#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1je5 n ALA 2 N 0.00 5.81 -1.20 -5.12 0.00 -1.26 -4.83 120.51 113.90 1je5 n ALA 2 Ca 0.00 -4.61 0.00 0.00 0.00 0.00 0.00 53.44 48.83 1je5 n ALA 2 Cb 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.10 1je5 n ALA 2 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1je5 n LYS 3 N 0.81 0.00 -2.59 0.00 3.00 -1.26 -4.81 118.16 113.31 1je5 n LYS 3 Ca 0.41 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 58.29 1je5 n LYS 3 Cb 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.30 1je5 n LYS 3 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1je5 s LYS 4 N 0.01 4.27 -0.19 1.64 2.20 -1.26 -5.01 119.74 121.41 1je5 s LYS 4 Ca 0.00 1.46 -0.06 0.00 -0.36 0.00 0.00 55.97 57.00 1je5 s LYS 4 Cb 0.00 -3.66 -0.04 0.00 -1.51 0.00 0.00 37.83 32.63 1je5 s LYS 4 CO 0.00 -0.61 0.03 0.42 -0.36 0.00 0.00 175.35 174.84 1je5 s ILE 5 N 3.11 4.46 0.24 5.43 -1.09 -1.26 -4.40 121.20 127.68 1je5 s ILE 5 Ca 0.48 -0.15 0.07 0.00 -2.23 0.00 0.00 60.65 58.82 1je5 s ILE 5 Cb -0.18 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.66 1je5 s ILE 5 CO 0.10 0.45 0.12 -0.36 -1.23 0.00 0.00 174.94 174.02 1je5 s PHE 6 N 0.56 2.99 -0.06 3.97 0.40 0.14 -4.92 117.98 121.06 1je5 s PHE 6 Ca 0.01 -0.13 0.06 0.00 -0.60 0.00 0.00 56.93 56.27 1je5 s PHE 6 Cb -0.13 -1.36 -0.01 0.00 0.51 0.00 0.00 43.02 42.03 1je5 s PHE 6 CO 0.02 0.55 -0.24 0.99 0.70 0.00 0.00 175.22 177.23 1je5 s THR 7 N -2.09 1.99 0.84 0.64 2.01 -1.26 -0.96 115.64 116.81 1je5 s THR 7 Ca 0.32 -1.03 -0.13 0.00 0.31 0.00 0.00 61.69 61.16 1je5 s THR 7 Cb -0.08 -1.69 0.10 0.00 0.01 0.00 0.00 72.50 70.84 1je5 s THR 7 CO 0.23 0.55 1.19 -0.94 -0.69 0.00 0.00 174.62 174.96 1je5 s SER 8 N -0.09 4.19 0.82 3.53 1.04 0.12 -4.98 113.70 118.32 1je5 s SER 8 Ca -0.05 0.75 -0.12 0.00 0.48 0.00 0.00 55.95 57.00 1je5 s SER 8 Cb -0.14 -1.19 0.08 0.00 0.10 0.00 0.00 66.02 64.87 1je5 s SER 8 CO 0.04 -2.10 1.15 0.00 0.98 0.00 0.00 173.24 173.31 1je5 s ALA 9 N -3.57 2.45 0.13 5.32 0.00 -1.26 -4.58 121.76 120.24 1je5 s ALA 9 Ca 0.64 -0.53 -0.31 0.00 0.00 0.00 0.00 51.96 51.75 1je5 s ALA 9 Cb -0.11 -3.00 -0.08 0.00 0.00 0.00 0.00 23.12 19.93 1je5 s ALA 9 CO 0.50 -1.74 1.42 -1.17 0.00 0.00 0.00 175.76 174.77 1je5 s LEU 10 N -5.67 4.37 0.00 0.00 2.96 -1.26 -4.61 118.68 114.47 1je5 s LEU 10 Ca 0.62 2.38 0.03 0.00 -0.22 0.00 0.00 54.13 56.93 1je5 s LEU 10 Cb -0.12 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 42.97 1je5 s LEU 10 CO 0.51 -0.68 0.13 0.61 -1.32 0.00 0.00 176.35 175.60 1je5 n GLY 11 N 3.50 3.44 3.26 7.98 0.00 0.22 -4.66 105.19 118.93 1je5 n GLY 11 Ca 0.12 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.09 1je5 n GLY 11 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1je5 s THR 12 N -2.58 2.33 0.22 2.61 2.01 0.10 -1.32 115.64 119.01 1je5 s THR 12 Ca 0.16 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 60.94 1je5 s THR 12 Cb 0.01 -1.91 -0.08 0.00 0.01 0.00 0.00 72.50 70.52 1je5 s THR 12 CO 0.12 0.55 1.07 0.00 -0.69 0.00 0.00 174.62 175.67 1je5 s ALA 13 N 0.30 3.37 0.61 7.40 0.00 0.11 -0.67 121.76 132.89 1je5 s ALA 13 Ca -0.16 0.80 -0.12 0.00 0.00 0.00 0.00 51.96 52.48 1je5 s ALA 13 Cb -0.17 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 1je5 s ALA 13 CO 0.08 -0.13 1.03 -1.21 0.00 0.00 0.00 175.76 175.53 1je5 s GLU 14 N -0.82 3.54 0.86 0.00 0.41 -0.08 -1.16 118.70 121.45 1je5 s GLU 14 Ca 0.46 0.84 -0.11 0.00 -0.41 0.00 0.00 54.97 55.75 1je5 s GLU 14 Cb -0.29 -2.07 0.11 0.00 -1.78 0.00 0.00 34.13 30.10 1je5 s GLU 14 CO 0.36 -0.62 1.15 -1.25 -0.49 0.00 0.00 175.26 174.42 1je5 s PRO 15 N -4.93 1.40 -0.89 0.39 0.04 -1.26 -4.01 135.00 125.74 1je5 s PRO 15 Ca 0.56 1.54 -0.05 0.00 0.04 0.00 0.00 61.00 63.10 1je5 s PRO 15 Cb -0.12 -1.77 0.01 0.00 0.04 0.00 0.00 34.50 32.66 1je5 s PRO 15 CO 0.50 -2.35 0.66 0.66 0.04 0.00 0.00 177.00 176.51 1je5 n TYR 16 N -3.85 -1.69 -1.82 0.56 0.53 -1.26 -4.92 117.16 104.71 1je5 n TYR 16 Ca 0.12 0.57 -0.31 0.00 -1.02 0.00 0.00 57.90 57.26 1je5 n TYR 16 Cb 0.52 -3.48 0.03 0.00 -1.03 0.00 0.00 39.34 35.37 1je5 n TYR 16 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1je5 s ALA 17 N -3.14 2.97 -0.45 -0.72 0.00 -1.26 -4.97 121.76 114.19 1je5 s ALA 17 Ca 0.33 -0.13 0.03 0.00 0.00 0.00 0.00 51.96 52.19 1je5 s ALA 17 Cb -0.15 -3.08 0.13 0.00 0.00 0.00 0.00 23.12 20.02 1je5 s ALA 17 CO 0.41 -0.89 0.23 0.71 0.00 0.00 0.00 175.76 176.21 1je5 s TYR 18 N -3.20 2.39 -0.01 0.00 1.51 0.56 -4.89 117.35 113.71 1je5 s TYR 18 Ca 0.56 -2.63 -0.00 0.00 -1.01 0.00 0.00 57.07 53.99 1je5 s TYR 18 Cb -0.11 -2.19 -0.01 0.00 -0.11 0.00 0.00 41.96 39.53 1je5 s TYR 18 CO 0.54 -0.78 -0.01 -0.89 -1.11 0.00 0.00 175.55 173.29 1je5 n ILE 19 N 3.52 0.06 0.24 2.71 5.41 -1.26 -1.42 119.36 128.63 1je5 n ILE 19 Ca 0.07 -0.02 0.11 0.00 1.00 0.00 0.00 62.75 63.91 1je5 n ILE 19 Cb 0.34 -1.16 0.56 0.00 -0.71 0.00 0.00 39.64 38.68 1je5 n ILE 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1je5 h ALA 20 N -0.02 1.10 -2.53 -1.39 0.00 -1.89 -3.45 119.26 111.07 1je5 h ALA 20 Ca -0.03 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1je5 h ALA 20 Cb 1.03 -0.03 -0.16 0.00 0.00 0.00 0.00 17.79 18.63 1je5 h ALA 20 CO -0.01 0.23 0.07 -1.59 0.00 0.00 0.00 179.25 177.95 1je5 s LYS 21 N -3.82 1.07 0.69 0.00 -2.85 -1.26 -4.95 119.74 108.61 1je5 s LYS 21 Ca -0.01 -0.24 -0.06 0.00 -1.00 0.00 0.00 55.97 54.66 1je5 s LYS 21 Cb 0.11 0.49 0.05 0.00 -2.06 0.00 0.00 37.83 36.42 1je5 s LYS 21 CO 0.61 -0.40 1.00 -1.25 0.10 0.00 0.00 175.35 175.41 1je5 s PRO 22 N -2.56 2.31 -0.49 1.78 0.04 -1.26 -4.53 135.00 130.29 1je5 s PRO 22 Ca -0.05 -0.22 -0.22 0.00 0.04 0.00 0.00 61.00 60.56 1je5 s PRO 22 Cb -0.01 -2.19 0.04 0.00 0.04 0.00 0.00 34.50 32.38 1je5 s PRO 22 CO -0.03 -1.15 0.75 0.34 0.04 0.00 0.00 177.00 176.95 1je5 s ASP 23 N -4.48 6.32 -0.71 6.66 2.15 0.90 -4.81 116.67 122.70 1je5 s ASP 23 Ca 0.59 -0.45 -0.01 0.00 0.43 0.00 0.00 52.55 53.11 1je5 s ASP 23 Cb -0.11 -2.36 0.42 0.00 -0.30 0.00 0.00 42.92 40.57 1je5 s ASP 23 CO 0.45 -0.96 1.97 -1.22 -0.17 0.00 0.00 175.17 175.24 