#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k49 h SER 2 N 0.00 0.00 -3.87 6.12 0.02 -1.92 -3.45 113.55 110.45 2k49 h SER 2 Ca 0.00 0.00 -0.44 0.00 -0.84 0.00 0.00 61.79 60.51 2k49 h SER 2 Cb 0.00 0.00 0.16 0.00 0.14 0.00 0.00 62.40 62.70 2k49 h SER 2 CO 0.00 0.00 0.24 -0.83 -1.14 0.00 0.00 176.83 175.10 2k49 s GLY 3 N -3.88 1.61 0.16 -3.77 0.00 -1.26 -4.48 107.32 95.70 2k49 s GLY 3 Ca -0.00 -0.76 -0.14 0.00 0.00 0.00 0.00 44.72 43.82 2k49 s GLY 3 CO 0.41 -0.04 0.39 0.66 0.00 0.00 0.00 173.10 174.52 2k49 s TRP 4 N -3.23 0.07 -0.06 1.90 -2.14 -0.96 -4.68 118.94 109.84 2k49 s TRP 4 Ca 0.68 -0.42 -0.01 0.00 2.66 0.00 0.00 56.10 59.01 2k49 s TRP 4 Cb -0.12 0.18 -0.04 0.00 -3.10 0.00 0.00 33.47 30.39 2k49 s TRP 4 CO 0.55 -0.78 0.03 0.71 -2.66 0.00 0.00 176.95 174.80 2k49 s TYR 5 N -3.89 3.21 -0.17 1.66 1.51 -0.07 -1.22 117.35 118.38 2k49 s TYR 5 Ca 0.10 0.20 0.00 0.00 -1.01 0.00 0.00 57.07 56.37 2k49 s TYR 5 Cb 0.01 -1.77 0.03 0.00 -0.11 0.00 0.00 41.96 40.13 2k49 s TYR 5 CO -0.04 0.51 -0.10 -1.21 -1.11 0.00 0.00 175.55 173.59 2k49 s GLU 6 N -1.18 1.98 -0.22 -0.62 2.02 -0.30 -0.15 118.70 120.23 2k49 s GLU 6 Ca 0.16 -0.66 -0.18 0.00 0.02 0.00 0.00 54.97 54.31 2k49 s GLU 6 Cb -0.12 -2.20 -0.03 0.00 0.10 0.00 0.00 34.13 31.89 2k49 s GLU 6 CO 0.06 -0.36 0.51 -1.17 0.02 0.00 0.00 175.26 174.33 2k49 s LEU 7 N 1.48 4.12 0.26 1.80 2.96 -0.17 -1.20 118.68 127.93 2k49 s LEU 7 Ca 0.01 0.62 0.11 0.00 -0.22 0.00 0.00 54.13 54.66 2k49 s LEU 7 Cb -0.15 -2.69 -0.05 0.00 0.50 0.00 0.00 46.19 43.81 2k49 s LEU 7 CO -0.09 -0.21 -0.18 -0.94 -1.32 0.00 0.00 176.35 173.61 2k49 s SER 8 N 1.26 3.69 -0.12 3.68 1.04 0.33 -1.09 113.70 122.49 2k49 s SER 8 Ca 0.23 -0.94 0.02 0.00 0.48 0.00 0.00 55.95 55.75 2k49 s SER 8 Cb -0.15 -0.37 -0.00 0.00 0.10 0.00 0.00 66.02 65.60 2k49 s SER 8 CO 0.09 0.06 -0.20 -0.75 0.98 0.00 0.00 173.24 173.42 2k49 s LYS 9 N -3.33 3.13 0.95 4.02 2.20 -1.26 -0.75 119.74 124.70 2k49 s LYS 9 Ca 0.28 -0.82 -0.15 0.00 -0.36 0.00 0.00 55.97 54.92 2k49 s LYS 9 Cb -0.06 -2.45 0.19 0.00 -1.51 0.00 0.00 37.83 34.00 2k49 s LYS 9 CO 0.14 0.11 1.31 0.45 -0.36 0.00 0.00 175.35 177.00 2k49 s SER 10 N 0.54 3.24 0.40 1.43 0.15 0.27 -4.91 113.70 114.81 2k49 s SER 10 Ca -0.12 0.30 0.08 0.00 0.70 0.00 0.00 55.95 56.90 2k49 s SER 10 Cb -0.17 -0.38 0.85 0.00 -1.71 0.00 0.00 66.02 64.61 2k49 s SER 10 CO 0.04 -2.66 2.01 0.77 1.20 0.00 0.00 173.24 174.61 2k49 h SER 11 N -1.58 0.52 -0.10 5.45 4.64 -2.01 -0.96 113.55 119.50 2k49 h SER 11 Ca -0.44 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2k49 h SER 11 Cb 1.24 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2k49 h SER 11 CO 0.40 0.35 0.00 0.59 -0.87 0.00 0.00 176.83 177.30 2k49 n ASN 12 N -4.47 1.55 -1.50 4.97 3.02 -1.26 -4.83 115.26 112.74 2k49 n ASN 12 Ca 0.07 -2.12 -0.20 0.00 -0.03 0.00 0.00 54.58 52.30 2k49 n ASN 12 Cb 0.17 -0.43 -0.08 0.00 -0.61 0.00 0.00 39.78 38.83 2k49 n ASN 12 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2k49 n ASP 13 N 0.05 -5.54 -4.76 6.41 9.92 -0.36 -4.97 116.55 117.30 2k49 n ASP 13 Ca 0.05 0.48 -0.40 0.00 -0.53 0.00 0.00 54.79 54.39 2k49 n ASP 13 Cb 0.34 -4.76 -0.06 0.00 -0.64 0.00 0.00 41.12 36.01 2k49 n ASP 13 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2k49 s GLN 14 N -3.66 4.53 -0.11 -1.24 -0.21 -1.25 -4.81 119.66 112.91 2k49 s GLN 14 Ca 0.00 1.12 -0.11 0.00 0.02 0.00 0.00 55.36 56.39 2k49 s GLN 14 Cb 0.00 -3.31 -0.05 0.00 1.00 0.00 0.00 33.01 30.65 2k49 s GLN 14 CO 0.00 0.44 0.25 -0.06 -2.12 0.00 0.00 175.29 173.80 2k49 s PHE 15 N -0.63 3.56 -0.05 0.91 0.40 -0.12 -0.57 117.98 121.49 2k49 s PHE 15 Ca 0.37 0.64 -0.02 0.00 -0.60 0.00 0.00 56.93 57.32 2k49 s PHE 15 Cb -0.22 -2.18 0.03 0.00 0.51 0.00 0.00 43.02 41.16 2k49 s PHE 15 CO 0.25 0.50 0.08 -1.59 0.70 0.00 0.00 175.22 175.15 2k49 s LYS 16 N -0.38 -0.04 0.06 0.44 -2.85 0.07 -0.28 119.74 116.76 2k49 s LYS 16 Ca 0.17 0.39 0.03 0.00 -1.00 0.00 0.00 55.97 55.55 2k49 s LYS 16 Cb -0.13 -0.41 -0.04 