.11 116.55 119.26 1fad n ASP 106 Ca -0.08 0.70 -0.22 0.00 0.71 0.00 0.00 54.79 55.90 1fad n ASP 106 Cb 0.07 -0.80 -0.14 0.00 -0.02 0.00 0.00 41.12 40.22 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 0.41 0.00 -2.24 -0.73 -0.67 -3.44 115.58 108.91 1fad h ASN 107 Ca 0.00 -0.90 -0.15 0.00 1.87 0.00 0.00 56.30 57.12 1fad h ASN 107 Cb 0.21 -0.13 -0.12 0.00 0.27 0.00 0.00 38.32 38.54 1fad h ASN 107 CO 0.00 1.79 -0.20 0.55 -0.37 0.00 0.00 177.43 179.19 1fad n VAL 108 N -3.65 0.00 -0.33 2.57 3.14 0.98 -5.01 118.33 116.03 1fad n VAL 108 Ca -0.30 -0.96 0.23 0.00 -2.96 0.00 0.00 64.34 60.36 1fad n VAL 108 Cb 1.00 0.88 0.44 0.00 -1.06 0.00 0.00 33.84 35.11 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 1.15 1.78 1.30 7.55 0.00 0.77 0.36 103.07 115.99 1fad h GLY 109 Ca -0.35 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1fad h GLY 109 CO -0.13 -0.66 0.35 3.21 0.00 0.00 0.00 176.54 179.31 1fad h ARG 110 N 0.02 0.00 0.00 4.80 -0.00 -1.89 0.22 114.38 117.53 1fad h ARG 110 Ca 0.73 0.00 -0.02 0.00 -0.50 0.00 0.00 59.98 60.18 1fad h ARG 110 Cb 1.75 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 31.71 1fad h ARG 110 CO -0.84 0.00 -0.11 -0.44 0.00 0.00 0.00 179.97 178.58 1fad h ASP 111 N 0.00 0.00 0.08 7.04 3.32 -0.68 -2.13 116.42 124.06 1fad h ASP 111 Ca 0.00 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 1fad h ASP 111 Cb 0.70 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 1fad h ASP 111 CO 0.00 0.11 -0.59 -0.50 -1.72 0.00 0.00 179.24 176.54 1fad h TRP 112 N 0.00 0.66 -0.97 4.55 -0.00 -0.74 -2.49 115.95 116.96 1fad h TRP 112 Ca -0.00 -0.25 0.00 0.00 -0.00 0.00 0.00 58.89 58.64 1fad h TRP 112 Cb 0.46 -0.12 -0.05 0.00 -0.00 0.00 0.00 29.16 29.45 1fad h TRP 112 CO 0.00 0.98 0.61 0.87 -0.00 0.00 0.00 178.44 180.90 1fad h LYS 113 N 0.39 1.30 -0.15 0.49 1.79 -1.50 1.27 116.57 120.16 1fad h LYS 113 Ca -0.00 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1fad h LYS 113 Cb 1.14 -0.28 -0.01 0.00 -1.58 0.00 0.00 32.23 31.50 1fad h LYS 113 CO 0.11 0.89 0.10 -0.09 -1.08 0.00 0.00 179.45 179.38 1fad h ARG 114 N 1.33 0.19 0.00 3.15 2.43 -1.39 -1.79 114.38 118.31 1fad h ARG 114 Ca 0.35 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.41 1fad h ARG 114 Cb -0.10 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 1fad h ARG 114 CO -0.07 0.13 -0.46 -0.07 -1.51 0.00 0.00 179.97 177.99 1fad h LEU 115 N 0.19 0.00 -0.16 3.80 3.38 -0.91 -2.91 115.31 118.71 1fad h LEU 115 Ca 0.05 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.03 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 0.46 0.09 0.00 0.09 0.00 0.00 178.44 179.07 1fad h ALA 116 N 1.54 