1je5 n TYR 24 N 6.65 3.13 -0.31 -5.34 4.02 -1.26 -2.08 117.16 121.97 1je5 n TYR 24 Ca -0.01 -2.76 0.06 0.00 -0.01 0.00 0.00 57.90 55.17 1je5 n TYR 24 Cb 0.47 -1.28 0.15 0.00 -0.02 0.00 0.00 39.34 38.66 1je5 n TYR 24 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1je5 h GLY 25 N 2.36 0.75 -4.65 2.72 0.00 -1.91 -3.50 103.07 98.83 1je5 h GLY 25 Ca 0.58 0.25 -0.25 0.00 0.00 0.00 0.00 47.33 47.90 1je5 h GLY 25 CO 1.49 -0.36 -0.36 1.16 0.00 0.00 0.00 176.54 178.47 1je5 n ASN 26 N -5.53 -0.79 -3.92 0.19 0.23 -1.26 -4.82 115.26 99.36 1je5 n ASN 26 Ca 0.15 -0.47 -0.37 0.00 -0.53 0.00 0.00 54.58 53.36 1je5 n ASN 26 Cb 0.49 -0.70 0.02 0.00 -2.08 0.00 0.00 39.78 37.51 1je5 n ASN 26 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1je5 n GLY 30 N -0.69 -1.02 3.78 4.83 0.00 -1.26 -4.82 105.19 106.01 1je5 n GLY 30 Ca 0.05 0.44 -0.39 0.00 0.00 0.00 0.00 46.02 46.12 1je5 n GLY 30 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1je5 s PHE 31 N -3.33 3.76 -5.00 1.61 0.40 -1.26 -4.83 117.98 109.33 1je5 s PHE 31 Ca 0.32 1.31 0.00 0.00 -0.60 0.00 0.00 56.93 57.96 1je5 s PHE 31 Cb -0.17 -2.62 0.00 0.00 0.51 0.00 0.00 43.02 40.75 1je5 s PHE 31 CO 0.93 0.44 0.00 0.41 0.70 0.00 0.00 175.22 177.70 1je5 n GLY 32 N 2.10 0.48 3.05 4.36 0.00 -1.26 -5.03 105.19 108.88 1je5 n GLY 32 Ca -0.07 -1.50 -0.52 0.00 0.00 0.00 0.00 46.02 43.92 1je5 n GLY 32 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1je5 n ASN 33 N 0.00 0.62 -0.07 1.61 2.85 -1.26 -4.67 115.26 114.33 1je5 n ASN 33 Ca 0.00 0.55 -0.02 0.00 -0.11 0.00 0.00 54.58 55.00 1je5 n ASN 33 Cb 0.00 -0.84 0.23 0.00 1.24 0.00 0.00 39.78 40.42 1je5 n ASN 33 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1je5 h PRO 34 N 8.82 0.69 -6.23 1.20 0.11 -1.96 -3.43 132.00 131.20 1je5 h PRO 34 Ca -0.08 -0.15 -0.66 0.00 0.11 0.00 0.00 66.00 65.22 1je5 h PRO 34 Cb 1.30 -0.10 0.09 0.00 0.11 0.00 0.00 31.00 32.40 1je5 h PRO 34 CO 1.06 0.67 -0.05 -2.13 -0.21 0.00 0.00 178.00 177.34 1je5 n ARG 35 N -4.27 0.73 -1.46 1.05 3.00 -1.26 -4.77 116.66 109.68 1je5 n ARG 35 Ca 0.03 0.26 -0.30 0.00 -0.00 0.00 0.00 57.85 57.83 1je5 n ARG 35 Cb 0.24 -1.56 0.08 0.00 0.00 0.00 0.00 32.46 31.23 1je5 n ARG 35 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1je5 s GLY 36 N -0.48 1.65 -0.03 5.14 0.00 -1.26 -4.89 107.32 107.44 1je5 s GLY 36 Ca 0.68 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 45.39 1je5 s GLY 36 CO 0.56 0.37 0.00 0.14 0.00 0.00 0.00 173.10 174.18 1je5 s VAL 37 N -3.04 0.15 0.05 1.40 1.01 -0.88 -1.09 120.40 118.00 1je5 s VAL 37 Ca 0.60 0.10 -0.13 0.00 0.00 0.00 0.00 61.98 62.56 1je5 s VAL 37 Cb -0.15 -0.26 -0.06 0.00 0.00 0.00 0.00 36.38 35.91 1je5 s VAL 37 CO 0.55 0.14 0.42 -0.31 0.00 0.00 0.00 175.10 175.91 1je5 s TYR 38 N 1.07 3.65 0.01 5.22 1.51 0.07 -0.07 117.35 128.82 1je5 s TYR 38 Ca -0.09 0.92 -0.28 0.00 -1.01 0.00 0.00 57.07 56.61 1je5 s TYR 38 Cb -0.13 -2.25 0.08 0.00 -0.11 0.00 0.00 41.96 39.55 1je5 s TYR 38 CO -0.02 0.57 0.72 -1.59 -1.11 0.00 0.00 175.55 174.12 1je5 s LYS 39 N -1.53 1.04 -0.21 -0.62 -2.85 -0.50 -1.32 119.74 113.75 1je5 s LYS 39 Ca 0.29 -0.08 -0.22 0.00 -1.00 0.00 0.00 55.97 54.97 1je5 s LYS 39 Cb -0.15 0.48 0.06 0.00 -2.06 0.00 0.00 37.83 36.16 1je5 s LYS 39 CO 0.16 -0.39 0.60 0.54 0.10 0.00 0.00 175.35 176.36 1je5 s VAL 40 N -2.31 0.00 -0.26 1.79 0.11 -0.72 -0.32 120.40 118.69 1je5 s VAL 40 Ca -0.04 -0.01 -0.08 0.00 -2.93 0.00 0.00 61.98 58.92 1je5 s VAL 40 Cb -0.01 -0.85 -0.03 0.00 -1.53 0.00 0.00 36.38 33.97 1je5 s VAL 40 CO -0.01 -0.01 0.09 -1.81 -3.33 0.00 0.00 175.10 170.03 1je5 s ASP 41 N 0.16 5.26 -0.22 3.54 1.01 -1.26 -1.41 116.67 123.76 1je5 s ASP 41 Ca -0.01 -0.23 -0.06 0.00 0.71 0.00 0.00 52.55 52.97 1je5 s ASP 41 Cb -0.04 -1.95 -0.02 0.00 1.01 0.00 0.00 42.92 41.92 1je5 s ASP 41 CO 0.02 -0.05 0.02 -0.22 0.21 0.00 0.00 175.17 175.14 1je5 s LEU 42 N 1.63 3.26 -0.24 1.23 0.20 0.29 -0.90 118.68 124.14 1je5 s LEU 42 Ca 0.06 -0.24 -0.08 0.00 0.69 0.00 0.00 54.13 54.56 1je5 s LEU 42 Cb -0.15 -1.84 -0.04 0.00 -0.43 0.00 0.00 46.19 43.73 1je5 s LEU 42 CO 0.05 0.02 0.10 -0.89 -0.29 0.00 0.00 176.35 175.34 1je5 s THR 43 N 1.29 4.71 -0.03 3.68 2.01 0.15 -0.27 115.64 127.17 1je5 s THR 43 Ca 0.04 -0.04 0.07 0.00 0.31 0.00 0.00 61.69 62.07 1je5 s THR 43 Cb -0.15 -3.20 -0.02 0.00 0.01 0.00 0.00 72.50 69.15 1je5 s THR 43 CO 0.01 0.34 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.40 1je5 s ILE 44 N 1.38 2.04 0.21 1.82 1.01 0.49 -0.72 121.20 127.43 1je5 s ILE 44 Ca 0.06 -1.09 -0.31 0.00 0.00 0.00 0.00 60.65 59.31 1je5 s ILE 44 Cb -0.15 -1.70 -0.11 0.00 0.01 0.00 0.00 42.46 40.51 1je5 s ILE 44 CO 0.05 0.57 1.61 -2.84 0.00 0.00 0.00 174.94 174.33 1je5 s PRO 45 N -0.43 4.18 0.49 2.79 0.02 -1.26 -0.91 135.00 139.87 1je5 s PRO 45 Ca 0.05 2.47 0.18 0.00 0.02 0.00 0.00 61.00 63.72 1je5 s PRO 45 Cb -0.11 -3.10 1.22 0.00 0.02 0.00 0.00 34.50 32.52 1je5 s PRO 45 CO 0.01 -0.63 2.08 -0.91 -0.33 0.00 0.00 177.00 177.21 1je5 h ASN 46 N 6.23 0.00 0.79 2.53 2.35 -0.75 -2.07 115.58 124.66 1je5 h ASN 46 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1je5 h ASN 46 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 1je5 h ASN 46 CO 0.89 0.10 0.00 2.29 -1.65 0.00 0.00 177.43 179.06 1je5 n LYS 47 N -4.27 0.00 -2.36 0.81 2.85 -1.26 -4.60 118.16 109.33 1je5 n LYS 47 Ca -0.03 0.11 -0.42 0.00 -1.05 0.00 0.00 58.31 56.92 1je5 n LYS 47 Cb 0.18 -1.50 -0.03 0.00 -0.65 0.00 0.00 35.03 33.03 1je5 n LYS 47 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1je5 s ASP 48 N -3.00 6.95 0.52 -5.58 -1.08 -0.78 -4.89 116.67 108.81 1je5 s ASP 48 Ca 0.11 1.91 0.20 0.00 -0.52 0.00 0.00 52.55 54.25 1je5 s ASP 48 Cb 0.15 -2.55 1.30 0.00 -1.46 0.00 0.00 42.92 40.36 1je5 s ASP 48 CO 0.42 -0.67 2.06 -0.65 0.52 0.00 0.00 175.17 176.85 1je5 h PRO 49 N 7.78 0.04 0.00 4.34 0.11 -1.88 -1.59 132.00 140.81 1je5 h PRO 49 Ca -0.34 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.68 1je5 h PRO 49 Cb 1.16 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1je5 h PRO 49 CO 0.90 0.03 -0.40 -0.09 -0.21 0.00 0.00 178.00 178.24 