0.00 -2.06 0.00 0.00 37.83 35.19 2k49 s LYS 16 CO 0.05 -0.29 0.05 -0.59 0.10 0.00 0.00 175.35 174.67 2k49 s PHE 17 N 1.98 3.14 0.01 1.78 -0.71 -1.26 -0.51 117.98 122.41 2k49 s PHE 17 Ca 0.02 0.07 0.08 0.00 -1.04 0.00 0.00 56.93 56.06 2k49 s PHE 17 Cb -0.12 -1.63 -0.02 0.00 -1.21 0.00 0.00 43.02 40.04 2k49 s PHE 17 CO -0.04 0.51 -0.24 0.14 -1.34 0.00 0.00 175.22 174.25 2k49 s VAL 18 N -1.29 1.91 -0.28 -2.49 -7.23 -0.34 -1.73 120.40 108.95 2k49 s VAL 18 Ca 0.26 -1.15 -0.08 0.00 -1.81 0.00 0.00 61.98 59.20 2k49 s VAL 18 Cb -0.12 -1.61 -0.02 0.00 0.56 0.00 0.00 36.38 35.19 2k49 s VAL 18 CO 0.18 0.43 0.11 -0.22 -0.31 0.00 0.00 175.10 175.29 2k49 s LEU 19 N -0.85 3.78 -0.12 1.32 2.96 -0.27 -1.15 118.68 124.36 2k49 s LEU 19 Ca 0.10 -0.35 -0.13 0.00 -0.22 0.00 0.00 54.13 53.52 2k49 s LEU 19 Cb -0.09 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.58 2k49 s LEU 19 CO 0.00 -0.11 0.31 -0.54 -1.32 0.00 0.00 176.35 174.69 2k49 s LYS 20 N 1.62 4.09 0.00 1.98 1.02 -0.36 -0.71 119.74 127.38 2k49 s LYS 20 Ca 0.05 0.16 0.00 0.00 0.02 0.00 0.00 55.97 56.20 2k49 s LYS 20 Cb -0.16 -3.35 0.00 0.00 -0.52 0.00 0.00 37.83 33.80 2k49 s LYS 20 CO 0.05 0.40 1.57 0.00 -0.92 0.00 0.00 175.35 176.45 2k49 n ALA 21 N 3.01 3.37 0.00 5.17 0.00 0.00 -2.28 120.51 129.78 2k49 n ALA 21 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2k49 n ALA 21 Cb 0.52 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.95 2k49 n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k49 n GLY 22 N 1.14 1.79 0.00 0.00 0.00 -1.26 -4.67 105.19 102.20 2k49 n GLY 22 Ca 0.00 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 45.90 2k49 n GLY 22 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2k49 n ASN 23 N 2.35 0.00 0.00 1.61 6.94 -1.26 -4.86 115.26 120.04 2k49 n ASN 23 Ca 0.00 0.04 0.00 0.00 -0.02 0.00 0.00 54.58 54.60 2k49 n ASN 23 Cb 0.00 -0.32 0.00 0.00 -2.36 0.00 0.00 39.78 37.10 2k49 n ASN 23 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2k49 n GLY 24 N 0.64 1.85 3.71 4.83 0.00 -1.26 -5.07 105.19 109.89 2k49 n GLY 24 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2k49 n GLY 24 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k49 s GLU 25 N -0.83 4.52 -0.20 1.61 2.12 -1.26 -4.83 118.70 119.83 2k49 s GLU 25 Ca 0.00 1.48 -0.28 0.00 0.36 0.00 0.00 54.97 56.53 2k49 s GLU 25 Cb 0.00 -3.45 0.00 0.00 0.26 0.00 0.00 34.13 30.94 2k49 s GLU 25 CO 0.00 -0.12 0.98 0.08 -0.54 0.00 0.00 175.26 175.67 2k49 s VAL 26 N 1.13 4.74 -0.17 3.70 1.01 -1.26 -0.82 120.40 128.73 2k49 s VAL 26 Ca 0.53 1.93 0.03 0.00 0.00 0.00 0.00 61.98 64.47 2k49 s VAL 26 Cb -0.22 -4.27 -0.22 0.00 0.00 0.00 0.00 36.38 31.67 2k49 s VAL 26 CO 0.27 -0.11 0.14 2.30 0.00 0.00 0.00 175.10 177.70 2k49 n ILE 27 N 5.10 1.59 -5.01 2.22 -5.35 0.12 -4.80 119.36 113.24 2k49 n ILE 27 Ca 0.10 -0.67 -0.28 0.00 -0.27 0.00 0.00 62.75 61.63 2k49 n ILE 27 Cb 0.47 -1.34 -0.16 0.00 -1.74 0.00 0.00 39.64 36.87 2k49 n ILE 27 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2k49 s LEU 28 N -6.50 2.00 -0.18 7.28 2.01 -1.20 -3.47 118.68 118.62 2k49 s LEU 28 Ca -0.23 -0.40 -0.00 0.00 0.01 0.00 0.00 54.13 53.51 2k49 s LEU 28 Cb 0.08 -1.11 0.04 0.00 0.01 0.00 0.00 46.19 45.21 2k49 s LEU 28 CO 0.72 0.21 -0.06 -0.89 1.01 0.00 0.00 176.35 177.34 2k49 s THR 29 N -0.19 1.24 0.64 5.49 2.01 0.38 -1.11 115.64 124.10 2k49 s THR 29 Ca 0.00 -0.73 -0.10 0.00 0.31 0.00 0.00 61.69 61.17 2k49 s THR 29 Cb -0.11 -1.40 -0.00 0.00 0.01 0.00 0.00 72.50 71.00 2k49 s THR 29 CO 0.02 0.13 1.01 -0.44 -0.69 0.00 0.00 174.62 174.65 2k49 s SER 30 N 1.57 5.72 0.89 3.53 0.01 -0.70 -1.72 113.70 123.01 2k49 s SER 30 Ca 0.00 1.08 -0.07 0.00 1.31 0.00 0.00 55.95 58.27 2k49 s SER 30 Cb -0.16 -2.02 0.12 0.00 0.21 0.00 0.00 66.02 64.17 2k49 s SER 30 CO -0.08 -1.11 0.71 -0.62 0.41 0.00 0.00 173.24 172.55 2k49 n GLU 31 N -2.79 -0.50 -2.65 12.44 -0.58 -1.26 -4.58 120.64 120.72 2k49 n GLU 31 Ca 0.06 -1.26 -0.42 0.00 -0.42 0.00 0.00 57.16 55.12 2k49 n GLU 31 Cb 