#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ff9 s PRO 76 N -3.09 1.21 0.44 0.00 0.04 -1.26 -4.88 135.00 127.46 3ff9 s PRO 76 Ca 0.71 1.11 -0.26 0.00 0.04 0.00 0.00 61.00 62.60 3ff9 s PRO 76 Cb -0.28 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.39 3ff9 s PRO 76 CO 0.32 -2.36 1.45 -0.89 0.04 0.00 0.00 177.00 175.56 3ff9 n ILE 77 N -4.00 2.69 0.00 0.56 2.08 -1.26 -1.67 119.36 117.76 3ff9 n ILE 77 Ca 0.08 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.89 3ff9 n ILE 77 Cb 0.54 -1.88 0.00 0.00 -0.75 0.00 0.00 39.64 37.55 3ff9 n ILE 77 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 3ff9 n LEU 78 N -0.11 0.00 -4.95 1.39 4.77 -1.26 -5.02 117.00 111.82 3ff9 n LEU 78 Ca 0.05 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.80 3ff9 n LEU 78 Cb 0.41 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 3ff9 n LEU 78 CO 0.60 0.00 0.22 0.26 -1.33 0.00 0.00 177.39 177.14 3ff9 s TRP 79 N -2.19 3.29 -0.03 -1.77 0.52 -0.67 -4.64 118.94 113.45 3ff9 s TRP 79 Ca 0.00 0.20 0.05 0.00 0.02 0.00 0.00 56.10 56.37 3ff9 s TRP 79 Cb 0.00 -2.15 -0.01 0.00 -1.15 0.00 0.00 33.47 30.16 3ff9 s TRP 79 CO 0.00 -0.17 -0.19 0.99 0.02 0.00 0.00 176.95 177.60 3ff9 s THR 80 N -2.43 1.53 0.13 2.01 2.01 0.25 -4.84 115.64 114.29 3ff9 s THR 80 Ca 0.45 -0.80 -0.06 0.00 0.31 0.00 0.00 61.69 61.60 3ff9 s THR 80 Cb -0.10 -1.29 -0.06 0.00 0.01 0.00 0.00 72.50 71.06 3ff9 s THR 80 CO 0.36 0.44 0.38 -0.60 -0.69 0.00 0.00 174.62 174.51 3ff9 s ARG 81 N -0.19 3.64 -0.30 4.92 3.52 -1.26 0.77 118.95 130.04 3ff9 s ARG 81 Ca 0.01 -0.05 -0.07 0.00 -0.13 0.00 0.00 55.73 55.49 3ff9 s ARG 81 Cb -0.10 -2.87 0.17 0.00 -1.56 0.00 0.00 34.95 30.59 3ff9 s ARG 81 CO 0.01 0.48 0.75 1.21 -0.81 0.00 0.00 175.30 176.95 3ff9 s ASN 82 N -2.31 -1.05 1.56 -2.12 2.47 -0.96 -4.97 114.94 107.57 3ff9 s ASN 82 Ca 0.39 0.86 0.00 0.00 0.42 0.00 0.00 52.86 54.54 3ff9 s ASN 82 Cb -0.12 1.96 0.00 0.00 -1.45 0.00 0.00 41.25 41.64 3ff9 s ASN 82 CO 0.23 -0.20 0.00 0.61 -3.72 0.00 0.00 177.10 174.03 3ff9 n GLY 83 N 5.39 2.96 1.07 1.21 0.00 -1.26 -2.61 105.19 111.94 3ff9 n GLY 83 Ca -0.05 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.84 3ff9 n GLY 83 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ff9 n SER 84 N 7.83 4.08 -4.30 1.61 3.41 -1.26 -5.00 113.62 119.99 3ff9 n SER 84 Ca 0.00 -2.77 -0.16 0.00 -0.26 0.00 0.00 58.87 55.68 3ff9 n SER 84 Cb 0.00 -0.51 -0.10 0.00 -0.26 0.00 0.00 64.21 63.33 3ff9 n SER 84 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3ff9 s HIS 85 N -2.40 1.47 -0.07 7.33 3.76 -1.07 -1.34 115.29 122.96 3ff9 s HIS 85 Ca 0.42 -0.83 0.02 0.00 -0.15 0.00 0.00 55.06 54.52 3ff9 s HIS 85 Cb 0.31 -0.81 -0.02 0.00 1.11 0.00 0.00 32.58 33.17 3ff9 s HIS 85 CO 0.13 0.04 -0.14 0.00 -0.85 0.00 0.00 174.74 173.92 3ff9 s TYR 87 N -0.39 2.23 -0.17 0.00 1.51 0.23 -1.69 117.35 119.07 3ff9 s TYR 87 Ca 0.04 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.72 3ff9 s TYR 87 Cb -0.12 -1.25 0.02 0.00 -0.11 0.00 0.00 41.96 40.50 3ff9 s TYR 87 CO 0.02 0.26 -0.20 -0.47 -1.11 0.00 0.00 175.55 174.05 3ff9 s TYR 88 N -0.99 2.71 -0.33 2.71 6.14 -0.48 0.84 117.35 127.96 3ff9 s TYR 88 Ca 0.12 -1.57 -0.08 0.00 0.64 0.00 0.00 57.07 56.19 3ff9 s TYR 88 Cb -0.10 -1.88 0.02 0.00 0.42 0.00 0.00 41.96 40.42 3ff9 s TYR 88 CO 0.05 -0.77 0.12 -0.06 0.64 0.00 0.00 175.55 175.53 3ff9 s PHE 89 N 1.22 3.20 0.76 4.97 0.08 -1.26 -1.09 117.98 125.87 3ff9 s PHE 89 Ca 0.03 -1.07 -0.11 0.00 0.12 0.00 0.00 56.93 55.90 3ff9 s PHE 89 Cb -0.13 -2.31 0.05 0.00 -0.57 0.00 0.00 43.02 40.05 3ff9 s PHE 89 CO -0.11 -0.63 1.08 -1.54 -0.10 0.00 0.00 175.22 173.92 3ff9 s SER 90 N 1.49 4.71 -0.15 1.36 1.04 -0.56 -4.97 