#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kru h ILE 3 N 0.00 0.61 -0.63 2.46 2.10 -1.98 -0.66 117.51 119.42 3kru h ILE 3 Ca 0.00 -0.20 0.18 0.00 1.08 0.00 0.00 64.86 65.93 3kru h ILE 3 Cb 0.00 1.12 -0.03 0.00 -1.09 0.00 0.00 36.82 36.83 3kru h ILE 3 CO 0.00 0.05 0.48 0.25 -1.08 0.00 0.00 178.15 177.85 3kru h LEU 4 N 0.00 0.00 -2.46 2.19 5.85 -1.94 -2.25 115.31 116.70 3kru h LEU 4 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3kru h LEU 4 Cb 0.12 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.15 3kru h LEU 4 CO 0.01 0.00 0.00 1.41 -0.34 0.00 0.00 178.44 179.52 3kru n HIS 5 N -4.21 0.80 -2.91 1.25 8.25 -0.25 -1.12 115.22 117.03 3kru n HIS 5 Ca 0.12 -0.40 -0.40 0.00 -0.26 0.00 0.00 57.72 56.78 3kru n HIS 5 Cb 0.73 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.80 3kru n HIS 5 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3kru s MET 6 N -1.20 4.52 0.80 -0.41 -1.94 -0.85 -4.71 119.30 115.51 3kru s MET 6 Ca 0.44 1.14 -0.12 0.00 -1.71 0.00 0.00 55.69 55.45 3kru s MET 6 Cb 0.24 -3.41 0.08 0.00 2.01 0.00 0.00 34.83 33.74 3kru s MET 6 CO 0.32 0.14 1.13 -2.14 -0.01 0.00 0.00 175.02 174.46 3kru s PRO 7 N 0.42 1.91 -0.13 2.03 0.02 -1.25 -4.06 135.00 133.93 3kru s PRO 7 Ca 0.42 1.41 -0.00 0.00 0.02 0.00 0.00 61.00 62.85 3kru s PRO 7 Cb -0.20 -1.84 0.03 0.00 0.02 0.00 0.00 34.50 32.51 3kru s PRO 7 CO 0.24 -1.94 -0.09 -1.17 -0.33 0.00 0.00 177.00 173.70 3kru s LEU 8 N -5.89 1.42 -0.19 -5.54 2.96 0.01 -4.95 118.68 106.51 3kru s LEU 8 Ca 0.66 -0.44 -0.15 0.00 -0.22 0.00 0.00 54.13 53.98 3kru s LEU 8 Cb -0.21 -0.95 -0.04 0.00 0.50 0.00 0.00 46.19 45.49 3kru s LEU 8 CO 0.53 -0.12 0.38 -0.75 -1.32 0.00 0.00 176.35 175.07 3kru s LYS 9 N 1.63 4.20 -0.16 1.98 2.20 -1.26 -0.88 119.74 127.45 3kru s LYS 9 Ca 0.04 0.19 -0.00 0.00 -0.36 0.00 0.00 55.97 55.83 3kru s LYS 9 Cb -0.13 -3.51 0.04 0.00 -1.51 0.00 0.00 37.83 32.72 3kru s LYS 9 CO -0.09 0.04 -0.07 0.42 -0.36 0.00 0.00 175.35 175.29 3kru s ILE 10 N 1.07 1.25 0.00 5.43 1.01 0.43 -5.00 121.20 125.39 3kru s ILE 10 Ca 0.19 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 60.18 3kru s ILE 10 Cb -0.14 -1.36 0.00 0.00 0.01 0.00 0.00 42.46 40.97 3kru s ILE 10 CO 0.07 0.20 0.00 0.29 0.00 0.00 0.00 174.94 175.50 3kru n LYS 11 N 4.84 0.00 -0.08 2.79 5.02 -1.26 -1.32 118.16 128.14 3kru n LYS 11 Ca -0.13 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.27 3kru n LYS 11 Cb 0.48 0.00 0.36 0.00 -0.02 0.00 0.00 35.03 35.85 3kru n LYS 11 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3kru n ASP 12 N 3.53 1.98 -4.70 4.39 9.92 -0.64 -4.87 116.55 126.16 3kru n ASP 12 Ca 0.00 -1.73 -0.35 0.00 -0.53 0.00 0.00 54.79 52.18 3kru n ASP 12 Cb 0.00 -0.10 -0.09 0.00 -0.64 0.00 0.00 41.12 40.29 3kru n ASP 12 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3kru s ILE 13 N -1.80 5.17 -0.24 0.53 -1.09 -0.44 -5.06 121.20 118.28 3kru s ILE 13 Ca 0.34 0.10 -0.04 0.00 -2.23 0.00 0.00 60.65 58.82 3kru s ILE 13 Cb 0.19 -3.34 -0.00 0.00 -1.58 0.00 0.00 42.46 37.73 3kru s ILE 13 CO 0.29 0.46 -0.02 -0.89 -1.23 0.00 0.00 174.94 173.54 3kru s THR 14 N 0.30 3.41 -0.14 2.92 2.01 -1.26 -0.43 115.64 122.45 3kru s THR 14 Ca 0.06 -0.59 -0.19 0.00 0.31 0.00 0.00 61.69 61.28 3kru s THR 14 Cb -0.12 -2.61 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 3kru s THR 14 CO -0.01 0.34 0.55 -0.63 -0.69 0.00 0.00 174.62 174.17 3kru s ILE 15 N 1.46 5.12 -0.40 1.82 1.01 -0.06 -4.91 121.20 125.25 3kru s ILE 15 Ca 0.04 1.07 0.27 0.00 0.00 0.00 0.00 60.65 62.03 3kru s ILE 15 Cb -0.15 -3.88 0.32 0.00 0.01 0.00 0.00 42.46 38.76 3kru s ILE 15 CO -0.02 0.24 1.77 0.07 0.00 0.00 0.00 174.94 176.99 3kru h LYS 16 N 7.04 0.00 -3.71 2.79 2.10 -1.86 0.07 116.57 123.00 3kru h LYS 16 Ca -0.38 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.08 3kru h LYS 16 Cb 1.17 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.46 3kru h LYS 16 CO 0.75 0.00 -0.01 0.54 -2.00 0.00 0.00 179.45 178.74 3kru s ASN 17 N -5.21 0.65 -0.17 7.07 2.20 -1.26 -3.80 114.94 114.42 3kru s ASN 17 Ca 0.06 -1.41 0.14 0.00 -0.94 0.00 0.00 52.86 50.72 3kru s ASN 17 Cb 0.09 0.75 0.71 0.00 -2.00 0.00 0.00 41.25 40.80 3kru s ASN 17 CO 0.56 -1.48 1.60 0.54 -2.94 0.00 0.00 177.10 175.39 3kru n ARG 18 N -0.57 4.13 -3.80 3.55 5.12 -0.28 -4.65 116.66 120.16 3kru n ARG 18 Ca -0.03 -2.77 -0.36 0.00 -1.93 0.00 0.00 57.85 52.76 3kru n ARG 18 Cb 0.61 -2.06 -0.12 0.00 -1.16 0.00 0.00 32.46 29.73 3kru n ARG 18 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3kru s ILE 19 N -2.28 4.59 -0.11 0.55 -1.09 -1.26 -0.81 121.20 120.78 3kru s ILE 19 Ca 0.49 -0.08 -0.02 0.00 -2.23 0.00 0.00 60.65 58.80 3kru s ILE 19 Cb 0.35 -3.14 -0.03 0.00 -1.58 0.00 0.00 42.46 38.06 3kru s ILE 19 CO 0.18 0.35 -0.03 -0.32 -1.23 0.00 0.00 174.94 173.89 3kru s MET 20 N 1.33 3.23 -0.38 2.79 -2.45 -0.31 -1.93 119.30 121.59 3kru s MET 20 Ca 0.05 -0.48 -0.29 0.00 -1.25 0.00 0.00 55.69 53.72 3kru s MET 20 Cb -0.15 -2.80 0.01 0.00 1.25 0.00 0.00 34.83 33.14 3kru s MET 20 CO 0.04 0.50 1.26 1.41 1.05 0.00 0.00 175.02 179.28 3kru s MET 21 N -0.33 3.80 0.37 4.11 1.75 0.23 -1.18 119.30 128.05 3kru s MET 21 Ca 0.06 0.97 -0.27 0.00 -1.25 0.00 0.00 55.69 55.20 3kru s MET 21 Cb -0.12 -3.91 -0.11 0.00 2.84 0.00 0.00 34.83 33.53 3kru s MET 21 CO 0.02 -1.28 1.37 0.45 -0.65 0.00 0.00 175.02 174.93 3kru n SER 22 N 7.90 3.14 -4.67 1.11 2.88 -0.34 -2.10 113.62 121.53 3kru n SER 22 Ca 0.14 1.20 -0.42 0.00 -1.33 0.00 0.00 58.87 58.46 3kru n SER 22 Cb 0.48 -1.54 -0.03 0.00 -0.75 0.00 0.00 64.21 62.36 3kru n SER 22 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 3kru s PRO 23 N -2.04 4.17 -0.14 -1.46 0.04 -1.24 -4.81 135.00 129.52 3kru s PRO 23 Ca 0.56 2.44 -0.02 0.00 0.04 0.00 0.00 61.00 64.01 3kru s PRO 23 Cb -0.52 -3.85 0.05 0.00 0.04 0.00 0.00 34.50 30.21 3kru s PRO 23 CO 0.62 -0.85 0.02 -1.64 0.04 0.00 0.00 177.00 175.20 3kru s MET 24 N 3.52 0.59 0.24 4.56 -1.94 -1.26 -4.82 119.30 120.18 3kru s MET 24 Ca 0.80 -0.16 -0.31 0.00 -1.71 0.00 0.00 55.69 54.30 3kru s MET 24 Cb -0.40 -1.59 -0.14 0.00 2.01 0.00 0.00 34.83 34.71 3kru s MET 24 CO 0.35 -0.49 1.31 0.00 -0.01 0.00 0.00 175.02 176.18 3kru n MET 26 N 1.72 2.76 -4.12 0.00 2.81 -1.26 -5.01 117.12 114.01 3kru n MET 26 Ca 0.11 -0.29 -0.33 0.00 -1.81 0.00 0.00 57.70 55.39 3kru n MET 26 Cb 0.30 -1.07 -0.02 0.00 -0.71 0.00 0.00 33.22 31.72 3kru n MET 26 