0.19 -1.01 1.53 0.00 0.24 0.81 119.26 122.56 1fad h ALA 116 Ca -0.00 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1fad h ALA 116 Cb 0.86 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1fad h ALA 116 CO 0.06 -0.34 0.67 0.00 0.00 0.00 0.00 179.25 179.64 1fad h ARG 117 N 0.19 1.33 -0.46 0.00 2.47 -1.27 -0.86 114.38 115.78 1fad h ARG 117 Ca 0.06 -0.08 -0.09 0.00 -1.26 0.00 0.00 59.98 58.61 1fad h ARG 117 Cb -0.00 -0.30 -0.02 0.00 -1.65 0.00 0.00 29.97 28.00 1fad h ARG 117 CO -0.03 0.88 -0.07 0.93 0.56 0.00 0.00 179.97 182.23 1fad h GLU 118 N 1.37 0.80 0.00 0.04 4.39 -1.11 -1.86 114.58 118.21 1fad h GLU 118 Ca 0.37 -0.25 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1fad h GLU 118 Cb -0.16 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.42 1fad h GLU 118 CO -0.08 0.86 0.00 1.28 -1.16 0.00 0.00 179.01 179.90 1fad n LEU 119 N -4.18 0.00 -2.87 1.33 4.77 0.27 -4.89 117.00 111.44 1fad n LEU 119 Ca 0.02 0.30 -0.13 0.00 -0.03 0.00 0.00 56.01 56.16 1fad n LEU 119 Cb 0.35 -0.30 0.07 0.00 -2.33 0.00 0.00 43.42 41.21 1fad n LEU 119 CO 0.43 -0.10 0.08 1.17 -1.33 0.00 0.00 177.39 177.64 1fad n LYS 120 N -1.30 -5.09 -1.55 3.23 3.00 -0.59 -4.99 118.16 110.88 1fad n LYS 120 Ca 0.09 0.65 -0.32 0.00 -0.00 0.00 0.00 58.31 58.74 1fad n LYS 120 Cb 0.17 -5.09 0.06 0.00 0.00 0.00 0.00 35.03 30.17 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 -3.28 3.51 0.04 3.15 -7.23 -1.08 -4.90 120.40 110.61 1fad s VAL 121 Ca 0.00 0.57 -0.36 0.00 -1.81 0.00 0.00 61.98 60.38 1fad s VAL 121 Cb -0.00 -3.12 -0.15 0.00 0.56 0.00 0.00 36.38 33.67 1fad s VAL 121 CO 0.56 -0.56 1.57 -0.24 -0.31 0.00 0.00 175.10 176.12 1fad n SER 122 N -2.97 2.58 0.16 4.85 2.88 -1.26 -4.83 113.62 115.03 1fad n SER 122 Ca 0.09 1.08 0.06 0.00 -1.33 0.00 0.00 58.87 58.77 1fad n SER 122 Cb 0.53 -1.30 0.56 0.00 -0.75 0.00 0.00 64.21 63.24 1fad n SER 122 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1fad h GLU 123 N 6.18 0.20 -0.29 -1.46 5.08 -2.00 -2.27 114.58 120.03 1fad h GLU 123 Ca -0.47 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 57.91 1fad h GLU 123 Cb 1.29 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 1fad h GLU 123 CO 0.87 0.14 0.10 0.00 -1.00 0.00 0.00 179.01 179.12 1fad h ALA 124 N 1.90 0.33 -0.92 3.43 0.00 -2.00 -1.24 119.26 120.75 1fad h ALA 124 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1fad h ALA 124 Cb -0.02 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1fad h ALA 124 CO -0.01 -0.30 0.58 0.87 0.00 0.00 0.00 179.25 180.38 1fad h LYS 125 N 0.23 1.24 -0.91 0.00 1.57 -1.78 -2.02 116.57 114.89 1fad h LYS 125 Ca 0.13 -0.10 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1fad