113.70 116.62 3ff9 s SER 90 Ca 0.01 1.67 0.03 0.00 0.48 0.00 0.00 55.95 58.14 3ff9 s SER 90 Cb -0.18 -2.43 -0.11 0.00 0.10 0.00 0.00 66.02 63.39 3ff9 s SER 90 CO 0.04 -1.88 -0.11 0.80 0.98 0.00 0.00 173.24 173.07 3ff9 n MET 91 N -3.41 0.66 -1.51 4.02 1.56 -1.26 -4.66 117.12 112.52 3ff9 n MET 91 Ca 0.08 0.07 -0.30 0.00 -0.27 0.00 0.00 57.70 57.29 3ff9 n MET 91 Cb 0.54 -1.31 0.11 0.00 2.15 0.00 0.00 33.22 34.70 3ff9 n MET 91 CO 0.00 0.00 0.00 -1.21 -0.73 0.00 0.00 175.97 174.03 3ff9 s GLU 92 N -2.31 1.79 -0.06 2.12 2.02 -1.26 -4.91 118.70 116.09 3ff9 s GLU 92 Ca -0.19 0.58 0.05 0.00 0.02 0.00 0.00 54.97 55.44 3ff9 s GLU 92 Cb 0.05 -1.89 -0.01 0.00 0.10 0.00 0.00 34.13 32.38 3ff9 s GLU 92 CO 0.39 -1.81 -0.23 0.15 0.02 0.00 0.00 175.26 173.78 3ff9 s LYS 93 N -5.16 2.61 0.07 1.61 1.02 -1.26 -4.09 119.74 114.54 3ff9 s LYS 93 Ca 0.62 -0.87 0.00 0.00 0.02 0.00 0.00 55.97 55.74 3ff9 s LYS 93 Cb -0.15 -2.22 -0.04 0.00 -0.52 0.00 0.00 37.83 34.90 3ff9 s LYS 93 CO 0.54 0.39 -0.05 0.15 -0.92 0.00 0.00 175.35 175.47 3ff9 s LYS 94 N -0.17 0.70 1.01 1.68 1.02 -0.43 -4.70 119.74 118.86 3ff9 s LYS 94 Ca -0.03 -1.24 -0.15 0.00 0.02 0.00 0.00 55.97 54.57 3ff9 s LYS 94 Cb -0.14 0.01 0.20 0.00 -0.52 0.00 0.00 37.83 37.38 3ff9 s LYS 94 CO 0.04 -0.06 1.16 0.16 -0.92 0.00 0.00 175.35 175.72 3ff9 s ASP 95 N -2.90 2.62 0.12 2.83 3.84 -1.26 -1.16 116.67 120.76 3ff9 s ASP 95 Ca 0.08 0.77 -0.20 0.00 -0.00 0.00 0.00 52.55 53.20 3ff9 s ASP 95 Cb 0.06 -1.17 -0.06 0.00 -1.38 0.00 0.00 42.92 40.37 3ff9 s ASP 95 CO -0.07 -3.09 1.75 -0.25 -0.00 0.00 0.00 175.17 173.51 3ff9 h TRP 96 N -1.87 0.12 -0.66 2.11 7.01 -1.58 -1.42 115.95 119.66 3ff9 h TRP 96 Ca -0.48 0.01 0.07 0.00 2.11 0.00 0.00 58.89 60.60 3ff9 h TRP 96 Cb 1.30 -0.03 -0.06 0.00 -2.10 0.00 0.00 29.16 28.27 3ff9 h TRP 96 CO -0.63 0.06 0.34 -0.91 -2.79 0.00 0.00 178.44 174.51 3ff9 h ASN 97 N 0.15 0.46 0.43 2.65 2.35 -1.93 -1.31 115.58 118.39 3ff9 h ASN 97 Ca 0.07 0.05 -0.11 0.00 -0.55 0.00 0.00 56.30 55.76 3ff9 h ASN 97 Cb 0.04 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 3ff9 h ASN 97 CO -0.07 0.29 -0.51 0.28 -1.65 0.00 0.00 177.43 175.77 3ff9 h SER 98 N 0.60 0.09 -0.53 5.81 0.02 -1.87 -2.36 113.55 115.31 3ff9 h SER 98 Ca 0.31 -0.05 -0.11 0.00 -0.84 0.00 0.00 61.79 61.10 3ff9 h SER 98 Cb 0.27 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3ff9 h SER 98 CO -0.22 0.59 -0.11 0.28 -1.14 0.00 0.00 176.83 176.23 3ff9 h SER 99 N 0.07 1.02 -0.06 3.07 0.02 -0.49 -2.06 113.55 115.12 3ff9 h SER 99 Ca -0.00 -0.35 -0.00 0.00 -0.84 0.00 0.00 61.79 60.60 3ff9 h SER 99 Cb 0.92 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 3ff9 h SER 99 CO 0.07 1.13 0.03 0.25 -1.14 0.00 0.00 176.83 177.18 3ff9 h LEU 100 N 0.89 0.07 -0.81 5.07 5.85 -1.02 -2.24 115.31 123.11 3ff9 h LEU 100 Ca 0.14 -0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.92 3ff9 h LEU 100 Cb 0.67 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.62 3ff9 h LEU 100 CO 0.05 0.08 0.47 0.11 -0.34 0.00 0.00 178.44 178.80 3ff9 h LYS 101 N 0.05 0.77 0.11 1.25 1.57 -1.27 0.38 116.57 119.43 3ff9 h LYS 101 Ca 0.02 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3ff9 h LYS 101 Cb 0.02 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.16 3ff9 h LYS 101 CO -0.00 0.51 -0.05 0.35 -0.57 0.00 0.00 179.45 179.68 3ff9 h PHE 102 N 0.79 -0.14 -0.47 -1.35 3.04 -1.08 0.14 116.94 117.87 3ff9 h PHE 102 Ca 0.39 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.33 3ff9 h PHE 102 Cb 0.33 0.05 -0.02 0.00 2.56 0.00 0.00 35.95 38.87 3ff9 h PHE 102 CO -0.06 -0.09 0.27 0.00 -2.02 0.00 0.00 178.31 176.41 3ff9 h ALA 104 N 1.11 1.35 0.00 0.00 0.00 -0.69 -0.23 119.26 120.80 