#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1je1 n VAL 4 N 0.00 0.00 -0.09 -1.45 0.24 -1.26 -4.75 118.33 111.02 1je1 n VAL 4 Ca 0.00 -0.45 -0.18 0.00 -2.04 0.00 0.00 64.34 61.68 1je1 n VAL 4 Cb 0.00 1.07 -0.06 0.00 -1.47 0.00 0.00 33.84 33.38 1je1 n VAL 4 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1je1 n HIS 5 N -0.30 0.00 -3.19 6.34 8.25 -1.26 -4.86 115.22 120.21 1je1 n HIS 5 Ca 0.02 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.05 1je1 n HIS 5 Cb 0.12 -0.62 -0.07 0.00 1.12 0.00 0.00 29.99 30.54 1je1 n HIS 5 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1je1 s ILE 6 N -2.42 4.92 -0.27 1.59 1.01 -1.26 -4.59 121.20 120.19 1je1 s ILE 6 Ca -0.26 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 59.91 1je1 s ILE 6 Cb 0.09 -4.26 0.35 0.00 0.01 0.00 0.00 42.46 38.65 1je1 s ILE 6 CO 0.33 -0.74 1.58 0.18 0.00 0.00 0.00 174.94 176.28 1je1 n LEU 7 N 6.04 5.28 -4.78 2.97 4.77 -1.26 -4.80 117.00 125.23 1je1 n LEU 7 Ca -0.07 -2.77 -0.37 0.00 -0.03 0.00 0.00 56.01 52.77 1je1 n LEU 7 Cb 0.45 -0.74 -0.05 0.00 -2.33 0.00 0.00 43.42 40.75 1je1 n LEU 7 CO 0.53 0.87 0.69 0.00 -1.33 0.00 0.00 177.39 178.14 1je1 s ALA 8 N -1.87 3.17 0.36 -1.18 0.00 -1.25 -4.93 121.76 116.07 1je1 s ALA 8 Ca 0.32 0.61 -0.25 0.00 0.00 0.00 0.00 51.96 52.64 1je1 s ALA 8 Cb 0.27 -3.22 -0.10 0.00 0.00 0.00 0.00 23.12 20.07 1je1 s ALA 8 CO 0.05 0.01 0.99 0.15 0.00 0.00 0.00 175.76 176.97 1je1 s LYS 9 N -2.22 4.38 0.29 0.00 1.02 -1.26 -4.96 119.74 116.99 1je1 s LYS 9 Ca 0.53 1.40 -0.30 0.00 0.02 0.00 0.00 55.97 57.62 1je1 s LYS 9 Cb -0.20 -2.65 -0.11 0.00 -0.52 0.00 0.00 37.83 34.35 1je1 s LYS 9 CO 0.26 0.08 1.60 0.21 -0.92 0.00 0.00 175.35 176.58 1je1 s LYS 10 N -2.33 4.12 0.00 1.68 2.20 -1.26 -0.88 119.74 123.27 1je1 s LYS 10 Ca 0.54 2.58 0.00 0.00 -0.36 0.00 0.00 55.97 58.74 1je1 s LYS 10 Cb -0.19 -3.02 0.00 0.00 -1.51 0.00 0.00 37.83 33.10 1je1 s LYS 10 CO 0.25 -0.64 0.00 0.41 -0.36 0.00 0.00 175.35 175.01 1je1 n GLY 11 N 2.20 0.84 0.43 5.54 0.00 -1.26 -4.88 105.19 108.07 1je1 n GLY 11 Ca 0.08 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.21 1je1 n GLY 11 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1je1 n GLU 12 N -1.67 1.04 -4.67 1.61 1.02 -0.06 -4.87 120.64 113.05 1je1 n GLU 12 Ca 0.00 -0.86 -0.33 0.00 -0.02 0.00 0.00 57.16 55.95 1je1 n GLU 12 Cb 0.00 -1.48 -0.15 0.00 -0.02 0.00 0.00 31.44 29.79 1je1 n GLU 12 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1je1 s VAL 13 N -2.55 2.92 0.71 2.62 1.01 -1.26 -4.73 120.40 119.12 1je1 s VAL 13 Ca 0.17 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 61.34 1je1 s VAL 13 Cb 0.18 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 34.34 1je1 s VAL 13 CO 0.61 0.52 1.08 0.00 0.00 0.00 0.00 175.10 177.31 1je1 s ALA 14 N 0.55 2.76 0.28 5.51 0.00 -1.26 -4.70 121.76 124.90 1je1 s ALA 14 Ca -0.09 -0.19 0.10 0.00 0.00 0.00 0.00 51.96 51.79 1je1 s ALA 14 Cb -0.16 -3.08 0.37 0.00 0.00 0.00 0.00 23.12 20.26 1je1 s ALA 14 CO 0.04 -1.18 1.62 0.93 0.00 0.00 0.00 175.76 177.17 1je1 h GLU 15 N -0.69 0.02 -5.06 0.00 5.08 -1.84 -3.33 114.58 108.75 1je1 h GLU 15 Ca -0.45 -0.01 -0.63 0.00 -1.00 0.00 0.00 59.36 57.27 1je1 h GLU 15 Cb 1.24 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.34 1je1 h GLU 15 CO 0.61 0.61 -0.45 1.03 -1.00 0.00 0.00 179.01 179.81 1je1 s ARG 16 N -3.66 4.03 -0.03 2.33 0.52 -1.26 -1.76 118.95 119.12 1je1 s ARG 16 Ca -0.02 -0.21 0.02 0.00 -0.52 0.00 0.00 55.73 55.01 1je1 s ARG 16 Cb 0.13 -3.59 0.01 0.00 0.52 0.00 0.00 34.95 32.01 1je1 s ARG 16 CO 0.76 -0.06 -0.08 0.08 0.02 0.00 0.00 175.30 176.01 1je1 s VAL 17 N 1.42 0.76 -0.33 3.52 1.01 -0.08 -2.05 120.40 124.65 1je1 s VAL 17 Ca 0.09 -0.33 -0.12 0.00 0.00 0.00 0.00 61.98 61.63 1je1 s VAL 17 Cb -0.15 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.52 1je1 s VAL 17 CO 0.08 0.25 0.21 -0.22 0.00 0.00 0.00 175.10 175.42 1je1 s LEU 18 N 0.35 4.40 -0.13 3.92 0.20 -0.06 -1.59 118.68 125.77 1je1 s LEU 18 Ca -0.06 -0.44 -0.04 0.00 0.69 0.00 0.00 54.13 54.28 1je1 s LEU 18 Cb -0.10 -2.10 -0.03 0.00 -0.43 0.00 0.00 46.19 43.53 1je1 s LEU 18 CO 0.01 -0.22 0.02 0.68 -0.29 0.00 0.00 176.35 176.54 1je1 s VAL 19 N 1.69 4.41 0.10 1.68 -7.23 -0.61 -1.26 120.40 119.19 1je1 s VAL 19 Ca 0.06 -0.19 0.05 0.00 -1.81 0.00 0.00 61.98 60.09 1je1 s VAL 19 Cb -0.17 -2.91 -0.04 0.00 0.56 0.00 0.00 36.38 33.83 1je1 s VAL 19 CO 0.09 0.55 -0.13 0.68 -0.31 0.00 0.00 175.10 175.98 1je1 s VAL 20 N -0.33 1.17 0.08 1.32 -7.23 0.38 -1.36 120.40 114.44 1je1 s VAL 20 Ca 0.07 -1.60 0.01 0.00 -1.81 0.00 0.00 61.98 58.64 1je1 s VAL 20 Cb -0.12 -1.38 -0.25 0.00 0.56 0.00 0.00 36.38 35.18 1je1 s VAL 20 CO 0.02 -0.41 1.15 1.23 -0.31 0.00 0.00 175.10 176.77 1je1 h GLY 21 N 3.70 0.18 -6.78 2.32 0.00 -1.81 0.37 103.07 101.06 1je1 h GLY 21 Ca -0.39 -0.47 -0.62 0.00 0.00 0.00 0.00 47.33 45.85 1je1 h GLY 21 CO 0.49 0.41 0.02 -0.35 0.00 0.00 0.00 176.54 177.11 1je1 s ASP 22 N -6.93 6.45 0.33 0.19 -1.08 -1.26 -2.39 116.67 111.97 1je1 s ASP 22 Ca -0.03 0.51 0.04 0.00 -0.52 0.00 0.00 52.55 52.56 1je1 s ASP 22 Cb 0.08 -2.29 0.67 0.00 -1.46 0.00 0.00 42.92 39.92 1je1 s ASP 22 CO 0.86 -0.32 1.90 -0.65 0.52 0.00 0.00 175.17 177.48 1je1 h PRO 23 N 8.03 0.84 -0.70 4.34 0.11 -1.87 -0.39 132.00 142.37 1je1 h PRO 23 Ca -0.28 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1je1 h PRO 23 Cb 1.14 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 1je1 h PRO 23 CO 0.73 0.55 0.45 0.78 -0.21 0.00 0.00 178.00 180.30 1je1 h GLY 24 N 0.86 0.99 1.30 -0.55 0.00 -1.96 -1.85 103.07 101.86 1je1 h GLY 24 Ca 0.40 -0.38 -0.14 0.00 0.00 0.00 0.00 47.33 47.20 1je1 h GLY 24 CO -0.16 0.37 -0.37 -0.09 0.00 0.00 0.00 176.54 176.28 1je1 h ARG 25 N 0.95 0.77 -0.68 4.80 2.43 -1.50 -1.55 114.38 119.60 1je1 h ARG 25 Ca 0.25 -0.39 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 1je1 h ARG 25 Cb -0.09 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 1je1 h ARG 25 CO -0.05 1.01 0.38 0.00 -1.51 0.00 0.00 179.97 179.80 1je1 h ALA 26 N 0.94 0.87 -0.46 2.80 0.00 -0.92 0.18 119.26 122.67 1je1 h ALA 26 Ca 0.06 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1je1 h ALA 26 Cb 0.92 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1je1 h ALA 26 CO 0.08 0.38 -0.18 -0.09 0.00 0.00 0.00 179.25 179.45 1je1 h ARG 27 N 0.93 0.94 -0.25 0.00 2.43 -1.23 -1.65 114.38 115.55 1je1 h ARG 27 Ca 0.24 -0.39 -0.03 0.00 -0.81 0.00 0.00 59.98 58.99 1je1 h ARG 27 Cb 0.03 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1je1 h ARG 27 CO -0.04 1.05 0.03 1.25 -1.51 0.00 0.00 179.97 180.75 1je1 h LEU 28 N 0.78 0.41 -1.13 3.80 5.85 -0.94 -3.03 115.31 121.05 1je1 h LEU 28 Ca 0.11 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1je1 h LEU 28 Cb 0.74 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1je1 h LEU 28 CO 0.06 0.58 0.00 -0.07 -0.34 0.00 0.00 178.44 178.67 1je1 h LEU 29 N 0.22 0.00 -1.74 2.25 3.38 -0.59 -2.87 115.31 115.95 1je1 h LEU 29 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1je1 h LEU 29 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1je1 h LEU 29 CO 0.01 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.31 1je1 h SER 30 N 0.00 0.00 0.19 -0.43 4.64 -1.17 -1.86 113.55 114.92 1je1 h SER 30 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1je1 h SER 30 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1je1 h SER 30 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 1je1 n THR 31 N -2.94 0.25 1.02 2.95 -2.24 -1.09 -1.93 114.28 110.30 1je1 n THR 31 Ca -0.00 0.06 0.11 0.00 -2.27 0.00 0.00 64.05 61.95 1je1 n THR 31 Cb 0.23 -0.76 0.09 0.00 -2.10 0.00 0.00 70.33 67.79 1je1 n THR 31 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1je1 n LEU 32 N -1.16 0.85 -4.94 3.22 4.77 -0.70 -4.93 117.00 114.12 1je1 n LEU 32 Ca 0.11 -0.28 -0.24 0.00 -0.03 0.00 0.00 56.01 55.58 1je1 n LEU 32 Cb 0.11 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.07 1je1 n LEU 32 CO 0.13 0.20 0.20 -0.76 -1.33 0.00 0.00 177.39 175.82 1je1 s LEU 33 N -2.92 3.95 -0.12 2.23 1.43 -0.81 -4.95 118.68 117.48 1je1 s LEU 33 Ca 0.11 0.46 -0.18 0.00 -1.03 0.00 0.00 54.13 53.49 1je1 s LEU 33 Cb 0.17 -3.