1je5 h ARG 50 N 0.05 0.00 -0.12 1.05 9.65 -1.93 -2.69 114.38 120.39 1je5 h ARG 50 Ca 0.14 0.00 0.01 0.00 -1.10 0.00 0.00 59.98 59.03 1je5 h ARG 50 Cb 0.52 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.09 1je5 h ARG 50 CO -0.01 0.40 0.06 0.00 2.80 0.00 0.00 179.97 183.22 1je5 h GLN 52 N 0.13 0.64 -0.27 0.00 -0.00 -1.60 -2.15 115.11 111.86 1je5 h GLN 52 Ca 0.05 -0.14 -0.13 0.00 -0.00 0.00 0.00 58.65 58.43 1je5 h GLN 52 Cb 0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.38 1je5 h GLN 52 CO -0.03 0.64 -0.35 0.00 0.00 0.00 0.00 178.83 179.09 1je5 h ARG 53 N 0.61 0.60 -0.30 1.69 2.47 -1.11 -1.26 114.38 117.08 1je5 h ARG 53 Ca 0.13 -0.28 -0.00 0.00 -1.26 0.00 0.00 59.98 58.57 1je5 h ARG 53 Cb 0.34 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.64 1je5 h ARG 53 CO 0.01 0.87 0.19 0.52 0.56 0.00 0.00 179.97 182.11 1je5 h MET 54 N 0.51 0.40 -0.28 0.04 2.86 -0.27 -1.35 114.93 116.84 1je5 h MET 54 Ca 0.05 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1je5 h MET 54 Cb 0.85 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.41 1je5 h MET 54 CO 0.07 0.29 0.16 0.28 1.06 0.00 0.00 176.91 178.78 1je5 h VAL 55 N 0.39 1.11 -0.81 -2.22 2.07 -1.22 -2.06 116.25 113.51 1je5 h VAL 55 Ca 0.11 -0.28 0.12 0.00 0.82 0.00 0.00 66.70 67.47 1je5 h VAL 55 Cb -0.01 0.79 -0.08 0.00 -1.52 0.00 0.00 31.29 30.47 1je5 h VAL 55 CO -0.02 0.11 0.42 0.44 0.02 0.00 0.00 177.57 178.54 1je5 h ASP 56 N 0.34 0.54 -0.41 0.57 3.32 -0.91 0.76 116.42 120.63 1je5 h ASP 56 Ca 0.10 0.08 -0.11 0.00 0.02 0.00 0.00 57.03 57.11 1je5 h ASP 56 Cb 0.04 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1je5 h ASP 56 CO -0.02 0.26 -0.17 -0.33 -1.72 0.00 0.00 179.24 177.27 1je5 h GLU 57 N 0.65 0.84 -0.20 3.56 5.08 -0.99 0.75 114.58 124.28 1je5 h GLU 57 Ca 0.42 -0.35 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1je5 h GLU 57 Cb 0.52 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1je5 h GLU 57 CO -0.32 0.99 -0.04 0.82 -1.00 0.00 0.00 179.01 179.46 1je5 h ILE 58 N 0.65 1.28 -0.87 3.13 2.04 -0.79 -1.32 117.51 121.64 1je5 h ILE 58 Ca 0.09 -1.01 -0.02 0.00 1.00 0.00 0.00 64.86 64.93 1je5 h ILE 58 Cb 0.72 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 38.31 1je5 h ILE 58 CO 0.05 0.31 0.48 0.58 0.00 0.00 0.00 178.15 179.57 1je5 h VAL 59 N 0.10 1.25 -0.55 1.67 2.07 -0.79 0.92 116.25 120.93 1je5 h VAL 59 Ca 0.05 -0.62 -0.05 0.00 0.82 0.00 0.00 66.70 66.90 1je5 h VAL 59 Cb 0.48 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1je5 h VAL 59 CO 0.02 0.28 0.14 0.50 0.02 0.00 0.00 177.57 178.53 1je5 h LYS 60 N 1.21 0.87 -0.39 1.57 3.64 -0.77 0.15 116.57 122.85 1je5 h LYS 60 Ca 0.31 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1je5 h LYS 60 Cb 0.02 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1je5 h LYS 60 CO -0.05 0.82 0.21 0.00 -2.27 0.00 0.00 179.45 178.16 1je5 h HIS 62 N 0.50 -0.14 -0.74 0.00 -0.00 -0.54 -1.33 115.15 112.91 1je5 h HIS 62 Ca 0.14 -0.00 0.07 0.00 -0.00 0.00 0.00 60.37 60.57 1je5 h HIS 62 Cb 0.06 0.05 -0.06 0.00 -0.00 0.00 0.00 27.41 27.46 1je5 h HIS 62 CO -0.02 0.03 0.42 0.93 -0.00 0.00 0.00 177.93 179.28 1je5 h GLU 63 N -0.28 0.72 0.06 5.26 5.08 -0.59 0.23 114.58 125.06 1je5 h GLU 63 Ca -0.02 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1je5 h GLU 63 Cb 0.23 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1je5 h GLU 63 CO 0.03 0.48 -0.03 1.49 -1.00 0.00 0.00 179.01 179.98 1je5 h GLU 64 N 0.74 -0.07 -0.34 2.33 4.22 -1.10 -0.72 114.58 119.63 1je5 h GLU 64 Ca 0.34 0.01 -0.14 0.00 0.08 0.00 0.00 59.36 59.64 1je5 h GLU 64 Cb 0.24 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1je5 h GLU 64 CO -0.20 0.12 -0.34 0.00 -2.18 0.00 0.00 179.01 176.40 1je5 h ALA 65 N 0.67 0.75 -0.52 2.92 0.00 -0.94 -2.18 119.26 119.96 1je5 h ALA 65 Ca -0.01 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 1je5 h ALA 65 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1je5 h ALA 65 CO 0.01 0.66 -0.06 -0.92 0.00 0.00 0.00 179.25 178.94 1je5 h TYR 66 N 0.64 1.06 -0.79 0.00 3.20 -0.54 -0.52 116.97 120.02 1je5 h TYR 66 Ca 0.06 -0.21 -0.01 0.00 3.14 0.00 0.00 58.73 61.72 1je5 h TYR 66 Cb 0.89 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.85 1je5 h TYR 66 CO 0.05 0.99 0.45 0.00 -1.64 0.00 0.00 178.16 178.00 1je5 h ALA 67 N 0.92 1.01 -0.38 1.82 0.00 -1.06 0.55 119.26 122.13 1je5 h ALA 67 Ca 0.14 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1je5 h ALA 67 Cb 0.61 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1je5 h ALA 67 CO 0.04 0.51 -0.06 0.00 0.00 0.00 0.00 179.25 179.73 1je5 h ALA 68 N 1.24 0.52 -0.63 0.00 0.00 -1.10 -1.55 119.26 117.74 1je5 h ALA 68 Ca 0.28 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1je5 h ALA 68 Cb 0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1je5 h ALA 68 CO -0.05 0.36 0.21 0.00 0.00 0.00 0.00 179.25 179.77 1je5 h ALA 69 N 0.85 0.82 -0.32 0.00 0.00 -0.77 -1.14 119.26 118.69 1je5 h ALA 69 Ca 0.10 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1je5 h ALA 69 Cb 0.56 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1je5 h ALA 69 CO 0.03 0.48 0.08 0.28 0.00 0.00 0.00 179.25 180.13 1je5 h VAL 70 N 0.90 1.22 -0.74 0.00 2.07 -0.81 -0.93 116.25 117.96 1je5 h VAL 70 Ca 0.21 -0.72 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 1je5 h VAL 70 Cb 0.27 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1je5 h VAL 70 CO -0.01 0.24 0.26 -0.33 0.02 0.00 0.00 177.57 177.75 1je5 h GLU 71 N 0.36 1.12 -0.53 1.57 5.08 -1.08 0.10 114.58 121.21 1je5 h GLU 71 Ca 0.10 -0.22 0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1je5 h GLU 71 Cb 0.28 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1je5 h GLU 71 CO -0.00 0.93 0.32 1.49 -1.00 0.00 0.00 179.01 180.75 1je5 h GLU 72 N 1.08 0.62 -0.22 2.33 4.81 -1.02 -0.47 114.58 121.72 1je5 h GLU 72 Ca 0.24 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.37 1je5 h GLU 72 Cb 0.26 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1je5 h GLU 72 CO -0.01 0.41 -0.11 -0.92 -0.73 0.00 0.00 179.01 177.65 1je5 h TYR 73 N 0.63 0.53 0.00 0.92 3.20 -0.76 -3.07 116.97 118.42 1je5 h TYR 73 Ca 0.21 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1je5 h TYR 73 Cb 0.02 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.16 1je5 h TYR 73 CO -0.06 0.74 -0.05 0.93 -1.64 0.00 0.00 178.16 178.08 1je5 h GLU 74 N 0.17 0.00 0.00 1.82 4.39 -0.65 -0.78 114.58 119.53 1je5 h GLU 74 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1je5 h GLU 74 Cb 0.