#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jdb s LYS 3 N 0.00 2.28 0.42 0.38 1.02 -1.26 -5.00 119.74 117.57 1jdb s LYS 3 Ca 0.00 -2.57 -0.23 0.00 0.02 0.00 0.00 55.97 53.18 1jdb s LYS 3 Cb 0.00 -3.53 -0.09 0.00 -0.52 0.00 0.00 37.83 33.69 1jdb s LYS 3 CO 0.00 -1.14 1.06 -1.12 -0.92 0.00 0.00 175.35 173.23 1jdb s SER 4 N 0.21 6.65 -0.01 2.83 0.01 -1.26 0.84 113.70 122.98 1jdb s SER 4 Ca 0.17 2.05 -0.10 0.00 1.31 0.00 0.00 55.95 59.37 1jdb s SER 4 Cb -0.23 -2.58 0.01 0.00 0.21 0.00 0.00 66.02 63.43 1jdb s SER 4 CO -0.02 -0.57 0.21 0.00 0.41 0.00 0.00 173.24 173.27 1jdb s ALA 5 N -1.70 -0.51 -0.02 1.44 0.00 -1.17 -0.72 121.76 119.09 1jdb s ALA 5 Ca 0.60 0.07 -0.02 0.00 0.00 0.00 0.00 51.96 52.61 1jdb s ALA 5 Cb -0.22 0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.98 1jdb s ALA 5 CO 0.27 -0.22 0.05 -1.17 0.00 0.00 0.00 175.76 174.68 1jdb s LEU 6 N -1.30 1.83 -0.12 0.00 0.20 -0.65 -1.18 118.68 117.45 1jdb s LEU 6 Ca -0.14 0.07 0.03 0.00 0.69 0.00 0.00 54.13 54.78 1jdb s LEU 6 Cb -0.06 0.16 0.01 0.00 -0.43 0.00 0.00 46.19 45.87 1jdb s LEU 6 CO 0.03 -0.03 -0.22 -0.22 -0.29 0.00 0.00 176.35 175.62 1jdb s LEU 7 N -0.03 2.05 -0.05 -0.68 2.96 -0.30 -1.06 118.68 121.57 1jdb s LEU 7 Ca -0.01 -0.57 0.02 0.00 -0.22 0.00 0.00 54.13 53.36 1jdb s LEU 7 Cb -0.01 -1.38 0.01 0.00 0.50 0.00 0.00 46.19 45.31 1jdb s LEU 7 CO 0.00 0.10 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.33 1jdb s VAL 8 N 0.69 0.98 0.19 1.68 1.01 -0.36 -0.84 120.40 123.74 1jdb s VAL 8 Ca -0.11 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.50 1jdb s VAL 8 Cb -0.16 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.29 1jdb s VAL 8 CO 0.01 0.31 0.31 -0.76 0.00 0.00 0.00 175.10 174.98 1jdb s LEU 9 N 0.56 4.31 0.38 3.92 1.43 -0.55 0.22 118.68 128.95 1jdb s LEU 9 Ca -0.11 0.12 0.20 0.00 -1.03 0.00 0.00 54.13 53.31 1jdb s LEU 9 Cb -0.14 -2.87 1.23 0.00 0.03 0.00 0.00 46.19 44.44 1jdb s LEU 9 CO 0.02 0.00 1.65 -0.33 0.23 0.00 0.00 176.35 177.93 1jdb h GLU 10 N 1.77 0.21 0.00 1.70 5.08 -1.32 0.26 114.58 122.28 1jdb h GLU 10 Ca -0.50 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1jdb h GLU 10 Cb 1.21 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1jdb h GLU 10 CO 0.65 0.14 0.00 -0.40 -1.00 0.00 0.00 179.01 178.40 1jdb n ASP 11 N -4.95 0.00 0.00 1.42 5.68 -1.26 -4.83 116.55 112.62 1jdb n ASP 11 Ca 0.34 -0.75 0.00 0.00 -0.50 0.00 0.00 54.79 53.87 1jdb n ASP 11 Cb 1.15 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 41.13 1jdb n ASP 11 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jdb n GLY 12 N 0.51 0.76 3.73 6.12 0.00 0.92 -5.04 105.19 112.19 1jdb n GLY 12 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1jdb n GLY 12 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jdb s THR 13 N -2.69 3.74 -0.00 2.61 2.01 -1.25 -4.79 115.64 115.26 1jdb s THR 13 Ca 0.00 1.38 0.04 0.00 0.31 0.00 0.00 61.69 63.42 1jdb s THR 13 Cb 0.00 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.59 1jdb s THR 13 CO 0.00 0.18 -0.11 -1.10 -0.69 0.00 0.00 174.62 172.91 1jdb s GLN 14 N 0.23 2.45 -0.24 4.92 -0.21 -1.26 -1.48 119.66 124.06 1jdb s GLN 14 Ca 0.55 -0.77 -0.01 0.00 0.02 0.00 0.00 55.36 55.15 1jdb s GLN 14 Cb -0.31 -2.41 0.07 0.00 1.00 0.00 0.00 33.01 31.36 1jdb s GLN 14 CO 0.34 0.60 0.04 -0.06 -2.12 0.00 0.00 175.29 174.08 1jdb s PHE 15 N -0.92 1.60 -0.26 0.91 0.40 -0.02 -4.99 117.98 114.70 1jdb s PHE 15 Ca 0.15 -1.38 -0.18 0.00 -0.60 0.00 0.00 56.93 54.92 1jdb s PHE 15 Cb -0.11 -1.41 -0.03 0.00 0.51 0.00 0.00 43.02 41.99 1jdb s PHE 15 CO 0.05 -0.74 0.51 -1.01 0.70 0.00 0.00 175.22 174.74 1jdb s HIS 16 N 1.66 3.27 0.00 0.36 3.76 -1.26 -1.15 115.29 121.93 1jdb s HIS 16 Ca 0.02 0.64 0.00 0.00 -0.15 0.00 0.00 55.06 55.57 1jdb s HIS 16 Cb -0.18 -2.72 0.00 0.00 1.11 0.00 0.00 32.58 30.80 1jdb s HIS 16 CO -0.13 -0.28 0.00 0.41 -0.85 0.00 0.00 174.74 173.89 1jdb n GLY 17 N 4.38 5.44 2.93 -2.22 0.00 -0.33 -4.71 105.19 110.68 1jdb n GLY 17 Ca -0.04 -1.22 -0.17 0.00 0.00 0.00 0.00 46.02 44.58 1jdb n GLY 17 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1jdb s ARG 18 N 3.18 0.51 0.14 1.61 3.52 -0.83 -3.02 118.95 124.06 1jdb s ARG 18 Ca 0.00 -0.14 -0.31 0.00 -0.13 0.00 0.00 55.73 55.16 1jdb s ARG 18 Cb 0.00 -0.53 -0.08 0.00 -1.56 0.00 0.00 34.95 32.78 1jdb s ARG 18 CO 0.00 0.04 1.37 0.00 -0.81 0.00 0.00 175.30 175.90 1jdb s ALA 19 N 0.27 3.58 0.00 6.12 0.00 0.25 -1.37 121.76 130.61 1jdb s ALA 19 Ca -0.03 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1jdb s ALA 19 Cb -0.07 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1jdb s ALA 19 CO -0.00 -0.60 0.37 0.44 0.00 0.00 0.00 175.76 175.97 1jdb n ILE 20 N 3.51 0.08 -0.09 0.00 -5.35 -0.75 -4.89 119.36 111.87 1jdb n ILE 20 Ca 0.10 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.23 1jdb n ILE 20 Cb 0.42 1.29 0.00 0.00 -1.74 0.00 0.00 39.64 39.61 1jdb n ILE 20 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1jdb n GLY 21 N -0.04 5.51 3.78 3.28 0.00 -1.22 -4.46 105.19 112.03 1jdb n GLY 21 Ca 0.00 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.53 1jdb n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jdb s ALA 22 N -2.00 2.39 0.12 4.61 0.00 0.68 -4.76 121.76 122.81 1jdb s ALA 22 Ca 0.00 0.32 -0.25 0.00 0.00 0.00 0.00 51.96 52.03 1jdb s ALA 22 Cb 0.00 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.78 1jdb s ALA 22 CO 0.00 -1.52 0.78 0.99 0.00 0.00 0.00 175.76 176.01 1jdb s THR 23 N -2.76 4.50 -5.00 0.00 2.01 -1.26 -4.34 115.64 108.79 1jdb s THR 23 Ca 0.62 1.69 0.00 0.00 0.31 0.00 0.00 61.69 64.31 1jdb s THR 23 Cb -0.17 -4.14 0.00 0.00 0.01 0.00 0.00 72.50 68.20 1jdb s THR 23 CO 0.51 0.46 0.00 0.61 -0.69 0.00 0.00 174.62 175.51 1jdb n GLY 24 N 1.90 0.75 3.23 4.40 0.00 0.22 -4.93 105.19 110.76 1jdb n GLY 24 Ca -0.04 -1.68 -0.23 0.00 0.00 0.00 0.00 46.02 44.06 1jdb n GLY 24 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jdb s SER 25 N -4.00 2.27 -0.00 1.61 0.01 -1.25 0.14 113.70 112.47 1jdb s SER 25 Ca 0.00 -0.56 -0.02 0.00 1.31 0.00 0.00 55.95 56.68 1jdb s SER 25 Cb 0.00 -0.16 -0.00 0.00 0.21 0.00 0.00 66.02 66.07 1jdb s SER 25 CO 0.00 0.09 0.04 0.00 0.41 0.00 0.00 173.24 173.78 1jdb s ALA 26 N -0.94 -0.08 0.01 1.44 0.00 0.01 -4.91 121.76 117.29 1jdb s ALA 26 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.86 1jdb s ALA 26 Cb -0.09 0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 1jdb s ALA 26 CO 0.02 -0.11 -0.02 0.08 0.00 0.00 0.00 175.76 175.74 1jdb s VAL 27 N -0.74 0.10 -2.28 0.00 1.01 -1.26 -0.37 120.40 116.86 1jdb s VAL 27 Ca -0.08 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1jdb s VAL 27 Cb -0.05 -0.14 0.00 0.00 0.00 0.00 0.00 36.38 36.19 1jdb s VAL 27 CO -0.00 -0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.56 1jdb n GLY 28 N 2.56 -1.50 3.72 4.51 0.00 -0.96 -4.73 105.19 108.80 1jdb n GLY 28 Ca -0.16 -1.04 -0.40 0.00 0.00 0.00 0.00 46.02 44.42 1jdb n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jdb s GLU 29 N -1.25 4.43 -0.12 1.61 2.12 -0.67 -0.07 118.70 124.76 1jdb s GLU 29 Ca 0.00 0.87 -0.20 0.00 0.36 0.00 0.00 54.97 55.99 1jdb s GLU 29 Cb 0.00 -3.43 -0.04 0.00 0.26 0.00 0.00 34.13 30.92 1jdb s GLU 29 CO 0.00 0.11 0.57 0.08 -0.54 0.00 0.00 175.26 175.48 1jdb s VAL 30 N 0.66 5.12 0.18 3.70 1.01 0.16 -0.24 120.40 130.98 1jdb s VAL 30 Ca 0.37 1.13 0.07 0.00 0.00 0.00 0.00 61.98 63.55 1jdb s VAL 30 Cb -0.18 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 1jdb s VAL 30 CO 0.18 0.26 -0.13 0.68 0.00 0.00 0.00 175.10 176.09 1jdb s VAL 31 N 0.92 1.54 0.01 2.92 -7.23 -0.76 -3.87 120.40 113.94 1jdb s VAL 31 Ca 0.30 -2.14 0.08 0.00 -1.81 0.00 0.00 61.98 58.41 1jdb s VAL 31 Cb -0.16 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.80 1jdb s VAL 31 CO 0.13 -0.64 -0.25 0.72 -0.31 0.00 0.00 175.10 174.75 1jdb s PHE 32 N -3.04 2.37 -0.08 2.82 -0.12 -1.26 -0.17 117.98 118.49 1jdb s PHE 32 Ca 0.20 -0.40 0.02 0.00 -0.05 0.00 0.00 56.93 56.70 1jdb s PHE 32 Cb 0.00 -1.46 0.02 0.00 -0.63 0.00 0.00 43.02 40.95 1jdb s PHE 32 CO 0.05 0.07 -0.12 1.21 -0.05 0.00 0.00 175.22 176.38 1jdb s ASN 33 N -0.96 1.92 0.00 1.98 3.84 0.89 -4.46 114.94 118.15 1jdb s ASN 33 Ca 0.11 -0.31 0.18 0.00 0.21 0.00 0.00 52.86 53.05 1jdb s ASN 33 Cb -0.10 -0.86 0.76 0.00 -0.55 0.00 0.00 41.25 40.50 1jdb s ASN 33 CO 0.01 0.00 1.53 0.35 -2.79 0.00 0.00 177.10 176.20 1jdb n THR 34 N 4.08 0.16 -1.96 -5.21 -2.24 -0.87 -2.00 114.28 106.24 1jdb n THR 34 Ca -0.20 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 60.92 1jdb n THR 34 Cb 0.51 0.14 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 1jdb n THR 34 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1jdb s SER 35 N -1.48 6.64 0.21 3.42 0.01 -1.26 -4.76 113.70 116.48 1jdb s SER 35 Ca 0.28 2.31 0.25 0.00 1.31 0.00 0.00 55.95 60.10 1jdb s SER 35 Cb 0.14 -2.54 0.90 0.00 0.21 0.00 0.00 66.02 64.74 1jdb s SER 35 CO 0.22 -0.93 1.74 0.23 0.41 0.00 0.00 173.24 174.91 1jdb n MET 36 N 7.00 0.21 -4.04 12.44 2.81 -1.26 -4.66 117.12 129.61 1jdb n MET 36 Ca 0.17 0.30 -0.09 0.00 -1.81 0.00 0.00 57.70 56.27 1jdb n MET 36 Cb 0.42 -1.80 -0.09 0.00 -0.71 0.00 0.00 33.22 31.04 1jdb n MET 36 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1jdb s THR 37 N -3.19 0.10 0.00 2.03 -4.23 -1.26 -4.98 115.64 104.11 1jdb s THR 37 Ca 0.08 -1.63 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1jdb s THR 37 Cb 0.11 -1.87 0.00 0.00 1.34 0.00 0.00 72.50 72.09 1jdb s THR 37 CO 0.49 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 1jdb n GLY 38 N -0.13 0.74 0.37 3.99 0.00 -1.26 -4.84 105.19 104.06 1jdb n GLY 38 Ca -0.08 -0.23 0.10 0.00 0.00 0.00 0.00 46.02 45.81 1jdb n GLY 38 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1jdb h TYR 39 N 0.00 0.92 -0.17 1.61 -0.00 -1.94 -1.06 116.97 116.33 1jdb h TYR 39 Ca 0.00 0.03 -0.15 0.00 0.00 0.00 0.00 58.73 58.61 1jdb h TYR 39 Cb 0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 36.73 36.43 1jdb h TYR 39 CO 0.00 0.36 -0.52 0.37 -0.00 0.00 0.00 178.16 178.37 1jdb h GLN 40 N 0.80 0.49 -0.33 0.10 4.15 -1.91 -2.02 115.11 116.38 1jdb h GLN 40 Ca 0.45 -0.29 -0.10 0.00 0.77 0.00 0.00 58.65 59.48 1jdb h GLN 40 Cb 0.60 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.30 1jdb h GLN 40 CO -0.21 0.89 -0.19 0.93 -1.93 0.00 0.00 178.83 178.32 1jdb h GLU 41 N 0.38 0.62 -0.26 1.69 3.07 -1.44 -2.20 114.58 116.43 1jdb h GLU 41 Ca 0.01 -0.22 -0.08 0.00 -0.50 0.00 0.00 59.36 58.57 1jdb h GLU 41 Cb 1.04 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.90 1jdb h GLU 41 CO 0.09 0.77 -0.16 0.82 -1.40 0.00 0.00 179.01 179.14 1jdb h ILE 42 N 0.55 1.30 -0.76 3.13 2.04 -1.04 -2.72 117.51 120.02 1jdb h ILE 42 Ca 0.09 -1.26 -0.04 0.00 1.00 0.00 0.00 64.86 64.64 1jdb h ILE 42 Cb 0.63 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 1jdb h ILE 42 CO 0.04 0.40 0.31 -0.07 0.00 0.00 0.00 178.15 178.83 1jdb h LEU 43 N 0.29 1.03 -0.64 1.44 3.38 -1.20 -2.44 115.31 117.19 1jdb h LEU 43 Ca 0.05 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1jdb h LEU 43 Cb 0.68 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1jdb h LEU 43 CO 0.04 0.91 0.00 0.35 0.09 0.00 0.00 178.44 179.84 1jdb n THR 44 N -4.29 0.12 -2.63 0.22 -2.24 -0.84 -1.57 114.28 103.05 1jdb n THR 44 Ca 0.07 -0.20 -0.43 0.00 -2.27 0.00 0.00 64.05 61.22 1jdb n THR 44 Cb 0.18 0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.48 1jdb n THR 44 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1jdb s ASP 45 N -1.59 7.14 0.40 3.42 -1.08 -0.92 -3.17 116.67 120.86 1jdb s ASP 45 Ca 0.31 1.52 0.09 0.00 -0.52 0.00 0.00 52.55 53.95 1jdb s ASP 45 Cb 0.16 -2.55 0.86 0.00 -1.46 0.00 0.00 42.92 39.93 1jdb s ASP 45 CO 0.25 -0.58 1.99 -0.65 0.52 0.00 0.00 175.17 176.70 1jdb h PRO 46 N 7.37 0.58 0.00 4.34 0.11 -1.89 -2.33 132.00 140.19 1jdb h PRO 46 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1jdb h PRO 46 Cb 1.11 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1jdb h PRO 46 CO 0.92 0.38 0.44 0.77 -0.21 0.00 0.00 178.00 180.30 1jdb h SER 47 N 0.60 0.00 -0.30 -2.05 0.02 -1.85 0.36 113.55 110.33 1jdb h SER 47 Ca 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1jdb h SER 47 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1jdb h SER 47 CO -0.08 0.00 0.00 -1.22 -1.14 0.00 0.00 176.83 174.39 1jdb n TYR 48 N -2.20 0.39 -1.63 3.45 4.01 -0.87 -4.27 117.16 116.03 1jdb n TYR 48 Ca -0.01 -0.19 -0.47 0.00 -0.16 0.00 0.00 57.90 57.07 1jdb n TYR 48 Cb 0.46 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.46 1jdb n TYR 48 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1jdb n SER 49 N 0.61 2.05 -1.32 7.72 2.88 0.13 -2.13 113.62 123.56 1jdb n SER 49 Ca 0.15 1.14 -0.15 0.00 -1.33 0.00 0.00 58.87 58.68 1jdb n SER 49 Cb 0.36 -1.33 -0.05 0.00 -0.75 0.00 0.00 64.21 62.44 1jdb n SER 49 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1jdb n ARG 50 N 1.83 -1.11 -4.21 -1.46 5.12 -1.25 -4.79 116.66 110.79 1jdb n ARG 50 Ca 0.13 0.98 -0.20 0.00 -1.93 0.00 