#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 -3.51 -1.65 0.00 0.00 -1.26 -4.80 120.51 109.28 1fad n ALA 90 Ca 0.00 -1.42 -0.43 0.00 0.00 0.00 0.00 53.44 51.59 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 -1.25 0.00 0.00 0.00 177.50 176.25 1fad s PRO 91 N -5.10 3.14 0.51 0.00 0.04 -1.26 -4.82 135.00 127.52 1fad s PRO 91 Ca 0.62 1.95 0.16 0.00 0.04 0.00 0.00 61.00 63.77 1fad s PRO 91 Cb -0.07 -4.36 1.23 0.00 0.04 0.00 0.00 34.50 31.34 1fad s PRO 91 CO 0.49 -2.09 2.13 -1.00 0.04 0.00 0.00 177.00 176.56 1fad h PRO 92 N 14.87 0.06 -1.37 0.56 0.13 -1.93 -1.82 132.00 142.49 1fad h PRO 92 Ca -0.40 -0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.35 1fad h PRO 92 Cb 1.23 -0.01 -0.17 0.00 0.13 0.00 0.00 31.00 32.18 1fad h PRO 92 CO 0.97 0.04 0.48 0.41 -0.23 0.00 0.00 178.00 179.67 1fad n GLY 93 N -1.54 4.28 0.28 1.56 0.00 -1.26 -4.53 105.19 103.98 1fad n GLY 93 Ca -0.02 -1.22 0.19 0.00 0.00 0.00 0.00 46.02 44.97 1fad n GLY 93 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1fad h GLU 94 N 1.43 0.00 -0.77 1.61 4.11 -1.72 -2.83 114.58 116.42 1fad h GLU 94 Ca 0.35 0.00 0.11 0.00 0.07 0.00 0.00 59.36 59.89 1fad h GLU 94 Cb 1.05 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.25 1fad h GLU 94 CO 0.87 0.00 0.50 0.00 0.07 0.00 0.00 179.01 180.45 1fad h ALA 95 N 2.02 1.85 0.38 1.06 0.00 -1.87 0.93 119.26 123.63 1fad h ALA 95 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1fad h ALA 95 Cb 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1fad h ALA 95 CO 0.00 -0.01 -0.18 -0.92 0.00 0.00 0.00 179.25 178.13 1fad h TYR 96 N 0.64 -0.47 0.00 0.00 5.03 -1.90 -2.46 116.97 117.81 1fad h TYR 96 Ca 0.36 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.65 1fad h TYR 96 Cb 0.53 0.16 -0.00 0.00 1.55 0.00 0.00 36.73 38.96 1fad h TYR 96 CO -0.00 -0.29 -0.04 1.37 -1.32 0.00 0.00 178.16 177.87 1fad h LEU 97 N -0.78 0.00 -0.72 2.82 -0.00 -1.69 -1.09 115.31 113.85 1fad h LEU 97 Ca -0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.80 1fad h LEU 97 Cb 0.39 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.02 1fad h LEU 97 CO 0.09 0.04 0.33 -0.61 -0.00 0.00 0.00 178.44 178.29 1fad h GLN 98 N 0.00 1.05 -0.09 0.17 4.15 0.96 1.28 115.11 122.64 1fad h GLN 98 Ca -0.00 -0.17 -0.00 0.00 0.77 0.00 0.00 58.65 59.25 1fad h GLN 98 Cb 0.12 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 27.62 1fad h GLN 98 CO 0.01 0.84 0.04 0.28 -1.93 0.00 0.00 178.83 178.06 1fad h VAL 99 N 1.02 1.13 -0.43 2.39 2.07 -0.71 -0.94 116.25 120.78 1fad h VAL 99 Ca 0.25 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1fad h VAL 99 Cb 0.14 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1fad h VAL 99 CO -0.03 0.12 0.21 0.00 0.02 0.00 0.00 177.57 177.89 1fad h ALA 100 N 0.89 0.56 -0.03 1.67 0.00 -1.20 -0.80 119.26 120.34 1fad h ALA 100 Ca 0.03 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1fad h ALA 100 Cb 0.15 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1fad h ALA 100 CO -0.00 0.12 0.20 0.74 0.00 0.00 0.00 179.25 180.30 1fad h PHE 101 N 0.56 0.00 0.00 0.00 -1.00 0.20 -1.38 116.94 115.32 1fad h PHE 101 Ca 0.15 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.90 