#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ja7 n LYS 70 N 0.00 0.00 0.31 3.23 5.02 -1.26 -4.52 118.16 120.94 2ja7 n LYS 70 Ca 0.00 0.07 0.20 0.00 -2.02 0.00 0.00 58.31 56.55 2ja7 n LYS 70 Cb 0.00 -1.51 0.99 0.00 -0.02 0.00 0.00 35.03 34.50 2ja7 n LYS 70 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2ja7 h GLU 71 N 0.00 0.00 -0.47 1.97 5.08 -2.04 0.09 114.58 119.20 2ja7 h GLU 71 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ja7 h GLU 71 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2ja7 h GLU 71 CO 0.00 0.01 0.00 1.63 -1.00 0.00 0.00 179.01 179.65 2ja7 n LYS 72 N -3.18 2.28 -3.97 2.33 5.02 -1.26 -4.82 118.16 114.56 2ja7 n LYS 72 Ca -0.02 -1.98 -0.35 0.00 -2.02 0.00 0.00 58.31 53.94 2ja7 n LYS 72 Cb 0.16 -1.46 -0.13 0.00 -0.02 0.00 0.00 35.03 33.59 2ja7 n LYS 72 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ja7 s ALA 73 N -1.38 2.97 -0.03 7.82 0.00 0.02 -1.86 121.76 129.30 2ja7 s ALA 73 Ca 0.38 -1.08 -0.16 0.00 0.00 0.00 0.00 51.96 51.10 2ja7 s ALA 73 Cb 0.20 -1.80 -0.05 0.00 0.00 0.00 0.00 23.12 21.47 2ja7 s ALA 73 CO 0.28 -0.31 0.43 0.42 0.00 0.00 0.00 175.76 176.58 2ja7 s ILE 74 N 1.27 5.05 0.71 0.00 1.01 -1.01 -4.98 121.20 123.26 2ja7 s ILE 74 Ca 0.04 0.88 -0.16 0.00 0.00 0.00 0.00 60.65 61.41 2ja7 s ILE 74 Cb -0.15 -3.75 0.01 0.00 0.01 0.00 0.00 42.46 38.59 2ja7 s ILE 74 CO 0.01 0.52 1.11 -0.81 0.00 0.00 0.00 174.94 175.76 2ja7 n PRO 75 N 2.28 0.63 0.33 2.79 -0.04 -1.26 -4.69 135.00 135.04 2ja7 n PRO 75 Ca -0.12 0.28 0.21 0.00 -0.04 0.00 0.00 63.50 63.83 2ja7 n PRO 75 Cb 0.52 -2.35 1.14 0.00 -0.04 0.00 0.00 33.50 32.77 2ja7 n PRO 75 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2ja7 h LYS 76 N -0.13 0.00 -6.56 0.54 1.63 -1.97 -3.31 116.57 106.77 2ja7 h LYS 76 Ca -0.48 0.00 -0.45 0.00 -0.85 0.00 0.00 60.65 58.86 2ja7 h LYS 76 Cb 1.33 0.00 0.03 0.00 -0.60 0.00 0.00 32.23 32.99 2ja7 h LYS 76 CO 0.49 0.00 -0.17 0.34 -3.45 0.00 0.00 179.45 176.66 2ja7 s ASP 77 N -5.32 5.36 0.00 4.20 -1.08 -1.26 -4.11 116.67 114.46 2ja7 s ASP 77 Ca -0.04 -0.62 0.00 0.00 -0.52 0.00 0.00 52.55 51.37 2ja7 s ASP 77 Cb 0.13 -0.19 0.00 0.00 -1.46 0.00 0.00 42.92 41.40 2ja7 s ASP 77 CO 0.44 -1.06 0.00 0.00 0.52 0.00 0.00 175.17 175.06 2ja7 n GLN 78 N -2.06 0.00 -1.55 4.34 6.02 -1.26 -4.91 117.38 117.96 2ja7 n GLN 78 Ca 0.12 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.71 2ja7 n GLN 78 Cb 0.60 -3.61 0.03 0.00 1.02 0.00 0.00 30.24 28.28 2ja7 n GLN 78 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2ja7 n ARG 79 N -2.00 0.90 0.00 -1.09 3.00 -1.25 -4.96 116.66 111.27 2ja7 n ARG 79 Ca 0.00 0.34 0.00 0.00 -0.00 0.00 0.00 57.85 58.19 2ja7 n ARG 79 Cb 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 32.46 30.56 2ja7 n ARG 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ja7 n ALA 80 N -1.14 0.16 -0.85 5.13 0.00 -1.26 -5.12 120.51 117.43 2ja7 n ALA 80 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.52 2ja7 n ALA 80 Cb 0.43 