#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i26 s PRO 17 N 0.00 3.69 0.17 1.09 0.02 -1.26 -4.78 135.00 133.93 3i26 s PRO 17 Ca 0.00 2.28 0.05 0.00 0.02 0.00 0.00 61.00 63.35 3i26 s PRO 17 Cb 0.00 -2.61 -0.04 0.00 0.02 0.00 0.00 34.50 31.87 3i26 s PRO 17 CO 0.00 -0.77 0.15 0.14 -0.33 0.00 0.00 177.00 176.20 3i26 s VAL 18 N -1.25 4.55 -0.18 3.83 -7.23 -0.16 -4.71 120.40 115.24 3i26 s VAL 18 Ca 0.62 -1.09 -0.04 0.00 -1.81 0.00 0.00 61.98 59.66 3i26 s VAL 18 Cb -0.41 -3.34 -0.02 0.00 0.56 0.00 0.00 36.38 33.17 3i26 s VAL 18 CO 0.51 -0.13 -0.04 -0.89 -0.31 0.00 0.00 175.10 174.25 3i26 s THR 19 N -1.79 3.72 0.38 5.32 2.01 -1.26 -1.31 115.64 122.71 3i26 s THR 19 Ca 0.31 -0.40 -0.28 0.00 0.31 0.00 0.00 61.69 61.63 3i26 s THR 19 Cb -0.10 -2.65 -0.11 0.00 0.01 0.00 0.00 72.50 69.65 3i26 s THR 19 CO 0.24 0.46 1.49 -2.65 -0.69 0.00 0.00 174.62 173.47 3i26 n PRO 20 N 4.01 2.68 -2.93 4.92 -0.02 -1.26 -4.92 135.00 137.49 3i26 n PRO 20 Ca -0.17 0.94 -0.42 0.00 -2.02 0.00 0.00 63.50 61.83 3i26 n PRO 20 Cb 0.52 -2.67 -0.05 0.00 -0.02 0.00 0.00 33.50 31.28 3i26 n PRO 20 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3i26 s TYR 21 N -1.10 3.22 -0.10 6.00 6.14 0.02 -4.82 117.35 126.71 3i26 s TYR 21 Ca 0.53 0.87 -0.30 0.00 0.64 0.00 0.00 57.07 58.82 3i26 s TYR 21 Cb -0.48 -3.21 -0.04 0.00 0.42 0.00 0.00 41.96 38.66 3i26 s TYR 21 CO 0.64 -0.55 1.48 -0.47 0.64 0.00 0.00 175.55 177.29 3i26 s TYR 22 N 2.97 2.38 0.00 4.97 6.04 -1.24 -1.65 117.35 130.81 3i26 s TYR 22 Ca 0.33 0.56 0.00 0.00 0.04 0.00 0.00 57.07 58.00 3i26 s TYR 22 Cb -0.14 -3.73 0.00 0.00 -1.04 0.00 0.00 41.96 37.05 3i26 s TYR 22 CO 0.12 -2.89 0.00 0.41 -1.54 0.00 0.00 175.55 171.65 3i26 n GLY 23 N 3.89 2.47 3.70 8.97 0.00 -1.26 -4.29 105.19 118.67 3i26 n GLY 23 Ca 0.16 -1.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.13 3i26 n GLY 23 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3i26 s PRO 24 N -1.73 0.11 0.26 1.61 0.04 -1.26 -4.08 135.00 129.96 3i26 s PRO 24 Ca 0.00 0.19 -0.20 0.00 0.04 0.00 0.00 61.00 61.03 3i26 s PRO 24 Cb 0.00 -1.73 0.06 0.00 0.04 0.00 0.00 34.50 32.87 3i26 s PRO 24 CO 0.00 -2.87 0.92 0.20 0.04 0.00 0.00 177.00 175.29 3i26 s GLY 25 N -3.87 0.14 0.02 0.56 0.00 -1.26 -3.60 107.32 99.32 3i26 s GLY 25 Ca 0.67 -0.42 -0.00 0.00 0.00 0.00 0.00 44.72 44.97 3i26 s GLY 25 CO 0.56 0.97 -0.03 -2.38 0.00 0.00 0.00 173.10 172.22 3i26 s HIS 26 N -2.49 0.29 -0.17 1.90 -3.43 -1.26 -4.96 115.29 105.18 3i26 s HIS 26 Ca 0.18 -0.60 0.05 0.00 -0.80 0.00 0.00 55.06 53.88 3i26 s HIS 26 Cb -0.04 -0.22 -0.22 0.00 -1.43 0.00 0.00 32.58 30.67 3i26 s HIS 26 CO 0.07 -0.22 0.16 -0.89 -2.00 0.00 0.00 174.74 171.86 3i26 n ILE 27 N 1.38 1.57 -4.50 -5.38 5.41 -1.26 -1.83 119.36 114.75 3i26 n ILE 27 Ca -0.22 -0.70 -0.25 0.00 1.00 0.00 0.00 62.75 62.58 3i26 n ILE 27 Cb 0.56 -1.23 -0.09 0.00 -0.71 0.00 0.00 39.64 38.17 3i26 n ILE 27 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3i26 s THR 28 N -2.54 0.78 0.54 1.39 -4.23 -1.26 -4.52 115.64 105.79 3i26 s THR 28 Ca -0.21 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 58.57 3i26 s THR 28 Cb 0.07 -2.46 0.32 0.00 1.34 0.00 0.00 72.50 71.77 3i26 s THR 28 CO 0.74 0.00 2.19 2.19 -0.54 0.00 0.00 174.62 179.20 3i26 h PHE 29 N 1.87 0.00 -0.84 3.99 -0.00 -2.01 -3.37 116.94 116.58 3i26 h PHE 29 Ca -0.37 0.00 -0.71 0.00 -0.00 0.00 0.00 57.97 56.89 3i26 h PHE 29 Cb 1.27 0.00 -0.09 0.00 -0.00 0.00 0.00 35.95 37.13 3i26 h PHE 29 CO 1.23 0.04 2.38 -3.47 -0.00 0.00 0.00 178.31 178.48 3i26 n ASP 30 N -3.92 4.64 -4.12 -0.68 2.03 -1.26 -4.88 116.55 108.37 3i26 n ASP 30 Ca -0.03 -2.93 -0.10 0.00 0.52 0.00 0.00 54.79 52.26 3i26 n ASP 30 Cb 0.12 -1.65 -0.09 0.00 -0.72 0.00 0.00 41.12 38.78 3i26 n ASP 30 CO 0.00 0.00 0.00 -1.66 -1.92 0.00 0.00 177.20 173.62 3i26 s TRP 31 N 2.88 0.79 0.16 -0.67 1.48 -1.26 -1.96 118.94 120.36 3i26 s TRP 31 Ca 0.48 -1.16 -0.16 0.00 -1.06 0.00 0.00 56.10 54.20 3i26 s TRP 31 Cb 0.07 -0.41 0.03 0.00 -1.16 0.00 0.00 33.47 32.00 3i26 s TRP 31 CO -0.00 -0.55 0.44 0.00 -4.06 0.00 0.00 176.95 172.78 3i26 s GLY 33 N -2.85 1.72 -0.09 0.00 0.00 -0.67 -0.91 107.32 104.51 3i26 s GLY 33 Ca 0.07 -1.62 0.02 0.00 0.00 0.00 0.00 44.72 43.19 3i26 s GLY 33 CO -0.07 -1.65 -0.15 -1.36 0.00 0.00 0.00 173.10 169.87 3i26 s PHE 34 N -1.69 1.89 0.00 1.90 0.08 -0.25 -1.51 117.98 118.40 3i26 s PHE 34 Ca 0.22 -0.82 0.00 0.00 0.12 0.00 0.00 56.93 56.44 3i26 s PHE 34 Cb -0.08 -1.35 0.00 0.00 -0.57 0.00 0.00 43.02 41.02 3i26 s PHE 34 CO 0.11 -0.41 0.00 0.41 -0.10 0.00 0.00 175.22 175.23 3i26 n GLY 35 N 4.01 3.66 0.00 4.36 0.00 -1.06 -0.16 105.19 116.01 3i26 n GLY 35 Ca -0.20 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 44.97 3i26 n GLY 35 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3i26 n ASP 36 N 0.00 0.00 -0.10 1.61 3.85 -1.24 -3.46 116.55 117.20 3i26 n ASP 36 Ca 0.00 0.00 0.04 0.00 -0.71 0.00 0.00 54.79 54.12 3i26 n ASP 36 Cb 0.00 0.00 0.37 0.00 -1.35 0.00 0.00 41.12 40.14 3i26 n ASP 36 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 3i26 h SER 37 N 0.00 0.60 0.06 -1.12 4.64 -1.89 -2.29 113.55 113.56 3i26 h SER 37 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3i26 h SER 37 Cb 0.00 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 3i26 h SER 37 CO 0.00 0.42 0.00 0.54 -0.87 0.00 0.00 176.83 176.92 3i26 n ARG 38 N -4.46 0.51 -0.96 4.77 1.74 -1.26 -1.96 116.66 115.04 3i26 n ARG 38 Ca 0.07 0.02 0.03 0.00 -0.77 0.00 0.00 57.85 57.19 3i26 n ARG 38 Cb 0.12 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.09 3i26 n ARG 38 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3i26 n SER 39 N -1.05 0.66 -4.29 0.55 3.41 -0.90 -0.60 113.62 111.40 3i26 n SER 39 Ca 0.13 -2.14 -0.37 0.00 -0.26 0.00 0.00 58.87 56.23 3i26 n SER 39 Cb 0.08 -0.27 -0.13 0.00 -0.26 0.00 0.00 64.21 63.63 3i26 n SER 39 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i26 s ASP 40 N -1.66 5.20 0.22 4.04 -1.08 -0.83 -4.74 116.67 117.81 3i26 s ASP 40 Ca 0.19 -0.99 0.25 0.00 -0.52 0.00 0.00 52.55 51.48 3i26 s ASP 40 Cb 0.22 -1.86 0.64 0.00 -1.46 0.00 0.00 42.92 40.45 3i26 s ASP 40 CO -0.08 -0.27 1.64 0.00 0.52 0.00 0.00 175.17 176.98 3i26 n THR 42 N -2.33 0.00 -1.68 0.00 -2.24 -1.26 -4.75 114.28 102.02 3i26 n THR 42 Ca 0.05 -0.00 -0.47 0.00 -2.27 0.00 0.00 64.05 61.36 3i26 n THR 42 Cb 0.45 -0.48 -0.04 0.00 -2.10 0.00 0.00 70.33 68.15 3i26 n THR 42 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3i26 n ASN 43 N -1.25 3.32 -0.31 3.42 2.85 -1.20 -4.91 115.26 117.18 3i26 n ASN 43 Ca 0.15 1.03 0.16 0.00 -0.11 0.00 0.00 54.58 55.81 3i26 n ASN 43 Cb 0.23 -1.41 0.34 0.00 1.24 0.00 0.00 39.78 40.18 3i26 n ASN 43 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3i26 h PRO 44 N 7.51 0.29 -0.05 1.20 0.11 -1.92 -1.19 132.00 137.96 3i26 h PRO 44 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3i26 h PRO 44 Cb 1.26 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3i26 h PRO 44 CO 0.92 0.19 0.00 1.04 -0.21 0.00 0.00 178.00 179.94 3i26 n GLN 45 N -5.12 1.20 -2.18 1.05 1.13 -1.26 -4.90 117.38 107.29 3i26 n GLN 45 Ca 0.24 -0.29 -0.39 0.00 -1.94 0.00 0.00 57.00 54.62 3i26 n GLN 45 Cb 0.75 -1.30 -0.01 0.00 0.11 0.00 0.00 30.24 29.79 3i26 n GLN 45 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3i26 s SER 46 N -1.53 6.36 0.00 1.08 0.15 -0.45 -2.10 113.70 117.21 3i26 s SER 46 Ca 0.27 2.47 0.17 0.00 0.70 0.00 0.00 55.95 59.57 3i26 s SER 46 Cb 0.13 -2.62 0.49 0.00 -1.71 0.00 0.00 66.02 62.31 3i26 s SER 46 CO 0.21 -0.80 1.40 -0.81 1.20 0.00 0.00 173.24 174.45 3i26 n PRO 47 N -0.00 2.14 0.26 5.44 -0.04 -1.26 -4.90 135.00 136.64 3i26 n PRO 47 Ca 0.05 -1.77 0.09 0.00 -0.04 0.00 0.00 63.50 61.83 3i26 n PRO 47 Cb 0.45 -1.41 0.66 0.00 -0.04 0.00 0.00 33.50 33.16 3i26 n PRO 47 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 3i26 h MET 48 N 3.03 0.00 -0.61 0.54 2.86 -1.80 -2.98 114.93 115.98 3i26 h MET 48 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3i26 h MET 48 Cb 0.69 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.35 3i26 h MET 48 CO 0.00 0.04 0.00 -1.13 1.06 0.00 0.00 176.91 176.88 3i26 n SER 49 N -4.36 3.55 -4.88 1.22 3.41 -1.18 -2.63 113.62 108.74 3i26 n SER 49 Ca -0.03 -2.22 -0.33 0.00 -0.26 0.00 0.00 58.87 56.04 3i26 n SER 49 Cb 0.13 -0.46 -0.05 0.00 -0.26 0.00 0.00 64.21 63.56 3i26 n SER 49 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3i26 s LEU 50 N -1.34 4.29 -0.00 1.04 1.43 -1.13 -4.16 118.68 118.81 3i26 s LEU 50 Ca 0.40 0.70 0.15 0.00 -1.03 0.00 0.00 54.13 54.35 3i26 s LEU 50 Cb 0.24 -3.21 -0.16 0.00 0.03 0.00 0.00 46.19 43.08 3i26 s LEU 50 CO 0.22 0.09 0.63 0.47 0.23 0.00 0.00 176.35 177.99 3i26 n ASP 51 N 0.39 0.73 -4.81 2.29 8.00 0.23 -4.01 116.55 119.36 3i26 n ASP 51 Ca -0.04 -0.83 -0.22 0.00 0.71 0.00 0.00 54.79 54.40 3i26 n ASP 51 Cb 0.52 1.02 -0.04 0.00 -0.02 0.00 0.00 41.12 42.59 3i26 n ASP 51 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3i26 s ILE 52 N -2.43 4.03 0.40 0.53 -4.36 -1.22 -3.34 121.20 114.82 3i26 s ILE 52 Ca 0.05 -1.45 -0.27 0.00 -0.26 0.00 0.00 60.65 58.73 3i26 s ILE 52 Cb 0.11 -3.27 -0.10 0.00 1.25 0.00 0.00 42.46 40.45 3i26 s ILE 52 CO 0.62 -0.29 1.40 -2.65 0.24 0.00 0.00 174.94 174.25 3i26 n PRO 53 N -1.21 2.31 0.08 0.37 -0.02 -1.26 -4.91 135.00 130.37 3i26 n PRO 53 Ca -0.06 0.82 0.04 0.00 -2.02 0.00 0.00 63.50 62.28 3i26 n PRO 53 Cb 0.59 -2.55 0.47 0.00 -0.02 0.00 0.00 33.50 31.98 3i26 n PRO 53 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3i26 h GLN 54 N 2.51 0.35 0.00 -0.52 4.15 -1.99 -2.56 115.11 117.05 3i26 h GLN 54 Ca -0.49 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.89 3i26 h GLN 54 Cb 1.27 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.88 3i26 h GLN 54 CO 0.62 0.28 0.00 -0.56 -1.93 0.00 0.00 178.83 177.24 3i26 h GLN 55 N 0.36 0.00 -0.06 1.69 -0.00 -2.04 -2.63 115.11 112.43 3i26 h GLN 55 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.74 3i26 h GLN 55 Cb 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.53 3i26 h GLN 55 CO -0.01 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.10 3i26 n LEU 56 N -2.61 2.00 -0.34 0.06 4.77 -0.96 -4.30 117.00 115.62 3i26 n LEU 56 Ca 0.01 -0.70 0.09 0.00 -0.03 0.00 0.00 56.01 55.39 3i26 n LEU 56 Cb 0.26 -0.03 0.29 0.00 -2.33 0.00 0.00 43.42 41.62 3i26 n LEU 56 CO 0.23 0.35 1.23 0.00 -1.33 0.00 0.00 177.39 177.87 3i26 h PRO 58 N 0.88 0.00 0.00 0.00 0.11 -1.83 -2.23 132.00 128.93 3i26 h PRO 58 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 3i26 h PRO 58 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.72 3i26 h PRO 58 CO -0.26 0.08 0.00 0.87 -0.21 0.00 0.00 178.00 178.48 3i26 h LYS 59 N 0.00 0.00 -5.80 1.05 1.79 -1.54 -3.45 116.57 108.62 3i26 h LYS 59 Ca -0.00 0.00 -0.64 0.00 -2.18 0.00 0.00 60.65 57.83 3i26 h LYS 59 Cb 0.20 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.80 3i26 h LYS 59 CO 0.01 0.00 -0.49 -0.06 -1.08 0.00 0.00 179.45 177.83 3i26 s PHE 60 N -3.29 3.55 -0.41 -1.35 0.40 -0.84 -1.68 117.98 114.37 3i26 s PHE 60 Ca 0.06 0.37 -0.05 0.00 -0.60 0.00 0.00 56.93 56.71 3i26 s PHE 60 Cb 0.08 -1.84 0.10 0.00 0.51 0.00 0.00 43.02 41.88 3i26 s PHE 60 CO 0.59 0.65 0.22 0.45 0.70 0.00 0.00 175.22 177.83 3i26 s SER 61 N -1.88 5.38 0.13 1.36 0.15 -0.57 -4.94 113.70 113.33 3i26 s SER 61 Ca 0.26 -1.81 -0.04 0.00 0.70 0.00 0.00 55.95 55.06 3i26 s SER 61 Cb -0.13 -1.88 -0.03 0.00 -1.71 0.00 0.00 66.02 62.27 3i26 s SER 61 CO 0.18 -0.54 0.13 -0.44 1.20 0.00 0.00 173.24 173.77 3i26 s SER 62 N 1.97 0.23 -0.28 5.45 0.01 -1.26 -2.55 113.70 117.26 3i26 s SER 62 Ca 0.05 -1.04 -0.15 0.00 1.31 0.00 0.00 55.95 56.12 3i26 s SER 62 Cb -0.23 0.34 0.10 0.00 0.21 0.00 0.00 66.02 66.43 3i26 s SER 62 CO -0.02 -0.77 0.74 -0.75 0.41 0.00 0.00 173.24 172.85 3i26 s LYS 63 N -4.00 0.64 0.30 12.44 2.47 -1.22 -4.90 119.74 125.47 3i26 s LYS 63 Ca 0.19 1.15 -0.29 0.00 -1.56 0.00 0.00 55.97 55.45 3i26 s LYS 63 Cb 0.06 0.20 -0.11 0.00 -1.46 0.00 0.00 37.83 36.52 3i26 s LYS 63 CO -0.01 -0.14 1.53 -1.12 0.16 0.00 0.00 175.35 175.77 3i26 s SER 64 N 1.72 6.44 -0.16 1.43 0.01 -1.26 -2.46 113.70 119.42 3i26 s SER 64 Ca -0.09 2.90 0.00 0.00 1.31 0.00 0.00 55.95 60.07 3i26 s SER 64 Cb -0.05 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.54 3i26 s SER 64 CO -0.19 -0.84 0.00 -1.20 0.41 0.00 0.00 173.24 171.42 3i26 n SER 65 N 1.78 -4.57 -4.85 2.44 7.64 -1.26 -4.84 113.62 109.96 3i26 n SER 65 Ca 0.06 0.04 -0.24 0.00 1.01 0.00 0.00 58.87 59.74 3i26 n SER 65 Cb 0.39 -2.20 -0.03 0.00 -1.01 0.00 0.00 64.21 61.35 3i26 n SER 65 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3i26 s SER 66 N -2.12 4.75 0.15 6.43 0.15 -1.03 -4.27 113.70 117.76 3i26 s SER 66 Ca 0.00 -0.99 -0.21 0.00 0.70 0.00 0.00 55.95 55.44 3i26 s SER 66 Cb 0.00 -0.23 0.06 0.00 -1.71 0.00 0.00 66.02 64.14 3i26 s SER 66 CO 0.00 -0.77 0.55 -0.94 1.20 0.00 0.00 173.24 173.28 3i26 s SER 67 N -4.12 -0.48 0.29 5.45 1.04 -1.26 -4.55 113.70 110.07 3i26 s SER 67 Ca 0.42 -0.07 0.02 0.00 0.48 0.00 0.00 55.95 56.80 3i26 s SER 67 Cb -0.01 0.56 0.44 0.00 0.10 0.00 0.00 66.02 67.12 3i26 s SER 67 CO 0.24 -0.93 1.77 0.24 0.98 0.00 0.00 173.24 175.54 3i26 h MET 68 N 2.12 0.56 0.53 4.02 2.86 -1.94 -0.59 114.93 122.47 3i26 h MET 68 Ca -0.34 -0.17 -0.03 0.00 -2.06 0.00 0.00 59.70 57.10 3i26 h MET 68 Cb 1.29 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 32.91 3i26 h MET 68 CO 0.40 0.68 -0.25 0.35 1.06 0.00 0.00 176.91 179.15 3i26 h PHE 69 N 0.51 -0.66 -0.67 -0.22 3.57 -1.97 -2.66 116.94 114.84 3i26 h PHE 69 Ca 0.09 -0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.69 3i26 h PHE 69 Cb 0.54 0.22 -0.08 0.00 2.79 0.00 0.00 35.95 39.42 3i26 h PHE 69 CO 0.02 -0.33 0.24 1.25 -2.23 0.00 0.00 178.31 177.26 3i26 h LEU 70 N -0.95 0.21 -1.51 0.59 6.46 -1.93 -2.10 115.31 116.08 3i26 h LEU 70 Ca -0.07 0.10 -0.05 0.00 -0.12 0.00 0.00 57.88 57.74 3i26 h LEU 70 Cb 0.62 0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.63 3i26 h LEU 70 CO 0.12 0.10 -0.22 0.28 -0.62 0.00 0.00 178.44 178.10 3i26 h SER 71 N 0.40 0.00 -0.17 1.25 0.02 -1.13 -1.59 113.55 112.33 3i26 h SER 71 Ca 0.35 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.25 3i26 h SER 71 Cb 0.49 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 3i26 h SER 71 CO -0.36 0.22 -0.09 0.25 -1.14 0.00 0.00 176.83 175.71 3i26 h LEU 72 N 0.00 0.38 0.00 5.07 5.85 -1.01 -3.35 115.31 122.25 3i26 h LEU 72 Ca -0.00 -0.42 -0.09 0.00 0.84 0.00 0.00 57.88 58.21 3i26 h LEU 72 Cb 0.55 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 3i26 h LEU 72 CO 0.03 0.71 -0.88 0.45 -0.34 0.00 0.00 178.44 178.41 3i26 h HIS 73 N 0.05 0.00 -4.00 1.25 3.86 -1.43 -3.41 115.15 111.47 3i26 h HIS 73 Ca 0.04 0.00 -0.37 0.00 -1.16 0.00 0.00 60.37 58.88 3i26 h HIS 73 Cb 0.57 0.00 -0.26 0.00 1.06 0.00 0.00 27.41 28.78 3i26 h HIS 73 CO 0.07 0.36 -0.77 -1.58 0.86 0.00 0.00 177.93 176.86 3i26 s TRP 74 N -3.07 0.84 0.00 2.45 0.51 -0.61 0.35 118.94 119.41 3i26 s TRP 74 Ca 0.01 -0.27 0.00 0.00 -2.12 0.00 0.00 56.10 53.72 3i26 s TRP 74 Cb 0.08 -0.52 0.00 0.00 -0.81 0.00 0.00 33.47 32.22 3i26 s TRP 74 CO 0.77 -0.01 0.00 0.09 -0.51 0.00 0.00 176.95 177.29 3i26 n ASN 75 N 2.31 0.00 -4.69 2.95 3.02 -1.26 -4.47 115.26 113.11 3i26 n ASN 75 Ca -0.17 -0.40 -0.42 0.00 -0.03 0.00 0.00 54.58 53.56 3i26 n ASN 75 Cb 0.56 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.70 3i26 n ASN 75 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3i26 s ASN 76 N -1.00 6.87 0.30 6.41 0.01 -1.26 -4.47 114.94 121.80 3i26 s ASN 76 Ca 0.00 2.09 0.05 0.00 -0.71 0.00 0.00 52.86 54.29 3i26 s ASN 76 Cb 0.00 -2.56 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 3i26 s ASN 76 CO 0.00 -0.70 0.22 -1.00 -1.51 0.00 0.00 177.10 174.10 3i26 s HIS 77 N 2.34 1.60 0.31 2.20 3.76 -0.61 -5.00 115.29 119.89 3i26 s HIS 77 Ca 0.63 -1.53 0.01 0.00 -0.15 0.00 0.00 55.06 54.02 3i26 s HIS 77 Cb -0.31 -0.73 0.50 0.00 1.11 0.00 0.00 32.58 33.15 3i26 s HIS 77 CO 0.26 -0.73 1.86 0.66 -0.85 0.00 0.00 174.74 175.95 3i26 h SER 78 N 2.23 0.66 -0.66 1.40 4.64 -2.06 -1.85 113.55 117.92 3i26 h SER 78 Ca -0.29 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 3i26 h SER 78 Cb 1.24 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3i26 h SER 78 CO 0.44 0.66 0.00 -1.20 -0.87 0.00 0.00 176.83 175.86 3i26 n SER 79 N -4.29 4.09 -3.75 4.97 7.64 -1.26 -4.88 113.62 116.13 3i26 n SER 79 Ca 0.03 -2.15 -0.26 0.00 1.01 0.00 0.00 58.87 57.49 3i26 n SER 79 Cb 0.22 -0.49 -0.17 0.00 -1.01 0.00 0.00 64.21 62.76 3i26 n SER 79 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3i26 s PHE 80 N -1.29 0.96 -0.61 1.43 0.40 -0.70 -5.09 117.98 113.07 3i26 s PHE 80 Ca 0.47 -0.69 -0.15 0.00 -0.60 0.00 0.00 56.93 55.96 3i26 s PHE 80 Cb 0.26 -0.98 0.15 0.00 0.51 0.00 0.00 43.02 42.97 3i26 s PHE 80 CO 0.28 -0.54 0.56 0.08 0.70 0.00 0.00 175.22 176.30 3i26 s VAL 81 N 1.88 5.21 -0.15 -0.44 1.01 -1.26 -1.57 120.40 125.08 3i26 s VAL 81 Ca 0.01 -1.82 -0.17 0.00 0.00 0.00 0.00 61.98 60.00 3i26 s VAL 81 Cb -0.16 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.87 3i26 s VAL 81 CO -0.07 -0.91 0.43 -0.55 0.00 0.00 0.00 175.10 174.00 3i26 s SER 82 N 3.08 6.58 0.06 3.32 0.15 -1.26 -4.08 113.70 121.55 3i26 s SER 82 Ca 0.08 0.68 0.06 0.00 0.70 0.00 0.00 55.95 57.47 3i26 s SER 82 Cb -0.24 -2.26 -0.04 0.00 -1.71 0.00 0.00 66.02 61.78 3i26 s SER 82 CO -0.01 -0.01 -0.13 -0.47 1.20 0.00 0.00 173.24 173.82 3i26 s TYR 83 N 0.83 2.69 -1.27 3.44 6.04 -1.26 -4.78 117.35 123.04 3i26 s TYR 83 Ca 0.23 -0.18 -0.12 0.00 0.04 0.00 0.00 57.07 57.04 3i26 s TYR 83 Cb -0.15 -1.47 0.15 0.00 -1.04 0.00 0.00 41.96 39.45 3i26 s TYR 83 CO 0.08 0.35 1.74 -0.25 -1.54 0.00 0.00 175.55 175.94 3i26 n ASP 84 N 1.17 5.02 -4.69 4.32 8.00 -1.26 -4.89 116.55 124.21 3i26 n ASP 84 Ca -0.15 -3.03 -0.43 0.00 0.71 0.00 0.00 54.79 51.90 3i26 n ASP 84 Cb 0.52 -1.55 -0.01 0.00 -0.02 0.00 0.00 41.12 40.07 3i26 n ASP 84 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3i26 n TYR 85 N 5.04 2.19 -3.15 1.24 4.01 -1.26 -4.81 117.16 120.42 3i26 n TYR 85 Ca 0.41 0.55 0.05 0.00 -0.16 0.00 0.00 57.90 58.75 3i26 n TYR 85 Cb 0.40 -2.41 -0.01 0.00 -0.31 0.00 0.00 39.34 37.00 3i26 n TYR 85 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 3i26 s PHE 86 N -0.97 -0.82 0.02 -0.72 5.36 -1.26 -0.87 117.98 118.73 3i26 s PHE 86 Ca 0.57 0.85 -0.16 0.00 -0.96 0.00 0.00 56.93 57.23 3i26 s PHE 86 Cb -0.59 0.28 0.03 0.00 -0.34 0.00 0.00 43.02 42.40 3i26 s PHE 86 CO 0.61 -0.45 0.36 1.21 -1.46 0.00 0.00 175.22 175.49 3i26 s ASN 87 N 2.93 -0.22 -0.01 6.13 3.84 -1.00 -4.80 114.94 121.81 3i26 s ASN 87 Ca 0.06 -0.01 0.06 0.00 0.21 0.00 0.00 52.86 53.17 3i26 s ASN 87 Cb -0.11 0.38 -0.01 0.00 -0.55 0.00 0.00 41.25 40.95 3i26 s ASN 87 CO -0.14 -0.59 -0.18 0.00 -2.79 0.00 0.00 177.10 173.40 3i26 n GLY 89 N 2.60 1.51 0.14 0.00 0.00 -0.30 -4.38 105.19 104.77 3i26 n GLY 89 Ca -0.15 0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 3i26 n GLY 89 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3i26 h VAL 90 N 0.02 1.12 -3.13 1.61 2.07 -1.66 -3.42 116.25 112.86 3i26 h VAL 90 Ca 0.00 -0.31 -0.59 0.00 0.82 0.00 0.00 66.70 66.62 3i26 h VAL 90 Cb 0.00 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 3i26 h VAL 90 CO 0.00 0.12 -0.31 -1.61 0.02 0.00 0.00 177.57 175.79 3i26 s GLU 91 N -5.89 3.64 -0.02 1.57 2.02 -1.04 -4.85 118.70 114.13 3i26 s GLU 91 Ca -0.13 -0.05 -0.01 0.00 0.02 0.00 0.00 54.97 54.80 3i26 s GLU 91 Cb 0.09 -2.90 0.02 0.00 0.10 0.00 0.00 34.13 31.44 3i26 s GLU 91 CO 0.71 0.50 0.04 0.15 0.02 0.00 0.00 175.26 176.69 3i26 s LYS 92 N -2.43 0.01 -0.15 1.61 1.02 -1.26 -1.78 119.74 116.75 3i26 s LYS 92 Ca 0.38 0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.51 3i26 s LYS 92 Cb -0.13 -0.12 0.03 0.00 -0.52 0.00 0.00 37.83 37.09 3i26 s LYS 92 CO 0.23 -0.09 -0.13 0.08 -0.92 0.00 0.00 175.35 174.52 3i26 s VAL 93 N 0.60 1.53 -0.22 3.17 1.01 -0.09 -0.87 120.40 125.53 3i26 s VAL 93 Ca -0.05 -0.67 -0.07 0.00 0.00 0.00 0.00 61.98 61.19 3i26 s VAL 93 Cb -0.07 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 3i26 s VAL 93 CO -0.02 0.39 0.06 -0.36 0.00 0.00 0.00 175.10 175.18 3i26 s PHE 94 N 1.49 3.15 -0.40 5.22 0.08 0.16 -1.10 117.98 126.58 3i26 s PHE 94 Ca 0.04 -0.19 0.08 0.00 0.12 0.00 0.00 56.93 56.97 3i26 s PHE 94 Cb -0.13 -2.16 0.25 0.00 -0.57 0.00 0.00 43.02 40.40 3i26 s PHE 94 CO -0.10 -0.13 0.54 0.98 -0.10 0.00 0.00 175.22 176.42 3i26 n TYR 95 N 4.28 -0.60 -3.90 0.36 9.36 0.78 -1.09 117.16 126.36 3i26 n TYR 95 Ca -0.16 -3.42 -0.11 0.00 3.32 0.00 0.00 57.90 57.53 3i26 n TYR 95 Cb 0.52 -0.20 0.00 0.00 -0.63 0.00 0.00 39.34 39.03 3i26 n TYR 95 CO 0.00 0.00 0.00 -1.83 0.22 0.00 0.00 176.86 175.25 3i26 s GLU 96 N -1.02 2.10 0.00 2.98 4.04 -1.26 -3.64 118.70 121.91 3i26 s GLU 96 Ca 0.35 -1.51 0.00 0.00 0.04 0.00 0.00 54.97 53.84 3i26 s GLU 96 Cb 0.17 0.57 0.00 0.00 0.02 0.00 0.00 34.13 34.89 3i26 s GLU 96 CO -0.12 -0.95 0.00 0.41 -1.84 0.00 0.00 175.26 172.76 3i26 n GLY 97 N -0.54 1.20 0.23 -3.83 0.00 -1.26 -4.74 105.19 96.25 3i26 n GLY 97 Ca -0.05 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.03 3i26 n GLY 97 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3i26 h VAL 98 N 0.00 1.07 0.00 1.61 3.04 -1.90 -2.73 116.25 117.34 3i26 h VAL 98 Ca 0.00 -0.63 0.00 0.00 -1.01 0.00 0.00 66.70 65.06 3i26 h VAL 98 Cb 0.00 1.35 0.00 0.00 -2.01 0.00 0.00 31.29 30.63 3i26 h VAL 98 CO 0.00 0.18 0.00 0.59 -1.01 0.00 0.00 177.57 177.33 3i26 n ASN 99 N -4.24 0.00 -3.89 3.17 3.02 -1.26 -3.03 115.26 109.03 3i26 n ASN 99 Ca -0.02 0.05 -0.30 0.00 -0.03 0.00 0.00 54.58 54.28 3i26 n ASN 99 Cb 0.25 -0.31 -0.14 0.00 -0.61 0.00 0.00 39.78 38.97 3i26 n ASN 99 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3i26 s PHE 100 N -2.61 2.89 0.30 3.10 5.36 -1.03 -4.92 117.98 121.07 3i26 s PHE 100 Ca 0.18 -2.94 0.03 0.00 -0.96 0.00 0.00 56.93 53.24 3i26 s PHE 100 Cb 0.13 -2.57 -0.04 0.00 -0.34 0.00 0.00 43.02 40.21 3i26 s PHE 100 CO 0.30 -0.77 0.16 -1.12 -1.46 0.00 0.00 175.22 172.33 3i26 s SER 101 N 0.03 1.51 0.56 6.13 0.01 -1.17 -5.00 113.70 115.77 3i26 s SER 101 Ca 0.16 -1.55 0.27 0.00 1.31 0.00 0.00 55.95 56.14 3i26 s SER 101 Cb -0.25 0.38 1.50 0.00 0.21 0.00 0.00 66.02 67.87 3i26 s SER 101 CO -0.01 -0.89 2.02 -0.65 0.41 0.00 0.00 173.24 174.12 3i26 h PRO 102 N 2.22 0.00 -1.00 12.44 0.11 -1.82 -1.20 132.00 142.75 3i26 h PRO 102 Ca -0.33 0.00 0.25 0.00 0.11 0.00 0.00 66.00 66.03 3i26 h PRO 102 Cb 1.25 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.23 3i26 h PRO 102 CO 0.52 0.00 0.59 -0.09 -0.21 0.00 0.00 178.00 178.81 3i26 h ARG 103 N 0.00 0.54 0.00 1.05 2.43 -1.78 0.25 114.38 116.86 3i26 h ARG 103 Ca 0.17 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 3i26 h ARG 103 Cb 0.82 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.25 3i26 h ARG 103 CO -0.00 0.35 -0.04 -0.22 -1.51 0.00 0.00 179.97 178.56 3i26 h LYS 104 N 0.55 0.00 -5.39 0.20 3.64 -1.53 -3.47 116.57 110.57 3i26 h LYS 104 Ca 0.65 0.00 -0.41 0.00 -1.27 0.00 0.00 60.65 59.63 3i26 h LYS 104 Cb 1.27 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.05 3i26 h LYS 104 CO -0.49 0.04 -0.61 1.04 -2.27 0.00 0.00 179.45 177.15 3i26 n GLN 105 N -3.25 -4.25 -3.19 1.90 1.13 0.87 -4.94 117.38 105.65 3i26 n GLN 105 Ca -0.01 0.61 -0.39 0.00 -1.94 0.00 0.00 57.00 55.27 3i26 n GLN 105 Cb 0.20 -5.40 -0.06 0.00 0.11 0.00 0.00 30.24 25.09 3i26 n GLN 105 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 3i26 s TYR 106 N -3.07 3.80 0.32 1.08 5.04 -1.26 -4.95 117.35 118.31 3i26 s TYR 106 Ca 0.44 1.34 -0.14 0.00 -2.44 0.00 0.00 57.07 56.26 3i26 s TYR 106 Cb -0.22 -2.59 0.02 