1fad h PHE 101 Cb 0.12 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.67 1fad h PHE 101 CO -0.01 0.00 -0.21 0.22 -1.61 0.00 0.00 178.31 176.70 1fad h ASP 102 N 0.00 0.00 -0.61 2.17 1.82 0.26 -2.10 116.42 117.96 1fad h ASP 102 Ca 0.02 -0.59 -0.04 0.00 -0.39 0.00 0.00 57.03 56.03 1fad h ASP 102 Cb 0.41 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.39 1fad h ASP 102 CO -0.00 0.91 0.23 0.16 -1.61 0.00 0.00 179.24 178.93 1fad h ILE 103 N -1.00 1.24 -0.42 2.25 3.07 -1.23 -2.26 117.51 119.16 1fad h ILE 103 Ca -0.05 -0.75 -0.14 0.00 1.55 0.00 0.00 64.86 65.47 1fad h ILE 103 Cb 0.73 0.58 -0.01 0.00 -0.27 0.00 0.00 36.82 37.85 1fad h ILE 103 CO -0.03 0.29 -0.29 -0.37 -1.05 0.00 0.00 178.15 176.70 1fad h VAL 104 N 0.86 1.27 -0.18 0.16 -1.51 -1.41 -2.35 116.25 113.08 1fad h VAL 104 Ca 0.20 -1.46 0.00 0.00 -1.23 0.00 0.00 66.70 64.22 1fad h VAL 104 Cb 0.23 1.26 -0.01 0.00 -2.13 0.00 0.00 31.29 30.64 1fad h VAL 104 CO -0.01 0.49 0.11 0.00 -1.23 0.00 0.00 177.57 176.93 1fad n ASP 106 N -4.98 0.61 0.00 0.00 8.00 -0.87 -0.32 116.55 119.00 1fad n ASP 106 Ca -0.04 0.68 0.00 0.00 0.71 0.00 0.00 54.79 56.15 1fad n ASP 106 Cb 0.03 -0.80 0.00 0.00 -0.02 0.00 0.00 41.12 40.33 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 -2.21 0.00 -2.21 -2.24 2.85 0.18 -4.65 115.26 106.98 1fad n ASN 107 Ca 0.01 0.05 -0.30 0.00 -0.11 0.00 0.00 54.58 54.22 1fad n ASN 107 Cb 0.18 -0.12 0.08 0.00 1.24 0.00 0.00 39.78 41.16 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 -1.39 3.34 -0.40 3.44 3.14 0.63 -4.83 118.33 122.26 1fad n VAL 108 Ca 0.00 -3.08 -0.07 0.00 -2.96 0.00 0.00 64.34 58.24 1fad n VAL 108 Cb 0.00 -1.05 -0.04 0.00 -1.06 0.00 0.00 33.84 31.68 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 -0.91 -2.34 0.29 7.55 0.00 0.57 -0.09 105.19 110.25 1fad n GLY 109 Ca 0.58 1.14 0.15 0.00 0.00 0.00 0.00 46.02 47.89 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 -0.00 -1.88 -1.47 114.38 112.64 1fad h ARG 110 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.71 1fad h ARG 110 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.45 1fad h ARG 110 CO -0.95 0.04 0.00 -0.25 0.00 0.00 0.00 179.97 178.81 1fad n ASP 111 N -3.72 0.52 0.06 7.04 9.92 0.87 -1.52 116.55 129.72 1fad n ASP 111 Ca -0.03 0.64 -0.10 0.00 -0.53 0.00 0.00 54.79 54.77 1fad n ASP 111 Cb 0.13 -0.75 0.01 0.00 -0.64 0.00 0.00 41.12 39.86 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 0.50 -0.95 1.24 -0.00 -1.26 -2.17 115.95 113.31 1fad h TRP 112 Ca 0.00 -0.24 -0.00 0.00 -0.00 0.00 0.00 58.89 58.64 1fad h TRP 112 Cb 0.29 -0.07 -0.05 0.00 -0.00 0.00 0.00 29.16 29.34 1fad h TRP 112 CO 0.00 1.02 0.58 0.87 -0.00 0.00 0.00 178.44 180.91 1fad h LYS 113 N 0.22 1.28 -0.42 0.49 1.57 -1.41 0.95 116.57 119.25 1fad h LYS 113 Ca -0.05 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1fad h LYS 113 Cb 1.41 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 33.43 1fad h LYS 113 CO 0.14 0.89 0.27 -0.09 -0.57 0.00 0.00 179.45 180.08 1fad h ARG 114 N 1.30 0.57 0.00 3.15 2.43 -1.43 -1.12 114.38 119.28 1fad h ARG 114 Ca 0.34 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.40 1fad h ARG 114 