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3kru n TYR 27 N -0.81 -1.75 -0.34 2.03 4.01 -1.26 -4.85 117.16 114.20 3kru n TYR 27 Ca 0.03 0.79 0.00 0.00 -0.16 0.00 0.00 57.90 58.56 3kru n TYR 27 Cb 0.20 -3.27 0.00 0.00 -0.31 0.00 0.00 39.34 35.97 3kru n TYR 27 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3kru n SER 28 N -2.77 1.07 -4.91 7.72 7.64 -0.95 -4.87 113.62 116.54 3kru n SER 28 Ca -0.05 -1.40 -0.27 0.00 1.01 0.00 0.00 58.87 58.15 3kru n SER 28 Cb 0.56 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.79 3kru n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kru s ALA 29 N -0.40 3.19 0.76 -0.43 0.00 0.01 -4.79 121.76 120.10 3kru s ALA 29 Ca 0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 51.96 51.28 3kru s ALA 29 Cb 0.00 -2.70 0.11 0.00 0.00 0.00 0.00 23.12 20.53 3kru s ALA 29 CO 0.00 -0.94 0.69 0.45 0.00 0.00 0.00 175.76 175.96 3kru n SER 30 N -2.72 0.51 0.10 0.00 2.88 -1.23 -4.39 113.62 108.77 3kru n SER 30 Ca 0.05 -1.53 0.11 0.00 -1.33 0.00 0.00 58.87 56.17 3kru n SER 30 Cb 0.58 -0.48 0.45 0.00 -0.75 0.00 0.00 64.21 64.00 3kru n SER 30 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3kru n THR 31 N -2.61 0.86 1.64 2.46 -2.24 -1.21 -1.10 114.28 112.09 3kru n THR 31 Ca 0.10 0.23 0.15 0.00 -2.27 0.00 0.00 64.05 62.26 3kru n THR 31 Cb 0.35 -1.11 0.82 0.00 -2.10 0.00 0.00 70.33 68.29 3kru n THR 31 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3kru n ASP 32 N -2.06 0.00 -0.08 3.42 5.68 -1.26 -4.92 116.55 117.33 3kru n ASP 32 Ca 0.02 -0.54 -0.01 0.00 -0.50 0.00 0.00 54.79 53.77 3kru n ASP 32 Cb 0.22 -0.14 -0.00 0.00 -1.14 0.00 0.00 41.12 40.05 3kru n ASP 32 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kru n GLY 33 N 1.05 0.45 3.78 6.12 0.00 -0.25 -4.83 105.19 111.50 3kru n GLY 33 Ca 0.18 -0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 3kru n GLY 33 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3kru s MET 34 N -0.91 4.42 0.84 1.61 -1.94 -1.26 -1.33 119.30 120.74 3kru s MET 34 Ca 0.00 0.98 -0.12 0.00 -1.71 0.00 0.00 55.69 54.84 3kru s MET 34 Cb 0.00 -3.27 0.10 0.00 2.01 0.00 0.00 34.83 33.67 3kru s MET 34 CO 0.00 0.55 1.11 -1.25 -0.01 0.00 0.00 175.02 175.42 3kru s PRO 35 N -0.96 1.69 0.03 2.03 0.04 -1.26 -3.55 135.00 133.02 3kru s PRO 35 Ca 0.33 0.57 0.01 0.00 0.04 0.00 0.00 61.00 61.95 3kru s PRO 35 Cb -0.21 -1.88 -0.00 0.00 0.04 0.00 0.00 34.50 32.45 3kru s PRO 35 CO 0.23 -1.88 0.03 0.27 0.04 0.00 0.00 177.00 175.69 3kru n ASN 36 N -3.60 -0.07 0.27 6.66 0.23 -1.26 -4.98 115.26 112.52 3kru n ASN 36 Ca 0.07 -1.19 0.13 0.00 -0.53 0.00 0.00 54.58 53.05 3kru n ASN 36 Cb 0.57 0.16 0.79 0.00 -2.08 0.00 0.00 39.78 39.21 3kru n ASN 36 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3kru h ASP 37 N 0.18 0.00 0.20 0.53 3.32 -1.98 -2.08 116.42 116.59 3kru h ASP 37 Ca -0.02 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 3kru h ASP 37 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3kru h ASP 37 CO 0.03 0.06 -0.09 -0.25 -1.72 0.00 0.00 179.24 177.27 3kru h TRP 38 N 0.00 -0.24 -0.85 4.55 7.01 -1.96 -1.33 115.95 123.13 3kru h TRP 38 Ca -0.00 -0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.02 3kru h TRP 38 Cb 0.16 0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 27.25 3kru h TRP 38 CO 0.00 -0.14 0.56 0.45 -2.79 0.00 0.00 178.44 176.51 3kru h HIS 39 N -0.27 1.05 -0.14 2.65 3.86 -1.76 -0.75 115.15 119.78 3kru h HIS 39 Ca -0.03 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3kru h HIS 39 Cb 0.21 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 3kru h HIS 39 CO -0.06 0.63 0.08 0.82 0.86 0.00 0.00 177.93 180.25 3kru h ILE 40 N 1.11 1.09 -0.39 2.45 2.04 -1.21 -1.40 117.51 121.20 3kru h ILE 40 Ca 0.33 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 3kru h ILE 40 Cb -0.05 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 3kru h ILE 40 CO -0.10 0.08 0.13 0.58 0.00 0.00 0.00 178.15 178.85 3kru h VAL 41 N 0.13 1.21 -0.21 1.67 2.07 -1.14 -1.20 116.25 118.78 3kru h VAL 41 Ca 0.05 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 66.95 3kru h VAL 41 Cb 0.07 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 3kru h VAL 41 CO -0.01 0.24 -0.15 -0.74 0.02 0.00 0.00 177.57 176.93 3kru h HIS 42 N 0.49 -0.37 -0.00 1.57 -0.00 -0.82 -0.32 115.15 115.70 3kru h HIS 42 Ca 0.13 0.03 -0.21 0.00 -0.00 0.00 0.00 60.37 60.32 3kru h HIS 42 Cb 0.24 0.20 0.02 0.00 -0.00 0.00 0.00 27.41 27.86 3kru h HIS 42 CO 0.01 -0.22 -0.81 1.88 -0.00 0.00 0.00 177.93 178.79 3kru h TYR 43 N -0.15 0.82 -0.98 5.26 0.05 -1.28 -3.26 116.97 117.43 3kru h TYR 43 Ca 0.12 -0.44 0.16 0.00 0.05 0.00 0.00 58.73 58.62 3kru h TYR 43 Cb 0.33 -0.09 -0.09 0.00 1.01 0.00 0.00 36.73 37.89 3kru h TYR 43 CO -0.31 1.27 0.61 0.00 -1.05 0.00 0.00 178.16 178.69 3kru h ALA 44 N 0.36 1.68 -0.71 3.88 0.00 -1.04 -2.24 119.26 121.19 3kru h ALA 44 Ca -0.10 0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.92 3kru h ALA 44 Cb 1.49 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 3kru h ALA 44 CO 0.16 0.02 0.39 1.15 0.00 0.00 0.00 179.25 180.97 3kru h THR 45 N 0.82 0.93 0.00 0.00 2.02 -1.09 -0.11 112.91 115.47 3kru h THR 45 Ca 0.52 -0.24 -0.09 0.00 0.77 0.00 0.00 66.41 67.37 3kru h THR 45 Cb 0.73 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 3kru h THR 45 CO -0.29 0.13 -0.45 0.03 0.37 0.00 0.00 175.52 175.31 3kru h ARG 46 N 0.69 0.00 -0.18 6.66 -0.00 -1.51 0.26 114.38 120.29 3kru h ARG 46 Ca 0.33 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.78 3kru h ARG 46 Cb 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.23 3kru h ARG 46 CO -0.22 0.45 -0.02 0.00 0.00 0.00 0.00 179.97 180.18 3kru h ALA 47 N 1.55 0.25 -0.58 0.04 0.00 -0.96 -2.16 119.26 117.40 3kru h ALA 47 Ca -0.00 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.70 3kru h ALA 47 Cb 1.19 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 3kru h ALA 47 CO 0.06 -0.02 0.39 0.82 0.00 0.00 0.00 179.25 180.50 3kru h ILE 48 N 0.07 1.13 0.00 0.00 2.04 -0.89 -1.65 117.51 118.21 3kru h ILE 48 Ca 0.05 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.65 3kru h ILE 48 Cb 0.43 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 3kru h ILE 48 CO 0.01 0.14 0.00 0.61 0.00 0.00 0.00 178.15 178.91 3kru n GLY 49 N -1.45 -0.67 0.45 5.37 0.00 0.07 -4.75 105.19 104.21 3kru n GLY 49 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3kru