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.02 1je1 s LEU 33 CO 0.75 -0.36 0.48 -1.10 0.23 0.00 0.00 176.35 176.35 1je1 s GLN 34 N -4.37 4.33 -1.25 1.70 -0.21 0.26 -4.43 119.66 115.70 1je1 s GLN 34 Ca 0.41 0.44 -0.10 0.00 0.02 0.00 0.00 55.36 56.14 1je1 s GLN 34 Cb -0.10 -3.44 -0.01 0.00 1.00 0.00 0.00 33.01 30.47 1je1 s GLN 34 CO 0.37 0.15 0.66 -1.71 -2.12 0.00 0.00 175.29 172.64 1je1 n ASN 35 N 3.72 -2.94 -4.75 5.90 4.05 -1.26 -1.97 115.26 118.01 1je1 n ASN 35 Ca -0.07 -0.96 -0.41 0.00 0.45 0.00 0.00 54.58 53.58 1je1 n ASN 35 Cb 0.52 -3.48 -0.02 0.00 1.23 0.00 0.00 39.78 38.03 1je1 n ASN 35 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 177.26 171.37 1je1 s PRO 36 N -6.11 4.28 -0.03 1.20 0.02 -1.26 -4.63 135.00 128.47 1je1 s PRO 36 Ca 0.23 2.29 0.04 0.00 0.02 0.00 0.00 61.00 63.58 1je1 s PRO 36 Cb -0.08 -3.10 -0.01 0.00 0.02 0.00 0.00 34.50 31.34 1je1 s PRO 36 CO 0.86 -0.37 -0.16 0.15 -0.33 0.00 0.00 177.00 177.15 1je1 s LYS 37 N -0.76 1.47 -0.42 5.54 -0.14 -0.48 -4.94 119.74 120.01 1je1 s LYS 37 Ca 0.57 -0.56 -0.27 0.00 -1.36 0.00 0.00 55.97 54.34 1je1 s LYS 37 Cb -0.41 -1.35 0.02 0.00 -1.68 0.00 0.00 37.83 34.41 1je1 s LYS 37 CO 0.46 0.28 1.02 -1.17 -0.76 0.00 0.00 175.35 175.18 1je1 s LEU 38 N -0.14 3.87 0.00 3.17 2.96 -1.26 -1.04 118.68 126.24 1je1 s LEU 38 Ca 0.01 0.50 0.23 0.00 -0.22 0.00 0.00 54.13 54.65 1je1 s LEU 38 Cb -0.09 -3.38 0.08 0.00 0.50 0.00 0.00 46.19 43.30 1je1 s LEU 38 CO 0.01 -1.04 1.14 0.35 -1.32 0.00 0.00 176.35 175.49 1je1 n THR 39 N 6.36 0.00 -3.61 3.68 -2.24 0.41 -4.97 114.28 113.91 1je1 n THR 39 Ca 0.09 -0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.55 1je1 n THR 39 Cb 0.48 1.11 -0.06 0.00 -2.10 0.00 0.00 70.33 69.76 1je1 n THR 39 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1je1 s ASN 40 N -2.53 -0.45 0.00 3.42 2.47 -1.18 -3.88 114.94 112.80 1je1 s ASN 40 Ca 0.18 0.73 0.00 0.00 0.42 0.00 0.00 52.86 54.19 1je1 s ASN 40 Cb 0.18 0.69 0.00 0.00 -1.45 0.00 0.00 41.25 40.67 1je1 s ASN 40 CO 0.59 -0.24 0.00 -1.84 -3.72 0.00 0.00 177.10 171.89 1je1 n GLU 41 N 1.66 0.00 -1.64 0.43 0.28 -1.26 -1.46 120.64 118.65 1je1 n GLU 41 Ca -0.12 0.00 -0.46 0.00 -0.16 0.00 0.00 57.16 56.42 1je1 n GLU 41 Cb 0.57 -0.16 -0.03 0.00 1.43 0.00 0.00 31.44 33.24 1je1 n GLU 41 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1je1 n ASN 42 N 0.00 2.22 -1.23 -1.84 5.15 -1.26 -0.99 115.26 117.31 1je1 n ASN 42 Ca 0.00 1.15 -0.16 0.00 -0.60 0.00 0.00 54.58 54.97 1je1 n ASN 42 Cb 0.09 -1.35 -0.07 0.00 -0.53 0.00 0.00 39.78 37.92 1je1 n ASN 42 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1je1 n ARG 43 N 1.84 -1.57 -0.82 1.20 1.74 -1.26 -1.90 116.66 115.89 1je1 n ARG 43 Ca 0.12 1.05 0.00 0.00 -0.77 0.00 0.00 57.85 58.25 1je1 n ARG 43 Cb 0.29 -5.44 0.00 0.00 -1.02 0.00 0.00 32.46 26.29 1je1 n ARG 43 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1je1 n GLY 44 N -0.07 1.06 3.47 -0.13 0.00 -0.16 -4.97 105.19 104.39 1je1 n GLY 44 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1je1 n GLY 44 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1je1 n PHE 45 N -2.00 4.62 -1.87 1.61 3.01 -0.80 -4.81 117.46 117.22 1je1 n PHE 45 Ca 0.00 -2.98 -0.42 0.00 1.01 0.00 0.00 57.45 55.06 1je1 n PHE 45 Cb 0.00 -2.50 -0.03 0.00 -0.01 0.00 0.00 39.48 36.94 1je1 n PHE 45 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1je1 s LEU 46 N 3.27 4.37 -0.09 4.37 1.43 -1.26 -4.16 118.68 126.61 1je1 s LEU 46 Ca 0.50 2.64 0.02 0.00 -1.03 0.00 0.00 54.13 56.25 1je1 s LEU 46 Cb 0.03 -3.58 0.02 0.00 0.03 0.00 0.00 46.19 42.68 1je1 s LEU 46 CO 0.05 -0.89 -0.12 -0.69 0.23 0.00 0.00 176.35 174.93 1je1 s VAL 47 N 1.80 1.21 0.07 -1.59 1.01 -0.54 -1.68 120.40 120.69 1je1 s VAL 47 Ca 0.73 -0.48 0.09 0.00 0.00 0.00 0.00 61.98 62.32 1je1 s VAL 47 Cb -0.44 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 1je1 s VAL 47 CO 0.32 0.38 -0.22 -0.31 0.00 0.00 0.00 175.10 175.28 1je1 s TYR 48 N 0.98 2.45 -0.04 5.22 1.51 -0.09 -0.45 117.35 126.94 1je1 s TYR 48 Ca -0.08 -0.32 0.02 0.00 -1.01 0.00 0.00 57.07 55.68 1je1 s TYR 48 Cb -0.15 -1.38 0.01 0.00 -0.11 0.00 0.00 41.96 40.33 1je1 s TYR 48 CO -0.00 0.27 -0.06 0.99 -1.11 0.00 0.00 175.55 175.63 1je1 s THR 49 N -0.97 0.63 0.00 -0.71 2.01 -0.21 -0.49 115.64 115.90 1je1 s THR 49 Ca 0.15 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 61.93 1je1 s THR 49 Cb -0.10 -0.61 0.00 0.00 0.01 0.00 0.00 72.50 71.80 1je1 s THR 49 CO 0.06 0.23 0.00 0.61 -0.69 0.00 0.00 174.62 174.83 1je1 n GLY 50 N 3.74 2.80 3.51 4.40 0.00 -0.43 -1.38 105.19 117.84 1je1 n GLY 50 Ca -0.23 -0.81 -0.25 0.00 0.00 0.00 0.00 46.02 44.73 1je1 n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1je1 s LYS 51 N 0.42 1.84 -0.29 1.61 1.02 -0.83 -0.70 119.74 122.81 1je1 s LYS 51 Ca 0.00 -1.52 -0.13 0.00 0.02 0.00 0.00 55.97 54.34 1je1 s LYS 51 Cb 0.00 -1.96 0.11 0.00 -0.52 0.00 0.00 37.83 35.47 1je1 s LYS 51 CO 0.00 0.38 0.71 -0.47 -0.92 0.00 0.00 175.35 175.06 1je1 s TYR 52 N -2.05 -1.13 -1.46 3.18 5.04 0.37 -0.57 117.35 120.72 1je1 s TYR 52 Ca 0.26 2.09 -0.10 0.00 -2.44 0.00 0.00 57.07 56.89 1je1 s TYR 52 Cb -0.07 0.68 0.06 0.00 0.35 0.00 0.00 41.96 42.98 1je1 s TYR 52 CO 0.14 -0.56 0.92 0.09 -1.34 0.00 0.00 175.55 174.81 1je1 n ASN 53 N 4.84 -3.95 -0.56 4.32 4.13 -1.26 -1.35 115.26 121.44 1je1 n ASN 53 Ca -0.15 -0.78 -0.07 0.00 1.68 0.00 0.00 54.58 55.26 1je1 n ASN 53 Cb 0.54 -4.00 -0.03 0.00 -1.54 0.00 0.00 39.78 34.75 1je1 n ASN 53 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1je1 n GLY 54 N -1.69 0.89 3.21 7.41 0.00 -1.26 -5.00 105.19 108.75 1je1 n GLY 54 Ca -0.05 -0.33 -0.21 0.00 0.00 0.00 0.00 46.02 45.43 1je1 n GLY 54 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1je1 s GLU 55 N -2.29 0.95 0.02 1.61 2.56 -0.45 -5.12 118.70 115.97 1je1 s GLU 55 Ca 0.00 -1.02 -0.23 0.00 0.00 0.00 0.00 54.97 53.72 1je1 s GLU 55 Cb 0.00 -1.06 -0.05 0.00 2.00 0.00 0.00 34.13 35.02 1je1 s GLU 55 CO 0.00 0.24 0.69 0.99 -0.56 0.00 0.00 175.26 176.63 1je1 s THR 56 N -1.20 4.81 0.00 -1.70 2.01 -1.26 -0.48 115.64 117.82 1je1 s THR 56 Ca 0.02 1.47 -0.06 0.00 0.31 0.00 0.00 61.69 63.43 1je1 s THR 56 Cb -0.10 -4.04 -0.00 0.00 0.01 0.00 0.00 72.50 68.37 1je1 s THR 56 CO 0.03 0.38 0.10 -0.69 -0.69 0.00 0.00 174.62 173.75 1je1 s VAL 57 N -0.07 0.08 0.15 3.82 1.01 0.12 -4.53 120.40 120.98 1je1 s VAL 57 Ca 0.35 -0.66 0.11 0.00 0.00 0.00 0.00 61.98 61.78 1je1 s VAL 57 Cb -0.19 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.77 1je1 s VAL 57 CO 0.20 -0.36 -0.25 -0.44 0.00 0.00 0.00 175.10 174.25 1je1 s SER 58 N -1.24 3.43 -0.19 3.32 0.01 -0.87 -1.31 113.70 116.84 1je1 s SER 58 Ca -0.13 -0.76 0.01 0.00 1.31 0.00 0.00 55.95 56.37 1je1 s SER 58 Cb -0.07 -0.27 0.03 0.00 0.21 0.00 0.00 66.02 65.92 1je1 s SER 58 CO 0.01 0.16 -0.14 -0.63 0.41 0.00 0.00 173.24 173.05 1je1 s ILE 59 N -1.27 1.82 0.09 1.44 1.01 0.36 -0.88 121.20 123.76 1je1 s ILE 59 Ca 0.17 -1.00 0.10 0.00 0.00 0.00 0.00 60.65 59.91 1je1 s ILE 59 Cb -0.09 -1.79 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 1je1 s ILE 59 CO 0.08 0.30 -0.25 0.00 0.00 0.00 0.00 174.94 175.07 1je1 s ALA 60 N 1.34 2.20 -0.03 9.38 0.00 -0.39 -0.91 121.76 133.36 1je1 s ALA 60 Ca 0.01 -1.33 -0.19 0.00 0.00 0.00 0.00 51.96 50.45 1je1 s ALA 60 Cb -0.15 -0.40 -0.05 0.00 0.00 0.00 0.00 23.12 22.52 1je1 s ALA 60 CO -0.10 0.50 0.55 0.99 0.00 0.00 0.00 175.76 177.71 1je1 s THR 61 N -0.95 5.00 -0.43 0.00 2.01 -0.68 -0.47 115.64 120.12 1je1 s THR 61 Ca 0.12 1.14 0.04 0.00 0.31 0.00 0.00 61.69 63.29 1je1 s THR 61 Cb -0.10 -3.88 0.02 0.00 0.01 0.00 0.00 72.50 68.55 1je1 s THR 61 CO 0.04 0.41 0.57 0.00 -0.69 0.00 0.00 174.62 174.94 1je1 n HIS 62 N 2.90 0.00 -4.50 4.92 1.44 0.13 -4.73 115.22 