#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 -3.68 -1.68 0.00 0.00 -1.26 -4.79 120.51 109.10 1fad n ALA 90 Ca 0.00 -1.39 -0.43 0.00 0.00 0.00 0.00 53.44 51.62 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 -5.03 3.23 0.37 0.00 0.04 -1.26 -4.83 135.00 127.52 1fad s PRO 91 Ca 0.61 1.95 0.05 0.00 0.04 0.00 0.00 61.00 63.65 1fad s PRO 91 Cb -0.08 -4.33 0.71 0.00 0.04 0.00 0.00 34.50 30.84 1fad s PRO 91 CO 0.48 -1.99 1.98 -1.00 0.04 0.00 0.00 177.00 176.51 1fad h PRO 92 N 14.40 0.62 -1.57 0.56 0.13 -1.93 -2.06 132.00 142.15 1fad h PRO 92 Ca -0.40 -0.07 -0.26 0.00 -0.87 0.00 0.00 66.00 64.41 1fad h PRO 92 Cb 1.23 -0.12 -0.11 0.00 0.13 0.00 0.00 31.00 32.12 1fad h PRO 92 CO 0.97 0.48 0.33 0.41 -0.23 0.00 0.00 178.00 179.97 1fad n GLY 93 N -1.26 3.73 0.30 1.56 0.00 -1.26 -4.50 105.19 103.75 1fad n GLY 93 Ca 0.03 -0.85 0.17 0.00 0.00 0.00 0.00 46.02 45.37 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 1.31 0.00 -0.33 1.61 4.81 -1.76 -2.91 114.58 117.31 1fad h GLU 94 Ca 0.23 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.50 1fad h GLU 94 Cb 0.99 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.33 1fad h GLU 94 CO 0.60 0.04 0.10 0.00 -0.73 0.00 0.00 179.01 179.01 1fad h ALA 95 N 1.96 0.36 -0.24 2.92 0.00 -1.87 0.85 119.26 123.24 1fad h ALA 95 Ca -0.00 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1fad h ALA 95 Cb 0.14 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1fad h ALA 95 CO 0.00 -0.31 0.05 -0.92 0.00 0.00 0.00 179.25 178.08 1fad h TYR 96 N 0.23 0.42 -0.97 0.00 5.03 -1.90 -2.60 116.97 117.17 1fad h TYR 96 Ca 0.15 -0.05 0.01 0.00 2.58 0.00 0.00 58.73 61.41 1fad h TYR 96 Cb 0.14 -0.12 -0.05 0.00 1.55 0.00 0.00 36.73 38.25 1fad h TYR 96 CO -0.15 0.50 0.64 1.25 -1.32 0.00 0.00 178.16 179.08 1fad h LEU 97 N 0.21 1.13 -0.96 2.82 5.85 -1.42 -2.16 115.31 120.78 1fad h LEU 97 Ca 0.07 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1fad h LEU 97 Cb 0.30 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 1fad h LEU 97 CO 0.00 0.82 0.58 -0.61 -0.34 0.00 0.00 178.44 178.89 1fad h GLN 98 N 1.32 1.29 -0.04 1.25 4.15 0.92 0.27 115.11 124.28 1fad h GLN 98 Ca 0.36 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.66 1fad h GLN 98 Cb -0.14 -0.27 -0.00 0.00 0.21 0.00 0.00 27.48 27.28 1fad h GLN 98 CO -0.08 0.90 0.02 0.28 -1.93 0.00 0.00 178.83 178.03 1fad h VAL 99 N 1.32 1.01 -0.29 2.39 2.07 -1.01 -0.32 116.25 121.42 1fad h VAL 99 Ca 0.34 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.81 1fad h VAL 99 Cb -0.06 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1fad h VAL 99 CO -0.06 0.01 0.04 0.00 0.02 0.00 0.00 177.57 177.57 1fad h ALA 100 N 1.01 0.38 -0.02 1.67 0.00 -1.14 -2.04 119.26 119.13 1fad h ALA 100 Ca 0.01 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1fad h ALA 100 Cb -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1fad h ALA 100 CO -0.00 0.09 0.12 0.74 0.00 0.00 0.00 179.25 180.19 1fad h PHE 101 N 0.30 0.00 0.00 0.00 -1.00 -0.20 -1.67 116.94 114.37 1fad h PHE 101 Ca 0.09 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.83 1fad h PHE 101 Cb 0.36 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.91 1fad h PHE 