0.00 57.85 56.83 1jdb n ARG 50 Cb 0.28 -5.18 -0.12 0.00 -1.16 0.00 0.00 32.46 26.28 1jdb n ARG 50 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1jdb s GLN 51 N -3.64 0.90 -0.32 5.56 -0.21 -0.91 -1.67 119.66 119.37 1jdb s GLN 51 Ca 0.00 -0.99 -0.11 0.00 0.02 0.00 0.00 55.36 54.28 1jdb s GLN 51 Cb 0.00 -0.96 -0.02 0.00 1.00 0.00 0.00 33.01 33.03 1jdb s GLN 51 CO 0.00 0.22 0.19 0.42 -2.12 0.00 0.00 175.29 174.00 1jdb s ILE 52 N -1.22 4.97 -0.20 1.08 1.01 0.66 -0.09 121.20 127.40 1jdb s ILE 52 Ca 0.00 -0.26 -0.19 0.00 0.00 0.00 0.00 60.65 60.20 1jdb s ILE 52 Cb -0.10 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 1jdb s ILE 52 CO 0.03 0.06 0.56 -0.69 0.00 0.00 0.00 174.94 174.89 1jdb s VAL 53 N 1.68 5.07 -0.20 2.92 1.01 -0.29 -1.83 120.40 128.76 1jdb s VAL 53 Ca 0.06 1.04 -0.07 0.00 0.00 0.00 0.00 61.98 63.00 1jdb s VAL 53 Cb -0.17 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 1jdb s VAL 53 CO 0.09 0.15 0.05 -0.89 0.00 0.00 0.00 175.10 174.50 1jdb s THR 54 N 1.74 4.52 -0.19 3.92 2.01 0.76 -0.17 115.64 128.22 1jdb s THR 54 Ca 0.26 -0.12 -0.07 0.00 0.31 0.00 0.00 61.69 62.07 1jdb s THR 54 Cb -0.16 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.26 1jdb s THR 54 CO 0.10 0.42 0.05 -0.76 -0.69 0.00 0.00 174.62 173.75 1jdb s LEU 55 N 0.77 3.70 0.23 4.42 1.43 -0.96 -0.08 118.68 128.20 1jdb s LEU 55 Ca 0.03 0.02 0.10 0.00 -1.03 0.00 0.00 54.13 53.25 1jdb s LEU 55 Cb -0.14 -1.94 0.18 0.00 0.03 0.00 0.00 46.19 44.32 1jdb s LEU 55 CO 0.02 0.14 1.50 0.71 0.23 0.00 0.00 176.35 178.95 1jdb h THR 56 N 5.00 1.44 -2.77 5.49 1.35 -1.74 -3.43 112.91 118.25 1jdb h THR 56 Ca -0.36 -2.51 -0.56 0.00 -0.55 0.00 0.00 66.41 62.43 1jdb h THR 56 Cb 1.17 2.38 -0.03 0.00 -1.73 0.00 0.00 68.15 69.95 1jdb h THR 56 CO 0.67 0.70 1.04 -0.47 -0.25 0.00 0.00 175.52 177.22 1jdb s TYR 57 N -3.26 2.30 0.31 4.73 5.04 -1.26 -4.92 117.35 120.29 1jdb s TYR 57 Ca -0.00 0.57 0.04 0.00 -2.44 0.00 0.00 57.07 55.24 1jdb s TYR 57 Cb 0.11 -3.82 0.65 0.00 0.35 0.00 0.00 41.96 39.25 1jdb s TYR 57 CO 0.77 -2.84 1.85 -1.00 -1.34 0.00 0.00 175.55 172.99 1jdb h PRO 58 N 9.54 0.86 -4.34 4.97 0.13 -1.94 -3.39 132.00 137.84 1jdb h PRO 58 Ca -0.33 -0.05 -0.74 0.00 -0.87 0.00 0.00 66.00 64.01 1jdb h PRO 58 Cb 1.14 -0.19 -0.22 0.00 0.13 0.00 0.00 31.00 31.86 1jdb h PRO 58 CO 0.98 0.57 -0.32 -1.01 -0.23 0.00 0.00 178.00 177.99 1jdb s HIS 59 N -5.86 3.24 -0.27 1.56 3.76 -1.26 -1.04 115.29 115.42 1jdb s HIS 59 Ca -0.11 -0.89 -0.06 0.00 -0.15 0.00 0.00 55.06 53.85 1jdb s HIS 59 Cb 0.22 -3.15 -0.00 0.00 1.11 0.00 0.00 32.58 30.77 1jdb s HIS 59 CO 0.80 -0.79 0.04 0.42 -0.85 0.00 0.00 174.74 174.36 1jdb s ILE 60 N 1.68 3.82 0.00 0.60 -1.09 -0.95 -4.53 121.20 120.73 1jdb s ILE 60 Ca 0.05 -0.57 0.00 0.00 -2.23 0.00 0.00 60.65 57.89 1jdb s ILE 60 Cb -0.24 -2.88 0.00 0.00 -1.58 0.00 0.00 42.46 37.76 1jdb s ILE 60 CO 0.07 0.21 0.00 0.61 -1.23 0.00 0.00 174.94 174.60 1jdb n GLY 61 N 4.85 1.22 0.39 6.18 0.00 -1.26 -4.26 105.19 112.31 1jdb n GLY 61 Ca -0.16 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.07 1jdb n GLY 61 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1jdb h ASN 62 N 0.00 0.00 -0.28 1.61 2.35 -1.83 -0.97 115.58 116.46 1jdb h ASN 62 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1jdb h ASN 62 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1jdb h ASN 62 CO 0.00 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.11 1jdb n VAL 63 N -3.92 1.43 -4.79 2.81 0.24 -1.26 0.02 118.33 112.85 1jdb n VAL 63 Ca 0.09 -1.32 0.00 0.00 -2.04 0.00 0.00 64.34 61.07 1jdb n VAL 63 Cb 0.63 0.24 0.00 0.00 -1.47 0.00 0.00 33.84 33.25 1jdb n VAL 63 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jdb n GLY 64 N 0.04 2.28 3.16 7.63 0.00 -0.37 -4.16 105.19 113.76 1jdb n GLY 64 Ca 0.14 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 1jdb n GLY 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jdb s THR 65 N 0.00 0.14 -0.13 2.61 -4.23 -0.29 -4.71 115.64 109.03 1jdb s THR 65 Ca 0.00 -1.18 -0.17 0.00 -1.18 0.00 0.00 61.69 59.15 1jdb s THR 65 Cb 0.00 -1.17 0.04 0.00 1.34 0.00 0.00 72.50 72.72 1jdb s THR 65 CO 0.00 -0.65 0.46 0.54 -0.54 0.00 0.00 174.62 174.42 1jdb s ASN 66 N -2.53 -0.44 0.51 3.99 2.20 -1.26 -0.20 114.94 117.21 1jdb s ASN 66 Ca 0.01 0.74 0.25 0.00 -0.94 0.00 0.00 52.86 52.92 1jdb s ASN 66 Cb 0.03 0.78 1.35 0.00 -2.00 0.00 0.00 41.25 41.40 1jdb s ASN 66 CO -0.08 -0.27 1.94 0.44 -2.94 0.00 0.00 177.10 176.19 1jdb h ASP 67 N 4.84 0.09 0.98 3.54 3.32 -1.98 0.13 116.42 127.35 1jdb h ASP 67 Ca -0.28 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.78 1jdb h ASP 67 Cb 1.17 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1jdb h ASP 67 CO 0.27 0.04 0.00 0.00 -1.72 0.00 0.00 179.24 177.83 1jdb h ALA 68 N 1.65 1.00 -0.52 3.45 0.00 -1.97 -2.42 119.26 120.46 1jdb h ALA 68 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1jdb h ALA 68 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1jdb h ALA 68 CO -0.04 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.96 1jdb n ASP 69 N -2.70 4.87 -4.63 0.00 9.92 0.47 -4.85 116.55 119.63 1jdb n ASP 69 Ca 0.02 -2.69 -0.39 0.00 -0.53 0.00 0.00 54.79 51.19 1jdb n ASP 69 Cb 0.29 -0.63 -0.08 0.00 -0.64 0.00 0.00 41.12 40.06 1jdb n ASP 69 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1jdb s GLU 70 N -2.33 4.09 0.00 -1.24 2.02 -0.91 -3.31 118.70 117.01 1jdb s GLU 70 Ca 0.46 0.20 0.30 0.00 0.02 0.00 0.00 54.97 55.95 1jdb s GLU 70 Cb 0.34 -3.61 1.40 0.00 0.10 0.00 0.00 34.13 32.36 1jdb s GLU 70 CO 0.16 -0.23 1.95 0.39 0.02 0.00 0.00 175.26 177.55 1jdb n GLU 71 N 5.12 1.02 -2.39 1.61 -0.58 -1.26 -4.85 120.64 119.30 1jdb n GLU 71 Ca -0.07 -0.33 -0.04 0.00 -0.42 0.00 0.00 57.16 56.31 1jdb n GLU 71 Cb 0.50 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.89 1jdb n GLU 71 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1jdb n SER 72 N -0.70 -1.03 0.23 1.62 3.41 -1.19 -0.66 113.62 115.29 1jdb n SER 72 Ca 0.19 -1.68 0.14 0.00 -0.26 0.00 0.00 58.87 57.26 1jdb n SER 72 Cb 0.24 1.71 0.45 0.00 -0.26 0.00 0.00 64.21 66.35 1jdb n SER 72 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1jdb h SER 73 N 0.95 0.00 -5.59 4.04 4.64 -1.91 -3.46 113.55 112.22 1jdb h SER 73 Ca -0.15 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.87 1jdb h SER 73 Cb 0.59 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.58 1jdb h SER 73 CO 0.20 0.00 -0.29 0.00 -0.87 0.00 0.00 176.83 175.87 1jdb s GLN 74 N -3.41 1.79 -0.41 4.77 -2.07 -1.26 -5.09 119.66 113.97 1jdb s GLN 74 Ca 0.04 -1.76 -0.24 0.00 -1.82 0.00 0.00 55.36 51.58 1jdb s GLN 74 Cb 0.08 0.41 0.02 0.00 -1.09 0.00 0.00 33.01 32.42 1jdb s GLN 74 CO 0.58 -0.72 0.84 0.08 -1.32 0.00 0.00 175.29 174.75 1jdb s VAL 75 N -3.30 4.63 -0.25 3.63 1.01 -1.26 -4.30 120.40 120.55 1jdb s VAL 75 Ca 0.33 0.76 0.22 0.00 0.00 0.00 0.00 61.98 63.29 1jdb s VAL 75 Cb 0.01 -4.31 0.03 0.00 0.00 0.00 0.00 36.38 32.11 1jdb s VAL 75 CO 0.20 -0.62 1.10 0.45 0.00 0.00 0.00 175.10 176.23 1jdb h HIS 76 N 8.77 0.00 -3.84 5.22 -0.00 -1.51 -3.47 115.15 120.32 1jdb h HIS 76 Ca -0.24 0.00 -0.52 0.00 -0.00 0.00 0.00 60.37 59.60 1jdb h HIS 76 Cb 1.09 0.00 0.07 0.00 -0.00 0.00 0.00 27.41 28.56 1jdb h HIS 76 CO 0.82 0.04 0.65 0.00 -0.00 0.00 0.00 177.93 179.44 1jdb s ALA 77 N -3.32 3.51 0.33 2.45 0.00 -1.15 -3.59 121.76 119.98 1jdb s ALA 77 Ca 0.00 1.27 0.12 0.00 0.00 0.00 0.00 51.96 53.36 1jdb s ALA 77 Cb 0.09 -3.49 0.59 0.00 0.00 0.00 0.00 23.12 20.31 1jdb s ALA 77 CO 0.78 -0.66 1.74 0.37 0.00 0.00 0.00 175.76 177.99 1jdb h GLN 78 N 3.53 0.00 -2.43 0.00 5.75 -0.67 -3.47 115.11 117.81 1jdb h GLN 78 Ca -0.49 0.00 0.16 0.00 -0.15 0.00 0.00 58.65 58.17 1jdb h GLN 78 Cb 1.23 0.00 -0.08 0.00 1.07 0.00 0.00 27.48 29.70 1jdb h GLN 78 CO 0.66 0.46 0.45 0.20 -2.65 0.00 0.00 178.83 177.96 1jdb s GLY 79 N -4.37 -0.23 -0.04 2.39 0.00 -1.23 -4.33 107.32 99.51 1jdb s GLY 79 Ca -0.02 0.10 0.02 0.00 0.00 0.00 0.00 44.72 44.82 1jdb s GLY 79 CO 0.74 0.00 -0.06 -2.27 0.00 0.00 0.00 173.10 171.51 1jdb s LEU 80 N -2.92 1.54 -0.16 0.66 2.96 -1.17 -1.14 118.68 118.45 1jdb s LEU 80 Ca 0.12 -0.15 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 1jdb s LEU 80 Cb -0.02 -0.48 0.01 0.00 0.50 0.00 0.00 46.19 46.20 1jdb s LEU 80 CO 0.02 -0.00 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.15 1jdb s VAL 81 N 0.60 2.10 0.21 1.68 1.01 0.76 -0.85 120.40 125.91 1jdb s VAL 81 Ca -0.09 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 60.94 1jdb s VAL 81 Cb -0.12 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 1jdb s VAL 81 CO 0.01 0.54 0.12 0.27 0.00 0.00 0.00 175.10 176.04 1jdb s ILE 82 N 1.07 0.10 -0.19 2.22 -4.36 -0.14 -2.26 121.20 117.65 1jdb s ILE 82 Ca -0.01 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 58.22 1jdb s ILE 82 Cb -0.14 -2.50 -0.21 0.00 1.25 0.00 0.00 42.46 40.86 1jdb s ILE 82 CO -0.08 -0.02 0.23 -1.14 0.24 0.00 0.00 174.94 174.17 1jdb n ARG 83 N -0.29 0.62 -3.78 0.37 3.00 -1.25 -2.23 116.66 113.09 1jdb n ARG 83 Ca 0.01 0.48 -0.13 0.00 -0.00 0.00 0.00 57.85 58.21 1jdb n ARG 83 Cb 0.66 -1.73 -0.14 0.00 0.00 0.00 0.00 32.46 31.25 1jdb n ARG 83 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1jdb s ASP 84 N -6.93 -0.07 -0.41 6.15 2.15 -0.21 0.33 116.67 117.68 1jdb s ASP 84 Ca -0.27 0.21 -0.14 0.00 0.43 0.00 0.00 52.55 52.77 1jdb s ASP 84 Cb 0.06 0.14 0.03 0.00 -0.30 0.00 0.00 42.92 42.85 1jdb s ASP 84 CO 0.64 -0.11 0.30 -0.22 -0.17 0.00 0.00 175.17 175.60 1jdb s LEU 85 N 0.79 5.11 0.79 -1.34 2.96 -1.26 -2.24 118.68 123.49 1jdb s LEU 85 Ca -0.06 -0.98 -0.14 0.00 -0.22 0.00 0.00 54.13 52.73 1jdb s LEU 85 Cb -0.08 -2.14 0.07 0.00 0.50 0.00 0.00 46.19 44.54 1jdb s LEU 85 CO -0.03 -0.46 1.22 -0.81 -1.32 0.00 0.00 176.35 174.94 1jdb n PRO 86 N 5.13 0.30 -0.23 0.98 -0.04 -1.26 -4.89 135.00 134.99 1jdb n PRO 86 Ca -0.11 0.18 0.08 0.00 -0.04 0.00 0.00 63.50 63.60 1jdb n PRO 86 Cb 0.46 -2.45 0.34 0.00 -0.04 0.00 0.00 33.50 31.82 1jdb n PRO 86 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1jdb h LEU 87 N -0.73 0.70 -8.26 1.53 3.38 -1.97 -3.44 115.31 106.51 1jdb h LEU 87 Ca -0.47 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.37 1jdb h LEU 87 Cb 1.30 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 41.79 1jdb h LEU 87 CO 0.47 0.42 -0.47 0.27 0.09 0.00 0.00 178.44 179.22 1jdb s ILE 88 N -5.71 0.08 -0.01 1.22 -4.36 -1.26 -5.14 121.20 106.02 1jdb s ILE 88 Ca -0.10 -1.65 -0.13 0.00 -0.26 0.00 0.00 60.65 58.52 1jdb s ILE 88 Cb 0.20 -1.97 -0.05 0.00 1.25 0.00 0.00 42.46 41.89 1jdb s ILE 88 CO 0.78 -0.35 0.36 0.00 0.24 0.00 0.00 174.94 175.97 1jdb s ALA 89 N -4.01 3.73 -0.38 2.27 0.00 -1.26 -4.67 121.76 117.44 1jdb s ALA 89 Ca 0.21 -0.31 0.02 0.00 0.00 0.00 0.00 51.96 51.89 1jdb s ALA 89 Cb 0.05 -2.30 0.16 0.00 0.00 0.00 0.00 23.12 21.03 1jdb s ALA 89 CO 0.02 0.52 0.30 0.45 0.00 0.00 0.00 175.76 177.04 1jdb s SER 90 N -1.16 1.96 -0.29 0.00 0.15 0.10 -4.89 113.70 109.58 1jdb s SER 90 Ca 0.23 -2.47 -0.17 0.00 0.70 0.00 0.00 55.95 54.24 1jdb s SER 90 Cb -0.16 -0.22 0.13 0.00 -1.71 0.00 0.00 66.02 64.06 1jdb s SER 90 CO 0.12 -0.24 0.91 0.21 1.20 0.00 0.00 173.24 175.45 1jdb s ASN 91 N 0.69 -0.61 0.63 5.45 3.84 -1.26 -4.70 114.94 118.97 1jdb s ASN 91 Ca 0.25 0.99 0.26 0.00 0.21 0.00 0.00 52.86 54.57 1jdb s ASN 91 Cb -0.10 1.22 1.36 0.00 -0.55 0.00 0.00 41.25 43.17 1jdb s ASN 91 CO -0.08 -0.16 1.78 2.19 -2.79 0.00 0.00 177.10 178.04 1jdb h PHE 92 N 6.04 0.00 0.00 0.43 -0.00 -1.98 0.47 116.94 121.90 1jdb h PHE 92 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.68 1jdb h PHE 92 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.15 1jdb h PHE 92 CO 0.13 0.00 -0.55 0.54 -0.00 0.00 0.00 178.31 178.43 1jdb n ARG 93 N -3.23 0.16 -1.99 6.09 1.74 -1.26 -4.93 116.66 113.24 1jdb n ARG 93 Ca 0.05 0.04 -0.41 0.00 -0.77 0.00 0.00 57.85 56.76 1jdb n ARG 93 Cb 0.65 -1.60 -0.02 0.00 -1.02 0.00 0.00 32.46 30.47 1jdb n ARG 93 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1jdb s ASN 94 N -3.65 6.62 0.00 0.55 2.47 0.15 -4.48 114.94 116.60 1jdb s ASN 94 Ca 0.09 2.72 0.00 0.00 0.42 0.00 0.00 52.86 56.09 1jdb s ASN 94 Cb 0.15 -2.63 0.00 0.00 -1.45 0.00 0.00 41.25 37.32 1jdb s ASN 94 CO 0.70 -0.71 0.00 0.35 -3.72 0.00 0.00 177.10 173.72 1jdb n THR 95 N 1.99 0.00 -3.61 -5.21 -2.24 0.73 -4.94 114.28 100.99 1jdb n THR 95 Ca 0.06 -0.37 -0.01 0.00 -2.27 0.00 0.00 64.05 61.46 1jdb n THR 95 Cb 0.40 0.93 -0.06 0.00 -2.10 0.00 0.00 70.33 69.50 1jdb n THR 95 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1jdb s GLU 96 N -0.93 0.28 0.61 -0.78 2.12 -1.16 -4.99 118.70 113.85 1jdb s GLU 96 Ca 0.00 0.51 -0.19 0.00 0.36 0.00 0.00 54.97 55.66 1jdb s GLU 96 Cb 0.00 0.09 -0.04 0.00 0.26 0.00 0.00 34.13 34.45 1jdb s GLU 96 CO 0.00 -0.06 1.12 -0.40 -0.54 0.00 0.00 175.26 175.38 1jdb n ASP 97 N 3.69 1.43 -0.03 -1.70 5.75 -1.26 -1.14 116.55 123.29 1jdb n ASP 97 Ca -0.17 0.84 -0.08 0.00 -0.01 0.00 0.00 54.79 55.36 1jdb n ASP 97 Cb 0.57 -1.47 -0.02 