3ff9 h ALA 104 Ca 0.17 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3ff9 h ALA 104 Cb 0.04 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 3ff9 h ALA 104 CO -0.03 0.54 -0.11 -0.44 0.00 0.00 0.00 179.25 179.21 3ff9 h ASP 105 N 1.26 0.00 -0.68 0.00 3.32 -0.32 -2.92 116.42 117.08 3ff9 h ASP 105 Ca 0.41 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.33 3ff9 h ASP 105 Cb 0.03 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.51 3ff9 h ASP 105 CO -0.13 0.11 0.16 0.29 -1.72 0.00 0.00 179.24 177.94 3ff9 n LYS 106 N -3.27 4.28 -3.14 3.56 4.76 -0.35 -4.92 118.16 119.08 3ff9 n LYS 106 Ca 0.00 -3.12 -0.19 0.00 -2.87 0.00 0.00 58.31 52.13 3ff9 n LYS 106 Cb 0.36 -2.25 0.05 0.00 -1.84 0.00 0.00 35.03 31.34 3ff9 n LYS 106 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ff9 n GLY 107 N 0.20 -0.32 2.28 0.72 0.00 -1.09 -4.99 105.19 101.98 3ff9 n GLY 107 Ca 0.36 0.04 -0.12 0.00 0.00 0.00 0.00 46.02 46.29 3ff9 n GLY 107 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ff9 n SER 108 N -2.04 -0.67 -4.22 1.61 3.41 -0.24 -4.86 113.62 106.61 3ff9 n SER 108 Ca -0.05 -2.45 -0.14 0.00 -0.26 0.00 0.00 58.87 55.97 3ff9 n SER 108 Cb 0.58 1.40 -0.10 0.00 -0.26 0.00 0.00 64.21 65.82 3ff9 n SER 108 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3ff9 s HIS 109 N -3.17 1.18 0.57 7.33 3.76 -0.92 -3.16 115.29 120.88 3ff9 s HIS 109 Ca 0.25 -0.71 -0.20 0.00 -0.15 0.00 0.00 55.06 54.25 3ff9 s HIS 109 Cb 0.01 -0.62 -0.04 0.00 1.11 0.00 0.00 32.58 33.03 3ff9 s HIS 109 CO 0.18 0.05 1.22 -0.51 -0.85 0.00 0.00 174.74 174.83 3ff9 s LEU 110 N -2.82 3.75 0.13 0.89 1.43 -1.26 -0.30 118.68 120.50 3ff9 s LEU 110 Ca 0.11 2.43 -0.35 0.00 -1.03 0.00 0.00 54.13 55.29 3ff9 s LEU 110 Cb -0.00 -4.50 -0.15 0.00 0.03 0.00 0.00 46.19 41.57 3ff9 s LEU 110 CO 0.00 -1.48 1.48 -0.11 0.23 0.00 0.00 176.35 176.47 3ff9 n LEU 111 N -1.33 2.52 -4.16 1.79 7.94 -0.30 -4.00 117.00 119.44 3ff9 n LEU 111 Ca 0.12 1.10 -0.11 0.00 -1.11 0.00 0.00 56.01 56.01 3ff9 n LEU 111 Cb 0.49 -1.33 -0.10 0.00 0.53 0.00 0.00 43.42 43.00 3ff9 n LEU 111 CO 0.46 -0.59 -0.39 0.42 -1.11 0.00 0.00 177.39 176.18 3ff9 s THR 112 N 0.74 0.72 -0.54 1.96 -4.23 -1.26 0.46 115.64 113.48 3ff9 s THR 112 Ca 0.81 -1.84 0.07 0.00 -1.18 0.00 0.00 61.69 59.55 3ff9 s THR 112 Cb -0.79 -1.57 0.25 0.00 1.34 0.00 0.00 72.50 71.73 3ff9 s THR 112 CO 0.41 -0.80 0.65 0.49 -0.54 0.00 0.00 174.62 174.83 3ff9 n PHE 113 N 0.13 2.02 -0.17 3.99 3.01 -1.26 -4.97 117.46 120.21 3ff9 n PHE 113 Ca -0.13 -3.92 0.20 0.00 1.01 0.00 0.00 57.45 54.61 3ff9 n PHE 113 Cb 0.60 -0.46 0.58 0.00 -0.01 0.00 0.00 39.48 40.19 3ff9 n PHE 113 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 3ff9 h PRO 114 N 4.18 0.26 0.00 -1.08 0.13 -1.96 0.48 132.00 134.01 3ff9 h PRO 114 Ca 0.15 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3ff9 h PRO 114 Cb 0.75 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.82 3ff9 h PRO 114 CO 0.68 0.17 0.00 -0.25 -0.23 0.00 0.00 178.00 178.37 3ff9 n ASP 115 N -4.43 0.00 -3.09 1.44 10.43 -1.26 -4.65 116.55 114.98 3ff9 n ASP 115 Ca 0.16 0.31 -0.21 0.00 2.57 0.00 0.00 54.79 57.63 3ff9 n ASP 115 Cb 0.70 -0.43 0.06 0.00 1.84 0.00 0.00 41.12 43.29 3ff9 n ASP 115 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3ff9 n ASN 116 N -1.43 -5.80 -3.85 -2.24 3.02 0.17 -5.01 115.26 100.12 3ff9 n ASN 116 Ca 0.08 -0.43 -0.11 0.00 -0.03 0.00 0.00 54.58 54.09 3ff9 n ASN 116 Cb 0.25 -4.46 -0.09 0.00 -0.61 0.00 0.00 39.78 34.87 3ff9 n ASN 116 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3ff9 s GLN 117 N -6.03 0.58 0.00 3.52 -0.21 -1.26 -4.88 119.66 111.39 3ff9 s GLN 117 Ca 0.46 -0.47 0.00 0.00 0.02 0.00 0.00 55.36 55.37 