Cb -0.07 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1fad h ARG 114 CO -0.06 0.40 -0.33 -0.07 -1.51 0.00 0.00 179.97 178.40 1fad h LEU 115 N 0.57 0.00 -0.37 3.80 3.38 -0.59 -2.86 115.31 119.23 1fad h LEU 115 Ca 0.15 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.14 1fad h LEU 115 Cb -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1fad h LEU 115 CO -0.03 0.33 0.21 0.00 0.09 0.00 0.00 178.44 179.04 1fad h ALA 116 N 1.67 0.46 -0.95 1.53 0.00 0.22 0.65 119.26 122.85 1fad h ALA 116 Ca -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fad h ALA 116 Cb 0.75 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1fad h ALA 116 CO 0.04 -0.14 0.58 0.00 0.00 0.00 0.00 179.25 179.73 1fad h ARG 117 N 0.43 1.28 -0.57 0.00 3.08 -1.23 -0.95 114.38 116.42 1fad h ARG 117 Ca 0.15 -0.11 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 1fad h ARG 117 Cb 0.02 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.78 1fad h ARG 117 CO -0.08 0.89 0.09 0.93 -1.07 0.00 0.00 179.97 180.74 1fad h GLU 118 N 1.31 0.92 0.00 0.04 4.39 -1.01 -1.27 114.58 118.96 1fad h GLU 118 Ca 0.34 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1fad h GLU 118 Cb -0.06 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.47 1fad h GLU 118 CO -0.06 0.86 0.00 1.28 -1.16 0.00 0.00 179.01 179.92 1fad n LEU 119 N -4.24 0.00 -2.99 1.33 4.77 0.22 -4.89 117.00 111.20 1fad n LEU 119 Ca 0.04 0.31 -0.15 0.00 -0.03 0.00 0.00 56.01 56.18 1fad n LEU 119 Cb 0.27 -0.31 0.07 0.00 -2.33 0.00 0.00 43.42 41.11 1fad n LEU 119 CO 0.41 -0.10 0.11 1.17 -1.33 0.00 0.00 177.39 177.66 1fad n LYS 120 N -1.31 -5.60 -2.47 3.23 4.81 -0.48 -4.98 118.16 111.36 1fad n LYS 120 Ca 0.09 0.69 -0.36 0.00 -0.87 0.00 0.00 58.31 57.87 1fad n LYS 120 Cb 0.18 -5.25 -0.03 0.00 0.02 0.00 0.00 35.03 29.95 1fad n LYS 120 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1fad s VAL 121 N -3.29 3.58 0.19 3.15 1.01 -1.04 -4.94 120.40 119.07 1fad s VAL 121 Ca 0.08 1.10 -0.33 0.00 0.00 0.00 0.00 61.98 62.84 1fad s VAL 121 Cb -0.04 -3.51 -0.14 0.00 0.00 0.00 0.00 36.38 32.69 1fad s VAL 121 CO 0.60 -0.10 1.45 -1.54 0.00 0.00 0.00 175.10 175.50 1fad n SER 122 N -0.58 2.68 0.20 3.32 3.41 -1.26 -4.83 113.62 116.55 1fad n SER 122 Ca 0.08 1.12 0.14 0.00 -0.26 0.00 0.00 58.87 59.95 1fad n SER 122 Cb 0.50 -1.39 0.76 0.00 -0.26 0.00 0.00 64.21 63.82 1fad n SER 122 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1fad h GLU 123 N 4.80 0.00 -0.16 4.33 3.07 -1.99 -1.76 114.58 122.87 1fad h GLU 123 Ca -0.45 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.42 1fad h GLU 123 Cb 1.28 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.17 1fad h GLU 123 CO 0.80 0.00 0.07 0.00 -1.40 0.00 0.00 179.01 178.48 1fad h ALA 124 N 1.88 0.18 -0.18 3.43 0.00 -1.99 0.41 119.26 122.99 1fad h ALA 124 Ca 0.07 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1fad h ALA 124 Cb 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1fad h ALA 124 CO -0.00 -0.37 0.07 0.87 0.00 0.00 0.00 179.25 179.82 1fad h LYS 125 N 0.15 0.28 -0.99 0.00 1.79 -1.69 -2.50 116.57 113.61 1fad h LYS 125 Ca 0.07 -0.05 0.01 0.00 -2.18 0.00 0.00 60.65 58.50 1fad h LYS 125 