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.94 2ja7 n ALA 80 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2ja7 n THR 81 N -0.10 0.00 -2.50 0.00 -2.24 -1.26 -4.94 114.28 103.24 2ja7 n THR 81 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 2ja7 n THR 81 Cb 0.00 -0.19 -0.04 0.00 -2.10 0.00 0.00 70.33 68.00 2ja7 n THR 81 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2ja7 s THR 82 N -1.21 3.79 -0.80 4.28 2.01 -1.26 -4.92 115.64 117.53 2ja7 s THR 82 Ca 0.13 1.57 0.24 0.00 0.31 0.00 0.00 61.69 63.94 2ja7 s THR 82 Cb -0.02 -4.00 0.23 0.00 0.01 0.00 0.00 72.50 68.72 2ja7 s THR 82 CO 0.11 0.28 1.74 -2.65 -0.69 0.00 0.00 174.62 173.41 2ja7 n PRO 83 N 2.21 0.12 -3.93 4.92 -0.02 -1.26 -4.75 135.00 132.30 2ja7 n PRO 83 Ca 0.02 0.21 -0.31 0.00 -2.02 0.00 0.00 63.50 61.41 2ja7 n PRO 83 Cb 0.46 -1.68 -0.04 0.00 -0.02 0.00 0.00 33.50 32.22 2ja7 n PRO 83 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2ja7 s TYR 84 N -3.11 3.49 -0.15 6.00 1.51 -1.26 -2.11 117.35 121.72 2ja7 s TYR 84 Ca 0.09 0.23 -0.29 0.00 -1.01 0.00 0.00 57.07 56.08 2ja7 s TYR 84 Cb 0.13 -1.74 -0.01 0.00 -0.11 0.00 0.00 41.96 40.23 2ja7 s TYR 84 CO 0.46 0.58 1.11 1.41 -1.11 0.00 0.00 175.55 178.00 2ja7 s MET 85 N -2.55 4.32 0.48 -0.62 -2.45 -0.39 -4.83 119.30 113.26 2ja7 s MET 85 Ca 0.34 1.49 -0.23 0.00 -1.25 0.00 0.00 55.69 56.04 2ja7 s MET 85 Cb -0.13 -3.62 -0.07 0.00 1.25 0.00 0.00 34.83 32.26 2ja7 s MET 85 CO 0.27 -0.53 1.30 0.95 1.05 0.00 0.00 175.02 178.06 2ja7 s THR 86 N 2.75 2.50 0.38 10.11 -4.23 -1.26 -4.81 115.64 121.09 2ja7 s THR 86 Ca 0.50 0.40 0.13 0.00 -1.18 0.00 0.00 61.69 61.54 2ja7 s THR 86 Cb -0.19 -3.21 0.35 0.00 1.34 0.00 0.00 72.50 70.79 2ja7 s THR 86 CO 0.14 0.02 1.85 0.07 -0.54 0.00 0.00 174.62 176.16 2ja7 h LYS 87 N 1.99 0.53 -0.39 3.99 2.10 -2.00 0.62 116.57 123.41 2ja7 h LYS 87 Ca -0.50 -0.03 -0.12 0.00 -2.00 0.00 0.00 60.65 58.00 2ja7 h LYS 87 Cb 1.27 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 32.47 2ja7 h LYS 87 CO 0.60 0.35 -0.21 1.88 -2.00 0.00 0.00 179.45 180.07 2ja7 h TYR 88 N 0.54 0.96 0.04 0.07 -1.99 -1.98 0.25 116.97 114.86 2ja7 h TYR 88 Ca 0.47 -0.24 -0.00 0.00 2.00 0.00 0.00 58.73 60.96 2ja7 h TYR 88 Cb 0.99 -0.22 -0.00 0.00 2.00 0.00 0.00 36.73 39.49 2ja7 h TYR 88 CO -0.00 1.01 -0.06 0.93 -0.00 0.00 0.00 178.16 180.04 2ja7 h GLU 89 N 0.63 -0.10 -1.00 4.88 5.08 -1.25 0.13 114.58 122.95 2ja7 h GLU 89 Ca 0.08 0.01 0.20 0.00 -1.00 0.00 0.00 59.36 58.65 2ja7 h GLU 89 Cb 0.77 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.93 2ja7 h GLU 89 CO 0.06 -0.06 0.61 0.07 -1.00 0.00 0.00 179.01 178.69 2ja7 h ARG 90 N -0.10 0.73 -0.45 2.33 0.11 -1.41 0.70 114.38 116.29 2ja7 h ARG 90 Ca -0.01 -0.04 0.08 0.00 0.10 0.00 0.00 59.98 60.11 2ja7 h ARG 90 Cb 0.09 -0.16 -0.06 0.00 1.11 0.00 0.00 29.97 30.94 2ja7 h ARG 90 CO -0.01 0.48 0.06 0.00 0.10 0.00 0.00 179.97 180.60 2ja7 h ALA 91 N 1.65 0.47 -0.08 0.08 0.00 -0.49 -0.42 119.26 120.47 2ja7 h ALA 91 Ca 0.59 0.10 -0.23 0.00 0.00 0.00 