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1je5 h GLU 74 CO 0.03 0.05 0.00 0.00 -1.16 0.00 0.00 179.01 177.93 1je5 h ALA 75 N 1.95 1.00 -0.48 3.43 0.00 -0.98 -3.38 119.26 120.80 1je5 h ALA 75 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1je5 h ALA 75 Cb 0.52 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.16 1je5 h ALA 75 CO 0.01 0.00 -0.33 -1.71 0.00 0.00 0.00 179.25 177.21 1je5 n ASN 76 N -2.84 -2.54 -4.63 0.00 4.05 -0.97 -5.10 115.26 103.23 1je5 n ASN 76 Ca 0.02 -2.27 -0.43 0.00 0.45 0.00 0.00 54.58 52.35 1je5 n ASN 76 Cb 0.35 1.35 -0.03 0.00 1.23 0.00 0.00 39.78 42.68 1je5 n ASN 76 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 1je5 n PRO 77 N 2.46 2.48 -0.01 1.20 -0.02 -0.34 -4.84 135.00 135.93 1je5 n PRO 77 Ca 0.13 0.83 -0.06 0.00 -2.02 0.00 0.00 63.50 62.39 1je5 n PRO 77 Cb 0.61 -3.08 -0.04 0.00 -0.02 0.00 0.00 33.50 30.97 1je5 n PRO 77 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1je5 h PRO 78 N 12.31 -0.10 -4.31 0.52 0.13 -1.97 -3.51 132.00 135.07 1je5 h PRO 78 Ca -0.46 0.01 -0.58 0.00 -0.87 0.00 0.00 66.00 64.09 1je5 h PRO 78 Cb 1.24 0.02 -0.38 0.00 0.13 0.00 0.00 31.00 32.02 1je5 h PRO 78 CO 0.95 0.19 -0.80 -1.25 -0.23 0.00 0.00 178.00 176.86 1je5 s PRO 86 N -2.20 1.64 -0.55 1.56 0.04 -1.26 -5.25 135.00 128.97 1je5 s PRO 86 Ca -0.07 -0.71 -0.20 0.00 0.04 0.00 0.00 61.00 60.06 1je5 s PRO 86 Cb -0.00 -2.26 0.07 0.00 0.04 0.00 0.00 34.50 32.35 1je5 s PRO 86 CO 0.24 -0.47 0.75 -1.17 0.04 0.00 0.00 177.00 176.39 1je5 s LEU 87 N 1.52 4.81 0.28 -3.56 2.96 -1.26 -5.07 118.68 118.36 1je5 s LEU 87 Ca -0.01 -0.93 0.03 0.00 -0.22 0.00 0.00 54.13 53.00 1je5 s LEU 87 Cb -0.16 -2.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.01 1je5 s LEU 87 CO -0.08 -1.08 0.43 -0.54 -1.32 0.00 0.00 176.35 173.77 1je5 s LYS 88 N 3.09 3.46 0.38 1.98 1.02 -1.26 -5.05 119.74 123.36 1je5 s LYS 88 Ca 0.18 -0.55 -0.28 0.00 0.02 0.00 0.00 55.97 55.34 1je5 s LYS 88 Cb -0.19 -2.80 -0.10 0.00 -0.52 0.00 0.00 37.83 34.22 1je5 s LYS 88 CO 0.12 0.32 1.44 -2.14 -0.92 0.00 0.00 175.35 174.17 1je5 s PRO 89 N -4.04 4.09 0.12 -1.68 0.02 -1.26 -4.99 135.00 127.26 1je5 s PRO 89 Ca 0.37 2.48 -0.24 0.00 0.02 0.00 0.00 61.00 63.63 1je5 s PRO 89 Cb -0.09 -2.94 0.07 0.00 0.02 0.00 0.00 34.50 31.55 1je5 s PRO 89 CO 0.32 -0.51 0.59 1.52 -0.33 0.00 0.00 177.00 178.59 1je5 s TYR 90 N -1.14 -0.53 -0.04 6.54 -0.85 -1.26 -5.10 117.35 114.98 1je5 s TYR 90 Ca 0.53 0.43 -0.04 0.00 -0.52 0.00 0.00 57.07 57.48 1je5 s TYR 90 Cb -0.45 0.50 -0.04 0.00 0.38 0.00 0.00 41.96 42.35 1je5 s TYR 90 CO 0.60 -0.79 0.17 -1.21 -1.52 0.00 0.00 175.55 172.81 1je5 s GLU 91 N -3.27 3.44 0.00 -3.49 2.02 -1.26 -0.85 118.70 115.29 1je5 s GLU 91 Ca -0.01 -0.27 0.00 0.00 0.02 0.00 0.00 54.97 54.71 1je5 s GLU 91 Cb -0.01 -3.12 0.00 0.00 0.10 0.00 0.00 34.13 31.10 1je5 s GLU 91 CO -0.09 0.70 0.00 0.41 0.02 0.00 0.00 175.26 176.30 1je5 n GLY 92 N 1.20 1.28 3.82 -1.39 0.00 0.12 -4.54 105.19 105.68 1je5 n GLY 92 Ca -0.13 -2.02 -0.34 0.00 0.00 0.00 0.00 46.02 43.53 1je5 n GLY 92 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1je5 s ASP 93 N -1.00 6.98 0.67 1.61 1.01 -1.26 -4.87 116.67 119.82 1je5 s ASP 93 Ca 0.00 1.51 -0.14 0.00 0.71 0.00 0.00 52.55 54.63 1je5 s ASP 93 Cb 0.00 -2.46 0.00 0.00 1.01 0.00 0.00 42.92 41.47 1je5 s ASP 93 CO 0.00 -0.16 1.09 -0.04 0.21 0.00 0.00 175.17 176.27 1je5 s MET 94 N -2.61 2.83 -0.00 8.23 -1.94 -1.26 -4.71 119.30 119.84 1je5 s MET 94 Ca 0.52 1.24 0.00 0.00 -1.71 0.00 0.00 55.69 55.74 1je5 s MET 94 Cb -0.13 -1.96 0.01 0.00 2.01 0.00 0.00 34.83 34.75 1je5 s MET 94 CO 0.18 -1.21 0.62 -0.35 -0.01 0.00 0.00 175.02 174.26 1je5 n PRO 95 N -2.66 1.03 -3.82 2.03 -0.04 -1.26 -4.76 135.00 125.51 1je5 n PRO 95 Ca 0.09 -0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.42 1je5 n PRO 95 Cb 0.53 -1.40 -0.08 0.00 -0.04 0.00 0.00 33.50 32.51 1je5 n PRO 95 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1je5 s PHE 96 N -0.79 0.00 -0.16 0.54 -0.12 -1.26 -0.69 117.98 115.50 1je5 s PHE 96 Ca 0.00 -0.18 -0.12 0.00 -0.05 0.00 0.00 56.93 56.59 1je5 s PHE 96 Cb 0.00 0.01 0.05 0.00 -0.63 0.00 0.00 43.02 42.45 1je5 s PHE 96 CO 0.00 -0.44 0.41 -0.59 -0.05 0.00 0.00 175.22 174.55 1je5 s PHE 97 N -2.45 -0.52 0.06 3.49 -0.12 -0.49 -4.97 117.98 112.98 1je5 s PHE 97 Ca -0.06 1.19 -0.31 0.00 -0.05 0.00 0.00 56.93 57.70 1je5 s PHE 97 Cb -0.02 0.21 -0.06 0.00 -0.63 0.00 0.00 43.02 42.52 1je5 s PHE 97 CO -0.03 -0.28 1.29 0.34 -0.05 0.00 0.00 175.22 176.49 1je5 s ASP 98 N 0.83 6.96 0.00 1.98 -1.08 -1.26 -1.18 116.67 122.92 1je5 s ASP 98 Ca -0.05 2.11 0.27 0.00 -0.52 0.00 0.00 52.55 54.36 1je5 s ASP 98 Cb -0.06 -2.58 1.35 0.00 -1.46 0.00 0.00 42.92 40.18 1je5 s ASP 98 CO -0.06 -0.57 1.90 0.59 0.52 0.00 0.00 175.17 177.54 1je5 n ASN 99 N 4.25 0.68 0.00 -0.34 3.02 0.11 -4.89 115.26 118.09 1je5 n ASN 99 Ca 0.10 -1.32 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 1je5 n ASN 99 Cb 0.45 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 1je5 n ASN 99 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1je5 n GLY 100 N 1.03 0.67 0.48 7.41 0.00 -1.26 -4.84 105.19 108.69 1je5 n GLY 100 Ca 0.20 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.28 1je5 n GLY 100 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1je5 n ASP 101 N -0.06 1.74 0.00 1.61 3.85 -1.26 -4.96 116.55 117.47 1je5 n ASP 101 Ca 0.00 -3.25 0.00 0.00 -0.71 0.00 0.00 54.79 50.83 1je5 n ASP 101 Cb 0.03 -0.44 0.00 0.00 -1.35 0.00 0.00 41.12 39.36 1je5 n ASP 101 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1je5 n GLY 102 N -0.99 0.56 3.24 6.12 0.00 -1.26 -5.02 105.19 107.85 1je5 n GLY 102 Ca 0.15 