0.00 0.35 0.00 0.00 41.96 39.53 3i26 s TYR 106 CO 0.54 0.51 0.65 -1.54 -1.34 0.00 0.00 175.55 174.36 3i26 s SER 107 N -0.86 0.08 0.07 4.32 1.04 -1.26 -4.11 113.70 112.98 3i26 s SER 107 Ca 0.31 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.71 3i26 s SER 107 Cb -0.20 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.65 3i26 s SER 107 CO 0.20 -1.42 0.00 0.00 0.98 0.00 0.00 173.24 173.00 3i26 n TRP 109 N -2.92 0.00 0.73 0.00 7.02 -1.26 -0.77 117.44 120.24 3i26 n TRP 109 Ca 0.00 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.59 3i26 n TRP 109 Cb 0.00 0.00 0.28 0.00 -2.42 0.00 0.00 31.31 29.17 3i26 n TRP 109 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 3i26 n ASP 110 N 0.00 2.62 0.28 -0.99 8.00 -0.74 -4.11 116.55 121.61 3i26 n ASP 110 Ca 0.00 -1.88 0.16 0.00 0.71 0.00 0.00 54.79 53.79 3i26 n ASP 110 Cb 0.00 -0.19 0.83 0.00 -0.02 0.00 0.00 41.12 41.74 3i26 n ASP 110 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 3i26 h GLU 111 N 3.39 0.00 0.00 -1.24 9.09 -1.90 -3.47 114.58 120.44 3i26 h GLU 111 Ca 0.00 0.00 0.10 0.00 0.05 0.00 0.00 59.36 59.51 3i26 h GLU 111 Cb 0.75 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.82 3i26 h GLU 111 CO 0.00 0.06 -0.13 0.41 0.05 0.00 0.00 179.01 179.41 3i26 n GLY 112 N -0.58 -1.82 0.31 1.06 0.00 -1.26 -1.97 105.19 100.93 3i26 n GLY 112 Ca -0.01 -1.29 -0.04 0.00 0.00 0.00 0.00 46.02 44.68 3i26 n GLY 112 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3i26 h VAL 113 N -0.32 1.23 0.00 1.61 2.07 -1.93 -2.81 116.25 116.10 3i26 h VAL 113 Ca 0.01 -0.83 -0.11 0.00 0.82 0.00 0.00 66.70 66.58 3i26 h VAL 113 Cb 0.32 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 3i26 h VAL 113 CO 0.00 0.31 -0.54 0.44 0.02 0.00 0.00 177.57 177.81 3i26 h ASP 114 N 0.86 0.00 -0.96 0.57 3.32 -1.89 -2.38 116.42 115.94 3i26 h ASP 114 Ca 0.19 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.28 3i26 h ASP 114 Cb 0.30 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.79 3i26 h ASP 114 CO -0.00 0.54 0.62 1.23 -1.72 0.00 0.00 179.24 179.91 3i26 h GLY 115 N 1.70 1.41 2.00 2.75 0.00 -1.13 -0.95 103.07 108.86 3i26 h GLY 115 Ca -0.01 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.85 3i26 h GLY 115 CO 0.07 0.39 0.00 1.49 0.00 0.00 0.00 176.54 178.49 3i26 h TRP 116 N 1.19 0.00 0.00 5.60 4.06 -1.41 -2.08 115.95 123.31 3i26 h TRP 116 Ca 0.39 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 61.20 3i26 h TRP 116 Cb 0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.17 3i26 h TRP 116 CO -0.01 0.00 -0.65 0.82 -3.56 0.00 0.00 178.44 175.04 3i26 h ILE 117 N 0.00 1.43 -0.16 1.49 1.08 -0.94 -1.77 117.51 118.64 3i26 h ILE 117 Ca 0.00 -2.27 -0.04 0.00 -0.39 0.00 0.00 64.86 62.16 3i26 h ILE 117 Cb 0.94 2.24 -0.00 0.00 -3.07 0.00 0.00 36.82 36.93 3i26 h ILE 117 CO 0.00 0.64 -0.05 -0.08 -0.69 0.00 0.00 178.15 177.97 3i26 h GLU 118 N 0.00 0.31 -0.86 2.37 4.57 -0.85 -2.05 114.58 118.07 3i26 h GLU 118 Ca -0.01 -0.12 0.01 0.00 -1.18 0.00 0.00 59.36 58.06 3i26 h GLU 118 Cb 1.19 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.72 3i26 h GLU 118 CO 0.08 0.60 0.57 -0.07 -1.18 0.00 0.00 179.01 179.01 3i26 h LEU 119 N 0.01 0.97 -0.29 1.64 3.38 -1.40 -1.16 115.31 118.47 3i26 h LEU 119 Ca 0.04 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.02 3i26 h LEU 119 Cb 0.49 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 3i26 h LEU 119 CO 0.02 0.70 0.08 0.50 0.09 0.00 0.00 178.44 179.82 3i26 h LYS 120 N 1.15 0.19 -0.45 1.13 3.64 -1.27 -0.89 116.57 120.06 3i26 h LYS 120 Ca 0.32 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.70 3i26 h LYS 120 Cb -0.11 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 3i26 h LYS 120 CO -0.08 0.12 0.29 1.15 -2.27 0.00 0.00 179.45 178.67 3i26 h THR 121 N 0.19 1.11 -0.80 1.00 2.02 -0.97 -2.04 112.91 113.40 3i26 h THR 121 Ca 0.13 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 3i26 h THR 121 Cb 0.12 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 66.95 3i26 h THR 121 CO -0.16 0.11 0.42 0.03 0.37 0.00 0.00 175.52 176.29 3i26 h ARG 122 N 0.60 1.13 0.40 6.66 3.08 -0.88 -1.07 114.38 124.30 3i26 h ARG 122 Ca 0.17 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 3i26 h ARG 122 Cb -0.06 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.78 3i26 h ARG 122 CO -0.04 0.85 -0.19 0.35 -1.07 0.00 0.00 179.97 179.86 3i26 h PHE 123 N 1.13 -0.50 -0.38 3.04 3.57 -0.89 -2.38 116.94 120.55 3i26 h PHE 123 Ca 0.28 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 3i26 h PHE 123 Cb 0.06 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 3i26 h PHE 123 CO 0.01 -0.19 0.14 1.88 -2.23 0.00 0.00 178.31 177.92 3i26 h TYR 124 N -0.78 0.53 0.06 0.41 0.05 -1.31 0.23 116.97 116.16 3i26 h TYR 124 Ca -0.05 -0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.72 3i26 h TYR 124 Cb 0.53 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 38.08 3i26 h TYR 124 CO 0.00 0.42 -0.13 1.15 -1.05 0.00 0.00 178.16 178.56 3i26 h THR 125 N 0.53 0.70 -0.32 -2.88 2.02 -1.17 -0.49 112.91 111.29 3i26 h THR 125 Ca 0.13 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.20 3i26 h THR 125 Cb 0.12 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 3i26 h THR 125 CO -0.01 0.00 -0.26 0.50 0.37 0.00 0.00 175.52 176.12 3i26 h LYS 126 N -0.25 0.65 -0.14 6.66 1.63 -0.85 -2.10 116.57 122.17 3i26 h LYS 126 Ca 0.02 -0.26 -0.01 0.00 -0.85 0.00 0.00 60.65 59.55 3i26 h LYS 126 Cb 0.27 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 3i26 h LYS 126 CO -0.08 0.84 0.05 1.25 -3.45 0.00 0.00 179.45 178.06 3i26 h LEU 127 N 0.56 0.20 0.16 5.20 5.85 -0.38 -1.84 115.31 125.06 3i26 h LEU 127 Ca 0.08 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 3i26 h LEU 127 Cb 0.73 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.72 3i26 h LEU 127 CO 0.06 0.33 -0.08 1.88 -0.34 0.00 0.00 178.44 180.29 3i26 h TYR 128 N 0.05 -0.20 -0.44 1.25 0.05 -1.01 -0.23 116.97 116.45 3i26 h TYR 128 Ca 0.05 -0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.90 3i26 h TYR 128 Cb 0.20 0.07 -0.10 0.00 1.01 0.00 0.00 36.73 37.91 3i26 h TYR 128 CO -0.01 -0.04 -0.35 1.96 -1.05 0.00 0.00 178.16 178.67 3i26 h GLN 129 N -0.31 -0.24 -0.20 4.88 4.20 -1.36 -1.23 115.11 120.85 3i26 h GLN 129 Ca -0.02 0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 3i26 h GLN 129 Cb 0.24 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 3i26 h GLN 129 CO 0.04 -0.16 -0.20 0.52 -0.67 0.00 0.00 178.83 178.36 3i26 h MET 130 N -0.25 0.34 -0.24 1.46 2.86 -1.18 -2.87 114.93 115.05 3i26 h MET 130 Ca 0.18 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 3i26 h MET 130 Cb 0.55 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 3i26 h MET 130 CO -0.57 0.53 0.11 0.00 1.06 0.00 0.00 176.91 178.04 3i26 h ALA 131 N 1.49 1.74 0.00 6.32 0.00 0.18 -3.06 119.26 125.92 3i26 h ALA 131 Ca 0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3i26 h ALA 131 Cb 0.53 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3i26 h ALA 131 CO 0.04 0.22 -0.12 1.79 0.00 0.00 0.00 179.25 181.17 3i26 h THR 132 N 0.34 0.86 -0.33 0.00 1.35 -1.23 -1.82 112.91 112.06 3i26 h THR 132 Ca 0.09 -0.46 -0.09 0.00 -0.55 0.00 0.00 66.41 65.39 3i26 h THR 132 Cb 0.05 1.27 -0.06 0.00 -1.73 0.00 0.00 68.15 67.68 3i26 h THR 132 CO -0.01 0.12 0.01 0.35 -0.25 0.00 0.00 175.52 175.74 3i26 n THR 133 N -4.05 2.44 -4.25 6.82 -2.24 -1.16 -1.31 114.28 110.52 3i26 n THR 133 Ca -0.02 -2.21 -0.15 0.00 -2.27 0.00 0.00 64.05 59.40 3i26 n THR 133 Cb 0.21 -0.29 -0.10 0.00 -2.10 0.00 0.00 70.33 68.04 3i26 n THR 133 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3i26 s SER 134 N -2.13 1.89 -0.22 3.42 0.01 -0.69 -1.94 113.70 114.05 3i26 s SER 134 Ca 0.44 -0.96 -0.11 0.00 1.31 0.00 0.00 55.95 56.63 3i26 s SER 134 Cb 0.37 -0.03 -0.10 0.00 0.21 0.00 0.00 66.02 66.47 3i26 s SER 134 CO 0.06 -0.27 -0.28 -1.14 0.41 0.00 0.00 173.24 172.01 3i26 n ARG 135 N -0.01 0.47 -3.81 12.44 0.63 -1.26 -4.75 116.66 120.35 3i26 n ARG 135 Ca -0.11 0.20 -0.37 0.00 -0.92 0.00 0.00 57.85 56.66 3i26 n ARG 135 Cb 0.60 -1.29 -0.07 0.00 0.45 0.00 0.00 32.46 32.15 3i26 n ARG 135 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3i26 s ILE 137 N -0.62 0.81 -0.08 0.00 1.01 -0.75 -2.86 121.20 118.70 3i26 s ILE 137 Ca 0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 60.65 60.53 3i26 s ILE 137 Cb -0.12 -0.93 0.03 0.00 0.01 0.00 0.00 42.46 41.45 3i26 s ILE 137 CO 0.03 0.26 0.01 -0.75 0.00 0.00 0.00 174.94 174.49 3i26 s LYS 138 N 1.79 0.55 -0.23 2.79 2.20 0.04 -2.36 119.74 124.52 3i26 s LYS 138 Ca 0.04 0.08 -0.29 0.00 -0.36 0.00 0.00 55.97 55.44 3i26 s LYS 138 Cb -0.13 -1.04 -0.02 0.00 -1.51 0.00 0.00 37.83 35.13 3i26 s LYS 138 CO -0.07 -0.34 1.44 -1.17 -0.36 0.00 0.00 175.35 174.85 3i26 s LEU 139 N 1.98 3.96 0.23 5.43 2.96 -0.05 -0.54 118.68 132.65 3i26 s LEU 139 Ca 0.04 1.51 0.11 0.00 -0.22 0.00 0.00 54.13 55.57 3i26 s LEU 139 Cb -0.13 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.98 3i26 s LEU 139 CO -0.05 -1.09 -0.16 0.27 -1.32 0.00 0.00 176.35 174.00 3i26 s ILE 140 N 4.54 2.74 -0.08 6.68 -4.36 -0.34 -4.67 121.20 125.71 3i26 s ILE 140 Ca 0.63 -2.04 -0.16 0.00 -0.26 0.00 0.00 60.65 58.81 3i26 s ILE 140 Cb -0.22 -2.39 -0.05 0.00 1.25 0.00 0.00 42.46 41.06 3i26 s ILE 140 CO 0.25 -0.24 0.42 -1.10 0.24 0.00 0.00 174.94 174.51 3i26 s GLN 141 N -3.10 4.19 -0.13 0.37 -1.52 -1.26 -2.53 119.66 115.68 3i26 s GLN 141 Ca 0.26 0.38 -0.18 0.00 -1.95 0.00 0.00 55.36 53.86 3i26 s GLN 141 Cb -0.07 -3.36 -0.04 0.00 -0.22 0.00 0.00 33.01 29.32 3i26 s GLN 141 CO 0.14 0.35 0.49 -0.51 -0.25 0.00 0.00 175.29 175.51 3i26 s LEU 142 N 0.02 4.26 -0.05 2.90 1.43 0.37 -4.97 118.68 122.64 3i26 s LEU 142 Ca 0.24 0.80 -0.40 0.00 -1.03 0.00 0.00 54.13 53.74 3i26 s LEU 142 Cb -0.15 -2.70 -0.19 0.00 0.03 0.00 0.00 46.19 43.17 3i26 s LEU 142 CO 0.10 -0.03 1.19 0.00 0.23 0.00 0.00 176.35 177.84 3i26 n GLN 143 N 3.82 0.22 -1.77 1.70 1.13 -1.26 -4.84 117.38 116.37 3i26 n GLN 143 Ca -0.07 0.08 -0.41 0.00 -1.94 0.00 0.00 57.00 54.66 3i26 n GLN 143 Cb 0.51 -1.61 -0.00 0.00 0.11 0.00 0.00 30.24 29.26 3i26 n GLN 143 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3i26 n ALA 144 N 2.03 2.47 -1.70 -1.58 0.00 -1.26 -4.67 120.51 115.81 3i26 n ALA 144 Ca 0.21 0.34 -0.43 0.00 0.00 0.00 0.00 53.44 53.57 3i26 n ALA 144 Cb 0.08 -2.44 -0.01 0.00 0.00 0.00 0.00 19.45 17.09 3i26 n ALA 144 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3i26 n PRO 145 N 0.71 2.11 -0.02 0.00 -0.02 -1.26 -4.94 135.00 131.57 3i26 n PRO 145 Ca 0.02 0.74 -0.13 0.00 -2.02 0.00 0.00 63.50 62.11 3i26 n PRO 145 Cb 0.39 -2.31 -0.10 0.00 -0.02 0.00 0.00 33.50 31.45 3i26 n PRO 145 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3i26 h SER 146 N 2.54 0.02 -0.26 2.55 0.02 -1.91 -3.31 113.55 113.20 3i26 h SER 146 Ca -0.46 -0.54 -0.17 0.00 -0.84 0.00 0.00 61.79 59.78 3i26 h SER 146 Cb 1.28 -0.01 -0.07 0.00 0.14 0.00 0.00 62.40 63.75 3i26 h SER 146 CO 0.63 0.56 0.20 -0.24 -1.14 0.00 0.00 176.83 176.83 3i26 n SER 147 N -4.82 5.92 -4.64 3.07 2.88 -1.26 -4.94 113.62 109.83 3i26 n SER 147 Ca -0.09 -2.75 -0.43 0.00 -1.33 0.00 0.00 58.87 54.28 3i26 n SER 147 Cb 0.28 -1.11 -0.03 0.00 -0.75 0.00 0.00 64.21 62.61 3i26 n SER 147 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3i26 s LEU 148 N -0.93 4.00 0.87 2.46 1.43 -1.25 -5.00 118.68 120.25 3i26 s LEU 148 Ca 0.19 1.75 -0.12 0.00 -1.03 0.00 0.00 54.13 54.92 3i26 s LEU 148 Cb 0.14 -3.53 0.15 0.00 0.03 0.00 0.00 46.19 42.97 3i26 s LEU 148 CO -0.01 -1.16 1.21 -2.16 0.23 0.00 0.00 176.35 174.46 3i26 s PRO 149 N 4.47 1.23 -0.03 1.29 0.04 -1.26 -4.96 135.00 135.77 3i26 s PRO 149 Ca 0.71 -0.40 -0.34 0.00 0.04 0.00 0.00 61.00 61.01 3i26 s PRO 149 Cb -0.26 -1.98 -0.12 0.00 0.04 0.00 0.00 34.50 32.18 3i26 s PRO 149 CO 0.28 -1.98 