0.00 54.91 55.36 2ja7 h ALA 91 Cb 0.93 0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.88 2ja7 h ALA 91 CO -0.39 -0.34 -0.88 -0.09 0.00 0.00 0.00 179.25 177.55 2ja7 h ARG 92 N 0.19 0.69 0.34 0.00 2.43 0.27 -2.22 114.38 116.09 2ja7 h ARG 92 Ca 0.22 -0.64 -0.00 0.00 -0.81 0.00 0.00 59.98 58.75 2ja7 h ARG 92 Cb 0.29 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 2ja7 h ARG 92 CO -0.31 1.24 -0.37 0.82 -1.51 0.00 0.00 179.97 179.85 2ja7 h ILE 93 N 0.44 0.25 -0.52 1.20 2.04 0.62 0.57 117.51 122.12 2ja7 h ILE 93 Ca -0.08 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.88 2ja7 h ILE 93 Cb 1.51 0.25 -0.10 0.00 -0.74 0.00 0.00 36.82 37.74 2ja7 h ILE 93 CO 0.17 0.00 -0.16 -0.07 0.00 0.00 0.00 178.15 178.09 2ja7 h LEU 94 N -0.74 -0.58 0.10 1.44 3.38 -1.14 0.70 115.31 118.48 2ja7 h LEU 94 Ca -0.02 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 2ja7 h LEU 94 Cb 0.67 0.36 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 2ja7 h LEU 94 CO -0.08 -0.20 -0.08 1.23 0.09 0.00 0.00 178.44 179.41 2ja7 h GLY 95 N -0.04 -0.59 -0.87 0.83 0.00 -0.89 0.39 103.07 101.90 2ja7 h GLY 95 Ca 0.25 0.25 0.16 0.00 0.00 0.00 0.00 47.33 47.99 2ja7 h GLY 95 CO -0.55 -0.21 -0.31 -0.84 0.00 0.00 0.00 176.54 174.62 2ja7 h THR 96 N -0.17 0.05 -0.25 4.70 2.02 0.67 0.35 112.91 120.28 2ja7 h THR 96 Ca -0.01 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 2ja7 h THR 96 Cb 0.14 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.59 2ja7 h THR 96 CO 0.01 0.00 0.15 -0.09 0.37 0.00 0.00 175.52 175.95 2ja7 h ARG 97 N -0.02 0.34 0.12 6.66 9.65 0.53 -1.11 114.38 130.54 2ja7 h ARG 97 Ca 0.38 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 59.24 2ja7 h ARG 97 Cb 0.63 -0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 29.09 2ja7 h ARG 97 CO -0.94 0.27 -0.52 0.00 2.80 0.00 0.00 179.97 181.57 2ja7 h ALA 98 N 1.05 -1.00 -0.86 2.80 0.00 0.27 0.15 119.26 121.67 2ja7 h ALA 98 Ca 0.09 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2ja7 h ALA 98 Cb 0.02 0.90 -0.11 0.00 0.00 0.00 0.00 17.79 18.60 2ja7 h ALA 98 CO -0.02 -1.13 -0.55 1.25 0.00 0.00 0.00 179.25 178.81 2ja7 h LEU 99 N -0.75 -1.99 -0.60 0.00 5.85 -0.07 0.34 115.31 118.09 2ja7 h LEU 99 Ca -0.01 0.30 0.10 0.00 0.84 0.00 0.00 57.88 59.12 2ja7 h LEU 99 Cb 0.75 0.87 -0.08 0.00 0.37 0.00 0.00 40.66 42.57 2ja7 h LEU 99 CO -0.29 -0.24 0.17 1.56 -0.34 0.00 0.00 178.44 179.31 2ja7 h GLN 100 N -0.05 0.31 -0.82 1.25 4.20 -0.71 -1.30 115.11 117.99 2ja7 h GLN 100 Ca 0.14 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.88 2ja7 h GLN 100 Cb 0.41 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.06 2ja7 h GLN 100 CO -0.84 0.21 0.51 0.82 -0.67 0.00 0.00 178.83 178.86 2ja7 h ILE 101 N 0.32 1.06 0.00 2.54 2.04 0.24 0.22 117.51 123.93 2ja7 h ILE 101 Ca 0.31 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2ja7 h ILE 101 Cb 0.43 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 2ja7 h ILE 101 CO -0.36 0.17 0.00 -1.54 0.00 0.00 0.00 