Cb 0.03 -0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 30.58 1fad h LYS 125 CO -0.06 0.36 0.66 0.52 -1.08 0.00 0.00 179.45 179.84 1fad h MET 126 N 0.14 1.29 -0.98 3.15 2.86 -1.23 -1.20 114.93 118.96 1fad h MET 126 Ca 0.06 -0.08 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1fad h MET 126 Cb 0.18 -0.29 -0.05 0.00 0.06 0.00 0.00 31.60 31.50 1fad h MET 126 CO -0.00 0.85 0.65 -0.44 1.06 0.00 0.00 176.91 179.03 1fad h ASP 127 N 1.33 1.13 0.13 1.22 3.32 0.12 -2.33 116.42 121.33 1fad h ASP 127 Ca 0.37 -0.03 -0.29 0.00 0.02 0.00 0.00 57.03 57.10 1fad h ASP 127 Cb -0.13 -0.28 0.02 0.00 0.22 0.00 0.00 39.33 39.16 1fad h ASP 127 CO -0.09 0.82 -1.18 1.23 -1.72 0.00 0.00 179.24 178.30 1fad h GLY 128 N 1.33 0.70 0.99 2.75 0.00 -1.00 -2.63 103.07 105.21 1fad h GLY 128 Ca 0.36 -1.38 -0.04 0.00 0.00 0.00 0.00 47.33 46.28 1fad h GLY 128 CO -0.08 1.22 -0.36 -2.22 0.00 0.00 0.00 176.54 175.09 1fad h ILE 129 N 0.30 0.26 -0.58 2.60 5.03 -1.05 0.27 117.51 124.35 1fad h ILE 129 Ca -0.16 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 64.54 1fad h ILE 129 Cb 1.84 0.26 -0.03 0.00 -3.03 0.00 0.00 36.82 35.86 1fad h ILE 129 CO 0.22 0.00 0.23 1.05 -0.68 0.00 0.00 178.15 178.98 1fad h GLU 130 N -1.00 0.86 0.05 2.37 4.11 -1.56 -0.97 114.58 118.43 1fad h GLU 130 Ca -0.10 -0.15 -0.00 0.00 0.07 0.00 0.00 59.36 59.17 1fad h GLU 130 Cb 0.77 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1fad h GLU 130 CO 0.16 0.73 -0.02 0.93 0.07 0.00 0.00 179.01 180.88 1fad h GLU 131 N 0.79 -0.07 -0.34 1.06 5.08 -1.40 -3.32 114.58 116.39 1fad h GLU 131 Ca 0.19 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.40 1fad h GLU 131 Cb 0.19 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1fad h GLU 131 CO -0.02 0.38 -0.42 0.87 -1.00 0.00 0.00 179.01 178.83 1fad h LYS 132 N -0.54 0.86 -4.49 2.33 1.57 -0.51 -3.40 116.57 112.39 1fad h LYS 132 Ca -0.01 -0.47 -0.71 0.00 -1.87 0.00 0.00 60.65 57.59 1fad h LYS 132 Cb 0.48 0.02 -0.28 0.00 0.08 0.00 0.00 32.23 32.53 1fad h LYS 132 CO 0.01 1.11 -0.50 0.71 -0.57 0.00 0.00 179.45 180.21 1fad s TYR 133 N -4.31 3.34 -0.32 -1.35 2.02 -0.37 -4.93 117.35 111.43 1fad s TYR 133 Ca -0.10 -1.57 0.22 0.00 -0.37 0.00 0.00 57.07 55.25 1fad s TYR 133 Cb 0.11 -2.85 0.15 0.00 -0.40 0.00 0.00 41.96 38.97 1fad s TYR 133 CO 0.87 -0.83 1.30 -1.00 -1.57 0.00 0.00 175.55 174.32 1fad h PRO 134 N 8.35 0.00 0.00 -1.71 0.13 -1.79 -3.41 132.00 133.57 1fad h PRO 134 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1fad h PRO 134 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1fad h PRO 134 CO 0.72 0.02 -0.04 -2.13 -0.23 0.00 0.00 178.00 176.34 1fad n ARG 135 N -2.88 0.00 -3.05 0.86 3.00 -1.26 -5.05 116.66 108.27 1fad n ARG 135 Ca 0.02 -0.32 -0.43 0.00 -0.00 0.00 0.00 57.85 57.11 1fad n ARG 135 Cb 0.55 -0.28 -0.06 0.00 0.00 0.00 0.00 32.46 32.67 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 -0.07 6.28 0.15 6.15 0.01 -1.26 -4.90 113.70 120.06 1fad s SER 136 Ca 0.00 -0.64 -0.14 0.00 1.31 0.00 0.00 55.95 56.48 1fad s SER 136 Cb 0.00 -2.34 0.04 0.00 0.21 0.00 0.00 66.02 63.93 1fad s SER 136 CO 0.00 -0.97 1.72 0.25 0.41 0.00 0.00 173.24 174.65 1fad h LEU 137 N 