0.00 -1.03 0.00 0.00 41.12 39.17 1jdb n ASP 97 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1jdb h LEU 98 N 0.62 -0.56 -0.93 -2.12 5.85 -1.84 -1.40 115.31 114.93 1jdb h LEU 98 Ca -0.49 0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.38 1jdb h LEU 98 Cb 1.35 0.27 -0.06 0.00 0.37 0.00 0.00 40.66 42.60 1jdb h LEU 98 CO 0.52 -0.22 0.60 -1.28 -0.34 0.00 0.00 178.44 177.73 1jdb h SER 99 N -0.18 0.99 -0.52 1.25 0.87 -1.92 -1.04 113.55 113.00 1jdb h SER 99 Ca 0.12 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 1jdb h SER 99 Cb 0.37 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 1jdb h SER 99 CO -0.31 0.67 0.28 0.28 -0.53 0.00 0.00 176.83 177.22 1jdb h SER 100 N 1.15 0.65 -0.67 6.23 0.02 -1.73 -1.69 113.55 117.51 1jdb h SER 100 Ca 0.38 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 61.18 1jdb h SER 100 Cb 0.04 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.38 1jdb h SER 100 CO -0.13 0.56 0.20 0.22 -1.14 0.00 0.00 176.83 176.54 1jdb h TYR 101 N 0.69 1.08 -0.39 3.45 3.20 -0.64 -1.39 116.97 122.97 1jdb h TYR 101 Ca 0.18 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 1jdb h TYR 101 Cb 0.05 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 37.99 1jdb h TYR 101 CO -0.02 0.88 0.14 -0.07 -1.64 0.00 0.00 178.16 177.45 1jdb h LEU 102 N 0.97 0.56 -0.23 2.82 3.38 -1.06 -1.40 115.31 120.36 1jdb h LEU 102 Ca 0.21 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1jdb h LEU 102 Cb 0.31 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1jdb h LEU 102 CO -0.01 0.60 0.07 0.11 0.09 0.00 0.00 178.44 179.30 1jdb h LYS 103 N 0.49 0.16 -0.74 1.13 1.57 -1.06 0.13 116.57 118.26 1jdb h LYS 103 Ca 0.13 -0.01 0.16 0.00 -1.87 0.00 0.00 60.65 59.06 1jdb h LYS 103 Cb 0.23 -0.04 -0.11 0.00 0.08 0.00 0.00 32.23 32.39 1jdb h LYS 103 CO -0.01 0.11 0.16 -0.09 -0.57 0.00 0.00 179.45 179.05 1jdb h ARG 104 N 0.17 0.24 -0.09 3.15 2.43 -0.98 0.44 114.38 119.74 1jdb h ARG 104 Ca 0.10 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1jdb h ARG 104 Cb 0.08 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1jdb h ARG 104 CO -0.11 0.16 0.00 0.72 -1.51 0.00 0.00 179.97 179.23 1jdb n HIS 105 N -5.18 0.10 -3.71 2.20 8.25 -0.55 -4.94 115.22 111.40 1jdb n HIS 105 Ca 0.14 -0.05 -0.25 0.00 -0.26 0.00 0.00 57.72 57.31 1jdb n HIS 105 Cb 0.47 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.64 1jdb n HIS 105 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1jdb n ASN 106 N 0.07 -4.09 -4.61 0.41 3.02 0.15 -4.95 115.26 105.28 1jdb n ASN 106 Ca 0.17 -0.70 -0.39 0.00 -0.03 0.00 0.00 54.58 53.64 1jdb n ASN 106 Cb 0.30 -4.44 -0.09 0.00 -0.61 0.00 0.00 39.78 34.94 1jdb n ASN 106 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1jdb s ILE 107 N -3.39 5.18 0.04 2.41 -1.09 -0.04 -4.79 121.20 119.52 1jdb s ILE 107 Ca 0.40 0.56 -0.31 0.00 -2.23 0.00 0.00 60.65 59.08 1jdb s ILE 107 Cb -0.19 -3.69 -0.06 0.00 -1.58 0.00 0.00 42.46 36.93 1jdb s ILE 107 CO 0.78 0.17 1.35 -0.69 -1.23 0.00 0.00 174.94 175.31 1jdb s VAL 108 N 2.01 3.68 0.01 2.92 1.01 -1.26 -0.23 120.40 128.55 1jdb s VAL 108 Ca 0.15 1.15 -0.02 0.00 0.00 0.00 0.00 61.98 63.25 1jdb s VAL 108 Cb -0.16 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 1jdb s VAL 108 CO 0.10 0.04 0.03 0.00 0.00 0.00 0.00 175.10 175.27 1jdb s ALA 109 N 1.73 -0.04 0.03 5.51 0.00 -1.26 -3.05 121.76 124.67 1jdb s ALA 109 Ca 0.63 -0.35 0.05 0.00 0.00 0.00 0.00 51.96 52.29 1jdb s ALA 109 Cb -0.32 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1jdb s ALA 109 CO 0.28 -0.15 -0.14 -1.50 0.00 0.00 0.00 175.76 174.25 1jdb s ILE 110 N -1.19 1.09 0.35 0.00 2.07 -0.03 -1.81 121.20 121.68 1jdb s ILE 110 Ca -0.13 -0.89 0.04 0.00 -1.41 0.00 0.00 60.65 58.25 1jdb s ILE 110 Cb -0.08 -0.97 -0.05 0.00 0.13 0.00 0.00 42.46 41.49 1jdb s ILE 110 CO -0.00 0.07 0.08 0.00 -1.91 0.00 0.00 174.94 173.18 1jdb s ALA 111 N -0.72 2.53 -0.89 1.50 0.00 -0.47 -0.96 121.76 122.75 1jdb s ALA 111 Ca 0.02 -1.77 -0.00 0.00 0.00 0.00 0.00 51.96 50.21 1jdb s ALA 111 Cb -0.07 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.74 1jdb s ALA 111 CO 0.01 -0.32 0.01 -0.25 0.00 0.00 0.00 175.76 175.21 1jdb n ASP 112 N -0.86 -3.48 -4.56 0.00 8.00 0.15 -1.97 116.55 113.83 1jdb n ASP 112 Ca -0.04 -0.02 -0.25 0.00 0.71 0.00 0.00 54.79 55.20 1jdb n ASP 112 Cb 0.66 -2.72 -0.10 0.00 -0.02 0.00 0.00 41.12 38.95 1jdb n ASP 112 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1jdb s ILE 113 N -2.54 2.50 -1.17 0.53 -5.25 -1.21 -4.66 121.20 109.41 1jdb s ILE 113 Ca 0.01 -2.17 -0.21 0.00 -0.99 0.00 0.00 60.65 57.29 1jdb s ILE 113 Cb -0.00 -2.62 0.01 0.00 2.95 0.00 0.00 42.46 42.79 1jdb s ILE 113 CO 0.01 -0.26 1.77 -0.62 -1.79 0.00 0.00 174.94 174.04 1jdb s ASP 114 N -3.62 6.06 0.47 4.36 -1.08 -1.26 -4.48 116.67 117.12 1jdb s ASP 114 Ca 0.32 -1.85 0.31 0.00 -0.52 0.00 0.00 52.55 50.82 1jdb s ASP 114 Cb -0.01 -2.58 1.39 0.00 -1.46 0.00 0.00 42.92 40.26 1jdb s ASP 114 CO 0.17 -1.96 1.94 0.71 0.52 0.00 0.00 175.17 176.55 1jdb h THR 115 N 6.15 0.00 -0.07 1.71 1.35 -1.93 -2.01 112.91 118.10 1jdb h THR 115 Ca 0.30 -0.33 -0.14 0.00 -0.55 0.00 0.00 66.41 65.69 1jdb h THR 115 Cb 0.93 1.21 0.01 0.00 -1.73 0.00 0.00 68.15 68.57 1jdb h THR 115 CO 1.36 0.00 -0.51 -0.09 -0.25 0.00 0.00 175.52 176.03 1jdb h ARG 116 N 0.00 0.47 -0.85 4.72 2.43 -1.91 -0.80 114.38 118.44 1jdb h ARG 116 Ca 0.00 -0.41 0.01 0.00 -0.81 0.00 0.00 59.98 58.77 1jdb h ARG 116 Cb 0.37 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 1jdb h ARG 116 CO 0.00 1.05 0.56 -0.22 -1.51 0.00 0.00 179.97 179.86 1jdb h LYS 117 N 0.03 1.11 0.10 0.20 3.64 -1.81 -1.21 116.57 118.63 1jdb h LYS 117 Ca -0.04 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1jdb h LYS 117 Cb 1.17 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 1jdb h LYS 117 CO 0.10 0.74 -0.05 1.25 -2.27 0.00 0.00 179.45 179.22 1jdb h LEU 118 N 1.15 -0.11 -0.54 5.20 5.85 -1.31 -2.01 115.31 123.53 1jdb h LEU 118 Ca 0.32 -0.08 0.08 0.00 0.84 0.00 0.00 57.88 59.04 1jdb h LEU 118 Cb -0.12 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 40.87 1jdb h LEU 118 CO -0.07 0.00 0.17 0.74 -0.34 0.00 0.00 178.44 178.95 1jdb h THR 119 N -0.22 0.77 -0.61 1.05 2.02 -0.84 -1.27 112.91 113.81 1jdb h THR 119 Ca -0.01 -0.12 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 1jdb h THR 119 Cb 0.18 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 1jdb h THR 119 CO 0.02 0.06 0.14 0.03 0.37 0.00 0.00 175.52 176.14 1jdb h ARG 120 N 0.34 0.96 -0.43 6.66 3.08 -1.14 0.14 114.38 123.99 1jdb h ARG 120 Ca 0.27 -0.22 -0.12 0.00 0.07 0.00 0.00 59.98 59.98 1jdb h ARG 120 Cb 0.33 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1jdb h ARG 120 CO -0.30 0.86 -0.21 1.25 -1.07 0.00 0.00 179.97 180.50 1jdb h LEU 121 N 0.92 0.94 -0.61 3.04 5.85 -0.66 -0.68 115.31 124.11 1jdb h LEU 121 Ca 0.19 -0.40 -0.13 0.00 0.84 0.00 0.00 57.88 58.38 1jdb h LEU 121 Cb 0.34 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1jdb h LEU 121 CO 0.00 1.13 -0.29 -0.07 -0.34 0.00 0.00 178.44 178.88 1jdb h LEU 122 N 0.74 0.82 -0.22 2.25 3.38 -0.97 0.57 115.31 121.88 1jdb h LEU 122 Ca 0.10 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 1jdb h LEU 122 Cb 0.78 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1jdb h LEU 122 CO 0.06 1.05 -0.02 -0.09 0.09 0.00 0.00 178.44 179.53 1jdb h ARG 123 N 0.68 0.40 -0.11 1.13 2.43 -0.59 0.31 114.38 118.63 1jdb h ARG 123 Ca 0.08 -0.14 -0.16 0.00 -0.81 0.00 0.00 59.98 58.94 1jdb h ARG 123 Cb 0.82 -0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.35 1jdb h ARG 123 CO 0.07 0.62 -0.57 0.93 -1.51 0.00 0.00 179.97 179.50 1jdb h GLU 124 N 0.15 0.59 -0.01 0.20 4.39 -1.02 -3.36 114.58 115.53 1jdb h GLU 124 Ca 0.06 -0.48 0.00 0.00 0.34 0.00 0.00 59.36 59.28 1jdb h GLU 124 Cb 0.45 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1jdb h GLU 124 CO 0.02 1.10 -0.46 1.63 -1.16 0.00 0.00 179.01 180.14 1jdb n LYS 125 N -4.16 1.66 0.00 2.33 5.02 0.18 -5.09 118.16 118.10 1jdb n LYS 125 Ca -0.08 -0.60 0.00 0.00 -2.02 0.00 0.00 58.31 55.61 1jdb n LYS 125 Cb 0.64 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 34.36 1jdb n LYS 125 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jdb n GLY 126 N 1.24 0.79 3.60 0.72 0.00 0.10 -4.98 105.19 106.65 1jdb n GLY 126 Ca 0.06 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.79 1jdb n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jdb n ALA 127 N 1.18 0.10 -2.64 4.61 0.00 -0.54 -4.50 120.51 118.72 1jdb n ALA 127 Ca 0.00 0.09 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 1jdb n ALA 127 Cb 0.00 -2.08 -0.09 0.00 0.00 0.00 0.00 19.45 17.28 1jdb n ALA 127 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1jdb s GLN 128 N -2.41 0.59 0.21 0.00 -0.21 -1.25 -5.02 119.66 111.57 1jdb s GLN 128 Ca 0.70 -0.82 -0.09 0.00 0.02 0.00 0.00 55.36 55.17 1jdb s GLN 128 Cb -0.47 0.23 -0.07 0.00 1.00 0.00 0.00 33.01 33.70 1jdb s GLN 128 CO 0.52 -0.14 0.53 -0.80 -2.12 0.00 0.00 175.29 173.27 1jdb s ASN 129 N -2.24 6.62 0.29 5.90 0.01 -1.26 0.38 114.94 124.63 1jdb s ASN 129 Ca -0.03 0.88 -0.10 0.00 -0.71 0.00 0.00 52.86 52.90 1jdb s ASN 129 Cb -0.00 -2.21 0.00 0.00 0.41 0.00 0.00 41.25 39.45 1jdb s ASN 129 CO -0.06 -0.05 0.50 -0.83 -1.51 0.00 0.00 177.10 175.15 1jdb s GLY 130 N -2.34 0.82 -0.01 0.66 0.00 0.91 -0.91 107.32 106.45 1jdb s GLY 130 Ca 0.46 -1.07 0.02 0.00 0.00 0.00 0.00 44.72 44.13 1jdb s GLY 130 CO 0.21 -0.73 -0.07 0.00 0.00 0.00 0.00 173.10 172.52 1jdb s ILE 132 N 0.01 4.05 -0.24 0.00 1.01 0.51 -1.22 121.20 125.32 1jdb s ILE 132 Ca 0.00 -0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.37 1jdb s ILE 132 Cb -0.05 -2.81 0.04 0.00 0.01 0.00 0.00 42.46 39.65 1jdb s ILE 132 CO -0.00 0.45 -0.11 -0.63 0.00 0.00 0.00 174.94 174.65 1jdb s ILE 133 N 0.69 2.38 -0.34 2.92 1.01 -0.22 -0.81 121.20 126.83 1jdb s ILE 133 Ca -0.00 -1.30 -0.07 0.00 0.00 0.00 0.00 60.65 59.27 1jdb s ILE 133 Cb -0.14 -2.26 0.03 0.00 0.01 0.00 0.00 42.46 40.10 1jdb s ILE 133 CO 0.02 0.16 0.12 0.00 0.00 0.00 0.00 174.94 175.24 1jdb s ALA 134 N 1.21 3.10 -0.09 9.38 0.00 0.36 -1.63 121.76 134.09 1jdb s ALA 134 Ca -0.03 -1.68 -0.31 0.00 0.00 0.00 0.00 51.96 49.94 1jdb s ALA 134 Cb -0.17 -2.31 0.11 0.00 0.00 0.00 0.00 23.12 20.74 1jdb s ALA 134 CO -0.06 -1.26 1.39 0.20 0.00 0.00 0.00 175.76 176.02 1jdb s GLY 135 N 1.45 -0.29 0.18 0.00 0.00 0.10 0.68 107.32 109.45 1jdb s GLY 135 Ca -0.00 0.38 -0.26 0.00 0.00 0.00 0.00 44.72 44.84 1jdb s GLY 135 CO 0.04 4.97 1.55 -0.55 0.00 0.00 0.00 173.10 179.11 1jdb h ASP 136 N 2.00 -1.78 -2.36 1.64 3.32 -1.95 -3.32 116.42 113.96 1jdb h ASP 136 Ca -0.24 0.30 -0.57 0.00 0.02 0.00 0.00 57.03 56.54 1jdb h ASP 136 Cb 1.18 0.82 -0.38 0.00 0.22 0.00 0.00 39.33 41.18 1jdb h ASP 136 CO 0.29 -0.28 -0.94 0.20 -1.72 0.00 0.00 179.24 176.79 1jdb s ASN 137 N -5.35 1.62 0.15 6.45 -0.87 -1.26 -4.73 114.94 110.96 1jdb s ASN 137 Ca -0.13 -2.84 -0.31 0.00 -1.57 0.00 0.00 52.86 48.00 1jdb s ASN 137 Cb 0.14 -0.35 -0.10 0.00 -0.02 0.00 0.00 41.25 40.92 1jdb s ASN 137 CO 0.66 -0.20 1.62 -2.84 -2.57 0.00 0.00 177.10 173.77 1jdb s PRO 138 N 0.30 4.19 -0.49 -0.60 0.02 -1.25 -4.96 135.00 132.21 1jdb s PRO 138 Ca 0.30 2.40 -0.24 0.00 0.02 0.00 0.00 61.00 63.48 1jdb s PRO 138 Cb -0.02 -3.24 0.03 0.00 0.02 0.00 0.00 34.50 31.29 1jdb s PRO 138 CO -0.15 -0.66 0.87 0.34 -0.33 0.00 0.00 177.00 177.07 1jdb s ASP 139 N 1.45 6.41 0.38 2.53 -1.08 -1.26 -4.96 116.67 120.14 1jdb s ASP 139 Ca 0.72 -0.13 0.13 0.00 -0.52 0.00 0.00 52.55 52.75 1jdb s ASP 139 Cb -0.44 -2.42 0.77 0.00 -1.46 0.00 0.00 42.92 39.37 1jdb s ASP 139 CO 0.32 -1.06 1.85 0.00 0.52 0.00 0.00 175.17 176.80 1jdb h ALA 140 N 9.12 1.40 -0.33 3.66 0.00 -1.99 -1.65 119.26 129.46 1jdb h ALA 140 Ca -0.25 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.18 1jdb h ALA 140 Cb 1.08 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1jdb h ALA 140 CO 1.02 0.44 -0.44 0.00 0.00 0.00 0.00 179.25 180.27 1jdb h ALA 141 N 1.65 0.60 -0.20 0.00 0.00 -1.99 -2.48 119.26 116.83 1jdb h ALA 141 Ca -0.00 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 54.28 1jdb h ALA 141 Cb 0.63 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1jdb h ALA 141 CO 0.05 0.68 -0.53 1.25 0.00 0.00 0.00 179.25 180.69 1jdb h LEU 142 N 0.68 0.63 -0.76 0.00 5.85 -1.96 -1.45 115.31 118.30 1jdb h LEU 142 Ca 0.04 -0.33 -0.12 0.00 0.84 0.00 0.00 57.88 58.32 1jdb h LEU 142 Cb 1.02 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1jdb h LEU 142 CO 0.10 1.04 -0.32 0.00 -0.34 0.00 0.00 178.44 178.91 1jdb h ALA 143 N 0.98 0.93 -0.16 1.25 0.00 -1.25 0.38 119.26 121.39 1jdb h ALA 143 Ca 0.01 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 1jdb h ALA 143 Cb 1.07 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1jdb h ALA 143 CO 0.10 0.62 -0.24 1.25 0.00 0.00 0.00 179.25 180.97 1jdb h LEU 144 N 0.49 0.28 0.07 0.00 5.85 -1.30 0.33 115.31 121.03 1jdb h LEU 144 Ca 0.06 -0.08 -0.28 0.00 0.84 0.00 0.00 57.88 