h LYS 125 Cb 0.10 -0.27 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 1fad h LYS 125 CO -0.13 0.85 0.60 1.98 -0.57 0.00 0.00 179.45 182.18 1fad h MET 126 N 1.27 1.20 -0.77 3.15 4.05 -1.16 0.32 114.93 122.99 1fad h MET 126 Ca 0.33 -0.07 -0.06 0.00 -0.28 0.00 0.00 59.70 59.62 1fad h MET 126 Cb -0.09 -0.27 -0.03 0.00 -0.80 0.00 0.00 31.60 30.41 1fad h MET 126 CO -0.07 0.80 0.26 -0.44 0.23 0.00 0.00 176.91 177.69 1fad h ASP 127 N 1.24 1.10 0.06 1.39 3.32 -0.53 -2.54 116.42 120.46 1fad h ASP 127 Ca 0.33 -0.20 -0.20 0.00 0.02 0.00 0.00 57.03 56.99 1fad h ASP 127 Cb -0.14 -0.29 0.02 0.00 0.22 0.00 0.00 39.33 39.14 1fad h ASP 127 CO -0.07 1.01 -0.80 1.23 -1.72 0.00 0.00 179.24 178.88 1fad h GLY 128 N 1.14 0.49 1.00 2.75 0.00 -1.06 -2.86 103.07 104.53 1fad h GLY 128 Ca 0.25 -0.98 0.00 0.00 0.00 0.00 0.00 47.33 46.61 1fad h GLY 128 CO -0.01 0.86 0.32 1.19 0.00 0.00 0.00 176.54 178.90 1fad h ILE 129 N -0.09 1.13 -0.30 2.60 2.10 -0.96 0.39 117.51 122.37 1fad h ILE 129 Ca -0.12 -0.24 -0.03 0.00 1.08 0.00 0.00 64.86 65.55 1fad h ILE 129 Cb 1.54 0.41 -0.01 0.00 -1.09 0.00 0.00 36.82 37.67 1fad h ILE 129 CO 0.16 0.13 0.07 1.05 -1.08 0.00 0.00 178.15 178.47 1fad h GLU 130 N 0.66 0.49 0.29 2.19 4.11 -1.57 0.22 114.58 120.98 1fad h GLU 130 Ca 0.18 -0.12 -0.01 0.00 0.07 0.00 0.00 59.36 59.47 1fad h GLU 130 Cb -0.07 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.12 1fad h GLU 130 CO -0.04 0.57 -0.14 0.93 0.07 0.00 0.00 179.01 180.40 1fad h GLU 131 N 0.33 -0.38 -0.37 1.06 5.08 -1.26 -3.29 114.58 115.75 1fad h GLU 131 Ca 0.09 0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.32 1fad h GLU 131 Cb 0.31 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1fad h GLU 131 CO 0.00 -0.07 -0.41 0.87 -1.00 0.00 0.00 179.01 178.40 1fad h LYS 132 N -0.98 0.93 -3.31 2.33 1.57 -0.33 -3.38 116.57 113.41 1fad h LYS 132 Ca -0.04 -0.51 -0.66 0.00 -1.87 0.00 0.00 60.65 57.57 1fad h LYS 132 Cb 0.48 0.03 -0.39 0.00 0.08 0.00 0.00 32.23 32.43 1fad h LYS 132 CO 0.07 1.16 -0.45 0.71 -0.57 0.00 0.00 179.45 180.37 1fad s TYR 133 N -4.35 3.49 -0.54 -1.35 2.02 0.77 -4.89 117.35 112.50 1fad s TYR 133 Ca -0.11 -3.11 0.24 0.00 -0.37 0.00 0.00 57.07 53.72 1fad s TYR 133 Cb 0.11 -2.95 0.42 0.00 -0.40 0.00 0.00 41.96 39.15 1fad s TYR 133 CO 0.88 -0.70 1.50 -1.00 -1.57 0.00 0.00 175.55 174.67 1fad h PRO 134 N 6.15 0.00 0.00 -1.71 0.13 -1.69 -3.38 132.00 131.50 1fad h PRO 134 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1fad h PRO 134 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1fad h PRO 134 CO 0.74 0.00 -0.20 -2.13 -0.23 0.00 0.00 178.00 176.17 1fad n ARG 135 N -2.57 