10.09 0.67 -0.50 2.44 5.85 -1.96 -2.64 115.31 129.25 1fad h LEU 137 Ca -0.27 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.26 1fad h LEU 137 Cb 1.09 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 1fad h LEU 137 CO 0.99 0.63 0.12 -1.28 -0.34 0.00 0.00 178.44 178.57 1fad h SER 138 N 0.66 0.76 -0.65 1.25 0.87 -1.92 -2.74 113.55 111.80 1fad h SER 138 Ca 0.17 -0.23 -0.09 0.00 -1.23 0.00 0.00 61.79 60.41 1fad h SER 138 Cb 0.16 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 1fad h SER 138 CO -0.02 0.80 0.07 -0.33 -0.53 0.00 0.00 176.83 176.82 1fad h GLU 139 N 0.69 1.10 0.08 2.24 4.39 -1.94 -2.66 114.58 118.48 1fad h GLU 139 Ca 0.16 -0.32 -0.00 0.00 0.34 0.00 0.00 59.36 59.54 1fad h GLU 139 Cb 0.33 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1fad h GLU 139 CO 0.00 1.03 -0.04 0.00 -1.16 0.00 0.00 179.01 178.84 1fad h ARG 140 N 1.01 -0.11 -0.52 2.33 3.08 -1.47 -3.35 114.38 115.36 1fad h ARG 140 Ca 0.19 0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 1fad h ARG 140 Cb 0.49 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1fad h ARG 140 CO 0.02 0.44 0.07 -0.39 -1.07 0.00 0.00 179.97 179.04 1fad h VAL 141 N -0.80 1.23 -0.56 2.04 -1.51 -1.58 -3.22 116.25 111.85 1fad h VAL 141 Ca -0.01 -0.90 0.11 0.00 -1.23 0.00 0.00 66.70 64.67 1fad h VAL 141 Cb 0.59 0.76 -0.08 0.00 -2.13 0.00 0.00 31.29 30.43 1fad h VAL 141 CO 0.02 0.33 0.07 0.03 -1.23 0.00 0.00 177.57 176.79 1fad h ARG 142 N 0.78 0.19 0.21 5.19 3.08 -1.60 0.72 114.38 122.95 1fad h ARG 142 Ca 0.16 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1fad h ARG 142 Cb 0.36 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1fad h ARG 142 CO 0.01 0.13 -0.10 1.49 -1.07 0.00 0.00 179.97 180.42 1fad h GLU 143 N 0.20 -0.27 -0.91 0.04 4.57 -1.70 0.47 114.58 116.98 1fad h GLU 143 Ca 0.29 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.47 1fad h GLU 143 Cb 0.43 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.04 1fad h GLU 143 CO -0.41 -0.05 0.51 0.77 -1.18 0.00 0.00 179.01 178.66 1fad h SER 144 N -0.46 1.13 -0.16 1.04 0.02 -1.53 -2.33 113.55 111.25 1fad h SER 144 Ca -0.03 -0.09 -0.15 0.00 -0.84 0.00 0.00 61.79 60.68 1fad h SER 144 Cb 0.35 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1fad h SER 144 CO 0.05 0.89 -0.42 -0.07 -1.14 0.00 0.00 176.83 176.14 1fad h LEU 145 N 1.27 0.76 -0.00 5.07 3.38 0.59 -3.00 115.31 123.38 1fad h LEU 145 Ca 0.32 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1fad h LEU 145 Cb 0.00 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 1fad h LEU 145 CO -0.05 1.08 0.00 0.50 0.09 0.00 0.00 178.44 180.06 1fad h LYS 146 N 0.57 0.00 -0.57 1.13 3.64 0.47 0.16 116.57 121.98 1fad h LYS 146 Ca 0.04 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1fad h LYS 146 Cb 0.97 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.76 1fad h LYS 146 CO 0.09 0.01 0.35 -0.39 -2.27 0.00 0.00 179.45 177.24 1fad h VAL 147 N -0.00 1.16 -0.53 2.00 -1.51 -1.48 -0.60 116.25 115.30 1fad h VAL 147 Ca 0.00 -0.35 -0.07 0.00 -1.23 0.00 0.00 66.70 65.05 1fad h VAL 147 Cb 0.00 0.37 -0.02 0.00 -2.13 0.00 0.00 31.29 29.51 1fad h VAL 147 CO -0.00 0.17 0.06 -0.25 -1.23 0.00 