101 CO 0.03 0.00 -0.21 0.22 -1.61 0.00 0.00 178.31 176.74 1fad h ASP 102 N 0.00 0.00 -0.67 2.17 1.82 -0.32 -2.04 116.42 117.38 1fad h ASP 102 Ca 0.01 -0.62 -0.02 0.00 -0.39 0.00 0.00 57.03 56.01 1fad h ASP 102 Cb 0.24 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.22 1fad h ASP 102 CO -0.00 0.93 0.35 0.16 -1.61 0.00 0.00 179.24 179.07 1fad h ILE 103 N -1.00 1.21 -0.37 2.25 3.07 -1.25 -1.44 117.51 119.98 1fad h ILE 103 Ca -0.05 -0.56 -0.16 0.00 1.55 0.00 0.00 64.86 65.64 1fad h ILE 103 Cb 0.77 0.36 -0.01 0.00 -0.27 0.00 0.00 36.82 37.67 1fad h ILE 103 CO -0.03 0.24 -0.38 -0.37 -1.05 0.00 0.00 178.15 176.56 1fad h VAL 104 N 0.92 1.27 -0.00 0.16 -1.51 -1.46 -2.61 116.25 113.02 1fad h VAL 104 Ca 0.23 -1.55 -0.00 0.00 -1.23 0.00 0.00 66.70 64.15 1fad h VAL 104 Cb 0.07 1.41 -0.00 0.00 -2.13 0.00 0.00 31.29 30.64 1fad h VAL 104 CO -0.03 0.52 0.00 0.00 -1.23 0.00 0.00 177.57 176.82 1fad h ASP 106 N -0.12 0.00 0.10 0.00 3.32 -1.30 0.79 116.42 119.22 1fad h ASP 106 Ca 0.00 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.72 1fad h ASP 106 Cb 0.12 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1fad h ASP 106 CO -0.00 0.00 -1.79 -1.13 -1.72 0.00 0.00 179.24 174.60 1fad h ASN 107 N 0.00 0.35 0.00 6.45 -0.73 -0.85 -3.44 115.58 117.36 1fad h ASN 107 Ca 0.00 -0.86 -0.22 0.00 1.87 0.00 0.00 56.30 57.10 1fad h ASN 107 Cb 0.17 -0.11 -0.15 0.00 0.27 0.00 0.00 38.32 38.50 1fad h ASN 107 CO 0.00 1.76 -0.35 0.55 -0.37 0.00 0.00 177.43 179.03 1fad n VAL 108 N -3.72 0.00 -0.34 2.57 3.14 0.84 -5.00 118.33 115.82 1fad n VAL 108 Ca -0.31 -1.42 0.11 0.00 -2.96 0.00 0.00 64.34 59.76 1fad n VAL 108 Cb 0.96 1.22 0.29 0.00 -1.06 0.00 0.00 33.84 35.25 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 2.43 1.67 1.57 7.55 0.00 0.54 0.09 103.07 116.92 1fad h GLY 109 Ca -0.21 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.79 1fad h GLY 109 CO 0.02 -0.05 0.20 3.21 0.00 0.00 0.00 176.54 179.92 1fad h ARG 110 N 0.73 0.00 0.00 4.80 -0.00 -1.87 0.72 114.38 118.76 1fad h ARG 110 Ca 0.55 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.99 1fad h ARG 110 Cb 0.82 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.79 1fad h ARG 110 CO -0.38 0.00 -0.15 -0.44 0.00 0.00 0.00 179.97 179.00 1fad h ASP 111 N 0.00 0.00 0.14 7.04 5.19 -1.37 -1.76 116.42 125.66 1fad h ASP 111 Ca 0.00 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.29 1fad h ASP 111 Cb 0.40 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.90 1fad h ASP 111 CO 0.00 0.15 -0.44 -0.50 -3.12 0.00 0.00 179.24 175.33 1fad h TRP 112 N 0.00 0.45 -0.91 4.55 -0.00 -1.02 -1.56 115.95 117.45 1fad h TRP 112 Ca -0.00 -0.13 -0.01 0.00 -0.00 0.00 0.00 58.89 58.74 1fad h TRP 112 Cb 0.53 -0.09 -0.04 0.00 -0.00 0.00 0.00 29.16 29.55 1fad h TRP 112 CO 0.00 0.75 0.51 0.87 -0.00 0.00 0.00 178.44 180.58 1fad h LYS 113 N 0.30 1.26 -0.12 0.49 1.79 -1.44 1.33 116.57 120.18 1fad h LYS 113 Ca 0.02 -0.14 -0.01 0.00 -2.18 0.00 0.00 60.65 58.35 1fad h LYS 113 Cb 0.90 -0.25 -0.00 0.00 -1.58 0.00 0.00 32.23 31.30 1fad h LYS 113 CO 0.08 0.91 0.04 -0.09 -1.08 0.00 0.00 179.45 179.30 1fad h ARG 114 N 1.27 0.18 0.00 3.15 2.43 -1.33 -2.59 114.38 117.48 1fad h ARG 