178.15 176.42 2ja7 n SER 102 N -4.63 0.53 -0.34 1.72 3.41 0.39 -1.52 113.62 113.17 2ja7 n SER 102 Ca 0.11 0.63 0.14 0.00 -0.26 0.00 0.00 58.87 59.50 2ja7 n SER 102 Cb 0.15 -0.74 0.62 0.00 -0.26 0.00 0.00 64.21 63.98 2ja7 n SER 102 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2ja7 n MET 103 N -2.08 1.43 -1.64 4.33 2.81 0.73 -4.89 117.12 117.81 2ja7 n MET 103 Ca 0.02 -0.69 0.00 0.00 -1.81 0.00 0.00 57.70 55.23 2ja7 n MET 103 Cb 0.21 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.24 2ja7 n MET 103 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2ja7 n ASN 104 N -0.19 -0.83 -4.48 7.83 3.02 -0.58 -5.06 115.26 114.97 2ja7 n ASN 104 Ca 0.20 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.45 2ja7 n ASN 104 Cb 0.29 -0.41 0.16 0.00 -0.61 0.00 0.00 39.78 39.22 2ja7 n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ja7 s ALA 105 N -2.02 1.81 0.24 5.41 0.00 -1.02 -5.01 121.76 121.17 2ja7 s ALA 105 Ca 0.00 -0.78 -0.25 0.00 0.00 0.00 0.00 51.96 50.93 2ja7 s ALA 105 Cb 0.00 -2.94 -0.09 0.00 0.00 0.00 0.00 23.12 20.10 2ja7 s ALA 105 CO 0.00 -2.46 0.84 -2.14 0.00 0.00 0.00 175.76 172.00 2ja7 s PRO 106 N -5.49 4.56 -0.25 0.00 0.02 -1.26 -4.83 135.00 127.74 2ja7 s PRO 106 Ca 0.67 1.20 -0.08 0.00 0.02 0.00 0.00 61.00 62.81 2ja7 s PRO 106 Cb -0.11 -3.05 -0.03 0.00 0.02 0.00 0.00 34.50 31.33 2ja7 s PRO 106 CO 0.53 0.44 0.09 0.08 -0.33 0.00 0.00 177.00 177.81 2ja7 s VAL 107 N -1.37 4.51 -1.06 3.83 1.01 -1.26 -4.97 120.40 121.10 2ja7 s VAL 107 Ca 0.42 -0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.35 2ja7 s VAL 107 Cb -0.21 -3.12 0.25 0.00 0.00 0.00 0.00 36.38 33.30 2ja7 s VAL 107 CO 0.25 0.32 0.97 0.49 0.00 0.00 0.00 175.10 177.13 2ja7 n PHE 108 N 4.92 0.58 -4.02 5.22 0.99 -1.26 -4.82 117.46 119.07 2ja7 n PHE 108 Ca -0.16 -0.21 -0.11 0.00 -0.00 0.00 0.00 57.45 56.96 2ja7 n PHE 108 Cb 0.52 -0.18 -0.12 0.00 -1.00 0.00 0.00 39.48 38.70 2ja7 n PHE 108 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 2ja7 s VAL 109 N -1.59 0.31 0.00 -4.37 1.01 -1.26 -4.97 120.40 109.54 2ja7 s VAL 109 Ca 0.17 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.96 2ja7 s VAL 109 Cb 0.12 -0.41 -0.06 0.00 0.00 0.00 0.00 36.38 36.04 2ja7 s VAL 109 CO 0.06 -0.38 1.42 -1.81 0.00 0.00 0.00 175.10 174.40 2ja7 s ASP 110 N -1.34 6.83 -0.44 3.32 1.01 -1.26 -4.90 116.67 119.89 2ja7 s ASP 110 Ca -0.11 2.14 -0.28 0.00 0.71 0.00 0.00 52.55 55.00 2ja7 s ASP 110 Cb -0.09 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.29 2ja7 s ASP 110 CO -0.00 -0.74 1.45 -0.76 0.21 0.00 0.00 175.17 175.34 2ja7 s LEU 111 N 2.45 3.53 0.00 1.23 1.02 -1.26 -4.78 118.68 120.87 2ja7 s LEU 111 Ca 0.65 0.74 0.00 0.00 0.02 0.00 0.00 54.13 55.54 2ja7 s LEU 111 Cb -0.32 -3.42 0.00 0.00 0.02 0.00 0.00 46.19 42.47 2ja7 s LEU 111 CO 0.27 -1.53 0.46 1.21 0.02 0.00 0.00 176.35 176.78 2ja7 n GLU 112 N 8.25 0.34 0.00 1.70 2.13 -1.26 -4.27 120.64 127.52 2ja7 n GLU 112 Ca 0.16 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.98 