0.00 177.57 176.31 1fad h TRP 148 N 0.77 0.95 -0.83 5.19 7.01 -1.37 -2.53 115.95 125.15 1fad h TRP 148 Ca 0.21 -0.14 0.01 0.00 2.11 0.00 0.00 58.89 61.07 1fad h TRP 148 Cb -0.04 -0.26 -0.04 0.00 -2.10 0.00 0.00 29.16 26.72 1fad h TRP 148 CO -0.03 0.87 0.55 -0.22 -2.79 0.00 0.00 178.44 176.82 1fad h LYS 149 N 0.77 1.09 -0.72 2.65 3.64 -0.22 -2.53 116.57 121.25 1fad h LYS 149 Ca 0.16 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 1fad h LYS 149 Cb 0.45 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 1fad h LYS 149 CO 0.02 0.72 0.19 -0.97 -2.27 0.00 0.00 179.45 177.14 1fad h ASN 150 N 1.12 1.09 0.01 4.20 -0.73 -0.91 -3.19 115.58 117.17 1fad h ASN 150 Ca 0.31 -0.23 -0.00 0.00 1.87 0.00 0.00 56.30 58.25 1fad h ASN 150 Cb -0.12 -0.29 0.00 0.00 0.27 0.00 0.00 38.32 38.18 1fad h ASN 150 CO -0.07 1.03 -0.01 0.00 -0.37 0.00 0.00 177.43 178.01 1fad h ALA 151 N 1.10 -0.02 -2.45 1.57 0.00 -1.05 -3.41 119.26 115.01 1fad h ALA 151 Ca 0.23 -0.07 -0.54 0.00 0.00 0.00 0.00 54.91 54.53 1fad h ALA 151 Cb 0.36 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1fad h ALA 151 CO 0.00 -0.44 0.60 -1.21 0.00 0.00 0.00 179.25 178.20 1fad s GLU 152 N -5.64 4.41 0.00 0.00 0.41 -1.03 -4.98 118.70 111.87 1fad s GLU 152 Ca -0.14 1.77 0.00 0.00 -0.41 0.00 0.00 54.97 56.19 1fad s GLU 152 Cb 0.05 -3.40 0.00 0.00 -1.78 0.00 0.00 34.13 29.00 1fad s GLU 152 CO 0.66 -0.31 0.00 1.63 -0.49 0.00 0.00 175.26 176.75 1fad n LYS 153 N 4.23 0.00 0.05 1.61 4.01 -1.26 -3.76 118.16 123.04 1fad n LYS 153 Ca 0.10 0.00 -0.06 0.00 -0.51 0.00 0.00 58.31 57.83 1fad n LYS 153 Cb 0.46 -0.20 0.12 0.00 -0.51 0.00 0.00 35.03 34.90 1fad n LYS 153 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 1fad h LYS 154 N 0.00 0.39 0.00 1.97 3.64 -1.98 -2.78 116.57 117.82 1fad h LYS 154 Ca 0.00 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1fad h LYS 154 Cb 0.00 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1fad h LYS 154 CO 0.00 0.81 0.00 -1.71 -2.27 0.00 0.00 179.45 176.28 1fad n ASN 155 N -3.96 0.00 0.06 4.20 2.85 -1.26 -2.83 115.26 114.31 1fad n ASN 155 Ca -0.02 0.14 0.07 0.00 -0.11 0.00 0.00 54.58 54.66 1fad n ASN 155 Cb 0.56 -0.34 0.32 0.00 1.24 0.00 0.00 39.78 41.56 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 -1.34 1.41 -1.91 5.20 0.00 -1.05 -3.96 120.51 118.85 1fad n ALA 156 Ca 0.08 0.03 -0.28 0.00 0.00 0.00 0.00 53.44 53.27 1fad n ALA 156 Cb 0.17 -1.23 0.09 0.00 0.00 0.00 0.00 19.45 18.49 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 -3.45 4.47 0.13 0.00 1.04 -1.13 -4.65 113.70 110.11 1fad s SER 157 Ca 0.03 0.62 -0.19 0.00 0.48 0.00 0.00 55.95 56.90 1fad s SER 157 Cb 0.07 -1.12 -0.05 0.00 0.10 0.00 0.00 66.02 65.01 1fad s SER 157 CO 0.22 -1.89 1.78 -0.37 0.98 0.00 0.00 173.24 173.96 1fad h VAL 158 N -0.97 1.05 -1.19 5.02 -1.51 -1.91 -2.46 116.25 114.27 1fad h VAL 158 Ca -0.45 -0.10 0.35 0.00 -1.23 0.00 0.00 66.70 65.26 1fad h VAL 158 Cb 1.32 0.73 -0.10 0.00 -2.13 0.00 0.00 31.29 31.10 1fad h VAL 158 CO 0.62 0.05 0.79 0.00 -1.23 0.00 0.00 177.57 177.80 1fad h ALA 159 N 1.09 2.60 0.36 5.19 0.00 -1.93 1.03 119.26 127.60 1fad h ALA 159 Ca 0.08 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1fad