114 Ca 0.32 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.36 1fad h ARG 114 Cb 0.01 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1fad h ARG 114 CO -0.05 0.31 -0.44 -0.07 -1.51 0.00 0.00 179.97 178.20 1fad h LEU 115 N 0.01 0.00 -0.19 3.80 3.38 -0.79 -2.94 115.31 118.58 1fad h LEU 115 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1fad h LEU 115 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1fad h LEU 115 CO -0.00 0.44 0.12 0.00 0.09 0.00 0.00 178.44 179.09 1fad h ALA 116 N 1.56 0.24 -0.96 1.53 0.00 0.21 0.56 119.26 122.40 1fad h ALA 116 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fad h ALA 116 Cb 0.87 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1fad h ALA 116 CO 0.06 -0.28 0.61 0.00 0.00 0.00 0.00 179.25 179.63 1fad h ARG 117 N 0.25 1.28 -0.80 0.00 3.08 -1.37 -0.07 114.38 116.75 1fad h ARG 117 Ca 0.07 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1fad h ARG 117 Cb -0.02 -0.28 -0.04 0.00 0.08 0.00 0.00 29.97 29.71 1fad h ARG 117 CO -0.02 0.87 0.32 0.93 -1.07 0.00 0.00 179.97 181.01 1fad h GLU 118 N 1.31 1.19 0.00 0.04 5.08 -1.14 -0.95 114.58 120.11 1fad h GLU 118 Ca 0.35 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1fad h GLU 118 Cb -0.11 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 28.95 1fad h GLU 118 CO -0.07 0.95 0.00 1.28 -1.00 0.00 0.00 179.01 180.17 1fad n LEU 119 N -4.28 0.00 -3.43 1.33 4.77 0.19 -4.90 117.00 110.68 1fad n LEU 119 Ca 0.07 0.26 -0.17 0.00 -0.03 0.00 0.00 56.01 56.14 1fad n LEU 119 Cb 0.18 -0.26 0.08 0.00 -2.33 0.00 0.00 43.42 41.10 1fad n LEU 119 CO 0.41 -0.07 0.08 0.29 -1.33 0.00 0.00 177.39 176.77 1fad n LYS 120 N -1.26 -5.86 -1.33 3.23 5.02 -0.17 -4.97 118.16 112.82 1fad n LYS 120 Ca 0.11 0.83 -0.31 0.00 -2.02 0.00 0.00 58.31 56.92 1fad n LYS 120 Cb 0.17 -5.79 0.09 0.00 -0.02 0.00 0.00 35.03 29.48 1fad n LYS 120 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1fad s VAL 121 N -3.39 3.39 -0.20 -0.18 -7.23 -1.02 -4.87 120.40 106.90 1fad s VAL 121 Ca 0.06 0.45 -0.36 0.00 -1.81 0.00 0.00 61.98 60.32 1fad s VAL 121 Cb -0.01 -3.01 -0.13 0.00 0.56 0.00 0.00 36.38 33.80 1fad s VAL 121 CO 0.74 -0.59 1.89 -1.20 -0.31 0.00 0.00 175.10 175.62 1fad n SER 122 N -3.48 2.91 0.06 4.85 7.64 -1.26 -4.81 113.62 119.54 1fad n SER 122 Ca 0.08 0.92 0.05 0.00 1.01 0.00 0.00 58.87 60.94 1fad n SER 122 Cb 0.54 -1.28 0.48 0.00 -1.01 0.00 0.00 64.21 62.94 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 9.07 0.40 0.08 1.43 5.08 -2.00 -2.40 114.58 126.24 1fad h GLU 123 Ca -0.45 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 57.90 1fad h GLU 123 Cb 1.29 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 1fad h GLU 123 CO 0.96 0.26 -0.14 0.00 -1.00 0.00 0.00 179.01 179.10 1fad h ALA 124 N 1.81 -0.23 -0.56 3.43 0.00 -2.00 0.27 119.26 121.98 1fad h ALA 124 Ca 0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1fad h ALA 124 Cb -0.02 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1fad h ALA 124 CO -0.03 -0.66 0.31 0.87 0.00 0.00 0.00 179.25 179.75 1fad h LYS 125 N -0.28 0.77 -0.93 0.00 1.57 -1.83 -2.03 116.57 113.85 1fad h LYS 125 Ca 0.02 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1fad