0.00 -3.15 0.86 3.00 -1.26 -5.06 116.66 108.48 1fad n ARG 135 Ca 0.04 -0.52 -0.43 0.00 -0.00 0.00 0.00 57.85 56.93 1fad n ARG 135 Cb 0.48 -0.32 -0.07 0.00 0.00 0.00 0.00 32.46 32.56 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 -0.40 6.27 0.14 6.15 0.01 -1.26 -4.92 113.70 119.69 1fad s SER 136 Ca 0.00 -0.57 -0.18 0.00 1.31 0.00 0.00 55.95 56.51 1fad s SER 136 Cb 0.00 -2.30 -0.02 0.00 0.21 0.00 0.00 66.02 63.91 1fad s SER 136 CO 0.00 -0.79 1.80 0.25 0.41 0.00 0.00 173.24 174.91 1fad h LEU 137 N 9.63 0.37 -0.14 2.44 5.85 -1.97 -0.08 115.31 131.41 1fad h LEU 137 Ca -0.26 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1fad h LEU 137 Cb 1.10 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 1fad h LEU 137 CO 0.90 0.27 0.03 -1.28 -0.34 0.00 0.00 178.44 178.03 1fad h SER 138 N 0.44 0.21 -0.19 1.25 0.87 -1.94 -2.71 113.55 111.49 1fad h SER 138 Ca 0.12 -0.23 -0.10 0.00 -1.23 0.00 0.00 61.79 60.35 1fad h SER 138 Cb -0.05 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 61.84 1fad h SER 138 CO -0.03 0.38 -0.20 -0.33 -0.53 0.00 0.00 176.83 176.13 1fad h GLU 139 N 0.02 0.63 0.48 2.24 4.39 -1.94 -2.52 114.58 117.88 1fad h GLU 139 Ca 0.04 -0.23 -0.02 0.00 0.34 0.00 0.00 59.36 59.49 1fad h GLU 139 Cb 0.26 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1fad h GLU 139 CO 0.00 0.79 -0.23 -0.09 -1.16 0.00 0.00 179.01 178.32 1fad h ARG 140 N 0.56 -0.62 -0.54 2.33 2.43 -0.98 -3.30 114.38 114.26 1fad h ARG 140 Ca 0.09 0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.21 1fad h ARG 140 Cb 0.66 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 1fad h ARG 140 CO 0.05 -0.41 -0.03 -0.39 -1.51 0.00 0.00 179.97 177.68 1fad h VAL 141 N -1.11 1.26 -0.36 0.20 -1.51 -1.59 -3.20 116.25 109.94 1fad h VAL 141 Ca -0.07 -1.13 0.06 0.00 -1.23 0.00 0.00 66.70 64.33 1fad h VAL 141 Cb 0.49 0.87 -0.06 0.00 -2.13 0.00 0.00 31.29 30.47 1fad h VAL 141 CO 0.11 0.40 0.02 0.03 -1.23 0.00 0.00 177.57 176.90 1fad h ARG 142 N 0.87 0.12 0.07 5.19 2.47 -1.58 1.05 114.38 122.56 1fad h ARG 142 Ca 0.15 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.86 1fad h ARG 142 Cb 0.55 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.84 1fad h ARG 142 CO 0.03 0.08 -0.03 1.49 0.56 0.00 0.00 179.97 182.10 1fad h GLU 143 N 0.12 -0.09 -0.70 0.04 4.81 -1.63 0.18 114.58 117.31 1fad h GLU 143 Ca 0.18 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1fad h GLU 143 Cb 0.24 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 1fad h GLU 143 CO -0.28 -0.01 0.35 0.77 -0.73 0.00 0.00 179.01 179.11 1fad h SER 144 N -0.15 0.89 -0.53 1.04 0.02 -1.46 -2.71 113.55 110.65 1fad h SER 144 Ca -0.01 -0.09 -0.12 0.00 -0.84 0.00 0.00 61.79 60.74 1fad h SER 144 Cb 0.13 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1fad h SER 144 CO 0.02 0.75 -0.12 -0.07 -1.14 0.00 0.00 176.83 176.26 1fad h LEU 145 N 0.99 1.02 -0.35 5.07 3.38 0.15 -2.36 115.31 123.22 1fad h LEU 145 Ca 0.24 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1fad h LEU 145 Cb 0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1fad h LEU 145 CO -0.03 1.14 0.23 0.11 0.09 0.00 0.00 178.44 179.98 1fad h LYS 146 N 0.89 0.45 -0.47 1.13 1.57 -0.65 0.22 116.57 119.71 1fad h LYS 146 Ca 0.13 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.79 1fad h LYS 146 Cb 0.69 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 1fad h LYS 146 CO 0.05 0.30 -0.10 -0.39 -0.57 0.00 0.00 179.45 178.74 1fad h VAL 147 N 0.47 1.27 0.41 0.50 -1.51 -1.50 -0.79 116.25 115.10 1fad h VAL 147 Ca 0.13 -1.23 -0.02 0.00 -1.23 0.00 0.00 66.70 64.35 1fad h VAL 147 Cb -0.05 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 30.20 1fad h VAL 147 CO -0.03 0.42 -0.20 -0.25 -1.23 0.00 0.00 177.57 176.29 1fad h TRP 148 N 0.75 -0.52 -0.41 5.19 7.01 -1.15 -2.72 115.95 124.11 1fad h TRP 148 Ca 0.12 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.11 1fad h TRP 148 Cb 0.65 0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.86 1fad h TRP 148 CO 0.05 -0.19 0.27 1.57 -2.79 0.00 0.00 178.44 177.34 1fad h LYS 149 N -0.87 0.53 -0.72 2.65 5.09 -0.61 -2.16 116.57 120.50 1fad h LYS 149 Ca -0.06 -0.03 -0.03 0.00 0.09 0.00 0.00 60.65 60.62 1fad h LYS 149 Cb 0.55 -0.12 -0.03 0.00 0.10 0.00 0.00 32.23 32.73 1fad h LYS 149 CO 0.09 0.35 0.35 -0.97 -2.09 0.00 0.00 179.45 177.18 1fad h ASN 150 N 0.55 0.94 -0.23 7.07 -0.73 -1.07 -3.02 115.58 119.09 1fad h ASN 150 Ca 0.15 -0.13 -0.07 0.00 1.87 0.00 0.00 56.30 58.12 1fad h ASN 150 Cb -0.06 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.28 1fad h ASN 150 CO -0.03 0.81 -0.12 0.00 -0.37 0.00 0.00 177.43 177.72 1fad h ALA 151 N 1.17 0.33 -2.23 1.57 0.00 -1.08 -3.41 119.26 115.61 1fad h ALA 151 Ca 0.25 -0.30 -0.56 0.00 0.00 0.00 0.00 54.91 54.29 1fad h ALA 151 Cb 0.12 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1fad h ALA 151 CO -0.03 0.18 0.76 -1.21 0.00 0.00 0.00 179.25 178.95 1fad s GLU 152 N -4.58 4.31 0.00 0.00 8.01 -0.93 -4.97 118.70 120.54 1fad s GLU 152 Ca -0.13 1.60 0.00 0.00 0.01 0.00 0.00 54.97 56.44 1fad s GLU 152 Cb 0.07 -3.63 0.00 0.00 -4.31 0.00 0.00 34.13 26.26 1fad s GLU 152 CO 0.77 -0.53 0.00 1.63 0.01 0.00 0.00 175.26 177.14 1fad n LYS 153 N 5.75 0.00 0.17 1.61 4.76 -1.26 -3.58 118.16 125.60 1fad n LYS 153 Ca 0.12 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.57 