58.41 1jdb h LEU 144 Cb 0.80 -0.07 0.02 0.00 0.37 0.00 0.00 40.66 41.78 1jdb h LEU 144 CO 0.07 0.53 -1.20 -0.08 -0.34 0.00 0.00 178.44 177.41 1jdb h GLU 145 N 0.25 0.54 -0.56 1.25 4.81 -0.80 -0.74 114.58 119.32 1jdb h GLU 145 Ca 0.04 -0.72 -0.11 0.00 -0.13 0.00 0.00 59.36 58.44 1jdb h GLU 145 Cb 0.57 0.24 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1jdb h GLU 145 CO 0.04 1.31 -0.09 0.87 -0.73 0.00 0.00 179.01 180.41 1jdb h LYS 146 N 0.24 1.05 -0.15 1.92 1.57 0.10 0.08 116.57 121.38 1jdb h LYS 146 Ca -0.16 -0.38 -0.01 0.00 -1.87 0.00 0.00 60.65 58.22 1jdb h LYS 146 Cb 1.88 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 34.11 1jdb h LYS 146 CO 0.22 1.08 0.06 0.00 -0.57 0.00 0.00 179.45 180.24 1jdb h ALA 147 N 0.94 0.19 -0.06 3.86 0.00 -0.33 -2.95 119.26 120.92 1jdb h ALA 147 Ca 0.15 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1jdb h ALA 147 Cb 0.66 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1jdb h ALA 147 CO 0.05 -0.21 -0.31 0.00 0.00 0.00 0.00 179.25 178.78 1jdb h ARG 148 N 0.08 0.10 0.00 0.00 3.08 -0.96 -2.99 114.38 113.68 1jdb h ARG 148 Ca 0.05 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1jdb h ARG 148 Cb 0.19 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1jdb h ARG 148 CO -0.00 0.40 0.00 0.00 -1.07 0.00 0.00 179.97 179.30 1jdb h ALA 149 N 1.60 1.00 -2.53 0.04 0.00 -0.82 -3.44 119.26 115.10 1jdb h ALA 149 Ca 0.01 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.40 1jdb h ALA 149 Cb 0.59 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.43 1jdb h ALA 149 CO 0.04 0.00 1.10 0.12 0.00 0.00 0.00 179.25 180.52 1jdb s PHE 150 N -3.55 2.24 0.13 0.00 5.36 -1.13 -4.86 117.98 116.17 1jdb s PHE 150 Ca 0.03 0.01 0.34 0.00 -0.96 0.00 0.00 56.93 56.35 1jdb s PHE 150 Cb 0.08 -4.18 1.55 0.00 -0.34 0.00 0.00 43.02 40.12 1jdb s PHE 150 CO 0.57 -4.83 2.02 -1.00 -1.46 0.00 0.00 175.22 170.52 1jdb h PRO 151 N 8.36 0.00 0.00 10.12 0.13 -1.91 -3.49 132.00 145.21 1jdb h PRO 151 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1jdb h PRO 151 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1jdb h PRO 151 CO 0.95 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.13 1jdb n GLY 152 N -0.28 -0.11 0.16 1.56 0.00 -1.26 -4.75 105.19 100.50 1jdb n GLY 152 Ca -0.00 -1.63 0.04 0.00 0.00 0.00 0.00 46.02 44.43 1jdb n GLY 152 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1jdb h LEU 153 N 0.00 0.00 -9.28 0.99 4.07 -1.94 -3.42 115.31 105.73 1jdb h LEU 153 Ca 0.00 0.00 -0.54 0.00 0.08 0.00 0.00 57.88 57.42 1jdb h LEU 153 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1jdb h LEU 153 CO 0.00 0.43 1.16 0.21 -1.08 0.00 0.00 178.44 179.16 1jdb s ASN 154 N -6.41 6.52 0.00 -0.43 2.47 -1.26 -0.97 114.94 114.86 1jdb s ASN 154 Ca 0.03 2.36 0.00 0.00 0.42 0.00 0.00 52.86 55.67 1jdb s ASN 154 Cb 0.08 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.35 1jdb s ASN 154 CO 0.72 -1.03 0.00 0.61 -3.72 0.00 0.00 177.10 173.68 1jdb n GLY 155 N 4.38 0.73 3.51 1.21 0.00 -1.26 -5.04 105.19 108.72 1jdb n GLY 155 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1jdb n GLY 155 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1jdb s MET 156 N -0.57 3.68 -0.34 1.61 0.00 -0.14 -4.87 119.30 118.66 1jdb s MET 156 Ca 0.00 -0.49 -0.24 0.00 0.00 0.00 0.00 55.69 54.97 1jdb s MET 156 Cb 0.00 -3.56 0.01 0.00 0.00 0.00 0.00 34.83 31.28 1jdb s MET 156 CO 0.00 -0.26 0.80 0.34 0.00 0.00 0.00 175.02 175.90 1jdb s ASP 157 N 1.68 6.61 -0.02 1.11 -1.08 -1.26 -0.58 116.67 123.13 1jdb s ASP 157 Ca 0.06 0.51 0.14 0.00 -0.52 0.00 0.00 52.55 52.74 1jdb s ASP 157 Cb -0.16 -2.41 -0.22 0.00 -1.46 0.00 0.00 42.92 38.67 1jdb s ASP 157 CO 0.08 -0.70 0.34 0.18 0.52 0.00 0.00 175.17 175.59 1jdb n LEU 158 N 6.38 0.06 -0.27 -1.34 4.77 -1.25 -4.52 117.00 120.82 1jdb n LEU 158 Ca 0.04 -0.04 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 1jdb n LEU 158 Cb 0.48 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.74 1jdb n LEU 158 CO 0.53 0.01 1.10 0.00 -1.33 0.00 0.00 177.39 177.70 1jdb h ALA 159 N 1.38 1.12 0.00 -1.18 0.00 -1.78 0.07 119.26 118.87 1jdb h ALA 159 Ca 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1jdb h ALA 159 Cb 0.63 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1jdb h ALA 159 CO 0.00 -0.02 -0.10 1.57 0.00 0.00 0.00 179.25 180.70 1jdb h LYS 160 N 0.66 0.00 0.02 0.00 2.10 -1.89 -0.78 116.57 116.69 1jdb h LYS 160 Ca 0.40 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.82 1jdb h LYS 160 Cb 0.45 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.78 1jdb h LYS 160 CO -0.29 0.10 -0.98 0.93 -2.00 0.00 0.00 179.45 177.21 1jdb h GLU 161 N 0.00 0.36 0.00 0.07 4.39 -1.24 -3.34 114.58 114.82 1jdb h GLU 161 Ca -0.00 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.28 1jdb h GLU 161 Cb 0.41 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 1jdb h GLU 161 CO 0.01 1.11 -1.45 1.33 -1.16 0.00 0.00 179.01 178.85 1jdb n VAL 162 N -3.70 0.00 -0.69 3.13 0.24 -0.89 -5.02 118.33 111.40 1jdb n VAL 162 Ca -0.07 -0.25 -0.32 0.00 -2.04 0.00 0.00 64.34 61.67 1jdb n VAL 162 Cb 0.86 0.51 0.17 0.00 -1.47 0.00 0.00 33.84 33.91 1jdb n VAL 162 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1jdb n THR 163 N -1.85 0.00 -2.86 3.34 5.66 -0.32 -4.75 114.28 113.50 1jdb n THR 163 Ca -0.00 -0.25 -0.38 0.00 -3.05 0.00 0.00 64.05 60.37 1jdb n THR 163 Cb 0.43 -0.71 -0.06 0.00 -1.55 0.00 0.00 70.33 68.43 1jdb n THR 163 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1jdb s THR 164 N -2.36 4.27 0.04 1.09 -1.32 -1.26 -4.97 115.64 111.12 1jdb s THR 164 Ca 0.59 1.78 -0.25 0.00 -1.21 0.00 0.00 61.69 62.60 1jdb s THR 164 Cb -0.19 -4.09 -0.17 0.00 -1.51 0.00 0.00 72.50 66.55 1jdb s THR 164 CO 0.66 0.31 1.53 0.00 -2.21 0.00 0.00 174.62 174.91 1jdb h ALA 165 N 3.67 -0.10 -1.56 11.08 0.00 -1.99 -3.38 119.26 126.98 1jdb h ALA 165 Ca -0.47 -0.11 -0.58 0.00 0.00 0.00 0.00 54.91 53.75 1jdb h ALA 165 Cb 1.20 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.93 1jdb h ALA 165 CO 0.66 -0.46 -0.52 -1.21 0.00 0.00 0.00 179.25 177.72 1jdb s GLU 166 N -5.41 2.16 -0.02 0.00 2.02 -1.26 -4.85 118.70 111.34 1jdb s GLU 166 Ca -0.14 -1.92 -0.14 0.00 0.02 0.00 0.00 54.97 52.79 1jdb s GLU 166 Cb 0.04 -1.90 -0.05 0.00 0.10 0.00 0.00 34.13 32.32 1jdb s GLU 166 CO 0.65 -0.12 0.37 0.00 0.02 0.00 0.00 175.26 176.19 1jdb s ALA 167 N -2.63 3.71 0.37 5.21 0.00 -1.26 -4.57 121.76 122.58 1jdb s ALA 167 Ca 0.39 -0.28 0.04 0.00 0.00 0.00 0.00 51.96 52.11 1jdb s ALA 167 Cb 0.05 -2.34 -0.05 0.00 0.00 0.00 0.00 23.12 20.78 1jdb s ALA 167 CO 0.21 0.47 0.07 1.52 0.00 0.00 0.00 175.76 178.03 1jdb s TYR 168 N -0.97 1.96 -0.11 0.00 1.13 -0.17 -4.94 117.35 114.24 1jdb s TYR 168 Ca 0.22 -1.02 -0.04 0.00 -1.41 0.00 0.00 57.07 54.83 1jdb s TYR 168 Cb -0.16 -1.32 -0.04 0.00 -1.10 0.00 0.00 41.96 39.35 1jdb s TYR 168 CO 0.12 -0.01 0.05 0.45 -2.51 0.00 0.00 175.55 173.64 1jdb s SER 169 N -3.57 5.62 -0.14 -0.18 0.15 -1.26 0.24 113.70 114.57 1jdb s SER 169 Ca 0.31 0.23 0.00 0.00 0.70 0.00 0.00 55.95 57.19 1jdb s SER 169 Cb 0.07 -1.71 0.02 0.00 -1.71 0.00 0.00 66.02 62.68 1jdb s SER 169 CO 0.14 0.36 -0.14 0.86 1.20 0.00 0.00 173.24 175.67 1jdb s TRP 170 N -0.77 2.08 -0.04 3.44 -0.11 0.17 -4.94 118.94 118.77 1jdb s TRP 170 Ca 0.12 -1.14 0.16 0.00 1.22 0.00 0.00 56.10 56.45 1jdb s TRP 170 Cb -0.12 -1.54 0.29 0.00 -1.50 0.00 0.00 33.47 30.59 1jdb s TRP 170 CO 0.03 -0.64 1.12 0.25 -4.62 0.00 0.00 176.95 173.09 1jdb n THR 171 N 4.73 0.43 -4.00 5.86 -2.24 -1.26 -1.76 114.28 116.05 1jdb n THR 171 Ca -0.17 -1.07 -0.36 0.00 -2.27 0.00 0.00 64.05 60.18 1jdb n THR 171 Cb 0.50 0.59 -0.07 0.00 -2.10 0.00 0.00 70.33 69.25 1jdb n THR 171 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1jdb s GLN 172 N -0.63 3.39 0.00 -0.78 0.74 -1.26 0.32 119.66 121.44 1jdb s GLN 172 Ca 0.24 -0.21 0.00 0.00 0.05 0.00 0.00 55.36 55.44 1jdb s GLN 172 Cb 0.26 -3.11 0.00 0.00 1.10 0.00 0.00 33.01 31.26 1jdb s GLN 172 CO -0.09 0.72 0.00 0.41 -0.55 0.00 0.00 175.29 175.78 1jdb n GLY 173 N 2.16 1.08 3.82 2.59 0.00 -1.26 -3.94 105.19 109.63 1jdb n GLY 173 Ca -0.19 -1.92 -0.33 0.00 0.00 0.00 0.00 46.02 43.58 1jdb n GLY 173 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jdb s SER 174 N -1.00 6.61 0.76 1.61 0.01 -1.26 -4.64 113.70 115.79 1jdb s SER 174 Ca 0.00 1.75 -0.11 0.00 1.31 0.00 0.00 55.95 58.90 1jdb s SER 174 Cb 0.00 -2.54 0.04 0.00 0.21 0.00 0.00 66.02 63.73 1jdb s SER 174 CO 0.00 -0.59 1.09 0.86 0.41 0.00 0.00 173.24 175.01 1jdb s TRP 175 N -2.21 3.01 0.01 2.43 -0.00 -1.26 -4.34 118.94 116.58 1jdb s TRP 175 Ca 0.63 1.17 -0.08 0.00 -0.00 0.00 0.00 56.10 57.82 1jdb s TRP 175 Cb -0.12 -3.07 0.00 0.00 -0.00 0.00 0.00 33.47 30.29 1jdb s TRP 175 CO 0.20 -1.53 0.15 0.95 -0.00 0.00 0.00 176.95 176.72 1jdb s THR 176 N -3.19 0.09 0.24 5.86 -4.23 -0.71 -4.86 115.64 108.83 1jdb s THR 176 Ca 0.60 -0.77 -0.04 0.00 -1.18 0.00 0.00 61.69 60.29 1jdb s THR 176 Cb -0.13 -0.58 0.11 0.00 1.34 0.00 0.00 72.50 73.24 1jdb s THR 176 CO 0.54 -0.43 1.74 0.25 -0.54 0.00 0.00 174.62 176.18 1jdb h LEU 177 N 4.05 0.86 0.00 4.79 5.85 -1.98 1.35 115.31 130.23 1jdb h LEU 177 Ca -0.31 -0.21 -0.11 0.00 0.84 0.00 0.00 57.88 58.09 1jdb h LEU 177 Cb 1.19 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 42.00 1jdb h LEU 177 CO 0.43 0.90 -0.42 0.71 -0.34 0.00 0.00 178.44 179.72 1jdb h THR 178 N 0.84 1.49 0.07 1.05 1.35 -2.03 -3.38 112.91 112.30 1jdb h THR 178 Ca 0.16 -2.03 -0.16 0.00 -0.55 0.00 0.00 66.41 63.84 1jdb h THR 178 Cb 0.45 2.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.58 1jdb h THR 178 CO 0.02 0.57 -0.77 1.23 -0.25 0.00 0.00 175.52 176.32 1jdb h GLY 179 N -0.32 0.18 0.00 5.82 0.00 -1.94 -3.51 103.07 103.29 1jdb h GLY 179 Ca -0.05 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1jdb h GLY 179 CO 0.08 0.40 0.00 0.61 0.00 0.00 0.00 176.54 177.63 1jdb n GLY 180 N 1.64 -0.83 3.71 4.60 0.00 0.46 -4.77 105.19 110.00 1jdb n GLY 180 Ca -0.18 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 1jdb n GLY 180 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jdb s LEU 181 N 0.00 4.38 0.66 0.99 1.43 -1.26 -1.75 118.68 123.13 1jdb s LEU 181 Ca 0.00 1.64 -0.12 0.00 -1.03 0.00 0.00 54.13 54.63 1jdb s LEU 181 Cb 0.00 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.67 1jdb s LEU 181 CO 0.00 -0.23 1.05 -2.16 0.23 0.00 0.00 176.35 175.24 1jdb s PRO 182 N 0.88 3.15 0.60 1.29 0.04 -1.26 -5.03 135.00 134.67 1jdb s PRO 182 Ca 0.50 0.96 -0.17 0.00 0.04 0.00 0.00 61.00 62.34 1jdb s PRO 182 Cb -0.21 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 1jdb s PRO 182 CO 0.28 -0.93 1.11 -0.65 0.04 0.00 0.00 177.00 176.84 1jdb s GLN 183 N -4.85 3.14 0.54 4.56 -0.21 -1.26 -4.70 119.66 116.88 1jdb s GLN 183 Ca 0.58 1.45 -0.19 0.00 0.02 0.00 0.00 55.36 57.22 1jdb s GLN 183 Cb -0.14 -1.99 -0.06 0.00 1.00 0.00 0.00 33.01 31.83 1jdb s GLN 183 CO 0.51 -0.99 1.11 0.00 -2.12 0.00 0.00 175.29 173.79 1jdb s ALA 184 N -2.12 2.71 0.70 6.09 0.00 -1.26 -4.66 121.76 123.22 1jdb s ALA 184 Ca 0.69 0.73 -0.11 0.00 0.00 0.00 0.00 51.96 53.27 1jdb s ALA 184 Cb -0.21 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.60 1jdb s ALA 184 CO 0.34 -0.72 1.08 0.15 0.00 0.00 0.00 175.76 176.61 1jdb s LYS 185 N -3.38 2.77 -0.16 0.00 1.02 0.15 -4.93 119.74 115.20 1jdb s LYS 185 Ca 0.71 0.36 -0.16 0.00 0.02 0.00 0.00 55.97 56.90 1jdb s LYS 185 Cb -0.22 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 35.00 1jdb s LYS 185 CO 0.27 -1.05 0.38 0.15 -0.92 0.00 0.00 175.35 174.18 1jdb s LYS 186 N -5.33 4.26 0.37 1.68 1.02 -1.26 -4.76 119.74 115.71 1jdb s LYS 186 Ca 0.58 0.23 0.28 0.00 0.02 0.00 0.00 55.97 57.09 1jdb s LYS 186 Cb -0.11 -3.46 1.24 0.00 -0.52 0.00 0.00 37.83 34.98 1jdb s LYS 186 CO 0.51 0.13 1.27 0.39 -0.92 0.00 0.00 175.35 176.72 1jdb n GLU 187 N 3.89 -0.03 -0.13 1.68 1.02 -1.26 -0.25 120.64 125.56 1jdb n GLU 187 Ca -0.09 1.00 -0.02 0.00 -0.02 0.00 0.00 57.16 58.03 1jdb n GLU 187 Cb 0.52 -2.01 0.22 0.00 -0.02 0.00 0.00 31.44 30.14 1jdb n GLU 187 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 1jdb h ASP 188 N 0.00 0.76 0.17 1.62 2.03 -2.02 -2.31 116.42 116.67 1jdb h ASP 188 Ca 0.72 -0.11 -0.02 0.00 -0.73 0.00 0.00 57.03 56.90 1jdb h ASP 188 Cb 2.41 -0.20 -0.00 0.00 -0.83 0.00 0.00 39.33 40.71 1jdb h ASP 188 CO -0.33 0.70 -0.08 -0.33 -1.03 0.00 0.00 179.24 178.18 1jdb h GLU 189 N 0.82 0.00 -4.67 4.15 5.08 -1.02 -3.39 114.58 115.53 1jdb h GLU 189 Ca 0.19 0.00 -0.70 0.00 -1.00 0.00 0.00 59.36 57.85 1jdb h GLU 189 Cb 0.20 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.18 1jdb h GLU 189 CO -0.01 0.08 -0.58 -0.51 -1.00 0.00 0.00 179.01 176.98 1jdb s LEU 190 N -7.78 4.35 0.38 1.33 1.43 -0.87 -5.00 118.68 112.53 1jdb s LEU 190 Ca -0.04 -1.02 0.07 0.00 -1.03 0.00 0.00 54.13 52.11 1jdb s LEU 190 Cb 0.15 -1.92 0.81 0.00 0.03 0.00 0.00 46.19 45.26 1jdb s LEU 190 CO 0.60 -0.32 1.99 1.55 0.23 0.00 0.00 176.35 180.39 1jdb h PRO 191 N 8.28 0.65 -6.47 1.29 0.13 -1.76 -3.41 132.00 130.71 1jdb h PRO 191 Ca -0.25 -0.04 -0.67 0.00 -0.87 0.00 0.00 66.00 64.17 1jdb h PRO 191 Cb 1.10 -0.15 -0.16 0.00 0.13 0.00 0.00 31.00 31.92 1jdb h PRO 191 CO 0.62 0.43 -0.73 -0.06 -0.23 0.00 0.00 178.00 178.03 1jdb s PHE 192 N -5.59 2.79 -0.24 1.56 0.08 -0.95 -4.95 117.98 110.67 1jdb s PHE 192 Ca -0.09 -0.12 -0.03 0.00 0.12 0.00 0.00 56.93 56.80 1jdb s PHE 192 Cb 0.19 -1.48 0.01 0.00 -0.57 0.00 0.00 43.02 41.16 1jdb s PHE 192 CO 0.76 0.41 -0.03 -1.58 -0.10 0.00 0.00 175.22 174.68 1jdb s HIS 193 N -1.17 3.02 -0.06 0.36 2.46 -1.26 0.30 115.29 118.95 1jdb s HIS 193 Ca 0.21 -1.21 0.03 0.00 0.47 0.00 0.00 55.06 54.57 1jdb s HIS 193 Cb -0.11 -2.11 -0.02 0.00 -0.13 0.00 0.00 32.58 30.21 1jdb s HIS 193 CO 0.13 -0.63 -0.16 0.08 -2.47 0.00 0.00 174.74 171.68 1jdb s VAL 194 N 1.42 2.89 -0.24 0.89 1.01 0.90 -1.00 120.40 126.26 1jdb s VAL 194 Ca 0.03 -0.77 -0.07 0.00 0.00 0.00 0.00 61.98 61.17 1jdb s VAL 194 Cb -0.16 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 1jdb s VAL 194 CO -0.03 0.58 0.06 -0.69 0.00 0.00 0.00 175.10 175.01 1jdb s VAL 195 N -0.47 4.26 -0.19 2.92 1.01 -0.37 -0.35 120.40 127.20 1jdb s VAL 195 Ca 0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.84 1jdb s VAL 195 Cb -0.12 -2.98 0.01 0.00 0.00 0.00 0.00 36.38 33.29 1jdb s VAL 195 CO 0.02 0.35 -0.14 0.00 0.00 0.00 0.00 175.10 175.33 1jdb s ALA 196 N 1.53 2.52 -0.06 5.51 0.00 0.51 0.89 121.76 132.67 1jdb s ALA 196 Ca 0.06 -1.19 -0.30 0.00 0.00 0.00 0.00 51.96 50.53 1jdb s ALA 196 Cb -0.15 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 1jdb s ALA 196 CO 0.03 -0.36 1.38 0.71 0.00 0.00 0.00 175.76 177.52 1jdb s TYR 197 N 1.34 2.76 -0.81 0.00 1.51 0.13 -1.13 117.35 121.14 1jdb s TYR 197 Ca 0.05 0.82 -0.23 0.00 -1.01 0.00 0.00 57.07 56.69 1jdb s TYR 197 Cb -0.14 -3.63 0.07 0.00 -0.11 0.00 0.00 41.96 38.15 1jdb s TYR 197 CO -0.09 -2.34 1.17 0.34 -1.11 0.00 0.00 175.55 173.52 1jdb s ASP 198 N 2.08 6.33 0.00 2.29 2.15 0.41 -2.95 116.67 126.98 1jdb s ASP 198 Ca 0.62 -1.17 0.22 0.00 0.43 0.00 0.00 52.55 52.66 1jdb s ASP 198 Cb -0.28 -2.48 0.61 0.00 -0.30 0.00 0.00 42.92 40.46 1jdb s ASP 198 CO 0.23 -1.47 1.51 0.49 -0.17 0.00 0.00 175.17 175.76 1jdb n PHE 199 N 8.11 0.89 0.00 -5.34 3.72 -1.26 -3.24 117.46 120.33 1jdb n PHE 199 Ca 0.11 -0.44 0.00 0.00 -0.05 0.00 0.00 57.45 57.06 1jdb n PHE 199 Cb 0.48 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 1jdb n PHE 199 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1jdb n GLY 200 N 1.62 0.83 3.76 1.37 0.00 -1.21 -4.13 105.19 107.43 1jdb n GLY 200 Ca 0.23 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1jdb n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jdb s ALA 201 N -0.30 3.61 0.13 4.61 0.00 -1.23 -4.27 121.76 124.30 1jdb s ALA 201 Ca 0.00 1.39 -0.27 0.00 0.00 0.00 0.00 51.96 53.08 1jdb s ALA 201 Cb 0.00 -3.56 -0.07 0.00 0.00 0.00 0.00 23.12 19.49 1jdb s ALA 201 CO 0.00 -0.81 0.85 0.15 0.00 0.00 0.00 175.76 175.95 1jdb s LYS 202 N -0.99 4.64 0.41 0.00 1.02 -1.26 -4.87 119.74 118.68 1jdb s LYS 202 Ca 0.57 1.27 0.20 0.00 0.02 0.00 0.00 55.97 58.02 1jdb s LYS 202 Cb -0.43 -3.32 1.14 0.00 -0.52 0.00 0.00 37.83 34.70 1jdb s LYS 202 CO 0.49 0.39 1.78 0.00 -0.92 0.00 0.00 175.35 177.10 1jdb h ARG 203 N 4.96 0.35 -0.67 1.68 3.08 -1.22 -2.05 114.38 120.51 1jdb h ARG 203 Ca -0.45 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.56 1jdb h ARG 203 Cb 1.21 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 31.14 1jdb h ARG 203 CO 0.69 0.23 0.34 -0.97 -1.07 0.00 0.00 179.97 179.19 1jdb h ASN 204 N 0.36 0.84 -0.08 7.04 -1.24 -1.93 -2.38 115.58 118.20 1jdb h ASN 204 Ca 0.59 -0.08 -0.00 0.00 0.71 0.00 0.00 56.30 57.51 1jdb h ASN 204 Cb 1.55 -0.21 -0.00 0.00 0.73 0.00 0.00 38.32 40.38 1jdb h ASN 204 CO -0.27 0.70 0.04 0.40 -1.29 0.00 0.00 177.43 177.01 1jdb h ILE 205 N 0.94 1.12 -0.04 2.57 2.04 -1.69 -1.38 117.51 121.06 1jdb h ILE 205 Ca 0.23 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.78 1jdb h ILE 205 Cb 0.07 1.19 -0.06 0.00 -0.74 0.00 0.00 36.82 37.28 1jdb h ILE 205 CO -0.03 0.10 -0.53 -0.07 0.00 0.00 0.00 178.15 177.61 1jdb h LEU 206 N 0.01 -1.65 -0.44 1.44 3.38 -1.58 -1.23 115.31 115.23 1jdb h LEU 206 Ca 0.03 0.19 0.09 0.00 0.09 0.00 0.00 57.88 58.28 1jdb h LEU 206 Cb 0.13 0.63 -0.09 0.00 0.09 0.00 0.00 40.66 41.42 1jdb h LEU 206 CO -0.00 -0.51 -0.25 0.03 0.09 0.00 0.00 178.44 177.79 1jdb h ARG 207 N -0.64 -0.16 -0.07 1.13 3.08 -1.40 0.11 114.38 116.42 1jdb h ARG 207 Ca 0.02 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.10 1jdb h ARG 207 Cb 0.71 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.79 1jdb h ARG 207 CO -0.38 -0.11 0.06 0.52 -1.07 0.00 0.00 179.97 179.00 1jdb h MET 208 N -0.17 0.00 0.01 0.04 2.86 -0.63 0.11 114.93 117.15 1jdb h MET 208 Ca 0.20 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1jdb h MET 208 Cb 0.49 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.15 1jdb h MET 208 CO -0.54 0.00 -0.00 -0.07 1.06 0.00 0.00 176.91 177.36 1jdb h LEU 209 N 0.00 -0.01 -0.94 1.22 3.38 0.14 -2.92 115.31 116.19 1jdb h LEU 209 Ca 0.03 -0.74 0.11 0.00 0.09 0.00 0.00 57.88 57.38 1jdb h LEU 209 Cb 0.16 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 1jdb h LEU 209 CO -0.00 0.75 0.57 0.58 0.09 0.00 0.00 178.44 180.42 1jdb h VAL 210 N -0.78 0.90 -0.32 1.22 2.07 -0.33 0.17 116.25 119.18 1jdb h VAL 210 Ca -0.00 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.26 1jdb h VAL 210 Cb 0.75 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1jdb h VAL 210 CO 0.00 0.16 0.22 0.44 0.02 0.00 0.00 177.57 178.41 1jdb h ASP 211 N 0.90 0.20 -0.25 0.57 3.32 -1.03 0.51 116.42 120.64 1jdb h ASP 211 Ca 0.46 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.51 1jdb h ASP 211 Cb 0.47 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1jdb h ASP 211 CO -0.27 0.14 0.00 0.54 -1.72 0.00 0.00 179.24 177.93 1jdb n ARG 212 N -4.48 1.79 -2.47 3.56 1.74 0.52 -4.88 116.66 112.45 1jdb n ARG 212 Ca 0.03 -1.00 -0.04 0.00 -0.77 0.00 0.00 57.85 56.08 1jdb n ARG 212 Cb 0.22 -1.33 0.01 0.00 -1.02 0.00 0.00 32.46 30.33 1jdb n ARG 212 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jdb n GLY 213 N 0.77 0.54 3.28 -0.13 0.00 0.18 -5.00 105.19 104.83 1jdb n GLY 213 Ca 0.09 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 1jdb n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jdb s ARG 215 N 1.41 4.64 0.01 0.00 1.70 0.86 -3.60 118.95 123.98 1jdb s ARG 215 Ca -0.00 1.68 0.07 0.00 -0.47 0.00 0.00 55.73 57.00 1jdb s ARG 215 Cb -0.18 -3.13 -0.02 0.00 -0.57 0.00 0.00 34.95 31.05 1jdb s ARG 215 CO 0.01 0.25 -0.21 -0.51 -1.08 0.00 0.00 175.30 173.77 1jdb s LEU 216 N -1.53 2.09 -0.24 -1.89 1.43 -0.72 -0.07 118.68 117.75 1jdb s LEU 216 Ca 0.45 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1jdb s LEU 216 Cb -0.29 -1.03 0.04 0.00 0.03 0.00 0.00 46.19 44.94 1jdb s LEU 216 CO 0.37 0.22 -0.12 -0.89 0.23 0.00 0.00 176.35 176.16 1jdb s THR 217 N -0.60 2.37 -0.28 5.49 2.01 0.52 0.42 115.64 125.56 1jdb s THR 217 Ca 0.08 -1.28 -0.19 0.00 0.31 0.00 0.00 61.69 60.60 1jdb s THR 217 Cb -0.08 -2.24 -0.02 0.00 0.01 0.00 0.00 72.50 70.17 1jdb s THR 217 CO 0.00 0.18 0.58 -0.63 -0.69 0.00 0.00 174.62 174.06 1jdb s ILE 218 N 1.22 5.00 0.08 1.82 -1.09 0.14 -0.36 121.20 128.01 1jdb s ILE 218 Ca -0.03 0.88 0.07 0.00 -2.23 0.00 0.00 60.65 59.34 1jdb s ILE 218 Cb -0.17 -3.92 -0.04 0.00 -1.58 0.00 0.00 42.46 36.75 1jdb s ILE 218 CO -0.07 -0.03 -0.11 0.68 -1.23 0.00 0.00 174.94 174.18 1jdb s VAL 219 N 2.47 3.28 0.75 2.92 -7.23 -0.28 -1.00 120.40 121.31 1jdb s VAL 219 Ca 0.23 -1.22 -0.15 0.00 -1.81 0.00 0.00 61.98 59.04 1jdb s VAL 219 Cb -0.15 -2.50 0.04 0.00 0.56 0.00 0.00 36.38 34.32 1jdb s VAL 219 CO 0.10 0.18 1.14 -2.65 -0.31 0.00 0.00 175.10 173.56 1jdb n PRO 220 N 0.93 0.48 -0.33 4.82 -0.02 -1.26 -0.44 135.00 139.18 1jdb n PRO 220 Ca -0.14 0.23 0.17 0.00 -2.02 0.00 0.00 63.50 61.74 1jdb n PRO 220 Cb 0.52 -2.39 0.41 0.00 -0.02 0.00 0.00 33.50 32.03 1jdb n PRO 220 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jdb h ALA 221 N -0.40 1.92 -0.08 3.55 0.00 -1.78 -2.39 119.26 120.07 1jdb h ALA 221 Ca -0.48 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1jdb h ALA 221 Cb 1.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1jdb h ALA 221 CO 0.48 -0.31 0.00 1.04 0.00 0.00 0.00 179.25 180.46 1jdb n GLN 222 N -4.71 1.78 -1.58 0.00 6.02 -1.26 -4.68 117.38 112.95 1jdb n GLN 222 Ca 0.24 -1.15 -0.44 0.00 -0.01 0.00 0.00 57.00 55.64 1jdb n GLN 222 Cb 0.70 -1.45 -0.01 0.00 1.02 0.00 0.00 30.24 30.50 1jdb n GLN 222 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1jdb n THR 223 N 0.38 2.04 -2.48 5.09 -1.04 -0.90 -4.93 114.28 112.44 1jdb n THR 223 Ca 0.18 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.05 61.36 1jdb n THR 223 Cb 0.38 -0.99 -0.03 0.00 -1.82 0.00 0.00 70.33 67.86 1jdb n THR 223 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1jdb s SER 224 N -0.60 6.45 0.15 8.00 1.04 -1.26 -4.88 113.70 122.59 1jdb s SER 224 Ca 0.59 1.76 -0.18 0.00 0.48 0.00 0.00 55.95 58.61 1jdb s SER 224 Cb -0.68 -2.54 0.03 0.00 0.10 0.00 0.00 66.02 62.94 1jdb s SER 224 CO 0.59 -0.71 1.73 0.00 0.98 0.00 0.00 173.24 175.84 1jdb h ALA 225 N 1.27 0.30 -0.42 5.32 0.00 -1.92 -2.56 119.26 121.24 1jdb h ALA 225 Ca -0.48 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1jdb h ALA 225 Cb 1.20 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1jdb h ALA 225 CO 0.60 -0.37 0.22 1.05 0.00 0.00 0.00 179.25 180.75 1jdb h GLU 226 N 0.14 0.57 -0.07 0.00 9.09 -1.93 0.23 114.58 122.62 1jdb h GLU 226 Ca 0.14 -0.06 -0.10 0.00 0.05 0.00 0.00 59.36 59.40 1jdb h GLU 226 Cb 0.16 -0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 27.13 1jdb h GLU 226 CO -0.20 0.43 -0.40 -0.44 0.05 0.00 0.00 179.01 178.46 1jdb h ASP 227 N 0.58 0.14 0.05 3.06 5.19 -1.87 -2.55 116.42 121.03 1jdb h ASP 227 Ca 0.15 -0.06 -0.08 0.00 -0.62 0.00 0.00 57.03 56.42 1jdb h ASP 227 Cb 0.03 -0.04 0.01 0.00 0.18 0.00 0.00 39.33 39.51 1jdb h ASP 227 CO -0.02 0.53 -0.34 0.58 -3.12 0.00 0.00 179.24 176.86 1jdb h VAL 228 N 0.12 1.65 -1.01 -1.35 2.07 -0.89 -3.26 116.25 113.57 1jdb h VAL 228 Ca 0.01 -2.34 0.23 0.00 0.82 0.00 0.00 66.70 65.42 1jdb h VAL 228 Cb 0.76 3.20 -0.11 0.00 -1.52 0.00 0.00 31.29 33.62 1jdb h VAL 228 CO 0.06 0.63 0.62 -0.07 0.02 0.00 0.00 177.57 178.83 1jdb h LEU 229 N -0.67 0.66 -1.58 2.57 3.38 -0.57 0.51 115.31 119.62 1jdb h LEU 229 Ca -0.06 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1jdb h LEU 229 Cb 1.23 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1jdb h LEU 229 CO 0.06 0.17 0.12 0.11 0.09 0.00 0.00 178.44 178.99 1jdb h LYS 230 N 0.61 0.00 -0.00 1.13 1.57 -1.49 0.20 116.57 118.58 1jdb h LYS 230 Ca 0.60 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.38 1jdb h LYS 230 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1jdb h LYS 230 CO -0.40 0.00 -0.33 -1.33 -0.57 0.00 0.00 179.45 176.82 1jdb n MET 231 N -2.39 0.48 -3.62 3.15 2.81 0.18 -4.95 117.12 112.77 1jdb n MET 231 Ca -0.02 -0.27 -0.21 0.00 -1.81 0.00 0.00 57.70 55.40 1jdb n MET 231 Cb 0.16 -1.49 0.04 0.00 -0.71 0.00 0.00 33.22 31.21 1jdb n MET 231 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1jdb n ASN 232 N -1.03 -2.32 -4.73 7.83 4.13 0.70 -4.90 115.26 114.93 1jdb n ASN 232 Ca 0.10 -0.81 -0.42 0.00 1.68 0.00 0.00 54.58 55.12 1jdb n ASN 232 Cb 0.34 -4.22 -0.01 0.00 -1.54 0.00 0.00 39.78 34.35 1jdb n ASN 232 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1jdb n PRO 233 N -4.13 2.52 0.10 3.52 -0.04 -1.26 -4.90 135.00 130.81 1jdb n PRO 233 Ca -0.25 0.89 -0.02 0.00 -0.04 0.00 0.00 63.50 64.08 1jdb n PRO 233 Cb 0.66 -2.63 -0.04 0.00 -0.04 0.00 0.00 33.50 31.45 1jdb n PRO 233 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1jdb h ASP 234 N 4.14 0.00 -4.52 3.54 3.32 -1.42 -3.47 116.42 118.01 1jdb h ASP 234 Ca -0.47 0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.63 1jdb h ASP 234 Cb 1.24 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.60 1jdb h ASP 234 CO 0.74 0.74 0.43 -0.83 -1.72 0.00 0.00 179.24 178.60 1jdb s GLY 235 N -4.58 -0.42 -0.13 2.75 0.00 -1.14 -4.45 107.32 99.35 1jdb s GLY 235 Ca 0.03 1.48 0.01 0.00 0.00 0.00 0.00 44.72 46.24 1jdb s GLY 235 CO 0.78 0.76 -0.18 -0.42 0.00 0.00 0.00 173.10 174.05 1jdb s ILE 236 N -1.86 2.51 -0.11 0.90 1.01 -0.52 -1.24 121.20 121.88 1jdb s ILE 236 Ca -0.02 -0.84 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 1jdb s ILE 236 Cb -0.01 -2.03 -0.02 0.00 0.01 0.00 0.00 42.46 40.41 1jdb s ILE 236 CO -0.00 0.53 -0.08 0.12 0.00 0.00 0.00 174.94 175.51 1jdb s PHE 237 N 0.61 2.91 -0.63 3.97 5.36 0.26 -2.61 117.98 127.85 1jdb s PHE 237 Ca -0.10 -0.28 -0.12 0.00 -0.96 0.00 0.00 56.93 55.47 1jdb s PHE 237 Cb -0.16 -1.83 0.16 0.00 -0.34 0.00 0.00 43.02 40.85 1jdb s PHE 237 CO 0.03 0.05 0.54 -0.51 -1.46 0.00 0.00 175.22 173.86 1jdb s LEU 238 N -0.09 6.13 1.15 6.12 1.43 -0.65 0.17 118.68 132.95 1jdb s LEU 238 Ca 0.00 -2.25 -0.17 0.00 -1.03 0.00 0.00 54.13 50.68 1jdb s LEU 238 Cb -0.13 -2.11 0.17 0.00 0.03 0.00 0.00 46.19 44.15 1jdb s LEU 238 CO 0.03 -0.66 0.29 -1.54 0.23 0.00 0.00 176.35 174.70 1jdb n SER 239 N 4.52 -2.44 -4.73 2.29 3.41 -1.15 -1.15 113.62 114.37 1jdb n SER 239 Ca -0.01 -0.22 -0.25 0.00 -0.26 0.00 0.00 58.87 58.13 1jdb n SER 239 Cb 0.42 -1.00 0.10 0.00 -0.26 0.00 0.00 64.21 63.47 1jdb n SER 239 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1jdb s ASN 240 N -2.03 4.45 0.00 4.04 4.22 -1.15 -0.47 114.94 123.99 1jdb s ASN 240 Ca 0.58 0.15 0.00 0.00 -2.14 0.00 0.00 52.86 51.44 1jdb s ASN 240 Cb -0.14 -0.65 0.00 0.00 1.28 0.00 0.00 41.25 41.74 1jdb s ASN 240 CO 0.63 -1.81 0.00 0.61 -2.04 0.00 0.00 177.10 174.48 1jdb n GLY 241 N -2.98 1.17 3.85 0.45 0.00 -1.26 -3.33 105.19 103.10 1jdb n GLY 241 Ca 0.11 -0.82 -0.30 0.00 0.00 0.00 0.00 46.02 45.01 1jdb n GLY 241 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jdb s PRO 242 N -2.00 2.57 1.46 1.61 0.04 -1.26 -4.61 135.00 132.81 1jdb s PRO 242 Ca 0.00 0.53 0.00 0.00 0.04 0.00 0.00 61.00 61.57 1jdb s PRO 242 Cb 0.00 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.56 1jdb s PRO 242 CO 0.00 -1.25 0.00 0.41 0.04 0.00 0.00 177.00 176.20 1jdb n GLY 243 N -2.66 -1.50 3.73 0.56 0.00 -1.26 -3.32 105.19 100.74 1jdb n GLY 243 Ca 0.07 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 1jdb n GLY 243 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1jdb s ASP 244 N -4.05 6.95 0.01 1.61 -1.08 0.25 -4.87 116.67 115.49 1jdb s ASP 244 Ca 0.00 2.30 -0.04 0.00 -0.52 0.00 0.00 52.55 54.29 1jdb s ASP 244 Cb 0.00 -2.60 -0.28 0.00 -1.46 0.00 0.00 42.92 38.57 1jdb s ASP 244 CO 0.00 -0.51 0.90 1.55 0.52 0.00 0.00 175.17 177.64 1jdb h PRO 245 N 5.77 0.28 -0.92 4.34 0.13 -1.89 -3.38 132.00 136.33 1jdb h PRO 245 Ca -0.44 -0.47 0.30 0.00 -0.87 0.00 0.00 66.00 64.52 1jdb h PRO 245 Cb 1.21 0.18 -0.17 0.00 0.13 0.00 0.00 31.00 32.35 1jdb h PRO 245 CO 0.79 1.16 0.19 0.00 -0.23 0.00 0.00 178.00 179.91 1jdb n ALA 246 N -2.66 0.64 1.96 -0.56 0.00 -1.26 -0.58 120.51 118.05 1jdb n ALA 246 Ca -0.16 0.97 0.08 0.00 0.00 0.00 0.00 53.44 54.34 1jdb n ALA 246 Cb 1.05 -0.80 0.47 0.00 0.00 0.00 0.00 19.45 20.16 1jdb n ALA 246 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1jdb n PRO 247 N -5.26 1.04 -2.75 0.00 -0.04 -1.26 -4.46 135.00 122.27 1jdb n PRO 247 Ca 0.26 -0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 63.24 1jdb n PRO 247 Cb 0.88 -1.26 0.01 0.00 -0.04 0.00 0.00 33.50 33.09 1jdb n PRO 247 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jdb h ASP 249 N 5.31 0.45 -0.09 0.00 2.03 -1.84 -1.43 116.42 120.86 1jdb h ASP 249 Ca 0.31 0.06 0.03 0.00 -0.73 0.00 0.00 57.03 56.69 1jdb h ASP 249 Cb 0.56 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 39.04 1jdb h ASP 249 CO 1.40 0.26 0.09 0.10 -1.03 0.00 0.00 179.24 180.06 1jdb h TYR 250 N 0.59 0.00 0.13 4.15 -0.00 -1.95 0.06 116.97 119.95 1jdb h TYR 250 Ca 0.33 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 59.06 1jdb h TYR 250 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.07 1jdb h TYR 250 CO -0.11 0.00 -0.06 0.00 -0.00 0.00 0.00 178.16 177.99 1jdb h ALA 251 N 1.90 -0.17 -0.83 0.10 0.00 -1.56 -2.42 119.26 116.29 1jdb h ALA 251 Ca 0.04 -0.17 0.19 0.00 0.00 0.00 0.00 54.91 54.98 1jdb h ALA 251 Cb 0.23 0.07 -0.12 0.00 0.00 0.00 0.00 17.79 17.97 1jdb h ALA 251 CO -0.00 -0.19 0.30 0.82 0.00 0.00 0.00 179.25 180.18 1jdb h ILE 252 N -0.99 0.51 0.31 0.00 2.04 -0.85 0.16 117.51 118.68 1jdb h ILE 252 Ca -0.02 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1jdb h ILE 252 Cb 0.39 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1jdb h ILE 252 CO 0.03 0.07 -0.16 0.74 0.00 0.00 0.00 178.15 178.82 1jdb h THR 253 N 0.36 0.00 -0.89 -0.27 2.02 -1.10 0.62 112.91 113.65 1jdb h THR 253 Ca 0.49 0.00 0.24 0.00 0.77 0.00 0.00 66.41 67.91 1jdb h THR 253 Cb 0.88 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.16 1jdb h THR 253 CO -0.51 0.00 0.33 0.00 0.37 0.00 0.00 175.52 175.70 1jdb h ALA 254 N -1.74 1.40 0.76 6.16 0.00 -0.82 -0.87 119.26 124.15 1jdb h ALA 254 Ca -0.04 0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1jdb h ALA 254 Cb 0.34 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1jdb h ALA 254 CO 0.06 -0.43 -0.50 0.82 0.00 0.00 0.00 179.25 179.20 1jdb h ILE 255 N 0.29 0.01 -0.92 0.00 2.04 -0.55 -2.14 117.51 116.23 1jdb h ILE 255 Ca 0.57 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.70 1jdb h ILE 255 Cb 1.14 0.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1jdb h ILE 255 CO -0.60 0.00 0.73 1.56 0.00 0.00 0.00 178.15 179.84 1jdb h GLN 256 N -1.19 0.00 0.19 2.37 4.20 0.57 0.11 115.11 121.37 1jdb h GLN 256 Ca -0.10 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1jdb h GLN 256 Cb 0.96 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.75 1jdb h GLN 256 CO 0.08 0.00 -0.09 0.87 -0.67 0.00 0.00 178.83 179.02 1jdb h LYS 257 N 0.00 -0.25 -0.15 1.46 6.56 -1.14 -3.02 116.57 120.03 1jdb h LYS 257 Ca 0.44 0.02 0.04 0.00 -1.06 0.00 0.00 60.65 60.09 1jdb h LYS 257 Cb 1.89 0.06 -0.01 0.00 -0.57 0.00 0.00 32.23 33.60 1jdb h LYS 257 CO -0.00 0.15 0.18 0.74 -2.06 0.00 0.00 179.45 178.45 1jdb h PHE 258 N -0.74 0.00 -0.12 -1.35 0.04 -0.17 -0.64 116.94 113.96 1jdb h PHE 258 Ca -0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1jdb h PHE 258 Cb 0.50 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.65 1jdb h PHE 258 CO 0.06 0.00 0.00 1.28 -0.60 0.00 0.00 178.31 179.05 1jdb n LEU 259 N -3.77 0.76 -0.01 1.54 4.77 -0.52 -2.02 117.00 117.76 1jdb n LEU 259 Ca 0.01 -0.38 0.06 0.00 -0.03 0.00 0.00 56.01 55.67 1jdb n LEU 259 Cb 0.29 -0.12 -0.09 0.00 -2.33 0.00 0.00 43.42 41.18 1jdb n LEU 259 CO 0.27 0.18 -0.60 -0.62 -1.33 0.00 0.00 177.39 175.29 1jdb n GLU 260 N -0.11 0.57 -2.68 3.23 1.02 -0.25 -4.98 120.64 117.44 1jdb n GLU 260 Ca 0.04 -0.10 -0.22 0.00 -0.02 0.00 0.00 57.16 56.87 1jdb n GLU 260 Cb 0.13 -1.27 0.07 0.00 -0.02 0.00 0.00 31.44 30.35 1jdb n GLU 260 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1jdb s THR 261 N -2.77 2.42 -2.33 2.62 -4.23 -0.86 -5.02 115.64 105.47 1jdb s THR 261 Ca -0.04 -0.69 0.23 0.00 -1.18 0.00 0.00 61.69 60.01 1jdb s THR 261 Cb 0.08 -2.74 0.49 0.00 1.34 0.00 0.00 72.50 71.67 1jdb s THR 261 CO 0.49 0.00 1.45 0.47 -0.54 0.00 0.00 174.62 176.49 1jdb n ASP 262 N -2.49 3.54 -4.70 3.99 8.00 -1.26 -4.87 116.55 118.75 1jdb n ASP 262 Ca 0.11 -1.99 -0.42 0.00 0.71 0.00 0.00 54.79 53.20 1jdb n ASP 262 Cb 0.60 -0.32 -0.03 0.00 -0.02 0.00 0.00 41.12 41.36 1jdb n ASP 262 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1jdb s ILE 263 N -1.37 3.63 0.23 0.53 1.01 -1.26 -4.75 121.20 119.21 1jdb s ILE 263 Ca 0.42 1.06 -0.31 0.00 0.00 0.00 0.00 60.65 61.82 1jdb s ILE 263 Cb 0.23 -3.68 -0.11 0.00 0.01 0.00 0.00 42.46 38.91 1jdb s ILE 263 CO 0.32 0.02 1.65 -2.84 0.00 0.00 0.00 174.94 174.09 1jdb s PRO 264 N 2.07 4.14 -0.05 2.79 0.02 -1.26 -4.75 135.00 137.96 1jdb s PRO 264 Ca 0.64 2.56 0.00 0.00 0.02 0.00 0.00 61.00 64.22 1jdb s PRO 264 Cb -0.33 -3.07 0.02 0.00 0.02 0.00 0.00 34.50 31.15 1jdb s PRO 264 CO 0.28 -0.69 -0.03 0.08 -0.33 0.00 0.00 177.00 176.31 1jdb s VAL 265 N 0.75 0.45 -0.07 3.83 1.01 0.15 -1.44 120.40 125.07 1jdb s VAL 265 Ca 0.70 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.65 1jdb s VAL 265 Cb -0.48 -0.51 0.02 0.00 0.00 0.00 0.00 36.38 35.40 1jdb s VAL 265 CO 0.37 0.22 -0.07 0.12 0.00 0.00 0.00 175.10 175.74 1jdb s PHE 266 N 1.17 1.15 0.29 5.22 5.36 -1.07 -1.38 117.98 128.71 1jdb s PHE 266 Ca -0.07 -0.44 0.11 0.00 -0.96 0.00 0.00 56.93 55.56 1jdb s PHE 266 Cb -0.14 -0.95 -0.05 0.00 -0.34 0.00 0.00 43.02 41.54 1jdb s PHE 266 CO -0.01 -0.32 -0.10 0.20 -1.46 0.00 0.00 175.22 173.52 1jdb s GLY 267 N 1.17 1.85 -0.06 13.12 0.00 -1.02 -1.63 107.32 120.75 1jdb s GLY 267 Ca -0.06 -1.83 0.00 0.00 0.00 0.00 0.00 44.72 42.84 1jdb s GLY 267 CO -0.02 -1.88 -0.04 -0.42 0.00 0.00 0.00 173.10 170.75 1jdb s ILE 268 N -2.45 0.54 0.00 0.90 1.01 -0.30 -2.49 121.20 118.40 1jdb s ILE 268 Ca 0.31 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.88 1jdb s ILE 268 Cb -0.05 -0.59 0.00 0.00 0.01 0.00 0.00 42.46 41.83 1jdb s ILE 268 CO 0.17 0.24 0.00 0.00 0.00 0.00 0.00 174.94 175.36 1jdb h LEU 270 N 0.00 -0.09 -1.24 0.00 5.85 -1.82 0.33 115.31 118.35 1jdb h LEU 270 Ca 0.00 0.02 0.23 0.00 0.84 0.00 0.00 57.88 58.97 1jdb h LEU 270 Cb 0.00 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 40.98 1jdb h LEU 270 CO 0.00 -0.04 0.63 1.23 -0.34 0.00 0.00 178.44 179.92 1jdb h GLY 271 N -0.03 1.41 0.92 3.75 0.00 -0.24 1.05 103.07 109.93 1jdb h GLY 271 Ca 0.03 -0.26 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 1jdb h GLY 271 CO -0.06 -0.10 -0.33 0.84 0.00 0.00 0.00 176.54 176.89 1jdb h HIS 272 N 0.54 0.76 -0.44 5.60 -0.00 -1.22 0.42 115.15 120.81 1jdb h HIS 272 Ca 0.57 -0.25 -0.12 0.00 -0.00 0.00 0.00 60.37 60.57 1jdb h HIS 272 Cb 1.22 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 28.46 1jdb h HIS 272 CO -0.00 0.99 -0.21 1.96 -0.00 0.00 0.00 177.93 180.67 1jdb h GLN 273 N 0.31 0.89 -0.56 5.26 4.20 0.39 -2.51 115.11 123.09 1jdb h GLN 273 Ca 0.02 -0.36 -0.04 0.00 0.06 0.00 0.00 58.65 58.33 1jdb h GLN 273 Cb 0.91 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.63 1jdb h GLN 273 CO 0.08 1.01 0.20 -0.07 -0.67 0.00 0.00 178.83 179.37 1jdb h LEU 274 N 0.77 0.80 -1.76 1.46 3.38 0.94 -0.78 115.31 120.12 1jdb h LEU 274 Ca 0.11 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.91 1jdb h LEU 274 Cb 0.75 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1jdb h LEU 274 CO 0.06 0.77 0.22 0.25 0.09 0.00 0.00 178.44 179.83 1jdb h LEU 275 N 0.77 0.27 -0.15 1.67 5.85 -0.73 0.50 115.31 123.49 1jdb h LEU 275 Ca 0.18 -0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.70 1jdb h LEU 275 Cb 0.25 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1jdb h LEU 275 CO -0.01 0.19 -0.93 0.00 -0.34 0.00 0.00 178.44 177.35 1jdb h ALA 276 N 1.81 0.46 -0.20 1.25 0.00 -0.96 -2.42 119.26 119.22 1jdb h ALA 276 Ca 0.13 -0.83 -0.18 0.00 0.00 0.00 0.00 54.91 54.03 1jdb h ALA 276 Cb 0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1jdb h ALA 276 CO -0.03 1.12 -0.61 -0.07 0.00 0.00 0.00 179.25 179.67 1jdb h LEU 277 N 0.01 0.75 -1.29 0.00 3.38 -0.14 0.71 115.31 118.74 1jdb h LEU 277 Ca -0.02 -0.43 0.03 0.00 0.09 0.00 0.00 57.88 57.56 1jdb h LEU 277 Cb 1.64 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 42.13 1jdb h LEU 277 CO 0.13 1.18 0.50 0.00 0.09 0.00 0.00 178.44 180.34 1jdb h ALA 278 N 0.82 1.55 -0.00 1.53 0.00 -0.87 0.17 119.26 122.46 1jdb h ALA 278 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1jdb h ALA 278 Cb 1.19 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1jdb h ALA 278 CO 0.12 0.37 -0.01 0.43 0.00 0.00 0.00 179.25 180.16 1jdb n SER 279 N -4.45 0.20 0.00 0.00 7.64 -0.92 -4.74 113.62 111.35 1jdb n SER 279 Ca 0.10 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 59.16 1jdb n SER 279 Cb 0.12 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 1jdb n SER 279 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jdb n GLY 280 N 1.11 0.94 3.98 0.23 0.00 0.59 -4.77 105.19 107.27 1jdb n GLY 280 Ca 0.20 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 1jdb n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jdb s ALA 281 N -2.00 3.96 0.10 4.61 0.00 0.24 -4.76 121.76 123.92 1jdb s ALA 281 Ca 0.00 -1.49 0.04 0.00 0.00 0.00 0.00 51.96 50.51 1jdb s ALA 281 Cb 0.00 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 21.09 1jdb s ALA 281 CO 0.00 -0.86 0.07 0.15 0.00 0.00 0.00 175.76 175.12 1jdb s LYS 282 N -4.80 2.78 0.21 0.00 3.01 -1.26 -4.29 119.74 115.39 1jdb s LYS 282 Ca 0.59 -0.78 0.07 0.00 -1.01 0.00 0.00 55.97 54.85 1jdb s LYS 282 Cb -0.09 -2.65 -0.04 0.00 -1.01 0.00 0.00 37.83 34.04 1jdb s LYS 282 CO 0.39 0.54 0.08 0.95 0.51 0.00 0.00 175.35 177.82 1jdb s THR 283 N -1.45 4.03 0.05 2.17 -4.23 -1.26 -1.10 115.64 113.85 1jdb s THR 283 Ca 0.29 -1.42 -0.00 0.00 -1.18 0.00 0.00 61.69 59.37 1jdb s THR 283 Cb -0.12 -3.09 -0.03 0.00 1.34 0.00 0.00 72.50 70.60 1jdb s THR 283 CO 0.21 -0.21 -0.04 0.68 -0.54 0.00 0.00 174.62 174.72 1jdb s VAL 284 N -1.94 0.28 -0.26 2.29 -7.23 0.28 -4.83 120.40 109.00 1jdb s VAL 284 Ca 0.30 -1.47 -0.16 0.00 -1.81 0.00 0.00 61.98 58.84 1jdb s VAL 284 Cb -0.09 -1.05 -0.03 0.00 0.56 0.00 0.00 36.38 35.77 1jdb s VAL 284 CO 0.21 -0.77 0.45 -0.75 -0.31 0.00 0.00 175.10 173.93 1jdb s LYS 285 N -2.90 4.06 0.67 4.82 2.20 -1.26 0.44 119.74 127.78 1jdb s LYS 285 Ca -0.01 0.20 -0.15 0.00 -0.36 0.00 0.00 55.97 55.65 1jdb s LYS 285 Cb 0.00 -3.64 0.01 0.00 -1.51 0.00 0.00 37.83 32.69 1jdb s LYS 285 CO -0.05 -0.28 1.13 -1.64 -0.36 0.00 0.00 175.35 174.15 1jdb s MET 286 N 2.08 2.65 0.14 4.03 -1.94 0.06 -4.94 119.30 121.38 1jdb s MET 286 Ca 0.19 1.49 -0.21 0.00 -1.71 0.00 0.00 55.69 55.45 1jdb s MET 286 Cb -0.16 -1.92 0.02 0.00 2.01 0.00 0.00 34.83 34.78 1jdb s MET 286 CO 0.09 -1.39 