h LYS 125 Cb 0.30 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 1fad h LYS 125 CO -0.08 0.58 0.61 0.52 -0.57 0.00 0.00 179.45 180.52 1fad h MET 126 N 0.75 1.23 -0.80 3.15 2.86 -1.13 0.97 114.93 121.96 1fad h MET 126 Ca 0.20 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.73 1fad h MET 126 Cb 0.03 -0.27 -0.04 0.00 0.06 0.00 0.00 31.60 31.38 1fad h MET 126 CO -0.03 0.82 0.38 0.22 1.06 0.00 0.00 176.91 179.36 1fad h ASP 127 N 1.26 1.04 -0.09 1.22 1.82 -0.54 -1.91 116.42 119.22 1fad h ASP 127 Ca 0.34 -0.14 -0.10 0.00 -0.39 0.00 0.00 57.03 56.75 1fad h ASP 127 Cb -0.14 -0.27 0.00 0.00 0.68 0.00 0.00 39.33 39.61 1fad h ASP 127 CO -0.07 0.89 -0.33 1.23 -1.61 0.00 0.00 179.24 179.35 1fad h GLY 128 N 1.13 0.42 1.00 -0.78 0.00 -0.67 -2.58 103.07 101.58 1fad h GLY 128 Ca 0.27 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1fad h GLY 128 CO -0.03 0.50 0.22 1.19 0.00 0.00 0.00 176.54 178.41 1fad h ILE 129 N -0.08 1.09 0.19 2.60 6.09 -0.75 -0.48 117.51 126.17 1fad h ILE 129 Ca -0.02 -0.16 -0.01 0.00 -1.37 0.00 0.00 64.86 63.31 1fad h ILE 129 Cb 0.96 0.61 0.00 0.00 0.47 0.00 0.00 36.82 38.86 1fad h ILE 129 CO 0.07 0.08 -0.09 -0.08 -3.07 0.00 0.00 178.15 175.06 1fad h GLU 130 N 0.44 -0.25 -0.19 2.19 4.81 -1.42 0.63 114.58 120.80 1fad h GLU 130 Ca 0.12 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 1fad h GLU 130 Cb -0.05 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1fad h GLU 130 CO -0.03 -0.14 0.09 0.93 -0.73 0.00 0.00 179.01 179.14 1fad h GLU 131 N -0.29 0.27 -0.36 1.92 5.08 -1.36 -3.06 114.58 116.78 1fad h GLU 131 Ca -0.03 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.13 1fad h GLU 131 Cb 0.23 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1fad h GLU 131 CO 0.04 0.30 -0.41 0.87 -1.00 0.00 0.00 179.01 178.81 1fad h LYS 132 N 0.18 0.89 -3.31 2.33 1.57 -1.05 -3.38 116.57 113.80 1fad h LYS 132 Ca 0.07 -0.48 -0.64 0.00 -1.87 0.00 0.00 60.65 57.72 1fad h LYS 132 Cb 0.11 0.02 -0.41 0.00 0.08 0.00 0.00 32.23 32.04 1fad h LYS 132 CO -0.01 1.13 -0.57 0.71 -0.57 0.00 0.00 179.45 180.14 1fad s TYR 133 N -4.34 3.35 -1.04 -1.35 2.02 0.22 -4.90 117.35 111.30 1fad s TYR 133 Ca -0.11 -3.18 0.28 0.00 -0.37 0.00 0.00 57.07 53.70 1fad s TYR 133 Cb 0.11 -2.84 1.11 0.00 -0.40 0.00 0.00 41.96 39.94 1fad s TYR 133 CO 0.88 -0.69 1.83 -0.35 -1.57 0.00 0.00 175.55 175.65 1fad n PRO 134 N 2.76 0.04 -0.03 -1.71 -0.04 -1.17 -4.18 135.00 130.68 1fad n PRO 134 Ca 0.10 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1fad n PRO 134 Cb 0.34 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.30 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 -1.47 0.00 -3.31 0.54 3.00 -1.26 -5.05 116.66 109.10 1fad n ARG 135 Ca 0.07 -0.41 -0.43 0.00 -0.00 0.00 0.00 57.85 57.09 1fad n ARG 135 Cb 0.33 -0.39 -0.09 0.00 0.00 0.00 0.00 32.46 32.32 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 6.20 0.16 6.15 0.01 -1.26 -4.92 113.70 120.00 1fad s SER 136 Ca 0.00 -0.63 -0.14 0.00 1.31 0.00 0.00 55.95 56.49 1fad s SER 136 Cb 0.00 -2.23 0.04 0.00 0.21 0.00 0.00 66.02 64.05 1fad s SER 136 CO 0.00 -0.58 1.72 0.25 0.41 0.00 0.00 173.24 175.04 1fad h LEU 137 N 9.07 0.70 -0.18 2.44 5.85 -1.96 -1.38 115.31 129.84 1fad h LEU 137 Ca -0.26 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.29 1fad h LEU 137 Cb 1.11 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 1fad h LEU 137 CO 0.79 0.66 0.07 -1.28 -0.34 0.00 0.00 178.44 178.34 1fad h SER 138 N 0.69 0.25 -0.53 1.25 0.87 -1.93 -2.79 113.55 111.37 1fad h SER 138 Ca 0.17 -0.17 -0.12 0.00 -1.23 0.00 0.00 61.79 60.44 1fad h SER 138 Cb 0.16 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 1fad h SER 138 CO -0.02 0.36 -0.14 -0.33 -0.53 0.00 0.00 176.83 176.17 1fad h GLU 139 N 0.13 1.03 0.40 2.24 4.39 -1.94 -1.58 114.58 119.25 1fad h GLU 139 Ca 0.06 -0.40 -0.02 0.00 0.34 0.00 0.00 59.36 59.34 1fad h GLU 139 Cb 0.19 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1fad h GLU 139 CO -0.00 1.09 -0.19 0.00 -1.16 0.00 0.00 179.01 178.74 1fad h ARG 140 N 0.90 -0.52 -0.42 2.33 3.08 -1.25 -3.31 114.38 115.18 1fad h ARG 140 Ca 0.13 0.04 -0.15 0.00 0.07 0.00 0.00 59.98 60.07 1fad h ARG 140 Cb 0.71 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 1fad h ARG 140 CO 0.05 -0.23 -0.32 -0.39 -1.07 0.00 0.00 179.97 178.02 1fad h VAL 141 N -0.80 1.27 -0.42 2.04 -1.51 -1.57 -3.29 116.25 111.97 1fad h VAL 141 Ca -0.06 -1.49 0.09 0.00 -1.23 0.00 0.00 66.70 64.01 1fad h VAL 141 Cb 0.54 1.28 -0.09 0.00 -2.13 0.00 0.00 31.29 30.89 1fad h VAL 141 CO 0.09 0.51 -0.17 0.03 -1.23 0.00 0.00 177.57 176.79 1fad h ARG 142 N 0.80 -0.09 -0.02 5.19 3.08 -1.37 0.99 114.38 122.97 1fad h ARG 142 Ca 0.08 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 1fad h ARG 142 Cb 0.91 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.98 1fad h ARG 142 CO 0.08 -0.06 0.01 1.49 -1.07 0.00 0.00 179.97 180.43 1fad h GLU 143 N -0.09 0.03 -0.80 0.04 4.57 -1.68 0.52 114.58 117.17 1fad h GLU 143 Ca 0.20 -0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.33 1fad h GLU 143 Cb 0.40 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.95 1fad h GLU 143 CO -0.48 0.13 0.32 0.77 -1.18 0.00 0.00 179.01 178.57 1fad h SER 144 N -0.09 1.11 -0.14 1.04 0.02 -1.49 -2.54 113.55 111.46 1fad h SER 144 Ca 0.01 -0.17 -0.10 0.00 -0.84 0.00 0.00 61.79 60.68 1fad h SER 144 Cb 0.11 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1fad h SER 144 CO -0.00 0.98 -0.25 -0.07 -1.14 0.00 0.00 176.83 176.35 1fad h LEU 145 N 1.17 0.60 -0.02 5.07 3.38 0.12 -2.86 115.31 122.76 1fad h LEU 145 Ca 0.27 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1fad h LEU 145 Cb 0.22 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1fad h LEU 145 CO -0.02 0.83 0.00 0.50 0.09 0.00 0.00 178.44 179.84 1fad h LYS 146 N 0.52 0.01 -0.62 1.13 3.64 -0.47 -0.39 116.57 120.38 1fad h LYS 146 Ca 0.07 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.36 1fad h LYS 146 Cb 0.70 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 1fad h LYS 146 CO 0.05 0.01 0.05 -0.39 -2.27 0.00 0.00 179.45 176.90 1fad h VAL 147 N 0.01 1.26 0.21 2.00 -1.51 -1.48 -1.48 116.25 115.26 1fad h VAL 147 Ca 0.01 -1.10 -0.01 0.00 -1.23 0.00 0.00 66.70 64.37 1fad h VAL 147 Cb 0.01 0.75 0.00 0.00 -2.13 0.00 0.00 31.29 29.92 1fad h VAL 147 CO -0.01 0.40 -0.10 -0.25 -1.23 0.00 0.00 177.57 176.38 1fad h TRP 148 N 0.98 -0.26 -0.62 