1fad n LYS 153 Cb 0.46 -0.25 0.30 0.00 -1.84 0.00 0.00 35.03 33.70 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 0.00 0.00 1.97 1.79 -1.97 -1.98 116.57 116.38 1fad h LYS 154 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1fad h LYS 154 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1fad h LYS 154 CO 0.00 0.45 0.00 -1.71 -1.08 0.00 0.00 179.45 177.11 1fad n ASN 155 N -4.00 0.00 0.03 0.86 2.85 -1.26 -2.91 115.26 110.83 1fad n ASN 155 Ca -0.02 -0.36 0.07 0.00 -0.11 0.00 0.00 54.58 54.17 1fad n ASN 155 Cb 0.47 -0.16 0.31 0.00 1.24 0.00 0.00 39.78 41.65 1fad n ASN 155 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1fad n ALA 156 N -1.16 1.55 -1.99 5.20 0.00 -0.74 -4.18 120.51 119.19 1fad n ALA 156 Ca 0.14 -0.01 -0.26 0.00 0.00 0.00 0.00 53.44 53.31 1fad n ALA 156 Cb 0.13 -1.23 0.05 0.00 0.00 0.00 0.00 19.45 18.41 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 -3.24 5.15 0.14 0.00 1.04 -1.15 -4.70 113.70 110.94 1fad s SER 157 Ca 0.05 0.52 -0.18 0.00 0.48 0.00 0.00 55.95 56.83 1fad s SER 157 Cb 0.08 -1.32 -0.02 0.00 0.10 0.00 0.00 66.02 64.86 1fad s SER 157 CO 0.25 -1.36 1.80 -0.37 0.98 0.00 0.00 173.24 174.54 1fad h VAL 158 N -0.39 1.08 -1.37 5.02 -1.51 -1.92 -2.28 116.25 114.88 1fad h VAL 158 Ca -0.45 -0.15 0.41 0.00 -1.23 0.00 0.00 66.70 65.28 1fad h VAL 158 Cb 1.29 0.61 -0.09 0.00 -2.13 0.00 0.00 31.29 30.96 1fad h VAL 158 CO 0.60 0.08 0.94 0.00 -1.23 0.00 0.00 177.57 177.96 1fad h ALA 159 N 1.12 2.97 0.10 5.19 0.00 -1.94 1.22 119.26 127.91 1fad h ALA 159 Ca 0.12 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1fad h ALA 159 Cb -0.05 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1fad h ALA 159 CO -0.03 -1.48 -0.05 0.78 0.00 0.00 0.00 179.25 178.48 1fad h GLY 160 N 0.10 -0.13 1.00 0.00 0.00 -1.62 -2.77 103.07 99.64 1fad h GLY 160 Ca 0.75 0.05 -0.00 0.00 0.00 0.00 0.00 47.33 48.13 1fad h GLY 160 CO -0.22 -0.05 -0.01 -2.00 0.00 0.00 0.00 176.54 174.25 1fad h LEU 161 N -0.24 -0.03 -1.32 3.11 5.85 -1.07 -2.75 115.31 118.84 1fad h LEU 161 Ca -0.01 -0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.85 1fad h LEU 161 Cb 0.10 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.07 1fad h LEU 161 CO 0.02 -0.02 0.57 -0.37 -0.34 0.00 0.00 178.44 178.30 1fad h VAL 162 N -0.04 0.82 0.93 1.05 -1.51 0.13 1.30 116.25 118.92 1fad h VAL 162 Ca -0.00 -0.22 -0.04 0.00 -1.23 0.00 0.00 66.70 65.20 1fad h VAL 162 Cb 0.03 0.11 0.01 0.00 -2.13 0.00 0.00 31.29 29.31 1fad h VAL 162 CO 0.01 0.12 -0.48 0.50 -1.23 0.00 0.00 177.57 176.48 1fad h LYS 163 N 0.65 -1.25 -0.57 5.19 3.64 -1.20 -2.40 116.57 120.65 1fad h LYS 163 Ca 0.44 0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.80 1fad h LYS 163 Cb 0.76 0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 1fad h LYS 163 CO -0.20 -0.83 -0.08 0.00 -2.27 0.00 0.00 179.45 176.07 1fad h ALA 164 N -1.26 0.77 0.03 5.00 0.00 -1.20 -2.93 119.26 119.67 1fad h ALA 164 Ca -0.13 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.45 1fad h ALA 164 Cb 1.