3ff9 s GLN 117 Cb -0.20 0.24 0.00 0.00 1.00 0.00 0.00 33.01 34.05 3ff9 s GLN 117 CO 0.57 -0.15 0.00 0.41 -2.12 0.00 0.00 175.29 174.00 3ff9 n GLY 118 N 1.14 0.71 0.06 3.09 0.00 -1.26 -4.92 105.19 104.01 3ff9 n GLY 118 Ca -0.21 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.68 3ff9 n GLY 118 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ff9 h VAL 119 N 0.00 1.07 -0.08 1.61 2.07 -1.98 0.98 116.25 119.92 3ff9 h VAL 119 Ca 0.00 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.19 3ff9 h VAL 119 Cb 0.00 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 3ff9 h VAL 119 CO 0.00 0.08 0.05 0.11 0.02 0.00 0.00 177.57 177.84 3ff9 h LYS 120 N -0.20 0.11 -0.45 1.57 6.56 -1.93 0.19 116.57 122.41 3ff9 h LYS 120 Ca -0.01 -0.01 0.04 0.00 -1.06 0.00 0.00 60.65 59.62 3ff9 h LYS 120 Cb 0.18 -0.02 -0.04 0.00 -0.57 0.00 0.00 32.23 31.77 3ff9 h LYS 120 CO 0.01 0.08 0.22 -0.07 -2.06 0.00 0.00 179.45 177.63 3ff9 h LEU 121 N 0.10 0.31 -0.81 2.94 3.38 -1.94 -1.80 115.31 117.49 3ff9 h LEU 121 Ca 0.03 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 3ff9 h LEU 121 Cb -0.00 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3ff9 h LEU 121 CO -0.01 0.22 0.20 0.15 0.09 0.00 0.00 178.44 179.09 3ff9 h PHE 122 N 0.44 1.13 0.00 1.13 3.57 -0.55 -2.23 116.94 120.43 3ff9 h PHE 122 Ca 0.20 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.58 3ff9 h PHE 122 Cb 0.12 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.53 3ff9 h PHE 122 CO -0.11 0.91 0.02 0.78 -2.23 0.00 0.00 178.31 177.68 3ff9 h GLY 123 N 1.09 0.00 1.83 2.40 0.00 0.23 -2.10 103.07 106.53 3ff9 h GLY 123 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 3ff9 h GLY 123 CO -0.00 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.72 3ff9 n GLU 124 N -2.55 0.07 -0.06 4.80 1.02 -0.84 -1.57 120.64 121.51 3ff9 n GLU 124 Ca -0.02 0.23 0.09 0.00 -0.02 0.00 0.00 57.16 57.44 3ff9 n GLU 124 Cb 0.07 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.10 3ff9 n GLU 124 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3ff9 n TYR 125 N -1.42 0.15 -4.18 -0.32 4.01 -0.79 -4.98 117.16 109.65 3ff9 n TYR 125 Ca 0.04 -0.10 -0.28 0.00 -0.16 0.00 0.00 57.90 57.39 3ff9 n TYR 125 Cb 0.13 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.13 3ff9 n TYR 125 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3ff9 s LEU 126 N -1.38 2.58 0.00 7.72 2.01 -0.61 -5.10 118.68 123.90 3ff9 s LEU 126 Ca 0.24 -1.37 0.00 0.00 0.01 0.00 0.00 54.13 53.01 3ff9 s LEU 126 Cb 0.16 -1.05 0.00 0.00 0.01 0.00 0.00 46.19 45.31 3ff9 s LEU 126 CO 0.23 -1.01 0.00 0.61 1.01 0.00 0.00 176.35 177.19 3ff9 n GLY 127 N -1.59 5.14 0.17 -3.19 0.00 -1.26 -4.53 105.19 99.93 3ff9 n GLY 127 Ca -0.07 -1.67 0.06 0.00 0.00 0.00 0.00 46.02 44.34 3ff9 n GLY 127 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3ff9 h GLN 128 N 0.00 0.00 -6.90 1.61 1.08 -1.98 0.91 115.11 109.83 3ff9 h GLN 128 Ca 0.00 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.68 3ff9 h GLN 128 Cb 0.00 0.00 0.06 0.00 -0.05 0.00 0.00 27.48 27.49 3ff9 h GLN 128 CO 0.00 0.33 0.58 -0.51 -0.95 0.00 0.00 178.83 178.27 3ff9 s ASP 129 N -6.36 6.65 0.26 1.46 1.01 -1.26 -4.82 116.67 113.61 3ff9 s ASP 129 Ca 0.05 2.54 -0.13 0.00 0.71 0.00 0.00 52.55 55.72 3ff9 s ASP 129 Cb 0.07 -2.63 -0.08 0.00 1.01 0.00 0.00 42.92 41.28 3ff9 s ASP 129 CO 0.72 -0.61 0.63 -0.36 0.21 0.00 0.00 175.17 175.77 3ff9 s PHE 130 N -1.25 3.42 -0.05 4.23 0.08 -1.26 -4.60 117.98 118.56 3ff9 s PHE 130 Ca 0.53 1.05 0.03 0.00 0.12 0.00 0.00 56.93 58.66 3ff9 s PHE 130 Cb -0.36 -2.40 0.00 0.00 -0.57 0.00 0.00 43.02 39.70 3ff9 s PHE 130 CO 0.47 0.21 -0.14 0.71 -0.10 0.00 0.00 175.22 176.36 3ff9 s TYR 