n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kru n GLY 50 N 0.13 0.82 3.73 -0.02 0.00 -0.62 -2.69 105.19 106.55 3kru n GLY 50 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3kru n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kru s VAL 51 N -2.11 2.37 0.05 1.61 1.01 -0.86 -4.91 120.40 117.57 3kru s VAL 51 Ca 0.00 0.29 -0.22 0.00 0.00 0.00 0.00 61.98 62.05 3kru s VAL 51 Cb 0.00 -3.19 -0.14 0.00 0.00 0.00 0.00 36.38 33.05 3kru s VAL 51 CO 0.00 0.04 1.50 1.23 0.00 0.00 0.00 175.10 177.86 3kru h GLY 52 N 5.78 0.17 -7.05 4.51 0.00 -1.67 -3.41 103.07 101.40 3kru h GLY 52 Ca -0.45 -0.12 -0.51 0.00 0.00 0.00 0.00 47.33 46.25 3kru h GLY 52 CO 0.85 0.11 -0.78 -2.27 0.00 0.00 0.00 176.54 174.45 3kru s LEU 53 N -9.61 1.21 -0.39 3.11 0.20 -0.93 -1.17 118.68 111.10 3kru s LEU 53 Ca -0.14 -0.51 -0.17 0.00 0.69 0.00 0.00 54.13 54.00 3kru s LEU 53 Cb 0.05 -0.71 0.01 0.00 -0.43 0.00 0.00 46.19 45.11 3kru s LEU 53 CO 0.69 -0.21 0.45 -0.63 -0.29 0.00 0.00 176.35 176.37 3kru s ILE 54 N 1.78 5.07 -0.44 6.68 1.01 -0.23 -0.60 121.20 134.47 3kru s ILE 54 Ca 0.02 -0.08 -0.20 0.00 0.00 0.00 0.00 60.65 60.39 3kru s ILE 54 Cb -0.15 -3.98 0.03 0.00 0.01 0.00 0.00 42.46 38.37 3kru s ILE 54 CO -0.07 -0.32 0.59 -0.32 0.00 0.00 0.00 174.94 174.83 3kru s MET 55 N 2.21 3.22 0.45 2.79 1.75 -0.89 -0.56 119.30 128.28 3kru s MET 55 Ca 0.14 -0.52 -0.25 0.00 -1.25 0.00 0.00 55.69 53.81 3kru s MET 55 Cb -0.16 -3.97 -0.08 0.00 2.84 0.00 0.00 34.83 33.45 3kru s MET 55 CO 0.14 -1.00 1.43 -1.14 -0.65 0.00 0.00 175.02 173.80 3kru s GLN 56 N 2.64 3.66 0.82 4.11 0.74 -0.00 -3.62 119.66 128.02 3kru s GLN 56 Ca 0.19 2.43 -0.15 0.00 0.05 0.00 0.00 55.36 57.88 3kru s GLN 56 Cb -0.15 -2.64 -0.03 0.00 1.10 0.00 0.00 33.01 31.28 3kru s GLN 56 CO 0.17 -0.84 0.29 -0.85 -0.55 0.00 0.00 175.29 173.50 3kru n GLU 57 N -0.23 0.04 -1.50 1.67 0.28 -1.26 -2.56 120.64 117.09 3kru n GLU 57 Ca 0.05 0.05 -0.62 0.00 -0.16 0.00 0.00 57.16 56.48 3kru n GLU 57 Cb 0.42 -1.69 -0.10 0.00 1.43 0.00 0.00 31.44 31.49 3kru n GLU 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3kru n ALA 58 N -2.78 -0.73 -4.05 -1.84 0.00 -1.26 -4.32 120.51 105.54 3kru n ALA 58 Ca 0.07 0.37 -0.33 0.00 0.00 0.00 0.00 53.44 53.55 3kru n ALA 58 Cb 0.52 -1.90 -0.15 0.00 0.00 0.00 0.00 19.45 17.91 3kru n ALA 58 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3kru s THR 59 N 3.98 2.21 0.11 0.00 2.01 0.20 -4.36 115.64 119.78 3kru s THR 59 Ca 1.06 -1.20 -0.30 0.00 0.31 0.00 0.00 61.69 61.56 3kru s THR 59 Cb -1.44 -2.09 -0.07 0.00 0.01 0.00 0.00 72.50 68.92 3kru s THR 59 CO 0.73 0.30 1.21 0.00 -0.69 0.00 0.00 174.62 176.16 3kru s ALA 60 N 1.23 3.42 -0.83 7.40 0.00 -0.55 -1.37 121.76 131.06 3kru s ALA 60 Ca -0.01 0.90 0.26 0.00 0.00 0.00 0.00 51.96 53.12 3kru s ALA 60 Cb -0.16 -3.44 0.72 0.00 0.00 0.00 0.00 23.12 20.24 3kru s ALA 60 CO -0.09 -0.41 1.61 1.33 0.00 0.00 0.00 175.76 178.19 3kru n VAL 61 N 3.39 0.25 -3.97 0.00 0.24 -0.48 -1.21 118.33 116.56 3kru n VAL 61 Ca 0.07 -0.15 -0.09 0.00 -2.04 0.00 0.00 64.34 62.13 3kru n VAL 61 Cb 0.45 -0.25 -0.10 0.00 -1.47 0.00 0.00 33.84 32.47 3kru n VAL 61 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3kru s GLU 62 N -3.07 0.41 0.39 7.34 2.02 -1.26 -4.35 118.70 120.18 3kru s GLU 62 Ca 0.10 -0.67 0.06 0.00 0.02 0.00 0.00 54.97 54.49 3kru s GLU 62 Cb 0.15 0.15 0.80 0.00 0.10 0.00 0.00 34.13 35.34 3kru s GLU 62 CO 0.64 -0.08 2.04 0.66 0.02 0.00 0.00 175.26 178.53 3kru h SER 63 N 4.28 0.54 0.65 -0.19 4.64 -1.94 0.53 113.55 122.06 3kru h SER 63 Ca -0.32 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3kru h SER 63 Cb 1.20 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3kru h SER 63 CO 0.45 0.39 0.00 -2.11 -0.87 0.00 0.00 176.83 174.69 3kru n ARG 64 N -4.47 0.08 -0.05 4.77 1.85 -1.26 -2.54 116.66 115.04 3kru n ARG 64 Ca 0.05 0.12 0.12 0.00 -1.00 0.00 0.00 57.85 57.14 3kru n ARG 64 Cb 0.08 -1.50 0.41 0.00 -1.05 0.00 0.00 32.46 30.40 3kru n ARG 64 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3kru n GLY 65 N 0.68 0.31 3.80 2.89 0.00 0.17 -4.62 105.19 108.41 3kru n GLY 65 Ca 0.07 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 3kru n GLY 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kru s ARG 66 N -1.87 3.51 -0.13 1.61 0.52 -1.05 -0.42 118.95 121.11 3kru s ARG 66 Ca 0.35 1.33 -0.23 0.00 -0.52 0.00 0.00 55.73 56.65 3kru s ARG 66 Cb 0.19 -2.05 -0.21 0.00 0.52 0.00 0.00 34.95 33.40 3kru s ARG 66 CO 0.30 -0.67 0.61 0.82 0.02 0.00 0.00 175.30 176.38 3kru h ILE 67 N 0.99 1.43 -2.66 1.52 2.04 -1.91 -3.39 117.51 115.53 3kru h ILE 67 Ca -0.48 -2.08 -0.49 0.00 1.00 0.00 0.00 64.86 62.81 3kru h ILE 67 Cb 1.23 2.71 -0.14 0.00 -0.74 0.00 0.00 36.82 39.88 3kru h ILE 67 CO 0.58 0.49 -0.66 0.42 0.00 0.00 0.00 178.15 178.97 3kru s THR 68 N -2.09 1.58 -0.82 -0.27 -4.23 -1.26 -0.03 115.64 108.53 3kru s THR 68 Ca -0.15 -2.10 0.02 0.00 -1.18 0.00 0.00 61.69 58.27 3kru s THR 68 Cb -0.02 -2.50 0.12 0.00 1.34 0.00 0.00 72.50 71.44 3kru s THR 68 CO 0.55 -0.26 0.73 -0.90 -0.54 0.00 0.00 174.62 174.20 3kru n ASP 69 N -0.60 1.84 -0.13 3.99 5.68 -1.26 -2.54 116.55 123.53 3kru n ASP 69 Ca -0.05 -2.15 0.10 0.00 -0.50 0.00 0.00 54.79 52.18 3kru n ASP 69 Cb 0.64 -0.53 0.15 0.00 -1.14 0.00 0.00 41.12 40.24 3kru n ASP 69 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3kru n HIS 70 N 0.11 0.00 -3.19 2.11 8.25 -1.26 -3.29 115.22 117.95 3kru n HIS 70 Ca 0.05 -1.06 -0.31 0.00 -0.26 0.00 0.00 57.72 56.14 3kru n HIS 70 Cb 0.42 -0.16 -0.04 0.00 1.12 0.00 0.00 29.99 31.32 3kru n HIS 70 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3kru s ASP 71 N -2.92 6.57 0.54 0.41 1.11 -1.05 -0.81 116.67 120.52 3kru s ASP 71 Ca 0.33 0.99 -0.20 0.00 0.18 0.00 0.00 52.55 53.84 3kru s ASP 71 Cb 0.29 -2.26 -0.05 0.00 1.07 0.00 0.00 42.92 41.97 3kru s ASP 71 CO 0.02 -0.22 1.18 -0.76 1.18 0.00 0.00 175.17 176.57 3kru s LEU 72 N -3.33 3.79 0.10 1.23 1.43 -1.26 -4.16 118.68 116.48 3kru s LEU 72 Ca 0.49 2.33 0.05 0.00 -1.03 0.00 0.00 54.13 55.97 3kru s LEU 72 Cb -0.11 -4.49 -0.03 0.00 0.03 0.00 0.00 46.19 41.59 3kru s LEU 72 CO 0.26 -1.32 -0.13 -0.83 0.23 0.00 0.00 176.35 174.56 3kru s GLY 73 N -1.55 0.96 -0.21 -3.19 0.00 -0.44 -1.47 107.32 101.41 3kru s GLY 73 Ca 0.72 -1.18 0.23 0.00 0.00 0.00 0.00 44.72 44.49 3kru s GLY 73 CO 0.32 -1.23 1.14 4.51 0.00 0.00 0.00 173.10 177.84 3kru n ILE 74 N 0.77 0.97 1.29 0.90 3.06 -0.35 -4.81 119.36 121.20 3kru n ILE 74 Ca -0.17 -2.46 0.13 0.00 -2.50 0.00 0.00 62.75 57.75 3kru n ILE 74 Cb 0.56 1.23 0.35 0.00 0.54 0.00 0.00 39.64 42.33 3kru n ILE 74 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 3kru n TRP 75 N -0.44 0.00 -3.94 9.51 2.14 -1.22 -4.50 117.44 119.00 3kru n TRP 75 Ca 0.05 0.00 -0.08 0.00 2.07 0.00 0.00 57.50 59.54 3kru n TRP 75 Cb 0.87 -0.03 -0.08 0.00 -0.81 0.00 0.00 31.31 31.26 3kru n TRP 75 CO 0.00 0.00 0.00 0.54 2.07 0.00 0.00 177.69 180.30 3kru s ASN 76 N -2.15 0.23 0.49 -0.67 2.20 -1.26 -4.95 114.94 108.83 3kru s ASN 76 Ca 0.31 -0.78 0.28 0.00 -0.94 0.00 0.00 52.86 51.73 3kru s ASN 76 Cb 0.20 0.30 1.21 0.00 -2.00 0.00 0.00 41.25 40.97 3kru s ASN 76 CO 0.39 -0.70 1.95 0.44 -2.94 0.00 0.00 177.10 176.23 3kru h ASP 77 N 2.85 0.00 0.74 3.54 3.32 -2.00 -2.75 116.42 122.13 3kru h ASP 77 Ca -0.34 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.66 3kru h ASP 77 Cb 1.18 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 3kru h ASP 77 CO 0.59 0.15 -0.24 -0.33 -1.72 0.00 0.00 179.24 177.68 3kru h GLU 78 N 0.00 0.00 0.00 3.56 3.07 -2.00 -2.78 114.58 116.43 3kru h GLU 78 Ca -0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 3kru h GLU 78 Cb 0.56 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 3kru h GLU 78 CO 0.02 0.24 -0.17 1.96 -1.40 0.00 0.00 179.01 179.66 3kru h GLN 79 N 0.00 0.00 -0.26 2.33 4.20 -1.83 -3.33 115.11 116.21 3kru h GLN 79 Ca -0.00 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.71 3kru h GLN 79 Cb 0.67 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 3kru h GLN 79 CO 0.03 0.17 0.16 0.28 -0.67 0.00 0.00 178.83 178.80 3kru h VAL 80 N 0.00 1.05 0.00 -0.54 2.07 -1.64 -0.87 116.25 116.32 3kru h VAL 80 Ca -0.00 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 3kru h VAL 80 Cb 0.76 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3kru h VAL 80 CO 0.02 0.06 -0.25 0.07 0.02 0.00 0.00 177.57 177.49 3kru h LYS 81 N 0.34 0.00 0.11 1.57 2.10 -1.75 -0.79 116.57 118.14 3kru h LYS 81 Ca 0.10 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.60 3kru h LYS 81 Cb -0.02 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.32 3kru h LYS 81 CO -0.04 0.25 -0.65 0.93 -2.00 0.00 0.00 179.45 177.95 3kru h GLU 82 N 0.00 0.23 -0.67 0.07 4.39 -1.67 -3.29 114.58 113.63 3kru h GLU 82 Ca -0.00 -0.38 0.06 0.00 0.34 0.00 0.00 59.36 59.37 3kru h GLU 82 Cb 0.73 0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 29.49 3kru h GLU 82 CO 0.03 1.18 0.44 -0.07 -1.16 0.00 0.00 179.01 179.44 3kru h LEU 83 N -0.52 0.62 -2.04 1.33 3.38 -1.03 -1.98 115.31 115.06 3kru h LEU 83 Ca -0.12 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.97 3kru h LEU 83 Cb 1.50 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 3kru h LEU 83 CO 0.11 0.41 0.32 0.50 0.09 0.00 0.00 178.44 179.86 3kru h LYS 84 N 0.71 0.00 -0.47 1.13 3.64 -1.21 -0.59 116.57 119.77 3kru h LYS 84 Ca 0.28 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.59 3kru h LYS 84 Cb 0.22 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 3kru h LYS 84 CO -0.09 0.00 -0.01 0.87 -2.27 0.00 0.00 179.45 177.95 3kru h LYS 85 N 0.00 0.78 0.07 1.90 1.57 -1.44 0.42 116.57 119.86 3kru h LYS 85 Ca 0.19 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3kru h LYS 85 Cb 0.82 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.04 3kru h LYS 85 CO -0.00 0.80 -0.03 0.82 -0.57 0.00 0.00 179.45 180.46 3kru h ILE 86 N 0.73 1.19 -0.22 1.86 2.04 -1.24 -2.96 117.51 118.91 3kru h ILE 86 Ca 0.14 -0.93 0.05 0.00 1.00 0.00 0.00 64.86 65.13 3kru h ILE 86 Cb 0.46 1.79 -0.06 0.00 -0.74 0.00 0.00 36.82 38.27 3kru h ILE 86 CO 0.02 0.23 -0.14 0.58 0.00 0.00 0.00 178.15 178.84 3kru h VAL 87 N -0.51 0.59 -0.58 1.67 2.07 -1.24 -1.89 116.25 116.36 3kru h VAL 87 Ca -0.01 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 3kru h VAL 87 Cb 0.44 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 3kru h VAL 87 CO 0.01 0.00 0.24 0.44 0.02 0.00 0.00 177.57 178.29 3kru h ASP 88 N -0.13 0.79 -0.02 0.57 3.32 -0.96 -1.04 116.42 118.94 3kru h ASP 88 Ca 0.13 -0.16 -0.16 0.00 0.02 0.00 0.00 57.03 56.86 3kru h ASP 88 Cb 0.32 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 3kru h ASP 88 CO -0.30 0.73 -0.53 -0.29 -1.72 0.00 0.00 179.24 177.13 3kru h ILE 89 N 0.80 1.31 -0.27 0.35 2.10 -1.42 0.46 117.51 120.84 3kru h ILE 89 Ca 0.19 -1.76 -0.07 0.00 1.08 0.00 0.00 64.86 64.30 3kru h ILE 89 Cb 0.18 1.72 -0.01 0.00 -1.09 0.00 0.00 36.82 37.62 3kru h ILE 89 CO -0.02 0.55 -0.13 0.00 -1.08 0.00 0.00 178.15 177.48 3kru h LYS 91 N 0.29 0.66 -0.36 0.00 1.57 -1.14 -2.30 116.57 115.28 3kru h LYS 91 Ca 0.06 -0.23 0.03 0.00 -1.87 0.00 0.00 60.65 58.63 3kru h LYS 91 Cb 0.63 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 3kru h LYS 91 CO 0.04 0.80 0.24 0.00 -0.57 0.00 0.00 179.45 179.96 3kru h ALA 92 N 1.22 1.86 -0.59 3.86 0.00 -0.80 -1.92 119.26 122.88 3kru h ALA 92 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3kru h ALA 92 Cb 0.63 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3kru h ALA 92 CO 0.04 0.09 0.00 0.09 0.00 0.00 0.00 179.25 179.48 3kru n ASN 93 N -4.49 3.41 0.00 0.00 4.13 -0.90 -4.94 115.26 112.47 3kru n ASN 93 Ca 0.03 -2.08 0.00 0.00 1.68 0.00 0.00 54.58 54.22 3kru n ASN 93 Cb 0.15 -0.43 0.00 0.00 -1.54 0.00 0.00 39.78 37.96 3kru n ASN 93 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3kru n GLY 94 N 1.37 0.87 3.90 7.41 0.00 -0.72 -4.39 105.19 113.62 3kru n GLY 94 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 3kru n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kru s ALA 95 N -2.00 3.86 0.08 4.61 0.00 -0.91 -4.92 121.76 122.48 3kru s ALA 95 Ca 0.00 -0.62 -0.29 0.00 0.00 0.00 0.00 51.96 51.05 3kru s ALA 95 Cb 0.00 -2.04 -0.05 0.00 0.00 0.00 0.00 23.12 21.03 3kru s ALA 95 CO 0.00 0.70 0.91 0.08 0.00 0.00 0.00 175.76 177.45 3kru s VAL 96 N -1.48 4.59 -0.22 0.00 1.01 -0.31 -3.92 120.40 120.08 3kru s VAL 96 Ca 0.34 1.96 -0.07 0.00 0.00 0.00 0.00 61.98 64.21 3kru s VAL 96 Cb -0.13 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 3kru s VAL 96 CO 0.22 0.31 0.07 -0.32 0.00 0.00 0.00 175.10 175.38 3kru s MET 97 N 0.09 3.83 0.22 2.72 1.75 -1.26 -1.07 119.30 125.58 3kru s MET 97 Ca 0.45 -0.41 0.09 0.00 -1.25 0.00 0.00 55.69 54.58 3kru s MET 97 Cb -0.22 -3.28 -0.04 0.00 2.84 0.00 0.00 34.83 34.12 3kru s MET 97 CO 0.28 0.05 -0.08 0.20 -0.65 