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 1je5 n GLY 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1je5 s THR 103 N -2.00 0.98 -0.02 2.61 -4.23 -1.26 -0.01 115.64 111.71 1je5 s THR 103 Ca 0.00 -2.02 0.02 0.00 -1.18 0.00 0.00 61.69 58.51 1je5 s THR 103 Cb 0.00 -1.92 0.00 0.00 1.34 0.00 0.00 72.50 71.92 1je5 s THR 103 CO 0.00 -0.67 -0.07 -0.89 -0.54 0.00 0.00 174.62 172.44 1je5 s THR 104 N -3.45 0.62 -0.16 3.99 2.01 -0.09 -0.71 115.64 117.85 1je5 s THR 104 Ca 0.18 -0.28 -0.07 0.00 0.31 0.00 0.00 61.69 61.84 1je5 s THR 104 Cb 0.04 -0.56 -0.04 0.00 0.01 0.00 0.00 72.50 71.95 1je5 s THR 104 CO 0.01 0.20 0.05 -0.89 -0.69 0.00 0.00 174.62 173.31 1je5 s THR 105 N 0.19 4.73 -0.07 -0.82 2.01 -0.32 -0.38 115.64 120.97 1je5 s THR 105 Ca -0.02 -0.06 0.02 0.00 0.31 0.00 0.00 61.69 61.93 1je5 s THR 105 Cb -0.07 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 1je5 s THR 105 CO 0.00 0.49 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.96 1je5 s PHE 106 N 0.12 2.84 -0.32 4.92 0.40 0.63 -1.39 117.98 125.19 1je5 s PHE 106 Ca 0.04 -0.13 -0.10 0.00 -0.60 0.00 0.00 56.93 56.14 1je5 s PHE 106 Cb -0.12 -1.71 -0.01 0.00 0.51 0.00 0.00 43.02 41.69 1je5 s PHE 106 CO 0.01 0.20 0.16 0.15 0.70 0.00 0.00 175.22 176.44 1je5 s LYS 107 N -0.59 3.34 -0.02 0.44 1.02 0.14 -0.54 119.74 123.52 1je5 s LYS 107 Ca 0.09 -0.72 0.03 0.00 0.02 0.00 0.00 55.97 55.38 1je5 s LYS 107 Cb -0.12 -3.60 -0.03 0.00 -0.52 0.00 0.00 37.83 33.57 1je5 s LYS 107 CO 0.02 -0.43 -0.09 -0.06 -0.92 0.00 0.00 175.35 173.87 1je5 s PHE 108 N 1.62 2.84 0.07 3.18 0.40 -0.50 -4.30 117.98 121.29 1je5 s PHE 108 Ca 0.05 -0.06 -0.26 0.00 -0.60 0.00 0.00 56.93 56.06 1je5 s PHE 108 Cb -0.17 -1.63 0.08 0.00 0.51 0.00 0.00 43.02 41.81 1je5 s PHE 108 CO 0.07 0.32 0.69 -1.59 0.70 0.00 0.00 175.22 175.40 1je5 s LYS 109 N -1.12 1.11 0.07 0.44 -2.85 -0.89 -1.76 119.74 114.74 1je5 s LYS 109 Ca 0.14 -0.24 -0.24 0.00 -1.00 0.00 0.00 55.97 54.63 1je5 s LYS 109 Cb -0.11 0.52 0.06 0.00 -2.06 0.00 0.00 37.83 36.24 1je5 s LYS 109 CO 0.04 -0.45 0.58 0.00 0.10 0.00 0.00 175.35 175.62 1je5 s TYR 111 N -2.72 3.03 -2.51 0.00 1.51 -1.26 -0.75 117.35 114.65 1je5 s TYR 111 Ca -0.04 1.52 0.26 0.00 -1.01 0.00 0.00 57.07 57.80 1je5 s TYR 111 Cb -0.00 -3.00 0.88 0.00 -0.11 0.00 0.00 41.96 39.72 1je5 s TYR 111 CO -0.04 -0.98 1.64 0.00 -1.11 0.00 0.00 175.55 175.06 1je5 n ALA 112 N -1.74 2.55 -2.86 3.71 0.00 -0.25 -4.74 120.51 117.17 1je5 n ALA 112 Ca 0.09 -0.50 -0.10 0.00 0.00 0.00 0.00 53.44 52.92 1je5 n ALA 112 Cb 0.53 -1.10 -0.05 0.00 0.00 0.00 0.00 19.45 18.82 1je5 n ALA 112 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1je5 s SER 113 N -1.90 -0.12 0.12 0.00 1.04 -1.26 -0.09 113.70 111.48 1je5 s SER 113 Ca 0.36 -0.42 -0.18 0.00 0.48 0.00 0.00 55.95 56.19 1je5 s SER 113 Cb 0.20 0.43 0.04 0.00 0.10 0.00 0.00 66.02 66.80 1je5 s SER 113 CO 0.32 -0.81 0.44 0.72 0.98 0.00 0.00 173.24 174.88 1je5 s PHE 114 N -3.82 -0.28 -0.27 5.02 -0.12 -0.67 -4.94 117.98 112.91 1je5 s PHE 114 Ca 0.04 0.01 -0.12 0.00 -0.05 0.00 0.00 56.93 56.81 1je5 s PHE 114 Cb 0.03 0.31 -0.05 0.00 -0.63 0.00 0.00 43.02 42.68 1je5 s PHE 114 CO -0.12 -0.72 0.22 -1.14 -0.05 0.00 0.00 175.22 173.42 1je5 s GLN 115 N -3.66 3.99 0.34 1.99 0.74 -1.26 -0.79 119.66 121.02 1je5 s GLN 115 Ca 0.02 -0.23 -0.29 0.00 0.05 0.00 0.00 55.36 54.91 1je5 s GLN 115 Cb 0.01 -3.63 -0.11 0.00 1.10 0.00 0.00 33.01 30.38 1je5 s GLN 115 CO -0.11 -0.14 1.55 -3.47 -0.55 0.00 0.00 175.29 172.56 1je5 n ASP 116 N 4.93 3.89 -0.05 6.67 -0.08 0.34 -4.88 116.55 127.37 1je5 n ASP 116 Ca -0.13 1.19 -0.13 0.00 -1.51 0.00 0.00 54.79 54.21 1je5 n ASP 116 Cb 0.52 -1.62 -0.07 0.00 2.34 0.00 0.00 41.12 42.29 1je5 n ASP 116 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1je5 h LYS 117 N 3.80 0.33 -0.06 -0.67 6.56 -1.96 0.11 116.57 124.69 1je5 h LYS 117 Ca -0.49 -0.18 -0.04 0.00 -1.06 0.00 0.00 60.65 58.88 1je5 h LYS 117 Cb 1.23 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.90 1je5 h LYS 117 CO 0.71 0.73 -0.12 -0.22 -2.06 0.00 0.00 179.45 178.49 1je5 h LYS 118 N -0.06 0.19 0.00 3.15 3.64 -1.99 -3.38 116.57 118.12 1je5 h LYS 118 Ca 0.02 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1je5 h LYS 118 Cb 0.68 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1je5 h LYS 118 CO 0.03 0.71 -0.93 -2.37 -2.27 0.00 0.00 179.45 174.62 1je5 n THR 119 N -4.64 0.00 -0.98 1.00 5.66 -1.25 -5.00 114.28 109.07 1je5 n THR 119 Ca -0.08 -0.12 0.00 0.00 -3.05 0.00 0.00 64.05 60.80 1je5 n THR 119 Cb 0.36 0.91 0.00 0.00 -1.55 0.00 0.00 70.33 70.05 1je5 n THR 119 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1je5 n LYS 120 N -1.49 -1.33 -2.67 1.09 4.01 0.39 -4.97 118.16 113.20 1je5 n LYS 120 Ca 0.03 0.33 -0.41 0.00 -0.51 0.00 0.00 58.31 57.75 1je5 n LYS 120 Cb 0.29 -4.38 -0.05 0.00 -0.51 0.00 0.00 35.03 30.39 1je5 n LYS 120 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 1je5 s GLU 121 N -1.37 4.73 -0.19 1.97 2.02 -1.26 -4.60 118.70 120.00 1je5 s GLU 121 Ca 0.00 1.55 -0.24 0.00 0.02 0.00 0.00 54.97 56.30 1je5 s GLU 121 Cb 0.00 -3.31 -0.02 0.00 0.10 0.00 0.00 34.13 30.91 1je5 s GLU 121 CO 0.00 0.29 0.77 0.99 0.02 0.00 0.00 175.26 177.34 1je5 s THR 122 N -0.55 4.91 0.20 3.63 2.01 -1.26 -0.51 115.64 124.07 1je5 s THR 122 Ca 0.45 1.50 0.10 0.00 0.31 0.00 0.00 61.69 64.05 1je5 s THR 122 Cb -0.26 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.12 1je5 s THR 122 CO 0.33 0.03 -0.20 -0.54 -0.69 0.00 0.00 174.62 173.55 1je5 s LYS 123 N 2.21 1.42 0.10 4.92 1.02 0.03 -4.96 119.74 124.48 1je5 s LYS 123 Ca 0.35 -1.52 -0.09 0.00 0.02 0.00 0.00 55.97 54.73 1je5 s LYS 123 Cb -0.16 -1.54 -0.06 0.00 -0.52 0.00 0.00 37.83 35.55 1je5 s LYS 123 CO 0.11 0.31 0.40 -1.58 -0.92 0.00 0.00 175.35 173.67 1je5 s HIS 124 N -2.10 3.55 -0.20 3.18 5.65 -1.26 -1.67 115.29 122.45 1je5 s HIS 124 Ca 0.20 0.75 -0.06 0.00 0.25 0.00 0.00 55.06 56.20 1je5 s HIS 124 Cb -0.06 -2.13 -0.03 0.00 -1.18 0.00 0.00 32.58 29.18 1je5 s HIS 124 CO 0.09 0.49 0.02 0.42 -0.65 0.00 0.00 174.74 175.10 1je5 s ILE 125 N -1.47 4.15 -0.21 0.89 1.01 0.87 -4.94 121.20 121.50 1je5 s ILE 125 Ca 0.35 -0.25 -0.11 0.00 0.00 0.00 0.00 60.65 60.65 1je5 s ILE 125 Cb -0.13 -2.88 -0.05 0.00 0.01 0.00 0.00 42.46 39.41 1je5 s ILE 125 CO 0.19 0.43 0.16 0.20 0.00 0.00 0.00 174.94 175.93 1je5 s ASN 126 N 0.85 6.20 -0.24 3.58 0.01 -1.26 -4.83 114.94 119.25 1je5 s ASN 126 Ca 0.01 0.22 -0.28 0.00 -0.71 0.00 0.00 52.86 52.10 1je5 s ASN 126 Cb -0.14 -2.11 0.01 0.00 0.41 0.00 0.00 41.25 39.42 1je5 s ASN 126 CO 0.02 0.12 1.00 -0.22 -1.51 0.00 0.00 177.10 176.51 1je5 s LEU 127 N 0.67 4.08 0.05 0.60 1.98 -1.26 -5.00 118.68 119.80 1je5 s LEU 127 Ca 0.09 1.28 -0.31 0.00 -2.89 0.00 0.00 54.13 52.31 1je5 s LEU 127 Cb -0.12 -3.47 -0.07 0.00 0.66 0.00 0.00 46.19 43.20 1je5 s LEU 127 CO 0.01 -0.65 1.39 -0.69 -1.89 0.00 0.00 176.35 174.52 1je5 s VAL 128 N 3.16 3.56 -0.06 1.68 1.01 -1.26 -4.95 120.40 123.53 1je5 s VAL 128 Ca 0.42 1.04 0.05 0.00 0.00 0.00 0.00 61.98 63.49 1je5 s VAL 128 Cb -0.15 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.56 1je5 s VAL 128 CO 0.07 0.03 -0.21 -0.69 0.00 0.00 0.00 175.10 174.30 1je5 s VAL 129 N 1.83 1.78 0.18 2.92 1.01 -1.26 -1.61 120.40 125.24 1je5 s VAL 129 Ca 0.64 -0.89 0.11 0.00 0.00 0.00 0.00 61.98 61.84 1je5 s VAL 129 Cb -0.34 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 1je5 s VAL 129 CO 0.28 0.50 -0.22 -0.69 0.00 0.00 0.00 175.10 174.97 1je5 s VAL 130 N 0.08 2.49 0.34 2.92 1.01 0.44 -0.57 120.40 127.11 1je5 s VAL 130 Ca -0.08 -1.90 -0.03 0.00 0.00 0.00 0.00 61.98 59.97 1je5 s VAL 130 Cb -0.14 -2.18 0.07 0.00 0.00 0.00 0.00 36.38 34.13 1je5 s VAL 130 CO 0.04 -0.07 0.47 -0.90 0.00 0.00 0.00 175.10 174.64 1je5 n ASP 131 N 0.38 0.30 0.32 3.32 5.68 0.56 0.23 116.55 127.32 1je5 n ASP 131 Ca -0.13 -1.33 0.20 0.00 -0.50 0.00 0.00 54.79 53.03 1je5 n ASP 131 Cb 0.55 -0.33 1.03 0.00 -1.14 0.00 0.00 41.12 41.23 1je5 n ASP 131 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1je5 h SER 132 N -0.47 0.00 -0.55 -1.12 4.64 -1.73 -1.43 113.55 112.89 1je5 h SER 132 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1je5 h SER 132 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1je5 h SER 132 CO 0.13 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 176.39 1je5 n LYS 133 N -3.17 3.58 -0.67 4.77 4.76 -1.26 -4.94 118.16 121.23 1je5 n LYS 133 Ca -0.02 -2.79 0.00 0.00 -2.87 0.00 0.00 58.31 52.63 1je5 n LYS 133 Cb 0.15 -1.83 0.00 0.00 -1.84 0.00 0.00 35.03 31.51 1je5 n LYS 133 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1je5 n GLY 134 N 0.76 0.73 3.68 0.72 0.00 -0.54 -5.03 105.19 105.52 1je5 n GLY 134 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 1je5 n GLY 134 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1je5 s LYS 135 N -0.33 4.37 0.24 1.61 2.20 -1.26 -4.70 119.74 121.87 1je5 s LYS 135 Ca 0.00 1.47 -0.30 0.00 -0.36 0.00 0.00 55.97 56.77 1je5 s LYS 135 Cb 0.00 -3.57 -0.11 0.00 -1.51 0.00 0.00 37.83 32.64 1je5 s LYS 135 CO 0.00 -0.42 1.54 0.21 -0.36 0.00 0.00 175.35 176.32 1je5 s LYS 136 N 2.33 4.20 -0.28 4.03 2.20 -1.26 -0.33 119.74 130.63 1je5 s LYS 136 Ca 0.50 2.42 -0.16 0.00 -0.36 0.00 0.00 55.97 58.37 1je5 s LYS 136 Cb -0.19 -3.09 -0.03 0.00 -1.51 0.00 0.00 37.83 33.01 1je5 s LYS 136 CO 0.17 -0.55 0.43 -1.64 -0.36 0.00 0.00 175.35 173.40 1je5 s MET 137 N 0.04 3.96 0.11 4.03 -1.94 0.27 -4.88 119.30 120.89 1je5 s MET 137 Ca 0.64 0.08 -0.09 0.00 -1.71 0.00 0.00 55.69 54.61 1je5 s MET 137 Cb -0.45 -3.68 -0.14 0.00 2.01 0.00 0.00 34.83 32.58 1je5 s MET 137 CO 0.41 -0.35 1.28 1.49 -0.01 0.00 0.00 175.02 177.84 1je5 h GLU 138 N 8.18 0.58 -4.22 2.03 4.57 -1.93 -3.39 114.58 120.40 1je5 h GLU 138 Ca -0.30 -0.58 -0.69 0.00 -1.18 0.00 0.00 59.36 56.61 1je5 h GLU 138 Cb 1.15 0.15 -0.35 0.00 -0.16 0.00 0.00 28.75 29.54 1je5 h GLU 138 CO 0.68 1.20 -0.52 -0.51 -1.18 0.00 0.00 179.01 178.68 1je5 s ASP 139 N -7.15 5.17 -0.07 1.04 -0.00 -1.26 -5.08 116.67 109.32 1je5 s ASP 139 Ca -0.08 -2.29 -0.30 0.00 -0.00 0.00 0.00 52.55 49.88 1je5 s ASP 139 Cb 0.08 -1.81 -0.04 0.00 -0.00 0.00 0.00 42.92 41.16 1je5 s ASP 139 CO 0.89 -0.47 1.31 0.68 -0.00 0.00 0.00 175.17 177.58 1je5 s VAL 140 N 0.75 4.05 0.61 -1.27 -7.23 -1.26 -5.02 120.40 111.03 1je5 s VAL 140 Ca 0.11 1.36 -0.16 0.00 -1.81 0.00 0.00 61.98 61.48 1je5 s VAL 140 Cb -0.22 -3.87 -0.03 0.00 0.56 0.00 0.00 36.38 32.82 1je5 s VAL 140 CO -0.04 -0.04 1.08 -2.16 -0.31 0.00 0.00 175.10 173.62 1je5 s PRO 141 N 2.78 3.14 0.05 4.82 0.04 -1.26 -4.86 135.00 139.72 1je5 s PRO 141 Ca 0.59 1.30 -0.31 0.00 0.04 0.00 0.00 61.00 62.62 1je5 s PRO 141 Cb -0.26 -2.00 -0.07 0.00 0.04 0.00 0.00 34.50 32.20 1je5 s PRO 141 CO 0.22 -0.96 1.51 0.42 0.04 0.00 0.00 177.00 178.22 1je5 s ILE 142 N -2.37 3.32 -0.57 0.56 -1.09 -1.26 -4.55 121.20 115.25 1je5 s ILE 142 Ca 0.65 0.80 -0.21 0.00 -2.23 0.00 0.00 60.65 59.66 1je5 s ILE 142 Cb -0.18 -3.51 0.07 0.00 -1.58 0.00 0.00 42.46 37.25 1je5 s ILE 142 CO 0.38 0.01 0.79 -0.63 -1.23 0.00 0.00 174.94 174.26 1je5 s ILE 143 N 2.21 4.62 0.61 2.92 -1.09 -1.26 -4.98 121.20 124.24 1je5 s ILE 143 Ca 0.68 -0.37 -0.06 0.00 -2.23 0.00 0.00 60.65 58.66 1je5 s ILE 143 Cb -0.36 -4.48 0.01 0.00 -1.58 0.00 0.00 42.46 36.05 1je5 s ILE 143 CO 0.30 -1.09 0.93 -0.83 -1.23 0.00 0.00 174.94 173.01 1je5 s GLY 144 N 3.14 1.62 0.41 6.18 0.00 -1.26 -4.43 107.32 112.97 1je5 s GLY 144 Ca 0.20 -0.69 -0.25 0.00 0.00 0.00 0.00 44.72 43.98 1je5 s GLY 144 CO 0.12 -0.38 1.21 0.61 0.00 0.00 0.00 173.10 174.65 1je5 n GLY 145 N -2.66 0.36 0.73 0.20 0.00 -1.26 -1.88 105.19 100.67 1je5 n GLY 145 Ca 0.05 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1je5 n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1je5 n GLY 146 N 0.90 1.59 3.77 -0.02 0.00 -0.31 -4.74 105.19 106.37 1je5 n GLY 146 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1je5 n GLY 146 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1je5 s SER 147 N -1.95 6.44 -0.17 1.61 0.01 -0.79 -4.63 113.70 114.22 1je5 s SER 147 Ca 0.00 2.60 -0.15 0.00 1.31 0.00 0.00 55.95 59.71 1je5 s SER 147 Cb 0.00 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 1je5 s SER 147 CO 0.00 -0.76 