#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j03 n LYS 2 N 0.00 0.00 -0.18 0.03 5.02 -1.26 -4.51 118.16 117.25 2j03 n LYS 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2j03 n LYS 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2j03 n LYS 2 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2j03 n GLY 3 N 0.63 0.97 0.00 0.72 0.00 -1.26 -4.33 105.19 101.92 2j03 n GLY 3 Ca 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.10 2j03 n GLY 3 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2j03 n ILE 4 N -0.37 0.00 -1.33 -0.61 0.13 -1.24 -4.88 119.36 111.06 2j03 n ILE 4 Ca 0.00 0.00 -0.29 0.00 -1.10 0.00 0.00 62.75 61.36 2j03 n ILE 4 Cb 0.00 0.00 0.14 0.00 -0.84 0.00 0.00 39.64 38.94 2j03 n ILE 4 CO 0.00 0.00 0.00 -0.76 2.80 0.00 0.00 176.55 178.59 2j03 s LEU 5 N 0.00 2.11 0.00 9.51 1.43 -1.26 -2.41 118.68 128.06 2j03 s LEU 5 Ca 0.00 1.28 -0.18 0.00 -1.03 0.00 0.00 54.13 54.20 2j03 s LEU 5 Cb 0.00 -3.66 0.06 0.00 0.03 0.00 0.00 46.19 42.62 2j03 s LEU 5 CO 0.00 -2.61 0.81 0.61 0.23 0.00 0.00 176.35 175.38 2j03 n GLY 6 N -1.51 0.48 2.82 -3.19 0.00 0.92 -4.03 105.19 100.68 2j03 n GLY 6 Ca 0.06 -1.00 -0.14 0.00 0.00 0.00 0.00 46.02 44.94 2j03 n GLY 6 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2j03 s VAL 7 N -2.11 -0.04 0.50 1.61 -7.23 -0.94 -0.67 120.40 111.52 2j03 s VAL 7 Ca 0.19 0.13 -0.23 0.00 -1.81 0.00 0.00 61.98 60.26 2j03 s VAL 7 Cb -0.01 -0.06 -0.06 0.00 0.56 0.00 0.00 36.38 36.81 2j03 s VAL 7 CO 0.01 0.05 1.34 -0.75 -0.31 0.00 0.00 175.10 175.44 2j03 s LYS 8 N 0.66 3.44 0.00 4.82 2.20 -0.70 -0.75 119.74 129.41 2j03 s LYS 8 Ca -0.05 2.21 0.00 0.00 -0.36 0.00 0.00 55.97 57.76 2j03 s LYS 8 Cb -0.08 -2.43 0.00 0.00 -1.51 0.00 0.00 37.83 33.81 2j03 s LYS 8 CO -0.02 -0.94 0.00 1.33 -0.36 0.00 0.00 175.35 175.36 2j03 n VAL 9 N -0.63 0.00 -0.34 4.02 0.24 -0.64 0.66 118.33 121.63 2j03 n VAL 9 Ca 0.08 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.22 2j03 n VAL 9 Cb 0.44 0.98 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 2j03 n VAL 9 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2j03 n GLY 10 N 0.33 0.84 3.62 7.63 0.00 -1.24 -4.79 105.19 111.57 2j03 n GLY 10 Ca 0.00 -1.80 -0.06 0.00 0.00 0.00 0.00 46.02 44.16 2j03 n GLY 10 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2j03 s MET 11 N -2.00 0.30 0.00 1.61 0.23 -1.26 -0.52 119.30 117.65 2j03 s MET 11 Ca 0.00 0.10 0.00 0.00 -1.03 0.00 0.00 55.69 54.76 2j03 s MET 11 Cb 0.00 0.14 0.00 0.00 -1.53 0.00 0.00 34.83 33.44 2j03 s MET 11 CO 0.00 -0.09 0.00 0.25 -2.03 0.00 0.00 175.02 173.15 2j03 n THR 12 N 0.78 0.00 -4.19 3.16 -2.24 0.32 -4.95 114.28 107.15 2j03 n THR 12 Ca -0.06 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.60 2j03 n THR 12 Cb 0.58 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.71 2j03 n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j03 s ARG 13 N 1.02 0.88 0.14 -0.78 1.70 -1.26 -0.04 118.95 120.62 2j03 s ARG 13 Ca 0.00 -1.31 0.02 0.00 -0.47 0.00 0.00 55.73 53.97 2j03 s ARG 13 Cb 0.00 -0.37 -0.01 0.00 -0.57 0.00 0.00 34.95 34.00 2j03 s ARG 13 CO 0.00 0.03 0.07 0.44 -1.08 0.00 0.00 175.30 174.76 2j03 n ILE 14 N 0.08 0.00 -4.48 4.99 -5.35 -0.89 -4.92 119.36 108.79 2j03 n ILE 14 Ca -0.13 -0.88 -0.23 0.00 -0.27 0.00 0.00 62.75 61.25 2j03 n ILE 14 Cb 0.60 0.36 -0.11 0.00 -1.74 0.00 0.00 39.64 38.75 2j03 n ILE 14 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2j03 s PHE 15 N -2.23 2.08 -0.26 4.28 0.08 -1.26 -0.17 117.98 120.49 2j03 s PHE 15 Ca 0.10 -0.83 -0.07 0.00 0.12 0.00 0.00 56.93 56.24 2j03 s PHE 15 Cb 0.00 -1.35 0.13 0.00 -0.57 0.00 0.00 43.02 41.23 2j03 s PHE 15 CO 0.07 0.17 0.55 1.03 -0.10 0.00 0.00 175.22 176.93 2j03 s ARG 16 N -3.81 0.48 0.00 0.44 0.52 -0.98 -4.94 118.95 110.66 2j03 s ARG 16 Ca 0.35 1.17 0.00 0.00 -0.52 0.00 0.00 55.73 56.73 2j03 s ARG 16 Cb 0.08 0.54 0.00 0.00 0.52 0.00 0.00 34.95 36.09 2j03 s ARG 16 CO 0.15 -0.32 0.00 -3.47 0.02 0.00 0.00 175.30 171.68 2j03 n ASP 17 N 5.42 0.00 -0.58 0.23 4.64 -1.26 -1.44 116.55 123.56 2j03 n ASP 17 Ca -0.08 0.00 -0.02 0.00 -1.38 0.00 0.00 54.79 53.30 2j03 n ASP 17 Cb 0.50 0.00 -0.02 0.00 -1.04 0.00 0.00 41.12 40.55 2j03 n ASP 17 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 2j03 n ASP 18 N 1.63 -0.31 -4.12 1.67 8.00 -1.26 -5.13 116.55 117.03 2j03 n ASP 18 Ca 0.00 -1.05 -0.26 0.00 0.71 0.00 0.00 54.79 54.19 2j03 n ASP 18 Cb 0.00 0.09 -0.16 0.00 -0.02 0.00 0.00 41.12 41.03 2j03 n ASP 18 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j03 s ARG 19 N 0.00 1.83 0.26 -1.24 1.70 -0.52 -5.13 118.95 115.85 2j03 s ARG 19 Ca 0.00 -0.59 -0.30 0.00 -0.47 0.00 0.00 55.73 54.38 2j03 s ARG 19 Cb 0.00 -1.56 -0.09 0.00 -0.57 0.00 0.00 34.95 32.73 2j03 s ARG 19 CO 0.00 0.20 1.12 0.00 -1.08 0.00 0.00 175.30 175.54 2j03 s ALA 20 N 0.16 3.41 -0.04 7.88 0.00 -1.26 -2.32 121.76 129.60 2j03 s ALA 20 Ca -0.07 0.92 0.06 0.00 0.00 0.00 0.00 51.96 52.87 2j03 s ALA 20 Cb -0.13 -3.35 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 2j03 s ALA 20 CO 0.03 -0.21 -0.23 0.14 0.00 0.00 0.00 175.76 175.49 2j03 s VAL 21 N -0.94 1.85 -0.42 0.00 -7.23 0.76 -4.96 120.40 109.45 2j03 s VAL 21 Ca 0.46 -0.97 -0.26 0.00 -1.81 0.00 0.00 61.98 59.40 2j03 s VAL 21 Cb -0.32 -1.56 0.02 0.00 0.56 0.00 0.00 36.38 35.08 2j03 s VAL 21 CO 0.41 0.52 0.96 -2.16 -0.31 0.00 0.00 175.10 174.52 2j03 s PRO 22 N -0.23 3.69 -0.07 4.82 0.04 -1.26 -2.09 135.00 139.90 2j03 s PRO 22 Ca 0.00 0.40 0.04 0.00 0.04 0.00 0.00 61.00 61.49 2j03 s PRO 22 Cb -0.12 -3.87 -0.00 0.00 0.04 0.00 0.00 34.50 30.55 2j03 s PRO 22 CO 0.02 -1.13 -0.22 0.14 0.04 0.00 0.00 177.00 175.85 2j03 s VAL 23 N 3.75 1.82 -0.21 -0.36 -7.23 0.94 -2.88 120.40 116.23 2j03 s VAL 23 Ca 0.39 -0.91 -0.09 0.00 -1.81 0.00 0.00 61.98 59.56 2j03 s VAL 23 Cb -0.10 -1.57 -0.05 0.00 0.56 0.00 0.00 36.38 35.22 2j03 s VAL 23 CO 0.24 0.51 0.12 0.28 -0.31 0.00 0.00 175.10 175.94 2j03 s THR 24 N 0.19 5.17 -0.78 5.32 -1.32 -1.15 -0.53 115.64 122.54 2j03 s THR 24 Ca -0.11 0.11 -0.22 0.00 -1.21 0.00 0.00 61.69 60.25 2j03 s THR 24 Cb -0.15 -3.38 0.08 0.00 -1.51 0.00 0.00 72.50 67.54 2j03 s THR 24 CO 0.06 0.40 1.11 -0.69 -2.21 0.00 0.00 174.62 173.28 2j03 s VAL 25 N 0.72 4.31 0.50 5.08 1.01 0.32 -2.53 120.40 129.80 2j03 s VAL 25 Ca 0.06 -0.64 -0.09 0.00 0.00 0.00 0.00 61.98 61.31 2j03 s VAL 25 Cb -0.13 -4.78 -0.05 0.00 0.00 0.00 0.00 36.38 31.42 2j03 s VAL 25 CO 0.02 -1.58 0.86 -0.63 0.00 0.00 0.00 175.10 173.76 2j03 s ILE 26 N 4.01 4.80 -0.48 2.22 -1.09 0.24 -1.62 121.20 129.27 2j03 s ILE 26 Ca 0.29 0.56 0.03 0.00 -2.23 0.00 0.00 60.65 59.31 2j03 s ILE 26 Cb -0.11 -3.82 0.15 0.00 -1.58 0.00 0.00 42.46 37.11 2j03 s ILE 26 CO 0.03 -0.82 0.32 -0.22 -1.23 0.00 0.00 174.94 173.02 2j03 s LEU 27 N -4.55 2.66 0.44 2.97 2.96 0.07 -1.49 118.68 121.74 2j03 s LEU 27 Ca 0.51 -2.97 -0.15 0.00 -0.22 0.00 0.00 54.13 51.30 2j03 s LEU 27 Cb -0.10 -0.95 -0.08 0.00 0.50 0.00 0.00 46.19 45.56 2j03 s LEU 27 CO 0.42 -0.21 0.88 0.00 -1.32 0.00 0.00 176.35 176.13 2j03 s ALA 28 N -0.05 3.18 0.19 5.97 0.00 -1.26 -2.22 121.76 127.56 2j03 s ALA 28 Ca 0.23 0.07 0.04 0.00 0.00 0.00 0.00 51.96 52.30 2j03 s ALA 28 Cb -0.12 -2.