1.83 2.41 0.04 0.00 0.00 177.00 179.59 3i26 n THR 150 N -3.44 0.49 -4.22 1.26 -1.04 -1.26 -4.96 114.28 101.10 3i26 n THR 150 Ca 0.13 -0.09 -0.20 0.00 -2.04 0.00 0.00 64.05 61.85 3i26 n THR 150 Cb 0.60 -1.84 -0.12 0.00 -1.82 0.00 0.00 70.33 67.14 3i26 n THR 150 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3i26 s LEU 151 N 3.51 2.29 -0.11 -4.42 1.43 -1.26 -4.17 118.68 115.96 3i26 s LEU 151 Ca 0.90 -0.66 0.02 0.00 -1.03 0.00 0.00 54.13 53.36 3i26 s LEU 151 Cb -0.67 -0.65 -0.01 0.00 0.03 0.00 0.00 46.19 44.89 3i26 s LEU 151 CO 0.48 -0.03 -0.17 -1.58 0.23 0.00 0.00 176.35 175.28 3i26 s GLN 152 N -1.87 3.18 0.33 1.70 0.74 0.68 -4.92 119.66 119.50 3i26 s GLN 152 Ca 0.02 -0.76 -0.29 0.00 0.05 0.00 0.00 55.36 54.38 3i26 s GLN 152 Cb -0.10 -2.49 -0.11 0.00 1.10 0.00 0.00 33.01 31.42 3i26 s GLN 152 CO 0.03 0.24 1.54 0.00 -0.55 0.00 0.00 175.29 176.55 3i26 s ALA 153 N 0.25 3.67 0.78 1.58 0.00 -1.26 0.59 121.76 127.37 3i26 s ALA 153 Ca -0.12 1.56 -0.12 0.00 0.00 0.00 0.00 51.96 53.29 3i26 s ALA 153 Cb -0.16 -3.63 0.06 0.00 0.00 0.00 0.00 23.12 19.39 3i26 s ALA 153 CO 0.06 -1.00 1.12 0.20 0.00 0.00 0.00 175.76 176.14 3i26 s GLY 154 N 0.21 1.61 0.27 0.00 0.00 -1.02 -4.73 107.32 103.66 3i26 s GLY 154 Ca 0.59 -0.37 0.04 0.00 0.00 0.00 0.00 44.72 44.98 3i26 s GLY 154 CO 0.54 0.06 0.00 -1.34 0.00 0.00 0.00 173.10 172.36 3i26 s VAL 155 N -3.32 1.22 0.25 1.40 -7.23 -1.26 -4.93 120.40 106.54 3i26 s VAL 155 Ca 0.60 -2.05 -0.15 0.00 -1.81 0.00 0.00 61.98 58.57 3i26 s VAL 155 Cb -0.13 -2.50 -0.08 0.00 0.56 0.00 0.00 36.38 34.23 3i26 s VAL 155 CO 0.52 -0.22 0.68 0.00 -0.31 0.00 0.00 175.10 175.77 3i26 h ARG 157 N 2.83 0.59 0.00 0.00 2.43 -1.28 -2.90 114.38 116.05 3i26 h ARG 157 Ca -0.48 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 58.49 3i26 h ARG 157 Cb 1.18 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 3i26 h ARG 157 CO 0.66 0.74 0.00 0.25 -1.51 0.00 0.00 179.97 180.11 3i26 n THR 158 N -4.16 0.12 -0.94 0.20 -2.24 -0.32 -4.88 114.28 102.06 3i26 n THR 158 Ca 0.00 0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 3i26 n THR 158 Cb 0.37 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 3i26 n THR 158 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3i26 n ASN 159 N -1.13 -3.48 -4.33 3.42 3.02 -1.09 -5.01 115.26 106.66 3i26 n ASN 159 Ca 0.15 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.41 3i26 n ASN 159 Cb 0.13 -1.90 0.16 0.00 -0.61 0.00 0.00 39.78 37.56 3i26 n ASN 159 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3i26 s LYS 160 N -0.93 0.97 -0.14 3.52 1.02 -1.26 -4.94 119.74 117.98 3i26 s LYS 160 Ca 0.00 -0.27 -0.29 0.00 0.02 0.00 0.00 55.97 55.42 3i26 s LYS 160 Cb 0.00 -1.87 -0.02 0.00 -0.52 0.00 0.00 37.83 35.42 3i26 s LYS 160 CO 0.00 -2.22 1.28 -1.14 -0.92 0.00 0.00 175.35 172.36 3i26 s GLN 161 N -5.81 4.25 0.34 1.68 2.00 -1.26 -4.28 119.66 116.57 3i26 s GLN 161 Ca 0.71 1.71 -0.29 0.00 -2.00 0.00 0.00 55.36 55.49 3i26 s GLN 161 Cb -0.06 -3.74 -0.11 0.00 0.80 0.00 0.00 33.01 29.91 3i26 s GLN 161 CO 0.52 -0.67 1.40 -1.17 -0.50 0.00 0.00 175.29 174.87 3i26 s LEU 162 N 3.29 4.38 0.26 3.68 2.96 -1.26 -4.96 118.68 127.02 3i26 s LEU 162 Ca 0.56 2.83 -0.31 0.00 -0.22 0.00 0.00 54.13 56.99 3i26 s LEU 162 Cb -0.23 -3.65 -0.13 0.00 0.50 0.00 0.00 46.19 42.68 3i26 s LEU 162 CO 0.17 -0.69 1.45 -2.65 -1.32 0.00 0.00 176.35 173.31 3i26 n PRO 163 N 0.92 2.20 0.04 0.98 -0.02 -1.26 -4.88 135.00 132.98 3i26 n PRO 163 Ca 0.02 0.78 0.14 0.00 -2.02 0.00 0.00 63.50 62.41 3i26 n PRO 163 Cb 0.40 -2.47 0.52 0.00 -0.02 0.00 0.00 33.50 31.94 3i26 n PRO 163 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3i26 n ASP 164 N 2.10 0.32 -3.70 2.55 8.00 0.16 -4.57 116.55 121.40 3i26 n ASP 164 Ca 0.11 0.50 -0.17 0.00 0.71 0.00 0.00 54.79 55.93 3i26 n ASP 164 Cb 0.33 -0.57 -0.17 0.00 -0.02 0.00 0.00 41.12 40.70 3i26 n ASP 164 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3i26 s ASN 165 N -3.56 0.66 0.65 -2.24 2.47 -0.24 -3.38 114.94 109.31 3i26 s ASN 165 Ca 0.13 0.15 -0.15 0.00 0.42 0.00 0.00 52.86 53.40 3i26 s ASN 165 Cb 0.16 -0.00 -0.00 0.00 -1.45 0.00 0.00 41.25 39.96 3i26 s ASN 165 CO 0.56 -0.21 1.11 -2.16 -3.72 0.00 0.00 177.10 172.69 3i26 s PRO 166 N 1.82 2.84 -0.04 0.43 0.04 -1.26 -4.33 135.00 134.50 3i26 s PRO 166 Ca -0.00 1.42 -0.30 0.00 0.04 0.00 0.00 61.00 62.16 3i26 s PRO 166 Cb -0.12 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 3i26 s PRO 166 CO -0.04 -1.23 1.25 0.50 0.04 0.00 0.00 177.00 177.52 3i26 s ARG 167 N -4.01 4.34 -0.27 4.56 3.52 0.13 -4.86 118.95 122.36 3i26 s ARG 167 Ca 0.68 1.75 -0.10 0.00 -0.13 0.00 0.00 55.73 57.93 3i26 s ARG 167 Cb -0.21 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.59 3i26 s ARG 167 CO 0.40 -0.47 0.15 -1.17 -0.81 0.00 0.00 175.30 173.41 3i26 s LEU 168 N 2.20 3.85 0.20 -0.88 2.96 -1.26 -2.20 118.68 123.55 3i26 s LEU 168 Ca 0.58 -0.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.45 3i26 s LEU 168 Cb -0.27 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.31 3i26 s LEU 168 CO 0.23 -0.04 0.01 0.00 -1.32 0.00 0.00 176.35 175.24 3i26 s ALA 169 N 1.70 1.55 -0.13 5.97 0.00 -0.25 -2.45 121.76 128.16 3i26 s ALA 169 Ca 0.07 -1.69 0.03 0.00 0.00 0.00 0.00 51.96 50.37 3i26 s ALA 169 Cb -0.16 0.61 0.01 0.00 0.00 0.00 0.00 23.12 23.58 3i26 s ALA 169 CO 0.09 -0.32 -0.22 -0.51 0.00 0.00 0.00 175.76 174.80 3i26 s LEU 170 N -3.24 2.06 0.78 0.00 1.02 0.20 -1.16 118.68 118.34 3i26 s LEU 170 Ca 0.27 -0.57 -0.11 0.00 0.02 0.00 0.00 54.13 53.74 3i26 s LEU 170 Cb 0.06 -1.39 0.07 0.00 0.02 0.00 0.00 46.19 44.95 3i26 s LEU 170 CO 0.07 0.10 1.14 -0.76 0.02 0.00 0.00 176.35 176.92 3i26 s LEU 171 N 0.70 2.60 0.20 1.79 1.43 0.14 -0.23 118.68 125.31 3i26 s LEU 171 Ca -0.10 0.76 0.10 0.00 -1.03 0.00 0.00 54.13 53.86 3i26 s LEU 171 Cb -0.16 -3.31 0.03 0.00 0.03 0.00 0.00 46.19 42.77 3i26 s LEU 171 CO 0.01 -1.79 1.41 0.28 0.23 0.00 0.00 176.35 176.50 3i26 h SER 172 N -0.93 0.00 -0.67 2.29 0.02 -1.87 -3.46 113.55 108.92 3i26 h SER 172 Ca -0.46 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 59.86 3i26 h SER 172 Cb 1.32 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.76 3i26 h SER 172 CO 0.65 0.77 -0.45 1.51 -1.14 0.00 0.00 176.83 178.16 3i26 s ASP 173 N -6.65 4.30 -0.09 3.07 1.47 -1.26 -5.06 116.67 112.46 3i26 s ASP 173 Ca 0.01 -1.44 0.13 0.00 1.18 0.00 0.00 52.55 52.43 3i26 s ASP 173 Cb 0.10 0.29 0.34 0.00 -0.34 0.00 0.00 42.92 43.32 3i26 s ASP 173 CO 0.78 -0.86 1.26 0.35 0.68 0.00 0.00 175.17 177.39 3i26 n THR 174 N -1.39 1.62 -2.81 2.11 -2.24 -1.26 -2.66 114.28 107.64 3i26 n THR 174 Ca -0.11 -1.52 -0.34 0.00 -2.27 0.00 0.00 64.05 59.81 3i26 n THR 174 Cb 0.66 0.11 -0.07 0.00 -2.10 0.00 0.00 70.33 68.93 3i26 n THR 174 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3i26 s VAL 175 N -1.97 4.34 0.35 2.28 1.01 -1.26 -4.26 120.40 120.90 3i26 s VAL 175 Ca 0.28 1.58 -0.29 0.00 0.00 0.00 0.00 61.98 63.55 3i26 s VAL 175 Cb 0.21 -3.71 -0.11 0.00 0.00 0.00 0.00 36.38 32.76 3i26 s VAL 175 CO 0.09 -0.19 1.50 -2.65 0.00 0.00 0.00 175.10 173.85 3i26 n PRO 176 N -0.31 2.65 -4.08 2.72 -0.02 -0.99 -3.98 135.00 130.99 3i26 n PRO 176 Ca 0.06 0.93 -0.13 0.00 -2.02 0.00 0.00 63.50 62.34 3i26 n PRO 176 Cb 0.53 -2.67 -0.05 0.00 -0.02 0.00 0.00 33.50 31.29 3i26 n PRO 176 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 3i26 s THR 177 N -0.84 0.00 -0.16 3.45 -1.32 -1.00 -4.92 115.64 110.85 3i26 s THR 177 Ca 0.56 -1.60 -0.24 0.00 -1.21 0.00 0.00 61.69 59.20 3i26 s THR 177 Cb -0.49 -2.52 0.06 0.00 -1.51 0.00 0.00 72.50 68.04 3i26 s THR 177 CO 0.60 0.00 0.62 -0.44 -2.21 0.00 0.00 174.62 173.19 3i26 s SER 178 N -3.18 -0.62 0.13 8.08 0.01 -1.26 -1.98 113.70 114.88 3i26 s SER 178 Ca 0.29 1.00 0.05 0.00 1.31 0.00 0.00 55.95 58.61 3i26 s SER 178 Cb 0.00 0.97 -0.04 0.00 0.21 0.00 0.00 66.02 67.16 3i26 s SER 178 CO 0.17 -0.36 -0.13 0.68 0.41 0.00 0.00 173.24 174.01 3i26 s VAL 179 N -0.30 1.28 -0.18 3.43 -7.23 -1.09 -4.98 120.40 111.34 3i26 s VAL 179 Ca -0.05 -1.82 -0.06 0.00 -1.81 0.00 0.00 61.98 58.25 3i26 s VAL 179 Cb -0.03 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.26 3i26 s VAL 179 CO 0.04 -0.52 0.03 -1.58 -0.31 0.00 0.00 175.10 172.76 3i26 s GLN 180 N -2.98 3.84 0.10 4.82 0.74 -1.26 0.40 119.66 125.32 3i26 s GLN 180 Ca 0.11 -0.42 0.08 0.00 0.05 0.00 0.00 55.36 55.18 3i26 s GLN 180 Cb -0.03 -3.11 -0.03 0.00 1.10 0.00 0.00 33.01 30.94 3i26 s GLN 180 CO 0.02 0.23 -0.19 -0.59 -0.55 0.00 0.00 175.29 174.21 3i26 s PHE 181 N 0.46 1.67 -0.25 1.67 -0.71 0.32 -4.25 117.98 116.89 3i26 s PHE 181 Ca 0.01 -0.44 -0.02 0.00 -1.04 0.00 0.00 56.93 55.44 3i26 s PHE 181 Cb -0.13 -0.91 0.03 0.00 -1.21 0.00 0.00 43.02 40.80 3i26 s PHE 181 CO 0.01 0.19 -0.06 0.08 -1.34 0.00 0.00 175.22 174.11 3i26 s VAL 182 N -1.33 2.89 -0.49 -2.49 1.01 -1.26 -1.28 120.40 117.45 3i26 s VAL 182 Ca 0.06 -1.05 -0.23 0.00 0.00 0.00 0.00 61.98 60.76 3i26 s VAL 182 Cb -0.09 -2.48 0.04 0.00 0.00 0.00 0.00 36.38 33.84 3i26 s VAL 182 CO 0.04 0.17 0.81 -0.76 0.00 0.00 0.00 175.10 175.37 3i26 s LEU 183 N 1.32 4.31 0.67 3.92 1.43 0.95 -4.59 118.68 126.68 3i26 s LEU 183 Ca -0.00 -0.31 -0.13 0.00 -1.03 0.00 0.00 54.13 52.66 3i26 s LEU 183 Cb -0.17 -2.84 -0.00 0.00 0.03 0.00 0.00 46.19 43.21 3i26 s LEU 183 CO -0.04 -1.01 1.07 -2.16 0.23 0.00 0.00 176.35 174.44 3i26 s PRO 184 N 3.40 2.94 0.00 1.29 0.04 -1.26 -0.28 135.00 141.13 3i26 s PRO 184 Ca 0.28 1.14 0.29 0.00 0.04 0.00 0.00 61.00 62.74 3i26 s PRO 184 Cb -0.13 -1.98 1.18 0.00 0.04 0.00 0.00 34.50 33.60 3i26 s PRO 184 CO 0.20 -1.11 1.85 0.41 0.04 0.00 0.00 177.00 178.40 3i26 n GLY 185 N -1.31 -1.25 3.77 0.56 0.00 -1.26 -4.65 105.19 101.06 3i26 n GLY 185 Ca 0.09 -0.20 -0.08 0.00 0.00 0.00 0.00 46.02 45.83 3i26 n GLY 185 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i26 s SER 186 N -2.76 -0.08 -0.50 1.61 1.04 -1.26 -1.96 113.70 109.79 3i26 s SER 186 Ca 0.21 -0.87 0.07 0.00 0.48 0.00 0.00 55.95 55.84 3i26 s SER 186 Cb 0.19 0.73 0.19 0.00 0.10 0.00 0.00 66.02 67.24 3i26 s SER 186 CO 0.53 -1.40 0.69 -0.24 0.98 0.00 0.00 173.24 173.79 3i26 n SER 187 N -0.76 -2.94 0.00 7.02 2.88 -0.13 -4.83 113.62 114.86 3i26 n SER 187 Ca -0.04 -2.88 0.00 0.00 -1.33 0.00 0.00 58.87 54.62 3i26 n SER 187 Cb 0.60 1.40 0.00 0.00 -0.75 0.00 0.00 64.21 65.46 3i26 n SER 187 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3i26 n GLY 188 N 2.78 2.08 0.16 0.46 0.00 -1.26 -3.24 105.19 106.17 3i26 n GLY 188 Ca 0.19 -0.43 0.08 0.00 0.00 0.00 0.00 46.02 45.85 3i26 n GLY 188 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3i26 h THR 189 N 0.00 0.33 -3.69 2.61 1.35 -2.04 -3.46 112.91 108.02 3i26 h THR 189 Ca 0.00 -1.50 -0.51 0.00 -0.55 0.00 0.00 66.41 63.86 3i26 h THR 189 Cb 0.00 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 3i26 h THR 189 CO 0.00 0.19 0.45 -0.89 -0.25 0.00 0.00 175.52 175.02 3i26 s THR 190 N -3.12 3.80 -0.11 6.82 2.01 -1.20 -5.05 115.64 118.79 3i26 s THR 190 Ca 0.04 1.68 -0.09 0.00 0.31 0.00 0.00 61.69 63.63 3i26 s THR 190 Cb 0.07 -4.07 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 3i26 s THR 190 CO 0.73 0.35 0.20 -0.63 -0.69 0.00 0.00 174.62 174.58 3i26 s ILE 191 N -0.74 5.39 -0.62 1.82 -1.09 -1.26 -0.96 121.20 123.73 3i26 s ILE 191 Ca 0.46 0.36 -0.11 0.00 -2.23 0.00 0.00 60.65 59.13 3i26 s ILE 191 Cb -0.29 -3.49 0.16 0.00 -1.58 0.00 0.00 42.46 37.26 3i26 s ILE 191 CO 0.36 0.58 0.52 0.00 -1.23 0.00 0.00 174.94 175.17 3i26 h THR 193 N 5.51 0.12 -3.40 0.00 1.35 -1.04 -3.42 112.91 112.03 3i26 h THR 193 Ca -0.09 -1.17 -0.03 0.00 -0.55 0.00 0.00 66.41 64.57 3i26 h THR 193 Cb 1.04 2.05 -0.10 0.00 -1.73 0.00 0.00 68.15 69.42 3i26 h THR 193 CO 0.83 0.07 -0.02 -1.59 -0.25 0.00 0.00 175.52 174.56 3i26 s LYS 194 N -3.18 1.43 -0.01 4.72 0.00 -0.42 -4.34 119.74 117.93 3i26 s LYS 194 