131 N -1.85 1.54 0.34 0.36 1.51 -0.23 -3.77 117.35 115.25 3ff9 s TYR 131 Ca 0.49 -0.49 -0.28 0.00 -1.01 0.00 0.00 57.07 55.78 3ff9 s TYR 131 Cb -0.11 -1.07 -0.10 0.00 -0.11 0.00 0.00 41.96 40.57 3ff9 s TYR 131 CO 0.19 -0.20 1.27 -1.58 -1.11 0.00 0.00 175.55 174.12 3ff9 s TRP 132 N 0.29 3.09 0.33 2.71 0.23 0.10 -0.43 118.94 125.26 3ff9 s TRP 132 Ca -0.08 1.46 0.03 0.00 -2.03 0.00 0.00 56.10 55.49 3ff9 s TRP 132 Cb -0.13 -3.60 -0.04 0.00 0.03 0.00 0.00 33.47 29.73 3ff9 s TRP 132 CO 0.03 -1.68 0.13 0.96 0.96 0.00 0.00 176.95 177.35 3ff9 s ILE 133 N -1.18 0.55 -1.45 2.03 -4.36 -1.04 -2.86 121.20 112.89 3ff9 s ILE 133 Ca 0.50 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.77 3ff9 s ILE 133 Cb -0.38 -2.52 -0.04 0.00 1.25 0.00 0.00 42.46 40.77 3ff9 s ILE 133 CO 0.50 0.00 2.57 0.61 0.24 0.00 0.00 174.94 178.85 3ff9 n GLY 134 N -0.68 4.10 2.76 6.27 0.00 0.17 -4.67 105.19 113.15 3ff9 n GLY 134 Ca -0.01 -1.46 -0.17 0.00 0.00 0.00 0.00 46.02 44.38 3ff9 n GLY 134 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ff9 s LEU 135 N 0.94 0.91 0.14 0.99 2.96 -1.26 -0.76 118.68 122.59 3ff9 s LEU 135 Ca 0.58 0.03 -0.10 0.00 -0.22 0.00 0.00 54.13 54.42 3ff9 s LEU 135 Cb 0.16 -0.13 -0.00 0.00 0.50 0.00 0.00 46.19 46.72 3ff9 s LEU 135 CO -0.06 -0.15 0.28 -0.13 -1.32 0.00 0.00 176.35 174.98 3ff9 s ARG 136 N 1.29 1.08 -0.64 1.98 0.52 -1.08 -0.21 118.95 121.89 3ff9 s ARG 136 Ca -0.06 -1.06 0.03 0.00 -0.52 0.00 0.00 55.73 54.12 3ff9 s ARG 136 Cb -0.13 0.38 0.16 0.00 0.52 0.00 0.00 34.95 35.88 3ff9 s ARG 136 CO -0.03 -0.39 0.42 1.21 0.02 0.00 0.00 175.30 176.53 3ff9 s ASN 137 N -2.92 4.75 -0.17 0.23 2.47 0.72 -1.16 114.94 118.86 3ff9 s ASN 137 Ca 0.12 -3.41 0.08 0.00 0.42 0.00 0.00 52.86 50.08 3ff9 s ASN 137 Cb 0.03 -1.68 -0.16 0.00 -1.45 0.00 0.00 41.25 37.99 3ff9 s ASN 137 CO -0.04 -0.18 -0.04 -0.38 -3.72 0.00 0.00 177.10 172.74 3ff9 n ILE 138 N 2.61 1.06 -2.67 -5.21 5.41 -1.26 -4.64 119.36 114.65 3ff9 n ILE 138 Ca 0.13 -0.55 -0.08 0.00 1.00 0.00 0.00 62.75 63.24 3ff9 n ILE 138 Cb 0.34 -0.85 0.05 0.00 -0.71 0.00 0.00 39.64 38.48 3ff9 n ILE 138 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 3ff9 n ASP 139 N -2.77 0.60 0.00 4.38 4.64 -1.26 -5.08 116.55 117.06 3ff9 n ASP 139 Ca -0.29 -2.64 0.00 0.00 -1.38 0.00 0.00 54.79 50.48 3ff9 n ASP 139 Cb 0.94 -0.14 0.00 0.00 -1.04 0.00 0.00 41.12 40.88 3ff9 n ASP 139 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3ff9 n GLY 140 N -0.20 1.55 3.67 0.27 0.00 -1.26 -4.90 105.19 104.32 3ff9 n GLY 140 Ca 0.06 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 3ff9 n GLY 140 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ff9 s TRP 141 N -2.59 1.95 0.00 1.61 0.52 -1.26 -4.34 118.94 114.83 3ff9 s TRP 141 Ca 0.00 0.08 -0.06 0.00 0.02 0.00 0.00 56.10 56.15 3ff9 s TRP 141 Cb 0.00 -4.00 -0.00 0.00 -1.15 0.00 0.00 33.47 28.32 3ff9 s TRP 141 CO 0.00 -4.24 0.10 1.03 0.02 0.00 0.00 176.95 173.87 3ff9 s ARG 142 N 3.73 0.43 0.21 4.98 0.52 -0.31 -0.86 118.95 127.65 3ff9 s ARG 142 Ca 0.77 -0.40 -0.30 0.00 -0.52 0.00 0.00 55.73 55.28 3ff9 s ARG 142 Cb -0.37 0.18 -0.08 0.00 0.52 0.00 0.00 34.95 35.19 3ff9 s ARG 142 CO 0.33 -0.10 1.05 -1.58 0.02 0.00 0.00 175.30 175.02 3ff9 s TRP 143 N -1.31 3.70 0.17 -0.53 0.52 -0.51 -2.64 118.94 118.34 3ff9 s TRP 143 Ca -0.14 1.71 -0.33 0.00 0.02 0.00 0.00 56.10 57.36 3ff9 s TRP 143 Cb -0.08 -3.19 -0.13 0.00 -1.15 0.00 0.00 33.47 28.93 3ff9 s TRP 143 CO 0.01 -0.27 1.68 0.39 0.02 0.00 0.00 176.95 178.78 3ff9 n GLU 144 N 1.97 2.49 -1.02 4.98 -0.58 0.06 -0.50 120.64 128.03 3ff9 n GLU 144 Ca 0.01 0.90 -0.01 0.00 -0.42 0.00 0.00 57.16 57.64 3ff9 n GLU 144 Cb 0.46 -2.72 -0.00 0.00 -0.57 0.00 0.00 