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1fad h ALA 164 CO 0.18 0.67 -0.25 1.25 0.00 0.00 0.00 179.25 181.11 1fad h LEU 165 N 0.94 -0.76 -0.79 0.00 5.85 0.17 -2.11 115.31 118.62 1fad h LEU 165 Ca 0.15 0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.82 1fad h LEU 165 Cb 0.65 0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 1fad h LEU 165 CO 0.04 -0.25 -0.53 0.08 -0.34 0.00 0.00 178.44 177.45 1fad h ARG 166 N -0.34 0.21 -1.01 1.25 0.11 -1.54 0.17 114.38 113.23 1fad h ARG 166 Ca 0.00 -0.13 0.01 0.00 0.10 0.00 0.00 59.98 59.97 1fad h ARG 166 Cb 0.35 0.01 -0.05 0.00 1.11 0.00 0.00 29.97 31.39 1fad h ARG 166 CO -0.15 0.69 0.67 1.15 0.10 0.00 0.00 179.97 182.43 1fad h THR 167 N 0.17 1.26 0.01 0.08 2.02 -1.40 -3.23 112.91 111.81 1fad h THR 167 Ca 0.00 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 1fad h THR 167 Cb 0.99 -0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1fad h THR 167 CO 0.08 0.25 -0.00 0.00 0.37 0.00 0.00 175.52 176.22 1fad n ARG 169 N -4.73 0.00 -1.16 0.00 0.63 -0.96 -5.03 116.66 105.42 1fad n ARG 169 Ca -0.04 0.00 -0.22 0.00 -0.92 0.00 0.00 57.85 56.67 1fad n ARG 169 Cb 0.18 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 32.98 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 6.50 -0.13 6.15 4.32 0.55 -4.59 117.00 129.79 1fad n LEU 170 Ca 0.00 -3.65 -0.00 0.00 -0.02 0.00 0.00 56.01 52.33 1fad n LEU 170 Cb 0.00 -1.45 0.26 0.00 -1.62 0.00 0.00 43.42 40.61 1fad n LEU 170 CO 0.00 1.83 1.11 -1.13 -1.22 0.00 0.00 177.39 177.98 1fad h ASN 171 N 3.67 0.74 0.04 -1.43 -0.73 -1.80 -2.86 115.58 113.20 1fad h ASN 171 Ca 0.43 -0.07 0.01 0.00 1.87 0.00 0.00 56.30 58.54 1fad h ASN 171 Cb 1.05 -0.19 -0.02 0.00 0.27 0.00 0.00 38.32 39.43 1fad h ASN 171 CO 0.79 0.63 -0.20 -0.07 -0.37 0.00 0.00 177.43 178.21 1fad h LEU 172 N 0.83 -0.60 -1.51 0.34 3.38 -1.97 0.53 115.31 116.30 1fad h LEU 172 Ca 0.21 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.21 1fad h LEU 172 Cb 0.08 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1fad h LEU 172 CO -0.03 -0.21 -0.01 -0.37 0.09 0.00 0.00 178.44 177.92 1fad h VAL 173 N -0.28 1.14 -0.68 1.22 -1.51 -1.91 -1.99 116.25 112.24 1fad h VAL 173 Ca -0.00 -0.54 0.03 0.00 -1.23 0.00 0.00 66.70 64.96 1fad h VAL 173 Cb 0.28 1.00 -0.04 0.00 -2.13 