Ca 0.06 -0.98 0.03 0.00 0.00 0.00 0.00 55.97 55.09 3i26 s LYS 194 Cb 0.05 0.50 -0.01 0.00 0.00 0.00 0.00 37.83 38.38 3i26 s LYS 194 CO 0.68 -0.60 -0.11 -1.01 0.00 0.00 0.00 175.35 174.32 3i26 s HIS 195 N -3.91 0.95 -0.33 1.78 3.76 0.51 -1.02 115.29 117.03 3i26 s HIS 195 Ca 0.13 -0.18 -0.17 0.00 -0.15 0.00 0.00 55.06 54.69 3i26 s HIS 195 Cb -0.01 -0.61 -0.01 0.00 1.11 0.00 0.00 32.58 33.05 3i26 s HIS 195 CO 0.01 -0.02 0.44 -1.17 -0.85 0.00 0.00 174.74 173.15 3i26 s LEU 196 N -0.24 4.30 -0.05 0.89 0.20 -0.34 -1.14 118.68 122.30 3i26 s LEU 196 Ca 0.04 -0.00 0.03 0.00 0.69 0.00 0.00 54.13 54.88 3i26 s LEU 196 Cb -0.04 -2.48 0.01 0.00 -0.43 0.00 0.00 46.19 43.25 3i26 s LEU 196 CO -0.00 -0.37 -0.11 -0.69 -0.29 0.00 0.00 176.35 174.89 3i26 s VAL 197 N 2.21 1.01 0.29 1.68 1.01 -0.25 -1.92 120.40 124.42 3i26 s VAL 197 Ca 0.16 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.46 3i26 s VAL 197 Cb -0.16 -0.91 -0.09 0.00 0.00 0.00 0.00 36.38 35.21 3i26 s VAL 197 CO 0.12 0.32 0.87 -2.16 0.00 0.00 0.00 175.10 174.25 3i26 s PRO 198 N 0.45 4.48 -0.19 2.72 0.04 -1.26 0.17 135.00 141.40 3i26 s PRO 198 Ca -0.09 1.18 -0.00 0.00 0.04 0.00 0.00 61.00 62.13 3i26 s PRO 198 Cb -0.13 -2.83 0.05 0.00 0.04 0.00 0.00 34.50 31.63 3i26 s PRO 198 CO 0.02 0.32 -0.06 0.12 0.04 0.00 0.00 177.00 177.44 3i26 s PHE 199 N -1.58 2.00 0.14 0.56 5.36 0.30 -4.66 117.98 120.11 3i26 s PHE 199 Ca 0.48 -1.36 0.08 0.00 -0.96 0.00 0.00 56.93 55.17 3i26 s PHE 199 Cb -0.18 -1.44 -0.04 0.00 -0.34 0.00 0.00 43.02 41.02 3i26 s PHE 199 CO 0.23 -0.69 -0.19 0.00 -1.46 0.00 0.00 175.22 173.11 3i26 s TYR 201 N -1.65 -0.19 -0.33 0.00 -0.85 -0.56 -4.95 117.35 108.82 3i26 s TYR 201 Ca 0.11 -0.14 -0.16 0.00 -0.52 0.00 0.00 57.07 56.36 3i26 s TYR 201 Cb -0.08 0.47 -0.01 0.00 0.38 0.00 0.00 41.96 42.72 3i26 s TYR 201 CO 0.05 -0.96 0.43 -0.51 -1.52 0.00 0.00 175.55 173.04 3i26 s LEU 202 N -2.86 4.33 0.00 -3.49 1.43 -1.26 -1.42 118.68 115.41 3i26 s LEU 202 Ca 0.08 -0.06 -0.00 0.00 -1.03 0.00 0.00 54.13 53.12 3i26 s LEU 202 Cb -0.02 -2.46 0.03 0.00 0.03 0.00 0.00 46.19 43.77 3i26 s LEU 202 CO -0.03 -0.37 0.17 -0.46 0.23 0.00 0.00 176.35 175.89 3i26 n ASN 203 N 5.52 0.19 -2.83 2.29 6.94 -0.05 -4.83 115.26 122.49 3i26 n ASN 203 Ca -0.07 -1.17 -0.09 0.00 -0.02 0.00 0.00 54.58 53.23 3i26 n ASN 203 Cb 0.49 -0.11 0.04 0.00 -2.36 0.00 0.00 39.78 37.84 3i26 n ASN 203 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 3i26 n HIS 204 N -1.72 -2.04 -0.37 -2.53 8.25 -1.26 -3.82 115.22 111.73 3i26 n HIS 204 Ca 0.03 0.73 0.00 0.00 -0.26 0.00 0.00 57.72 58.22 3i26 n HIS 204 Cb 0.10 -3.72 0.00 0.00 1.12 0.00 0.00 29.99 27.49 3i26 n HIS 204 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i26 n GLY 205 N -1.37 -3.17 3.75 -1.41 0.00 -1.26 -4.72 105.19 97.00 3i26 n GLY 205 Ca -0.04 -1.88 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 3i26 n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i26 s PHE 207 N -1.80 3.15 -0.12 0.00 5.36 0.22 -4.78 117.98 120.01 3i26 s PHE 207 Ca 0.75 -1.05 -0.29 0.00 -0.96 0.00 0.00 56.93 55.38 3i26 s PHE 207 Cb -0.29 -2.24 -0.02 0.00 -0.34 0.00 0.00 43.02 40.12 3i26 s PHE 207 CO 0.38 -0.60 1.31 0.99 -1.46 0.00 0.00 175.22 175.84 3i26 s THR 208 N 1.48 4.16 -0.28 0.12 2.01 -1.26 -1.31 115.64 120.56 3i26 s THR 208 Ca 0.02 1.42 -0.23 0.00 0.31 0.00 0.00 61.69 63.22 3i26 s THR 208 Cb -0.17 -3.92 0.10 0.00 0.01 0.00 0.00 72.50 68.52 3i26 s THR 208 CO 0.02 -0.10 0.89 0.28 -0.69 0.00 0.00 174.62 175.03 3i26 s THR 209 N 3.26 0.00 -1.12 -0.82 -1.32 -0.98 -4.93 115.64 109.74 3i26 s THR 209 Ca 0.58 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.06 3i26 s THR 209 Cb -0.24 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.75 3i26 s THR 209 CO 0.18 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.20 3i26 n GLY 210 N 2.78 0.84 1.43 6.08 0.00 -1.26 -3.66 105.19 111.40 3i26 n GLY 210 Ca -0.14 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.39 3i26 n GLY 210 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i26 n GLY 211 N -1.43 0.76 3.18 -0.02 0.00 -1.26 -5.04 105.19 101.38 3i26 n GLY 211 Ca -0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 3i26 n GLY 211 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i26 s SER 212 N -2.64 -0.02 -0.66 1.61 1.04 -1.24 -5.12 113.70 106.67 3i26 s SER 212 Ca 0.00 -0.25 -0.24 0.00 0.48 0.00 0.00 55.95 55.94 3i26 s SER 212 Cb 0.00 0.28 0.05 0.00 0.10 0.00 0.00 66.02 66.46 3i26 s SER 212 CO 0.00 -0.51 1.05 0.00 0.98 0.00 0.00 173.24 174.75 3i26 s LEU 214 N 4.50 4.55 0.33 0.00 1.43 -0.42 -4.69 118.68 124.37 3i26 s LEU 214 Ca 0.27 1.50 -0.29 0.00 -1.03 0.00 0.00 54.13 54.58 3i26 s LEU 214 Cb -0.14 -3.17 -0.11 0.00 0.03 0.00 0.00 46.19 42.81 3i26 s LEU 214 CO 0.13 0.19 1.42 -2.84 0.23 0.00 0.00 176.35 175.48 3i26 s PRO 215 N -0.91 4.23 -0.40 1.29 0.02 -1.26 0.71 135.00 138.67 3i26 s PRO 215 Ca 0.34 2.39 -0.18 0.00 0.02 0.00 0.00 61.00 63.57 3i26 s PRO 215 Cb -0.22 -3.04 0.01 0.00 0.02 0.00 0.00 34.50 31.28 3i26 s PRO 215 CO 0.24 -0.39 0.52 0.12 -0.33 0.00 0.00 177.00 177.15 3i26 s PHE 216 N -0.83 3.14 -0.17 6.54 5.36 -0.60 -4.81 117.98 126.60 3i26 s PHE 216 Ca 0.53 -0.11 -0.04 0.00 -0.96 0.00 0.00 56.93 56.35 3i26 s PHE 216 Cb -0.43 -3.03 0.08 0.00 -0.34 0.00 0.00 43.02 39.30 3i26 s PHE 216 CO 0.54 -0.69 0.22 0.20 -1.46 0.00 0.00 175.22 174.03 3i26 s GLY 217 N 1.85 -0.00 0.06 13.12 0.00 -1.26 -1.50 107.32 119.59 3i26 s GLY 217 Ca 0.17 0.40 0.00 0.00 0.00 0.00 0.00 44.72 45.29 3i26 s GLY 217 CO 0.15 2.05 -0.05 -1.34 0.00 0.00 0.00 173.10 173.91 3i26 s VAL 218 N 2.33 0.41 -0.05 1.40 -7.23 -0.48 -2.03 120.40 114.75 3i26 s VAL 218 Ca 0.05 -1.66 -0.30 0.00 -1.81 0.00 0.00 61.98 58.27 3i26 s VAL 218 Cb -0.15 -1.32 0.07 0.00 0.56 0.00 0.00 36.38 35.54 3i26 s VAL 218 CO -0.11 -0.82 0.65 -0.94 -0.31 0.00 0.00 175.10 173.57 3i26 s SER 219 N -2.63 -0.62 -0.19 4.85 1.04 -0.65 -0.64 113.70 114.86 3i26 s SER 219 Ca 0.04 0.67 -0.07 0.00 0.48 0.00 0.00 55.95 57.06 3i26 s SER 219 Cb 0.03 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 3i26 s SER 219 CO -0.06 -0.60 0.07 -0.31 0.98 0.00 0.00 173.24 173.32 3i26 s TYR 220 N -1.20 3.23 0.01 5.02 2.02 0.79 -0.95 117.35 126.27 3i26 s TYR 220 Ca -0.11 0.03 -0.02 0.00 -0.37 0.00 0.00 57.07 56.60 3i26 s TYR 220 Cb -0.00 -2.10 -0.01 0.00 -0.40 0.00 0.00 41.96 39.45 3i26 s TYR 220 CO 0.09 0.10 0.03 0.08 -1.57 0.00 0.00 175.55 174.28 3i26 s VAL 221 N 0.51 0.08 0.23 0.71 1.01 -0.78 -1.49 120.40 120.67 3i26 s VAL 221 Ca 0.03 -0.66 -0.22 0.00 0.00 0.00 0.00 61.98 61.13 3i26 s VAL 221 Cb -0.13 -0.26 0.06 0.00 0.00 0.00 0.00 36.38 36.05 3i26 s VAL 221 CO 0.01 -0.36 0.93 -0.94 0.00 0.00 0.00 175.10 174.73 3i26 s SER 222 N -1.12 -0.08 0.33 3.32 1.04 0.09 -1.17 113.70 116.10 3i26 s SER 222 Ca -0.12 -0.68 0.10 0.00 0.48 0.00 0.00 55.95 55.73 3i26 s SER 222 Cb -0.07 0.60 0.91 0.00 0.10 0.00 0.00 66.02 67.55 3i26 s SER 222 CO -0.00 -1.15 1.73 0.44 0.98 0.00 0.00 173.24 175.24 3i26 h ASP 223 N 2.00 0.66 0.00 7.02 5.19 -2.02 -2.83 116.42 126.44 3i26 h ASP 223 Ca -0.27 0.13 -0.10 0.00 -0.62 0.00 0.00 57.03 56.18 3i26 h ASP 223 Cb 1.23 0.03 -0.02 0.00 0.18 0.00 0.00 39.33 40.75 3i26 h ASP 223 CO 0.32 0.10 -1.98 -1.54 -3.12 0.00 0.00 179.24 173.02 3i26 n SER 224 N -4.86 0.58 -4.36 6.45 3.41 -1.26 -5.02 113.62 108.57 3i26 n SER 224 Ca 0.27 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.56 3i26 n SER 224 Cb 0.76 1.61 -0.15 0.00 -0.26 0.00 0.00 64.21 66.16 3i26 n SER 224 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3i26 s PHE 225 N -3.07 2.52 -0.05 7.33 5.36 -1.07 -5.12 117.98 123.88 3i26 s PHE 225 Ca -0.08 -0.44 -0.02 0.00 -0.96 0.00 0.00 56.93 55.44 3i26 s PHE 225 Cb 0.10 -1.59 0.04 0.00 -0.34 0.00 0.00 43.02 41.22 3i26 s PHE 225 CO 0.78 -0.02 0.10 -0.47 -1.46 0.00 0.00 175.22 174.14 3i26 s TYR 226 N -0.46 -0.07 -0.02 10.12 5.04 -1.26 -0.73 117.35 129.97 3i26 s TYR 226 Ca 0.05 0.35 -0.02 0.00 -2.44 0.00 0.00 57.07 55.02 3i26 s TYR 226 Cb -0.12 -0.23 0.01 0.00 0.35 0.00 0.00 41.96 41.98 3i26 s TYR 226 CO 0.01 -0.16 0.06 -0.47 -1.34 0.00 0.00 175.55 173.65 3i26 s TYR 227 N 1.48 -0.06 0.24 4.97 5.04 -0.56 -5.02 117.35 123.45 3i26 s TYR 227 Ca -0.05 0.17 -0.22 0.00 -2.44 0.00 0.00 57.07 54.52 3i26 s TYR 227 Cb -0.12 -0.02 0.03 0.00 0.35 0.00 0.00 41.96 42.21 3i26 s TYR 227 CO -0.04 -0.04 0.79 0.20 -1.34 0.00 0.00 175.55 175.11 3i26 s GLY 228 N 0.22 -0.12 -0.09 8.97 0.00 -1.26 -0.15 107.32 114.89 3i26 s GLY 228 Ca -0.02 -0.19 -0.09 0.00 0.00 0.00 0.00 44.72 44.42 3i26 s GLY 228 CO -0.01 -0.05 0.25 -0.47 0.00 0.00 0.00 173.10 172.82 3i26 s TYR 229 N -3.69 -0.27 -0.14 1.90 5.04 0.19 -4.99 117.35 115.39 3i26 s TYR 229 Ca 0.12 0.67 -0.10 0.00 -2.44 0.00 0.00 57.07 55.31 3i26 s TYR 229 Cb -0.05 0.09 0.04 0.00 0.35 0.00 0.00 41.96 42.40 3i26 s TYR 229 CO 0.06 -0.14 0.34 -0.47 -1.34 0.00 0.00 175.55 174.00 3i26 s TYR 230 N 0.10 -0.43 -0.25 4.97 5.04 -1.26 -1.39 117.35 124.13 3i26 s TYR 230 Ca -0.00 0.99 -0.11 0.00 -2.44 0.00 0.00 57.07 55.52 3i26 s TYR 230 Cb -0.02 0.15 0.10 0.00 0.35 0.00 0.00 41.96 42.54 3i26 s TYR 230 CO 0.00 -0.24 0.57 0.34 -1.34 0.00 0.00 175.55 174.89 3i26 s ASP 231 N 0.72 -0.80 -0.09 4.32 -1.08 -0.56 -5.00 116.67 114.17 3i26 s ASP 231 Ca -0.04 1.34 0.14 0.00 -0.52 0.00 0.00 52.55 53.46 3i26 s ASP 231 Cb -0.06 1.67 0.21 0.00 -1.46 0.00 0.00 42.92 43.28 3i26 s ASP 231 CO -0.05 -0.22 1.10 0.00 0.52 0.00 0.00 175.17 176.52 3i26 n ALA 232 N 5.03 2.18 -2.43 3.66 0.00 -1.26 -1.56 120.51 126.12 3i26 n ALA 232 Ca -0.14 -2.18 -0.42 0.00 0.00 0.00 0.00 53.44 50.69 3i26 n ALA 232 Cb 0.52 -0.29 -0.03 0.00 0.00 0.00 0.00 19.45 19.65 3i26 n ALA 232 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3i26 s THR 233 N -2.33 4.23 0.19 0.00 2.01 -1.26 -4.49 115.64 113.99 3i26 s THR 233 Ca 0.23 1.54 -0.20 0.00 0.31 0.00 0.00 61.69 63.57 3i26 s THR 233 Cb 0.20 -3.99 -0.08 0.00 0.01 0.00 0.00 72.50 68.64 3i26 s THR 233 CO 0.02 -0.05 0.70 -2.16 -0.69 0.00 0.00 174.62 172.45 3i26 s PRO 234 N 2.68 4.28 -0.09 4.92 0.04 -1.26 -1.52 135.00 144.05 3i26 s PRO 234 Ca 0.56 0.88 -0.09 0.00 0.04 0.00 0.00 61.00 62.39 3i26 s PRO 234 Cb -0.24 -2.99 0.02 0.00 0.04 0.00 0.00 34.50 31.33 3i26 s PRO 234 CO 0.20 0.46 0.24 -2.00 0.04 0.00 0.00 177.00 175.94 3i26 s GLU 240 N -1.73 0.29 -0.16 4.56 2.12 -1.26 -4.96 118.70 117.57 3i26 s GLU 240 Ca 0.40 0.33 -0.11 0.00 0.36 0.00 0.00 54.97 55.94 3i26 s GLU 240 Cb -0.18 0.14 0.05 0.00 0.26 0.00 0.00 34.13 34.40 3i26 s GLU 240 CO 0.22 -0.04 0.41 0.45 -0.54 0.00 0.00 175.26 175.76 3i26 s SER 241 N 0.10 -0.48 -0.02 -1.70 0.15 -1.26 -5.16 113.70 105.33 3i26 s SER 241 Ca -0.00 0.86 0.01 0.00 0.70 0.00 0.00 55.95 57.52 3i26 s SER 241 Cb -0.02 0.80 0.01 0.00 -1.71 0.00 0.00 66.02 65.10 3i26 s SER 241 CO 0.00 -0.17 -0.04 -1.00 1.20 0.00 0.00 173.24 173.23 3i26 s HIS 242 N 0.89 0.50 -0.13 3.44 3.76 -1.26 -4.64 115.29 117.86 3i26 s HIS 242 Ca -0.05 -0.10 -0.10 0.00 -0.15 0.00 0.00 55.06 54.66 3i26 s HIS 242 Cb -0.06 -0.42 -0.05 0.00 1.11 0.00 0.00 32.58 33.17 3i26 s HIS 242 CO -0.07 -0.08 0.20 -0.51 -0.85 0.00 0.00 174.74 173.43 3i26 s ASP 243 N 0.39 6.41 -0.51 1.40 1.01 -1.25 -1.80 116.67 122.33 3i26 s ASP 243 Ca -0.04 0.49 -0.28 0.00 0.71 0.00 0.00 52.55 53.42 3i26 s ASP 243 Cb -0.08 -2.12 0.02 0.00 1.01 0.00 0.00 42.92 41.75 3i26 s ASP 243 CO -0.00 0.29 1.28 -0.47 0.21 0.00 0.00 175.17 176.48 3i26 s TYR 244 N -0.47 2.54 0.05 4.23 5.04 -1.26 -0.87 117.35 126.61 3i26 s TYR 244 Ca 0.15 0.58 0.08 0.00 -2.44 0.00 0.00 57.07 55.43 3i26 s TYR 244 Cb -0.13 -4.42 -0.03 0.00 0.35 0.00 0.00 41.96 37.73 3i26 s TYR 244 CO 0.04 -1.68 -0.19 0.08 -1.34 0.00 0.00 175.55 172.46 3i26 s VAL 245 N 5.18 2.69 0.06 3.14 1.01 -0.51 -4.88 120.40 127.08 3i26 s VAL 245 Ca 0.51 -1.24 0.04 0.00 0.00 0.00 0.00 61.98 