0.00 0.00 175.02 174.82 3kru s GLY 98 N 0.99 1.72 -0.06 2.11 0.00 0.28 -0.07 107.32 112.29 3kru s GLY 98 Ca 0.04 -1.58 0.03 0.00 0.00 0.00 0.00 44.72 43.21 3kru s GLY 98 CO 0.03 -1.62 -0.13 -1.50 0.00 0.00 0.00 173.10 169.88 3kru s ILE 99 N -1.99 1.16 -0.60 0.90 2.07 -0.64 -0.82 121.20 121.28 3kru s ILE 99 Ca 0.27 -0.52 -0.22 0.00 -1.41 0.00 0.00 60.65 58.77 3kru s ILE 99 Cb -0.08 -1.04 0.06 0.00 0.13 0.00 0.00 42.46 41.54 3kru s ILE 99 CO 0.17 0.35 0.87 -1.58 -1.91 0.00 0.00 174.94 172.84 3kru s GLN 100 N 0.45 3.17 -0.05 3.50 0.74 -1.06 -0.58 119.66 125.83 3kru s GLN 100 Ca -0.11 -0.74 -0.30 0.00 0.05 0.00 0.00 55.36 54.27 3kru s GLN 100 Cb -0.14 -4.16 -0.03 0.00 1.10 0.00 0.00 33.01 29.77 3kru s GLN 100 CO 0.03 -1.60 1.23 -0.51 -0.55 0.00 0.00 175.29 173.89 3kru s LEU 101 N 3.65 4.28 0.11 3.68 1.43 0.46 -0.63 118.68 131.65 3kru s LEU 101 Ca 0.22 1.85 0.03 0.00 -1.03 0.00 0.00 54.13 55.20 3kru s LEU 101 Cb -0.17 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 3kru s LEU 101 CO 0.13 -0.60 -0.08 0.00 0.23 0.00 0.00 176.35 176.02 3kru s ALA 102 N 2.26 1.11 -0.20 4.21 0.00 -0.47 -1.49 121.76 127.18 3kru s ALA 102 Ca 0.57 -1.32 -0.05 0.00 0.00 0.00 0.00 51.96 51.16 3kru s ALA 102 Cb -0.25 0.10 0.10 0.00 0.00 0.00 0.00 23.12 23.06 3kru s ALA 102 CO 0.22 -0.15 0.37 -1.58 0.00 0.00 0.00 175.76 174.62 3kru s HIS 103 N -3.18 -0.70 -0.27 0.00 2.46 -1.26 -1.38 115.29 110.96 3kru s HIS 103 Ca 0.11 1.16 0.28 0.00 0.47 0.00 0.00 55.06 57.08 3kru s HIS 103 Cb 0.02 0.13 1.08 0.00 -0.13 0.00 0.00 32.58 33.68 3kru s HIS 103 CO -0.02 -0.53 1.82 0.00 -2.47 0.00 0.00 174.74 173.55 3kru h ALA 104 N 8.21 1.00 -0.37 1.58 0.00 -0.99 -0.53 119.26 128.16 3kru h ALA 104 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3kru h ALA 104 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3kru h ALA 104 CO 0.17 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.83 3kru n GLY 105 N 0.20 2.95 0.01 0.00 0.00 -1.26 -1.53 105.19 105.56 3kru n GLY 105 Ca 0.02 -0.02 0.06 0.00 0.00 0.00 0.00 46.02 46.08 3kru n GLY 105 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3kru n ARG 106 N 14.00 0.02 -0.20 1.61 1.85 -0.76 -1.92 116.66 131.26 3kru n ARG 106 Ca 0.00 0.30 0.09 0.00 -1.00 0.00 0.00 57.85 57.25 3kru n ARG 106 Cb 0.00 -1.53 0.26 0.00 -1.05 0.00 0.00 32.46 30.14 3kru n ARG 106 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3kru n LYS 107 N -1.56 2.12 -1.70 2.89 5.02 -0.58 -4.60 118.16 119.75 3kru n LYS 107 Ca 0.03 -1.73 -0.42 0.00 -2.02 0.00 0.00 58.31 54.17 3kru n LYS 107 Cb 0.15 -1.42 -0.03 0.00 -0.02 0.00 0.00 35.03 33.71 3kru n LYS 107 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kru n ASN 109 N 6.33 5.33 -4.56 0.00 5.15 0.96 -4.76 115.26 123.71 3kru n ASN 109 Ca 0.18 -2.96 -0.40 0.00 -0.60 0.00 0.00 54.58 50.80 3kru n ASN 109 Cb 0.39 -0.65 -0.09 0.00 -0.53 0.00 0.00 39.78 38.89 3kru n ASN 109 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3kru s ILE 110 N -2.79 5.18 0.45 -1.44 1.01 -1.25 -4.92 121.20 117.43 3kru s ILE 110 Ca 0.52 0.13 0.11 0.00 0.00 0.00 0.00 60.65 61.41 3kru s ILE 110 Cb 0.40 -3.79 0.24 0.00 0.01 0.00 0.00 42.46 39.33 3kru s ILE 110 CO 0.14 -0.03 2.06 0.77 0.00 0.00 0.00 174.94 177.88 3kru h SER 111 N 8.41 0.23 -0.42 3.58 4.64 -1.97 -2.16 113.55 125.86 3kru h SER 111 Ca -0.30 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 3kru h SER 111 Cb 1.15 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3kru h SER 111 CO 0.68 0.22 0.00 0.00 -0.87 0.00 0.00 176.83 176.86 3kru n TYR 112 N -4.45 0.55 -2.72 4.77 0.18 -1.26 -4.96 117.16 109.27 3kru n TYR 112 Ca -0.00 -0.28 -0.24 0.00 1.88 0.00 0.00 57.90 59.26 3kru n TYR 112 Cb 0.12 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.10 3kru n TYR 112 CO 0.00 0.00 0.00 -1.21 -2.08 0.00 0.00 176.86 173.57 3kru s GLU 113 N -1.45 2.91 -1.12 -3.48 0.41 -0.81 -5.01 118.70 110.16 3kru s GLU 113 Ca 0.37 -0.36 -0.18 0.00 -0.41 0.00 0.00 54.97 54.39 3kru s GLU 113 Cb 0.20 -2.44 0.11 0.00 -1.78 0.00 0.00 34.13 30.22 3kru s GLU 113 CO 0.28 -0.50 1.44 0.34 -0.49 0.00 0.00 175.26 176.33 3kru s ASP 114 N -4.28 6.77 -0.16 -0.19 2.15 -1.26 -4.99 116.67 114.70 3kru s ASP 114 Ca 0.52 -2.25 -0.29 0.00 0.43 0.00 0.00 52.55 50.95 3kru s ASP 114 Cb -0.10 -2.49 -0.01 0.00 -0.30 0.00 0.00 42.92 40.02 3kru s ASP 114 CO 0.41 -1.12 1.17 -0.69 -0.17 0.00 0.00 175.17 174.77 3kru s VAL 115 N 3.36 4.43 0.24 1.11 1.01 -1.26 -4.84 120.40 124.45 3kru s VAL 115 Ca 0.44 1.72 0.08 0.00 0.00 0.00 0.00 61.98 64.22 3kru s VAL 115 Cb -0.01 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 3kru s VAL 115 CO -0.03 -0.11 -0.13 0.68 0.00 0.00 0.00 175.10 175.51 3kru s VAL 116 N 3.09 1.83 0.13 2.92 -7.23 -1.26 -0.74 120.40 119.14 3kru s VAL 116 Ca 0.51 -2.21 -0.26 0.00 -1.81 0.00 0.00 61.98 58.21 3kru s VAL 116 Cb -0.20 -2.22 0.07 0.00 0.56 0.00 0.00 36.38 34.59 3kru s VAL 116 CO 0.14 -0.47 0.96 -0.83 -0.31 0.00 0.00 175.10 174.58 3kru s GLY 117 N -3.39 -0.27 0.33 2.32 0.00 -0.67 -1.82 107.32 103.82 3kru s GLY 117 Ca 0.26 0.25 0.06 0.00 0.00 0.00 0.00 44.72 45.28 3kru s GLY 117 CO 0.10 0.05 1.81 -0.56 0.00 0.00 0.00 173.10 174.50 3kru h PRO 118 N 2.00 0.38 -3.80 2.90 0.13 -1.86 -2.00 132.00 129.76 3kru h PRO 118 Ca -0.24 -0.12 -0.15 0.00 -0.87 0.00 0.00 66.00 64.63 3kru h PRO 118 Cb 1.23 -0.04 -0.20 0.00 0.13 0.00 0.00 31.00 32.13 3kru h PRO 118 CO 0.26 0.56 -0.59 -1.12 -0.23 0.00 0.00 178.00 176.88 3kru s SER 119 N -6.82 0.17 -1.35 1.44 0.01 -1.26 -4.51 113.70 101.38 3kru s SER 119 Ca -0.06 -0.44 -0.16 0.00 1.31 0.00 0.00 55.95 56.60 3kru s SER 119 Cb 0.15 0.17 0.07 0.00 0.21 0.00 0.00 66.02 66.62 3kru s SER 119 CO 0.76 -0.39 1.89 -0.81 0.41 0.00 0.00 173.24 175.11 3kru n PRO 120 N 1.27 3.11 -3.85 12.44 -0.04 -1.26 -4.78 135.00 141.89 3kru n PRO 120 Ca -0.22 -3.10 -0.16 0.00 -0.04 0.00 0.00 63.50 59.98 3kru n PRO 120 Cb 0.56 -3.37 -0.16 0.00 -0.04 0.00 0.00 33.50 30.50 3kru n PRO 120 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3kru s ILE 121 N 3.50 0.05 0.57 0.52 1.01 -1.26 -4.88 121.20 120.71 3kru s ILE 121 Ca 0.50 0.15 -0.18 0.00 0.00 0.00 0.00 60.65 61.12 3kru s ILE 121 Cb 0.07 -0.16 -0.04 0.00 0.01 0.00 0.00 42.46 42.33 3kru s ILE 121 CO 0.01 0.11 1.09 -0.54 0.00 0.00 0.00 174.94 175.61 3kru s LYS 122 N 0.99 3.28 0.48 2.79 1.02 -1.26 -4.51 119.74 122.53 3kru s LYS 122 Ca -0.09 1.42 0.28 0.00 0.02 0.00 0.00 