5.19 7.01 -1.34 -2.61 115.95 124.30 1fad h TRP 148 Ca 0.18 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.18 1fad h TRP 148 Cb 0.51 0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 27.62 1fad h TRP 148 CO 0.04 0.05 0.41 1.57 -2.79 0.00 0.00 178.44 177.71 1fad h LYS 149 N -0.57 0.82 -0.52 2.65 2.10 -1.08 -1.49 116.57 118.48 1fad h LYS 149 Ca -0.03 -0.05 0.01 0.00 -2.00 0.00 0.00 60.65 58.58 1fad h LYS 149 Cb 0.42 -0.18 -0.03 0.00 -0.90 0.00 0.00 32.23 31.54 1fad h LYS 149 CO 0.05 0.55 0.34 -0.97 -2.00 0.00 0.00 179.45 177.42 1fad h ASN 150 N 0.84 0.59 -0.36 7.07 -0.73 -1.17 -2.76 115.58 119.08 1fad h ASN 150 Ca 0.23 -0.01 -0.10 0.00 1.87 0.00 0.00 56.30 58.28 1fad h ASN 150 Cb -0.09 -0.15 -0.01 0.00 0.27 0.00 0.00 38.32 38.35 1fad h ASN 150 CO -0.05 0.43 -0.17 0.00 -0.37 0.00 0.00 177.43 177.27 1fad h ALA 151 N 1.19 0.50 -2.11 1.57 0.00 -1.03 -3.41 119.26 115.97 1fad h ALA 151 Ca 0.19 -0.35 -0.56 0.00 0.00 0.00 0.00 54.91 54.19 1fad h ALA 151 Cb -0.08 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1fad h ALA 151 CO -0.04 0.43 0.97 -1.21 0.00 0.00 0.00 179.25 179.40 1fad s GLU 152 N -4.63 4.10 0.00 0.00 8.01 -0.61 -4.94 118.70 120.63 1fad s GLU 152 Ca -0.12 1.64 0.00 0.00 0.01 0.00 0.00 54.97 56.50 1fad s GLU 152 Cb 0.10 -3.86 0.00 0.00 -4.31 0.00 0.00 34.13 26.06 1fad s GLU 152 CO 0.82 -0.90 0.00 1.63 0.01 0.00 0.00 175.26 176.82 1fad n LYS 153 N 6.98 0.00 0.13 1.61 5.02 -1.26 -3.51 118.16 127.13 1fad n LYS 153 Ca 0.15 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 1fad n LYS 153 Cb 0.45 -0.27 0.30 0.00 -0.02 0.00 0.00 35.03 35.49 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 0.15 0.00 1.97 1.57 -1.97 -1.85 116.57 116.44 1fad h LYS 154 Ca 0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1fad h LYS 154 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1fad h LYS 154 CO 0.00 0.49 0.00 0.09 -0.57 0.00 0.00 179.45 179.46 1fad n ASN 155 N -4.09 0.00 0.01 0.86 4.13 -1.26 -2.95 115.26 111.96 1fad n ASN 155 Ca -0.01 -0.68 0.07 0.00 1.68 0.00 0.00 54.58 55.64 1fad n ASN 155 Cb 0.42 -0.04 0.31 0.00 -1.54 0.00 0.00 39.78 38.93 1fad n ASN 155 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1fad n ALA 156 N -1.04 1.64 -1.98 5.41 0.00 -0.70 -4.12 120.51 119.72 1fad n ALA 156 Ca 0.18 -0.04 -0.26 0.00 0.00 0.00 0.00 53.44 53.32 1fad n ALA 156 Cb 0.10 -1.24 0.05 0.00 0.00 0.00 0.00 19.45 18.37 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 -3.07 5.12 0.20 0.00 1.04 -1.15 -4.68 113.70 111.15 1fad s SER 157 Ca 0.07 0.56 -0.12 0.00 0.48 0.00 0.00 55.95 56.94 1fad s SER 157 Cb 0.09 -1.34 0.12 0.00 0.10 0.00 0.00 66.02 64.99 1fad s SER 157 CO 0.26 -1.39 1.86 -0.37 0.98 0.00 0.00 173.24 174.59 1fad h VAL 158 N -0.44 1.17 -1.34 5.02 -1.51 -1.92 -1.63 116.25 115.60 1fad h VAL 158 Ca -0.45 -0.31 0.40 0.00 -1.23 0.00 0.00 66.70 65.10 1fad h VAL 158 Cb 1.29 0.19 -0.08 0.00 -2.13 0.00 0.00 31.29 30.56 1fad h VAL 158 CO 0.60 0.17 0.92 0.00 -1.23 0.00 0.00 177.57 178.03 1fad h ALA 159 N 1.24 2.99 0.16 5.19 0.00 -1.93 1.13 119.26 128.03 1fad h ALA 159 Ca 0.24 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1fad h ALA 159 Cb -0.10 