0.56 -0.68 -0.03 0.00 -0.57 0.00 0.00 31.44 30.73 2k49 n GLU 31 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2k49 s LEU 32 N 0.00 3.63 0.27 -4.62 1.43 -1.26 -4.30 118.68 113.84 2k49 s LEU 32 Ca 0.41 -0.84 -0.29 0.00 -1.03 0.00 0.00 54.13 52.38 2k49 s LEU 32 Cb -0.01 -2.52 -0.09 0.00 0.03 0.00 0.00 46.19 43.60 2k49 s LEU 32 CO 0.29 -1.64 1.16 -0.31 0.23 0.00 0.00 176.35 176.08 2k49 s TYR 33 N 5.02 3.44 -1.20 0.29 1.51 0.62 -4.77 117.35 122.26 2k49 s TYR 33 Ca 0.33 1.59 0.06 0.00 -1.01 0.00 0.00 57.07 58.05 2k49 s TYR 33 Cb -0.09 -3.39 0.27 0.00 -0.11 0.00 0.00 41.96 38.64 2k49 s TYR 33 CO 0.08 -0.94 1.04 0.25 -1.11 0.00 0.00 175.55 174.88 2k49 n THR 34 N 1.34 0.76 -3.66 -0.71 -2.24 -1.26 -0.95 114.28 107.57 2k49 n THR 34 Ca 0.00 -0.45 -0.09 0.00 -2.27 0.00 0.00 64.05 61.25 2k49 n THR 34 Cb 0.44 -0.20 -0.08 0.00 -2.10 0.00 0.00 70.33 68.39 2k49 n THR 34 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2k49 s GLY 35 N -0.55 -0.54 0.07 3.38 0.00 -1.26 -5.01 107.32 103.42 2k49 s GLY 35 Ca 0.19 2.13 -0.32 0.00 0.00 0.00 0.00 44.72 46.72 2k49 s GLY 35 CO 0.08 2.14 1.64 1.70 0.00 0.00 0.00 173.10 178.65 2k49 h LYS 36 N 6.88 -0.80 0.00 2.90 3.64 -1.92 0.53 116.57 127.80 2k49 h LYS 36 Ca -0.32 0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.11 2k49 h LYS 36 Cb 1.21 0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 33.21 2k49 h LYS 36 CO 0.19 -0.53 -0.01 1.03 -2.27 0.00 0.00 179.45 177.86 2k49 h SER 37 N -0.83 0.00 -0.56 4.20 0.87 -1.99 -1.87 113.55 113.37 2k49 h SER 37 Ca -0.08 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.40 2k49 h SER 37 Cb 0.63 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.57 2k49 h SER 37 CO 0.14 0.01 0.05 1.23 -0.53 0.00 0.00 176.83 177.73 2k49 h GLY 38 N 0.05 1.07 0.87 5.77 0.00 -1.75 0.14 103.07 109.21 2k49 h GLY 38 Ca -0.00 -0.73 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 2k49 h GLY 38 CO 0.00 0.67 0.05 0.00 0.00 0.00 0.00 176.54 177.27 2k49 h ALA 39 N 1.12 0.19 -0.97 3.60 0.00 -0.11 -0.58 119.26 122.50 2k49 h ALA 39 Ca 0.18 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.00 2k49 h ALA 39 Cb 0.47 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 2k49 h ALA 39 CO 0.02 -0.22 0.64 0.52 0.00 0.00 0.00 179.25 180.21 2k49 h MET 40 N 0.07 1.25 -0.92 0.00 2.86 -1.34 0.09 114.93 116.93 2k49 h MET 40 Ca 0.05 -0.08 0.12 0.00 -2.06 0.00 0.00 59.70 57.73 2k49 h MET 40 Cb 0.19 -0.28 -0.07 0.00 0.06 0.00 0.00 31.60 31.49 2k49 h MET 40 CO -0.00 0.83 0.59 -0.97 1.06 0.00 0.00 176.91 178.42 2k49 h ASN 41 N 1.29 0.80 -0.94 1.22 -1.24 -0.45 0.13 115.58 116.38 2k49 h ASN 41 Ca 0.37 0.03 0.03 0.00 0.71 0.00 0.00 56.30 57.45 2k49 h ASN 41 Cb -0.09 -0.13 -0.05 0.00 0.73 0.00 0.00 38.32 38.78 2k49 h ASN 41 CO -0.10 0.44 0.62 1.23 -1.29 0.00 0.00 177.43 178.33 2k49 h GLY 42 N 0.86 1.35 1.32 1.57 0.00 0.64 -1.21 103.07 107.61 2k49 h GLY 42 Ca 0.45 -0.47 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 2k49 h GLY 42 CO -0.21 0.41 0.00 -2.22 0.00 0.00 0.00 176.54 174.52 2k49 h ILE 43 N 1.19 1.25 -0.73 2.60 2.04 -0.06 -1.45 117.51 122.35 2k49 h ILE 43 Ca 0.37 -1.02 0.01 0.00 1.00 0.00 0.00 64.86 65.21 2k49 h ILE 43 Cb -0.01 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 2k49 h ILE 43 CO -0.11 0.36 0.48 -0.33 0.00 0.00 0.00 178.15 178.55 2k49 h GLU 44 N 0.77 0.97 -0.84 2.37 5.08 -0.58 0.22 114.58 122.56 2k49 h GLU 44 Ca 0.15 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.51 2k49 h GLU 44 Cb 0.46 -0.22 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 2k49 h GLU 44 CO 0.02 0.65 0.52 0.77 -1.00 0.00 0.00 179.01 179.97 2k49 h SER 45 N 0.99 0.82 -0.52 1.42 0.02 -0.68 -1.67 113.55 113.93 2k49 h SER 45 Ca 0.27 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 61.13 2k49 h SER 45 Cb -0.11 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 2k49 h SER 45 CO -0.06 0.53 -0.08 0.58 -1.14 0.00 0.00 176.83 176.66 2k49 h VAL 46 N 0.96 1.27 -0.89 2.27 2.07 -0.57 -0.41 116.25 