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.00 2j03 s ALA 28 CO -0.09 -0.04 -0.05 0.20 0.00 0.00 0.00 175.76 175.78 2j03 s GLY 29 N -2.87 1.30 -0.30 0.00 0.00 -1.26 -4.50 107.32 99.69 2j03 s GLY 29 Ca 0.56 -1.62 -0.42 0.00 0.00 0.00 0.00 44.72 43.24 2j03 s GLY 29 CO 0.27 -1.62 1.60 -1.05 0.00 0.00 0.00 173.10 172.30 2j03 n PRO 30 N -0.30 0.64 -3.41 2.90 -0.02 -1.26 -4.86 135.00 128.69 2j03 n PRO 30 Ca -0.07 0.23 -0.44 0.00 -2.02 0.00 0.00 63.50 61.20 2j03 n PRO 30 Cb 0.62 -1.83 -0.03 0.00 -0.02 0.00 0.00 33.50 32.24 2j03 n PRO 30 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2j03 n PRO 32 N 3.25 0.56 -2.04 0.00 -0.02 -1.26 -2.32 135.00 133.17 2j03 n PRO 32 Ca 0.18 0.12 -0.41 0.00 -2.02 0.00 0.00 63.50 61.37 2j03 n PRO 32 Cb 0.42 -2.11 -0.02 0.00 -0.02 0.00 0.00 33.50 31.78 2j03 n PRO 32 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2j03 s VAL 33 N 7.85 2.56 -0.02 -1.45 0.11 -1.26 -2.75 120.40 125.43 2j03 s VAL 33 Ca 1.17 0.56 0.03 0.00 -2.93 0.00 0.00 61.98 60.81 2j03 s VAL 33 Cb -1.04 -3.36 0.05 0.00 -1.53 0.00 0.00 36.38 30.50 2j03 s VAL 33 CO 0.51 0.13 0.85 1.33 -3.33 0.00 0.00 175.10 174.60 2j03 n VAL 34 N 0.74 0.51 -3.64 2.04 0.24 0.92 -4.74 118.33 114.41 2j03 n VAL 34 Ca 0.00 -0.57 -0.02 0.00 -2.04 0.00 0.00 64.34 61.71 2j03 n VAL 34 Cb 0.41 0.55 -0.03 0.00 -1.47 0.00 0.00 33.84 33.30 2j03 n VAL 34 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2j03 s GLN 35 N -0.67 0.05 0.17 7.34 0.74 -1.23 -4.91 119.66 121.15 2j03 s GLN 35 Ca 0.05 -0.00 0.01 0.00 0.05 0.00 0.00 55.36 55.47 2j03 s GLN 35 Cb 0.05 0.02 -0.05 0.00 1.10 0.00 0.00 33.01 34.13 2j03 s GLN 35 CO 0.00 -0.02 0.02 1.03 -0.55 0.00 0.00 175.29 175.77 2j03 s ARG 36 N -1.50 1.10 -0.44 1.67 0.52 -1.26 -1.21 118.95 117.82 2j03 s ARG 36 Ca 0.10 -1.54 0.05 0.00 -0.52 0.00 0.00 55.73 53.83 2j03 s ARG 36 Cb -0.01 -0.19 0.17 0.00 0.52 0.00 0.00 34.95 35.45 2j03 s ARG 36 CO -0.06 -0.16 0.50 1.03 0.02 0.00 0.00 175.30 176.63 2j03 s ARG 37 N -3.94 0.90 0.61 3.54 0.52 -1.16 -4.94 118.95 114.49 2j03 s ARG 37 Ca 0.25 -1.38 -0.18 0.00 -0.52 0.00 0.00 55.73 53.90 2j03 s ARG 37 Cb 0.06 -0.71 -0.02 0.00 0.52 0.00 0.00 34.95 34.80 2j03 s ARG 37 CO 0.04 -1.32 1.19 0.99 0.02 0.00 0.00 175.30 176.22 2j03 s THR 38 N 0.73 2.72 0.50 0.02 2.01 -1.26 -1.34 115.64 119.03 2j03 s THR 38 Ca 0.27 0.42 0.25 0.00 0.31 0.00 0.00 61.69 62.94 2j03 s THR 38 Cb -0.02 -3.10 0.42 0.00 0.01 0.00 0.00 72.50 69.80 2j03 s THR 38 CO -0.10 -0.12 1.92 1.55 -0.69 0.00 0.00 174.62 177.18 2j03 h PRO 39 N 0.65 0.12 -0.36 4.92 0.13 -1.81 0.68 132.00 136.33 2j03 h PRO 39 Ca -0.50 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 64.56 2j03 h PRO 39 Cb 1.29 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.37 2j03 h PRO 39 CO 0.54 0.08 -0.07 0.93 -0.23 0.00 0.00 178.00 179.26 2j03 h GLU 40 N 0.12 0.59 0.00 0.86 5.08 -1.93 -3.24 114.58 116.07 2j03 h GLU 40 Ca 0.37 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2j03 h GLU 40 Cb 1.26 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2j03 h GLU 40 CO -0.05 0.66 0.00 1.63 -1.00 0.00 0.00 179.01 180.25 2j03 n LYS 41 N -4.22 0.00 0.02 2.33 5.02 0.23 -4.83 118.16 116.71 2j03 n LYS 41 Ca 0.01 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.21 2j03 n LYS 41 Cb 0.30 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.18 2j03 n LYS 41 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2j03 h ASP 42 N 0.00 0.07 0.00 4.39 3.45 -1.57 -3.48 116.42 119.28 2j03 h ASP 42 Ca 0.00 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.35 2j03 h ASP 42 Cb 0.00 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 38.75 2j03 h ASP 42 CO 0.00 1.09 0.00 0.61 -1.57 0.00 0.00 179.24 179.37 2j03 n GLY 43 N 1.52 2.36 0.00 2.75 0.00 -1.04 -4.99 105.19 105.79 2j03 n GLY 43 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2j03 n GLY 43 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2j03 n TYR 44 N -0.47 0.00 0.00 1.61 4.01 -1.26 -4.61 117.16 116.44 2j03 n TYR 44 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2j03 n TYR 44 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2j03 n TYR 44 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2j03 n THR 45 N -0.23 0.00 -4.10 -0.72 -1.04 -0.45 -4.60 114.28 103.15 2j03 n THR 45 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 2j03 n THR 45 Cb 0.00 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.49 2j03 n THR 45 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2j03 n ALA 46 N 0.00 0.20 -3.74 2.41 0.00 -1.22 -3.88 120.51 114.28 2j03 n ALA 46 Ca 0.00 -0.58 -0.23 0.00 0.00 0.00 0.00 53.44 52.64 2j03 n ALA 46 Cb 0.00 0.45 -0.17 0.00 0.00 0.00 0.00 19.45 19.73 2j03 n ALA 46 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2j03 s VAL 47 N -2.30 0.57 -0.80 0.00 1.01 -1.25 -2.96 120.40 114.66 2j03 s VAL 47 Ca 0.10 -0.05 -0.22 0.00 0.00 0.00 0.00 61.98 61.81 2j03 s VAL 47 Cb 0.01 -0.66 0.08 0.00 0.00 0.00 0.00 36.38 35.81 2j03 s VAL 47 CO 0.07 0.27 1.14 -1.58 0.00 0.00 0.00 175.10 175.00 2j03 s GLN 48 N 1.56 3.33 1.02 2.72 0.74 -0.35 -2.98 119.66 125.71 2j03 s GLN 48 Ca -0.00 -1.04 -0.17 0.00 0.05 0.00 0.00 55.36 54.19 2j03 s GLN 48 Cb -0.13 -4.60 0.22 0.00 1.10 0.00 0.00 33.01 29.60 2j03 s GLN 48 CO -0.04 -1.92 1.26 -0.51 -0.55 0.00 0.00 175.29 173.53 2j03 s LEU 49 N 4.10 2.14 0.06 3.68 2.01 -1.20 -0.05 118.68 129.41 2j03 s LEU 49 Ca 0.31 0.39 -0.05 0.00 0.01 0.00 0.00 54.13 54.79 2j03 s LEU 49 Cb -0.09 -2.37 -0.02 0.00 0.01 0.00 0.00 46.19 43.72 2j03 s LEU 49 CO 0.02 -3.09 0.10 -0.83 1.01 0.00 0.00 176.35 173.55 2j03 s GLY 50 N -4.59 0.24 0.00 -3.19 0.00 -1.11 -3.60 107.32 95.07 2j03 s GLY 50 Ca 0.73 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 44.65 2j03 s GLY 50 CO 0.54 -0.95 0.00 0.33 0.00 0.00 0.00 173.10 173.02 2j03 n PHE 51 N 0.18 0.00 -1.21 1.90 -0.00 -1.19 -4.04 117.46 113.09 2j03 n PHE 51 Ca -0.16 0.00 -0.57 0.00 -0.00 0.00 0.00 57.45 56.72 2j03 n PHE 51 Cb 0.61 0.00 -0.11 0.00 -0.00 0.00 0.00 39.48 39.98 2j03 n PHE 51 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 2j03 n LEU 52 N 0.00 0.73 0.00 -2.13 4.32 -1.26 -4.69 117.00 113.98 2j03 n LEU 52 Ca 0.00 0.67 0.00 0.00 -0.02 0.00 0.00 56.01 56.66 2j03 n LEU 52 Cb 0.00 -0.86 0.00 0.00 -1.62 0.00 0.00 43.42 40.94 2j03 n LEU 52 CO 0.00 -0.74 0.00 -2.65 -1.22 0.00 0.00 177.39 172.78 2j03 n PRO 53 N 6.98 0.00 -0.00 3.23 -0.02 -1.26 -2.79 135.00 141.13 2j03 n PRO 53 Ca 0.51 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2j03 n PRO 53 Cb -0.04 