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1fad h ALA 159 CO -0.05 -1.46 -0.08 0.78 0.00 0.00 0.00 179.25 178.44 1fad h GLY 160 N 0.10 -0.22 0.98 0.00 0.00 -1.48 -2.83 103.07 99.61 1fad h GLY 160 Ca 0.71 0.08 -0.03 0.00 0.00 0.00 0.00 47.33 48.09 1fad h GLY 160 CO -0.17 -0.08 0.21 -2.00 0.00 0.00 0.00 176.54 174.50 1fad h LEU 161 N -0.40 0.72 -1.01 3.11 5.85 -1.07 -2.71 115.31 119.81 1fad h LEU 161 Ca -0.02 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.55 1fad h LEU 161 Cb 0.16 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1fad h LEU 161 CO 0.04 0.69 0.67 -0.37 -0.34 0.00 0.00 178.44 179.12 1fad h VAL 162 N 0.71 1.24 0.45 1.05 -1.51 0.11 0.86 116.25 119.16 1fad h VAL 162 Ca 0.18 -0.46 -0.02 0.00 -1.23 0.00 0.00 66.70 65.16 1fad h VAL 162 Cb 0.19 -0.22 0.00 0.00 -2.13 0.00 0.00 31.29 29.14 1fad h VAL 162 CO -0.01 0.25 -0.22 0.50 -1.23 0.00 0.00 177.57 176.86 1fad h LYS 163 N 1.35 -0.58 0.21 5.19 3.64 -1.39 -1.91 116.57 123.07 1fad h LYS 163 Ca 0.37 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.78 1fad h LYS 163 Cb -0.13 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1fad h LYS 163 CO -0.09 -0.37 -0.10 0.00 -2.27 0.00 0.00 179.45 176.63 1fad h ALA 164 N -0.09 -0.28 -0.91 5.00 0.00 -1.12 -2.51 119.26 119.34 1fad h ALA 164 Ca -0.06 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.69 1fad h ALA 164 Cb 0.48 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1fad h ALA 164 CO 0.10 -0.49 0.60 1.37 0.00 0.00 0.00 179.25 180.83 1fad h LEU 165 N -0.60 1.04 -0.19 0.00 8.10 0.69 -1.75 115.31 122.59 1fad h LEU 165 Ca -0.03 -0.02 -0.17 0.00 0.11 0.00 0.00 57.88 57.77 1fad h LEU 165 Cb 0.44 -0.25 0.00 0.00 -0.44 0.00 0.00 40.66 40.41 1fad h LEU 165 CO 0.05 0.74 -0.56 -0.09 -4.11 0.00 0.00 178.44 174.47 1fad h ARG 166 N 1.22 0.72 -0.99 0.17 2.43 -1.42 0.67 114.38 117.18 1fad h ARG 166 Ca 0.34 -0.51 0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1fad h ARG 166 Cb -0.11 0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 1fad h ARG 166 CO -0.08 1.13 0.66 1.15 -1.51 0.00 0.00 179.97 181.32 1fad h THR 167 N 0.43 1.25 0.27 0.20 2.02 -1.25 -3.22 112.91 112.62 1fad h THR 167 Ca -0.02 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1fad h THR 167 Cb 1.18 -0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 1fad h THR 167 CO 0.12 0.24 -0.13 0.00 0.37 0.00 0.00 175.52 176.12 1fad n ARG 169 N -5.02 0.00 -1.09 0.00 0.63 -0.69 -5.03 116.66 105.46 1fad n ARG 169 Ca -0.06 0.00 -0.15 0.00 -0.92 0.00 0.00 57.85 56.72 1fad n ARG 169 Cb 0.18 0.00 -0.15 0.00 0.45 0.00 0.00 32.46 32.95 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 5.52 0.01 6.15 4.32 0.23 -4.59 117.00 128.64 1fad n LEU 170 Ca 0.00 -3.36 0.21 0.00 -0.02 0.00 0.00 56.01 52.84 1fad n LEU 170 Cb 0.00 -1.39 0.72 0.00 -1.62 0.00 0.00 43.42 41.13 1fad n LEU 170 CO 0.00 1.71 1.19 -1.13 -1.22 0.00 0.00 177.39 177.94 1fad h ASN 171 N 3.04 0.00 0.28 -1.43 -0.73 -1.80 -2.84 115.58 112.10 1fad h ASN 171 Ca 0.24 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.40 1fad h ASN 171 Cb 1.36 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.94 1fad h ASN 171 CO 0.37 0.00 -0.23 -0.07 -0.37 0.00 0.00 177.43 177.13 1fad h LEU 