120.94 2k49 h VAL 46 Ca 0.37 -1.22 0.16 0.00 0.82 0.00 0.00 66.70 66.83 2k49 h VAL 46 Cb 0.16 0.93 -0.07 0.00 -1.52 0.00 0.00 31.29 30.79 2k49 h VAL 46 CO -0.17 0.43 0.58 1.56 0.02 0.00 0.00 177.57 179.99 2k49 h GLN 47 N 0.89 0.59 0.03 1.57 1.08 0.28 0.41 115.11 119.97 2k49 h GLN 47 Ca 0.15 -0.04 -0.07 0.00 -1.45 0.00 0.00 58.65 57.24 2k49 h GLN 47 Cb 0.63 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 2k49 h GLN 47 CO 0.04 0.39 -0.32 1.15 -0.95 0.00 0.00 178.83 179.14 2k49 h THR 48 N 0.60 1.64 0.00 -0.54 2.02 -1.11 -3.38 112.91 112.15 2k49 h THR 48 Ca 0.46 -2.38 -0.08 0.00 0.77 0.00 0.00 66.41 65.18 2k49 h THR 48 Cb 0.86 3.24 -0.01 0.00 -1.74 0.00 0.00 68.15 70.49 2k49 h THR 48 CO -0.21 0.61 -0.38 0.78 0.37 0.00 0.00 175.52 176.70 2k49 h ASN 49 N -0.84 0.00 -0.94 4.18 2.35 -0.68 -3.38 115.58 116.27 2k49 h ASN 49 Ca -0.07 0.00 0.14 0.00 -0.55 0.00 0.00 56.30 55.82 2k49 h ASN 49 Cb 1.19 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.41 2k49 h ASN 49 CO 0.02 0.38 -0.42 -1.28 -1.65 0.00 0.00 177.43 174.48 2k49 h SER 50 N 0.00 -1.52 -0.12 5.81 0.87 -0.37 0.25 113.55 118.46 2k49 h SER 50 Ca -0.00 0.30 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 2k49 h SER 50 Cb 0.80 0.77 0.00 0.00 -0.44 0.00 0.00 62.40 63.53 2k49 h SER 50 CO 0.05 -0.28 0.00 -0.81 -0.53 0.00 0.00 176.83 175.25 2k49 n PRO 51 N -5.43 1.64 -3.57 2.24 -0.04 -1.26 -3.85 135.00 124.72 2k49 n PRO 51 Ca 0.08 -0.95 -0.40 0.00 -0.04 0.00 0.00 63.50 62.18 2k49 n PRO 51 Cb 0.37 -1.40 -0.09 0.00 -0.04 0.00 0.00 33.50 32.35 2k49 n PRO 51 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2k49 s ILE 52 N -1.85 4.15 0.46 0.52 1.01 0.87 -4.93 121.20 121.42 2k49 s ILE 52 Ca 0.33 -1.88 0.24 0.00 0.00 0.00 0.00 60.65 59.35 2k49 s ILE 52 Cb 0.18 -3.73 0.27 0.00 0.01 0.00 0.00 42.46 39.19 2k49 s ILE 52 CO 0.27 -0.78 2.08 -0.08 0.00 0.00 0.00 174.94 176.44 2k49 h GLU 53 N 8.35 0.00 -0.28 2.79 4.57 -1.87 -2.89 114.58 125.25 2k49 h GLU 53 Ca -0.19 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 58.07 2k49 h GLU 53 Cb 1.06 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.64 2k49 h GLU 53 CO 0.84 0.12 0.35 0.00 -1.18 0.00 0.00 179.01 179.14 2k49 h ALA 54 N 1.88 1.89 -0.48 2.92 0.00 -1.93 -0.30 119.26 123.25 2k49 h ALA 54 Ca -0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2k49 h ALA 54 Cb 0.27 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 2k49 h ALA 54 CO 0.01 -0.50 0.14 0.54 0.00 0.00 0.00 179.25 179.45 2k49 n ARG 55 N -3.60 3.10 -1.60 0.00 5.12 -1.09 -5.00 116.66 113.59 2k49 n ARG 55 Ca 0.04 -2.12 -0.29 0.00 -1.93 0.00 0.00 57.85 53.55 2k49 n ARG 55 Cb 0.49 -1.96 0.11 0.00 -1.16 0.00 0.00 32.46 29.94 2k49 n ARG 55 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 2k49 s TYR 56 N -2.21 2.75 -0.29 -1.55 1.13 -0.13 -3.81 117.35 113.23 2k49 s TYR 56 Ca 0.38 0.99 0.00 0.00 -1.41 0.00 0.00 57.07 57.03 2k49 s TYR 56 Cb 0.30 -3.26 0.19 0.00 -1.10 0.00 0.00 41.96 38.09 2k49 s TYR 56 CO 0.10 -1.97 0.72 0.00 -2.51 0.00 0.00 175.55 171.89 2k49 s ALA 57 N -3.26 -2.84 -0.15 9.51 0.00 -1.20 -4.89 121.76 118.94 2k49 s ALA 57 Ca 0.62 1.22 -0.05 0.00 0.00 0.00 0.00 51.96 53.76 2k49 s ALA 57 Cb -0.14 -2.58 -0.03 0.00 0.00 0.00 0.00 23.12 20.37 2k49 s ALA 57 CO 0.53 -1.83 0.00 0.15 0.00 0.00 0.00 175.76 174.61 2k49 s LYS 58 N 2.87 3.68 0.18 0.00 3.01 -1.26 -0.94 119.74 127.27 2k49 s LYS 58 Ca 0.15 -0.44 -0.03 0.00 -1.01 0.00 0.00 55.97 54.64 2k49 s LYS 58 Cb -0.08 -3.00 -0.03 0.00 -1.01 0.00 0.00 37.83 33.71 2k49 s LYS 58 CO -0.24 0.32 0.16 -1.21 0.51 0.00 0.00 175.35 174.89 2k49 s GLU 59 N 0.18 1.16 -0.11 1.68 2.02 -0.64 -5.01 118.70 117.98 2k49 s GLU 59 Ca 0.01 -1.50 0.00 0.00 0.02 0.00 0.00 54.97 53.50 2k49 s GLU 59 Cb -0.13 0.29 0.02 0.00 0.10 0.00 0.00 34.13 34.41 2k49 s GLU 59 CO 0.02 -0.38 -0.10 0.08 0.02 0.00 0.00 175.26 174.90 2k49 s VAL 60 N -4.10 1.12 0.71 2.63 1.01 -1.26 -1.16 120.40 119.36 2k49 s VAL 60 Ca 0.31 -0.38 -0.15 0.00 0.00 0.00 0.00 61.98 61.77 