61.30 3i26 s VAL 245 Cb -0.09 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 3i26 s VAL 245 CO 0.29 0.33 -0.13 0.00 0.00 0.00 0.00 175.10 175.59 3i26 s ASP 247 N -1.56 3.68 -0.28 0.00 1.01 -0.22 -4.94 116.67 114.37 3i26 s ASP 247 Ca -0.03 -0.55 -0.06 0.00 0.71 0.00 0.00 52.55 52.62 3i26 s ASP 247 Cb -0.09 -0.49 0.00 0.00 1.01 0.00 0.00 42.92 43.35 3i26 s ASP 247 CO 0.02 0.21 0.06 -0.31 0.21 0.00 0.00 175.17 175.36 3i26 s TYR 248 N -1.02 3.12 -0.11 4.23 1.51 -1.26 -0.53 117.35 123.28 3i26 s TYR 248 Ca 0.15 -0.96 -0.03 0.00 -1.01 0.00 0.00 57.07 55.23 3i26 s TYR 248 Cb -0.10 -2.23 -0.03 0.00 -0.11 0.00 0.00 41.96 39.49 3i26 s TYR 248 CO 0.07 -0.56 -0.01 -0.51 -1.11 0.00 0.00 175.55 173.43 3i26 s LEU 249 N 1.50 3.47 -0.20 -1.29 1.43 0.13 -4.88 118.68 118.83 3i26 s LEU 249 Ca 0.03 0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 52.88 3i26 s LEU 249 Cb -0.17 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 3i26 s LEU 249 CO 0.02 0.30 1.36 0.12 0.23 0.00 0.00 176.35 178.37 3i26 s PHE 250 N -0.38 2.61 -0.04 0.29 5.36 -1.26 -1.09 117.98 123.46 3i26 s PHE 250 Ca 0.07 0.82 0.03 0.00 -0.96 0.00 0.00 56.93 56.89 3i26 s PHE 250 Cb -0.12 -3.73 0.01 0.00 -0.34 0.00 0.00 43.02 38.83 3i26 s PHE 250 CO 0.02 -2.08 -0.11 -1.64 -1.46 0.00 0.00 175.22 169.95 3i26 s MET 251 N 3.92 1.32 0.65 10.12 -1.94 -0.29 -4.98 119.30 128.10 3i26 s MET 251 Ca 0.59 -0.37 -0.15 0.00 -1.71 0.00 0.00 55.69 54.05 3i26 s MET 251 Cb -0.22 -1.17 -0.00 0.00 2.01 0.00 0.00 34.83 35.45 3i26 s MET 251 CO 0.21 0.09 1.12 -1.21 -0.01 0.00 0.00 175.02 175.22 3i26 s GLU 252 N 0.38 2.80 0.48 2.03 2.02 -1.26 -0.36 118.70 124.80 3i26 s GLU 252 Ca -0.08 1.45 -0.24 0.00 0.02 0.00 0.00 54.97 56.12 3i26 s GLU 252 Cb -0.12 -1.95 -0.07 0.00 0.10 0.00 0.00 34.13 32.10 3i26 s GLU 252 CO 0.02 -1.26 1.36 -1.25 0.02 0.00 0.00 175.26 174.15 3i26 s PRO 253 N -3.99 3.51 0.00 0.39 0.04 -1.26 -4.82 135.00 128.87 3i26 s PRO 253 Ca 0.68 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.98 3i26 s PRO 253 Cb -0.22 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.84 3i26 s PRO 253 CO 0.40 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.95 3i26 n GLY 254 N 0.64 -2.23 3.59 0.56 0.00 0.61 -4.98 105.19 103.38 3i26 n GLY 254 Ca 0.07 -1.37 -0.38 0.00 0.00 0.00 0.00 46.02 44.34 3i26 n GLY 254 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i26 s THR 255 N -2.14 5.28 0.17 2.61 2.01 -1.26 -0.04 115.64 122.28 3i26 s THR 255 Ca 0.00 0.22 0.11 0.00 0.31 0.00 0.00 61.69 62.33 3i26 s THR 255 Cb 0.00 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 3i26 s THR 255 CO 0.00 0.22 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.60 3i26 s TYR 256 N 1.81 2.21 -0.14 4.92 2.02 -0.40 -4.90 117.35 122.87 3i26 s TYR 256 Ca 0.08 -0.38 -0.13 0.00 -0.37 0.00 0.00 57.07 56.27 3i26 s TYR 256 Cb -0.16 -1.13 -0.05 0.00 -0.40 0.00 0.00 41.96 40.23 3i26 s TYR 256 CO 0.11 0.42 0.27 -0.80 -1.57 0.00 0.00 175.55 173.98 3i26 s ASN 257 N -2.48 6.45 -0.56 2.29 0.01 -0.32 -0.52 114.94 119.81 3i26 s ASN 257 Ca 0.18 0.52 -0.18 0.00 -0.71 0.00 0.00 52.86 52.67 3i26 s ASN 257 Cb -0.08 -2.17 0.10 0.00 0.41 0.00 0.00 41.25 39.51 3i26 s ASN 257 CO 0.08 0.16 0.62 0.00 -1.51 0.00 0.00 177.10 176.45 3i26 s ALA 258 N 0.14 3.48 0.11 0.60 0.00 0.16 -1.87 121.76 124.39 3i26 s ALA 258 Ca 0.16 -2.24 0.03 0.00 0.00 0.00 0.00 51.96 49.91 3i26 s ALA 258 Cb -0.13 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 3i26 s ALA 258 CO 0.04 -2.18 0.14 -1.12 0.00 0.00 0.00 175.76 172.64 3i26 s SER 259 N 3.43 5.74 0.07 0.00 0.01 -0.13 -2.67 113.70 120.14 3i26 s SER 259 Ca 0.09 0.02 0.01 0.00 1.31 0.00 0.00 55.95 57.38 3i26 s SER 259 Cb -0.25 -1.59 -0.03 0.00 0.21 0.00 0.00 66.02 64.36 3i26 s SER 259 CO 0.06 0.13 -0.06 0.28 0.41 0.00 0.00 173.24 174.06 3i26 s THR 260 N -1.55 0.50 -0.57 1.44 -1.32 -0.84 -1.64 115.64 111.67 3i26 s THR 260 Ca 0.31 -1.59 0.26 0.00 -1.21 0.00 0.00 61.69 59.45 3i26 s THR 260 Cb -0.12 -1.24 0.30 0.00 -1.51 0.00 0.00 72.50 69.93 3i26 s THR 260 CO 0.24 -0.74 1.75 -0.37 -2.21 0.00 0.00 174.62 173.29 3i26 h VAL 261 N 3.55 0.00 0.00 5.08 -1.51 -1.71 -2.66 116.25 119.00 3i26 h VAL 261 Ca -0.35 -0.53 0.00 0.00 -1.23 0.00 0.00 66.70 64.59 3i26 h VAL 261 Cb 1.17 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 31.81 3i26 h VAL 261 CO 0.57 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.52 3i26 n GLY 262 N 0.92 3.94 5.08 5.19 0.00 -1.26 -2.35 105.19 116.72 3i26 n GLY 262 Ca 0.04 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.80 3i26 n GLY 262 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3i26 n LYS 263 N -1.61 0.00 -3.04 1.61 3.00 -1.09 -4.84 118.16 112.18 3i26 n LYS 263 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 57.91 3i26 n LYS 263 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 34.98 3i26 n LYS 263 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 3i26 s PHE 264 N 0.00 3.75 -0.10 5.64 0.40 -1.26 0.27 117.98 126.68 3i26 s PHE 264 Ca 0.00 1.43 0.03 0.00 -0.60 0.00 0.00 56.93 57.79 3i26 s PHE 264 Cb 0.00 -2.76 0.01 0.00 0.51 0.00 0.00 43.02 40.78 3i26 s PHE 264 CO 0.00 0.33 -0.18 -1.17 0.70 0.00 0.00 175.22 174.90 3i26 s LEU 265 N -0.27 1.87 -0.19 -0.37 2.96 -0.31 -4.68 118.68 117.69 3i26 s LEU 265 Ca 0.36 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 3i26 s LEU 265 Cb -0.20 -1.18 0.05 0.00 0.50 0.00 0.00 46.19 45.36 3i26 s LEU 265 CO 0.22 0.07 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.57 3i26 s VAL 266 N 0.68 1.33 0.04 1.68 1.01 -1.26 -1.09 120.40 122.79 3i26 s VAL 266 Ca -0.12 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.02 3i26 s VAL 266 Cb -0.16 -1.50 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 3i26 s VAL 266 CO 0.03 0.08 -0.08 -0.72 0.00 0.00 0.00 175.10 174.41 3i26 s TYR 267 N 1.52 0.68 0.27 5.22 -0.85 -0.93 -4.74 117.35 118.52 3i26 s TYR 267 Ca -0.01 -0.48 -0.29 0.00 -0.52 0.00 0.00 57.07 55.77 3i26 s TYR 267 Cb -0.16 -0.41 -0.09 0.00 0.38 0.00 0.00 41.96 41.68 3i26 s TYR 267 CO -0.08 -0.08 0.98 -1.25 -1.52 0.00 0.00 175.55 173.61 3i26 s PRO 268 N -1.51 4.74 0.00 -3.49 0.04 -1.26 0.20 135.00 133.72 3i26 s PRO 268 Ca -0.09 1.53 0.05 0.00 0.04 0.00 0.00 61.00 62.53 3i26 s PRO 268 Cb -0.10 -3.15 -0.03 0.00 0.04 0.00 0.00 34.50 31.26 3i26 s PRO 268 CO 0.00 0.39 0.33 0.25 0.04 0.00 0.00 177.00 178.01 3i26 n THR 269 N 1.20 0.00 -3.89 1.26 -2.24 -1.26 -4.86 114.28 104.49 3i26 n THR 269 Ca -0.01 -0.40 -0.11 0.00 -2.27 0.00 0.00 64.05 61.26 3i26 n THR 269 Cb 0.47 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.63 3i26 n THR 269 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3i26 s LYS 270 N -1.29 0.51 0.05 -0.78 1.02 -1.26 -0.48 119.74 117.52 3i26 s LYS 270 Ca 0.03 -0.50 -0.21 0.00 0.02 0.00 0.00 55.97 55.32 3i26 s LYS 270 Cb 0.04 0.21 0.05 0.00 -0.52 0.00 0.00 37.83 37.61 3i26 s LYS 270 CO 0.19 -0.12 0.48 -1.54 -0.92 0.00 0.00 175.35 173.43 3i26 s SER 271 N -1.59 -0.38 -0.49 2.83 1.04 -1.05 -4.67 113.70 109.39 3i26 s SER 271 Ca -0.12 0.09 -0.24 0.00 0.48 0.00 0.00 55.95 56.16 3i26 s SER 271 Cb -0.06 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.56 3i26 s SER 271 CO -0.00 -0.71 0.87 -0.31 0.98 0.00 0.00 173.24 174.07 3i26 s TYR 272 N -2.54 2.90 0.04 5.02 1.51 -0.81 -1.20 117.35 122.28 3i26 s TYR 272 Ca -0.05 0.11 -0.30 0.00 -1.01 0.00 0.00 57.07 55.82 3i26 s TYR 272 Cb -0.01 -3.89 -0.04 0.00 -0.11 0.00 0.00 41.96 37.91 3i26 s TYR 272 CO -0.03 -1.16 0.97 0.00 -1.11 0.00 0.00 175.55 174.22 3i26 s MET 274 N 0.63 0.30 0.00 0.00 -1.94 -0.19 -0.78 119.30 117.32 3i26 s MET 274 Ca 0.50 -0.15 0.00 0.00 -1.71 0.00 0.00 55.69 54.33 3i26 s MET 274 Cb -0.22 -0.28 0.00 0.00 2.01 0.00 0.00 34.83 36.34 3i26 s MET 274 CO 0.29 0.08 0.00 -0.40 -0.01 0.00 0.00 175.02 174.97 3i26 n ASP 275 N 2.94 0.00 -4.00 3.03 5.68 -0.93 -0.46 116.55 122.82 3i26 n ASP 275 Ca -0.13 -0.46 -0.18 0.00 -0.50 0.00 0.00 54.79 53.52 3i26 n ASP 275 Cb 0.59 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 40.42 3i26 n ASP 275 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3i26 s THR 276 N 0.20 0.65 0.26 2.12 2.01 -1.26 -4.38 115.64 115.25 3i26 s THR 276 Ca 0.00 -0.33 0.11 0.00 0.31 0.00 0.00 61.69 61.78 3i26 s THR 276 Cb 0.00 -0.56 -0.05 0.00 0.01 0.00 0.00 72.50 71.90 3i26 s THR 276 CO 0.00 0.19 -0.16 0.00 -0.69 0.00 0.00 174.62 173.96 3i26 s MET 277 N -0.05 1.80 0.00 4.92 0.23 -0.82 -4.74 119.30 120.65 3i26 s MET 277 Ca 0.01 -1.63 0.29 0.00 -1.03 0.00 0.00 55.69 53.32 3i26 s MET 277 Cb -0.05 -1.88 1.18 0.00 -1.53 0.00 0.00 34.83 32.55 3i26 s MET 277 CO -0.00 0.35 1.85 0.09 -2.03 0.00 0.00 175.02 175.28 3i26 n ASN 278 N -0.50 0.27 -4.13 -1.18 3.02 -1.26 -4.72 115.26 106.75 3i26 n ASN 278 Ca -0.07 -0.18 -0.28 0.00 -0.03 0.00 0.00 54.58 54.02 3i26 n ASN 278 Cb 0.59 -0.17 -0.17 0.00 -0.61 0.00 0.00 39.78 39.42 3i26 n ASN 278 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3i26 s ILE 279 N -2.70 1.61 -0.17 2.41 -4.36 -1.26 -5.11 121.20 111.62 3i26 s ILE 279 Ca 0.23 -0.77 -0.27 0.00 -0.26 0.00 0.00 60.65 59.58 3i26 s ILE 279 Cb 0.19 -1.41 -0.01 0.00 1.25 0.00 0.00 42.46 42.48 3i26 s ILE 279 CO 0.52 0.46 0.91 -0.89 0.24 0.00 0.00 174.94 176.18 3i26 s THR 280 N 0.41 4.82 -0.12 8.37 2.01 -1.26 -4.75 115.64 125.12 3i26 s THR 280 Ca -0.15 1.81 0.00 0.00 0.31 0.00 0.00 61.69 63.66 3i26 s THR 280 Cb -0.16 -4.21 0.02 0.00 0.01 0.00 0.00 72.50 68.16 3i26 s THR 280 CO 0.06 -0.02 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.18 3i26 s VAL 281 N 2.36 1.17 0.45 3.82 1.01 -0.43 -5.02 120.40 123.77 3i26 s VAL 281 Ca 0.42 -0.39 -0.25 0.00 0.00 0.00 0.00 61.98 61.75 3i26 s VAL 281 Cb -0.17 -1.15 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 3i26 s VAL 281 CO 0.12 0.39 1.40 -2.16 0.00 0.00 0.00 175.10 174.85 3i26 s PRO 282 N 1.55 3.67 0.81 2.72 0.04 -1.26 -4.34 135.00 138.20 3i26 s PRO 282 Ca 0.03 2.36 -0.12 0.00 0.04 0.00 0.00 61.00 63.31 3i26 s PRO 282 Cb -0.13 -2.63 0.09 0.00 0.04 0.00 0.00 34.50 31.88 3i26 s PRO 282 CO -0.08 -0.80 1.17 0.14 0.04 0.00 0.00 177.00 177.47 3i26 s VAL 283 N -1.22 2.04 -0.06 -0.36 -7.23 -0.79 -4.73 120.40 108.05 3i26 s VAL 283 Ca 0.61 -0.05 0.04 0.00 -1.81 0.00 0.00 61.98 60.78 3i26 s VAL 283 Cb -0.42 -2.99 -0.00 0.00 0.56 0.00 0.00 36.38 33.52 3i26 s VAL 283 CO 0.54 0.00 -0.20 -1.10 -0.31 0.00 0.00 175.10 174.03 3i26 s GLN 284 N -5.57 2.21 -0.04 4.82 -0.21 -0.05 0.00 119.66 120.83 3i26 s GLN 284 Ca 0.63 -0.71 0.05 0.00 0.02 0.00 0.00 55.36 55.36 3i26 s GLN 284 Cb -0.10 -1.83 -0.01 0.00 1.00 0.00 0.00 33.01 32.08 3i26 s GLN 284 CO 0.49 0.24 -0.19 0.00 -2.12 0.00 0.00 175.29 173.70 3i26 s ALA 285 N 0.13 1.66 -0.14 6.09 0.00 0.30 0.36 121.76 130.17 3i26 s ALA 285 Ca -0.08 -0.79 -0.04 0.00 0.00 0.00 0.00 51.96 51.05 3i26 s ALA 285 Cb -0.14 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.43 3i26 s ALA 285 CO 0.04 0.33 -0.01 0.08 0.00 0.00 0.00 175.76 176.20 3i26 s VAL 286 N -0.10 4.17 0.18 0.00 1.01 -0.25 0.32 120.40 125.73 3i26 s VAL 286 Ca -0.01 -0.27 -0.32 0.00 0.00 0.00 0.00 61.98 61.37 3i26 s VAL 286 Cb -0.11 -2.82 -0.16 0.00 0.00 0.00 0.00 36.38 33.29 3i26 s VAL 286 CO 0.02 0.52 1.09 1.67 0.00 0.00 0.00 175.10 178.40 3i26 n GLN 287 N 3.15 1.03 -3.78 2.72 -0.06 -0.53 -4.65 117.38 115.26 3i26 n GLN 287 Ca -0.17 0.37 -0.30 0.00 -2.00 0.00 0.00 57.00 54.89 3i26 n GLN 287 Cb 0.53 -1.81 -0.15 0.00 -4.06 0.00 0.00 30.24 24.74 3i26 n GLN 287 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 3i26 s SER 288 N -0.14 4.13 0.27 1.69 0.15 -1.26 -4.89 113.70 113.66 3i26 s SER 288 Ca 0.72 -1.77 0.02 0.00 0.70 0.00 0.00 55.95 55.62 3i26 s SER 288 Cb -0.86 -1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 62.41 3i26 s SER 288 CO 0.54 -0.40 0.16 0.27 1.20 0.00 0.00 173.24 175.00 3i26 s ILE 289 N 1.44 0.22 