h ALA 159 Cb -0.03 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1fad h ALA 159 CO -0.03 -1.08 -0.17 0.78 0.00 0.00 0.00 179.25 178.75 1fad h GLY 160 N 0.21 -0.51 0.97 0.00 0.00 -1.62 -2.85 103.07 99.27 1fad h GLY 160 Ca 0.68 0.19 -0.02 0.00 0.00 0.00 0.00 47.33 48.18 1fad h GLY 160 CO -0.28 -0.19 -0.18 -2.00 0.00 0.00 0.00 176.54 173.89 1fad h LEU 161 N -0.79 -0.43 -1.15 3.11 5.85 -0.96 -2.93 115.31 118.00 1fad h LEU 161 Ca -0.05 -0.01 0.21 0.00 0.84 0.00 0.00 57.88 58.87 1fad h LEU 161 Cb 0.37 0.11 -0.10 0.00 0.37 0.00 0.00 40.66 41.42 1fad h LEU 161 CO 0.08 -0.28 0.62 -0.37 -0.34 0.00 0.00 178.44 178.16 1fad h VAL 162 N -0.55 0.65 1.01 1.05 -1.51 0.90 1.53 116.25 119.33 1fad h VAL 162 Ca -0.05 -0.21 -0.05 0.00 -1.23 0.00 0.00 66.70 65.16 1fad h VAL 162 Cb 0.42 -0.02 0.01 0.00 -2.13 0.00 0.00 31.29 29.56 1fad h VAL 162 CO 0.09 0.11 -0.49 0.50 -1.23 0.00 0.00 177.57 176.55 1fad h LYS 163 N 0.62 -1.31 -0.41 5.19 3.64 -1.34 -2.64 116.57 120.32 1fad h LYS 163 Ca 0.57 0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.94 1fad h LYS 163 Cb 1.09 0.30 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 1fad h LYS 163 CO -0.34 -0.87 -0.18 0.00 -2.27 0.00 0.00 179.45 175.79 1fad h ALA 164 N -1.36 0.92 -0.23 5.00 0.00 -1.14 -2.91 119.26 119.54 1fad h ALA 164 Ca -0.14 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1fad h ALA 164 Cb 1.04 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1fad h ALA 164 CO 0.23 0.62 0.00 -0.11 0.00 0.00 0.00 179.25 179.99 1fad n LEU 165 N -4.13 0.00 0.15 0.00 7.94 0.52 -1.76 117.00 119.71 1fad n LEU 165 Ca 0.01 0.96 -0.00 0.00 -1.11 0.00 0.00 56.01 55.87 1fad n LEU 165 Cb 0.41 -0.46 0.24 0.00 0.53 0.00 0.00 43.42 44.14 1fad n LEU 165 CO 0.44 -0.46 0.59 0.08 -1.11 0.00 0.00 177.39 176.93 1fad h ARG 166 N 0.00 0.04 -1.00 1.96 0.11 -1.54 0.14 114.38 114.08 1fad h ARG 166 Ca 0.00 -0.02 0.01 0.00 0.10 0.00 0.00 59.98 60.07 1fad h ARG 166 Cb 0.00 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.03 1fad h ARG 166 CO 0.00 0.53 0.66 1.15 0.10 0.00 0.00 179.97 182.42 1fad h THR 167 N 0.03 1.26 0.04 0.08 2.02 -1.47 -3.17 112.91 111.70 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 0.90 -0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1fad h THR 167 CO 0.07 0.25 -0.02 0.00 0.37 0.00 0.00 175.52 176.19 1fad n ARG 169 N -4.75 0.00 -1.10 0.00 0.63 -0.89 -5.02 116.66 105.54 1fad n ARG 169 Ca -0.06 0.00 -0.17 0.00 -0.92 0.00 0.00 57.85 56.71 1fad n ARG 169 Cb 0.24 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 33.01 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 5.77 -0.04 6.15 4.32 0.44 -4.56 117.00 129.08 1fad n LEU 170 Ca 0.00 -3.42 0.02 0.00 -0.02 0.00 0.00 56.01 52.59 1fad n LEU 170 Cb 0.00 -1.41 0.36 0.00 -1.62 0.00 0.00 43.42 40.75 1fad n LEU 170 CO 0.00 1.75 1.13 -1.13 -1.22 0.00 0.00 177.39 177.92 1fad h ASN 171 N 3.23 0.55 0.11 -1.43 -0.73 -1.76 -3.00 115.58 112.55 1fad h ASN 171 Ca 0.29 -0.03 0.01 0.00 1.87 0.00 0.00 56.30 58.44 1fad h ASN 171 Cb 1.29 -0.14 -0.05 0.00 0.27 0.00 0.00 38.32 39.69 1fad h ASN 171 CO 0.48 0.44 -0.52 -0.07 -0.37 0.00 0.00 177.43 177.39 1fad h LEU 172 