31.44 28.61 3ff9 n GLU 144 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ff9 n GLY 145 N 3.78 0.15 0.00 0.62 0.00 -1.26 -4.92 105.19 103.56 3ff9 n GLY 145 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3ff9 n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ff9 n GLY 146 N 0.28 4.75 3.68 -0.02 0.00 0.34 -5.15 105.19 109.08 3ff9 n GLY 146 Ca -0.01 -1.84 -0.30 0.00 0.00 0.00 0.00 46.02 43.88 3ff9 n GLY 146 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ff9 s PRO 147 N -1.13 -0.36 0.73 1.61 0.04 -1.26 -4.37 135.00 130.25 3ff9 s PRO 147 Ca 0.00 0.02 -0.13 0.00 0.04 0.00 0.00 61.00 60.93 3ff9 s PRO 147 Cb 0.00 -1.69 0.04 0.00 0.04 0.00 0.00 34.50 32.89 3ff9 s PRO 147 CO 0.00 -3.16 1.12 0.00 0.04 0.00 0.00 177.00 175.00 3ff9 s ALA 148 N -3.17 2.26 -0.05 8.56 0.00 -1.26 -1.42 121.76 126.67 3ff9 s ALA 148 Ca 0.70 0.48 -0.30 0.00 0.00 0.00 0.00 51.96 52.84 3ff9 s ALA 148 Cb -0.11 -3.33 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 3ff9 s ALA 148 CO 0.55 -1.67 1.15 -1.17 0.00 0.00 0.00 175.76 174.63 3ff9 s LEU 149 N -5.46 4.29 0.00 0.00 2.96 -0.04 -4.73 118.68 115.70 3ff9 s LEU 149 Ca 0.66 1.78 0.12 0.00 -0.22 0.00 0.00 54.13 56.46 3ff9 s LEU 149 Cb -0.20 -3.56 0.06 0.00 0.50 0.00 0.00 46.19 42.99 3ff9 s LEU 149 CO 0.49 -0.52 0.81 -1.54 -1.32 0.00 0.00 176.35 174.26 3ff9 n SER 150 N 4.93 1.77 -4.95 3.68 3.41 -1.26 -4.96 113.62 116.24 3ff9 n SER 150 Ca 0.10 -1.38 -0.25 0.00 -0.26 0.00 0.00 58.87 57.08 3ff9 n SER 150 Cb 0.47 0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.53 3ff9 n SER 150 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ff9 s LEU 151 N -1.19 4.33 0.17 1.04 1.43 -1.26 -5.07 118.68 118.13 3ff9 s LEU 151 Ca 0.12 0.15 -0.30 0.00 -1.03 0.00 0.00 54.13 53.07 3ff9 s LEU 151 Cb 0.09 -2.90 -0.08 0.00 0.03 0.00 0.00 46.19 43.34 3ff9 s LEU 151 CO 0.19 0.02 1.14 -0.60 0.23 0.00 0.00 176.35 177.33 3ff9 s ARG 153 N -3.41 4.54 -0.15 1.70 6.06 -1.26 -5.03 118.95 121.41 3ff9 s ARG 153 Ca 0.34 1.78 0.01 0.00 -2.50 0.00 0.00 55.73 55.37 3ff9 s ARG 153 Cb -0.11 -3.27 0.02 0.00 0.06 0.00 0.00 34.95 31.65 3ff9 s ARG 153 CO 0.29 -0.01 -0.18 -1.50 -2.50 0.00 0.00 175.30 171.39 3ff9 s ILE 154 N -0.09 1.84 -0.10 4.11 2.07 -1.26 -4.55 121.20 123.21 3ff9 s ILE 154 Ca 0.51 -0.83 -0.29 0.00 -1.41 0.00 0.00 60.65 58.63 3ff9 s ILE 154 Cb -0.31 -1.67 -0.06 0.00 0.13 0.00 0.00 42.46 40.56 3ff9 s ILE 154 CO 0.35 0.51 1.92 -0.22 -1.91 0.00 0.00 174.94 175.59 3ff9 s LEU 155 N 1.12 4.03 -0.37 8.50 2.96 -0.38 -4.77 118.68 129.77 3ff9 s LEU 155 Ca -0.01 2.17 0.02 0.00 -0.22 0.00 0.00 54.13 56.09 3ff9 s LEU 155 Cb -0.14 -3.53 0.11 0.00 0.50 0.00 0.00 46.19 43.13 3ff9 s LEU 155 CO -0.07 -1.33 0.11 -0.89 -1.32 0.00 0.00 176.35 172.85 3ff9 s THR 156 N 5.62 1.82 0.24 3.68 2.01 -1.26 0.25 115.64 128.01 3ff9 s THR 156 Ca 0.86 -2.23 0.02 0.00 0.31 0.00 0.00 61.69 60.65 3ff9 s THR 156 Cb -0.35 -2.33 -0.01 0.00 0.01 0.00 0.00 72.50 69.82 3ff9 s THR 156 CO 0.36 -0.68 1.60 0.78 -0.69 0.00 0.00 174.62 175.99 3ff9 h ASN 157 N 7.50 0.42 -4.05 3.53 -0.26 -1.92 -3.44 115.58 117.36 3ff9 h ASN 157 Ca -0.07 -0.20 -0.42 0.00 -0.56 0.00 0.00 56.30 55.05 3ff9 h ASN 157 Cb 0.99 -0.12 -0.29 0.00 -1.06 0.00 0.00 38.32 37.84 3ff9 h ASN 157 CO 0.52 0.84 -0.79 -0.55 -1.06 0.00 0.00 177.43 176.39 3ff9 s SER 158 N -6.88 1.21 0.53 5.81 0.15 -1.26 -5.04 113.70 108.22 3ff9 s SER 158 Ca -0.06 -0.19 0.19 0.00 0.70 0.00 0.00 55.95 56.59 3ff9 s SER 158 Cb 0.12 -0.16 1.37 0.00 -1.71 0.00 0.00 66.02 65.64 3ff9 s SER 158 CO 0.81 0.12 2.16 0.25 1.20 0.00 0.00 173.24 177.77 3ff9 h LEU 159 N 5.95 0.00 0.00 3.45 5.85 -2.04 -2.51 115.31 126.01 3ff9 h LEU 159 Ca -0.32 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.40 3ff9 h LEU 159 Cb 1.