2ja7 n GLU 112 Cb 0.48 -1.33 0.00 0.00 0.27 0.00 0.00 31.44 30.86 2ja7 n GLU 112 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ja7 n GLY 113 N 1.21 1.79 3.27 8.31 0.00 -1.26 -5.07 105.19 113.43 2ja7 n GLY 113 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2ja7 n GLY 113 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ja7 n GLU 114 N -1.58 -0.09 0.00 1.61 -0.58 -1.26 -4.94 120.64 113.79 2ja7 n GLU 114 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2ja7 n GLU 114 Cb 0.00 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.36 2ja7 n GLU 114 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2ja7 n THR 115 N -2.93 0.00 -3.90 2.62 -2.24 -1.26 -4.96 114.28 101.61 2ja7 n THR 115 Ca 0.04 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.47 2ja7 n THR 115 Cb 0.54 0.75 -0.11 0.00 -2.10 0.00 0.00 70.33 69.41 2ja7 n THR 115 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ja7 s ASP 116 N 0.00 5.55 0.12 3.42 -1.08 -1.26 -5.03 116.67 118.39 2ja7 s ASP 116 Ca 0.00 -0.00 -0.31 0.00 -0.52 0.00 0.00 52.55 51.72 2ja7 s ASP 116 Cb 0.00 -1.97 -0.09 0.00 -1.46 0.00 0.00 42.92 39.40 2ja7 s ASP 116 CO 0.00 0.10 1.58 1.55 0.52 0.00 0.00 175.17 178.92 2ja7 h PRO 117 N 7.26 -0.58 0.00 4.34 0.13 -1.95 0.74 132.00 141.94 2ja7 h PRO 117 Ca -0.37 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2ja7 h PRO 117 Cb 1.17 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2ja7 h PRO 117 CO 0.65 -0.39 0.04 1.25 -0.23 0.00 0.00 178.00 179.32 2ja7 h LEU 118 N -0.60 0.00 0.13 1.56 5.85 -1.89 0.55 115.31 120.90 2ja7 h LEU 118 Ca 0.04 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.49 2ja7 h LEU 118 Cb 0.67 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.70 2ja7 h LEU 118 CO -0.31 0.00 -1.33 -0.09 -0.34 0.00 0.00 178.44 176.37 2ja7 h ARG 119 N 0.00 0.27 -0.61 1.25 9.65 -1.48 -2.56 114.38 120.90 2ja7 h ARG 119 Ca 0.00 -0.45 -0.05 0.00 -1.10 0.00 0.00 59.98 58.37 2ja7 h ARG 119 Cb 0.07 0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 28.79 2ja7 h ARG 119 CO 0.00 1.22 0.16 0.82 2.80 0.00 0.00 179.97 184.97 2ja7 h ILE 120 N -0.29 1.24 -0.13 1.20 2.04 0.17 -1.65 117.51 120.09 2ja7 h ILE 120 Ca -0.28 -0.85 -0.01 0.00 1.00 0.00 0.00 64.86 64.72 2ja7 h ILE 120 Cb 1.76 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 2ja7 h ILE 120 CO 0.08 0.32 0.04 0.00 0.00 0.00 0.00 178.15 178.60 2ja7 h ALA 121 N 1.28 0.17 -0.60 1.87 0.00 -0.20 0.56 119.26 122.34 2ja7 h ALA 121 Ca 0.20 -0.12 0.14 0.00 0.00 0.00 0.00 54.91 55.13 2ja7 h ALA 121 Cb 0.30 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2ja7 h ALA 121 CO -0.00 -0.22 0.41 0.52 0.00 0.00 0.00 179.25 179.96 2ja7 h MET 122 N 0.03 0.19 0.24 0.00 2.86 -1.00 0.16 114.93 117.41 2ja7 h MET 122 Ca 0.04 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 2ja7 h MET 122 Cb 0.21 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.83 2ja7 h MET 122 CO -0.00 0.12 -0.11 -0.22 1.06 0.00 0.00 176.91 177.76 2ja7 h LYS 123 N 0.19 -0.31 -0.83 1.72 3.64 -0.28 -3.03 116.57 117.68 2ja7 h LYS 123 Ca 0.29 0.02 0.16 0.00 -1.27 0.00 0.00 60.65 59.84 2ja7 h LYS 123 Cb 0.86 0.07 -0.15 0.00 -0.41 0.00 0.00 32.23 32.60 2ja7 h LYS 123 CO -0.05 -0.10 -0.26 0.93 -2.27 0.00 0.00 179.45 177.70 2ja7 h GLU 124 N -1.05 -0.03 0.00 1.90 5.08 0.81 0.38 114.58 121.68 2ja7 h GLU 124 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2ja7 h GLU 124 Cb 0.35 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2ja7 h GLU 124 CO 0.05 -0.02 0.00 -0.11 -1.00 0.00 0.00 179.01 177.94 2ja7 n LEU 125 N -5.52 0.00 -0.01 1.33 7.94 0.50 -1.58 117.00 119.67 2ja7 n LEU 125 Ca 0.11 0.50 0.11 0.00 -1.11 0.00 0.00 56.01 55.61 2ja7 n LEU 125 Cb 0.41 -0.50 -0.16 0.00 0.53 0.00 0.00 43.42 43.70 2ja7 n LEU 125 CO -0.06 -0.42 -0.70 0.00 -1.11 0.00 0.00 177.39 175.10 2ja7 n ALA 126 N -1.50 2.94 0.01 1.96 0.00 0.13 -3.81 120.51 120.25 2ja7 n ALA 126 Ca 0.01 -0.52 0.11 0.00 0.00 0.00 0.00 53.44 53.04 2ja7 n ALA 126 Cb 0.05 -0.76 0.24 0.00 0.00 0.00 0.00 19.45 18.98 2ja7 n ALA 126 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ja7 n GLU 127 N -2.21 2.55 -3.14 0.00 1.02 -0.93 -4.93 120.64 113.00 2ja7 n GLU 127 Ca -0.03 -2.36 -0.20 0.00 -0.02 0.00 0.00 57.16 54.56 2ja7 n GLU 127 Cb 0.55 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.47 2ja7 n GLU 127 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2ja7 n LYS 128 N 1.41 -3.03 -1.88 3.49 5.02 -0.77 -4.85 118.16 117.55 2ja7 n LYS 128 Ca 0.20 0.45 -0.37 0.00 -2.02 0.00 0.00 58.31 56.57 2ja7 n LYS 128 Cb 0.58 -5.11 0.01 0.00 -0.02 0.00 0.00 35.03 30.49 2ja7 n LYS 128 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2ja7 n LYS 129 N -3.44 2.95 -3.95 1.97 5.02 -0.61 -4.47 118.16 115.62 2ja7 n LYS 129 Ca -0.04 -3.34 -0.35 0.00 -2.02 0.00 0.00 58.31 52.57 2ja7 n LYS 129 Cb 0.55 -2.27 -0.14 0.00 -0.02 0.00 0.00 35.03 33.15 2ja7 n LYS 129 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2ja7 s ILE 130 N -4.24 2.93 -0.66 -0.18 1.01 -1.26 -4.74 121.20 114.06 2ja7 s ILE 130 Ca 0.53 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 60.14 2ja7 s ILE 130 Cb 0.40 -2.51 0.00 0.00 0.01 0.00 0.00 42.46 40.36 2ja7 s ILE 130 CO -0.34 0.17 0.17 -0.81 0.00 0.00 0.00 174.94 174.13 2ja7 n PRO 131 N 4.67 0.26 -3.92 2.79 -0.04 -1.26 -4.60 135.00 132.90 2ja7 n PRO 131 Ca -0.16 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.05 2ja7 n PRO 131 Cb 0.47 -1.21 -0.03 0.00 -0.04 0.00 0.00 33.50 32.69 2ja7 n PRO 131 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ja7 s LEU 132 N 0.00 4.33 -0.13 1.53 1.43 -1.26 -5.06 118.68 119.52 2ja7 s LEU 132 Ca 0.00 0.18 -0.01 0.00 -1.03 0.00 0.00 54.13 53.27 2ja7 s LEU 132 Cb 0.00 -2.93 0.03 0.00 0.03 0.00 0.00 46.19 43.32 2ja7 s LEU 132 CO 0.00 0.02 -0.06 -0.69 0.23 0.00 0.00 176.35 175.85 2ja7 s VAL 133 N -1.80 0.99 -0.29 -1.59 1.01 -1.26 -2.53 120.40 114.94 2ja7 s VAL 133 Ca 0.35 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.73 2ja7 s VAL 133 Cb -0.11 -1.07 -0.00 0.00 0.00 0.00 0.00 36.38 35.20 2ja7 s VAL 133 CO 0.29 0.29 0.82 -0.63 0.00 0.00 0.00 175.10 175.86 2ja7 s ILE 134 N 1.71 4.79 -0.28 2.22 1.01 0.11 -4.89 121.20 125.86 2ja7 s ILE 134 Ca 0.04 1.34 -0.13 0.00 0.00 0.00 0.00 60.65 61.90 2ja7 s ILE 134 Cb -0.13 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.14 2ja7 s ILE 134 CO -0.08 -0.21 0.27 -0.60 0.00 0.00 0.00 174.94 174.32 2ja7 s ARG 135 N 2.97 3.93 -0.57 2.79 3.52 -1.26 -0.87 118.95 129.46 2ja7 s ARG 135 Ca 0.34 -0.20 -0.16 0.00 -0.13 0.00 0.00 55.73 55.58 2ja7 s ARG 135 Cb -0.14 -3.67 0.14 0.00 -1.56 0.00 0.00 34.95 29.71 2ja7 s ARG 135 CO 0.11 -0.25 0.52 1.03 -0.81 0.00 0.00 175.30 175.90 2ja7 s ARG 136 N 1.89 3.04 0.52 5.12 0.52 0.24 -4.90 118.95 125.39 2ja7 s ARG 136 Ca 0.10 -1.79 -0.20 0.00 -0.52 0.00 0.00 55.73 53.32 2ja7 s ARG 136 Cb -0.16 -4.30 -0.07 0.00 0.52 0.00 0.00 34.95 30.94 2ja7 s ARG 136 CO 0.11 -1.32 1.10 0.71 0.02 0.00 0.00 175.30 175.91 2ja7 s TYR 137 N 1.44 2.78 0.32 -0.53 1.51 -1.26 -1.44 117.35 120.16 2ja7 s TYR 137 Ca 0.05 1.55 0.08 0.00 -1.01 0.00 0.00 57.07 57.74 2ja7 s TYR 137 Cb -0.28 -3.21 -0.03 0.00 -0.11 0.00 0.00 41.96 38.33 2ja7 s TYR 137 CO 0.02 -1.32 0.21 -0.51 -1.11 0.00 0.00 175.55 172.84 2ja7 s LEU 138 N -3.70 3.51 0.41 -1.29 1.43 0.11 -4.94 118.68 114.20 2ja7 s LEU 138 Ca 0.71 -0.54 0.19 0.00 -1.03 0.00 0.00 54.13 53.45 2ja7 s LEU 138 Cb -0.21 -2.06 1.11 0.00 0.03 0.00 0.00 46.19 45.05 2ja7 s LEU 138 CO 0.25 -0.26 1.79 1.55 0.23 0.00 0.00 176.35 179.91 2ja7 h PRO 139 N 1.42 0.38 -0.01 1.29 0.13 -1.97 0.23 132.00 133.47 2ja7 h PRO 139 Ca -0.45 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2ja7 h PRO 139 Cb 1.25 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2ja7 h PRO 139 CO 0.60 0.25 -0.08 -0.40 -0.23 0.00 0.00 178.00 178.14 2ja7 n ASP 140 N -4.58 0.64 0.00 1.44 5.68 -1.26 -4.93 116.55 113.54 2ja7 n ASP 140 Ca 0.24 -0.84 0.00 0.00 -0.50 0.00 0.00 54.79 53.68 2ja7 n ASP 140 Cb 0.84 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.79 2ja7 n ASP 140 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ja7 n GLY 141 N 1.22 2.20 3.79 6.12 0.00 0.79 -5.07 105.19 114.24 2ja7 n GLY 141 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2ja7 n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ja7 s SER 142 N -1.53 6.33 0.32 1.61 1.04 -1.26 -4.64 113.70 115.57 2ja7 s SER 142 Ca 0.00 1.98 0.05 0.00 0.48 0.00 0.00 55.95 58.47 2ja7 s SER 142 Cb 0.00 -2.57 -0.06 0.00 0.10 0.00 0.00 66.02 63.49 2ja7 s SER 142 CO 0.00 -0.79 0.01 0.72 0.98 0.00 0.00 173.24 174.15 2ja7 s PHE 143 N -1.90 2.05 0.00 5.02 -0.12 -0.78 0.04 117.98 122.31 2ja7 s PHE 143 Ca 0.66 -0.81 0.05 0.00 -0.05 0.00 0.00 56.93 56.79 2ja7 s PHE 143 Cb -0.18 -1.30 -0.02 0.00 -0.63 0.00 0.00 43.02 40.89 2ja7 s PHE 143 CO 0.22 0.19 -0.16 -1.21 -0.05 0.00 0.00 175.22 174.21 2ja7 s GLU 144 N -3.80 1.22 -0.15 1.99 2.02 -0.52 -2.39 118.70 117.06 2ja7 s GLU 144 Ca 0.34 -0.64 -0.03 0.00 0.02 0.00 0.00 54.97 54.66 2ja7 