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 33.44 2j03 n PRO 53 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2j03 n GLN 54 N 0.00 0.00 -3.00 -0.52 10.64 -1.26 -4.23 117.38 119.01 2j03 n GLN 54 Ca 0.00 0.00 0.04 0.00 -1.83 0.00 0.00 57.00 55.21 2j03 n GLN 54 Cb 0.00 -0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2j03 n GLN 54 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 2j03 s ASN 55 N -0.00 -0.47 -0.95 2.61 0.02 -1.26 -4.57 114.94 110.32 2j03 s ASN 55 Ca 0.00 -0.07 -0.24 0.00 -1.02 0.00 0.00 52.86 51.53 2j03 s ASN 55 Cb -0.00 0.98 -0.21 0.00 0.02 0.00 0.00 41.25 42.04 2j03 s ASN 55 CO 0.00 -0.07 2.07 -2.65 0.02 0.00 0.00 177.10 176.47 2j03 n PRO 56 N 4.51 0.16 -0.66 -0.60 -0.02 -1.26 -4.12 135.00 133.01 2j03 n PRO 56 Ca 0.08 -1.39 0.00 0.00 -2.02 0.00 0.00 63.50 60.17 2j03 n PRO 56 Cb 0.60 -3.61 0.00 0.00 -0.02 0.00 0.00 33.50 30.47 2j03 n PRO 56 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2j03 n LYS 57 N 7.89 -1.02 0.00 -0.52 3.00 -1.26 -4.65 118.16 121.60 2j03 n LYS 57 Ca 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.70 2j03 n LYS 57 Cb 0.46 -3.08 0.00 0.00 0.00 0.00 0.00 35.03 32.41 2j03 n LYS 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2j03 n ARG 58 N -0.66 0.56 0.09 1.64 1.74 -1.26 -3.37 116.66 115.40 2j03 n ARG 58 Ca 0.00 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.16 2j03 n ARG 58 Cb 0.00 -1.22 -0.02 0.00 -1.02 0.00 0.00 32.46 30.20 2j03 n ARG 58 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 2j03 h VAL 59 N 0.43 0.18 0.00 1.55 3.04 -1.88 -3.50 116.25 116.07 2j03 h VAL 59 Ca 0.00 -1.36 0.00 0.00 -1.01 0.00 0.00 66.70 64.33 2j03 h VAL 59 Cb 0.55 1.72 0.00 0.00 -2.01 0.00 0.00 31.29 31.55 2j03 h VAL 59 CO 0.00 0.11 0.00 -0.46 -1.01 0.00 0.00 177.57 176.21 2j03 n ASN 60 N -2.78 0.00 -0.36 3.17 0.23 -1.22 -2.87 115.26 111.44 2j03 n ASN 60 Ca -0.03 0.00 0.03 0.00 -0.53 0.00 0.00 54.58 54.05 2j03 n ASN 60 Cb 0.65 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.53 2j03 n ASN 60 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2j03 h ARG 61 N 0.00 1.13 -3.31 -3.83 0.11 -1.96 -3.07 114.38 103.45 2j03 h ARG 61 Ca 0.00 -0.07 -0.69 0.00 0.10 0.00 0.00 59.98 59.32 2j03 h ARG 61 Cb 0.00 -0.26 -0.01 0.00 1.11 0.00 0.00 29.97 30.82 2j03 h ARG 61 CO 0.00 0.75 3.49 -0.35 0.10 0.00 0.00 179.97 183.96 2j03 n PRO 62 N -4.49 3.49 0.16 0.08 -0.04 -1.14 -4.43 135.00 128.64 2j03 n PRO 62 Ca 0.15 -2.45 0.02 0.00 -0.04 0.00 0.00 63.50 61.18 2j03 n PRO 62 Cb 0.18 -2.95 0.25 0.00 -0.04 0.00 0.00 33.50 30.94 2j03 n PRO 62 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2j03 h LEU 63 N 7.88 0.00 -2.08 1.53 6.46 -1.67 -3.46 115.31 123.97 2j03 h LEU 63 Ca 0.76 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 58.51 2j03 h LEU 63 Cb 0.41 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.33 2j03 h LEU 63 CO 1.80 0.50 -0.01 1.17 -0.62 0.00 0.00 178.44 181.28 2j03 n LYS 64 N -3.72 -1.00 -0.79 1.25 4.81 -1.26 -4.66 118.16 112.79 2j03 n LYS 64 Ca -0.01 -0.03 0.04 0.00 -0.87 0.00 0.00 58.31 57.45 2j03 n LYS 64 Cb 0.56 0.02 0.33 0.00 0.02 0.00 0.00 35.03 35.96 2j03 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2j03 n GLY 65 N -1.01 2.85 1.09 3.14 0.00 -1.26 -4.50 105.19 105.51 2j03 n GLY 65 Ca -0.00 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.22 2j03 n GLY 65 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2j03 n HIS 66 N 0.44 0.00 -3.42 1.61 1.44 -1.26 -4.30 115.22 109.73 2j03 n HIS 66 Ca 0.25 -0.42 -0.07 0.00 -2.01 0.00 0.00 57.72 55.48 2j03 n HIS 66 Cb 1.09 -0.24 -0.07 0.00 0.12 0.00 0.00 29.99 30.88 2j03 n HIS 66 CO 0.00 0.00 0.00 0.12 -2.81 0.00 0.00 176.34 173.65 2j03 s PHE 67 N 0.31 -0.94 0.11 -1.40 5.99 -1.26 -5.05 117.98 115.74 2j03 s PHE 67 Ca 0.00 1.19 -0.06 0.00 0.00 0.00 0.00 56.93 58.06 2j03 s PHE 67 Cb 0.00 0.20 0.14 0.00 0.00 0.00 0.00 43.02 43.36 2j03 s PHE 67 CO 0.00 -0.68 0.65 0.00 -0.00 0.00 0.00 175.22 175.20 2j03 n ALA 68 N 5.38 0.01 -0.51 11.12 0.00 -1.26 0.12 120.51 135.38 2j03 n ALA 68 Ca -0.05 0.44 0.40 0.00 0.00 0.00 0.00 53.44 54.23 2j03 n ALA 68 Cb 0.50 -0.23 0.62 0.00 0.00 0.00 0.00 19.45 20.34 2j03 n ALA 68 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2j03 n LYS 69 N -4.65 0.00 0.00 0.00 4.01 -1.26 -2.93 118.16 113.33 2j03 n LYS 69 Ca 0.05 0.89 0.00 0.00 -0.51 0.00 0.00 58.31 58.75 2j03 n LYS 69 Cb 0.19 -2.09 0.00 0.00 -0.51 0.00 0.00 35.03 32.61 2j03 n LYS 69 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2j03 n ALA 70 N -2.63 0.00 -2.01 7.82 0.00 0.33 -4.50 120.51 119.53 2j03 n ALA 70 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.78 2j03 n ALA 70 Cb 1.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 21.05 2j03 n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j03 n GLY 71 N -0.74 -0.37 1.85 0.00 0.00 -1.15 -1.94 105.19 102.84 2j03 n GLY 71 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2j03 n GLY 71 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2j03 n VAL 72 N -1.90 -4.45 0.00 1.61 0.31 -1.26 -4.82 118.33 107.82 2j03 n VAL 72 Ca 0.00 0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.60 2j03 n VAL 72 Cb 0.37 -4.86 0.00 0.00 -0.91 0.00 0.00 33.84 28.44 2j03 n VAL 72 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2j03 n GLU 73 N -0.36 0.00 -2.39 5.55 4.71 -0.82 -4.59 120.64 122.75 2j03 n GLU 73 Ca 0.03 0.00 -0.39 0.00 -0.01 0.00 0.00 57.16 56.79 2j03 n GLU 73 Cb 0.10 0.00 -0.03 0.00 -1.01 0.00 0.00 31.44 30.50 2j03 n GLU 73 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2j03 s PRO 74 N 0.00 3.11 0.57 3.49 0.04 -1.26 -4.69 135.00 136.27 2j03 s PRO 74 Ca 0.00 -0.34 0.32 0.00 0.04 0.00 0.00 61.00 61.02 2j03 s PRO 74 Cb 0.00 -4.67 1.08 0.00 0.04 0.00 0.00 34.50 30.95 2j03 s PRO 74 CO 0.00 -2.44 1.31 1.33 0.04 0.00 0.00 177.00 177.24 2j03 n VAL 75 N 6.88 0.00 0.16 -0.36 0.24 -1.12 -0.27 118.33 123.86 2j03 n VAL 75 Ca 0.20 1.27 0.00 0.00 -2.04 0.00 0.00 64.34 63.77 2j03 n VAL 75 Cb 0.50 -2.23 0.00 0.00 -1.47 0.00 0.00 33.84 30.64 2j03 n VAL 75 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2j03 n ARG 76 N -3.35 0.16 -0.28 7.34 3.00 -1.25 -4.82 116.66 117.46 2j03 n ARG 76 Ca 0.28 0.00 0.03 0.00 -0.00 0.00 0.00 57.85 58.16 2j03 n ARG 76 Cb 1.61 -1.28 -0.01 0.00 0.00 0.00 0.00 32.46 32.77 2j03 n ARG 76 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 2j03 n ILE 77 N 0.72 0.00 -4.39 5.15 2.08 0.62 -4.32 119.36 119.22 2j03 n ILE 77 Ca 0.00 0.01 -0.29 0.00 0.56 0.00 0.00 62.75 63.02 2j03 n ILE 77 Cb 0.06 -0.09 -0.12 0.00 -0.75 0.00 0.00 39.64 38.74 2j03 n ILE 77 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2j03 s LEU 78 N -2.17 2.46 -0.19 1.39 1.43 -1.26 -3.20 118.68 117.14 2j03 s LEU 78 Ca 0.00 -0.66 -0.10 0.00 -1.03 0.00 0.00 54.13 52.34 2j03 s LEU 78 Cb 0.00 -1.35 0.07 0.00 0.03 0.00 0.00 46.19 44.94 2j03 s LEU 