1.67 -0.22 -0.01 0.00 0.00 175.02 175.16 1jdb h LYS 287 N -0.02 -0.12 0.00 2.03 3.64 -1.97 -3.39 116.57 116.75 1jdb h LYS 287 Ca -0.47 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1jdb h LYS 287 Cb 1.26 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 1jdb h LYS 287 CO 0.53 -0.08 -0.06 1.97 -2.27 0.00 0.00 179.45 179.54 1jdb n PHE 288 N -5.30 0.00 -0.95 1.91 1.16 -1.26 -1.46 117.46 111.56 1jdb n PHE 288 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.57 1jdb n PHE 288 Cb 0.22 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.09 1jdb n PHE 288 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1jdb n GLY 289 N 0.20 -2.56 3.02 4.97 0.00 -1.26 -4.84 105.19 104.72 1jdb n GLY 289 Ca 0.00 -1.66 -0.31 0.00 0.00 0.00 0.00 46.02 44.05 1jdb n GLY 289 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1jdb s HIS 290 N -0.68 3.06 -0.27 1.61 0.09 -0.45 -5.01 115.29 113.64 1jdb s HIS 290 Ca 0.00 -2.26 -0.02 0.00 -0.00 0.00 0.00 55.06 52.78 1jdb s HIS 290 Cb 0.00 -1.98 0.09 0.00 -0.00 0.00 0.00 32.58 30.69 1jdb s HIS 290 CO 0.00 -0.86 0.09 -1.01 -0.00 0.00 0.00 174.74 172.95 1jdb s HIS 291 N 1.17 1.22 -0.57 1.40 3.76 -1.26 -1.72 115.29 119.28 1jdb s HIS 291 Ca -0.04 -1.30 0.00 0.00 -0.15 0.00 0.00 55.06 53.57 1jdb s HIS 291 Cb -0.19 -1.34 0.00 0.00 1.11 0.00 0.00 32.58 32.15 1jdb s HIS 291 CO -0.06 -0.79 0.00 0.41 -0.85 0.00 0.00 174.74 173.45 1jdb n GLY 292 N 4.99 -1.28 0.58 -2.22 0.00 -0.78 -2.05 105.19 104.43 1jdb n GLY 292 Ca -0.05 -0.97 0.06 0.00 0.00 0.00 0.00 46.02 45.05 1jdb n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jdb n GLY 293 N -0.07 3.45 0.19 -0.02 0.00 -1.26 -0.54 105.19 106.94 1jdb n GLY 293 Ca 0.00 -0.93 0.01 0.00 0.00 0.00 0.00 46.02 45.10 1jdb n GLY 293 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jdb n ASN 294 N -0.72 0.57 -4.63 1.61 6.94 -1.11 -4.41 115.26 113.51 1jdb n ASN 294 Ca 0.12 -1.76 -0.43 0.00 -0.02 0.00 0.00 54.58 52.50 1jdb n ASN 294 Cb 0.76 -0.13 -0.02 0.00 -2.36 0.00 0.00 39.78 38.03 1jdb n ASN 294 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1jdb s HIS 295 N -0.50 2.76 -0.18 -2.53 2.46 -0.96 -4.72 115.29 111.63 1jdb s HIS 295 Ca 0.04 0.92 -0.29 0.00 0.47 0.00 0.00 55.06 56.20 1jdb s HIS 295 Cb 0.04 -3.88 -0.02 0.00 -0.13 0.00 0.00 32.58 28.59 1jdb s HIS 295 CO 0.00 -1.56 1.32 -1.25 -2.47 0.00 0.00 174.74 170.78 1jdb s PRO 296 N 4.08 4.17 -0.16 2.88 0.04 -1.26 0.11 135.00 144.86 1jdb s PRO 296 Ca 0.54 1.65 0.02 0.00 0.04 0.00 0.00 61.00 63.25 1jdb s PRO 296 Cb -0.16 -3.81 0.01 0.00 0.04 0.00 0.00 34.50 30.58 1jdb s PRO 296 CO 0.22 -0.80 -0.21 0.08 0.04 0.00 0.00 177.00 176.33 1jdb s VAL 297 N 3.74 2.06 0.04 -0.36 1.01 0.18 -0.59 120.40 126.47 1jdb s VAL 297 Ca 0.57 -0.96 -0.20 0.00 0.00 0.00 0.00 61.98 61.40 1jdb s VAL 297 Cb -0.22 -1.84 -0.06 0.00 0.00 0.00 0.00 36.38 34.26 1jdb s VAL 297 CO 0.18 0.55 0.57 -0.75 0.00 0.00 0.00 175.10 175.64 1jdb s LYS 298 N 1.04 4.24 -0.56 2.72 2.20 -0.38 -1.38 119.74 127.61 1jdb s LYS 298 Ca -0.01 0.72 -0.22 0.00 -0.36 0.00 0.00 55.97 56.10 1jdb s LYS 298 Cb -0.14 -3.28 0.05 0.00 -1.51 0.00 0.00 37.83 32.95 1jdb s LYS 298 CO -0.07 0.54 0.86 0.34 -0.36 0.00 0.00 175.35 176.66 1jdb s ASP 299 N -0.76 6.27 0.46 1.43 -1.08 0.94 -2.08 116.67 121.85 1jdb s ASP 299 Ca 0.29 -0.66 0.18 0.00 -0.52 0.00 0.00 52.55 51.85 1jdb s ASP 299 Cb -0.19 -2.39 1.08 0.00 -1.46 0.00 0.00 42.92 39.96 1jdb s ASP 299 CO 0.18 -1.19 1.98 -0.37 0.52 0.00 0.00 175.17 176.29 1jdb h VAL 300 N 5.97 0.98 0.49 1.11 -1.51 -1.56 0.83 116.25 122.55 1jdb h VAL 300 Ca -0.27 -0.73 -0.02 0.00 -1.23 0.00 0.00 66.70 64.44 1jdb h VAL 300 Cb 1.08 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 31.66 1jdb h VAL 300 CO 1.08 0.20 -0.24 -0.33 -1.23 0.00 0.00 177.57 177.05 1jdb h GLU 301 N 0.00 -0.64 0.00 5.19 5.08 -1.90 -3.28 114.58 119.04 1jdb h GLU 301 Ca -0.00 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1jdb h GLU 301 Cb 0.40 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1jdb h GLU 301 CO 0.03 -0.43 -0.03 1.63 -1.00 0.00 0.00 179.01 179.21 1jdb n LYS 302 N -4.33 0.14 -3.35 2.33 5.02 -1.20 -4.95 118.16 111.81 1jdb n LYS 302 Ca -0.08 0.11 -0.17 0.00 -2.02 0.00 0.00 58.31 56.14 1jdb n LYS 302 Cb 0.26 -1.65 0.08 0.00 -0.02 0.00 0.00 35.03 33.70 1jdb n LYS 302 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1jdb n ASN 303 N -1.89 -2.98 -4.27 4.39 5.15 0.29 -5.01 115.26 110.93 1jdb n ASN 303 Ca 0.06 -0.55 -0.21 0.00 -0.60 0.00 0.00 54.58 53.28 1jdb n ASN 303 Cb 0.39 -4.68 -0.12 0.00 -0.53 0.00 0.00 39.78 34.84 1jdb n ASN 303 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1jdb s VAL 304 N -3.32 1.56 -0.06 3.44 -7.23 -1.04 -4.94 120.40 108.81 1jdb s VAL 304 Ca 0.13 -1.64 -0.01 0.00 -1.81 0.00 0.00 61.98 58.64 1jdb s VAL 304 Cb -0.06 -1.55 -0.03 0.00 0.56 0.00 0.00 36.38 35.30 1jdb s VAL 304 CO 0.66 -0.23 0.03 -0.69 -0.31 0.00 0.00 175.10 174.56 1jdb s VAL 305 N -1.62 4.46 0.03 1.32 1.01 -1.26 -0.04 120.40 124.29 1jdb s VAL 305 Ca 0.08 -0.29 0.06 0.00 0.00 0.00 0.00 61.98 61.83 1jdb s VAL 305 Cb -0.08 -2.93 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 1jdb s VAL 305 CO 0.04 0.53 -0.19 0.00 0.00 0.00 0.00 175.10 175.48 1jdb s MET 306 N -1.15 1.30 -0.24 2.72 0.23 -0.48 -4.95 119.30 116.72 1jdb s MET 306 Ca 0.16 -0.84 -0.10 0.00 -1.03 0.00 0.00 55.69 53.88 1jdb s MET 306 Cb -0.12 -1.36 -0.05 0.00 -1.53 0.00 0.00 34.83 31.78 1jdb s MET 306 CO 0.06 0.35 0.16 0.42 -2.03 0.00 0.00 175.02 173.97 1jdb s ILE 307 N -0.74 5.32 0.36 3.16 -1.09 -1.26 0.47 121.20 127.42 1jdb s ILE 307 Ca 0.06 0.17 0.08 0.00 -2.23 0.00 0.00 60.65 58.72 1jdb s ILE 307 Cb -0.08 -3.48 -0.07 0.00 -1.58 0.00 0.00 42.46 37.25 1jdb s ILE 307 CO 0.01 0.34 -0.03 0.42 -1.23 0.00 0.00 174.94 174.45 1jdb s THR 308 N 1.10 1.95 -0.19 2.92 -4.23 0.31 -4.25 115.64 113.25 1jdb s THR 308 Ca 0.07 -2.10 -0.12 0.00 -1.18 0.00 0.00 61.69 58.37 1jdb s THR 308 Cb -0.14 -2.76 -0.05 0.00 1.34 0.00 0.00 72.50 70.89 1jdb s THR 308 CO 0.05 -0.12 0.23 0.00 -0.54 0.00 0.00 174.62 174.23 1jdb s ALA 309 N -2.78 3.63 0.10 3.99 0.00 -1.26 -2.26 121.76 123.17 1jdb s ALA 309 Ca 0.33 -0.59 0.07 0.00 0.00 0.00 0.00 51.96 51.77 1jdb s ALA 309 Cb 0.06 -2.32 -0.03 0.00 0.00 0.00 0.00 23.12 20.83 1jdb s ALA 309 CO 0.16 0.06 -0.18 -0.65 0.00 0.00 0.00 175.76 175.15 1jdb s GLN 310 N 0.56 1.01 -0.46 0.00 -1.52 0.30 -0.90 119.66 118.64 1jdb s GLN 310 Ca 0.13 -1.11 0.04 0.00 -1.95 0.00 0.00 55.36 52.47 1jdb s GLN 310 Cb -0.12 -1.12 0.23 0.00 -0.22 0.00 0.00 33.01 31.77 1jdb s GLN 310 CO 0.02 0.25 0.91 -1.71 -0.25 0.00 0.00 175.29 174.51 1jdb n ASN 311 N 1.05 -2.72 -3.74 5.90 5.15 -0.90 -1.86 115.26 118.14 1jdb n ASN 311 Ca -0.19 -2.75 -0.13 0.00 -0.60 0.00 0.00 54.58 50.91 1jdb n ASN 311 Cb 0.54 1.55 -0.09 0.00 -0.53 0.00 0.00 39.78 41.25 1jdb n ASN 311 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 1jdb s HIS 312 N 0.70 -0.33 -0.67 1.20 -3.43 -0.70 -5.01 115.29 107.05 1jdb s HIS 312 Ca 0.30 0.71 0.06 0.00 -0.80 0.00 0.00 55.06 55.33 1jdb s HIS 312 Cb 0.15 0.14 0.09 0.00 -1.43 0.00 0.00 32.58 31.52 1jdb s HIS 312 CO -0.15 -0.30 0.86 0.41 -2.00 0.00 0.00 174.74 173.56 1jdb n GLY 313 N 2.12 0.51 3.27 -1.38 0.00 -1.26 -1.34 105.19 107.11 1jdb n GLY 313 Ca -0.17 -0.19 -0.16 0.00 0.00 0.00 0.00 46.02 45.50 1jdb n GLY 313 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jdb s PHE 314 N -0.69 1.41 0.12 1.61 0.40 -1.26 -0.76 117.98 118.81 1jdb s PHE 314 Ca 0.09 -0.65 -0.09 0.00 -0.60 0.00 0.00 56.93 55.69 1jdb s PHE 314 Cb 0.06 -0.71 -0.00 0.00 0.51 0.00 0.00 43.02 42.88 1jdb s PHE 314 CO 0.08 0.17 0.24 0.00 0.70 0.00 0.00 175.22 176.40 1jdb s ALA 315 N -2.84 -0.15 -0.08 5.36 0.00 0.17 -4.82 121.76 119.40 1jdb s ALA 315 Ca 0.15 -0.72 -0.24 0.00 0.00 0.00 0.00 51.96 51.16 1jdb s ALA 315 Cb -0.01 0.65 -0.03 0.00 0.00 0.00 0.00 23.12 23.73 1jdb s ALA 315 CO 0.03 -0.57 0.75 0.08 0.00 0.00 0.00 175.76 176.04 1jdb s VAL 316 N -3.90 5.00 -0.02 0.00 1.01 -1.26 0.10 120.40 121.33 1jdb s VAL 316 Ca 0.10 1.52 -0.30 0.00 0.00 0.00 0.00 61.98 63.30 1jdb s VAL 316 Cb 0.04 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 1jdb s VAL 316 CO -0.06 0.20 1.12 -0.62 0.00 0.00 0.00 175.10 175.73 1jdb s ASP 317 N 0.90 7.16 0.24 3.32 2.15 -0.26 -4.50 116.67 125.69 1jdb s ASP 317 Ca 0.39 1.79 0.11 0.00 0.43 0.00 0.00 52.55 55.27 1jdb s ASP 317 Cb -0.18 -2.57 0.21 0.00 -0.30 0.00 0.00 42.92 40.08 1jdb s ASP 317 CO 0.18 -0.46 1.51 1.05 -0.17 0.00 0.00 175.17 177.28 1jdb h GLU 318 N 7.07 0.00 0.00 4.34 4.11 -1.95 -3.16 114.58 125.00 1jdb h GLU 318 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.06 1jdb h GLU 318 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1jdb h GLU 318 CO 0.83 0.68 0.00 0.00 0.07 0.00 0.00 179.01 180.59 1jdb n ALA 319 N -2.36 1.63 -0.91 1.06 0.00 -1.26 -1.75 120.51 116.93 1jdb n ALA 319 Ca -0.00 -0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.47 1jdb n ALA 319 Cb 0.71 -1.21 0.25 0.00 0.00 0.00 0.00 19.45 19.20 1jdb n ALA 319 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1jdb n THR 320 N -1.45 2.17 -2.41 0.00 -2.24 -1.19 -5.00 114.28 104.16 1jdb n THR 320 Ca 0.04 -1.78 -0.39 0.00 -2.27 0.00 0.00 64.05 59.64 1jdb n THR 320 Cb 0.14 -0.18 -0.04 0.00 -2.10 0.00 0.00 70.33 68.16 1jdb n THR 320 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1jdb s LEU 321 N -2.64 4.42 0.26 3.22 2.96 -0.71 -4.20 118.68 121.99 1jdb s LEU 321 Ca 0.41 2.30 -0.21 0.00 -0.22 0.00 0.00 54.13 56.41 1jdb s LEU 321 Cb 0.32 -3.77 -0.09 0.00 0.50 0.00 0.00 46.19 43.16 1jdb s LEU 321 CO 0.10 -0.32 0.79 -2.16 -1.32 0.00 0.00 176.35 173.43 1jdb s PRO 322 N -1.77 4.32 0.00 0.98 0.04 -1.26 -4.95 135.00 132.36 1jdb s PRO 322 Ca 0.49 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.51 1jdb s PRO 322 Cb -0.31 -2.81 0.00 0.00 0.04 0.00 0.00 34.50 31.42 1jdb s PRO 322 CO 0.40 0.34 0.94 0.00 0.04 0.00 0.00 177.00 178.72 1jdb n ALA 323 N 0.57 1.01 1.15 8.56 0.00 -1.26 -1.20 120.51 129.34 1jdb n ALA 323 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1jdb n ALA 323 Cb 0.51 -0.97 0.50 0.00 0.00 0.00 0.00 19.45 19.50 1jdb n ALA 323 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1jdb n ASN 324 N -1.44 0.34 -4.29 0.00 2.04 -1.26 -4.71 115.26 105.93 1jdb n ASN 324 Ca 0.00 -0.13 -0.36 0.00 -0.44 0.00 0.00 54.58 53.64 1jdb n ASN 324 Cb 0.02 -0.11 -0.13 0.00 -2.53 0.00 0.00 39.78 37.02 1jdb n ASN 324 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 1jdb s LEU 325 N -2.80 3.73 -0.11 -4.53 1.43 -0.34 0.25 118.68 116.31 1jdb s LEU 325 Ca 0.19 -0.82 -0.07 0.00 -1.03 0.00 0.00 54.13 52.39 1jdb s LEU 325 Cb 0.19 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 1jdb s LEU 325 CO 0.56 -0.19 0.15 0.00 0.23 0.00 0.00 176.35 177.10 1jdb s ARG 326 N 1.43 3.45 -0.31 1.70 1.70 0.34 -4.71 118.95 122.54 1jdb s ARG 326 Ca 0.01 -0.14 -0.29 0.00 -0.47 0.00 0.00 55.73 54.84 1jdb s ARG 326 Cb -0.17 -3.18 -0.01 0.00 -0.57 0.00 0.00 34.95 31.02 1jdb s ARG 326 CO 0.01 0.77 1.49 0.08 -1.08 0.00 0.00 175.30 176.57 1jdb s VAL 327 N -1.06 3.85 -0.23 4.99 1.01 -1.26 -0.36 120.40 127.34 1jdb s VAL 327 Ca 0.16 0.92 0.09 0.00 0.00 0.00 0.00 61.98 63.16 1jdb s VAL 327 Cb -0.12 -3.97 -0.20 0.00 0.00 0.00 0.00 36.38 32.09 1jdb s VAL 327 CO 0.06 -0.49 -0.09 0.35 0.00 0.00 0.00 175.10 174.92 1jdb n THR 328 N 6.68 1.40 -4.20 3.92 -2.24 -0.78 -4.87 114.28 114.20 1jdb n THR 328 Ca 0.18 -0.67 -0.15 0.00 -2.27 0.00 0.00 64.05 61.13 1jdb n THR 328 Cb 0.47 -0.99 -0.11 0.00 -2.10 0.00 0.00 70.33 67.60 1jdb n THR 328 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1jdb s HIS 329 N -2.49 1.16 0.01 4.78 3.76 -1.17 -1.51 115.29 119.84 1jdb s HIS 329 Ca -0.23 -0.62 -0.08 0.00 -0.15 0.00 0.00 55.06 53.97 1jdb s HIS 329 Cb 0.07 -0.62 0.00 0.00 1.11 0.00 0.00 32.58 33.14 1jdb s HIS 329 CO 0.68 0.04 0.16 0.15 -0.85 0.00 0.00 174.74 174.92 1jdb s LYS 330 N -2.76 0.56 0.03 1.40 1.02 -0.88 -1.56 119.74 117.55 1jdb s LYS 330 Ca 0.06 -0.47 -0.28 0.00 0.02 0.00 0.00 55.97 55.31 1jdb s LYS 330 Cb -0.03 0.23 -0.05 0.00 -0.52 0.00 0.00 37.83 37.46 1jdb s LYS 330 CO 0.01 -0.14 0.87 0.45 -0.92 0.00 0.00 175.35 175.62 1jdb s SER 331 N -1.61 7.31 0.18 2.83 0.15 0.31 -1.25 113.70 121.61 1jdb s SER 331 Ca -0.12 1.57 0.26 0.00 0.70 0.00 0.00 55.95 58.37 1jdb s SER 331 Cb -0.05 -2.52 0.85 0.00 -1.71 0.00 0.00 66.02 62.59 1jdb s SER 331 CO 0.00 -0.11 1.78 0.18 1.20 0.00 0.00 173.24 176.30 1jdb n LEU 332 N 3.25 0.70 -0.04 3.45 4.32 0.24 -0.45 117.00 128.47 1jdb n LEU 332 Ca 0.01 0.55 -0.16 0.00 -0.02 0.00 0.00 56.01 56.39 1jdb n LEU 332 Cb 0.50 -0.34 -0.13 0.00 -1.62 0.00 0.00 43.42 41.83 1jdb n LEU 332 CO 0.50 -0.15 0.18 -0.26 -1.22 0.00 0.00 177.39 176.44 1jdb h PHE 333 N 0.00 0.14 0.00 -1.77 0.04 -1.91 -3.43 116.94 110.00 1jdb h PHE 333 Ca 0.00 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.67 1jdb h PHE 333 Cb 0.70 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.85 1jdb h PHE 333 CO 0.00 1.14 