s GLU 144 Cb 0.07 -1.20 -0.02 0.00 0.10 0.00 0.00 34.13 33.07 2ja7 s GLU 144 CO 0.15 0.32 -0.06 -0.51 0.02 0.00 0.00 175.26 175.18 2ja7 s ASP 145 N -0.61 4.56 0.14 -0.19 1.11 -1.26 0.79 116.67 121.21 2ja7 s ASP 145 Ca 0.05 -0.20 0.06 0.00 0.18 0.00 0.00 52.55 52.64 2ja7 s ASP 145 Cb -0.07 -1.74 -0.04 0.00 1.07 0.00 0.00 42.92 42.15 2ja7 s ASP 145 CO 0.00 0.15 -0.14 0.26 1.18 0.00 0.00 175.17 176.63 2ja7 s TRP 146 N 0.44 1.45 -0.05 4.23 0.52 -0.05 -4.99 118.94 120.50 2ja7 s TRP 146 Ca -0.05 -0.59 0.04 0.00 0.02 0.00 0.00 56.10 55.51 2ja7 s TRP 146 Cb -0.15 -0.74 -0.03 0.00 -1.15 0.00 0.00 33.47 31.41 2ja7 s TRP 146 CO 0.03 0.18 -0.14 -1.54 0.02 0.00 0.00 176.95 175.51 2ja7 s SER 147 N -2.75 4.09 0.39 2.95 1.04 -1.26 0.06 113.70 118.23 2ja7 s SER 147 Ca 0.13 -0.19 0.19 0.00 0.48 0.00 0.00 55.95 56.56 2ja7 s SER 147 Cb -0.03 -0.87 1.13 0.00 0.10 0.00 0.00 66.02 66.35 2ja7 s SER 147 CO 0.03 0.34 1.74 -0.37 0.98 0.00 0.00 173.24 175.97 2ja7 h VAL 148 N 4.30 0.46 0.01 5.02 -1.51 -1.74 0.23 116.25 123.01 2ja7 h VAL 148 Ca -0.47 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.88 2ja7 h VAL 148 Cb 1.15 0.06 -0.00 0.00 -2.13 0.00 0.00 31.29 30.38 2ja7 h VAL 148 CO 0.50 0.07 -0.02 -0.08 -1.23 0.00 0.00 177.57 176.81 2ja7 h GLU 149 N 0.36 -0.03 0.00 5.19 4.81 -1.81 -3.29 114.58 119.80 2ja7 h GLU 149 Ca 0.64 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.87 2ja7 h GLU 149 Cb 1.64 0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.03 2ja7 h GLU 149 CO -0.34 -0.02 0.00 0.39 -0.73 0.00 0.00 179.01 178.30 2ja7 n GLU 150 N -2.51 0.00 -0.43 1.92 1.02 0.71 -4.73 120.64 116.61 2ja7 n GLU 150 Ca -0.00 0.46 -0.17 0.00 -0.02 0.00 0.00 57.16 57.43 2ja7 n GLU 150 Cb 0.02 -1.12 -0.02 0.00 -0.02 0.00 0.00 31.44 30.29 2ja7 n GLU 150 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2ja7 n LEU 151 N -1.30 0.16 -4.77 -4.62 4.77 -0.59 -4.88 117.00 105.76 2ja7 n LEU 151 Ca 0.00 0.31 -0.38 0.00 -0.03 0.00 0.00 56.01 55.92 2ja7 n LEU 151 Cb 0.00 -0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 40.80 2ja7 n LEU 151 CO 0.00 -0.37 0.71 -0.63 -1.33 0.00 0.00 177.39 175.77 2ja7 s ILE 152 N 0.39 3.86 -0.55 -0.08 1.01 -0.90 -4.79 121.20 120.14 2ja7 s ILE 152 Ca 0.26 1.58 0.04 0.00 0.00 0.00 0.00 60.65 62.53 2ja7 s ILE 152 Cb -0.37 -3.90 0.14 0.00 0.01 0.00 0.00 42.46 38.34 2ja7 s ILE 152 CO 0.19 0.16 0.30 0.68 0.00 0.00 0.00 174.94 176.27 2ja7 s VAL 153 N -1.50 2.55 0.00 2.92 -7.23 -1.26 -1.26 120.40 114.61 2ja7 s VAL 153 Ca 0.51 -3.45 0.00 0.00 -1.81 0.00 0.00 61.98 57.24 2ja7 s VAL 153 Cb -0.23 -2.75 0.00 0.00 0.56 0.00 0.00 36.38 33.96 2ja7 s VAL 153 CO 0.29 -0.85 0.00 -0.67 -0.31 0.00 0.00 175.10 173.57 2ja7 n ASP 154 N 2.92 0.00 0.00 4.85 -0.08 -1.26 -5.08 116.55 117.90 2ja7 n ASP 154 Ca 0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 2ja7 n ASP 154 Cb 0.33 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.79 2ja7 n ASP 154 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50