172 N 0.00 -0.61 -1.69 0.34 3.38 -1.95 -0.97 115.31 113.82 1fad h LEU 172 Ca 0.25 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 1fad h LEU 172 Cb 1.07 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1fad h LEU 172 CO -0.00 -0.32 0.16 -0.37 0.09 0.00 0.00 178.44 178.00 1fad h VAL 173 N -0.50 1.08 -0.93 1.22 -1.51 -1.87 -1.50 116.25 112.24 1fad h VAL 173 Ca -0.04 -0.19 0.01 0.00 -1.23 0.00 0.00 66.70 65.25 1fad h VAL 173 Cb 0.42 0.70 -0.05 0.00 -2.13 0.00 0.00 31.29 30.23 1fad h VAL 173 CO 0.00 0.09 0.61 0.00 -1.23 0.00 0.00 177.57 177.03 1fad h ALA 174 N 1.80 1.19 -0.65 5.19 0.00 -1.27 -2.29 119.26 123.23 1fad h ALA 174 Ca 0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1fad h ALA 174 Cb -0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.38 1fad h ALA 174 CO -0.02 0.60 0.14 -0.44 0.00 0.00 0.00 179.25 179.53 1fad h ASP 175 N 1.27 1.00 0.59 0.00 3.32 -0.11 -0.90 116.42 121.59 1fad h ASP 175 Ca 0.34 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 1fad h ASP 175 Cb -0.12 -0.26 0.01 0.00 0.22 0.00 0.00 39.33 39.17 1fad h ASP 175 CO -0.07 0.98 -0.28 -0.07 -1.72 0.00 0.00 179.24 178.08 1fad h LEU 176 N 0.97 -0.67 -0.92 1.55 4.07 -1.18 0.17 115.31 119.30 1fad h LEU 176 Ca 0.20 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.15 1fad h LEU 176 Cb 0.39 0.17 -0.04 0.00 1.08 0.00 0.00 40.66 42.25 1fad h LEU 176 CO 0.01 -0.42 0.56 -0.37 -1.08 0.00 0.00 178.44 177.13 1fad h VAL 177 N -0.86 1.25 0.24 1.22 -1.51 -1.47 -0.31 116.25 114.80 1fad h VAL 177 Ca -0.08 -0.55 -0.01 0.00 -1.23 0.00 0.00 66.70 64.83 1fad h VAL 177 Cb 0.63 -0.05 0.00 0.00 -2.13 0.00 0.00 31.29 29.74 1fad h VAL 177 CO 0.13 0.26 -0.11 -0.08 -1.23 0.00 0.00 177.57 176.54 1fad h GLU 178 N 1.27 -0.31 -0.75 5.19 4.81 -0.97 -1.39 114.58 122.42 1fad h GLU 178 Ca 0.33 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.59 1fad h GLU 178 Cb -0.06 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.35 1fad h GLU 178 CO -0.06 -0.17 0.50 0.93 -0.73 0.00 0.00 179.01 179.47 1fad h GLU 179 N -0.36 0.99 -0.59 1.92 5.08 -0.38 -0.43 114.58 120.82 1fad h GLU 179 Ca -0.03 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1fad h GLU 179 Cb 0.27 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1fad h GLU 179 CO 0.05 0.66 0.29 0.00 -1.00 0.00 0.00 179.01 179.01 1fad h ALA 180 N 1.53 0.76 0.00 3.43 0.00 -0.72 -2.87 119.26 121.38 1fad h ALA 180 Ca 0.28 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 1fad h ALA 180 Cb -0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1fad h ALA 180 CO -0.06 0.31 -0.53 1.96 0.00 0.00 0.00 179.25 180.93 1fad h GLN 181 N 0.80 0.00 -5.11 0.00 4.20 -0.50 -3.47 115.11 111.03 1fad h GLN 181 Ca 0.20 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.53 1fad h GLN 181 Cb 0.10 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.84 1fad h GLN 181 CO -0.03 0.53 -0.56 0.39 -0.67 0.00 0.00 178.83 178.49 1fad n GLU 182 N -3.48 -3.80 -0.24 1.46 1.02 -0.24 -5.11 120.64 110.25 1fad n GLU 182 Ca 0.00 0.61 0.00 0.00 -0.02 0.00 0.00 57.16 57.75 1fad n GLU 182 Cb 0.64 -5.36 0.00 0.00 -0.02 0.00 0.00 31.44 26.70 1fad n GLU 182 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74