78 CO 0.00 0.19 0.44 -0.13 0.23 0.00 0.00 176.35 177.08 2j03 s ARG 79 N -2.04 0.42 0.87 1.70 3.00 -1.24 -4.95 118.95 116.72 2j03 s ARG 79 Ca 0.15 0.89 -0.14 0.00 0.00 0.00 0.00 55.73 56.62 2j03 s ARG 79 Cb -0.10 0.06 0.22 0.00 0.00 0.00 0.00 34.95 35.13 2j03 s ARG 79 CO 0.07 -0.17 0.51 0.39 0.00 0.00 0.00 175.30 176.09 2j03 n GLU 80 N 4.47 -3.62 -3.01 3.54 1.02 -1.25 -3.26 120.64 118.53 2j03 n GLU 80 Ca -0.20 -0.85 -0.17 0.00 -0.02 0.00 0.00 57.16 55.92 2j03 n GLU 80 Cb 0.55 -1.12 -0.02 0.00 -0.02 0.00 0.00 31.44 30.82 2j03 n GLU 80 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2j03 n ILE 81 N -4.66 -0.44 0.00 -3.67 2.08 -1.16 -4.84 119.36 106.67 2j03 n ILE 81 Ca 0.08 -2.75 0.00 0.00 0.56 0.00 0.00 62.75 60.65 2j03 n ILE 81 Cb 0.35 -0.38 0.00 0.00 -0.75 0.00 0.00 39.64 38.86 2j03 n ILE 81 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 2j03 n ARG 82 N 1.80 0.00 -2.86 0.38 3.00 -1.26 -0.64 116.66 117.07 2j03 n ARG 82 Ca 0.17 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.79 2j03 n ARG 82 Cb 0.56 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 33.00 2j03 n ARG 82 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2j03 n ASP 83 N 0.00 3.58 -4.53 6.15 8.00 -1.25 -3.42 116.55 125.08 2j03 n ASP 83 Ca 0.00 -3.48 -0.25 0.00 0.71 0.00 0.00 54.79 51.76 2j03 n ASP 83 Cb 0.00 -0.55 -0.10 0.00 -0.02 0.00 0.00 41.12 40.46 2j03 n ASP 83 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2j03 s PHE 84 N -3.26 2.49 -0.32 1.24 5.99 0.18 -1.79 117.98 122.51 2j03 s PHE 84 Ca 0.45 -0.28 -0.04 0.00 0.00 0.00 0.00 56.93 57.06 2j03 s PHE 84 Cb 0.33 -1.16 0.26 0.00 0.00 0.00 0.00 43.02 42.45 2j03 s PHE 84 CO -0.12 0.58 1.22 -1.71 -0.00 0.00 0.00 175.22 175.19 2j03 n ASN 85 N -0.26 -1.25 -2.90 6.13 2.85 -1.26 -3.92 115.26 114.65 2j03 n ASN 85 Ca -0.09 -1.50 -0.10 0.00 -0.11 0.00 0.00 54.58 52.78 2j03 n ASN 85 Cb 0.57 0.66 0.06 0.00 1.24 0.00 0.00 39.78 42.31 2j03 n ASN 85 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2j03 n PRO 86 N 1.76 -0.04 -1.87 1.20 -0.04 -1.26 -4.92 135.00 129.84 2j03 n PRO 86 Ca 0.03 -0.97 -0.23 0.00 -0.04 0.00 0.00 63.50 62.30 2j03 n PRO 86 Cb 0.70 -0.39 -0.06 0.00 -0.04 0.00 0.00 33.50 33.71 2j03 n PRO 86 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2j03 s GLU 87 N -3.77 2.20 -0.58 0.54 -1.05 -1.26 -4.80 118.70 109.98 2j03 s GLU 87 Ca 0.28 0.06 -0.05 0.00 -0.15 0.00 0.00 54.97 55.10 2j03 s GLU 87 Cb -0.01 -4.93 -0.20 0.00 -0.44 0.00 0.00 34.13 28.55 2j03 s GLU 87 CO 0.19 -3.74 1.60 0.41 0.95 0.00 0.00 175.26 174.67 2j03 n GLY 88 N 6.78 -0.29 0.00 -3.83 0.00 -1.26 -4.52 105.19 102.07 2j03 n GLY 88 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2j03 n GLY 88 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2j03 n ASP 89 N 4.79 0.00 -1.46 1.61 2.03 -1.26 -4.96 116.55 117.29 2j03 n ASP 89 Ca 0.40 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.71 2j03 n ASP 89 Cb 0.26 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.66 2j03 n ASP 89 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2j03 n THR 90 N 0.00 -8.12 -2.68 5.18 -1.04 -1.26 -4.86 114.28 101.50 2j03 n THR 90 Ca 0.00 1.77 -0.43 0.00 -2.04 0.00 0.00 64.05 63.35 2j03 n THR 90 Cb 0.00 -4.15 -0.03 0.00 -1.82 0.00 0.00 70.33 64.33 2j03 n THR 90 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2j03 s VAL 91 N -0.29 4.35 0.00 12.58 1.01 -0.98 -4.77 120.40 132.30 2j03 s VAL 91 Ca 0.00 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.15 2j03 s VAL 91 Cb 0.00 -4.51 0.00 0.00 0.00 0.00 0.00 36.38 31.87 2j03 s VAL 91 CO 0.00 -0.85 0.00 0.41 0.00 0.00 0.00 175.10 174.66 2j03 n THR 92 N 6.53 0.00 0.00 3.92 -1.04 -1.26 -2.22 114.28 120.21 2j03 n THR 92 Ca 0.10 0.47 0.00 0.00 -2.04 0.00 0.00 64.05 62.58 2j03 n THR 92 Cb 0.49 -1.09 0.00 0.00 -1.82 0.00 0.00 70.33 67.90 2j03 n THR 92 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2j03 n VAL 93 N 0.00 0.00 0.44 12.58 0.31 -1.26 -4.14 118.33 126.26 2j03 n VAL 93 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2j03 n VAL 93 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2j03 n VAL 93 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2j03 n GLU 94 N 0.00 0.40 0.21 5.55 1.02 -1.26 -2.28 120.64 124.27 2j03 n GLU 94 Ca 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.23 2j03 n GLU 94 Cb 0.00 -1.18 0.33 0.00 -0.02 0.00 0.00 31.44 30.57 2j03 n GLU 94 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2j03 h ILE 95 N 0.00 0.47 -3.33 -3.67 2.04 -1.97 -3.42 117.51 107.62 2j03 h ILE 95 Ca 0.00 -1.29 -0.67 0.00 1.00 0.00 0.00 64.86 63.90 2j03 h ILE 95 Cb 0.18 1.93 -0.32 0.00 -0.74 0.00 0.00 36.82 37.88 2j03 h ILE 95 CO 0.00 0.22 -0.78 -0.36 0.00 0.00 0.00 178.15 177.24 2j03 s PHE 96 N -3.42 2.94 0.09 1.37 0.08 -0.97 -5.11 117.98 112.97 2j03 s PHE 96 Ca 0.03 -1.39 -0.11 0.00 0.12 0.00 0.00 56.93 55.58 2j03 s PHE 96 Cb 0.09 -2.03 -0.06 0.00 -0.57 0.00 0.00 43.02 40.45 2j03 s PHE 96 CO 0.66 -0.70 0.43 0.15 -0.10 0.00 0.00 175.22 175.66 2j03 s LYS 97 N 1.36 3.80 0.35 0.44 1.02 -1.26 -4.93 119.74 120.53 2j03 s LYS 97 Ca 0.03 0.24 -0.25 0.00 0.02 0.00 0.00 55.97 56.01 2j03 s LYS 97 Cb -0.15 -2.98 -0.13 0.00 -0.52 0.00 0.00 37.83 34.05 2j03 s LYS 97 CO -0.07 0.54 0.80 -2.30 -0.92 0.00 0.00 175.35 173.41 2j03 n PRO 98 N 0.89 0.94 -0.35 -1.68 -0.02 -1.26 -2.74 135.00 130.78 2j03 n PRO 98 Ca -0.07 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2j03 n PRO 98 Cb 0.52 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 2j03 n PRO 98 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2j03 n GLY 99 N 1.49 0.71 3.91 -1.23 0.00 -0.56 -5.02 105.19 104.48 2j03 n GLY 99 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 2j03 n GLY 99 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j03 s GLU 100 N -0.65 3.58 -0.16 1.61 2.02 -1.11 -4.80 118.70 119.19 2j03 s GLU 100 Ca 0.00 -0.05 -0.01 0.00 0.02 0.00 0.00 54.97 54.94 2j03 s GLU 100 Cb 0.00 -2.60 -0.01 0.00 0.10 0.00 0.00 34.13 31.63 2j03 s GLU 100 CO 0.00 0.12 -0.13 1.03 0.02 0.00 0.00 175.26 176.30 2j03 s ARG 101 N -3.99 3.28 0.52 1.61 0.52 -1.26 -0.25 118.95 119.38 2j03 s ARG 101 Ca 0.44 -0.71 0.06 0.00 -0.52 0.00 0.00 55.73 55.00 2j03 s ARG 101 Cb -0.10 -2.71 0.03 0.00 0.52 0.00 0.00 34.95 32.69 2j03 s ARG 101 CO 0.34 0.01 0.42 0.14 0.02 0.00 0.00 175.30 176.24 2j03 s VAL 102 N 0.86 1.90 -0.53 3.52 -7.23 -0.97 0.25 120.40 118.20 2j03 s VAL 102 Ca -0.04 -1.43 0.06 0.00 -1.81 0.00 0.00 61.98 58.77 2j03 s VAL 102 Cb -0.15 -2.33 0.23 0.00 0.56 0.00 0.00 36.38 34.69 2j03 s VAL 102 CO -0.00 0.00 0.59 0.47 -0.31 0.00 0.00 175.10 175.84 2j03 n ASP 103 N -1.75 1.88 -4.65 4.85 8.00 -1.26 -2.28 116.55 121.34 2j03 n ASP 103 Ca 0.01 -3.02 -0.42 0.00 0.71 0.00 0.00 54.79 52.07 2j03 n ASP 103 Cb 0.64 -0.66 0.01 0.00 -0.02 0.00 0.00 41.12 41.09 2j03 n ASP 103 