115.39 1je1 n HIS 62 Ca -0.07 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.64 1je1 n HIS 62 Cb 0.51 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.62 1je1 n HIS 62 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1je1 n GLY 63 N 0.30 -1.12 3.58 -1.39 0.00 -1.01 -3.33 105.19 102.22 1je1 n GLY 63 Ca 0.02 -1.17 -0.34 0.00 0.00 0.00 0.00 46.02 44.53 1je1 n GLY 63 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1je1 s ILE 64 N 0.00 4.36 0.00 -0.61 1.01 -1.26 -4.58 121.20 120.12 1je1 s ILE 64 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1je1 s ILE 64 Cb 0.00 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.54 1je1 s ILE 64 CO 0.00 0.49 0.00 0.61 0.00 0.00 0.00 174.94 176.04 1je1 n GLY 65 N 3.44 2.19 0.09 6.18 0.00 -1.26 -4.50 105.19 111.33 1je1 n GLY 65 Ca -0.17 -1.86 -0.10 0.00 0.00 0.00 0.00 46.02 43.89 1je1 n GLY 65 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1je1 h GLY 66 N 0.00 0.05 0.42 -0.02 0.00 -1.92 -2.02 103.07 99.59 1je1 h GLY 66 Ca 0.00 0.05 0.12 0.00 0.00 0.00 0.00 47.33 47.50 1je1 h GLY 66 CO 0.00 -0.05 0.49 -2.55 0.00 0.00 0.00 176.54 174.42 1je1 h PRO 67 N -0.03 0.74 0.07 4.80 0.11 -1.95 -0.28 132.00 135.47 1je1 h PRO 67 Ca 0.05 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 1je1 h PRO 67 Cb 0.11 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.05 1je1 h PRO 67 CO -0.12 0.49 -0.03 1.03 -0.21 0.00 0.00 178.00 179.16 1je1 h SER 68 N 0.77 -0.08 -0.21 -2.05 0.87 -1.73 -2.93 113.55 108.19 1je1 h SER 68 Ca 0.44 -0.37 -0.05 0.00 -1.23 0.00 0.00 61.79 60.58 1je1 h SER 68 Cb 0.48 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.45 1je1 h SER 68 CO -0.29 0.34 -0.01 -0.29 -0.53 0.00 0.00 176.83 176.05 1je1 h ILE 69 N -0.51 1.19 -0.66 2.23 2.10 -1.15 -2.34 117.51 118.37 1je1 h ILE 69 Ca -0.01 -0.77 0.01 0.00 1.08 0.00 0.00 64.86 65.17 1je1 h ILE 69 Cb 0.44 0.96 -0.04 0.00 -1.09 0.00 0.00 36.82 37.09 1je1 h ILE 69 CO 0.02 0.26 0.43 0.00 -1.08 0.00 0.00 178.15 177.78 1je1 h ALA 70 N 1.52 0.84 -0.24 0.18 0.00 -1.05 -0.30 119.26 120.22 1je1 h ALA 70 Ca 0.10 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1je1 h ALA 70 Cb 0.32 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1je1 h ALA 70 CO 0.01 0.24 0.08 0.82 0.00 0.00 0.00 179.25 180.40 1je1 h ILE 71 N 0.87 1.19 -0.33 0.00 2.04 -1.28 -1.69 117.51 118.31 1je1 h ILE 71 Ca 0.25 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 1je1 h ILE 71 Cb -0.07 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1je1 h ILE 71 CO -0.07 0.19 0.18 0.58 0.00 0.00 0.00 178.15 179.03 1je1 h VAL 72 N 0.22 1.14 -0.37 1.67 2.07 -1.14 -1.87 116.25 117.96 1je1 h VAL 72 Ca 0.08 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1je1 h VAL 72 Cb 0.22 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1je1 h VAL 72 CO -0.00 0.14 0.17 -0.07 0.02 0.00 0.00 177.57 177.83 1je1 h LEU 73 N 0.41 0.50 -0.53 2.57 3.38 -1.03 -0.15 115.31 120.46 1je1 h LEU 73 Ca 0.12 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1je1 h LEU 73 Cb 0.06 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 1je1 h LEU 73 CO -0.02 0.50 0.27 -0.33 0.09 0.00 0.00 178.44 178.95 1je1 h GLU 74 N 0.46 0.51 -0.21 1.13 4.39 -1.17 -0.35 114.58 119.35 1je1 h GLU 74 Ca 0.13 -0.03 -0.17 0.00 0.34 0.00 0.00 59.36 59.63 1je1 h GLU 74 Cb 0.14 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.67 1je1 h GLU 74 CO -0.01 0.34 -0.56 0.93 -1.16 0.00 0.00 179.01 178.54 1je1 h GLU 75 N 0.53 0.66 -0.72 2.33 5.08 -1.14 -1.69 114.58 119.63 1je1 h GLU 75 Ca 0.23 -0.42 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 1je1 h GLU 75 Cb 0.13 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1je1 h GLU 75 CO -0.16 1.04 0.26 -0.07 -1.00 0.00 0.00 179.01 179.08 1je1 h LEU 76 N 0.50 1.02 -1.11 1.33 3.38 -0.78 -2.04 115.31 117.61 1je1 h LEU 76 Ca 0.01 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 1je1 h LEU 76 Cb 1.13 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1je1 h LEU 76 CO 0.11 0.94 0.26 0.00 0.09 0.00 0.00 178.44 179.83 1je1 h ALA 77 N 1.12 1.30 0.00 1.53 0.00 -0.91 -1.17 119.26 121.14 1je1 h ALA 77 Ca 0.24 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1je1 h ALA 77 Cb 0.26 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1je1 h ALA 77 CO -0.01 0.53 -0.21 0.52 0.00 0.00 0.00 179.25 180.07 1je1 h MET 78 N 0.88 0.00 -0.16 0.00 2.86 -0.74 -2.04 114.93 115.72 1je1 h MET 78 Ca 0.21 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1je1 h MET 78 Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 1je1 h MET 78 CO -0.02 0.21 0.00 1.28 1.06 0.00 0.00 176.91 179.44 1je1 n LEU 79 N -3.65 2.01 0.00 1.22 4.77 -0.53 -4.94 117.00 115.89 1je1 n LEU 79 Ca -0.01 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 55.17 1je1 n LEU 79 Cb 0.34 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1je1 n LEU 79 CO 0.33 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 1je1 n GLY 80 N 1.21 1.79 3.77 -0.72 0.00 -0.77 -4.31 105.19 106.16 1je1 n GLY 80 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1je1 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1je1 s ALA 81 N -1.82 3.22 0.00 4.61 0.00 -0.69 -4.42 121.76 122.66 1je1 s ALA 81 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 51.96 52.95 1je1 s ALA 81 Cb 0.00 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1je1 s ALA 81 CO 0.00 -0.49 0.00 0.27 0.00 0.00 0.00 175.76 175.54 1je1 n ASN 82 N 0.29 0.00 -3.91 0.00 2.04 -0.72 -4.17 115.26 108.79 1je1 n ASN 82 Ca 0.03 -0.90 -0.26 0.00 -0.44 0.00 0.00 54.58 53.01 1je1 n ASN 82 Cb 0.46 0.00 -0.17 0.00 -2.53 0.00 0.00 39.78 37.54 1je1 n ASN 82 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1je1 s VAL 83 N 0.00 0.99 -0.06 3.53 1.01 -0.79 -1.35 120.40 123.72 1je1 s VAL 83 Ca 0.00 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.72 1je1 s VAL 83 Cb 0.00 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.39 1je1 s VAL 83 CO 0.00 0.36 -0.09 -0.36 0.00 0.00 0.00 175.10 175.00 1je1 s PHE 84 N 1.64 1.23 -0.21 5.22 0.40 -0.06 -0.90 117.98 125.29 1je1 s PHE 84 Ca 0.03 -0.45 0.02 0.00 -0.60 0.00 0.00 56.93 55.93 1je1 s PHE 84 Cb -0.13 -0.96 0.04 0.00 0.51 0.00 0.00 43.02 42.49 1je1 s PHE 84 CO -0.07 -0.27 -0.14 0.42 0.70 0.00 0.00 175.22 175.86 1je1 s ILE 85 N 0.84 1.96 0.10 0.64 1.01 -0.62 -1.84 121.20 123.29 1je1 s ILE 85 Ca -0.12 -1.19 -0.28 0.00 0.00 0.00 0.00 60.65 59.06 1je1 s ILE 85 Cb -0.15 -1.95 -0.06 0.00 0.01 0.00 0.00 42.46 40.31 1je1 s ILE 85 CO 0.02 0.23 0.87 -0.60 0.00 0.00 0.00 174.94 175.45 1je1 s ARG 86 N 1.26 4.62 -0.29 2.79 3.52 -0.50 -1.57 118.95 128.78 1je1 s ARG 86 Ca -0.02 1.28 0.00 0.00 -0.13 0.00 0.00 55.73 56.87 1je1 s ARG 86 Cb -0.16 -3.36 0.09 0.00 -1.56 0.00 0.00 34.95 29.96 1je1 s ARG 86 CO -0.09 0.29 0.05 -0.47 -0.81 0.00 0.00 175.30 174.27 1je1 s TYR 87 N -0.19 2.22 0.00 5.12 5.04 -0.46 -1.44 117.35 127.64 1je1 s TYR 87 Ca 0.42 -1.91 0.00 0.00 -2.44 0.00 0.00 57.07 53.14 1je1 s TYR 87 Cb -0.22 -1.86 0.00 0.00 0.35 0.00 0.00 41.96 40.22 1je1 s TYR 87 CO 0.27 -0.84 0.00 0.41 -1.34 0.00 0.00 175.55 174.05 1je1 n GLY 88 N 4.70 6.40 3.51 8.97 0.00 -0.95 -4.51 105.19 123.31 1je1 n GLY 88 Ca -0.04 -1.72 -0.24 0.00 0.00 0.00 0.00 46.02 44.02 1je1 n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1je1 s THR 89 N -0.08 2.70 0.17 2.61 -4.23 -1.26 -0.04 115.64 115.51 1je1 s THR 89 Ca 0.00 -2.29 -0.18 0.00 -1.18 0.00 0.00 61.69 58.04 1je1 s THR 89 Cb 0.00 -2.42 0.04 0.00 1.34 0.00 0.00 72.50 71.45 1je1 s THR 89 CO 0.00 -0.39 0.50 0.28 -0.54 0.00 0.00 174.62 174.47 1je1 s THR 90 N -2.45 0.03 -0.23 3.99 -1.32 -0.27 -4.78 115.64 110.61 1je1 s THR 90 Ca 0.30 -0.62 -0.07 0.00 -1.21 0.00 0.00 61.69 60.10 1je1 s THR 90 Cb -0.05 -1.39 -0.03 0.00 -1.51 0.00 0.00 72.50 69.52 1je1 s THR 90 CO 0.16 -0.15 0.05 -0.83 -2.21 0.00 0.00 174.62 171.63 1je1 s GLY 91 N -2.84 1.76 0.35 6.08 0.00 -0.90 -1.67 107.32 110.10 1je1 s GLY 91 Ca 0.06 -1.06 -0.28 0.00 0.00 0.00 0.00 44.72 43.45 1je1 s GLY 91 CO -0.07 0.41 1.27 0.00 0.00 0.00 0.00 173.10 174.72 1je1 s ALA 92 N 1.34 3.40 -2.47 3.20 0.00 0.25 -0.79 121.76 126.69 1je1 s ALA 92 Ca 0.05 1.19 0.21 0.00 0.00 0.00 0.00 51.96 53.41 1je1 s ALA 92 Cb -0.15 -3.46 0.13 0.00 0.00 0.00 0.00 23.12 19.65 1je1 s ALA 92 CO 0.03 -0.63 1.13 1.28 0.00 0.00 0.00 175.76 177.57 1je1 n LEU 93 N 0.60 2.57 -4.23 0.00 4.77 -0.11 -0.67 117.00 119.94 1je1 n LEU 93 Ca 0.01 -0.95 -0.24 0.00 -0.03 0.00 0.00 56.01 54.81 1je1 n LEU 93 Cb 0.43 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.38 1je1 n LEU 93 CO 0.57 0.45 -0.51 0.68 -1.33 0.00 0.00 177.39 177.25 1je1 s VAL 94 N -1.88 1.53 0.17 4.08 -7.23 -1.25 -4.62 120.40 111.20 1je1 s VAL 94 Ca 0.23 -1.20 0.28 0.00 -1.81 0.00 0.00 61.98 59.48 1je1 s VAL 94 Cb 0.17 -1.35 0.30 0.00 0.56 0.00 0.00 36.38 36.06 1je1 s VAL 94 CO 0.32 0.11 1.92 1.55 -0.31 0.00 0.00 175.10 178.69 1je1 h PRO 95 N 4.76 0.00 0.00 4.82 0.13 -1.92 -3.30 132.00 136.50 1je1 h PRO 95 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1je1 h PRO 95 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1je1 h PRO 95 CO 0.43 0.13 0.00 2.48 -0.23 0.00 0.00 178.00 180.82 1je1 n TYR 96 N -3.32 0.00 -3.38 1.56 0.18 -1.26 -4.75 117.16 106.20 1je1 n TYR 96 Ca -0.00 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.40 1je1 n TYR 96 Cb 0.36 -0.36 -0.07 0.00 -0.38 0.00 0.00 39.34 38.89 1je1 n TYR 96 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 1je1 s ILE 97 N -2.72 5.20 0.32 -3.48 1.01 -1.24 -5.07 121.20 115.22 1je1 s ILE 97 Ca 0.22 0.77 -0.02 0.00 0.00 0.00 0.00 60.65 61.62 1je1 s ILE 97 Cb 0.18 -3.75 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1je1 s ILE 97 CO 0.45 0.28 0.55 0.20 0.00 0.00 0.00 174.94 176.42 1je1 s ASN 98 N 0.87 6.35 0.31 3.58 0.01 -1.26 -4.95 114.94 119.85 1je1 s ASN 98 Ca 0.21 0.56 -0.29 0.00 -0.71 0.00 0.00 52.86 52.62 1je1 s ASN 98 Cb -0.15 -2.08 -0.11 0.00 0.41 0.00 0.00 41.25 39.33 1je1 s ASN 98 CO 0.08 -0.25 1.45 -0.76 -1.51 0.00 0.00 177.10 176.11 1je1 s LEU 99 N -3.99 4.37 0.00 0.60 1.43 -1.26 -2.30 118.68 117.53 1je1 s LEU 99 Ca 0.41 2.84 0.00 0.00 -1.03 0.00 0.00 54.13 56.36 1je1 s LEU 99 Cb -0.10 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.47 1je1 s LEU 99 CO 0.34 -0.76 0.00 0.61 0.23 0.00 0.00 176.35 176.77 1je1 n GLY 100 N 1.37 1.89 3.93 -3.19 0.00 0.15 -5.01 105.19 104.33 1je1 n GLY 100 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1je1 n GLY 100 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1je1 s GLU 101 N -0.70 1.75 0.23 1.61 2.02 -0.97 -4.76 118.70 117.87 1je1 s GLU 101 Ca 0.00 -0.27 0.11 0.00 0.02 0.00 0.00 54.97 54.82 1je1 s GLU 101 Cb 0.00 -2.06 -0.04 0.00 0.10 0.00 0.00 34.13 32.13 1je1 s GLU 101 CO 0.00 -1.61 -0.14 0.71 0.02 0.00 0.00 175.26 174.24 1je1 s TYR 102 N -3.47 2.47 -0.12 1.61 1.51 -0.59 -1.57 117.35 117.20 1je1 s TYR 102 Ca 0.64 -0.29 0.00 0.00 -1.01 0.00 0.00 57.07 56.42 1je1 s TYR 102 Cb -0.09 -1.15 0.02 0.00 -0.11 0.00 0.00 41.96 40.63 1je1 s TYR 102 CO 0.48 0.59 -0.11 0.42 -1.11 0.00 0.00 175.55 175.82 1je1 s ILE 103 N -2.05 1.22 -0.32 2.71 1.01 -0.35 -0.96 121.20 122.46 1je1 s ILE 103 Ca 0.27 -0.43 -0.14 0.00 0.00 0.00 0.00 60.65 60.35 1je1 s ILE 103 Cb -0.07 -1.18 -0.02 0.00 0.01 0.00 0.00 42.46 41.19 1je1 s ILE 103 CO 0.15 0.40 0.32 -0.63 0.00 0.00 0.00 174.94 175.17 1je1 s ILE 104 N 1.46 5.21 -0.00 2.92 1.01 0.75 -0.79 121.20 131.75 1je1 s ILE 104 Ca 0.01 0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.49 1je1 s ILE 104 Cb -0.13 -3.74 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 1je1 s ILE 104 CO -0.07 0.02 1.04 -0.69 0.00 0.00 0.00 174.94 175.25 1je1 s VAL 105 N 1.94 4.64 -1.11 2.92 1.01 -0.82 -2.33 120.40 126.65 1je1 s VAL 105 Ca 0.11 1.90 0.11 0.00 0.00 0.00 0.00 61.98 64.10 1je1 s VAL 105 Cb -0.16 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.01 1je1 s VAL 105 CO 0.11 0.12 0.71 0.35 0.00 0.00 0.00 175.10 176.40 1je1 n THR 106 N 4.01 0.00 0.00 3.92 -2.24 -0.76 -4.62 114.28 114.58 1je1 n THR 106 Ca 0.07 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1je1 n THR 106 Cb 0.49 1.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.88 1je1 n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1je1 n GLY 107 N 0.89 1.08 2.92 3.38 0.00 -1.26 -4.47 105.19 107.73 1je1 n GLY 107 Ca 0.05 -0.70 -0.22 0.00 0.00 0.00 0.00 46.02 45.15 1je1 n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1je1 s ALA 108 N -2.00 0.88 0.39 4.61 0.00 -0.56 -1.53 121.76 123.54 1je1 s ALA 108 Ca 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 51.96 51.70 1je1 s ALA 108 Cb 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.54 1je1 s ALA 108 CO 0.00 -0.06 0.69 -1.12 0.00 0.00 0.00 175.76 175.28 1je1 s SER 109 N 1.01 6.41 0.08 0.00 0.01 0.64 -4.58 113.70 117.26 1je1 s SER 109 Ca -0.09 0.90 -0.26 0.00 1.31 0.00 0.00 55.95 57.81 1je1 s SER 109 Cb -0.14 -2.23 0.09 0.00 0.21 0.00 0.00 66.02 63.95 1je1 s SER 109 CO -0.00 -0.38 0.76 -0.72 0.41 0.00 0.00 173.24 173.31 1je1 s TYR 110 N -2.38 -0.43 0.00 2.43 1.13 -1.26 -1.29 117.35 115.55 1je1 s TYR 110 Ca 0.47 0.25 -0.15 0.00 -1.41 0.00 0.00 57.07 56.23 1je1 s TYR 110 Cb -0.10 0.55 -0.06 0.00 -1.10 0.00 0.00 41.96 41.25 1je1 s TYR 110 CO 0.35 -0.70 0.42 -0.80 -2.51 0.00 0.00 175.55 172.30 1je1 s ASN 111 N -2.62 6.82 0.94 -0.18 0.01 -1.26 -5.06 114.94 113.59 1je1 s ASN 111 Ca 0.03 0.97 -0.11 0.00 -0.71 0.00 0.00 52.86 53.04 1je1 s ASN 111 Cb -0.01 -2.26 0.16 0.00 0.41 0.00 0.00 41.25 39.55 1je1 s ASN 111 CO -0.10 0.32 1.09 -1.10 -1.51 0.00 0.00 177.10 175.79 1je1 s GLN 112 N -1.04 0.88 0.00 -0.60 -0.21 -1.26 -4.95 119.66 112.48 1je1 s GLN 112 Ca 0.24 0.96 0.00 0.00 0.02 0.00 0.00 55.36 56.58 1je1 s GLN 112 Cb -0.17 -1.75 0.00 0.00 1.00 0.00 0.00 33.01 32.09 1je1 s GLN 112 CO 0.14 -2.54 0.00 0.41 -2.12 0.00 0.00 175.29 171.18 1je1 n GLY 113 N -0.58 0.60 0.00 3.09 0.00 -1.26 -5.04 105.19 102.00 1je1 n GLY 113 Ca 0.07 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.97 1je1 n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1je1 n GLY 114 N 0.00 0.00 0.27 -0.02 0.00 -1.26 -1.55 105.19 102.64 1je1 n GLY 114 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1je1 n GLY 114 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1je1 h LEU 115 N 0.00 -0.36 -0.86 0.99 6.46 -1.98 -0.98 115.31 118.58 1je1 h LEU 115 Ca 0.00 0.19 -0.05 0.00 -0.12 0.00 0.00 57.88 57.91 1je1 h LEU 115 Cb 0.00 0.34 -0.03 0.00 -0.73 0.00 0.00 40.66 40.24 1je1 h LEU 115 CO 0.00 -0.18 0.29 -0.26 -0.62 0.00 0.00 178.44 177.67 1je1 h PHE 116 N 0.10 1.15 -0.45 1.25 -1.00 -1.67 -1.93 116.94 114.38 1je1 h PHE 116 Ca 0.40 -0.09 -0.08 0.00 2.81 0.00 0.00 57.97 61.01 1je1 h PHE 116 Cb 0.69 -0.34 -0.02 0.00 3.61 0.00 0.00 35.95 39.89 1je1 h PHE 116 CO -0.42 0.88 -0.01 -0.92 -1.61 0.00 0.00 178.31 176.22 1je1 h TYR 117 N 1.10 0.89 -0.57 -0.55 3.20 -0.28 0.61 116.97 121.36 1je1 h TYR 117 Ca 0.25 -0.16 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 1je1 h TYR 117 Cb 0.23 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.24 1je1 h TYR 117 CO 0.02 0.86 0.12 1.96 -1.64 0.00 0.00 178.16 179.48 1je1 h GLN 118 N 0.66 0.89 0.18 1.82 4.20 -0.99 0.26 115.11 122.13 1je1 h GLN 118 Ca 0.13 -0.20 -0.32 0.00 0.06 0.00 0.00 58.65 58.32 1je1 h GLN 118 Cb 0.52 -0.13 0.02 0.00 0.30 0.00 0.00 27.48 28.19 1je1 h GLN 118 CO 0.03 0.81 -1.53 1.88 -0.67 0.00 0.00 178.83 179.35 1je1 h TYR 119 N 0.85 0.71 0.00 2.96 0.05 -1.30 -3.37 116.97 116.87 1je1 h TYR 119 Ca 0.18 -0.52 0.00 0.00 0.05 0.00 0.00 58.73 58.44 1je1 h TYR 119 Cb 0.34 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.05 1je1 h TYR 119 CO 0.02 1.59 -0.73 -0.07 -1.05 0.00 0.00 178.16 177.92 1je1 h LEU 120 N -0.02 0.00 0.00 3.88 3.38 -0.90 -3.48 115.31 118.17 1je1 h LEU 120 Ca -0.30 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1je1 h LEU 120 Cb 2.