0.37 -0.54 0.41 0.00 0.00 173.24 172.73 1je5 s LYS 148 N -2.16 4.23 0.15 12.44 1.02 0.13 -0.71 119.74 134.86 1je5 s LYS 148 Ca 0.55 0.20 -0.03 0.00 0.02 0.00 0.00 55.97 56.71 1je5 s LYS 148 Cb -0.37 -3.48 -0.03 0.00 -0.52 0.00 0.00 37.83 33.43 1je5 s LYS 148 CO 0.48 0.09 0.13 -0.51 -0.92 0.00 0.00 175.35 174.63 1je5 s LEU 149 N 0.89 1.43 0.08 3.17 1.43 -0.43 -0.63 118.68 124.62 1je5 s LEU 149 Ca 0.19 -1.16 0.05 0.00 -1.03 0.00 0.00 54.13 52.18 1je5 s LEU 149 Cb -0.14 0.56 -0.03 0.00 0.03 0.00 0.00 46.19 46.61 1je5 s LEU 149 CO 0.07 -0.80 -0.13 -0.54 0.23 0.00 0.00 176.35 175.18 1je5 s LYS 150 N -4.05 0.83 0.06 1.70 1.02 -0.76 -0.61 119.74 117.93 1je5 s LYS 150 Ca 0.25 -1.03 0.04 0.00 0.02 0.00 0.00 55.97 55.25 1je5 s LYS 150 Cb 0.06 -0.73 -0.03 0.00 -0.52 0.00 0.00 37.83 36.62 1je5 s LYS 150 CO 0.03 0.15 -0.11 0.08 -0.92 0.00 0.00 175.35 174.58 1je5 s VAL 151 N -1.67 0.86 -0.04 3.17 1.01 -1.26 -0.70 120.40 121.77 1je5 s VAL 151 Ca 0.01 -1.24 0.00 0.00 0.00 0.00 0.00 61.98 60.75 1je5 s VAL 151 Cb -0.08 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 1je5 s VAL 151 CO 0.02 -0.31 0.00 -0.54 0.00 0.00 0.00 175.10 174.27 1je5 s LYS 152 N -1.75 2.87 0.19 2.72 1.02 0.06 0.11 119.74 124.96 1je5 s LYS 152 Ca -0.05 -0.52 -0.19 0.00 0.02 0.00 0.00 55.97 55.23 1je5 s LYS 152 Cb -0.09 -2.72 0.04 0.00 -0.52 0.00 0.00 37.83 34.53 1je5 s LYS 152 CO 0.01 0.66 0.56 1.52 -0.92 0.00 0.00 175.35 177.18 1je5 s TYR 153 N -1.00 -0.26 0.29 3.18 -0.85 -0.14 0.05 117.35 118.63 1je5 s TYR 153 Ca 0.17 -0.06 0.11 0.00 -0.52 0.00 0.00 57.07 56.77 1je5 s TYR 153 Cb -0.11 0.47 -0.05 0.00 0.38 0.00 0.00 41.96 42.65 1je5 s TYR 153 CO 0.07 -0.93 -0.16 -1.54 -1.52 0.00 0.00 175.55 171.47 1je5 s SER 154 N -2.84 3.69 -0.21 -0.18 1.04 -0.50 0.25 113.70 114.95 1je5 s SER 154 Ca 0.07 -1.04 -0.07 0.00 0.48 0.00 0.00 55.95 55.38 1je5 s SER 154 Cb -0.01 -0.35 -0.03 0.00 0.10 0.00 0.00 66.02 65.72 1je5 s SER 154 CO -0.05 -0.02 0.06 -0.76 0.98 0.00 0.00 173.24 173.44 1je5 s LEU 155 N -3.55 3.55 -0.38 2.42 1.43 -1.26 -0.87 118.68 120.03 1je5 s LEU 155 Ca 0.31 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 1je5 s LEU 155 Cb -0.03 -1.92 0.11 0.00 0.03 0.00 0.00 46.19 44.37 1je5 s LEU 155 CO 0.16 0.06 0.10 -0.69 0.23 0.00 0.00 176.35 176.21 1je5 s VAL 156 N 1.03 2.32 0.52 -1.59 1.01 -0.16 -4.95 120.40 118.58 1je5 s VAL 156 Ca 0.04 -2.54 -0.18 0.00 0.00 0.00 0.00 61.98 59.29 1je5 s VAL 156 Cb -0.14 -2.69 -0.07 0.00 0.00 0.00 0.00 36.38 33.47 1je5 s VAL 156 CO 0.03 -0.65 1.02 -2.16 0.00 0.00 0.00 175.10 173.34 1je5 s PRO 157 N 0.66 3.77 0.01 2.72 0.04 -1.26 -0.37 135.00 140.56 1je5 s PRO 157 Ca 0.12 1.17 -0.07 0.00 0.04 0.00 0.00 61.00 62.26 1je5 s PRO 157 Cb -0.20 -2.10 -0.00 0.00 0.04 0.00 0.00 34.50 32.23 1je5 s PRO 157 CO -0.07 -0.43 0.13 1.52 0.04 0.00 0.00 177.00 178.19 1je5 s TYR 158 N -2.32 0.07 0.79 0.56 -0.85 -0.56 -4.91 117.35 110.12 1je5 s TYR 158 Ca 0.63 -0.20 -0.11 0.00 -0.52 0.00 0.00 57.07 56.87 1je5 s TYR 158 Cb -0.13 -0.06 0.06 0.00 0.38 0.00 0.00 41.96 42.21 1je5 s TYR 158 CO 0.27 -0.31 1.09 0.21 -1.52 0.00 0.00 175.55 175.29 1je5 s LYS 159 N -1.62 2.18 0.79 -3.49 2.20 -1.26 -2.25 119.74 116.28 1je5 s LYS 159 Ca -0.13 0.69 -0.11 0.00 -0.36 0.00 0.00 55.97 56.06 1je5 s LYS 159 Cb -0.06 -1.92 0.07 0.00 -1.51 0.00 0.00 37.83 34.40 1je5 s LYS 159 CO 0.00 -1.57 1.09 1.67 -0.36 0.00 0.00 175.35 176.18 1je5 s TRP 160 N -3.14 2.67 0.31 4.03 -2.14 -1.26 -4.35 118.94 115.06 1je5 s TRP 160 Ca 0.60 1.39 -0.09 0.00 2.66 0.00 0.00 56.10 60.66 1je5 s TRP 160 Cb -0.14 -3.05 0.04 0.00 -3.10 0.00 0.00 33.47 27.21 1je5 s TRP 160 CO 0.54 -1.81 0.57 0.27 -2.66 0.00 0.00 176.95 173.86 1je5 n ASN 161 N -3.51 -1.65 0.22 -2.66 2.04 0.02 -4.86 115.26 104.85 1je5 n ASN 161 Ca 0.08 -2.33 0.11 0.00 -0.44 0.00 0.00 54.58 52.00 1je5 n ASN 161 Cb 0.54 2.81 0.68 0.00 -2.53 0.00 0.00 39.78 41.28 1je5 n ASN 161 CO 0.00 0.00 0.00 0.74 -0.44 0.00 0.00 177.26 177.56 1je5 h THR 162 N 1.79 0.90 0.16 5.53 2.02 -2.00 -3.09 112.91 118.22 1je5 h THR 162 Ca -0.26 0.00 -0.32 0.00 0.77 0.00 0.00 66.41 66.60 1je5 h THR 162 Cb 0.98 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 1je5 h THR 162 CO 0.33 0.00 -1.63 0.00 0.37 0.00 0.00 175.52 174.59 1je5 h ALA 163 N 1.95 0.17 -2.56 6.16 0.00 -2.00 -3.49 119.26 119.50 1je5 h ALA 163 Ca 0.04 -1.13 -0.10 0.00 0.00 0.00 0.00 54.91 53.72 1je5 h ALA 163 Cb 0.18 0.48 -0.16 0.00 0.00 0.00 0.00 17.79 18.28 1je5 h ALA 163 CO -0.00 0.96 -0.37 0.54 0.00 0.00 0.00 179.25 180.38 1je5 s VAL 164 N -2.54 0.11 0.72 0.00 0.11 -1.17 -5.16 120.40 112.47 1je5 s VAL 164 Ca -0.18 -0.94 -0.10 0.00 -2.93 0.00 0.00 61.98 57.83 1je5 s VAL 164 Cb 0.05 -1.02 0.03 0.00 -1.53 0.00 0.00 36.38 33.91 1je5 s VAL 164 CO 0.82 -0.52 1.08 -0.83 -3.33 0.00 0.00 175.10 172.32 1je5 s GLY 165 N -2.29 1.62 0.29 6.54 0.00 -1.26 -0.80 107.32 111.42 1je5 s GLY 165 Ca -0.02 -0.53 -0.30 0.00 0.00 0.00 0.00 44.72 43.86 1je5 s GLY 165 CO -0.06 -0.14 1.55 0.00 0.00 0.00 0.00 173.10 174.45 1je5 n ALA 166 N -3.02 2.23 -3.00 3.20 0.00 -0.03 -3.28 120.51 116.62 1je5 n ALA 166 Ca 0.07 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1je5 n ALA 166 Cb 0.59 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1je5 n ALA 166 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1je5 n SER 167 N 2.03 0.00 -3.87 0.00 2.88 -0.95 0.14 113.62 113.85 1je5 n SER 167 Ca 0.09 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.47 1je5 n SER 167 Cb 0.36 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.67 1je5 n SER 167 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1je5 s VAL 168 N -2.07 0.19 -0.03 2.46 1.01 -1.26 -1.50 120.40 119.20 1je5 s VAL 168 Ca 0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.82 1je5 s VAL 168 Cb 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 36.38 36.10 1je5 s VAL 168 CO 0.00 0.10 0.38 -0.54 0.00 0.00 0.00 175.10 175.04 1je5 s LYS 169 N 0.46 3.92 -0.64 2.72 1.02 0.50 -4.31 119.74 123.42 1je5 s LYS 169 Ca -0.04 0.34 -0.16 0.00 0.02 0.00 0.00 55.97 56.12 1je5 s LYS 169 Cb -0.07 -3.25 