0.00 0.00 31.29 30.40 1fad h VAL 173 CO -0.11 0.18 0.43 0.00 -1.23 0.00 0.00 177.57 176.83 1fad h ALA 174 N 1.70 0.88 -0.73 5.19 0.00 -1.18 -1.82 119.26 123.30 1fad h ALA 174 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1fad h ALA 174 Cb 0.22 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1fad h ALA 174 CO 0.01 0.20 0.47 -0.44 0.00 0.00 0.00 179.25 179.49 1fad h ASP 175 N 0.84 0.85 0.36 0.00 3.32 -0.14 0.33 116.42 121.98 1fad h ASP 175 Ca 0.27 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 1fad h ASP 175 Cb 0.00 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.34 1fad h ASP 175 CO -0.10 0.63 -0.17 -0.07 -1.72 0.00 0.00 179.24 177.81 1fad h LEU 176 N 0.99 -0.41 -0.70 1.55 4.07 -1.17 0.49 115.31 120.13 1fad h LEU 176 Ca 0.27 -0.07 -0.05 0.00 0.08 0.00 0.00 57.88 58.10 1fad h LEU 176 Cb -0.09 0.11 -0.03 0.00 1.08 0.00 0.00 40.66 41.73 1fad h LEU 176 CO -0.06 -0.18 0.24 -0.37 -1.08 0.00 0.00 178.44 176.99 1fad h VAL 177 N -0.63 1.25 0.02 1.22 -1.51 -1.28 -0.68 116.25 114.65 1fad h VAL 177 Ca -0.05 -0.85 -0.00 0.00 -1.23 0.00 0.00 66.70 64.56 1fad h VAL 177 Cb 0.45 0.48 0.00 0.00 -2.13 0.00 0.00 31.29 30.10 1fad h VAL 177 CO 0.08 0.34 -0.01 -0.08 -1.23 0.00 0.00 177.57 176.67 1fad h GLU 178 N 1.02 -0.03 -0.35 5.19 4.81 -0.20 -1.54 114.58 123.48 1fad h GLU 178 Ca 0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1fad h GLU 178 Cb 0.28 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1fad h GLU 178 CO -0.01 0.03 0.23 0.93 -0.73 0.00 0.00 179.01 179.46 1fad h GLU 179 N -0.08 0.46 -0.54 1.92 5.08 0.21 -1.77 114.58 119.86 1fad h GLU 179 Ca -0.00 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.21 1fad h GLU 179 Cb 0.08 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1fad h GLU 179 CO 0.00 0.31 -0.14 0.00 -1.00 0.00 0.00 179.01 178.19 1fad h ALA 180 N 1.78 0.74 0.00 3.43 0.00 -0.56 -2.91 119.26 121.74 1fad h ALA 180 Ca 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1fad h ALA 180 Cb -0.05 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1fad h ALA 180 CO -0.03 0.68 0.00 0.00 0.00 0.00 0.00 179.25 179.90 1fad n GLN 181 N -4.13 0.26 -4.03 0.00 10.64 -0.63 -4.92 117.38 114.56 1fad n GLN 181 Ca 0.01 0.25 -0.32 0.00 -1.83 0.00 0.00 57.00 55.11 1fad n GLN 181 Cb 0.42 -1.83 0.00 0.00 -0.86 0.00 0.00 30.24 27.98 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 -2.29 -4.56 -0.34 2.61 1.02 -0.74 -5.11 120.64 111.24 1fad n GLU 182 Ca 0.05 0.51 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 1fad n GLU 182 Cb 0.41 -5.31 0.00 0.00 -0.02 0.00 0.00 31.44 26.51 1fad n GLU 182 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74