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.75 1je1 h LEU 120 CO 0.17 0.05 0.00 0.54 0.09 0.00 0.00 178.44 179.30 1je1 n ARG 121 N -2.43 -0.00 -3.55 1.13 5.12 0.90 -4.94 116.66 112.89 1je1 n ARG 121 Ca 0.02 0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 55.86 1je1 n ARG 121 Cb 0.49 -2.91 0.03 0.00 -1.16 0.00 0.00 32.46 28.91 1je1 n ARG 121 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1je1 n ASP 122 N -0.00 -2.06 -2.08 0.55 3.85 -1.25 -5.02 116.55 110.55 1je1 n ASP 122 Ca 0.00 -2.39 -0.11 0.00 -0.71 0.00 0.00 54.79 51.57 1je1 n ASP 122 Cb 0.00 3.42 0.27 0.00 -1.35 0.00 0.00 41.12 43.46 1je1 n ASP 122 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1je1 n ASN 123 N -1.46 4.52 -4.76 -1.12 3.02 -1.26 -4.42 115.26 109.78 1je1 n ASN 123 Ca -0.08 -3.35 -0.38 0.00 -0.03 0.00 0.00 54.58 50.75 1je1 n ASN 123 Cb 0.54 -0.78 0.02 0.00 -0.61 0.00 0.00 39.78 38.96 1je1 n ASN 123 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1je1 s ALA 124 N -3.09 2.90 -1.02 5.41 0.00 -1.26 -4.92 121.76 119.78 1je1 s ALA 124 Ca 0.56 1.20 -0.18 0.00 0.00 0.00 0.00 51.96 53.54 1je1 s ALA 124 Cb 0.45 -3.50 0.13 0.00 0.00 0.00 0.00 23.12 20.21 1je1 s ALA 124 CO 0.13 -1.10 1.24 0.00 0.00 0.00 0.00 175.76 176.03 1je1 s VAL 126 N 2.57 3.53 -0.13 0.00 1.01 -1.26 -4.94 120.40 121.19 1je1 s VAL 126 Ca 0.37 1.35 -0.29 0.00 0.00 0.00 0.00 61.98 63.41 1je1 s VAL 126 Cb -0.04 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.42 1je1 s VAL 126 CO -0.07 0.25 2.04 0.00 0.00 0.00 0.00 175.10 177.32 1je1 s ALA 127 N -0.38 3.12 -0.95 5.51 0.00 -1.26 -4.91 121.76 122.89 1je1 s ALA 127 Ca 0.50 0.93 -0.14 0.00 0.00 0.00 0.00 51.96 53.25 1je1 s ALA 127 Cb -0.33 -3.96 0.20 0.00 0.00 0.00 0.00 23.12 19.04 1je1 s ALA 127 CO 0.38 -2.23 0.99 0.45 0.00 0.00 0.00 175.76 175.35 1je1 s SER 128 N 6.29 6.87 0.14 0.00 0.15 -1.26 -4.81 113.70 121.08 1je1 s SER 128 Ca 0.92 -2.74 0.07 0.00 0.70 0.00 0.00 55.95 54.90 1je1 s SER 128 Cb -0.35 -2.27 -0.04 0.00 -1.71 0.00 0.00 66.02 61.64 1je1 s SER 128 CO 0.37 -0.65 -0.17 0.42 1.20 0.00 0.00 173.24 174.41 1je1 s THR 129 N 0.64 1.61 0.86 6.45 -4.23 -1.26 -1.50 115.64 118.20 1je1 s THR 129 Ca 0.26 -1.81 -0.12 0.00 -1.18 0.00 0.00 61.69 58.84 1je1 s THR 129 Cb -0.08 -1.70 0.15 0.00 1.34 0.00 0.00 72.50 72.21 1je1 s THR 129 CO -0.08 -0.35 1.20 -2.16 -0.54 0.00 0.00 174.62 172.70 1je1 s PRO 130 N -2.70 1.26 0.12 3.99 0.04 -1.26 -4.77 135.00 131.68 1je1 s PRO 130 Ca 0.12 -0.40 -0.31 0.00 0.04 0.00 0.00 61.00 60.45 1je1 s PRO 130 Cb -0.06 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.41 1je1 s PRO 130 CO 0.05 -1.95 1.50 0.34 0.04 0.00 0.00 177.00 176.98 1je1 s ASP 131 N -4.76 6.69 0.10 6.66 2.15 0.58 -4.93 116.67 123.17 1je1 s ASP 131 Ca 0.69 2.45 -0.27 0.00 0.43 0.00 0.00 52.55 55.85 1je1 s ASP 131 Cb -0.06 -2.58 -0.11 0.00 -0.30 0.00 0.00 42.92 39.86 1je1 s ASP 131 CO 0.50 -0.76 1.65 0.15 -0.17 0.00 0.00 175.17 176.54 1je1 h PHE 132 N 7.11 -0.61 -0.02 -5.34 3.04 -1.94 -2.18 116.94 117.01 1je1 h PHE 132 Ca -0.42 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.54 1je1 h PHE 132 Cb 1.20 0.24 -0.00 0.00 2.56 0.00 0.00 35.95 39.96 1je1 h PHE 132 CO 0.68 -0.34 0.01 0.93 -2.02 0.00 0.00 178.31 177.57 1je1 h GLU 133 N -0.48 0.02 -0.73 1.11 5.08 -1.98 -2.30 114.58 115.30 1je1 h GLU 133 Ca 0.00 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1je1 h GLU 133 Cb 0.46 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 1je1 h GLU 133 CO -0.07 0.04 0.48 1.25 -1.00 0.00 0.00 179.01 179.71 1je1 h LEU 134 N -0.00 0.80 -0.55 1.33 5.85 -1.92 -1.36 115.31 119.46 1je1 h LEU 134 Ca 0.01 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.60 1je1 h LEU 134 Cb 0.02 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 1je1 h LEU 134 CO -0.00 0.56 -0.09 0.74 -0.34 0.00 0.00 178.44 179.31 1je1 h THR 135 N 0.94 1.27 -0.21 1.05 2.02 -1.20 -2.13 112.91 114.64 1je1 h THR 135 Ca 0.28 -1.26 -0.08 0.00 0.77 0.00 0.00 66.41 66.12 1je1 h THR 135 Cb -0.03 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1je1 h THR 135 CO -0.07 0.45 -0.24 0.78 0.37 0.00 0.00 175.52 176.80 1je1 h ASN 136 N 0.92 0.38 -0.32 4.18 2.35 -0.79 -2.28 115.58 120.02 1je1 h ASN 136 Ca 0.15 -0.12 -0.06 0.00 -0.55 0.00 0.00 56.30 55.71 1je1 h ASN 136 Cb 0.67 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.91 1je1 h ASN 136 CO 0.05 0.63 -0.01 0.11 -1.65 0.00 0.00 177.43 176.55 1je1 h LYS 137 N 0.34 0.68 -0.37 0.81 1.57 -0.94 -1.82 116.57 116.84 1je1 h LYS 137 Ca 0.05 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1je1 h LYS 137 Cb 0.62 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 1je1 h LYS 137 CO 0.04 0.70 0.17 -0.07 -0.57 0.00 0.00 179.45 179.72 1je1 h LEU 138 N 0.64 0.50 -0.99 2.94 3.38 -0.84 -0.46 115.31 120.47 1je1 h LEU 138 Ca 0.13 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1je1 h LEU 138 Cb 0.41 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 1je1 h LEU 138 CO 0.02 0.50 0.65 0.58 0.09 0.00 0.00 178.44 180.28 1je1 h VAL 139 N 0.46 1.17 -0.29 1.22 2.07 -1.06 -0.24 116.25 119.57 1je1 h VAL 139 Ca 0.13 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 1je1 h VAL 139 Cb 0.15 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.72 1je1 h VAL 139 CO -0.01 0.23 0.07 0.74 0.02 0.00 0.00 177.57 178.61 1je1 h THR 140 N 1.25 1.22 -0.70 2.57 2.02 -0.93 -1.90 112.91 116.44 1je1 h THR 140 Ca 0.40 -0.72 -0.08 0.00 0.77 0.00 0.00 66.41 66.78 1je1 h THR 140 Cb 0.01 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1je1 h THR 140 CO -0.13 0.24 0.14 0.28 0.37 0.00 0.00 175.52 176.42 1je1 h SER 141 N 0.30 1.08 0.46 4.18 0.02 -0.46 -1.30 113.55 117.83 1je1 h SER 141 Ca 0.09 -0.25 -0.12 0.00 -0.84 0.00 0.00 61.79 60.67 1je1 h SER 141 Cb 0.29 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1je1 h SER 141 CO 0.00 1.05 -0.55 -0.26 -1.14 0.00 0.00 176.83 175.93 1je1 h PHE 142 N 1.07 0.12 -0.20 3.45 -1.00 -1.03 -2.70 116.94 116.64 1je1 h PHE 142 Ca 0.22 -0.04 -0.21 0.00 2.81 0.00 0.00 57.97 60.74 1je1 h PHE 142 Cb 0.41 -0.02 0.01 0.00 3.61 0.00 0.00 35.95 39.95 1je1 h PHE 142 CO 0.03 0.63 -0.69 1.03 -1.61 0.00 0.00 178.31 177.70 1je1 h SER 143 N 0.07 0.95 -0.85 2.17 0.87 -1.15 -1.59 113.55 114.02 1je1 h SER 143 Ca -0.00 -0.58 0.06 0.00 -1.23 0.00 0.00 61.79 60.04 1je1 h SER 143 Cb 1.00 -0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 62.62 1je1 h SER 143 CO 0.08 1.38 0.53 0.11 -0.53 0.00 0.00 176.83 178.40 1je1 h LYS 144 N 0.59 0.94 -0.52 2.24 6.56 -1.10 -1.41 116.57 123.88 1je1 h LYS 144 Ca -0.03 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.51 1je1 h LYS 144 Cb 1.31 -0.21 0.00 0.00 -0.57 0.00 0.00 32.23 32.76 1je1 h LYS 144 CO 0.15 0.62 0.00 0.54 -2.06 0.00 0.00 179.45 178.70 1je1 n ARG 145 N -4.62 2.01 -4.00 3.15 1.74 -1.03 -4.92 116.66 108.98 1je1 n ARG 145 Ca 0.12 -1.10 -0.28 0.00 -0.77 0.00 0.00 57.85 55.82 1je1 n ARG 145 Cb 0.17 -1.46 -0.02 0.00 -1.02 0.00 0.00 32.46 30.13 1je1 n ARG 145 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1je1 n ASN 146 N 0.29 -1.19 -4.88 0.55 3.02 -0.53 -4.97 115.26 107.55 1je1 n ASN 146 Ca 0.10 -0.99 -0.35 0.00 -0.03 0.00 0.00 54.58 53.30 1je1 n ASN 146 Cb 0.40 -3.05 -0.06 0.00 -0.61 0.00 0.00 39.78 36.46 1je1 n ASN 146 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1je1 s LEU 147 N -7.05 4.35 -0.34 3.41 1.43 -0.61 -5.05 118.68 114.82 1je1 s LEU 147 Ca 0.19 0.40 -0.29 0.00 -1.03 0.00 0.00 54.13 53.41 1je1 s LEU 147 Cb -0.10 -2.30 0.02 0.00 0.03 0.00 0.00 46.19 43.83 1je1 s LEU 147 CO 0.89 0.34 1.06 -0.75 0.23 0.00 0.00 176.35 178.13 1je1 s LYS 148 N -1.43 4.00 0.14 1.70 2.47 -1.26 -4.68 119.74 120.67 1je1 s LYS 148 Ca 0.20 0.95 0.01 0.00 -1.56 0.00 0.00 55.97 55.57 1je1 s LYS 148 Cb -0.12 -3.76 -0.04 0.00 -1.46 0.00 0.00 37.83 32.44 1je1 s LYS 148 CO 0.11 -0.96 0.00 1.52 0.16 0.00 0.00 175.35 176.18 1je1 s TYR 149 N 3.71 1.03 0.04 4.03 -0.85 -1.26 -1.54 117.35 122.51 1je1 s TYR 149 Ca 0.45 -1.06 0.04 0.00 -0.52 0.00 0.00 57.07 55.98 1je1 s TYR 149 Cb -0.12 -0.59 -0.02 0.00 0.38 0.00 0.00 41.96 41.61 1je1 s TYR 149 CO 0.18 -0.28 -0.11 0.71 -1.52 0.00 0.00 175.55 174.52 1je1 s TYR 150 N -3.76 0.97 -0.17 -3.49 1.51 -0.14 -4.95 117.35 107.31 1je1 s TYR 150 Ca 0.21 -0.38 -0.02 0.00 -1.01 0.00 0.00 57.07 55.86 1je1 s TYR 150 Cb 0.06 -0.57 -0.01 0.00 -0.11 0.00 0.00 41.96 41.33 1je1 s TYR 150 CO 0.01 -0.00 -0.09 0.08 -1.11 0.00 0.00 175.55 174.44 1je1 s VAL 151 N -1.00 3.26 -0.06 0.71 1.01 -1.26 -0.18 120.40 122.89 1je1 s VAL 151 Ca -0.02 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 1je1 s VAL 151 Cb -0.08 -2.42 0.10 0.00 0.00 0.00 0.00 36.38 33.98 1je1 s VAL 151 CO 0.01 0.48 1.34 -0.83 0.00 0.00 0.00 175.10 176.10 1je1 s GLY 152 N 0.78 -0.21 0.50 4.51 0.00 -0.98 -4.98 107.32 106.95 1je1 s GLY 152 Ca -0.03 0.18 -0.09 0.00 0.00 0.00 0.00 44.72 44.79 1je1 s GLY 152 CO 0.01 5.67 0.86 -1.31 0.00 0.00 0.00 173.10 178.33 1je1 s ASN 153 N -3.80 6.33 0.13 1.64 0.01 -1.26 -1.84 114.94 116.15 1je1 s ASN 153 Ca 0.29 1.14 0.04 0.00 -0.71 0.00 0.00 52.86 53.62 1je1 s ASN 153 Cb 0.01 -2.34 -0.04 0.00 0.41 0.00 0.00 41.25 39.29 1je1 s ASN 153 CO -0.02 -0.61 -0.10 0.68 -1.51 0.00 0.00 177.10 175.54 1je1 s VAL 154 N -2.77 1.05 -0.21 1.60 -7.23 -0.58 -1.02 120.40 111.24 1je1 s VAL 154 Ca 0.51 -1.92 -0.09 0.00 -1.81 0.00 0.00 61.98 58.67 1je1 s VAL 154 Cb -0.10 -1.68 -0.04 0.00 0.56 0.00 0.00 36.38 35.11 1je1 s VAL 154 CO 0.43 -0.70 0.11 0.12 -0.31 0.00 0.00 175.10 174.75 1je1 s PHE 155 N -3.10 3.29 -0.57 2.82 5.36 -0.65 -0.26 117.98 124.86 1je1 s PHE 155 Ca 0.13 0.14 -0.18 0.00 -0.96 0.00 0.00 56.93 56.05 1je1 s PHE 155 Cb 0.01 -2.17 0.10 0.00 -0.34 0.00 0.00 43.02 40.63 1je1 s PHE 155 CO -0.00 0.12 0.66 -1.12 -1.46 0.00 0.00 175.22 173.41 1je1 s SER 156 N 0.67 6.19 0.36 6.13 0.01 -0.41 -1.83 113.70 124.82 1je1 s SER 156 Ca 0.06 -1.45 -0.13 0.00 1.31 0.00 0.00 55.95 55.73 1je1 s SER 156 Cb -0.13 -2.28 -0.08 0.00 0.21 0.00 0.00 66.02 63.74 1je1 s SER 156 CO 0.01 -1.05 0.76 -0.55 0.41 0.00 0.00 173.24 172.83 1je1 s SER 157 N 3.52 6.68 0.00 2.44 0.15 0.49 -4.60 113.70 122.39 1je1 s SER 157 Ca 0.10 1.24 0.13 0.00 0.70 0.00 0.00 55.95 58.13 1je1 s SER 157 Cb -0.25 -2.36 -0.07 0.00 -1.71 0.00 0.00 66.02 61.63 1je1 s SER 157 CO 0.06 -0.29 0.66 0.47 1.20 0.00 0.00 173.24 175.34 1je1 n ASP 158 N -0.76 1.04 -3.64 5.45 8.00 -1.26 -4.36 116.55 121.03 1je1 n ASP 158 Ca 0.03 -1.02 -0.29 0.00 0.71 0.00 0.00 54.79 54.22 1je1 n ASP 158 Cb 0.53 0.74 -0.13 0.00 -0.02 0.00 0.00 41.12 42.24 1je1 n ASP 158 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1je1 s ALA 159 N -1.96 1.81 0.29 2.24 0.00 -1.26 -4.99 121.76 117.89 1je1 s ALA 159 Ca 0.08 -2.40 0.05 0.00 0.00 0.00 0.00 51.96 49.68 1je1 s ALA 159 Cb 0.10 -1.80 0.72 0.00 0.00 0.00 0.00 23.12 22.14 1je1 s ALA 159 CO 0.44 -2.07 1.75 0.35 0.00 0.00 0.00 175.76 176.22 1je1 h PHE 160 N 6.76 0.90 -0.43 0.00 3.57 -1.99 -2.20 116.94 123.55 1je1 h PHE 160 Ca 0.02 0.04 -0.18 0.00 3.53 0.00 0.00 57.97 61.38 1je1 h PHE 160 Cb 0.94 -0.25 -0.10 0.00 2.79 0.00 0.00 35.95 39.32 1je1 h PHE 160 CO 0.47 0.13 0.22 0.66 -2.23 0.00 0.00 178.31 177.56 1je1 n TYR 161 N -4.87 1.39 -0.93 0.41 4.02 -1.26 -3.50 117.16 112.41 1je1 n TYR 161 Ca 0.22 -0.91 0.04 0.00 -0.01 0.00 0.00 57.90 57.24 1je1 n TYR 161 Cb 0.59 -0.51 0.05 0.00 -0.02 0.00 0.00 39.34 39.46 1je1 n TYR 161 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1je1 n ALA 162 N -0.12 1.93 -2.95 -0.72 0.00 -0.83 -4.94 120.51 112.89 1je1 n ALA 162 Ca 0.25 -1.50 -0.44 0.00 0.00 0.00 0.00 53.44 51.76 1je1 n ALA 162 Cb 0.97 -0.23 0.00 0.00 0.00 0.00 0.00 19.45 20.20 1je1 n ALA 162 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1je1 n GLU 163 N -0.65 3.87 -0.16 0.00 1.02 -1.23 -4.91 120.64 118.58 1je1 n GLU 163 Ca 0.06 -4.21 0.00 0.00 -0.02 0.00 0.00 57.16 52.99 1je1 n GLU 163 Cb 0.52 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.25 1je1 n GLU 163 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1je1 n ASP 164 N 2.90 0.00 -0.11 1.62 5.68 -1.26 -4.87 116.55 120.51 1je1 n ASP 164 Ca 0.30 -0.94 -0.08 0.00 -0.50 0.00 0.00 54.79 53.57 1je1 n ASP 164 Cb 0.37 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.43 1je1 n ASP 164 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1je1 h GLU 165 N 0.00 0.83 -0.92 0.11 4.81 -1.97 -2.40 114.58 115.05 1je1 h GLU 165 Ca 0.00 -0.31 0.01 0.00 -0.13 0.00 0.00 59.36 58.92 1je1 h GLU 165 Cb 0.00 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 1je1 h GLU 165 CO 0.00 0.94 0.60 1.49 -0.73 0.00 0.00 179.01 181.31 1je1 h GLU 166 N 0.74 1.22 -0.13 1.92 4.81 -1.98 -2.50 114.58 118.66 1je1 h GLU 166 Ca 0.11 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1je1 h GLU 166 Cb 0.68 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1je1 h GLU 166 CO 0.05 0.82 -0.03 0.35 -0.73 0.00 0.00 179.01 179.47 1je1 h PHE 167 N 1.25 -0.06 -0.29 0.92 3.57 -1.80 -1.96 116.94 118.57 1je1 h PHE 167 Ca 0.34 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.85 1je1 h PHE 167 Cb -0.12 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 1je1 h PHE 167 CO 0.00 -0.05 0.18 0.28 -2.23 0.00 0.00 178.31 176.49 1je1 h VAL 168 N 0.01 1.05 -0.10 1.41 2.07 -1.03 -2.04 116.25 117.62 1je1 h VAL 168 Ca 0.06 -0.13 -0.11 0.00 0.82 0.00 0.00 66.70 67.34 1je1 h VAL 168 Cb 0.09 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1je1 h VAL 168 CO -0.13 0.07 -0.45 0.11 0.02 0.00 0.00 177.57 177.19 1je1 h LYS 169 N 0.37 0.24 0.08 1.57 1.57 -1.47 -1.87 116.57 117.06 1je1 h LYS 169 Ca 0.11 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1je1 h LYS 169 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1je1 h LYS 169 CO -0.04 0.64 -0.04 -0.22 -0.57 0.00 0.00 179.45 179.23 1je1 h LYS 170 N 0.19 -0.10 -0.03 3.15 3.64 -1.03 -1.63 116.57 120.76 1je1 h LYS 170 Ca 0.01 0.01 -0.20 0.00 -1.27 0.00 0.00 60.65 59.21 1je1 h LYS 170 Cb 0.87 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1je1 h LYS 170 CO 0.07 0.04 -0.82 -1.49 -2.27 0.00 0.00 179.45 174.97 1je1 h TRP 171 N -0.23 0.44 -0.11 1.91 4.06 -1.39 -3.02 115.95 117.63 1je1 h TRP 171 Ca -0.01 -0.22 -0.08 0.00 2.06 0.00 0.00 58.89 60.63 1je1 h TRP 171 Cb 0.19 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 28.28 1je1 h TRP 171 CO -0.03 1.00 -0.31 0.66 -3.56 0.00 0.00 178.44 176.20 1je1 h SER 172 N 0.19 0.21 0.71 -3.49 4.64 -1.35 -1.60 113.55 112.87 1je1 h SER 172 Ca -0.05 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1je1 h SER 172 Cb 1.42 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1je1 h SER 172 CO 0.13 0.52 0.00 -1.54 -0.87 0.00 0.00 176.83 175.08 1je1 n SER 173 N -4.11 0.00 -1.60 4.97 3.41 -0.61 -2.52 113.62 113.15 1je1 n SER 173 Ca -0.01 0.49 0.08 0.00 -0.26 0.00 0.00 58.87 59.17 1je1 n SER 173 Cb 0.40 -0.50 0.36 0.00 -0.26 0.00 0.00 64.21 64.21 1je1 n SER 173 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1je1 n ARG 174 N -1.50 4.12 -1.00 4.33 1.74 -0.63 -4.94 116.66 118.78 1je1 n ARG 174 Ca 0.05 -2.98 0.00 0.00 -0.77 0.00 0.00 57.85 54.15 1je1 n ARG 174 Cb 0.24 -2.03 0.00 0.00 -1.02 0.00 0.00 32.46 29.65 1je1 n ARG 174 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1je1 n GLY 175 N 0.66 0.41 3.73 -0.13 0.00 -1.05 -5.05 105.19 103.77 1je1 n GLY 175 Ca 0.26 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 1je1 n GLY 175 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1je1 s ASN 176 N -2.75 5.77 0.00 1.61 0.01 -1.02 -4.15 114.94 114.41 1je1 s ASN 176 Ca 0.00 0.23 0.18 0.00 -0.71 0.00 0.00 52.86 52.56 1je1 s ASN 176 Cb 0.00 -1.86 0.15 0.00 0.41 0.00 0.00 41.25 39.95 1je1 s ASN 176 CO 0.00 0.31 1.08 2.30 -1.51 0.00 0.00 177.10 179.28 1je1 n ILE 177 N 2.64 0.01 -3.70 0.60 -5.35 -0.19 -4.07 119.36 109.30 1je1 n ILE 177 Ca -0.18 -0.50 -0.06 0.00 -0.27 0.00 0.00 62.75 61.73 1je1 n ILE 177 Cb 0.53 1.37 -0.02 0.00 -1.74 0.00 0.00 39.64 39.79 1je1 n ILE 177 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1je1 s ALA 178 N -1.52 -1.59 -0.03 -1.28 0.00 -1.25 -0.93 121.76 115.15 1je1 s ALA 178 Ca 0.21 0.24 0.03 0.00 0.00 0.00 0.00 51.96 52.44 1je1 s ALA 178 Cb 0.15 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.94 1je1 s ALA 178 CO 0.23 -0.95 -0.12 0.54 0.00 0.00 0.00 175.76 175.46 1je1 s VAL 179 N -3.43 1.01 0.00 0.00 0.11 0.03 -1.64 120.40 116.47 1je1 s VAL 179 Ca 0.10 -0.49 0.00 0.00 -2.93 0.00 0.00 61.98 58.66 1je1 s VAL 179 Cb -0.02 -0.88 0.00 0.00 -1.53 0.00 0.00 36.38 33.95 1je1 s VAL 179 CO -0.00 0.30 0.00 -1.84 -3.33 0.00 0.00 175.10 170.23 1je1 n GLU 180 N 3.21 0.00 0.00 1.54 -0.00 -0.76 -2.11 120.64 122.52 1je1 n GLU 180 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.98 1je1 n GLU 180 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.98 1je1 n GLU 180 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1je1 n MET 181 N 0.00 0.38 0.00 3.44 2.81 -1.26 -0.37 117.12 122.11 1je1 n MET 181 Ca 0.00 -0.18 0.00 0.00 -1.81 0.00 0.00 57.70 55.71 1je1 n MET 181 Cb 0.00 -0.