2k49 s VAL 60 Cb 0.06 -1.10 0.03 0.00 0.00 0.00 0.00 36.38 35.37 2k49 s VAL 60 CO 0.08 0.38 1.16 0.00 0.00 0.00 0.00 175.10 176.72 2k49 s ALA 61 N 1.41 2.23 -0.67 5.51 0.00 0.38 -4.89 121.76 125.73 2k49 s ALA 61 Ca -0.00 0.72 0.13 0.00 0.00 0.00 0.00 51.96 52.82 2k49 s ALA 61 Cb -0.13 -3.40 0.65 0.00 0.00 0.00 0.00 23.12 20.23 2k49 s ALA 61 CO -0.05 -1.68 1.41 1.63 0.00 0.00 0.00 175.76 177.07 2k49 n LYS 62 N -2.68 0.08 -0.12 0.00 5.02 -1.26 -0.48 118.16 118.71 2k49 n LYS 62 Ca 0.12 0.48 0.03 0.00 -2.02 0.00 0.00 58.31 56.92 2k49 n LYS 62 Cb 0.51 -1.71 0.09 0.00 -0.02 0.00 0.00 35.03 33.91 2k49 n LYS 62 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2k49 n ASN 63 N -1.86 1.25 -1.41 4.39 3.02 -1.26 -4.87 115.26 114.52 2k49 n ASN 63 Ca 0.01 -2.04 -0.16 0.00 -0.03 0.00 0.00 54.58 52.36 2k49 n ASN 63 Cb 0.08 -0.20 -0.04 0.00 -0.61 0.00 0.00 39.78 39.01 2k49 n ASN 63 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2k49 n ASP 64 N 0.10 -4.79 -4.47 6.41 9.92 0.37 -5.00 116.55 119.08 2k49 n ASP 64 Ca 0.07 0.23 -0.42 0.00 -0.53 0.00 0.00 54.79 54.14 2k49 n ASP 64 Cb 0.22 -3.76 -0.10 0.00 -0.64 0.00 0.00 41.12 36.83 2k49 n ASP 64 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2k49 s LYS 65 N -3.87 3.13 0.30 -1.24 1.02 -1.20 -4.91 119.74 112.98 2k49 s LYS 65 Ca 0.00 -0.90 -0.28 0.00 0.02 0.00 0.00 55.97 54.81 2k49 s LYS 65 Cb 0.00 -3.89 -0.09 0.00 -0.52 0.00 0.00 37.83 33.33 2k49 s LYS 65 CO 0.00 -0.64 1.08 -1.25 -0.92 0.00 0.00 175.35 173.62 2k49 s PRO 66 N 1.68 4.54 0.31 -1.68 0.04 -1.23 -0.47 135.00 138.19 2k49 s PRO 66 Ca 0.05 1.72 -0.05 0.00 0.04 0.00 0.00 61.00 62.76 2k49 s PRO 66 Cb -0.18 -3.05 0.02 0.00 0.04 0.00 0.00 34.50 31.33 2k49 s PRO 66 CO 0.10 0.15 0.49 2.48 0.04 0.00 0.00 177.00 180.26 2k49 n TYR 67 N 0.92 -1.58 -3.74 0.56 4.11 -0.31 -1.18 117.16 115.95 2k49 n TYR 67 Ca 0.00 -1.85 -0.10 0.00 -0.00 0.00 0.00 57.90 55.95 2k49 n TYR 67 Cb 0.46 0.57 -0.06 0.00 -0.00 0.00 0.00 39.34 40.31 2k49 n TYR 67 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.86 176.27 2k49 s PHE 68 N -3.27 -0.06 0.07 -3.48 -0.71 -1.26 -1.61 117.98 107.65 2k49 s PHE 68 Ca 0.21 -0.28 0.04 0.00 -1.04 0.00 0.00 56.93 55.87 2k49 s PHE 68 Cb -0.02 0.11 -0.03 0.00 -1.21 0.00 0.00 43.02 41.88 2k49 s PHE 68 CO 0.15 -0.61 -0.13 0.54 -1.34 0.00 0.00 175.22 173.83 2k49 s ASN 69 N -2.71 1.50 -0.10 1.98 4.22 -0.12 -1.64 114.94 118.07 2k49 s ASN 69 Ca 0.02 -0.61 0.00 0.00 -2.14 0.00 0.00 52.86 50.13 2k49 s ASN 69 Cb 0.03 -0.03 -0.02 0.00 1.28 0.00 0.00 41.25 42.50 2k49 s ASN 69 CO -0.10 -0.11 -0.10 -0.22 -2.04 0.00 0.00 177.10 174.53 2k49 s LEU 70 N -1.74 2.97 0.03 3.54 2.96 0.55 -3.20 118.68 123.78 2k49 s LEU 70 Ca -0.03 -0.17 0.07 0.00 -0.22 0.00 0.00 54.13 53.78 2k49 s LEU 70 Cb -0.10 -1.66 -0.02 0.00 0.50 0.00 0.00 46.19 44.91 2k49 s LEU 70 CO 0.02 0.26 -0.20 -0.54 -1.32 0.00 0.00 176.35 174.57 2k49 s LYS 71 N -0.23 1.39 1.18 1.98 1.02 -1.25 -1.35 119.74 122.49 2k49 s LYS 71 Ca 0.02 -0.87 -0.20 0.00 0.02 0.00 0.00 55.97 54.95 2k49 s LYS 71 Cb -0.13 -1.46 0.28 0.00 -0.52 0.00 0.00 37.83 36.01 2k49 s LYS 71 CO 0.03 0.38 1.17 0.00 -0.92 0.00 0.00 175.35 176.00 2k49 s ALA 72 N -0.73 0.92 0.34 5.17 0.00 -0.58 -4.78 121.76 122.10 2k49 s ALA 72 Ca 0.07 -1.11 0.11 0.00 0.00 0.00 0.00 51.96 51.03 2k49 s ALA 72 Cb -0.08 -2.82 0.88 0.00 0.00 0.00 0.00 23.12 21.10 2k49 s ALA 72 CO 0.01 -3.46 1.79 0.00 0.00 0.00 0.00 175.76 174.10 2k49 h ALA 73 N -2.49 1.89 -0.19 0.00 0.00 -1.96 0.37 119.26 116.88 2k49 h ALA 73 Ca -0.43 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2k49 h ALA 73 Cb 1.27 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2k49 h ALA 73 CO 0.30 -0.26 0.00 -1.71 0.00 0.00 0.00 179.25 177.59 2k49 n ASN 74 N -4.70 1.39 -0.82 0.00 5.15 -1.26 -4.87 115.26 110.15 2k49 n ASN 74 Ca 0.23 -2.07 -0.11 0.00 -0.60 0.00 0.00 54.58 52.04 2k49 n ASN 74 Cb 0.67 -0.25 -0.05 0.00 -0.53 0.00 0.00 39.78 39.63 2k49 n ASN 74 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 