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2j03 n VAL 104 N 1.43 2.42 -4.28 2.53 0.31 -1.16 -4.17 118.33 115.40 2j03 n VAL 104 Ca 0.25 -0.50 -0.18 0.00 -0.01 0.00 0.00 64.34 63.91 2j03 n VAL 104 Cb 0.45 -1.33 -0.15 0.00 -0.91 0.00 0.00 33.84 31.90 2j03 n VAL 104 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2j03 s THR 105 N -1.21 0.59 0.00 2.52 2.01 -1.18 -2.15 115.64 116.23 2j03 s THR 105 Ca 0.61 -0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.30 2j03 s THR 105 Cb -0.55 -0.51 0.00 0.00 0.01 0.00 0.00 72.50 71.45 2j03 s THR 105 CO 0.58 0.17 0.00 0.61 -0.69 0.00 0.00 174.62 175.29 2j03 n GLY 106 N 2.97 2.51 3.42 4.40 0.00 -0.55 -0.81 105.19 117.13 2j03 n GLY 106 Ca -0.14 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 2j03 n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j03 s THR 107 N -2.91 4.16 0.57 2.61 2.01 -1.26 -0.94 115.64 119.88 2j03 s THR 107 Ca 0.00 -0.22 -0.21 0.00 0.31 0.00 0.00 61.69 61.57 2j03 s THR 107 Cb 0.00 -2.94 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 2j03 s THR 107 CO 0.00 0.35 1.33 -0.94 -0.69 0.00 0.00 174.62 174.67 2j03 s SER 108 N 1.59 5.14 0.31 3.53 1.04 0.17 -2.09 113.70 123.39 2j03 s SER 108 Ca 0.06 2.70 -0.29 0.00 0.48 0.00 0.00 55.95 58.90 2j03 s SER 108 Cb -0.15 -2.63 -0.11 0.00 0.10 0.00 0.00 66.02 63.24 2j03 s SER 108 CO 0.02 -1.65 1.46 -0.54 0.98 0.00 0.00 173.24 173.51 2j03 s LYS 109 N -3.03 4.22 -0.57 4.02 1.02 -1.26 -0.86 119.74 123.27 2j03 s LYS 109 Ca 0.74 2.41 -0.27 0.00 0.02 0.00 0.00 55.97 58.87 2j03 s LYS 109 Cb -0.39 -3.05 -0.01 0.00 -0.52 0.00 0.00 37.83 33.86 2j03 s LYS 109 CO 0.45 -0.44 1.71 0.20 -0.92 0.00 0.00 175.35 176.34 2j03 s GLY 110 N 0.09 0.49 -0.06 -3.33 0.00 -1.26 -1.89 107.32 101.36 2j03 s GLY 110 Ca 0.56 -0.58 0.07 0.00 0.00 0.00 0.00 44.72 44.77 2j03 s GLY 110 CO 0.51 3.20 1.07 0.54 0.00 0.00 0.00 173.10 178.42 2j03 n ARG 111 N 8.98 2.23 0.00 2.90 1.74 -0.80 -4.78 116.66 126.93 2j03 n ARG 111 Ca 0.18 -1.16 0.00 0.00 -0.77 0.00 0.00 57.85 56.09 2j03 n ARG 111 Cb 0.50 -1.60 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 2j03 n ARG 111 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2j03 n GLY 112 N 0.50 0.98 3.55 -0.13 0.00 -1.15 -4.04 105.19 104.91 2j03 n GLY 112 Ca 0.10 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 2j03 n GLY 112 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2j03 s PHE 113 N 0.00 2.22 0.26 1.61 5.99 -1.26 -0.38 117.98 126.42 2j03 s PHE 113 Ca 0.00 -0.12 -0.24 0.00 0.00 0.00 0.00 56.93 56.57 2j03 s PHE 113 Cb 0.00 -4.51 -0.09 0.00 0.00 0.00 0.00 43.02 38.42 2j03 s PHE 113 CO 0.00 -2.03 0.84 0.00 -0.00 0.00 0.00 175.22 174.04 2j03 s ALA 114 N 6.44 3.32 0.27 11.12 0.00 0.24 -4.86 121.76 138.30 2j03 s ALA 114 Ca 0.47 0.38 -0.14 0.00 0.00 0.00 0.00 51.96 52.67 2j03 s ALA 114 Cb -0.06 -3.02 -0.08 0.00 0.00 0.00 0.00 23.12 19.95 2j03 s ALA 114 CO 0.05 0.25 0.68 0.20 0.00 0.00 0.00 175.76 176.94 2j03 s GLY 115 N -1.54 2.38 0.89 0.00 0.00 -1.26 -1.10 107.32 106.69 2j03 s GLY 115 Ca 0.45 -0.02 -0.14 0.00 0.00 0.00 0.00 44.72 45.00 2j03 s GLY 115 CO 0.24 0.20 0.20 1.55 0.00 0.00 0.00 173.10 175.29 2j03 n VAL 116 N -0.04 0.42 -2.98 1.40 3.14 -1.26 -1.63 118.33 117.38 2j03 n VAL 116 Ca 0.01 -0.30 -0.12 0.00 -2.96 0.00 0.00 64.34 60.97 2j03 n VAL 116 Cb 0.53 -0.52 0.05 0.00 -1.06 0.00 0.00 33.84 32.84 2j03 n VAL 116 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 2j03 n MET 117 N -0.64 -1.86 0.00 1.45 0.00 -1.26 -4.44 117.12 110.38 2j03 n MET 117 Ca 0.06 0.79 0.00 0.00 -0.00 0.00 0.00 57.70 58.55 2j03 n MET 117 Cb 0.53 -5.20 0.00 0.00 0.00 0.00 0.00 33.22 28.55 2j03 n MET 117 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2j03 n LYS 118 N -2.87 0.00 0.02 2.12 0.00 -1.11 -4.61 118.16 111.71 2j03 n LYS 118 Ca -0.05 0.00 0.11 0.00 0.00 0.00 0.00 58.31 58.37 2j03 n LYS 118 Cb 0.59 0.00 -0.13 0.00 0.00 0.00 0.00 35.03 35.50 2j03 n LYS 118 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2j03 n ARG 119 N 0.00 0.63 -0.04 1.64 0.00 -0.64 -4.54 116.66 113.70 2j03 n ARG 119 Ca 0.00 -0.12 0.00 0.00 -0.00 0.00 0.00 57.85 57.73 2j03 n ARG 119 Cb 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 32.46 30.87 2j03 n ARG 119 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 2j03 n TRP 120 N -2.32 0.00 -3.85 -0.14 7.02 -1.26 -5.01 117.44 111.87 2j03 n TRP 120 Ca -0.03 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 56.08 2j03 n TRP 120 Cb 0.56 0.05 0.03 0.00 -2.42 0.00 0.00 31.31 29.53 2j03 n TRP 120 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2j03 n ASN 121 N 0.00 -4.86 -4.90 -0.99 4.13 -1.26 -4.62 115.26 102.76 2j03 n ASN 121 Ca 0.00 -1.11 -0.28 0.00 1.68 0.00 0.00 54.58 54.87 2j03 n ASN 121 Cb 0.51 -2.51 0.03 0.00 -1.54 0.00 0.00 39.78 36.26 2j03 n ASN 121 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2j03 s PHE 122 N -3.42 3.38 0.05 3.10 0.40 -1.26 -4.81 117.98 115.41 2j03 s PHE 122 Ca 0.42 0.83 -0.25 0.00 -0.60 0.00 0.00 56.93 57.34 2j03 s PHE 122 Cb -0.19 -2.71 -0.17 0.00 0.51 0.00 0.00 43.02 40.46 2j03 s PHE 122 CO 0.91 -0.77 1.56 0.00 0.70 0.00 0.00 175.22 177.63 2j03 h ALA 123 N -0.20 -0.09 0.00 5.36 0.00 -1.91 -3.43 119.26 118.99 2j03 h ALA 123 Ca -0.45 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2j03 h ALA 123 Cb 1.24 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2j03 h ALA 123 CO 0.62 -0.47 0.00 0.41 0.00 0.00 0.00 179.25 179.81 2j03 n GLY 124 N -0.69 0.52 3.38 0.00 0.00 -1.26 -4.98 105.19 102.16 2j03 n GLY 124 Ca -0.08 -1.30 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 2j03 n GLY 124 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2j03 s GLY 125 N 0.00 -0.44 0.09 -0.02 0.00 0.18 -4.75 107.32 102.38 2j03 s GLY 125 Ca 0.00 0.41 -0.28 0.00 0.00 0.00 0.00 44.72 44.85 2j03 s GLY 125 CO 0.00 0.12 0.65 -1.05 0.00 0.00 0.00 173.10 172.82 2j03 n PRO 126 N 0.05 0.00 -0.12 2.90 -0.02 -1.26 -4.74 135.00 131.81 2j03 n PRO 126 Ca -0.17 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.38 2j03 n PRO 126 Cb 0.62 -1.04 0.25 0.00 -0.02 0.00 0.00 33.50 33.32 2j03 n PRO 126 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2j03 n ASP 127 N 1.50 1.65 -0.75 2.55 8.00 -1.26 -4.74 116.55 123.49 2j03 n ASP 127 Ca 0.16 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.80 2j03 n ASP 127 Cb 0.15 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 2j03 n ASP 127 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2j03 n SER 128 N 0.35 0.00 0.00 -2.24 2.88 -1.26 -5.05 113.62 108.30 2j03 n SER 128 Ca 0.13 -0.75 0.00 0.00 -1.33 0.00 0.00 58.87 56.92 2j03 n SER 128 Cb 0.29 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 2j03 n SER 128 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2j03 n HIS 129 N 0.00 0.00 -0.06 0.66 8.25 -1.26 -4.66 115.22 118.15 2j03 n HIS 129 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.44 