55.97 57.60 3kru s LYS 122 Cb -0.13 -2.01 0.93 0.00 -0.52 0.00 0.00 37.83 36.10 3kru s LYS 122 CO -0.02 -0.87 1.82 0.00 -0.92 0.00 0.00 175.35 175.36 3kru h ALA 123 N 0.79 0.99 0.00 5.17 0.00 -1.82 -3.48 119.26 120.90 3kru h ALA 123 Ca -0.48 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3kru h ALA 123 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3kru h ALA 123 CO 0.57 0.10 0.00 0.41 0.00 0.00 0.00 179.25 180.32 3kru n GLY 124 N 0.40 0.26 0.34 0.00 0.00 -1.26 -4.58 105.19 100.35 3kru n GLY 124 Ca 0.01 -1.05 0.08 0.00 0.00 0.00 0.00 46.02 45.06 3kru n GLY 124 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3kru h ASP 125 N 0.00 0.51 0.96 1.61 3.45 -2.01 -1.81 116.42 119.12 3kru h ASP 125 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3kru h ASP 125 Cb 0.00 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 38.66 3kru h ASP 125 CO 0.00 0.33 -0.02 0.54 -1.57 0.00 0.00 179.24 178.52 3kru n ARG 126 N -4.47 0.02 -3.17 3.56 1.74 -1.26 -4.90 116.66 108.17 3kru n ARG 126 Ca 0.08 -0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.92 3kru n ARG 126 Cb 0.23 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.17 3kru n ARG 126 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3kru s TYR 127 N -2.98 3.42 0.42 -1.55 2.02 -0.68 -5.08 117.35 112.92 3kru s TYR 127 Ca 0.15 0.36 -0.22 0.00 -0.37 0.00 0.00 57.07 56.99 3kru s TYR 127 Cb 0.19 -2.07 -0.10 0.00 -0.40 0.00 0.00 41.96 39.58 3kru s TYR 127 CO 0.53 -0.07 0.99 0.21 -1.57 0.00 0.00 175.55 175.64 3kru s LYS 128 N -4.44 4.16 -0.06 -0.62 2.20 -1.26 -4.88 119.74 114.85 3kru s LYS 128 Ca 0.43 1.29 -0.30 0.00 -0.36 0.00 0.00 55.97 57.04 3kru s LYS 128 Cb -0.10 -2.33 -0.05 0.00 -1.51 0.00 0.00 37.83 33.85 3kru s LYS 128 CO 0.38 -0.10 1.50 -1.17 -0.36 0.00 0.00 175.35 175.59 3kru s LEU 129 N -2.97 4.29 0.47 5.43 2.96 -1.26 -4.65 118.68 122.94 3kru s LEU 129 Ca 0.61 2.10 -0.21 0.00 -0.22 0.00 0.00 54.13 56.40 3kru s LEU 129 Cb -0.15 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.91 3kru s LEU 129 CO 0.19 -0.83 1.03 -2.16 -1.32 0.00 0.00 176.35 173.26 3kru s PRO 130 N 3.42 3.90 -0.06 0.98 0.04 -1.26 -4.93 135.00 137.08 3kru s PRO 130 Ca 0.67 1.35 -0.29 0.00 0.04 0.00 0.00 61.00 62.77 3kru s PRO 130 Cb -0.31 -2.16 -0.02 0.00 0.04 0.00 0.00 34.50 32.05 3kru s PRO 130 CO 0.26 -0.34 0.96 0.50 0.04 0.00 0.00 177.00 178.42 3kru s ARG 131 N -3.13 4.48 -0.15 4.56 3.52 0.09 -4.37 118.95 123.94 3kru s ARG 131 Ca 0.65 1.35 -0.29 0.00 -0.13 0.00 0.00 55.73 57.31 3kru s ARG 131 Cb -0.16 -3.50 -0.03 0.00 -1.56 0.00 0.00 34.95 29.70 3kru s ARG 131 CO 0.20 -0.17 1.52 -2.00 -0.81 0.00 0.00 175.30 174.03 3kru s GLU 132 N 1.50 4.06 0.31 5.12 2.12 -1.26 -1.67 118.70 128.89 3kru s GLU 132 Ca 0.49 1.83 -0.29 0.00 0.36 0.00 0.00 54.97 57.36 3kru s GLU 132 Cb -0.19 -3.94 -0.10 0.00 0.26 0.00 0.00 34.13 30.16 3kru s GLU 132 CO 0.22 -0.96 1.31 -0.51 -0.54 0.00 0.00 175.26 174.78 3kru s LEU 133 N 4.27 4.43 0.70 2.70 1.43 -0.75 -4.96 118.68 126.49 3kru s LEU 133 Ca 0.67 2.65 -0.10 0.00 -1.03 0.00 0.00 54.13 56.32 3kru s LEU 133 Cb -0.27 -3.64 0.03 0.00 0.03 0.00 0.00 46.19 42.34 3kru s LEU 133 CO 0.25 -0.53 1.07 -0.94 0.23 0.00 0.00 176.35 176.42 3kru s SER 134 N -0.37 5.19 0.24 2.29 1.04 -1.26 -4.90 113.70 115.93 3kru s SER 134 Ca 0.50 0.89 -0.07 0.00 0.48 0.00 0.00 55.95 57.75 3kru s SER 134 Cb -0.39 -1.64 0.24 0.00 0.10 0.00 0.00 66.02 64.33 3kru s SER 134 CO 0.51 -1.44 1.92 0.58 0.98 0.00 0.00 173.24 175.78 3kru h VAL 135 N -0.64 1.24 -0.85 5.02 2.07 -1.99 -0.59 116.25 120.50 3kru h VAL 135 Ca -0.45 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 66.60 3kru h VAL 135 Cb 1.28 -0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 3kru h VAL 135 CO 0.63 0.23 0.42 -0.33 0.02 0.00 0.00 177.57 178.55 3kru h GLU 136 N 1.28 1.22 -0.53 1.57 5.08 -1.99 -0.99 114.58 120.22 3kru h GLU 136 Ca 0.35 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 58.44 3kru h GLU 136 Cb -0.14 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 28.87 3kru h GLU 136 CO -0.08 0.93 -0.07 0.93 -1.00 0.00 0.00 179.01 179.72 3kru h GLU 137 N 1.21 0.98 -0.44 2.33 5.08 -1.82 -1.22 114.58 120.69 3kru h GLU 137 Ca 0.29 -0.35 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 3kru h GLU 137 Cb 0.10 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 3kru h GLU 137 CO -0.04 1.02 0.21 0.82 -1.00 0.00 0.00 179.01 180.02 3kru h ILE 138 N 0.85 0.94 -0.70 3.13 2.04 -0.83 -0.94 117.51 122.00 3kru h ILE 138 Ca 0.14 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.88 3kru h ILE 138 Cb 0.62 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 3kru h ILE 138 CO 0.04 0.08 0.46 0.11 0.00 0.00 0.00 178.15 178.84 3kru h LYS 139 N 0.42 0.87 -0.72 2.37 6.56 -0.89 -0.33 116.57 124.85 3kru h LYS 139 Ca 0.20 -0.05 -0.05 0.00 -1.06 0.00 0.00 60.65 59.69 3kru h LYS 139 Cb 0.12 -0.20 -0.03 0.00 -0.57 0.00 0.00 32.23 31.55 3kru h LYS 139 CO -0.15 0.57 0.27 0.77 -2.06 0.00 0.00 179.45 178.85 3kru h SER 140 N 0.89 0.99 -0.28 0.86 0.02 -0.31 -0.18 113.55 115.54 3kru h SER 140 Ca 0.27 -0.15 -0.17 0.00 -0.84 0.00 0.00 61.79 60.90 3kru h SER 140 Cb -0.02 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.26 3kru h SER 140 CO -0.07 0.89 -0.49 0.40 -1.14 0.00 0.00 176.83 176.43 3kru h ILE 141 N 1.05 1.29 -0.42 3.27 2.04 -0.44 -0.47 117.51 123.83 3kru h ILE 141 Ca 0.24 -1.68 0.08 0.00 1.00 0.00 0.00 64.86 64.50 3kru h ILE 141 Cb 0.22 1.66 -0.07 0.00 -0.74 0.00 0.00 36.82 37.89 3kru h ILE 141 CO -0.02 0.54 -0.05 0.58 0.00 0.00 0.00 178.15 179.20 3kru h VAL 142 N 0.58 0.63 -0.74 1.67 2.07 -0.88 -0.83 116.25 118.75 3kru h VAL 142 Ca 0.02 -0.02 0.06 0.00 0.82 0.00 0.00 66.70 67.58 3kru h VAL 142 Cb 1.09 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 31.38 3kru h VAL 142 CO 0.11 0.01 0.43 0.50 0.02 0.00 0.00 177.57 178.64 3kru h LYS 143 N 0.05 0.76 -0.77 1.57 3.64 -0.71 -2.04 116.57 119.07 3kru h LYS 143 Ca 0.21 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.59 3kru h LYS 143 Cb 0.31 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 31.90 3kru h LYS 143 CO -0.39 0.50 0.47 0.00 -2.27 0.00 0.00 179.45 177.76 3kru h ALA 144 N 1.37 1.03 -0.62 5.00 0.00 -0.27 -0.13 119.26 125.64 3kru h ALA 144 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3kru h ALA 144 Cb 0.19 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3kru h ALA 144 