2k49 n HIS 75 N 0.10 0.00 -2.68 1.20 8.25 0.13 -4.99 115.22 117.23 2k49 n HIS 75 Ca 0.07 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.12 2k49 n HIS 75 Cb 0.26 -2.04 -0.05 0.00 1.12 0.00 0.00 29.99 29.28 2k49 n HIS 75 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 2k49 s GLN 76 N -2.87 4.72 -0.26 -0.41 -2.07 -1.25 -4.75 119.66 112.77 2k49 s GLN 76 Ca 0.00 1.53 -0.28 0.00 -1.82 0.00 0.00 55.36 54.79 2k49 s GLN 76 Cb 0.00 -3.32 -0.04 0.00 -1.09 0.00 0.00 33.01 28.57 2k49 s GLN 76 CO 0.00 0.28 2.01 0.42 -1.32 0.00 0.00 175.29 176.68 2k49 s ILE 77 N -0.46 3.24 -0.04 3.63 -1.09 -1.26 -1.52 121.20 123.70 2k49 s ILE 77 Ca 0.45 0.24 0.16 0.00 -2.23 0.00 0.00 60.65 59.28 2k49 s ILE 77 Cb -0.26 -3.32 -0.24 0.00 -1.58 0.00 0.00 42.46 37.07 2k49 s ILE 77 CO 0.32 -0.20 0.31 2.30 -1.23 0.00 0.00 174.94 176.44 2k49 n ILE 78 N 7.54 0.16 -3.72 2.92 -5.35 -0.45 -4.88 119.36 115.59 2k49 n ILE 78 Ca 0.26 -0.41 -0.13 0.00 -0.27 0.00 0.00 62.75 62.20 2k49 n ILE 78 Cb 0.46 0.01 -0.09 0.00 -1.74 0.00 0.00 39.64 38.28 2k49 n ILE 78 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2k49 s GLY 79 N -4.02 -0.35 -0.11 3.28 0.00 -0.88 -4.56 107.32 100.69 2k49 s GLY 79 Ca -0.06 1.31 -0.00 0.00 0.00 0.00 0.00 44.72 45.96 2k49 s GLY 79 CO 0.66 1.13 -0.07 -0.51 0.00 0.00 0.00 173.10 174.31 2k49 s THR 80 N 0.25 0.97 0.97 0.90 -4.23 -0.70 -0.33 115.64 113.47 2k49 s THR 80 Ca -0.00 -0.26 -0.12 0.00 -1.18 0.00 0.00 61.69 60.13 2k49 s THR 80 Cb -0.03 -1.00 0.17 0.00 1.34 0.00 0.00 72.50 72.98 2k49 s THR 80 CO 0.01 0.36 1.09 -0.44 -0.54 0.00 0.00 174.62 175.09 2k49 s SER 81 N 1.69 2.78 0.55 3.99 0.01 -0.65 -0.47 113.70 121.59 2k49 s SER 81 Ca 0.04 1.44 -0.14 0.00 1.31 0.00 0.00 55.95 58.60 2k49 s SER 81 Cb -0.13 -2.11 -0.06 0.00 0.21 0.00 0.00 66.02 63.93 2k49 s SER 81 CO -0.07 -3.07 0.99 0.00 0.41 0.00 0.00 173.24 171.50 2k49 s GLN 82 N -4.86 3.80 -0.38 12.44 -2.07 -1.23 -4.77 119.66 122.60 2k49 s GLN 82 Ca 0.65 0.84 -0.28 0.00 -1.82 0.00 0.00 55.36 54.75 2k49 s GLN 82 Cb -0.19 -2.13 -0.03 0.00 -1.09 0.00 0.00 33.01 29.57 2k49 s GLN 82 CO 0.58 -0.38 1.89 -1.64 -1.32 0.00 0.00 175.29 174.43 2k49 s MET 83 N -4.51 3.11 0.69 9.60 -1.94 -1.26 -4.72 119.30 120.26 2k49 s MET 83 Ca 0.57 1.35 -0.11 0.00 -1.71 0.00 0.00 55.69 55.79 2k49 s MET 83 Cb -0.10 -4.27 0.00 0.00 2.01 0.00 0.00 34.83 32.47 2k49 s MET 83 CO 0.40 -2.12 1.07 0.71 -0.01 0.00 0.00 175.02 175.07 2k49 s TYR 84 N 7.75 3.35 -0.03 -0.03 2.02 -0.33 -4.93 117.35 125.15 2k49 s TYR 84 Ca 0.81 1.18 -0.19 0.00 -0.37 0.00 0.00 57.07 58.50 2k49 s TYR 84 Cb -0.21 -2.94 -0.32 0.00 -0.40 0.00 0.00 41.96 38.08 2k49 s TYR 84 CO 0.31 -1.09 0.88 0.66 -1.57 0.00 0.00 175.55 174.74 2k49 h SER 85 N -0.60 0.58 -2.69 2.29 4.64 -1.94 -3.27 113.55 112.57 2k49 h SER 85 Ca -0.45 -0.93 -0.53 0.00 -0.47 0.00 0.00 61.79 59.41 2k49 h SER 85 Cb 1.23 -0.19 -0.14 0.00 -0.31 0.00 0.00 62.40 62.99 2k49 h SER 85 CO 0.62 1.53 -0.72 -0.94 -0.87 0.00 0.00 176.83 176.45 2k49 s SER 86 N -7.18 3.06 0.29 4.97 1.04 -1.26 -4.78 113.70 109.84 2k49 s SER 86 Ca -0.13 -1.09 0.04 0.00 0.48 0.00 0.00 55.95 55.25 2k49 s SER 86 Cb 0.02 -0.22 0.45 0.00 0.10 0.00 0.00 66.02 66.37 2k49 s SER 86 CO 0.86 -0.16 1.73 0.71 0.98 0.00 0.00 173.24 177.35 2k49 h THR 87 N 2.33 1.27 -0.80 2.02 1.35 -1.92 -2.84 112.91 114.31 2k49 h THR 87 Ca -0.40 -1.30 0.04 0.00 -0.55 0.00 0.00 66.41 64.20 2k49 h THR 87 Cb 1.24 1.43 -0.05 0.00 -1.73 0.00 0.00 68.15 69.04 2k49 h THR 87 CO 0.64 0.41 0.51 0.00 -0.25 0.00 0.00 175.52 176.82 2k49 h ALA 88 N 1.35 1.07 -0.79 6.62 0.00 -1.99 0.16 119.26 125.68 2k49 h ALA 88 Ca 0.05 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2k49 h ALA 88 Cb 0.69 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2k49 h ALA 88 CO 0.05 0.30 0.52 0.00 0.00 0.00 0.00 179.25 180.12 2k49 h ALA 89 N 1.35 1.00 0.03 0.00 0.00 -1.93 -0.52 119.26 119.18 2k49 h ALA 89 Ca 0.33 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2k49 h ALA 