0.15 0.00 -0.52 0.00 0.00 37.83 34.14 1je5 s LYS 169 CO -0.01 0.63 0.63 -0.51 -0.92 0.00 0.00 175.35 175.17 1je5 s LEU 170 N -0.84 6.16 -0.37 3.17 1.43 -1.26 -0.98 118.68 125.98 1je5 s LEU 170 Ca 0.22 -1.97 -0.29 0.00 -1.03 0.00 0.00 54.13 51.07 1je5 s LEU 170 Cb -0.16 -2.23 0.02 0.00 0.03 0.00 0.00 46.19 43.85 1je5 s LEU 170 CO 0.11 -0.84 1.16 -1.58 0.23 0.00 0.00 176.35 175.44 1je5 s GLN 171 N 1.46 3.91 0.21 1.70 0.74 -0.05 -2.10 119.66 125.52 1je5 s GLN 171 Ca 0.09 0.95 -0.31 0.00 0.05 0.00 0.00 55.36 56.15 1je5 s GLN 171 Cb -0.23 -3.83 -0.11 0.00 1.10 0.00 0.00 33.01 29.94 1je5 s GLN 171 CO 0.00 -1.13 1.59 -1.17 -0.55 0.00 0.00 175.29 174.04 1je5 s LEU 172 N 4.15 4.37 -0.10 3.68 2.96 -0.56 -1.41 118.68 131.76 1je5 s LEU 172 Ca 0.49 2.74 -0.02 0.00 -0.22 0.00 0.00 54.13 57.12 1je5 s LEU 172 Cb -0.12 -3.61 -0.06 0.00 0.50 0.00 0.00 46.19 42.91 1je5 s LEU 172 CO 0.23 -0.86 -0.11 -0.62 -1.32 0.00 0.00 176.35 173.67 1je5 n GLU 173 N 3.48 0.23 -3.76 1.98 -0.58 0.11 -4.69 120.64 117.41 1je5 n GLU 173 Ca 0.13 0.08 -0.04 0.00 -0.42 0.00 0.00 57.16 56.90 1je5 n GLU 173 Cb 0.38 -1.05 -0.01 0.00 -0.57 0.00 0.00 31.44 30.18 1je5 n GLU 173 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1je5 s SER 174 N -5.40 -0.19 0.02 1.62 1.04 -1.07 -4.56 113.70 105.16 1je5 s SER 174 Ca -0.14 -0.42 0.02 0.00 0.48 0.00 0.00 55.95 55.89 1je5 s SER 174 Cb 0.04 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.66 1je5 s SER 174 CO 0.21 -0.95 -0.07 -0.69 0.98 0.00 0.00 173.24 172.72 1je5 s VAL 175 N -3.35 0.53 -0.21 5.02 1.01 -0.64 -0.76 120.40 122.00 1je5 s VAL 175 Ca 0.12 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 1je5 s VAL 175 Cb -0.02 -0.52 0.00 0.00 0.00 0.00 0.00 36.38 35.84 1je5 s VAL 175 CO 0.03 -0.11 -0.10 -0.32 0.00 0.00 0.00 175.10 174.60 1je5 s MET 176 N -0.84 3.20 -0.41 2.72 0.00 0.12 -0.42 119.30 123.67 1je5 s MET 176 Ca -0.03 -0.72 -0.23 0.00 0.00 0.00 0.00 55.69 54.71 1je5 s MET 176 Cb -0.06 -2.86 0.02 0.00 0.00 0.00 0.00 34.83 31.92 1je5 s MET 176 CO 0.00 -0.22 0.76 -1.17 0.00 0.00 0.00 175.02 174.39 1je5 s LEU 177 N 1.40 4.23 -0.13 4.11 2.96 0.14 -1.83 118.68 129.55 1je5 s LEU 177 Ca 0.05 0.05 -0.10 0.00 -0.22 0.00 0.00 54.13 53.91 1je5 s LEU 177 Cb -0.14 -2.95 -0.25 0.00 0.50 0.00 0.00 46.19 43.35 1je5 s LEU 177 CO -0.07 -0.82 0.35 0.52 -1.32 0.00 0.00 176.35 175.01 1je5 n VAL 178 N 5.96 1.74 -3.66 1.68 0.31 0.19 -2.31 118.33 122.25 1je5 n VAL 178 Ca 0.02 -0.54 -0.09 0.00 -0.01 0.00 0.00 64.34 63.72 1je5 n VAL 178 Cb 0.48 -1.80 -0.10 0.00 -0.91 0.00 0.00 33.84 31.51 1je5 n VAL 178 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1je5 s GLU 179 N -2.52 0.31 0.07 5.55 2.12 -0.63 -4.67 118.70 118.92 1je5 s GLU 179 Ca -0.23 0.99 -0.27 0.00 0.36 0.00 0.00 54.97 55.82 1je5 s GLU 179 Cb 0.06 0.27 -0.06 0.00 0.26 0.00 0.00 34.13 34.67 1je5 s GLU 179 CO 0.74 -0.25 0.84 -1.17 -0.54 0.00 0.00 175.26 174.88 1je5 s LEU 180 N 2.49 4.47 0.30 2.70 2.96 -1.26 0.22 118.68 130.55 1je5 s LEU 180 Ca -0.02 1.57 -0.15 0.00 -0.22 0.00 0.00 54.13 55.31 1je5 s LEU 180 Cb -0.12 -3.36 -0.09 0.00 0.50 0.00 0.00 46.19 43.13 1je5 s LEU 180 CO -0.12 -0.01 0.72 0.00 -1.32 0.00 0.00 176.35 175.61 1je5 s ALA 181 N -0.04 3.36 0.00 5.97 0.00 -1.26 -4.92 121.76 124.87 1je5 s ALA 181 Ca 0.42 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.41 1je5 s ALA 181 Cb -0.21 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.16 1je5 s ALA 181 CO 0.25 0.35 0.00 0.25 0.00 0.00 0.00 175.76 176.61 1je5 n THR 182 N -0.18 0.00 0.18 0.00 -2.24 -1.26 -4.68 114.28 106.10 1je5 n THR 182 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1je5 n THR 182 Cb 0.53 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1je5 n THR 182 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1je5 n ASP 189 N 0.00 -1.37 -0.10 3.42 5.68 -1.26 -4.98 116.55 117.94 1je5 n ASP 189 Ca 0.00 0.63 0.14 0.00 -0.50 0.00 0.00 54.79 55.06 1je5 n ASP 189 Cb 0.00 1.44 0.55 0.00 -1.14 0.00 0.00 41.12 41.98 1je5 n ASP 189 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1je5 n TRP 190 N -3.50 0.00 -0.28 2.11 7.02 -1.26 -4.43 117.44 117.09 1je5 n TRP 190 Ca 0.00 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.55 1je5 n TRP 190 Cb 0.00 -0.22 0.18 0.00 -2.42 0.00 0.00 31.31 28.85 1je5 n TRP 190 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1je5 h ALA 191 N 3.49 0.84 -0.28 6.99 0.00 -2.09 -1.74 119.26 126.47 1je5 h ALA 191 Ca 0.00 0.28 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 1je5 h ALA 191 Cb 0.40 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1je5 h ALA 191 CO 0.00 -0.45 0.01 -0.44 0.00 0.00 0.00 179.25 178.37 1je5 h ASP 192 N 0.07 0.38 -1.51 0.00 3.32 -2.09 -3.28 116.42 113.31 1je5 h ASP 192 Ca 0.45 -0.06 -0.68 0.00 0.02 0.00 0.00 57.03 56.77 1je5 h ASP 192 Cb 0.82 -0.10 -0.33 0.00 0.22 0.00 0.00 39.33 39.94 1je5 h ASP 192 CO -0.76 0.43 0.34 -0.62 -1.72 0.00 0.00 179.24 176.91 1je5 n GLU 193 N -4.33 3.02 -2.46 3.56 4.71 -0.65 -5.04 120.64 119.44 1je5 n GLU 193 Ca 0.01 -3.80 -0.35 0.00 -0.01 0.00 0.00 57.16 53.01 1je5 n GLU 193 Cb 0.21 -2.27 -0.03 0.00 -1.01 0.00 0.00 31.44 28.34 1je5 n GLU 193 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1je5 s VAL 194 N -5.08 3.59 0.00 2.62 1.01 -1.24 -4.86 120.40 116.44 1je5 s VAL 194 Ca 0.54 1.05 0.00 0.00 0.00 0.00 0.00 61.98 63.56 1je5 s VAL 194 Cb 0.44 -3.46 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1je5 s VAL 194 CO -0.22 -0.16 0.00 -1.84 0.00 0.00 0.00 175.10 172.88 1je5 n GLU 195 N -0.83 0.00 0.00 2.72 0.28 -1.26 -4.90 120.64 116.66 1je5 n GLU 195 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.09 1je5 n GLU 195 Cb 0.51 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.38 1je5 n GLU 195 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 1je5 n GLU 196 N 0.00 3.42 -0.62 3.44 0.28 -1.26 -5.29 120.64 120.61 1je5 n GLU 196 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1je5 n GLU 196 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1je5 n GLU 196 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06