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.90 1je1 n MET 181 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1je1 n GLU 182 N -0.10 3.69 -0.15 0.03 4.71 -1.26 -3.73 120.64 123.82 1je1 n GLU 182 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.16 57.09 1je1 n GLU 182 Cb 0.10 -0.70 0.03 0.00 -1.01 0.00 0.00 31.44 29.87 1je1 n GLU 182 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1je1 h ALA 184 N 1.21 1.17 -0.29 0.00 0.00 -1.88 0.53 119.26 120.00 1je1 h ALA 184 Ca 0.19 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1je1 h ALA 184 Cb 0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1je1 h ALA 184 CO -0.10 0.17 -0.05 1.15 0.00 0.00 0.00 179.25 180.43 1je1 h THR 185 N 0.86 1.28 0.11 0.00 2.02 -1.83 -2.05 112.91 113.31 1je1 h THR 185 Ca 0.38 -1.06 -0.00 0.00 0.77 0.00 0.00 66.41 66.50 1je1 h THR 185 Cb 0.28 1.37 -0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1je1 h THR 185 CO -0.21 0.34 -0.07 0.25 0.37 0.00 0.00 175.52 176.20 1je1 h LEU 186 N 0.33 -0.16 0.04 2.58 5.85 -0.63 -1.79 115.31 121.52 1je1 h LEU 186 Ca 0.08 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1je1 h LEU 186 Cb 0.52 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1je1 h LEU 186 CO 0.03 -0.11 -0.02 -0.26 -0.34 0.00 0.00 178.44 177.74 1je1 h PHE 187 N -0.17 -0.05 -0.17 1.25 0.05 -0.93 -1.70 116.94 115.21 1je1 h PHE 187 Ca -0.01 -0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.77 1je1 h PHE 187 Cb 0.14 0.02 -0.01 0.00 2.00 0.00 0.00 35.95 38.10 1je1 h PHE 187 CO -0.08 0.13 0.08 1.15 -0.18 0.00 0.00 178.31 179.41 1je1 h THR 188 N -0.22 1.14 -0.47 -1.55 2.02 -1.40 -1.22 112.91 111.21 1je1 h THR 188 Ca -0.01 -0.40 -0.03 0.00 0.77 0.00 0.00 66.41 66.75 1je1 h THR 188 Cb 0.20 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1je1 h THR 188 CO 0.01 0.13 0.17 0.25 0.37 0.00 0.00 175.52 176.45 1je1 h LEU 189 N 0.14 0.62 -0.75 2.58 5.85 -1.36 -1.84 115.31 120.54 1je1 h LEU 189 Ca 0.06 -0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.60 1je1 h LEU 189 Cb 0.13 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1je1 h LEU 189 CO -0.01 0.57 -0.11 0.28 -0.34 0.00 0.00 178.44 178.84 1je1 h SER 190 N 0.67 0.82 -0.49 1.25 0.02 -1.03 0.19 113.55 115.00 1je1 h SER 190 Ca 0.16 -0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 1je1 h SER 190 Cb 0.16 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 1je1 h SER 190 CO -0.01 0.95 0.13 0.11 -1.14 0.00 0.00 176.83 176.87 1je1 h LYS 191 N 0.75 0.77 -0.16 3.45 6.56 -0.59 0.14 116.57 127.48 1je1 h LYS 191 Ca 0.12 -0.17 -0.05 0.00 -1.06 0.00 0.00 60.65 59.49 1je1 h LYS 191 Cb 0.61 -0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 32.16 1je1 h LYS 191 CO 0.04 0.73 -0.10 0.28 -2.06 0.00 0.00 179.45 178.34 1je1 h VAL 192 N 0.66 1.32 -0.00 0.50 2.07 -1.12 -3.26 116.25 116.42 1je1 h VAL 192 Ca 0.15 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.49 1je1 h VAL 192 Cb 0.30 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1je1 h VAL 192 CO -0.00 0.35 -0.13 0.29 0.02 0.00 0.00 177.57 178.10 1je1 n LYS 193 N -4.59 0.24 -2.21 1.57 4.76 0.66 -4.95 118.16 113.64 1je1 n LYS 193 Ca -0.06 -0.06 -0.03 0.00 -2.87 0.00 0.00 58.31 55.30 1je1 n LYS 193 Cb 0.32 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 1je1 n LYS 193 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1je1 n GLY 194 N 1.41 0.39 3.95 0.72 0.00 0.31 -5.04 105.19 106.94 1je1 n GLY 194 Ca 0.10 -0.72 -0.25 0.00 0.00 0.00 0.00 46.02 45.15 1je1 n GLY 194 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1je1 s TRP 195 N -2.37 3.48 -0.33 1.61 0.51 -0.16 -5.04 118.94 116.64 1je1 s TRP 195 Ca 0.02 0.10 -0.12 0.00 -2.12 0.00 0.00 56.10 53.98 1je1 s TRP 195 Cb -0.01 -1.65 -0.01 0.00 -0.81 0.00 0.00 33.47 30.99 1je1 s TRP 195 CO 0.02 0.49 0.21 0.15 -0.51 0.00 0.00 176.95 177.31 1je1 s LYS 196 N -3.44 3.42 0.15 4.98 1.02 -0.46 -4.55 119.74 120.86 1je1 s LYS 196 Ca 0.35 -0.68 0.05 0.00 0.02 0.00 0.00 55.97 55.70 1je1 s LYS 196 Cb -0.10 -3.71 -0.04 0.00 -0.52 0.00 0.00 37.83 33.45 1je1 s LYS 196 CO 0.29 -0.44 -0.11 -1.12 -0.92 0.00 0.00 175.35 173.05 1je1 s SER 197 N 1.68 1.93 0.33 2.83 0.01 -1.26 -0.88 113.70 118.34 1je1 s SER 197 Ca 0.05 -0.99 -0.14 0.00 1.31 0.00 0.00 55.95 56.18 1je1 s SER 197 Cb -0.17 -0.04 0.03 0.00 0.21 0.00 0.00 66.02 66.05 1je1 s SER 197 CO 0.09 -0.29 0.67 0.00 0.41 0.00 0.00 173.24 174.12 1je1 s ALA 198 N -3.16 -0.48 -0.19 1.44 0.00 -0.77 -0.30 121.76 118.30 1je1 s ALA 198 Ca 0.17 -0.82 -0.17 0.00 0.00 0.00 0.00 51.96 51.14 1je1 s ALA 198 Cb 0.01 0.87 0.05 0.00 0.00 0.00 0.00 23.12 24.05 1je1 s ALA 198 CO 0.02 -0.94 0.51 0.99 0.00 0.00 0.00 175.76 176.34 1je1 s THR 199 N -3.08 -0.00 -0.02 0.00 2.01 -1.26 -1.41 115.64 111.87 1je1 s THR 199 Ca 0.18 0.00 0.04 0.00 0.31 0.00 0.00 61.69 62.22 1je1 s THR 199 Cb -0.04 -0.72 -0.00 0.00 0.01 0.00 0.00 72.50 71.75 1je1 s THR 199 CO 0.12 0.00 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.23 1je1 s VAL 200 N 0.35 1.07 0.03 3.82 1.01 -0.52 -1.94 120.40 124.22 1je1 s VAL 200 Ca -0.01 -0.54 0.08 0.00 0.00 0.00 0.00 61.98 61.50 1je1 s VAL 200 Cb -0.04 -0.92 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 1je1 s VAL 200 CO -0.00 0.31 -0.22 -0.76 0.00 0.00 0.00 175.10 174.43 1je1 s LEU 201 N -0.05 2.14 -0.24 3.92 1.43 0.03 -2.24 118.68 123.67 1je1 s LEU 201 Ca 0.00 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.47 1je1 s LEU 201 Cb -0.08 -1.05 -0.05 0.00 0.03 0.00 0.00 46.19 45.04 1je1 s LEU 201 CO 0.00 0.20 0.22 -0.69 0.23 0.00 0.00 176.35 176.32 1je1 s VAL 202 N -0.75 5.31 -0.35 -1.59 1.01 0.94 -1.21 120.40 123.76 1je1 s VAL 202 Ca 0.08 0.31 -0.29 0.00 0.00 0.00 0.00 61.98 62.09 1je1 s VAL 202 Cb -0.09 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1je1 s VAL 202 CO 0.01 0.31 1.36 -0.69 0.00 0.00 0.00 175.10 176.09 1je1 s VAL 203 N 1.23 4.01 -1.19 2.92 1.01 -0.61 -1.12 120.40 126.65 1je1 s VAL 203 Ca 0.10 1.09 0.15 0.00 0.00 0.00 0.00 61.98 63.33 1je1 s VAL 203 Cb -0.14 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 1je1 s VAL 203 CO 0.06 -0.61 0.77 -1.54 0.00 0.00 0.00 175.10 173.78 1je1 n SER 204 N 8.22 1.32 -3.45 3.32 3.41 -0.67 -0.68 113.62 125.09 1je1 n SER 204 Ca 0.16 -1.16 -0.13 0.00 -0.26 0.00 0.00 58.87 57.48 1je1 n SER 204 Cb 0.47 0.62 -0.03 0.00 -0.26 0.00 0.00 64.21 65.01 1je1 n SER 204 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1je1 s ASP 205 N -1.98 -0.57 -0.21 4.04 3.68 -1.22 -4.94 116.67 115.47 1je1 s ASP 205 Ca 0.11 0.14 -0.01 0.00 2.13 0.00 0.00 52.55 54.92 1je1 s ASP 205 Cb 0.12 0.57 0.06 0.00 -1.45 0.00 0.00 42.92 42.21 1je1 s ASP 205 CO 0.44 -0.87 -0.03 0.21 0.13 0.00 0.00 175.17 175.06 1je1 s ASN 206 N -2.42 3.32 0.35 -0.34 3.84 -1.26 -0.58 114.94 117.85 1je1 s ASN 206 Ca -0.01 -0.94 0.26 0.00 0.21 0.00 0.00 52.86 52.38 1je1 s ASN 206 Cb -0.01 -0.94 0.87 