89 Cb 0.05 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2k49 h ALA 89 CO -0.13 0.42 -0.01 -0.09 0.00 0.00 0.00 179.25 179.44 2k49 h ARG 90 N 1.07 -0.04 0.41 0.00 2.43 -1.07 0.51 114.38 117.69 2k49 h ARG 90 Ca 0.29 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 2k49 h ARG 90 Cb -0.11 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 2k49 h ARG 90 CO -0.06 0.04 -0.25 0.22 -1.51 0.00 0.00 179.97 178.40 2k49 h ASP 91 N -0.10 -0.63 0.37 -3.80 3.58 -0.51 -0.03 116.42 115.30 2k49 h ASP 91 Ca -0.00 0.04 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 2k49 h ASP 91 Cb 0.09 0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.33 2k49 h ASP 91 CO 0.01 -0.40 -0.09 0.78 -2.88 0.00 0.00 179.24 176.65 2k49 h ASN 92 N -0.63 0.00 0.23 2.28 2.35 -1.13 0.15 115.58 118.83 2k49 h ASN 92 Ca -0.04 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2k49 h ASN 92 Cb 0.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.89 2k49 h ASN 92 CO 0.04 0.09 -0.11 1.23 -1.65 0.00 0.00 177.43 177.03 2k49 h GLY 93 N 0.84 -0.33 0.50 2.83 0.00 -0.25 -0.60 103.07 106.06 2k49 h GLY 93 Ca -0.00 0.12 0.06 0.00 0.00 0.00 0.00 47.33 47.51 2k49 h GLY 93 CO 0.01 -0.12 0.09 -2.22 0.00 0.00 0.00 176.54 174.30 2k49 h ILE 94 N -0.52 0.79 -0.44 2.60 2.04 -0.23 0.60 117.51 122.34 2k49 h ILE 94 Ca -0.03 -0.07 0.08 0.00 1.00 0.00 0.00 64.86 65.84 2k49 h ILE 94 Cb 0.39 0.55 -0.07 0.00 -0.74 0.00 0.00 36.82 36.94 2k49 h ILE 94 CO 0.05 0.04 -0.02 0.11 0.00 0.00 0.00 178.15 178.34 2k49 h LYS 95 N 0.22 0.09 0.00 2.37 1.57 -1.00 -0.41 116.57 119.40 2k49 h LYS 95 Ca 0.20 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.94 2k49 h LYS 95 Cb 0.24 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2k49 h LYS 95 CO -0.26 0.06 -0.17 0.77 -0.57 0.00 0.00 179.45 179.28 2k49 h SER 96 N 0.09 0.00 -0.39 0.86 0.02 -0.18 -0.94 113.55 113.01 2k49 h SER 96 Ca 0.22 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.08 2k49 h SER 96 Cb 0.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 2k49 h SER 96 CO -0.38 0.17 -0.09 0.58 -1.14 0.00 0.00 176.83 175.97 2k49 h VAL 97 N 0.00 1.28 0.00 2.27 2.07 0.37 0.24 116.25 122.47 2k49 h VAL 97 Ca -0.00 -1.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 2k49 h VAL 97 Cb 0.32 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2k49 h VAL 97 CO 0.02 0.39 -0.14 0.24 0.02 0.00 0.00 177.57 178.10 2k49 h MET 98 N 0.56 0.00 0.16 1.57 2.07 -0.19 0.40 114.93 119.49 2k49 h MET 98 Ca 0.10 0.00 -0.33 0.00 -2.07 0.00 0.00 59.70 57.40 2k49 h MET 98 Cb 0.61 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.34 2k49 h MET 98 CO 0.04 0.14 -1.65 0.93 1.07 0.00 0.00 176.91 177.43 2k49 h GLU 99 N 0.00 0.33 0.00 1.72 5.08 -0.95 -3.42 114.58 117.35 2k49 h GLU 99 Ca -0.00 -0.57 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 2k49 h GLU 99 Cb 0.31 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2k49 h GLU 99 CO 0.02 1.27 -0.79 0.09 -1.00 0.00 0.00 179.01 178.60 2k49 n ASN 100 N -3.70 2.25 0.19 1.42 3.02 0.81 -0.57 115.26 118.67 2k49 n ASN 100 Ca -0.25 -0.27 0.17 0.00 -0.03 0.00 0.00 54.58 54.20 2k49 n ASN 100 Cb 1.01 1.13 0.81 0.00 -0.61 0.00 0.00 39.78 42.13 2k49 n ASN 100 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2k49 h GLY 101 N 1.03 0.00 -3.89 7.41 0.00 -0.33 -0.79 103.07 106.50 2k49 h GLY 101 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 2k49 h GLY 101 CO 0.00 0.00 0.73 0.58 0.00 0.00 0.00 176.54 177.85 2k49 n LYS 102 N -3.83 2.39 -3.03 4.80 2.85 -1.26 -4.01 118.16 116.07 2k49 n LYS 102 Ca 0.02 -2.93 -0.24 0.00 -1.05 0.00 0.00 58.31 54.11 2k49 n LYS 102 Cb 0.36 -2.15 0.00 0.00 -0.65 0.00 0.00 35.03 32.59 2k49 n LYS 102 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 2k49 s THR 103 N -3.86 4.55 -0.74 0.58 -1.32 -0.30 -5.00 115.64 109.55 2k49 s THR 103 Ca 0.57 -0.33 0.11 0.00 -1.21 0.00 0.00 61.69 60.83 2k49 s THR 103 Cb 0.46 -3.69 -0.07 0.00 -1.51 0.00 0.00 72.50 67.69 2k49 s THR 103 CO 0.04 -0.52 0.55 0.35 -2.21 0.00 0.00 174.62 172.83 2k49 n THR 104 N -2.03 0.00 -2.36 5.08 -2.24 -1.26 -4.93 114.28 106.53 2k49 n THR 104 Ca -0.01 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 61.05 2k49 n THR 104 Cb 0.57 1.06 -0.03 0.00 -2.10 0.00 0.00 70.33 69.83 2k49 n THR 104 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2k49 s THR 105 N -1.78 3.77 -0.22 4.28 2.01 -1.26 -4.98 115.64 117.46 2k49 s THR 105 Ca 0.06 0.66 0.00 0.00 0.31 0.00 0.00 61.69 62.73 2k49 s THR 105 Cb 0.09 -4.38 0.06 0.00 0.01 0.00 0.00 72.50 68.27 2k49 s THR 105 CO 0.37 -1.11 -0.05 -0.63 -0.69 0.00 0.00 174.62 172.51 2k49 s ILE 106 N 6.15 1.44 -0.09 1.82 1.01 -1.26 -0.89 121.20 129.39 2k49 s ILE 106 Ca 0.54 -1.11 -0.22 0.00 0.00 0.00 0.00 60.65 59.87 2k49 s ILE 106 Cb -0.11 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 2k49 s ILE 106 CO 0.26 -0.06 0.63 -0.54 0.00 0.00 0.00 174.94 175.23 2k49 s LYS 107 N 1.44 4.39 -0.40 2.79 1.02 0.78 -4.99 119.74 124.78 2k49 s LYS 107 Ca -0.04 0.74 -0.17 0.00 0.02 0.00 0.00 55.97 56.51 2k49 s LYS 107 Cb -0.18 -3.46 0.01 0.00 -0.52 0.00 0.00 37.83 33.69 2k49 s LYS 107 CO -0.07 0.06 0.42 0.34 -0.92 0.00 0.00 175.35 175.19 2k49 s ASP 108 N 0.78 6.20 -0.02 2.83 -1.08 -1.26 -1.00 116.67 123.12 2k49 s ASP 108 Ca 0.34 -0.53 0.07 0.00 -0.52 0.00 0.00 52.55 51.91 2k49 s ASP 108 Cb -0.17 -2.22 0.21 0.00 -1.46 0.00 0.00 42.92 39.28 2k49 s ASP 108 CO 0.15 -0.52 1.17 0.18 0.52 0.00 0.00 175.17 176.67 2k49 n LEU 109 N 5.56 2.63 0.08 -1.34 4.77 -0.25 -4.65 117.00 123.81 2k49 n LEU 109 Ca -0.08 -2.11 -0.00 0.00 -0.03 0.00 0.00 56.01 53.79 2k49 n LEU 109 Cb 0.48 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.35 2k49 n LEU 109 CO 0.45 0.64 0.11 0.71 -1.33 0.00 0.00 177.39 177.96 2k49 h THR 110 N 1.19 0.83 0.14 -5.08 1.35 -1.87 -3.40 112.91 106.07 2k49 h THR 110 Ca 0.00 -2.31 -0.01 0.00 -0.55 0.00 0.00 66.41 63.55 2k49 h THR 110 Cb 0.70 2.33 0.00 0.00 -1.73 0.00 0.00 68.15 69.46 2k49 h THR 110 CO 0.01 0.48 -0.07 -0.07 -0.25 0.00 0.00 175.52 175.62 2k49 h LEU 111 N 0.00 -0.16-10.27 3.87 3.38 -1.91 -3.45 115.31 106.77 2k49 h LEU 111 Ca -0.08 0.01 -0.46 0.00 0.09 0.00 0.00 57.88 57.44 2k49 h LEU 111 Cb 1.53 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.32 2k49 h LEU 111 CO 0.07 0.07 -0.34 -1.61 0.09 0.00 0.00 178.44 176.72 2k49 s GLU 112 N -2.14 2.75 -0.46 1.13 2.02 -1.26 -5.04 118.70 115.70 2k49 s GLU 112 Ca -0.03 -1.32 0.04 0.00 0.02 0.00 0.00 54.97 53.68 2k49 s GLU 112 Cb 0.00 -2.59 0.52 0.00 0.10 0.00 0.00 34.13 32.15 2k49 s GLU 112 CO 0.08 -0.15 1.71 1.58 0.02 0.00 0.00 175.26 178.50 2k49 n HIS 113 N -1.65 2.56 -0.43 1.61 -0.00 -1.26 -4.66 115.22 111.39 2k49 n HIS 113 Ca 0.04 -2.26 0.05 0.00 -0.00 0.00 0.00 57.72 55.55 2k49 n HIS 113 Cb 0.60 -0.89 0.31 0.00 -0.00 0.00 0.00 29.99 30.00 2k49 n HIS 113 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2k49 n HIS 114 N -0.99 1.58 0.45 1.57 8.25 -1.26 -4.35 115.22 120.47 2k49 n HIS 114 Ca 0.51 -0.55 0.10 0.00 -0.26 0.00 0.00 57.72 57.53 2k49 n HIS 114 Cb 1.04 -0.41 0.42 0.00 1.12 0.00 0.00 29.99 32.16 2k49 n HIS 114 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k49 n HIS 115 N 0.48 0.49 0.00 4.41 -0.00 -1.26 -4.89 115.22 114.44 2k49 n HIS 115 Ca 0.21 0.19 0.00 0.00 0.46 0.00 0.00 57.72 58.58 2k49 n HIS 115 Cb 0.97 -0.81 0.00 0.00 -0.12 0.00 0.00 29.99 30.03 2k49 n HIS 115 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2k49 n HIS 116 N -1.94 0.00 -1.99 1.57 8.25 -1.26 -4.82 115.22 115.02 2k49 n HIS 116 Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.07 2k49 n HIS 116 Cb 0.21 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.29 2k49 n HIS 116 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2k49 s HIS 117 N 0.00 3.07 0.00 4.41 5.65 -1.26 -5.24 115.29 121.92 2k49 s HIS 117 Ca 0.00 0.81 0.00 0.00 0.25 0.00 0.00 55.06 56.12 2k49 s HIS 117 Cb 0.00 -3.86 0.00 0.00 -1.18 0.00 0.00 32.58 27.54 2k49 s HIS 117 CO 0.00 -3.01 0.06 -2.39 -0.65 0.00 0.00 174.74 168.75