N 0.63 -1.58 -0.98 0.34 4.07 -1.96 -1.22 115.31 114.62 1fad h LEU 172 Ca 0.16 0.17 -0.07 0.00 0.08 0.00 0.00 57.88 58.22 1fad h LEU 172 Cb 0.01 0.58 -0.02 0.00 1.08 0.00 0.00 40.66 42.31 1fad h LEU 172 CO -0.03 -0.55 -0.04 -0.37 -1.08 0.00 0.00 178.44 176.38 1fad h VAL 173 N -0.73 1.24 -0.93 1.22 -1.51 -1.91 -2.52 116.25 111.11 1fad h VAL 173 Ca -0.00 -1.00 0.05 0.00 -1.23 0.00 0.00 66.70 64.51 1fad h VAL 173 Cb 0.74 0.96 -0.06 0.00 -2.13 0.00 0.00 31.29 30.81 1fad h VAL 173 CO -0.29 0.34 0.60 0.00 -1.23 0.00 0.00 177.57 176.99 1fad h ALA 174 N 1.31 1.25 -1.00 5.19 0.00 -1.32 -1.02 119.26 123.68 1fad h ALA 174 Ca 0.13 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1fad h ALA 174 Cb 0.46 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1fad h ALA 174 CO 0.02 0.42 0.65 -0.44 0.00 0.00 0.00 179.25 179.91 1fad h ASP 175 N 1.13 1.15 0.70 0.00 3.32 -0.79 -0.21 116.42 121.72 1fad h ASP 175 Ca 0.38 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.36 1fad h ASP 175 Cb 0.07 -0.29 0.01 0.00 0.22 0.00 0.00 39.33 39.34 1fad h ASP 175 CO -0.14 0.84 -0.34 -0.07 -1.72 0.00 0.00 179.24 177.82 1fad h LEU 176 N 1.35 -0.79 -0.95 1.55 3.38 -1.01 0.55 115.31 119.39 1fad h LEU 176 Ca 0.36 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1fad h LEU 176 Cb -0.14 0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 1fad h LEU 176 CO -0.08 -0.51 0.60 -0.37 0.09 0.00 0.00 178.44 178.17 1fad h VAL 177 N -1.02 1.26 0.02 1.22 -1.51 -1.40 0.34 116.25 115.15 1fad h VAL 177 Ca -0.10 -0.52 -0.00 0.00 -1.23 0.00 0.00 66.70 64.85 1fad h VAL 177 Cb 0.74 -0.11 0.00 0.00 -2.13 0.00 0.00 31.29 29.79 1fad h VAL 177 CO 0.16 0.26 -0.01 -0.08 -1.23 0.00 0.00 177.57 176.67 1fad h GLU 178 N 1.31 -0.02 -0.74 5.19 4.81 -0.89 -0.69 114.58 123.55 1fad h GLU 178 Ca 0.35 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 1fad h GLU 178 Cb -0.09 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 1fad h GLU 178 CO -0.07 0.10 0.37 0.93 -0.73 0.00 0.00 179.01 179.61 1fad h GLU 179 N -0.14 1.05 0.00 1.92 4.39 0.60 -1.53 114.58 120.86 1fad h GLU 179 Ca -0.00 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 1fad h GLU 179 Cb 0.13 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1fad h GLU 179 CO 0.00 0.80 -0.02 0.00 -1.16 0.00 0.00 179.01 178.63 1fad h ALA 180 N 1.36 1.01 0.00 3.43 0.00 -0.01 -3.34 119.26 121.72 1fad h ALA 180 Ca 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1fad h ALA 180 Cb 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1fad h ALA 180 CO -0.04 0.03 -0.00 0.37 0.00 0.00 0.00 179.25 179.61 1fad h GLN 181 N 0.00 0.00 -6.40 0.00 5.75 -0.07 -3.48 115.11 110.91 1fad h GLN 181 Ca -0.00 0.00 -0.49 0.00 -0.15 0.00 0.00 58.65 58.01 1fad h GLN 181 Cb 0.50 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 28.97 1fad h GLN 181 CO 0.00 0.00 -0.78 0.39 -2.65 0.00 0.00 178.83 175.80 1fad n GLU 182 N -2.03 -5.01 -0.34 1.69 1.02 -1.10 -5.12 120.64 109.75 1fad n GLU 182 Ca -0.00 0.55 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 1fad n GLU 182 Cb 0.00 -5.40 0.00 0.00 -0.02 0.00 0.00 31.44 26.02 1fad n GLU 182 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74