2j03 n HIS 129 Cb 0.00 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.13 2j03 n HIS 129 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j03 n GLY 130 N 0.00 -1.73 3.00 -1.41 0.00 -1.26 -4.90 105.19 98.89 2j03 n GLY 130 Ca 0.00 -0.57 -0.26 0.00 0.00 0.00 0.00 46.02 45.19 2j03 n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j03 n ALA 131 N -1.75 -2.40 -0.13 4.61 0.00 -1.26 -4.97 120.51 114.60 2j03 n ALA 131 Ca -0.01 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.40 2j03 n ALA 131 Cb 0.04 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 18.70 2j03 n ALA 131 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2j03 n HIS 132 N -3.74 0.00 0.55 0.00 -0.00 -1.26 -4.65 115.22 106.12 2j03 n HIS 132 Ca 0.00 0.00 0.10 0.00 0.46 0.00 0.00 57.72 58.29 2j03 n HIS 132 Cb 0.51 0.00 -0.14 0.00 -0.12 0.00 0.00 29.99 30.24 2j03 n HIS 132 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2j03 n LYS 133 N -0.36 0.29 -1.23 1.57 5.02 -1.26 -4.30 118.16 117.89 2j03 n LYS 133 Ca 0.00 -0.09 -0.24 0.00 -2.02 0.00 0.00 58.31 55.96 2j03 n LYS 133 Cb 0.03 -1.51 0.15 0.00 -0.02 0.00 0.00 35.03 33.68 2j03 n LYS 133 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2j03 n ILE 134 N -1.84 3.21 0.00 -0.18 -0.00 -1.26 -4.77 119.36 114.51 2j03 n ILE 134 Ca 0.00 -2.40 0.00 0.00 -0.00 0.00 0.00 62.75 60.36 2j03 n ILE 134 Cb 0.44 -0.66 0.00 0.00 -0.00 0.00 0.00 39.64 39.42 2j03 n ILE 134 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.55 177.96 2j03 n HIS 135 N -1.07 0.00 -2.95 4.28 8.25 -1.26 -3.82 115.22 118.65 2j03 n HIS 135 Ca 0.56 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.59 2j03 n HIS 135 Cb 1.29 -0.05 -0.05 0.00 1.12 0.00 0.00 29.99 32.30 2j03 n HIS 135 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2j03 s ARG 136 N -1.22 3.36 -0.10 -0.41 0.52 -1.26 0.47 118.95 120.30 2j03 s ARG 136 Ca 0.00 -0.22 -0.31 0.00 -0.52 0.00 0.00 55.73 54.69 2j03 s ARG 136 Cb 0.00 -3.98 0.10 0.00 0.52 0.00 0.00 34.95 31.58 2j03 s ARG 136 CO 0.00 -1.22 0.83 -1.01 0.02 0.00 0.00 175.30 173.92 2j03 s HIS 137 N 3.40 -0.53 -2.00 -0.53 3.76 -1.25 -5.00 115.29 113.14 2j03 s HIS 137 Ca 0.29 0.90 0.07 0.00 -0.15 0.00 0.00 55.06 56.17 2j03 s HIS 137 Cb -0.13 0.43 0.45 0.00 1.11 0.00 0.00 32.58 34.43 2j03 s HIS 137 CO 0.21 -0.48 1.16 -0.35 -0.85 0.00 0.00 174.74 174.43 2j03 n PRO 138 N 0.84 0.86 0.00 8.40 -0.04 -1.26 -4.19 135.00 139.60 2j03 n PRO 138 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2j03 n PRO 138 Cb 0.57 -1.14 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 2j03 n PRO 138 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2j03 n GLY 139 N 0.45 3.00 3.89 0.55 0.00 -1.26 -4.67 105.19 107.15 2j03 n GLY 139 Ca 0.06 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 2j03 n GLY 139 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2j03 s SER 140 N -4.00 4.71 0.00 1.61 0.15 -1.26 -5.01 113.70 109.90 2j03 s SER 140 Ca 0.00 0.87 0.00 0.00 0.70 0.00 0.00 55.95 57.52 2j03 s SER 140 Cb 0.00 -1.44 0.00 0.00 -1.71 0.00 0.00 66.02 62.87 2j03 s SER 140 CO 0.00 -1.79 0.00 2.30 1.20 0.00 0.00 173.24 174.95 2j03 n ILE 141 N -3.25 0.00 -1.31 6.45 -5.35 -1.26 -5.13 119.36 109.50 2j03 n ILE 141 Ca 0.08 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 2j03 n ILE 141 Cb 0.60 0.97 0.00 0.00 -1.74 0.00 0.00 39.64 39.47 2j03 n ILE 141 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2j03 n GLY 142 N 0.17 4.26 0.00 3.28 0.00 -1.26 -4.70 105.19 106.94 2j03 n GLY 142 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2j03 n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2j03 n ASN 143 N 0.00 0.47 0.00 1.61 5.03 -1.26 -5.15 115.26 115.97 2j03 n ASN 143 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 2j03 n ASN 143 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2j03 n ASN 143 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2j03 n ARG 144 N 0.00 3.28 -0.16 3.52 1.74 -1.26 -4.80 116.66 118.98 2j03 n ARG 144 Ca 0.00 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.04 2j03 n ARG 144 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.40 2j03 n ARG 144 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2j03 n LYS 145 N 0.00 -0.17 -3.66 5.56 4.76 -1.26 -2.41 118.16 120.99 2j03 n LYS 145 Ca 0.00 0.72 -0.36 0.00 -2.87 0.00 0.00 58.31 55.80 2j03 n LYS 145 Cb 0.00 -1.06 -0.08 0.00 -1.84 0.00 0.00 35.03 32.05 2j03 n LYS 145 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2j03 s THR 146 N -4.62 5.37 -0.10 -0.18 -4.23 -1.26 -0.11 115.64 110.52 2j03 s THR 146 Ca -0.05 0.33 0.23 0.00 -1.18 0.00 0.00 61.69 61.02 2j03 s THR 146 Cb 0.04 -3.53 0.23 0.00 1.34 0.00 0.00 72.50 70.58 2j03 s THR 146 CO 0.23 0.42 1.69 1.55 -0.54 0.00 0.00 174.62 177.97 2j03 h PRO 147 N 6.66 0.00 -1.39 3.99 0.13 -1.92 -3.45 132.00 136.02 2j03 h PRO 147 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2j03 h PRO 147 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2j03 h PRO 147 CO 0.76 0.21 0.00 0.41 -0.23 0.00 0.00 178.00 179.15 2j03 n GLY 148 N 0.67 0.66 0.00 1.56 0.00 0.85 -5.05 105.19 103.88 2j03 n GLY 148 Ca 0.02 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2j03 n GLY 148 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2j03 n ARG 149 N -0.69 -0.24 -3.46 1.61 1.85 -1.26 -5.06 116.66 109.41 2j03 n ARG 149 Ca 0.00 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.47 2j03 n ARG 149 Cb 0.44 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.79 2j03 n ARG 149 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2j03 s VAL 150 N -2.00 5.13 0.62 8.89 1.01 -1.26 -4.72 120.40 128.06 2j03 s VAL 150 Ca 0.00 0.81 -0.18 0.00 0.00 0.00 0.00 61.98 62.61 2j03 s VAL 150 Cb 0.00 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2j03 s VAL 150 CO 0.00 0.48 0.85 -1.22 0.00 0.00 0.00 175.10 175.21 2j03 n TYR 151 N 2.63 0.41 0.77 5.22 4.01 -1.26 -4.82 117.16 124.12 2j03 n TYR 151 Ca -0.12 0.43 0.00 0.00 -0.16 0.00 0.00 57.90 58.05 2j03 n TYR 151 Cb 0.52 -2.08 0.00 0.00 -0.31 0.00 0.00 39.34 37.47 2j03 n TYR 151 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2j03 n LYS 152 N -0.91 0.77 0.00 -0.72 3.00 -1.26 -3.24 118.16 115.80 2j03 n LYS 152 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.44 2j03 n LYS 152 Cb 0.48 -1.32 0.00 0.00 0.00 0.00 0.00 35.03 34.19 2j03 n LYS 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2j03 n GLY 153 N 0.24 1.00 3.31 3.14 0.00 -1.26 -5.11 105.19 106.50 2j03 n GLY 153 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.48 2j03 n GLY 153 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2j03 n LYS 154 N 0.00 0.00 -2.38 1.61 3.00 -1.20 -4.84 118.16 114.35 2j03 n LYS 154 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.90 2j03 n LYS 154 Cb 0.08 -1.34 -0.04 0.00 0.00 0.00 0.00 35.03 33.74 2j03 n LYS 154 