0.00 -0.40 -0.60 0.00 0.00 178.31 178.45 1jdb n ASP 334 N -4.45 0.17 0.00 2.17 5.68 -1.25 -5.04 116.55 113.83 1jdb n ASP 334 Ca -0.14 -0.52 0.00 0.00 -0.50 0.00 0.00 54.79 53.63 1jdb n ASP 334 Cb 0.59 0.60 0.00 0.00 -1.14 0.00 0.00 41.12 41.17 1jdb n ASP 334 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jdb n GLY 335 N 0.60 0.75 3.78 6.12 0.00 0.40 -5.01 105.19 111.84 1jdb n GLY 335 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1jdb n GLY 335 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jdb s THR 336 N -2.88 3.33 0.21 2.61 -4.23 -1.26 -4.54 115.64 108.88 1jdb s THR 336 Ca 0.00 0.77 -0.30 0.00 -1.18 0.00 0.00 61.69 60.98 1jdb s THR 336 Cb 0.00 -3.28 -0.09 0.00 1.34 0.00 0.00 72.50 70.47 1jdb s THR 336 CO 0.00 -0.24 1.27 -0.22 -0.54 0.00 0.00 174.62 174.89 1jdb s LEU 337 N -4.02 4.43 0.00 4.79 2.96 -1.26 0.11 118.68 125.69 1jdb s LEU 337 Ca 0.70 2.38 0.00 0.00 -0.22 0.00 0.00 54.13 56.99 1jdb s LEU 337 Cb -0.21 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.86 1jdb s LEU 337 CO 0.30 -0.46 0.00 0.00 -1.32 0.00 0.00 176.35 174.86 1jdb n GLN 338 N 2.33 3.80 -3.65 1.98 1.13 -0.60 -4.76 117.38 117.61 1jdb n GLN 338 Ca 0.05 0.00 -0.15 0.00 -1.94 0.00 0.00 57.00 54.95 1jdb n GLN 338 Cb 0.43 -0.30 -0.08 0.00 0.11 0.00 0.00 30.24 30.40 1jdb n GLN 338 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1jdb s GLY 339 N -0.58 -0.38 -0.00 1.08 0.00 -1.11 0.27 107.32 106.59 1jdb s GLY 339 Ca 0.00 0.99 -0.16 0.00 0.00 0.00 0.00 44.72 45.55 1jdb s GLY 339 CO 0.00 0.72 0.34 -0.26 0.00 0.00 0.00 173.10 173.90 1jdb s ILE 340 N -0.92 0.06 -0.02 0.90 -4.36 -0.09 -1.86 121.20 114.91 1jdb s ILE 340 Ca -0.10 -0.47 0.01 0.00 -0.26 0.00 0.00 60.65 59.83 1jdb s ILE 340 Cb -0.03 -0.71 0.02 0.00 1.25 0.00 0.00 42.46 42.99 1jdb s ILE 340 CO 0.06 -0.26 -0.01 -2.28 0.24 0.00 0.00 174.94 172.69 1jdb s HIS 341 N -1.58 0.31 -0.05 1.37 2.46 0.52 0.31 115.29 118.63 1jdb s HIS 341 Ca -0.12 -0.02 -0.30 0.00 0.47 0.00 0.00 55.06 55.09 1jdb s HIS 341 Cb -0.04 -0.34 -0.04 0.00 -0.13 0.00 0.00 32.58 32.03 1jdb s HIS 341 CO 0.03 -0.09 1.26 1.03 -2.47 0.00 0.00 174.74 174.50 1jdb s ARG 342 N 0.66 4.32 0.42 2.88 1.81 0.77 0.13 118.95 129.94 1jdb s ARG 342 Ca -0.07 1.75 0.15 0.00 -1.72 0.00 0.00 55.73 55.85 1jdb s ARG 342 Cb -0.10 -3.58 0.91 0.00 -0.45 0.00 0.00 34.95 31.73 1jdb s ARG 342 CO -0.01 -0.50 1.92 1.79 -0.68 0.00 0.00 175.30 177.81 1jdb h THR 343 N 5.02 1.13 0.00 0.02 1.35 0.30 -3.19 112.91 117.55 1jdb h THR 343 Ca -0.35 -0.94 -0.01 0.00 -0.55 0.00 0.00 66.41 64.56 1jdb h THR 343 Cb 1.16 1.52 -0.00 0.00 -1.73 0.00 0.00 68.15 69.09 1jdb h THR 343 CO 0.89 0.26 -2.00 -0.90 -0.25 0.00 0.00 175.52 173.53 1jdb n ASP 344 N -4.13 0.08 -4.49 5.36 5.68 -1.26 -5.02 116.55 112.77 1jdb n ASP 344 Ca -0.02 0.00 -0.25 0.00 -0.50 0.00 0.00 54.79 54.02 1jdb n ASP 344 Cb 0.33 1.95 -0.10 0.00 -1.14 0.00 0.00 41.12 42.16 1jdb n ASP 344 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1jdb s LYS 345 N -3.46 1.83 -1.06 0.11 -0.14 -1.20 -5.00 119.74 110.82 1jdb s LYS 345 Ca -0.08 -2.05 -0.08 0.00 -1.36 0.00 0.00 55.97 52.40 1jdb s LYS 345 Cb 0.14 -1.12 -0.11 0.00 -1.68 0.00 0.00 37.83 35.05 1jdb s LYS 345 CO 0.89 -0.20 3.09 -0.35 -0.76 0.00 0.00 175.35 178.02 1jdb n PRO 346 N -0.86 3.23 -3.75 -1.68 -0.04 -1.26 -4.38 135.00 126.26 1jdb n PRO 346 Ca -0.05 -1.99 -0.23 0.00 -0.04 0.00 0.00 63.50 61.19 1jdb n PRO 346 Cb 0.67 -2.51 -0.18 0.00 -0.04 0.00 0.00 33.50 31.44 1jdb n PRO 346 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jdb s ALA 347 N 1.28 0.64 0.06 0.55 0.00 -1.26 0.31 121.76 123.34 1jdb s ALA 347 Ca 0.67 -0.11 0.02 0.00 0.00 0.00 0.00 51.96 52.54 1jdb s ALA 347 Cb 0.23 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.57 1jdb s ALA 347 CO -0.05 -0.51 -0.08 -0.59 0.00 0.00 0.00 175.76 174.52 1jdb s PHE 348 N 2.00 0.78 0.07 0.00 -0.71 -0.48 0.27 117.98 119.92 1jdb s PHE 348 Ca 0.05 -0.58 -0.15 0.00 -1.04 0.00 0.00 56.93 55.21 1jdb s PHE 348 Cb -0.12 -0.46 0.03 0.00 -1.21 0.00 0.00 43.02 41.25 1jdb s PHE 348 CO -0.05 -0.08 0.35 -1.54 -1.34 0.00 0.00 175.22 172.56 1jdb s SER 349 N -1.91 -0.18 -0.02 1.98 1.04 0.15 -2.45 113.70 112.31 1jdb s SER 349 Ca -0.04 -0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.19 1jdb s SER 349 Cb -0.07 0.41 -0.00 0.00 0.10 0.00 0.00 66.02 66.46 1jdb s SER 349 CO -0.00 -0.71 -0.12 0.12 0.98 0.00 0.00 173.24 173.50 1jdb s PHE 350 N -3.06 1.17 0.11 5.02 5.36 -1.04 -0.91 117.98 124.63 1jdb s PHE 350 Ca -0.02 -0.28 -0.13 0.00 -0.96 0.00 0.00 56.93 55.54 1jdb s PHE 350 Cb 0.01 -0.80 -0.10 0.00 -0.34 0.00 0.00 43.02 41.79 1jdb s PHE 350 CO -0.07 -0.09 1.38 0.37 -1.46 0.00 0.00 175.22 175.36 1jdb h GLN 351 N 6.17 0.81 0.00 10.12 5.75 0.35 -0.61 115.11 137.69 1jdb h GLN 351 Ca -0.33 -0.52 0.00 0.00 -0.15 0.00 0.00 58.65 57.65 1jdb h GLN 351 Cb 1.17 0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.78 1jdb h GLN 351 CO 0.49 1.15 0.00 0.41 -2.65 0.00 0.00 178.83 178.22 1jdb n GLY 352 N 0.39 -1.10 2.99 2.39 0.00 -1.26 -3.64 105.19 104.96 1jdb n GLY 352 Ca -0.05 -1.58 -0.31 0.00 0.00 0.00 0.00 46.02 44.08 1jdb n GLY 352 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1jdb s HIS 353 N -0.05 3.49 0.47 1.61 3.76 -0.08 -4.28 115.29 120.20 1jdb s HIS 353 Ca 0.00 -2.80 0.12 0.00 -0.15 0.00 0.00 55.06 52.23 1jdb s HIS 353 Cb 0.00 -2.70 1.08 0.00 1.11 0.00 0.00 32.58 32.07 1jdb s HIS 353 CO 0.00 -0.93 2.09 -1.35 -0.85 0.00 0.00 174.74 173.70 1jdb h PRO 354 N 7.68 0.20 -0.00 8.40 0.11 -1.88 -0.31 132.00 146.19 1jdb h PRO 354 Ca -0.06 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1jdb h PRO 354 Cb 1.02 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1jdb h PRO 354 CO 0.51 0.16 -0.02 -0.85 -0.21 0.00 0.00 178.00 177.59 1jdb n GLU 355 N -4.48 0.31 0.00 1.05 0.00 -1.26 -3.48 120.64 112.77 1jdb n GLU 355 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.14 1jdb n GLU 355 Cb 0.10 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.04 1jdb n GLU 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1jdb n ALA 356 N -1.33 0.00 -3.04 -1.84 0.00 -0.13 -4.83 120.51 109.34 1jdb n ALA 356 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.47 1jdb n ALA 356 Cb 0.27 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.73 1jdb n ALA 356 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1jdb n SER 357 N 4.36 -7.48 -4.80 0.00 2.88 -1.26 -4.83 113.62 102.50 1jdb n SER 357 Ca 0.00 0.17 -0.23 0.00 -1.33 0.00 0.00 58.87 57.48 1jdb n SER 357 Cb 0.00 -4.78 0.08 0.00 -0.75 0.00 0.00 64.21 58.76 1jdb n SER 357 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1jdb s PRO 358 N -2.87 2.01 0.00 -1.46 0.04 -1.26 -4.76 135.00 126.70 1jdb s PRO 358 Ca 0.16 -0.82 0.00 0.00 0.04 0.00 0.00 61.00 60.38 1jdb s PRO 358 Cb -0.04 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 32.17 1jdb s PRO 358 CO 0.78 -1.21 0.00 0.41 0.04 0.00 0.00 177.00 177.02 1jdb n GLY 359 N -2.73 0.82 3.71 0.56 0.00 -1.26 -4.77 105.19 101.52 1jdb n GLY 359 Ca 0.11 -2.30 -0.43 0.00 0.00 0.00 0.00 46.02 43.41 1jdb n GLY 359 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1jdb n PRO 360 N -0.84 2.49 0.00 1.61 -0.02 -1.26 -4.89 135.00 132.09 1jdb n PRO 360 Ca 0.00 0.89 0.07 0.00 -2.02 0.00 0.00 63.50 62.44 1jdb n PRO 360 Cb 0.00 -2.67 0.43 0.00 -0.02 0.00 0.00 33.50 31.24 1jdb n PRO 360 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1jdb n HIS 361 N 2.96 0.00 -0.31 6.00 8.25 -1.26 -4.37 115.22 126.48 1jdb n HIS 361 Ca 0.13 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.78 1jdb n HIS 361 Cb 0.33 0.00 0.44 0.00 1.12 0.00 0.00 29.99 31.89 1jdb n HIS 361 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1jdb h ASP 362 N 0.00 0.55 0.12 0.41 5.19 -1.92 -2.24 116.42 118.54 1jdb h ASP 362 Ca 0.00 0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 1jdb h ASP 362 Cb 0.00 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.49 1jdb h ASP 362 CO 0.00 0.17 -0.14 0.00 -3.12 0.00 0.00 179.24 176.15 1jdb n ALA 363 N -2.43 2.84 -0.34 3.45 0.00 -1.26 -4.40 120.51 118.37 1jdb n ALA 363 Ca 0.23 -0.42 0.21 0.00 0.00 0.00 0.00 53.44 53.46 1jdb n ALA 363 Cb 0.73 -1.15 0.46 0.00 0.00 0.00 0.00 19.45 19.49 1jdb n ALA 363 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jdb h ALA 364 N 4.00 2.06 0.00 0.00 0.00 -1.43 -1.12 119.26 122.76 1jdb h ALA 364 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1jdb h ALA 364 Cb 0.51 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1jdb h ALA 364 CO 0.00 -0.51 0.22 -2.30 0.00 0.00 0.00 179.25 176.66 1jdb n PRO 365 N -4.75 0.06 -0.32 0.00 -0.01 -1.26 -1.91 135.00 126.81 1jdb n PRO 365 Ca 0.27 0.48 -0.03 0.00 -0.01 0.00 0.00 63.50 64.20 1jdb n PRO 365 Cb 0.85 -1.90 0.11 0.00 -0.01 0.00 0.00 33.50 32.54 1jdb n PRO 365 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 175.50 175.42 1jdb h LEU 366 N 0.00 1.10 -2.29 2.45 4.07 -1.55 -2.13 115.31 116.95 1jdb h LEU 366 Ca 0.00 -0.09 -0.01 0.00 0.08 0.00 0.00 57.88 57.86 1jdb h LEU 366 Cb 0.43 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 41.89 1jdb h LEU 366 CO 0.00 0.87 -0.04 -0.26 -1.08 0.00 0.00 178.44 177.93 1jdb h PHE 367 N 1.24 0.00 -0.59 1.13 0.04 -1.62 -2.47 116.94 114.67 1jdb h PHE 367 Ca 0.31 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.98 1jdb h PHE 367 Cb 0.01 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.14 1jdb h PHE 367 CO 0.01 0.04 -0.02 -0.44 -0.60 0.00 0.00 178.31 177.30 1jdb h ASP 368 N 0.00 1.04 0.54 2.17 3.32 -1.56 -2.19 116.42 119.74 1jdb h ASP 368 Ca -0.00 -0.31 -0.02 0.00 0.02 0.00 0.00 57.03 56.72 1jdb h ASP 368 Cb 0.19 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 1jdb h ASP 368 CO 0.01 1.10 -0.11 -0.74 -1.72 0.00 0.00 179.24 177.78 1jdb h HIS 369 N 0.96 0.00 0.06 4.55 2.76 -1.52 0.64 115.15 122.59 1jdb h HIS 369 Ca 0.17 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1jdb h HIS 369 Cb 0.59 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.55 1jdb h HIS 369 CO 0.04 0.11 -0.03 0.35 -1.30 0.00 0.00 177.93 177.10 1jdb h PHE 370 N 0.00 -0.07 -0.82 5.26 3.57 -1.52 -2.88 116.94 120.48 1jdb h PHE 370 Ca -0.00 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.62 1jdb h PHE 370 Cb 0.41 0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.11 1jdb h PHE 370 CO 0.00 0.52 0.54 0.82 -2.23 0.00 0.00 178.31 177.96 1jdb h ILE 371 N -0.91 0.88 -0.18 1.41 1.08 -1.10 0.10 117.51 118.79 1jdb h ILE 371 Ca -0.01 -0.23 -0.09 0.00 -0.39 0.00 0.00 64.86 64.14 1jdb h ILE 371 Cb 0.62 0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 34.51 1jdb h ILE 371 CO 0.01 0.12 -0.29 -0.08 -0.69 0.00 0.00 178.15 177.22 1jdb h GLU 372 N 0.67 0.35 -0.16 2.37 4.81 -0.90 -1.68 114.58 120.05 1jdb h GLU 372 Ca 0.40 -0.13 -0.17 0.00 -0.13 0.00 0.00 59.36 59.33 1jdb h GLU 372 Cb 0.61 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1jdb h GLU 372 CO -0.16 0.61 -0.59 -0.07 -0.73 0.00 0.00 179.01 178.07 1jdb h LEU 373 N 0.31 0.58 -0.21 1.64 3.38 -0.79 -2.83 115.31 117.40 1jdb h LEU 373 Ca 0.04 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1jdb h LEU 373 Cb 0.67 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1jdb h LEU 373 CO 0.05 1.04 0.10 0.40 0.09 0.00 0.00 178.44 180.12 1jdb h ILE 374 N 0.39 1.14 -0.93 1.22 2.04 -0.98 -0.82 117.51 119.56 1jdb h ILE 374 Ca -0.00 -0.39 0.02 0.00 1.00 0.00 0.00 64.86 65.49 1jdb h ILE 374 Cb 1.14 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 38.19 1jdb h ILE 374 CO 0.11 0.13 0.62 -0.08 0.00 0.00 0.00 178.15 178.93 1jdb h GLU 375 N 0.20 1.18 0.52 2.37 4.81 -1.29 -1.88 114.58 120.50 1jdb h GLU 375 Ca 0.07 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1jdb h GLU 375 Cb 0.12 -0.27 0.01 0.00 0.63 0.00 0.00 28.75 29.24 1jdb h GLU 375 CO -0.01 0.78 -0.25 0.37 -0.73 0.00 0.00 179.01 179.17 1jdb h GLN 376 N 1.22 -0.68 -0.61 1.92 4.15 -1.28 -0.53 115.11 119.30 1jdb h GLN 376 Ca 0.36 0.05 0.12 0.00 0.77 0.00 0.00 58.65 59.94 1jdb h GLN 376 Cb -0.07 0.15 -0.12 0.00 0.21 0.00 0.00 27.48 27.66 1jdb h GLN 376 CO -0.09 -0.43 -0.16 -0.92 -1.93 0.00 0.00 178.83 175.29 1jdb h TYR 377 N -0.75 -0.35 -0.02 3.99 3.20 -0.60 0.94 116.97 123.39 1jdb h TYR 377 Ca -0.07 0.06 -0.18 0.00 3.14 0.00 0.00 58.73 61.68 1jdb h TYR 377 Cb 0.56 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.07 1jdb h TYR 377 CO -0.03 -0.27 -0.78 0.00 -1.64 0.00 0.00 178.16 175.45 1jdb h ARG 378 N -0.01 0.18 -0.93 1.82 3.08 -1.21 -2.53 114.38 114.78 1jdb h ARG 378 Ca 0.29 -0.17 0.13 0.00 0.07 0.00 0.00 59.98 60.30 1jdb h ARG 378 Cb 0.45 0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.47 1jdb h ARG 378 CO -0.63 0.87 0.59 -0.22 -1.07 0.00 0.00 179.97 179.51 1jdb h LYS 379 N 0.11 0.78 0.00 0.04 3.64 -0.28 -3.51 116.57 117.35 1jdb h LYS 379 Ca -0.03 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1jdb h LYS 379 Cb 1.36 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1jdb h LYS 379 CO 0.12 0.52 0.00 2.41 -2.27 0.00 0.00 179.45 180.22