0.48 6.45 -4.36 -1.26 -3.94 121.20 120.24 3i26 s ILE 289 Ca 0.10 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.50 3i26 s ILE 289 Cb -0.18 -2.53 0.01 0.00 1.25 0.00 0.00 42.46 41.01 3i26 s ILE 289 CO -0.21 0.00 0.71 0.26 0.24 0.00 0.00 174.94 175.94 3i26 s TRP 290 N -3.78 3.12 0.99 1.37 0.52 -1.26 -4.96 118.94 114.95 3i26 s TRP 290 Ca 0.38 0.18 -0.13 0.00 0.02 0.00 0.00 56.10 56.55 3i26 s TRP 290 Cb 0.06 -2.45 0.11 0.00 -1.15 0.00 0.00 33.47 30.04 3i26 s TRP 290 CO 0.16 -0.52 0.68 -1.13 0.02 0.00 0.00 176.95 176.16 3i26 n SER 291 N -2.17 -1.27 -0.01 2.95 3.41 -1.26 -4.45 113.62 110.82 3i26 n SER 291 Ca 0.03 0.24 0.22 0.00 -0.26 0.00 0.00 58.87 59.10 3i26 n SER 291 Cb 0.58 -1.27 0.71 0.00 -0.26 0.00 0.00 64.21 63.97 3i26 n SER 291 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3i26 h GLU 292 N -1.88 0.00 0.00 4.33 5.08 -1.95 -2.15 114.58 118.01 3i26 h GLU 292 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 3i26 h GLU 292 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 3i26 h GLU 292 CO 0.39 0.00 0.00 -0.56 -1.00 0.00 0.00 179.01 177.84 3i26 h GLN 293 N 0.00 0.00 -6.25 2.33 3.07 -1.98 -3.44 115.11 108.84 3i26 h GLN 293 Ca 0.27 0.00 -0.56 0.00 0.09 0.00 0.00 58.65 58.44 3i26 h GLN 293 Cb 1.13 0.00 -0.09 0.00 0.08 0.00 0.00 27.48 28.59 3i26 h GLN 293 CO -0.00 0.00 -0.63 0.71 0.09 0.00 0.00 178.83 178.99 3i26 s TYR 294 N -3.28 2.80 -0.25 0.06 1.51 -0.81 -5.10 117.35 112.27 3i26 s TYR 294 Ca 0.06 -0.18 -0.19 0.00 -1.01 0.00 0.00 57.07 55.76 3i26 s TYR 294 Cb 0.10 -1.28 -0.03 0.00 -0.11 0.00 0.00 41.96 40.64 3i26 s TYR 294 CO 0.52 0.57 0.54 0.00 -1.11 0.00 0.00 175.55 176.08 3i26 s ALA 295 N -2.11 3.59 0.47 3.71 0.00 -1.26 -4.78 121.76 121.38 3i26 s ALA 295 Ca 0.30 -0.53 0.04 0.00 0.00 0.00 0.00 51.96 51.77 3i26 s ALA 295 Cb -0.08 -2.92 0.04 0.00 0.00 0.00 0.00 23.12 20.17 3i26 s ALA 295 CO 0.20 -0.72 0.33 0.43 0.00 0.00 0.00 175.76 176.00 3i26 n SER 296 N 5.49 2.54 -3.39 0.00 7.64 -1.26 -2.08 113.62 122.56 3i26 n SER 296 Ca -0.03 -2.63 -0.21 0.00 1.01 0.00 0.00 58.87 57.01 3i26 n SER 296 Cb 0.50 -0.01 -0.07 0.00 -1.01 0.00 0.00 64.21 63.61 3i26 n SER 296 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3i26 n ASP 297 N -1.82 0.27 -1.65 6.43 5.75 -1.26 -4.62 116.55 119.65 3i26 n ASP 297 Ca -0.03 -3.03 -0.16 0.00 -0.01 0.00 0.00 54.79 51.56 3i26 n ASP 297 Cb 0.53 1.26 0.07 0.00 -1.03 0.00 0.00 41.12 41.95 3i26 n ASP 297 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 3i26 n ASP 298 N -1.67 4.09 -0.17 -1.12 2.03 -1.26 -4.83 116.55 113.61 3i26 n ASP 298 Ca 0.01 -3.79 -0.08 0.00 0.52 0.00 0.00 54.79 51.45 3i26 n ASP 298 Cb 0.57 -0.39 0.01 0.00 -0.72 0.00 0.00 41.12 40.58 3i26 n ASP 298 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3i26 h ALA 299 N 1.87 0.63 -0.05 -1.67 0.00 -1.97 -0.59 119.26 117.48 3i26 h ALA 299 Ca 0.27 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3i26 h ALA 299 Cb 1.40 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 3i26 h ALA 299 CO 0.56 0.25 0.02 0.82 0.00 0.00 0.00 179.25 180.90 3i26 h ILE 300 N 0.64 1.14 -0.41 0.00 1.08 -1.93 0.16 117.51 118.20 3i26 h ILE 300 Ca 0.16 -0.41 -0.00 0.00 -0.39 0.00 0.00 64.86 64.22 3i26 h ILE 300 Cb 0.21 1.33 -0.02 0.00 -3.07 0.00 0.00 36.82 35.27 3i26 h ILE 300 CO -0.01 0.11 0.23 1.23 -0.69 0.00 0.00 178.15 179.03 3i26 h GLY 301 N -0.08 0.59 1.94 5.37 0.00 -1.87 0.31 103.07 109.32 3i26 h GLY 301 Ca 0.02 -0.24 -0.22 0.00 0.00 0.00 0.00 47.33 46.89 3i26 h GLY 301 CO -0.00 0.23 -1.04 1.46 0.00 0.00 0.00 176.54 177.19 3i26 h GLN 302 N 0.56 0.02 0.07 4.80 1.08 -0.95 -3.32 115.11 117.37 3i26 h GLN 302 Ca 0.15 -0.03 -0.27 0.00 -1.45 0.00 0.00 58.65 57.05 3i26 h GLN 302 Cb -0.00 0.01 0.02 0.00 -0.05 0.00 0.00 27.48 27.46 3i26 h GLN 302 CO -0.03 1.00 -1.13 0.00 -0.95 0.00 0.00 178.83 177.72 3i26 h ALA 303 N 0.97 0.15 -1.34 3.87 0.00 -0.45 -3.42 119.26 119.04 3i26 h ALA 303 Ca -0.03 -0.76 -0.61 0.00 0.00 0.00 0.00 54.91 53.51 3i26 h ALA 303 Cb 1.79 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 19.52 3i26 h ALA 303 CO 0.13 0.78 1.24 0.00 0.00 0.00 0.00 179.25 181.40 3i26 s LYS 305 N 4.62 0.76 0.63 0.00 1.02 -1.25 -4.50 119.74 121.00 3i26 s LYS 305 Ca 0.40 -1.12 -0.19 0.00 0.02 0.00 0.00 55.97 55.08 3i26 s LYS 305 Cb -0.03 -0.33 -0.02 0.00 -0.52 0.00 0.00 37.83 36.93 3i26 s LYS 305 CO -0.04 0.03 1.31 0.00 -0.92 0.00 0.00 175.35 175.73 3i26 s ALA 306 N -2.65 2.46 -2.02 5.17 0.00 -1.24 -1.81 121.76 121.68 3i26 s ALA 306 Ca 0.04 1.26 0.18 0.00 0.00 0.00 0.00 51.96 53.44 3i26 s ALA 306 Cb -0.01 -3.56 0.52 0.00 0.00 0.00 0.00 23.12 20.06 3i26 s ALA 306 CO -0.02 -1.58 1.43 -0.35 0.00 0.00 0.00 175.76 175.25 3i26 n PRO 307 N -1.74 2.36 -0.00 0.00 -0.04 -1.26 -4.85 135.00 129.47 3i26 n PRO 307 Ca 0.15 -2.11 0.09 0.00 -0.04 0.00 0.00 63.50 61.59 3i26 n PRO 307 Cb 0.47 -1.46 -0.12 0.00 -0.04 0.00 0.00 33.50 32.36 3i26 n PRO 307 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3i26 n TYR 308 N 1.22 0.00 -3.78 0.54 0.18 -0.99 -4.64 117.16 109.69 3i26 n TYR 308 Ca 0.20 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.85 3i26 n TYR 308 Cb 0.50 -0.15 -0.13 0.00 -0.38 0.00 0.00 39.34 39.18 3i26 n TYR 308 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3i26 s ILE 310 N 0.51 5.00 -0.23 0.00 1.01 0.10 -3.66 121.20 123.94 3i26 s ILE 310 Ca -0.03 -0.52 -0.14 0.00 0.00 0.00 0.00 60.65 59.95 3i26 s ILE 310 Cb -0.05 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 3i26 s ILE 310 CO -0.03 -0.13 0.32 0.12 0.00 0.00 0.00 174.94 175.22 3i26 s PHE 311 N 1.65 3.33 -0.50 3.97 5.36 -1.26 -0.54 117.98 130.00 3i26 s PHE 311 Ca 0.05 0.46 -0.06 0.00 -0.96 0.00 0.00 56.93 56.42 3i26 s PHE 311 Cb -0.18 -2.46 0.13 0.00 -0.34 0.00 0.00 43.02 40.17 3i26 s PHE 311 CO 0.09 -0.04 0.33 0.71 -1.46 0.00 0.00 175.22 174.86 3i26 s TYR 312 N 1.40 3.50 0.82 10.12 2.02 0.15 -4.92 117.35 130.44 3i26 s TYR 312 Ca 0.15 -2.25 -0.12 0.00 -0.37 0.00 0.00 57.07 54.48 3i26 s TYR 312 Cb -0.15 -3.36 0.09 0.00 -0.40 0.00 0.00 41.96 38.14 3i26 s TYR 312 CO 0.07 -0.96 1.14 1.21 -1.57 0.00 0.00 175.55 175.44 3i26 s ASN 313 N 1.94 4.33 -0.11 2.29 3.84 -1.26 -1.46 114.94 124.51 3i26 s ASN 313 Ca 0.09 0.99 -0.12 0.00 0.21 0.00 0.00 52.86 54.04 3i26 s ASN 313 Cb -0.23 -1.61 -0.05 0.00 -0.55 0.00 0.00 41.25 38.81 3i26 s ASN 313 CO -0.03 -2.04 0.27 -0.54 -2.79 0.00 0.00 177.10 171.97 3i26 s LYS 314 N -5.37 3.95 -0.01 0.43 1.02 -1.26 -4.82 119.74 113.68 3i26 s LYS 314 Ca 0.62 0.09 0.16 0.00 0.02 0.00 0.00 55.97 56.86 3i26 s LYS 314 Cb -0.13 -3.31 -0.19 0.00 -0.52 0.00 0.00 37.83 33.68 3i26 s LYS 314 CO 0.52 0.50 0.63 0.25 -0.92 0.00 0.00 175.35 176.33 3i26 n THR 315 N 2.71 1.23 -3.38 2.17 -2.24 -1.26 -4.94 114.28 108.57 3i26 n THR 315 Ca -0.15 -0.73 -0.19 0.00 -2.27 0.00 0.00 64.05 60.71 3i26 n THR 315 Cb 0.53 -0.71 -0.01 0.00 -2.10 0.00 0.00 70.33 68.05 3i26 n THR 315 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3i26 s THR 316 N -2.82 3.51 0.98 4.28 -4.23 -1.26 -5.13 115.64 110.97 3i26 s THR 316 Ca -0.05 -1.09 -0.12 0.00 -1.18 0.00 0.00 61.69 59.26 3i26 s THR 316 Cb 0.08 -3.20 0.18 0.00 1.34 0.00 0.00 72.50 70.90 3i26 s THR 316 CO 0.82 -0.09 1.08 -2.84 -0.54 0.00 0.00 174.62 173.06 3i26 s PRO 317 N -4.20 0.54 -0.26 3.99 0.02 -1.26 -4.94 135.00 128.88 3i26 s PRO 317 Ca 0.48 0.72 -0.29 0.00 0.02 0.00 0.00 61.00 61.93 3i26 s PRO 317 Cb -0.08 -1.73 -0.03 0.00 0.02 0.00 0.00 34.50 32.67 3i26 s PRO 317 CO 0.31 -2.71 1.78 -0.47 -0.33 0.00 0.00 177.00 175.58 3i26 s TYR 318 N -2.86 1.83 -0.14 6.54 5.04 -1.26 -4.95 117.35 121.55 3i26 s TYR 318 Ca 0.65 0.53 -0.01 0.00 -2.44 0.00 0.00 57.07 55.81 3i26 s TYR 318 Cb -0.19 -4.07 0.04 0.00 0.35 0.00 0.00 41.96 38.08 3i26 s TYR 318 CO 0.58 -3.17 -0.04 0.99 -1.34 0.00 0.00 175.55 172.57 3i26 s THR 319 N 6.30 0.93 -0.24 4.34 2.01 -1.26 -4.51 115.64 123.21 3i26 s THR 319 Ca 0.79 -0.43 -0.01 0.00 0.31 0.00 0.00 61.69 62.35 3i26 s THR 319 Cb -0.25 -1.09 0.03 0.00 0.01 0.00 0.00 72.50 71.19 3i26 s THR 319 CO 0.33 0.18 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.67 3i26 s VAL 320 N 1.72 2.74 -0.04 3.82 1.01 -1.26 -1.89 120.40 126.50 3i26 s VAL 320 Ca 0.02 -1.06 0.09 0.00 0.00 0.00 0.00 61.98 61.03 3i26 s VAL 320 Cb -0.14 -2.38 -0.13 0.00 0.00 0.00 0.00 36.38 33.72 3i26 s VAL 320 CO -0.08 0.22 0.14 0.35 0.00 0.00 0.00 175.10 175.74 3i26 n THR 321 N 4.64 0.20 -3.22 3.92 -2.24 -1.26 -4.82 114.28 111.50 3i26 n THR 321 Ca -0.17 -0.26 -0.24 0.00 -2.27 0.00 0.00 64.05 61.11 3i26 n THR 321 Cb 0.47 -0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.55 3i26 n THR 321 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3i26 n ASN 322 N -1.99 -0.23 -1.24 3.42 5.15 -1.26 -5.12 115.26 113.99 3i26 n ASN 322 Ca -0.06 -2.63 -0.01 0.00 -0.60 0.00 0.00 54.58 51.28 3i26 n ASN 322 Cb 0.43 -0.46 0.00 0.00 -0.53 0.00 0.00 39.78 39.22 3i26 n ASN 322 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3i26 n GLY 323 N 1.87 2.04 0.12 8.20 0.00 -1.26 -4.94 105.19 111.22 3i26 n GLY 323 Ca 0.23 -1.10 -0.19 0.00 0.00 0.00 0.00 46.02 44.95 3i26 n GLY 323 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i26 h SER 324 N 0.27 0.58 -2.37 1.61 4.64 -1.25 -3.48 113.55 113.54 3i26 h SER 324 Ca -0.04 -0.65 -0.04 0.00 -0.47 0.00 0.00 61.79 60.58 3i26 h SER 324 Cb 0.17 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3i26 h SER 324 CO 0.06 1.52 0.13 -0.90 -0.87 0.00 0.00 176.83 176.77 3i26 n ASP 325 N -3.59 -1.35 0.24 4.97 5.68 -1.26 -5.00 116.55 116.25 3i26 n ASP 325 Ca -0.13 -2.03 0.16 0.00 -0.50 0.00 0.00 54.79 52.29 3i26 n ASP 325 Cb 1.06 2.28 0.86 0.00 -1.14 0.00 0.00 41.12 44.18 3i26 n ASP 325 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3i26 h ALA 326 N 1.97 1.01 -0.04 2.12 0.00 -1.93 -2.28 119.26 120.12 3i26 h ALA 326 Ca -0.20 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3i26 h ALA 326 Cb 0.77 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3i26 h ALA 326 CO 0.26 -0.01 -0.18 0.09 0.00 0.00 0.00 179.25 179.40 3i26 n ASN 327 N -2.62 2.24 -3.47 0.00 3.02 -1.26 -4.55 115.26 108.62 3i26 n ASN 327 Ca -0.02 -3.42 -0.20 0.00 -0.03 0.00 0.00 54.58 50.91 3i26 n ASN 327 Cb 0.07 -0.49 -0.12 0.00 -0.61 0.00 0.00 39.78 38.63 3i26 n ASN 327 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3i26 s HIS 328 N -3.03 -0.23 0.00 3.10 3.76 -0.86 -4.94 115.29 113.09 3i26 s HIS 328 Ca 0.36 -0.10 0.00 0.00 -0.15 0.00 0.00 55.06 55.17 3i26 s HIS 328 Cb 0.32 -0.49 0.00 0.00 1.11 0.00 0.00 32.58 33.52 3i26 s HIS 328 CO -0.00 -0.74 0.00 0.41 -0.85 0.00 0.00 174.74 173.55 3i26 n GLY 329 N 5.30 1.00 3.70 -2.22 0.00 -1.26 -2.60 105.19 109.11 3i26 n GLY 329 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 3i26 n GLY 329 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i26 s ASP 330 N -1.65 6.52 0.20 1.61 3.68 -1.26 -4.45 116.67 121.32 3i26 s ASP 330 Ca 0.00 2.64 -0.11 0.00 2.13 0.00 0.00 52.55 57.20 3i26 s ASP 330 Cb 0.00 -2.57 0.13 0.00 -1.45 0.00 0.00 42.92 39.03 3i26 s ASP 330 CO 0.00 -0.92 1.87 0.44 0.13 0.00 0.00 175.17 176.68 3i26 h ASP 331 N 8.01 0.78 -0.49 -0.34 3.32 -1.76 -1.71 116.42 124.23 3i26 h ASP 331 Ca -0.44 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 56.53 3i26 h ASP 331 Cb 1.21 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 3i26 h ASP 331 CO 0.94 0.56 0.06 -0.08 -1.72 0.00 0.00 179.24 179.00 3i26 h GLU 332 N 0.92 0.83 -0.30 3.56 4.81 -1.90 -1.37 114.58 121.13 3i26 h GLU 332 Ca 0.25 -0.23 -0.16 0.00 -0.13 0.00 0.00 59.36 59.09 3i26 h GLU 332 Cb -0.10 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.19 3i26 h GLU 332 CO -0.06 0.84 -0.43 0.28 -0.73 0.00 0.00 179.01 178.91 3i26 h VAL 333 N 0.70 1.29 -0.72 0.32 2.07 -1.90 -1.41 116.25 116.60 3i26 h VAL 333 Ca 0.15 -1.61 0.11 0.00 0.82 0.00 0.00 66.70 66.16 3i26 h VAL 333 Cb 