CO -0.18 0.21 0.40 0.74 0.00 0.00 0.00 179.25 180.42 3kru h PHE 145 N 0.88 0.80 -0.31 0.00 0.04 -0.50 -0.70 116.94 117.15 3kru h PHE 145 Ca 0.33 0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.11 3kru h PHE 145 Cb 0.12 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 37.98 3kru h PHE 145 CO -0.05 0.52 0.20 0.78 -0.60 0.00 0.00 178.31 179.17 3kru h GLY 146 N 0.84 0.43 0.91 -1.45 0.00 -0.83 -1.08 103.07 101.91 3kru h GLY 146 Ca 0.23 -0.16 0.03 0.00 0.00 0.00 0.00 47.33 47.42 3kru h GLY 146 CO -0.05 0.16 0.54 0.83 0.00 0.00 0.00 176.54 178.02 3kru h GLU 147 N 0.41 1.03 -0.73 4.80 5.08 -0.90 -0.74 114.58 123.54 3kru h GLU 147 Ca 0.11 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 3kru h GLU 147 Cb -0.04 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 28.94 3kru h GLU 147 CO -0.02 0.68 0.31 0.00 -1.00 0.00 0.00 179.01 178.98 3kru h ALA 148 N 1.33 0.95 -0.64 3.43 0.00 -0.85 -1.26 119.26 122.22 3kru h ALA 148 Ca 0.32 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3kru h ALA 148 Cb -0.03 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3kru h ALA 148 CO -0.10 0.56 0.16 0.00 0.00 0.00 0.00 179.25 179.86 3kru h ALA 149 N 1.15 0.84 -0.40 0.00 0.00 -0.70 0.34 119.26 120.49 3kru h ALA 149 Ca 0.25 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.95 3kru h ALA 149 Cb 0.19 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3kru h ALA 149 CO -0.02 0.56 0.21 -0.22 0.00 0.00 0.00 179.25 179.77 3kru h LYS 150 N 0.94 0.41 -0.79 0.00 3.64 -0.77 -1.11 116.57 118.90 3kru h LYS 150 Ca 0.20 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.53 3kru h LYS 150 Cb 0.36 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 3kru h LYS 150 CO 0.00 0.27 0.41 0.00 -2.27 0.00 0.00 179.45 177.86 3kru h ARG 151 N 0.42 1.13 -0.66 1.90 3.08 -1.00 -2.11 114.38 117.13 3kru h ARG 151 Ca 0.17 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 3kru h ARG 151 Cb 0.07 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.88 3kru h ARG 151 CO -0.11 0.85 0.36 0.00 -1.07 0.00 0.00 179.97 179.99 3kru h ALA 152 N 1.21 0.85 -0.76 0.04 0.00 -0.45 0.36 119.26 120.51 3kru h ALA 152 Ca 0.28 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3kru h ALA 152 Cb 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3kru h ALA 152 CO -0.04 0.37 0.35 -0.97 0.00 0.00 0.00 179.25 178.96 3kru h ASN 153 N 0.91 1.02 -0.76 0.00 -1.24 -1.02 -1.96 115.58 112.52 3kru h ASN 153 Ca 0.23 -0.15 -0.02 0.00 0.71 0.00 0.00 56.30 57.07 3kru h ASN 153 Cb 0.05 -0.26 -0.04 0.00 0.73 0.00 0.00 38.32 38.80 3kru h ASN 153 CO -0.04 0.88 0.38 -0.07 -1.29 0.00 0.00 177.43 177.30 3kru h LEU 154 N 1.09 0.99 -0.94 0.34 3.38 -0.75 -1.88 115.31 117.53 3kru h LEU 154 Ca 0.26 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3kru h LEU 154 Cb 0.15 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3kru h LEU 154 CO -0.03 0.83 0.00 0.00 0.09 0.00 0.00 178.44 179.33 3kru h ALA 155 N 1.33 1.00 0.00 1.53 0.00 -0.64 -3.47 119.26 119.00 3kru h ALA 155 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3kru h ALA 155 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3kru h ALA 155 CO -0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.62 3kru n GLY 156 N 0.23 1.03 3.68 0.00 0.00 -0.71 -4.51 105.19 104.91 3kru n GLY 156 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 3kru n GLY 156 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kru n TYR 157 N -1.87 1.65 -0.01 1.61 4.01 -0.89 -4.94 117.16 116.73 3kru n TYR 157 Ca 0.00 0.47 -0.11 0.00 -0.16 0.00 0.00 57.90 58.09 3kru n TYR 157 Cb 0.00 -2.28 -0.14 0.00 -0.31 0.00 0.00 39.34 36.61 3kru n TYR 157 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3kru h ASP 158 N 1.32 0.10 -3.88 7.72 3.32 -0.83 -3.44 116.42 120.72 3kru h ASP 158 Ca -0.48 -0.21 -0.37 0.00 0.02 0.00 0.00 57.03 55.98 3kru h ASP 158 Cb 1.32 -0.03 -0.29 0.00 0.22 0.00 0.00 39.33 40.55 3kru h ASP 158 CO 0.56 1.19 -0.77 -0.69 -1.72 0.00 0.00 179.24 177.81 3kru s VAL 159 N -2.60 0.56 -0.10 -1.35 1.01 -0.95 -4.05 120.40 112.93 3kru s VAL 159 Ca -0.08 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.64 3kru s VAL 159 Cb 0.08 -0.49 -0.02 0.00 0.00 0.00 0.00 36.38 35.95 3kru s VAL 159 CO 0.82 0.17 -0.13 0.54 0.00 0.00 0.00 175.10 176.49 3kru s VAL 160 N 0.02 3.09 -0.13 2.92 0.11 -1.13 -1.62 120.40 123.66 3kru s VAL 160 Ca 0.00 -0.68 0.01 0.00 -2.93 0.00 0.00 61.98 58.39 3kru s VAL 160 Cb -0.05 -2.26 -0.00 0.00 -1.53 0.00 0.00 36.38 32.54 3kru s VAL 160 CO -0.00 0.55 -0.18 -0.70 -3.33 0.00 0.00 175.10 171.44 3kru s GLU 161 N -0.11 3.20 -0.24 1.54 2.12 0.25 -0.74 118.70 124.73 3kru s GLU 161 Ca -0.01 -0.78 -0.21 0.00 0.36 0.00 0.00 54.97 54.32 3kru s GLU 161 Cb -0.14 -2.51 -0.02 0.00 0.26 0.00 0.00 34.13 31.73 3kru s GLU 161 CO 0.04 0.13 0.68 0.42 -0.54 0.00 0.00 175.26 175.98 3kru s ILE 162 N 0.52 4.96 -0.87 -3.70 1.01 -0.18 -0.40 121.20 122.54 3kru s ILE 162 Ca -0.11 1.25 -0.23 0.00 0.00 0.00 0.00 60.65 61.56 3kru s ILE 162 Cb -0.16 -3.98 0.06 0.00 0.01 0.00 0.00 42.46 38.39 3kru s ILE 162 CO 0.04 0.02 1.27 -2.28 0.00 0.00 0.00 174.94 174.00 3kru s HIS 163 N 2.44 2.58 -0.26 3.97 2.46 -0.55 -1.31 115.29 124.61 3kru s HIS 163 Ca 0.29 -0.65 0.12 0.00 0.47 0.00 0.00 55.06 55.29 3kru s HIS 163 Cb -0.16 -4.55 0.61 0.00 -0.13 0.00 0.00 32.58 28.36 3kru s HIS 163 CO 0.09 -1.86 1.59 0.00 -2.47 0.00 0.00 174.74 172.08 3kru n ALA 164 N 8.46 3.93 -4.34 1.58 0.00 0.77 -4.58 120.51 126.32 3kru n ALA 164 Ca 0.17 -2.52 -0.20 0.00 0.00 0.00 0.00 53.44 50.89 3kru n ALA 164 Cb 0.49 -0.