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3ff9 h LEU 159 CO 0.49 0.00 0.00 2.30 -0.34 0.00 0.00 178.44 180.89 3ff9 n ILE 160 N -4.41 0.20 -2.62 4.05 -5.35 -1.26 -4.75 119.36 105.22 3ff9 n ILE 160 Ca -0.02 0.05 -0.43 0.00 -0.27 0.00 0.00 62.75 62.08 3ff9 n ILE 160 Cb 0.13 -0.63 -0.02 0.00 -1.74 0.00 0.00 39.64 37.37 3ff9 n ILE 160 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 3ff9 s GLN 161 N -2.60 4.17 0.00 6.28 -0.21 -0.95 -4.89 119.66 121.47 3ff9 s GLN 161 Ca 0.23 1.28 0.04 0.00 0.02 0.00 0.00 55.36 56.93 3ff9 s GLN 161 Cb 0.17 -3.70 0.08 0.00 1.00 0.00 0.00 33.01 30.55 3ff9 s GLN 161 CO 0.39 -0.77 0.87 0.54 -2.12 0.00 0.00 175.29 174.20 3ff9 n ARG 162 N 6.61 1.31 -4.94 2.91 1.74 -1.22 -4.71 116.66 118.35 3ff9 n ARG 162 Ca 0.12 -1.25 -0.31 0.00 -0.77 0.00 0.00 57.85 55.64 3ff9 n ARG 162 Cb 0.46 -1.09 -0.14 0.00 -1.02 0.00 0.00 32.46 30.67 3ff9 n ARG 162 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ff9 s GLY 164 N -0.97 1.93 0.22 0.00 0.00 0.71 -0.70 107.32 108.50 3ff9 s GLY 164 Ca 0.12 -0.84 0.04 0.00 0.00 0.00 0.00 44.72 44.03 3ff9 s GLY 164 CO 0.02 -0.66 -0.01 0.00 0.00 0.00 0.00 173.10 172.44 3ff9 s ALA 165 N -1.03 1.76 0.08 3.20 0.00 -0.35 -2.48 121.76 122.93 3ff9 s ALA 165 Ca 0.18 -1.73 0.06 0.00 0.00 0.00 0.00 51.96 50.46 3ff9 s ALA 165 Cb -0.12 0.45 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 3ff9 s ALA 165 CO 0.08 -0.24 -0.17 -1.50 0.00 0.00 0.00 175.76 173.93 3ff9 s ILE 166 N -3.42 1.34 0.28 0.00 2.07 0.43 -1.62 121.20 120.28 3ff9 s ILE 166 Ca 0.27 -1.34 -0.06 0.00 -1.41 0.00 0.00 60.65 58.11 3ff9 s ILE 166 Cb 0.05 -1.24 0.02 0.00 0.13 0.00 0.00 42.46 41.42 3ff9 s ILE 166 CO 0.08 -0.12 0.48 0.00 -1.91 0.00 0.00 174.94 173.46 3ff9 n HIS 167 N 1.31 -1.61 -0.26 3.50 1.44 -0.90 -1.07 115.22 117.64 3ff9 n HIS 167 Ca -0.20 -1.60 0.07 0.00 -2.01 0.00 0.00 57.72 53.98 3ff9 n HIS 167 Cb 0.54 0.55 0.20 0.00 0.12 0.00 0.00 29.99 31.40 3ff9 n HIS 167 CO 0.00 0.00 0.00 -0.09 -2.81 0.00 0.00 176.34 173.44 3ff9 h ARG 168 N 0.00 0.29 -0.29 -1.40 2.43 -0.95 -1.91 114.38 112.55 3ff9 h ARG 168 Ca -0.23 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 3ff9 h ARG 168 Cb 0.92 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.40 3ff9 h ARG 168 CO 0.30 0.19 0.00 0.09 -1.51 0.00 0.00 179.97 179.04 3ff9 n ASN 169 N -5.13 0.77 0.00 -3.80 3.02 -1.26 -4.68 115.26 104.18 3ff9 n ASN 169 Ca 0.15 -2.03 0.00 0.00 -0.03 0.00 0.00 54.58 52.68 3ff9 n ASN 169 Cb 0.49 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.49 3ff9 n ASN 169 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ff9 n GLY 170 N 0.53 0.46 3.84 7.41 0.00 -0.72 -5.04 105.19 111.66 3ff9 n GLY 170 Ca 0.03 -2.28 -0.37 0.00 0.00 0.00 0.00 46.02 43.40 3ff9 n GLY 170 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ff9 s LEU 171 N 0.00 4.44 -0.09 0.99 1.43 -1.26 -2.12 118.68 122.06 3ff9 s LEU 171 Ca 0.00 0.97 -0.07 0.00 -1.03 0.00 0.00 54.13 54.00 3ff9 s LEU 171 Cb 0.00 -2.77 0.03 0.00 0.03 0.00 0.00 46.19 43.48 3ff9 s LEU 171 CO 0.00 0.27 0.24 -1.58 0.23 0.00 0.00 176.35 175.50 3ff9 s GLN 172 N -1.35 0.25 0.48 1.70 0.74 -0.64 -1.25 119.66 119.59 3ff9 s GLN 172 Ca 0.28 0.39 -0.18 0.00 0.05 0.00 0.00 55.36 55.90 3ff9 s GLN 172 Cb -0.16 0.04 -0.09 0.00 1.10 0.00 0.00 33.01 33.90 3ff9 s GLN 172 CO 0.15 -0.08 0.96 0.00 -0.55 0.00 0.00 175.29 175.78 3ff9 s ALA 173 N 0.52 3.07 0.11 1.58 0.00 0.14 -1.21 121.76 125.97 3ff9 s ALA 173 Ca -0.03 0.24 -0.16 0.00 0.00 0.00 0.00 51.96 52.01 3ff9 s ALA 173 Cb -0.05 -3.11 0.03 0.00 0.00 0.00 0.00 23.12 20.00 3ff9 s ALA 173 CO -0.03 -0.08 0.39 0.45 0.00 