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2j03 s LYS 155 N -0.17 4.52 0.25 1.64 1.02 -1.26 -5.02 119.74 120.72 2j03 s LYS 155 Ca 0.82 1.88 -0.05 0.00 0.02 0.00 0.00 55.97 58.63 2j03 s LYS 155 Cb -1.15 -3.22 -0.02 0.00 -0.52 0.00 0.00 37.83 32.92 2j03 s LYS 155 CO 0.54 -0.03 0.33 -1.64 -0.92 0.00 0.00 175.35 173.64 2j03 s MET 156 N -0.59 1.49 0.37 1.68 -1.94 -1.26 -5.08 119.30 113.97 2j03 s MET 156 Ca 0.51 -1.52 -0.28 0.00 -1.71 0.00 0.00 55.69 52.68 2j03 s MET 156 Cb -0.33 0.38 -0.11 0.00 2.01 0.00 0.00 34.83 36.79 2j03 s MET 156 CO 0.38 -0.57 1.45 0.00 -0.01 0.00 0.00 175.02 176.27 2j03 s ALA 157 N -3.88 3.55 0.09 3.03 0.00 -1.26 -4.67 121.76 118.63 2j03 s ALA 157 Ca 0.31 1.51 -0.21 0.00 0.00 0.00 0.00 51.96 53.57 2j03 s ALA 157 Cb 0.02 -3.58 0.07 0.00 0.00 0.00 0.00 23.12 19.64 2j03 s ALA 157 CO 0.13 -0.97 1.00 0.41 0.00 0.00 0.00 175.76 176.33 2j03 n GLY 158 N 0.53 0.51 3.67 0.00 0.00 -0.25 -4.93 105.19 104.72 2j03 n GLY 158 Ca 0.01 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 2j03 n GLY 158 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2j03 s HIS 159 N -2.39 2.34 -0.05 1.61 5.65 -1.26 0.82 115.29 122.00 2j03 s HIS 159 Ca 0.23 0.46 0.01 0.00 0.25 0.00 0.00 55.06 56.00 2j03 s HIS 159 Cb -0.02 -3.81 0.02 0.00 -1.18 0.00 0.00 32.58 27.59 2j03 s HIS 159 CO 0.03 -3.25 -0.05 -0.47 -0.65 0.00 0.00 174.74 170.35 2j03 s TYR 160 N 3.43 0.84 -1.26 3.88 6.14 0.49 -4.83 117.35 126.04 2j03 s TYR 160 Ca 0.69 -0.26 0.00 0.00 0.64 0.00 0.00 57.07 58.14 2j03 s TYR 160 Cb -0.32 -0.76 0.00 0.00 0.42 0.00 0.00 41.96 41.30 2j03 s TYR 160 CO 0.27 -0.24 0.00 0.41 0.64 0.00 0.00 175.55 176.63 2j03 n GLY 161 N 4.26 0.62 3.65 8.97 0.00 -1.26 -1.90 105.19 119.52 2j03 n GLY 161 Ca -0.21 -2.22 -0.23 0.00 0.00 0.00 0.00 46.02 43.36 2j03 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j03 n ALA 162 N -1.00 -2.50 -2.69 4.61 0.00 -0.04 -4.72 120.51 114.17 2j03 n ALA 162 Ca 0.00 -0.27 -0.12 0.00 0.00 0.00 0.00 53.44 53.06 2j03 n ALA 162 Cb 0.00 -0.75 -0.07 0.00 0.00 0.00 0.00 19.45 18.63 2j03 n ALA 162 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2j03 s GLU 163 N -4.80 1.48 -0.37 0.00 -1.05 -1.20 -4.81 118.70 107.95 2j03 s GLU 163 Ca 0.05 -1.53 -0.29 0.00 -0.15 0.00 0.00 54.97 53.05 2j03 s GLU 163 Cb -0.03 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 34.04 2j03 s GLU 163 CO 0.76 -0.57 1.50 0.50 0.95 0.00 0.00 175.26 178.40 2j03 s ARG 164 N -3.88 3.57 0.03 -4.83 3.52 -1.26 0.44 118.95 116.55 2j03 s ARG 164 Ca 0.32 1.13 0.08 0.00 -0.13 0.00 0.00 55.73 57.13 2j03 s ARG 164 Cb 0.03 -4.05 -0.03 0.00 -1.56 0.00 0.00 34.95 29.34 2j03 s ARG 164 CO 0.13 -1.56 -0.23 0.08 -0.81 0.00 0.00 175.30 172.91 2j03 s VAL 165 N 5.62 2.36 -0.30 7.11 1.01 -0.12 -4.94 120.40 131.14 2j03 s VAL 165 Ca 0.66 -1.25 -0.02 0.00 0.00 0.00 0.00 61.98 61.36 2j03 s VAL 165 Cb -0.17 -1.93 0.10 0.00 0.00 0.00 0.00 36.38 34.39 2j03 s VAL 165 CO 0.32 0.40 0.11 -0.89 0.00 0.00 0.00 175.10 175.05 2j03 s THR 166 N -0.80 0.44 0.18 3.92 2.01 -1.26 -1.48 115.64 118.64 2j03 s THR 166 Ca 0.12 -1.11 -0.16 0.00 0.31 0.00 0.00 61.69 60.85 2j03 s THR 166 Cb -0.10 -1.35 -0.07 0.00 0.01 0.00 0.00 72.50 70.98 2j03 s THR 166 CO 0.02 -0.70 0.61 0.54 -0.69 0.00 0.00 174.62 174.40 2j03 s VAL 167 N 1.83 4.75 0.42 3.82 0.11 -0.91 -5.01 120.40 125.42 2j03 s VAL 167 Ca 0.09 0.99 0.02 0.00 -2.93 0.00 0.00 61.98 60.16 2j03 s VAL 167 Cb -0.17 -3.77 0.02 0.00 -1.53 0.00 0.00 36.38 30.93 2j03 s VAL 167 CO -0.30 0.22 0.18 0.23 -3.33 0.00 0.00 175.10 172.09 2j03 n MET 168 N 0.75 0.92 -1.73 1.54 0.00 -1.26 -2.98 117.12 114.36 2j03 n MET 168 Ca -0.04 -2.84 0.00 0.00 0.00 0.00 0.00 57.70 54.82 2j03 n MET 168 Cb 0.52 0.52 0.00 0.00 0.00 0.00 0.00 33.22 34.26 2j03 n MET 168 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2j03 n ASN 169 N -1.58 -0.51 -4.67 7.83 4.13 -1.05 -4.87 115.26 114.53 2j03 n ASN 169 Ca -0.09 0.26 -0.42 0.00 1.68 0.00 0.00 54.58 56.01 2j03 n ASN 169 Cb 0.51 -0.73 -0.03 0.00 -1.54 0.00 0.00 39.78 37.99 2j03 n ASN 169 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2j03 s LEU 170 N -3.42 4.38 0.14 3.41 1.02 -0.97 -4.72 118.68 118.52 2j03 s LEU 170 Ca 0.00 2.50 -0.31 0.00 0.02 0.00 0.00 54.13 56.34 2j03 s LEU 170 Cb 0.00 -3.54 -0.09 0.00 0.02 0.00 0.00 46.19 42.58 2j03 s LEU 170 CO 0.00 -0.97 1.42 -1.61 0.02 0.00 0.00 176.35 175.21 2j03 s GLU 171 N 3.75 4.31 -0.47 1.70 2.02 -1.26 -2.28 118.70 126.46 2j03 s GLU 171 Ca 0.79 2.14 -0.27 0.00 0.02 0.00 0.00 54.97 57.65 2j03 s GLU 171 Cb -0.39 -3.22 0.03 0.00 0.10 0.00 0.00 34.13 30.65 2j03 s GLU 171 CO 0.35 -0.45 1.02 0.08 0.02 0.00 0.00 175.26 176.28 2j03 s VAL 172 N 0.92 4.35 0.00 2.63 1.01 0.65 -3.65 120.40 126.31 2j03 s VAL 172 Ca 0.64 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.59 2j03 s VAL 172 Cb -0.38 -4.51 0.00 0.00 0.00 0.00 0.00 36.38 31.49 2j03 s VAL 172 CO 0.32 -0.91 0.00 0.52 0.00 0.00 0.00 175.10 175.03 2j03 n VAL 173 N 6.60 0.00 -2.19 2.92 0.31 -0.71 -1.50 118.33 123.76 2j03 n VAL 173 Ca 0.09 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.14 2j03 n VAL 173 Cb 0.49 -0.05 0.04 0.00 -0.91 0.00 0.00 33.84 33.41 2j03 n VAL 173 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2j03 s ASP 174 N -1.16 5.38 -0.20 4.52 3.68 -1.26 -4.39 116.67 123.24 2j03 s ASP 174 Ca 0.00 0.80 -0.04 0.00 2.13 0.00 0.00 52.55 55.44 2j03 s ASP 174 Cb 0.00 -1.66 0.09 0.00 -1.45 0.00 0.00 42.92 39.90 2j03 s ASP 174 CO 0.00 -1.27 0.23 0.54 0.13 0.00 0.00 175.17 174.81 2j03 s VAL 175 N -3.17 -0.35 -1.10 1.11 0.11 -1.26 -1.49 120.40 114.25 2j03 s VAL 175 Ca 0.56 -0.08 -0.13 0.00 -2.93 0.00 0.00 61.98 59.40 2j03 s VAL 175 Cb -0.11 -0.67 0.20 0.00 -1.53 0.00 0.00 36.38 34.27 2j03 s VAL 175 CO 0.47 -0.18 1.24 -0.63 -3.33 0.00 0.00 175.10 172.67 2j03 s ILE 176 N 2.35 5.31 0.61 7.04 1.09 -1.24 -4.82 121.20 131.54 2j03 s ILE 176 Ca 0.07 -2.68 0.33 0.00 -1.10 0.00 0.00 60.65 57.27 2j03 s ILE 176 Cb -0.15 -4.77 0.38 0.00 -1.06 0.00 0.00 42.46 36.86 2j03 s ILE 176 CO -0.12 -1.43 2.28 1.55 -0.10 0.00 0.00 174.94 177.12 2j03 h PRO 177 N 7.33 0.00 0.00 2.79 0.13 -1.94 0.34 132.00 140.65 2j03 h PRO 177 Ca 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.36 2j03 h PRO 177 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 2j03 h PRO 177 CO 1.11 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 176.97 2j03 n GLU 178 N -3.66 0.00 -0.07 0.86 4.07 -1.26 -2.35 120.64 118.23 2j03 n GLU 178 Ca -0.03 0.39 0.06 0.00 -0.06 0.00 0.00 57.16 57.52 2j03 n GLU 178 Cb 0.09 -1.16 0.24 0.00 -0.06 0.00 0.00 31.44 30.54 2j03 n GLU 178 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 2j03 n GLU 179 N -1.29 1.40 -2.71 5.31 4.07 -1.18 -4.95 120.64 121.29 2j03 n GLU 179 Ca 0.00 -0.62 -0.01 0.00 -0.06 0.00 0.00 57.16 56.47 2j03 n GLU 179 Cb 0.00 -1.23 -0.01 0.00 -0.06 0.00 0.00 31.44 