0.00 -0.55 0.00 0.00 41.25 40.62 1je1 s ASN 206 CO -0.08 -0.24 1.77 -0.07 -2.79 0.00 0.00 177.10 175.68 1je1 h LEU 207 N 8.08 0.00 0.00 3.21 4.07 -1.20 -3.19 115.31 126.28 1je1 h LEU 207 Ca -0.19 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.54 1je1 h LEU 207 Cb 1.10 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.80 1je1 h LEU 207 CO 0.39 0.00 -1.69 0.00 -1.08 0.00 0.00 178.44 176.05 1je1 n ALA 208 N -1.92 1.78 -3.00 1.53 0.00 -1.25 -5.03 120.51 112.62 1je1 n ALA 208 Ca 0.03 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.74 1je1 n ALA 208 Cb 0.38 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1je1 n ALA 208 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1je1 n LYS 209 N -2.88 3.34 0.00 0.00 4.81 -1.21 -4.82 118.16 117.40 1je1 n LYS 209 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.29 1je1 n LYS 209 Cb 0.94 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.99 1je1 n LYS 209 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 1je1 n ILE 212 N 0.00 -0.27 -4.05 3.15 -5.35 -1.26 -4.60 119.36 106.97 1je1 n ILE 212 Ca 0.00 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.37 1je1 n ILE 212 Cb 0.00 0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 37.79 1je1 n ILE 212 CO 0.00 0.00 0.00 0.26 -1.76 0.00 0.00 176.55 175.05 1je1 s TRP 213 N -1.82 0.55 -0.10 4.28 0.51 -1.26 -4.97 118.94 116.13 1je1 s TRP 213 Ca 0.00 -0.60 0.02 0.00 -2.12 0.00 0.00 56.10 53.40 1je1 s TRP 213 Cb 0.00 -0.35 0.01 0.00 -0.81 0.00 0.00 33.47 32.33 1je1 s TRP 213 CO 0.00 -0.15 -0.16 -1.50 -0.51 0.00 0.00 176.95 174.63 1je1 s ILE 214 N -1.85 1.54 0.00 2.03 1.10 -1.26 -5.03 121.20 117.73 1je1 s ILE 214 Ca -0.08 -0.68 0.00 0.00 -0.51 0.00 0.00 60.65 59.38 1je1 s ILE 214 Cb -0.07 -1.39 0.00 0.00 0.15 0.00 0.00 42.46 41.15 1je1 s ILE 214 CO -0.01 0.45 0.00 0.41 -2.11 0.00 0.00 174.94 173.67 1je1 n THR 215 N 4.05 0.00 0.00 4.00 -1.04 -1.26 -4.95 114.28 115.09 1je1 n THR 215 Ca -0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 1je1 n THR 215 Cb 0.52 -0.79 0.00 0.00 -1.82 0.00 0.00 70.33 68.23 1je1 n THR 215 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1je1 n LYS 216 N 0.00 0.00 0.08 -2.82 2.85 -1.26 -4.86 118.16 112.15 1je1 n LYS 216 Ca 0.00 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.16 1je1 n LYS 216 Cb 0.00 0.00 -0.11 0.00 -0.65 0.00 0.00 35.03 34.27 1je1 n LYS 216 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1je1 h GLU 217 N 0.00 0.11 0.00 -1.58 4.81 -1.98 0.16 114.58 116.10 1je1 h GLU 217 Ca 0.00 -0.18 -0.20 0.00 -0.13 0.00 0.00 59.36 58.85 1je1 h GLU 217 Cb 0.00 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1je1 h GLU 217 CO 0.00 1.07 -0.93 0.93 -0.73 0.00 0.00 179.01 179.35 1je1 h GLU 218 N 0.04 0.00 -0.01 1.92 5.08 -1.96 -2.75 114.58 116.89 1je1 h GLU 218 Ca -0.06 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.08 1je1 h GLU 218 Cb 1.81 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.08 1je1 h GLU 218 CO 0.16 0.93 -0.88 1.25 -1.00 0.00 0.00 179.01 179.47 1je1 h LEU 219 N 0.00 0.80 -0.95 1.33 6.46 -1.86 -2.18 115.31 118.90 1je1 h LEU 219 Ca -0.01 -0.73 -0.07 0.00 -0.12 0.00 0.00 57.88 56.95 1je1 h LEU 219 Cb 1.68 -0.24 -0.02 0.00 -0.73 0.00 0.00 40.66 41.35 1je1 h LEU 219 CO 0.12 1.42 0.01 -0.33 -0.62 0.00 0.00 178.44 179.04 1je1 h GLU 220 N 0.25 0.77 -0.49 1.25 5.08 -0.74 -0.76 114.58 119.94 1je1 h GLU 220 Ca -0.11 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 57.99 1je1 h GLU 220 Cb 1.55 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.68 1je1 h GLU 220 CO 0.17 0.77 0.07 -0.22 -1.00 0.00 0.00 179.01 178.80 1je1 h LYS 221 N 0.72 0.82 -0.33 2.33 3.64 -1.48 -0.43 116.57 121.83 1je1 h LYS 221 Ca 0.14 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1je1 h LYS 221 Cb 0.43 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 1je1 h LYS 221 CO 0.02 0.82 0.22 1.03 -2.27 0.00 0.00 179.45 179.27 1je1 h SER 222 N 0.69 0.38 -0.26 4.20 0.87 -0.91 0.37 113.55 118.89 1je1 h SER 222 Ca 0.15 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 1je1 h SER 222 Cb 0.41 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.26 1je1 h SER 222 CO 0.01 0.27 0.17 0.58 -0.53 0.00 0.00 176.83 177.34 1je1 h VAL 223 N 0.44 1.07 -0.28 2.23 2.07 -0.93 -1.68 116.25 119.17 1je1 h VAL 223 Ca 0.12 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1je1 h VAL 223 Cb -0.05 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1je1 h VAL 223 CO -0.03 0.07 0.15 0.24 0.02 0.00 0.00 177.57 178.02 1je1 h MET 224 N 0.35 0.39 -0.67 1.57 2.07 -0.77 -1.25 114.93 116.61 1je1 h MET 224 Ca 0.09 -0.05 -0.01 0.00 -2.07 0.00 0.00 59.70 57.67 1je1 h MET 224 Cb -0.04 -0.08 -0.03 0.00 -1.87 0.00 0.00 31.60 29.59 1je1 h MET 224 CO -0.02 0.35 0.39 -0.44 1.07 0.00 0.00 176.91 178.27 1je1 h ASP 225 N 0.33 0.82 -0.21 1.22 3.32 -0.79 -2.58 116.42 118.53 1je1 h ASP 225 Ca 0.10 -0.07 -0.09 0.00 0.02 0.00 0.00 57.03 56.99 1je1 h ASP 225 Cb 0.08 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1je1 h ASP 225 CO -0.02 0.65 -0.15 1.23 -1.72 0.00 0.00 179.24 179.23 1je1 h GLY 226 N 0.92 0.68 1.08 2.75 0.00 -1.16 -2.96 103.07 104.37 1je1 h GLY 226 Ca 0.24 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 1je1 h GLY 226 CO -0.04 0.47 0.40 0.00 0.00 0.00 0.00 176.54 177.37 1je1 h ALA 227 N 1.27 1.14 -0.77 3.60 0.00 -0.86 -1.12 119.26 122.52 1je1 h ALA 227 Ca 0.10 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1je1 h ALA 227 Cb 0.59 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1je1 h ALA 227 CO 0.04 0.65 0.26 0.87 0.00 0.00 0.00 179.25 181.07 1je1 h LYS 228 N 1.18 1.18 -0.45 0.00 1.57 -1.31 -0.07 116.57 118.66 1je1 h LYS 228 Ca 0.29 -0.24 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 1je1 h LYS 228 Cb 0.11 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1je1 h LYS 228 CO -0.04 0.99 -0.06 0.00 -0.57 0.00 0.00 179.45 179.77 1je1 h ALA 229 N 1.14 1.04 -0.25 3.86 0.00 -1.31 -0.97 119.26 122.78 1je1 h ALA 229 Ca 0.25 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1je1 h ALA 229 Cb 0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1je1 h ALA 229 CO -0.01 0.59 -0.06 0.28 0.00 0.00 0.00 179.25 180.05 1je1 h VAL 230 N 0.72 1.28 -0.37 0.00 2.07 -0.64 -2.25 116.25 117.06 1je1 h VAL 230 Ca 0.13 -1.05 -0.04 0.00 0.82 0.00 0.00 66.70 66.55 1je1 h VAL 230 Cb 0.53 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 1je1 h VAL 230 CO 0.03 0.33 0.04 -0.07 0.02 0.00 0.00 177.57 177.92 1je1 h LEU 231 N 0.22 0.52 -0.54 2.57 3.38 -0.87 0.15 115.31 120.73 1je1 h LEU 231 Ca 0.06 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1je1 h LEU 231 Cb 0.52 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1je1 h LEU 231 CO 0.02 0.56 0.30 0.44 0.09 0.00 0.00 178.44 179.86 1je1 h ASP 232 N 0.54 0.67 -0.28 -0.43 3.32 -1.00 -2.19 116.42 117.06 1je1 h ASP 232 Ca 0.12 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1je1 h ASP 232 Cb 0.28 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1je1 h ASP 232 CO 0.00 0.56 0.02 0.74 -1.72 0.00 0.00 179.24 178.84 1je1 h THR 233 N 0.73 1.25 -0.18 0.35 2.02 -0.76 -2.69 112.91 113.62 1je1 h THR 233 Ca 0.19 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.50 1je1 h THR 233 Cb 0.03 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1je1 h THR 233 CO -0.03 0.28 0.10 -0.07 0.37 0.00 0.00 175.52 176.17 1je1 h LEU 234 N 0.28 0.21 -2.82 2.58 3.38 -0.83 -2.61 115.31 115.50 1je1 h LEU 234 Ca 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1je1 h LEU 234 Cb 0.39 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1je1 h LEU 234 CO 0.01 0.17 0.00 0.35 0.09 0.00 0.00 178.44 179.07 1je1 n THR 235 N -4.49 1.15 1.73 0.22 -2.24 -0.84 -4.98 114.28 104.83 1je1 n THR 235 Ca -0.00 -1.04 0.14 0.00 -2.27 0.00 0.00 64.05 60.88 1je1 n THR 235 Cb 0.09 0.43 0.82 0.00 -2.10 0.00 0.00 70.33 69.58 1je1 n THR 235 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96