0.00 0.00 175.76 176.48 3ff9 s SER 174 N -2.74 -0.22 0.36 0.00 0.15 0.12 -4.76 113.70 106.61 3ff9 s SER 174 Ca 0.60 -0.28 -0.28 0.00 0.70 0.00 0.00 55.95 56.69 3ff9 s SER 174 Cb -0.10 0.45 -0.11 0.00 -1.71 0.00 0.00 66.02 64.56 3ff9 s SER 174 CO 0.24 -0.80 1.44 -0.55 1.20 0.00 0.00 173.24 174.77 3ff9 s SER 175 N -2.64 6.47 0.16 5.45 0.15 -1.26 -2.56 113.70 119.46 3ff9 s SER 175 Ca 0.01 2.94 0.17 0.00 0.70 0.00 0.00 55.95 59.77 3ff9 s SER 175 Cb 0.02 -2.66 0.76 0.00 -1.71 0.00 0.00 66.02 62.42 3ff9 s SER 175 CO -0.10 -0.78 1.51 0.00 1.20 0.00 0.00 173.24 175.08 3ff9 h GLU 177 N 0.00 0.00 -6.76 0.00 5.08 -1.97 -2.36 114.58 108.57 3ff9 h GLU 177 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 3ff9 h GLU 177 Cb 0.20 0.00 0.06 0.00 0.50 0.00 0.00 28.75 29.51 3ff9 h GLU 177 CO 0.00 0.00 0.79 0.08 -1.00 0.00 0.00 179.01 178.88 3ff9 s VAL 178 N -3.19 2.52 -0.32 3.13 1.01 -1.03 -4.66 120.40 117.86 3ff9 s VAL 178 Ca 0.08 0.43 -0.21 0.00 0.00 0.00 0.00 61.98 62.28 3ff9 s VAL 178 Cb 0.08 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.18 3ff9 s VAL 178 CO 0.66 0.07 0.66 0.00 0.00 0.00 0.00 175.10 176.49 3ff9 s ALA 179 N -0.00 3.51 0.19 5.51 0.00 -1.26 -4.05 121.76 125.66 3ff9 s ALA 179 Ca 0.60 -0.67 0.03 0.00 0.00 0.00 0.00 51.96 51.92 3ff9 s ALA 179 Cb -0.43 -3.16 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 3ff9 s ALA 179 CO 0.44 -1.18 -0.01 -0.51 0.00 0.00 0.00 175.76 174.50 3ff9 s LEU 180 N 2.71 2.18 0.99 0.00 1.43 -0.31 -4.63 118.68 121.04 3ff9 s LEU 180 Ca 0.26 -1.17 -0.12 0.00 -1.03 0.00 0.00 54.13 52.07 3ff9 s LEU 180 Cb -0.15 -0.16 0.18 0.00 0.03 0.00 0.00 46.19 46.10 3ff9 s LEU 180 CO 0.13 -0.52 1.09 -1.10 0.23 0.00 0.00 176.35 176.17 3ff9 s GLN 181 N -3.88 0.49 0.17 1.70 -0.21 -1.25 -1.31 119.66 115.38 3ff9 s GLN 181 Ca 0.25 0.64 -0.03 0.00 0.02 0.00 0.00 55.36 56.23 3ff9 s GLN 181 Cb 0.06 -1.73 -0.03 0.00 1.00 0.00 0.00 33.01 32.30 3ff9 s GLN 181 CO 0.05 -2.72 0.16 1.67 -2.12 0.00 0.00 175.29 172.33 3ff9 s TRP 182 N -2.90 0.85 -0.09 0.91 -2.14 -1.26 -0.73 118.94 113.59 3ff9 s TRP 182 Ca 0.65 -1.17 0.01 0.00 2.66 0.00 0.00 56.10 58.26 3ff9 s TRP 182 Cb -0.19 -0.38 0.02 0.00 -3.10 0.00 0.00 33.47 29.82 3ff9 s TRP 182 CO 0.58 -0.64 -0.11 0.42 -2.66 0.00 0.00 176.95 174.54 3ff9 s ILE 183 N -4.07 1.12 0.20 0.66 1.01 -1.14 -1.50 121.20 117.48 3ff9 s ILE 183 Ca 0.29 -0.42 0.05 0.00 0.00 0.00 0.00 60.65 60.56 3ff9 s ILE 183 Cb 0.06 -1.06 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 3ff9 s ILE 183 CO 0.06 0.36 0.23 0.00 0.00 0.00 0.00 174.94 175.60 3ff9 s LYS 185 N -3.54 0.12 0.10 0.00 2.20 0.59 -1.38 119.74 117.83 3ff9 s LYS 185 Ca 0.33 0.17 -0.23 0.00 -0.36 0.00 0.00 55.97 55.88 3ff9 s LYS 185 Cb -0.09 0.04 0.06 0.00 -1.51 0.00 0.00 37.83 36.32 3ff9 s LYS 185 CO 0.26 -0.03 0.55 -1.59 -0.36 0.00 0.00 175.35 174.19 3ff9 s LYS 186 N 0.17 1.15 0.42 4.03 -2.85 -0.68 -2.17 119.74 119.81 3ff9 s LYS 186 Ca -0.01 -0.36 -0.23 0.00 -1.00 0.00 0.00 55.97 54.37 3ff9 s LYS 186 Cb -0.02 0.53 -0.09 0.00 -2.06 0.00 0.00 37.83 36.19 3ff9 s LYS 186 CO -0.00 -0.46 1.07 0.54 0.10 0.00 0.00 175.35 176.60 3ff9 s VAL 187 N -3.10 3.59 -0.30 1.79 0.11 -1.26 0.76 120.40 121.99 3ff9 s VAL 187 Ca -0.02 1.19 -0.29 0.00 -2.93 0.00 0.00 61.98 59.93 3ff9 s VAL 187 Cb -0.00 -3.60 0.00 0.00 -1.53 0.00 0.00 36.38 31.25 3ff9 s VAL 187 CO -0.07 -0.02 1.29 -0.22 -3.33 0.00 0.00 175.10 172.75 3ff9 s LEU 188 N -2.80 3.88 0.00 2.54 2.96 -0.45 -4.65 118.68 120.16 3ff9 s LEU 188 Ca 0.60 1.19 0.30 0.00 -0.22 0.00 0.00 54.13 56.00 3ff9 s LEU 188 Cb -0.23 -3.54 1.82 0.00 0.50 0.00 0.00 46.19 44.74 3ff9 s LEU 188 CO 0.28 -1.07 2.15 0.00 -1.32 0.00 0.00 176.35 176.39