30.15 2j03 n GLU 179 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2j03 n ASN 180 N -0.07 -6.89 -2.55 4.31 2.85 0.10 -5.08 115.26 107.94 2j03 n ASN 180 Ca 0.10 1.41 -0.12 0.00 -0.11 0.00 0.00 54.58 55.86 2j03 n ASN 180 Cb 0.17 -5.28 -0.03 0.00 1.24 0.00 0.00 39.78 35.88 2j03 n ASN 180 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2j03 n LEU 181 N 0.88 0.00 -3.64 1.20 7.99 -0.27 -4.59 117.00 118.56 2j03 n LEU 181 Ca -0.06 -2.22 -0.11 0.00 -0.01 0.00 0.00 56.01 53.61 2j03 n LEU 181 Cb 0.11 1.75 -0.07 0.00 -0.11 0.00 0.00 43.42 45.10 2j03 n LEU 181 CO 0.43 -0.47 0.37 -0.22 -1.51 0.00 0.00 177.39 176.00 2j03 s LEU 182 N 0.00 -0.82 0.13 2.23 2.96 -0.56 -3.71 118.68 118.92 2j03 s LEU 182 Ca 0.24 1.46 0.11 0.00 -0.22 0.00 0.00 54.13 55.72 2j03 s LEU 182 Cb -0.00 2.39 -0.04 0.00 0.50 0.00 0.00 46.19 49.04 2j03 s LEU 182 CO 0.17 -0.24 -0.27 -0.76 -1.32 0.00 0.00 176.35 173.93 2j03 s LEU 183 N 1.01 2.34 0.00 -0.68 1.02 -0.55 -0.59 118.68 121.21 2j03 s LEU 183 Ca -0.05 -0.75 0.00 0.00 0.02 0.00 0.00 54.13 53.35 2j03 s LEU 183 Cb -0.05 -1.23 0.00 0.00 0.02 0.00 0.00 46.19 44.93 2j03 s LEU 183 CO -0.09 0.18 0.00 1.33 0.02 0.00 0.00 176.35 177.78 2j03 n VAL 184 N 0.87 0.00 -2.15 -1.59 0.24 -1.05 -1.73 118.33 112.93 2j03 n VAL 184 Ca -0.18 0.00 -0.40 0.00 -2.04 0.00 0.00 64.34 61.73 2j03 n VAL 184 Cb 0.53 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 32.93 2j03 n VAL 184 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2j03 n LYS 185 N 0.00 3.68 0.00 7.34 4.76 -1.24 -2.95 118.16 129.76 2j03 n LYS 185 Ca 0.00 -3.86 0.00 0.00 -2.87 0.00 0.00 58.31 51.58 2j03 n LYS 185 Cb 0.00 -2.34 0.00 0.00 -1.84 0.00 0.00 35.03 30.85 2j03 n LYS 185 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2j03 n GLY 186 N -0.27 0.00 3.33 0.72 0.00 -1.14 -4.75 105.19 103.07 2j03 n GLY 186 Ca 0.52 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.23 2j03 n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j03 n ALA 187 N 0.00 0.68 -3.84 4.61 0.00 -1.26 -4.75 120.51 115.94 2j03 n ALA 187 Ca 0.00 -1.94 -0.28 0.00 0.00 0.00 0.00 53.44 51.22 2j03 n ALA 187 Cb 0.00 -2.84 -0.16 0.00 0.00 0.00 0.00 19.45 16.44 2j03 n ALA 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2j03 s VAL 188 N 5.91 0.92 0.52 0.00 0.11 -1.26 -4.78 120.40 121.82 2j03 s VAL 188 Ca 0.47 -0.59 -0.21 0.00 -2.93 0.00 0.00 61.98 58.72 2j03 s VAL 188 Cb 0.10 -1.19 -0.08 0.00 -1.53 0.00 0.00 36.38 33.68 2j03 s VAL 188 CO 0.24 0.03 0.90 -0.81 -3.33 0.00 0.00 175.10 172.13 2j03 n PRO 189 N 4.93 1.00 0.00 1.54 -0.04 -1.26 -4.92 135.00 136.25 2j03 n PRO 189 Ca -0.11 0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 2j03 n PRO 189 Cb 0.47 -2.03 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 2j03 n PRO 189 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2j03 n GLY 190 N 1.34 1.02 3.59 0.55 0.00 -0.89 -4.28 105.19 106.52 2j03 n GLY 190 Ca 0.12 -1.66 -0.28 0.00 0.00 0.00 0.00 46.02 44.19 2j03 n GLY 190 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j03 s PRO 191 N -3.84 -0.34 0.39 1.61 0.04 -1.26 -4.91 135.00 126.68 2j03 s PRO 191 Ca 0.00 0.58 -0.26 0.00 0.04 0.00 0.00 61.00 61.36 2j03 s PRO 191 Cb 0.00 -1.64 -0.09 0.00 0.04 0.00 0.00 34.50 32.81 2j03 s PRO 191 CO 0.00 -3.27 1.19 -0.80 0.04 0.00 0.00 177.00 174.16 2j03 s ASN 192 N -3.09 6.55 0.00 6.66 0.02 -1.26 -3.35 114.94 120.47 2j03 s ASN 192 Ca 0.67 2.40 0.00 0.00 -1.02 0.00 0.00 52.86 54.91 2j03 s ASN 192 Cb -0.21 -2.62 0.00 0.00 0.02 0.00 0.00 41.25 38.44 2j03 s ASN 192 CO 0.61 -0.66 0.00 0.61 0.02 0.00 0.00 177.10 177.68 2j03 n GLY 193 N 0.68 0.65 3.32 0.66 0.00 0.21 -4.95 105.19 105.75 2j03 n GLY 193 Ca 0.04 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 2j03 n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2j03 s GLY 194 N -2.71 1.32 -0.58 -0.02 0.00 -1.20 -4.87 107.32 99.26 2j03 s GLY 194 Ca 0.00 -1.21 -0.26 0.00 0.00 0.00 0.00 44.72 43.25 2j03 s GLY 194 CO 0.00 -1.11 2.16 -2.27 0.00 0.00 0.00 173.10 171.89 2j03 s LEU 195 N -1.22 3.31 -0.06 0.66 2.96 -1.26 -1.72 118.68 121.35 2j03 s LEU 195 Ca 0.11 0.61 0.04 0.00 -0.22 0.00 0.00 54.13 54.66 2j03 s LEU 195 Cb -0.10 -2.52 -0.02 0.00 0.50 0.00 0.00 46.19 44.05 2j03 s LEU 195 CO 0.02 -2.74 -0.17 0.68 -1.32 0.00 0.00 176.35 172.81 2j03 s VAL 196 N 11.01 2.76 -0.30 1.68 -7.23 0.15 -4.43 120.40 124.05 2j03 s VAL 196 Ca 0.83 -0.82 0.03 0.00 -1.81 0.00 0.00 61.98 60.21 2j03 s VAL 196 Cb -0.14 -2.07 0.08 0.00 0.56 0.00 0.00 36.38 34.81 2j03 s VAL 196 CO 0.21 0.58 -0.01 0.27 -0.31 0.00 0.00 175.10 175.84 2j03 s ILE 197 N -0.46 2.03 0.13 -0.62 -4.36 0.01 -0.06 121.20 117.87 2j03 s ILE 197 Ca 0.06 -1.90 -0.30 0.00 -0.26 0.00 0.00 60.65 58.25 2j03 s ILE 197 Cb -0.12 -2.36 -0.07 0.00 1.25 0.00 0.00 42.46 41.17 2j03 s ILE 197 CO 0.02 -0.36 1.13 -0.69 0.24 0.00 0.00 174.94 175.28 2j03 s VAL 198 N 1.09 3.96 0.00 8.37 1.01 -1.01 -3.07 120.40 130.74 2j03 s VAL 198 Ca 0.02 1.57 0.00 0.00 0.00 0.00 0.00 61.98 63.57 2j03 s VAL 198 Cb -0.19 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.19 2j03 s VAL 198 CO -0.08 0.21 0.00 0.54 0.00 0.00 0.00 175.10 175.77 2j03 n ARG 199 N 2.96 0.49 -3.68 2.72 1.74 -1.26 -3.68 116.66 115.95 2j03 n ARG 199 Ca 0.05 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.98 2j03 n ARG 199 Cb 0.46 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 31.76 2j03 n ARG 199 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2j03 s GLU 200 N 4.19 0.10 0.87 5.56 1.03 -1.26 -4.26 118.70 124.93 2j03 s GLU 200 Ca 0.00 0.62 -0.17 0.00 0.03 0.00 0.00 54.97 55.45 2j03 s GLU 200 Cb 0.00 -0.16 -0.14 0.00 -0.80 0.00 0.00 34.13 33.03 2j03 s GLU 200 CO 0.00 -0.27 -0.85 2.41 -1.33 0.00 0.00 175.26 175.22 2j03 n THR 201 N 5.15 0.00 -1.24 1.83 -1.04 0.69 -4.55 114.28 115.12 2j03 n THR 201 Ca -0.09 -0.35 0.08 0.00 -2.04 0.00 0.00 64.05 61.66 2j03 n THR 201 Cb 0.50 0.00 0.17 0.00 -1.82 0.00 0.00 70.33 69.18 2j03 n THR 201 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2j03 n LYS 202 N 2.18 1.50 0.18 -2.82 3.00 -1.26 -4.25 118.16 116.70 2j03 n LYS 202 Ca -0.02 -2.84 0.13 0.00 -0.00 0.00 0.00 58.31 55.59 2j03 n LYS 202 Cb 0.53 -1.57 0.64 0.00 0.00 0.00 0.00 35.03 34.63 2j03 n LYS 202 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.40 178.97 2j03 h LYS 203 N 0.45 0.00 0.00 1.64 5.09 -1.95 -3.40 116.57 118.41 2j03 h LYS 203 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.75 2j03 h LYS 203 Cb 1.06 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.39 2j03 h LYS 203 CO 0.03 0.00 0.00 0.00 -2.09 0.00 0.00 179.45 177.39 2j03 n ALA 204 N -1.84 0.42 0.00 0.07 0.00 -1.26 -5.24 120.51 112.65 2j03 n ALA 204 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2j03 n ALA 204 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2j03 n ALA 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50