0.43 1.58 -0.08 0.00 -1.52 0.00 0.00 31.29 31.70 3i26 h VAL 333 CO 0.01 0.53 0.34 0.03 0.02 0.00 0.00 177.57 178.50 3i26 h ARG 334 N 0.60 0.53 -0.26 1.57 3.08 -1.20 0.26 114.38 118.97 3i26 h ARG 334 Ca 0.03 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3i26 h ARG 334 Cb 1.03 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.95 3i26 h ARG 334 CO 0.10 0.35 0.13 1.98 -1.07 0.00 0.00 179.97 181.47 3i26 h MET 335 N 0.55 0.37 -0.54 0.04 4.05 -1.12 -2.73 114.93 115.55 3i26 h MET 335 Ca 0.37 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.74 3i26 h MET 335 Cb 0.45 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.16 3i26 h MET 335 CO -0.31 0.35 0.35 0.52 0.23 0.00 0.00 176.91 178.05 3i26 h MET 336 N 0.29 0.72 0.00 0.39 2.86 -0.72 -2.96 114.93 115.52 3i26 h MET 336 Ca 0.09 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 3i26 h MET 336 Cb 0.10 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.60 3i26 h MET 336 CO -0.01 0.49 0.00 -1.33 1.06 0.00 0.00 176.91 177.12 3i26 n MET 337 N -4.69 0.16 0.30 1.72 2.00 0.87 -1.67 117.12 115.81 3i26 n MET 337 Ca 0.03 0.44 0.17 0.00 0.00 0.00 0.00 57.70 58.34 3i26 n MET 337 Cb 0.03 -1.84 0.97 0.00 0.00 0.00 0.00 33.22 32.39 3i26 n MET 337 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 175.97 177.93 3i26 h GLN 338 N 0.00 0.00 -0.75 0.03 1.08 -1.31 -2.25 115.11 111.91 3i26 h GLN 338 Ca 0.00 0.00 0.12 0.00 -1.45 0.00 0.00 58.65 57.32 3i26 h GLN 338 Cb 0.29 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.67 3i26 h GLN 338 CO 0.00 0.00 0.50 0.78 -0.95 0.00 0.00 178.83 179.16 3i26 h GLY 339 N 0.00 0.86 2.00 3.46 0.00 -1.50 -2.23 103.07 105.66 3i26 h GLY 339 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3i26 h GLY 339 CO -0.00 0.11 0.00 1.04 0.00 0.00 0.00 176.54 177.69 3i26 n LEU 340 N -4.50 0.43 0.05 3.11 4.77 -0.85 -1.88 117.00 118.14 3i26 n LEU 340 Ca 0.13 0.60 0.12 0.00 -0.03 0.00 0.00 56.01 56.84 3i26 n LEU 340 Cb 0.42 -0.54 0.48 0.00 -2.33 0.00 0.00 43.42 41.45 3i26 n LEU 340 CO 0.32 -0.43 0.88 0.18 -1.33 0.00 0.00 177.39 177.01 3i26 n LEU 341 N -1.97 0.31 -4.85 2.23 4.77 -0.84 -4.84 117.00 111.81 3i26 n LEU 341 Ca 0.03 0.54 -0.36 0.00 -0.03 0.00 0.00 56.01 56.19 3i26 n LEU 341 Cb 0.22 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 40.78 3i26 n LEU 341 CO 0.18 -0.18 -0.19 -0.13 -1.33 0.00 0.00 177.39 175.74 3i26 s ARG 342 N -3.07 3.35 -0.82 3.23 0.52 -0.79 -5.05 118.95 116.33 3i26 s ARG 342 Ca 0.10 -0.23 -0.21 0.00 -0.52 0.00 0.00 55.73 54.88 3i26 s ARG 342 Cb 0.14 -3.10 0.10 0.00 0.52 0.00 0.00 34.95 32.61 3i26 s ARG 342 CO 0.47 0.74 1.09 -0.80 0.02 0.00 0.00 175.30 176.82 3i26 s ASN 343 N -1.25 6.42 0.60 0.23 0.01 -1.26 -4.36 114.94 115.34 3i26 s ASN 343 Ca 0.18 -1.55 0.02 0.00 -0.71 0.00 0.00 52.86 50.80 3i26 s ASN 343 Cb -0.12 -2.42 0.07 0.00 0.41 0.00 0.00 41.25 39.19 3i26 s ASN 343 CO 0.07 -1.26 0.84 -0.44 -1.51 0.00 0.00 177.10 174.80 3i26 s SER 344 N 3.77 4.95 -0.04 -1.22 0.01 -0.76 -4.91 113.70 115.50 3i26 s SER 344 Ca 0.29 -0.29 0.06 0.00 1.31 0.00 0.00 55.95 57.32 3i26 s SER 344 Cb -0.10 -0.38 -0.09 0.00 0.21 0.00 0.00 66.02 65.66 3i26 s SER 344 CO -0.01 -1.40 0.09 -1.20 0.41 0.00 0.00 173.24 171.13 3i26 n SER 345 N -2.46 3.41 -3.88 2.44 7.64 0.30 -4.29 113.62 116.77 3i26 n SER 345 Ca 0.12 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.78 3i26 n SER 345 Cb 0.60 0.99 -0.17 0.00 -1.01 0.00 0.00 64.21 64.63 3i26 n SER 345 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i26 s ILE 347 N 1.11 3.55 0.25 0.00 -1.09 -0.80 -1.50 121.20 122.73 3i26 s ILE 347 Ca -0.08 -0.49 -0.17 0.00 -2.23 0.00 0.00 60.65 57.68 3i26 s ILE 347 Cb -0.14 -2.52 0.01 0.00 -1.58 0.00 0.00 42.46 38.23 3i26 s ILE 347 CO -0.01 0.52 0.59 -0.94 -1.23 0.00 0.00 174.94 173.87 3i26 s SER 348 N 0.16 -0.20 0.65 3.58 1.04 -0.58 -2.10 113.70 116.26 3i26 s SER 348 Ca -0.04 -0.70 0.42 0.00 0.48 0.00 0.00 55.95 56.11 3i26 s SER 348 Cb -0.14 0.64 2.32 0.00 0.10 0.00 0.00 66.02 68.94 3i26 s SER 348 CO 0.04 -1.21 2.35 -0.65 0.98 0.00 0.00 173.24 174.75 3i26 h PRO 349 N 2.14 0.00 0.00 4.02 0.11 -1.77 0.47 132.00 136.96 3i26 h PRO 349 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3i26 h PRO 349 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3i26 h PRO 349 CO 0.31 0.00 -0.08 1.04 -0.21 0.00 0.00 178.00 179.06 3i26 n GLN 350 N -3.21 0.22 0.00 1.05 3.00 -1.26 -4.85 117.38 112.33 3i26 n GLN 350 Ca -0.03 0.16 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 3i26 n GLN 350 Cb 0.08 -1.74 0.00 0.00 0.00 0.00 0.00 30.24 28.58 3i26 n GLN 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3i26 n GLY 351 N 1.35 0.52 3.88 1.08 0.00 0.15 -3.74 105.19 108.43 3i26 n GLY 351 Ca 0.06 -2.19 -0.28 0.00 0.00 0.00 0.00 46.02 43.61 3i26 n GLY 351 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i26 s SER 352 N -4.00 6.01 0.08 1.61 1.04 -0.66 -1.53 113.70 116.25 3i26 s SER 352 Ca 0.00 0.08 0.02 0.00 0.48 0.00 0.00 55.95 56.54 3i26 s SER 352 Cb 0.00 -1.74 -0.03 0.00 0.10 0.00 0.00 66.02 64.35 3i26 s SER 352 CO 0.00 0.09 -0.08 0.42 0.98 0.00 0.00 173.24 174.66 3i26 s THR 353 N -1.65 0.70 0.67 2.02 -4.23 -0.56 -0.79 115.64 111.78 3i26 s THR 353 Ca 0.33 -1.56 -0.11 0.00 -1.18 0.00 0.00 61.69 59.17 3i26 s THR 353 Cb -0.11 -1.22 0.16 0.00 1.34 0.00 0.00 72.50 72.67 3i26 s THR 353 CO 0.26 -0.62 0.73 -0.81 -0.54 0.00 0.00 174.62 173.65 3i26 n PRO 354 N 0.65 -1.53 -2.25 3.99 -0.04 -1.26 -0.54 135.00 134.02 3i26 n PRO 354 Ca -0.17 -1.15 -0.43 0.00 -0.04 0.00 0.00 63.50 61.71 3i26 n PRO 354 Cb 0.58 -0.91 -0.02 0.00 -0.04 0.00 0.00 33.50 33.11 3i26 n PRO 354 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3i26 s LEU 355 N 0.00 4.15 0.02 1.53 2.96 -1.26 -4.59 118.68 121.49 3i26 s LEU 355 Ca 0.44 1.80 -0.24 0.00 -0.22 0.00 0.00 54.13 55.91 3i26 s LEU 355 Cb -0.03 -3.54 0.05 0.00 0.50 0.00 0.00 46.19 43.18 3i26 s LEU 355 CO 0.32 -0.92 0.54 0.00 -1.32 0.00 0.00 176.35 174.98 3i26 s ALA 356 N 4.01 -1.39 0.03 5.97 0.00 -1.26 -5.05 121.76 124.06 3i26 s ALA 356 Ca 0.63 0.76 -0.24 0.00 0.00 0.00 0.00 51.96 53.11 3i26 s ALA 356 Cb -0.25 0.26 -0.16 0.00 0.00 0.00 0.00 23.12 22.97 3i26 s ALA 356 CO 0.22 -0.45 1.45 -0.07 0.00 0.00 0.00 175.76 176.91 3i26 h LEU 357 N 2.94 0.09 -8.74 0.00 3.38 -1.93 -3.30 115.31 107.75 3i26 h LEU 357 Ca -0.30 -0.32 -0.56 0.00 0.09 0.00 0.00 57.88 56.79 3i26 h LEU 357 Cb 1.19 -0.03 -0.21 0.00 0.09 0.00 0.00 40.66 41.71 3i26 h LEU 357 CO 0.40 0.39 -0.82 -0.31 0.09 0.00 0.00 178.44 178.20 3i26 s TYR 358 N -4.92 1.85 0.02 1.13 1.51 -1.26 -1.56 117.35 114.13 3i26 s TYR 358 Ca -0.15 -0.43 0.06 0.00 -1.01 0.00 0.00 57.07 55.55 3i26 s TYR 358 Cb 0.04 -0.99 -0.03 0.00 -0.11 0.00 0.00 41.96 40.87 3i26 s TYR 358 CO 0.69 0.26 -0.17 0.45 -1.11 0.00 0.00 175.55 175.66 3i26 s SER 359 N -2.14 3.83 0.10 2.29 0.15 -0.07 -0.99 113.70 116.88 3i26 s SER 359 Ca 0.10 -0.38 0.26 0.00 0.70 0.00 0.00 55.95 56.63 3i26 s SER 359 Cb -0.09 -0.65 0.99 0.00 -1.71 0.00 0.00 66.02 64.56 3i26 s SER 359 CO 0.05 0.27 1.80 0.35 1.20 0.00 0.00 173.24 176.92 3i26 n THR 360 N 1.71 0.40 -4.15 6.45 -2.24 -0.42 -0.95 114.28 115.07 3i26 n THR 360 Ca -0.16 -0.06 -0.10 0.00 -2.27 0.00 0.00 64.05 61.46 3i26 n THR 360 Cb 0.52 -0.64 -0.10 0.00 -2.10 0.00 0.00 70.33 68.01 3i26 n THR 360 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3i26 s GLU 361 N -3.07 0.84 0.28 -0.78 -1.05 -1.26 -4.90 118.70 108.76 3i26 s GLU 361 Ca 0.11 -1.36 -0.30 0.00 -0.15 0.00 0.00 54.97 53.27 3i26 s GLU 361 Cb 0.15 0.02 -0.11 0.00 -0.44 0.00 0.00 34.13 33.74 3i26 s GLU 361 CO 0.52 -0.13 1.60 1.41 0.95 0.00 0.00 175.26 179.61 3i26 s MET 362 N -3.93 4.13 -0.24 -4.83 -2.45 -1.26 -4.56 119.30 106.17 3i26 s MET 362 Ca 0.16 2.56 -0.09 0.00 -1.25 0.00 0.00 55.69 57.07 3i26 s MET 362 Cb 0.07 -3.04 -0.04 0.00 1.25 0.00 0.00 34.83 33.07 3i26 s MET 362 CO -0.03 -0.63 0.12 0.42 1.05 0.00 0.00 175.02 175.95 3i26 s ILE 363 N 0.17 4.96 0.59 10.11 1.01 -1.26 -4.96 121.20 131.81 3i26 s ILE 363 Ca 0.65 0.04 0.08 0.00 0.00 0.00 0.00 60.65 61.42 3i26 s ILE 363 Cb -0.48 -3.31 0.09 0.00 0.01 0.00 0.00 42.46 38.78 3i26 s ILE 363 CO 0.45 0.35 0.81 -0.31 0.00 0.00 0.00 174.94 176.24 3i26 s TYR 364 N 1.18 1.54 0.10 3.97 2.02 -1.26 -5.05 117.35 119.85 3i26 s TYR 364 Ca 0.06 -0.63 -0.01 0.00 -0.37 0.00 0.00 57.07 56.12 3i26 s TYR 364 Cb -0.14 -2.35 -0.04 0.00 -0.40 0.00 0.00 41.96 39.02 3i26 s TYR 364 CO 0.05 -1.19 0.27 -1.21 -1.57 0.00 0.00 175.55 171.89 3i26 s GLU 365 N -4.72 3.48 0.18 -0.62 0.41 -1.26 -3.89 118.70 112.29 3i26 s GLU 365 Ca 0.62 -0.37 -0.30 0.00 -0.41 0.00 0.00 54.97 54.51 3i26 s GLU 365 Cb -0.06 -2.97 -0.08 0.00 -1.78 0.00 0.00 34.13 29.24 3i26 s GLU 365 CO 0.39 0.55 1.04 -1.25 -0.49 0.00 0.00 175.26 175.50 3i26 s PRO 366 N -2.68 4.67 0.05 0.39 0.05 -1.26 -4.85 135.00 131.36 3i26 s PRO 366 Ca 0.37 1.62 0.02 0.00 0.05 0.00 0.00 61.00 63.06 3i26 s PRO 366 Cb -0.12 -3.30 -0.03 0.00 0.05 0.00 0.00 34.50 31.10 3i26 s PRO 366 CO 0.27 0.20 -0.08 0.54 0.05 0.00 0.00 177.00 177.98 3i26 s ASN 367 N -0.34 0.93 0.29 6.66 2.20 -1.25 -3.97 114.94 119.46 3i26 s ASN 367 Ca 0.47 -0.59 -0.03 0.00 -0.94 0.00 0.00 52.86 51.77 3i26 s ASN 367 Cb -0.27 0.03 -0.01 0.00 -2.00 0.00 0.00 41.25 39.00 3i26 s ASN 367 CO 0.34 -0.21 0.39 -0.72 -2.94 0.00 0.00 177.10 173.95 3i26 s TYR 368 N -1.53 1.00 0.00 1.54 -0.85 -0.89 -5.02 117.35 111.60 3i26 s TYR 368 Ca -0.08 -1.22 0.00 0.00 -0.52 0.00 0.00 57.07 55.25 3i26 s TYR 368 Cb -0.09 -0.18 0.00 0.00 0.38 0.00 0.00 41.96 42.07 3i26 s TYR 368 CO 0.00 -0.99 0.00 0.41 -1.52 0.00 0.00 175.55 173.46 3i26 n GLY 369 N -0.48 -1.43 3.30 5.49 0.00 -1.26 -1.90 105.19 108.92 3i26 n GLY 369 Ca 0.01 -1.63 -0.39 0.00 0.00 0.00 0.00 46.02 44.01 3i26 n GLY 369 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3i26 s SER 370 N -4.00 5.48 -0.10 1.61 0.15 -0.31 -4.95 113.70 111.58 3i26 s SER 370 Ca 0.00 -1.14 -0.02 0.00 0.70 0.00 0.00 55.95 55.49 3i26 s SER 370 Cb 0.00 -1.93 -0.03 0.00 -1.71 0.00 0.00 66.02 62.35 3i26 s SER 370 CO 0.00 -0.37 -0.00 0.00 1.20 0.00 0.00 173.24 174.07 3i26 s PRO 372 N -0.62 1.80 -0.02 0.00 0.02 -1.24 -4.99 135.00 129.95 3i26 s PRO 372 Ca 0.10 1.70 -0.02 0.00 0.02 0.00 0.00 61.00 62.80 3i26 s PRO 372 Cb -0.12 -1.80 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 3i26 s PRO 372 CO 0.02 -2.08 0.15 -0.65 -0.33 0.00 0.00 177.00 174.11 3i26 s GLN 373 N -4.15 3.32 -0.08 5.54 -0.21 -0.60 -4.65 119.66 118.84 3i26 s GLN 373 Ca 0.72 -0.35 -0.34 0.00 0.02 0.00 0.00 55.36 55.41 3i26 s GLN 373 Cb -0.27 -3.03 -0.12 0.00 1.00 0.00 0.00 33.01 30.59 3i26 s GLN 373 CO 0.49 0.68 1.87 0.34 -2.12 0.00 0.00 175.29 176.55 3i26 n PHE 374 N 1.14 2.33 0.15 0.91 -0.00 -1.26 -0.89 117.46 119.85 3i26 n PHE 374 Ca -0.13 -0.00 0.14 0.00 -0.00 0.00 0.00 57.45 57.46 3i26 n PHE 374 Cb 0.53 -2.66 0.69 0.00 -0.00 0.00 0.00 39.48 38.03 3i26 n PHE 374 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.76 176.86 3i26 h TYR 375 N 9.08 0.00 0.00 -5.13 -0.00 -1.37 -1.16 116.97 118.40 3i26 h TYR 375 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.25 3i26 h TYR 375 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.00 3i26 h TYR 375 CO 0.87 0.00 0.00 0.87 -0.00 0.00 0.00 178.16 179.90 3i26 h LYS 376 N 0.00 0.00 0.00 0.10 1.57 -1.88 -1.67 116.57 114.69 3i26 h LYS 376 Ca 0.11 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3i26 h LYS 376 Cb 0.45 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 3i26 h LYS 376 CO -0.00 0.00 -0.17 -0.07 -0.57 0.00 0.00 179.45 178.64 3i26 h LEU 377 N 0.00 0.00 -1.57 2.94 3.38 -1.58 -3.56 115.31 114.92 3i26 h LEU 377 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3i26 h LEU 377 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3i26 h LEU 377 CO 0.00 0.17 0.00 0.49 0.09 0.00 0.00 178.44 179.19