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.97 3kru n ALA 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kru n ALA 165 N -0.52 0.31 -2.09 0.00 0.00 -0.98 -3.65 120.51 113.58 3kru n ALA 165 Ca 0.32 -1.42 -0.21 0.00 0.00 0.00 0.00 53.44 52.13 3kru n ALA 165 Cb 1.13 0.84 -0.04 0.00 0.00 0.00 0.00 19.45 21.38 3kru n ALA 165 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3kru n HIS 166 N -0.73 -0.61 -0.88 0.00 8.25 -1.21 -2.08 115.22 117.96 3kru n HIS 166 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 3kru n HIS 166 Cb 0.41 -3.80 0.00 0.00 1.12 0.00 0.00 29.99 27.72 3kru n HIS 166 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kru n GLY 167 N -0.77 0.55 0.00 -1.41 0.00 -1.25 -4.47 105.19 97.84 3kru n GLY 167 Ca -0.23 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.73 3kru n GLY 167 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kru n TYR 168 N -2.88 -2.51 0.06 1.61 4.01 -0.88 -4.58 117.16 111.98 3kru n TYR 168 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.62 3kru n TYR 168 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 38.96 3kru n TYR 168 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3kru h LEU 169 N 0.00 -0.10 -0.56 7.72 5.85 -1.19 -0.02 115.31 127.02 3kru h LEU 169 Ca 0.00 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.67 3kru h LEU 169 Cb 0.00 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3kru h LEU 169 CO 0.00 -0.06 0.10 0.40 -0.34 0.00 0.00 178.44 178.54 3kru h ILE 170 N -0.08 1.25 -0.98 4.05 2.04 -1.81 -1.92 117.51 120.07 3kru h ILE 170 Ca 0.01 -0.96 0.03 0.00 1.00 0.00 0.00 64.86 64.94 3kru h ILE 170 Cb 0.08 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 36.90 3kru h ILE 170 CO -0.02 0.35 0.64 -0.74 0.00 0.00 0.00 178.15 178.38 3kru h HIS 171 N 0.81 1.20 -0.66 1.37 2.76 -1.54 -1.26 115.15 117.83 3kru h HIS 171 Ca 0.17 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 3kru h HIS 171 Cb 0.40 -0.40 -0.03 0.00 1.55 0.00 0.00 27.41 28.93 3kru h HIS 171 CO 0.03 0.70 0.42 0.93 -1.30 0.00 0.00 177.93 178.71 3kru h GLU 172 N 1.25 0.88 -0.27 5.26 5.08 -0.23 -0.98 114.58 125.57 3kru h GLU 172 Ca 0.39 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.54 3kru h GLU 172 Cb -0.02 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 3kru h GLU 172 CO -0.11 0.60 -0.41 0.74 -1.00 0.00 0.00 179.01 178.82 3kru h PHE 173 N 0.90 0.79 -0.04 4.33 0.04 -0.87 -3.16 116.94 118.92 3kru h PHE 173 Ca 0.24 -0.23 -0.12 0.00 2.80 0.00 0.00 57.97 60.66 3kru h PHE 173 Cb -0.07 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 37.90 3kru h PHE 173 CO 0.00 0.96 -0.53 -0.07 -0.60 0.00 0.00 178.31 178.07 3kru h LEU 174 N 0.54 0.12 -9.23 1.54 3.38 -0.11 -3.44 115.31 108.11 3kru h LEU 174 Ca 0.04 -0.06 -0.59 0.00 0.09 0.00 0.00 57.88 57.37 3kru h LEU 174 Cb 0.94 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.56 3kru h LEU 174 CO 0.08 0.63 -0.08 -0.55 0.09 0.00 0.00 178.44 178.61 3kru s SER 175 N -6.88 6.63 0.65 -0.43 0.15 -0.54 -4.91 113.70 108.37 3kru s SER 175 Ca -0.03 0.75 0.38 0.00 0.70 0.00 0.00 55.95 57.75 3kru s SER 175 Cb 0.13 -2.29 2.08 0.00 -1.71 0.00 0.00 66.02 64.23 3kru s SER 175 CO 0.77 -0.09 2.22 -0.65 1.20 0.00 0.00 173.24 176.69 3kru h PRO 176 N 7.09 0.00 0.00 5.44 0.11 -1.83 -0.93 132.00 141.88 3kru h PRO 176 Ca -0.37 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.70 3kru h PRO 176 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3kru h PRO 176 CO 0.75 0.00 -0.17 -0.07 -0.21 0.00 0.00 178.00 178.30 3kru h LEU 177 N 0.00 0.00 0.00 2.35 3.38 -1.92 -3.31 115.31 115.81 3kru h LEU 177 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3kru h LEU 177 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3kru h LEU 177 CO -0.00 0.17 -0.79 -1.54 0.09 0.00 0.00 178.44 176.37 3kru n SER 178 N -3.33 3.52 -4.22 -0.43 3.41 -0.86 -4.93 113.62 106.78 3kru n SER 178 Ca 0.00 -0.14 -0.40 0.00 -0.26 0.00 0.00 58.87 58.07 3kru n SER 178 Cb 0.40 1.04 -0.09 0.00 -0.26 0.00 0.00 64.21 65.30 3kru n SER 178 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3kru s ASN 179 N -1.87 5.64 -0.17 4.04 3.84 -0.41 -4.02 114.94 121.99 3kru s ASN 179 Ca -0.00 -1.81 0.16 0.00 0.21 0.00 0.00 52.86 51.42 3kru s ASN 179 Cb 0.01 -1.99 0.59 0.00 -0.55 0.00 0.00 41.25 39.31 3kru s ASN 179 CO 0.05 -0.64 1.50 0.29 -2.79 0.00 0.00 177.10 175.51 3kru n LYS 180 N 4.88 3.43 -1.97 0.43 4.76 -1.26 -4.65 118.16 123.78 3kru n LYS 180 Ca -0.08 -2.86 -0.36 0.00 -2.87 0.00 0.00 58.31 52.14 3kru n LYS 180 Cb 0.41 -1.90 0.04 0.00 -1.84 0.00 0.00 35.03 31.74 3kru n LYS 180 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3kru s ARG 181 N -2.60 2.96 -0.03 1.97 0.52 -1.26 -4.95 118.95 115.56 3kru s ARG 181 Ca 0.44 1.89 0.06 0.00 -0.52 0.00 0.00 55.73 57.60 3kru s ARG 181 Cb 0.34 -1.96 0.14 0.00 0.52 0.00 0.00 34.95 33.99 3kru s ARG 181 CO 0.12 -1.23 1.10 1.63 0.02 0.00 0.00 175.30 176.94 3kru n LYS 182 N -1.54 2.67 -0.07 3.54 4.76 -1.26 -3.23 118.16 123.03 3kru n LYS 182 Ca 0.13 -1.87 0.00 0.00 -2.87 0.00 0.00 58.31 53.70 3kru n LYS 182 Cb 0.49 -1.19 0.00 0.00 -1.84 0.00 0.00 35.03 32.49 3kru n LYS 182 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3kru n ASP 183 N -0.48 0.00 0.00 4.39 5.75 -1.26 -4.93 116.55 120.02 3kru n ASP 183 Ca 0.06 -0.08 0.08 0.00 -0.01 0.00 0.00 54.79 54.85 3kru n ASP 183 Cb 0.39 0.00 0.40 0.00 -1.03 0.00 0.00 41.12 40.88 3kru n ASP 183 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 3kru n GLU 184 N -0.08 0.20 -0.22 0.11 0.00 -1.26 -2.10 120.64 117.30 3kru n GLU 184 Ca 0.00 0.15 0.11 0.00 0.00 0.00 0.00 57.16 57.42 3kru n GLU 184 Cb 0.00 -1.50 0.23 0.00 0.00 0.00 0.00 31.44 30.17 3kru n GLU 184 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3kru n TYR 185 N -1.31 0.57 -4.13 -1.84 4.01 -1.26 -4.55 117.16 108.64 3kru n TYR 185 Ca 0.07 -0.30 -0.15 0.00 -0.16 0.00 0.00 57.90 57.36 3kru n TYR 185 Cb 0.14 -0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.11 3kru n TYR 185 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3kru s GLY 186 N -1.36 1.57 0.00 2.72 0.00 -0.89 -3.97 107.32 105.39 3kru s GLY 186 Ca 0.39 -1.60 0.00 0.00 0.00 0.00 0.00 44.72 43.52 3kru s GLY 186 CO 0.31 -1.11 0.00 -2.01 0.00 0.00 0.00 173.10 170.28 3kru n ASN 187 N -1.19 -2.81 -3.59 1.64 4.05 -1.20 -4.66 115.26 107.50 3kru n ASN 187 Ca 0.02 0.00 -0.11 0.00 0.45 0.00 0.00 54.58 54.94 3kru n ASN 187 Cb 0.62 -1.27 -0.04 0.00 1.23 0.00 0.00 39.78 40.32 3kru n ASN 187 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 3kru s SER 188 N -2.20 -0.31 0.24 1.20 1.04 -1.26 -5.01 113.70 107.39 3kru s SER 188 Ca 0.00 -0.23 -0.05 0.00 0.48 0.00 0.00 55.95 56.15 3kru s SER 188 Cb 0.00 0.50 0.24 0.00 0.10 0.00 0.00 66.02 66.86 3kru s SER 188 CO 0.00 -0.87 1.78 -0.29 0.98 0.00 0.00 173.24 174.84 3kru h ILE 189 N 2.32 1.25 -0.71 -1.02 2.10 -1.99 0.21 117.51 119.67 3kru h ILE 189 Ca -0.34 -0.87 -0.05 0.00 1.08 0.00 0.00 64.86 64.69 3kru h ILE 189 Cb 1.26 0.51 -0.03 0.00 -1.09 0.00 0.00 36.82 37.47 3kru h ILE 189 CO 0.45 0.34 0.26 -0.33 -1.08 0.00 0.00 178.15 177.79 3kru h GLU 190 N 1.00 1.07 -0.20 2.19 3.07 -1.96 -1.54 114.58 118.21 3kru h GLU 190 Ca 0.22 -0.21 -0.15 0.00 -0.50 0.00 0.00 59.36 58.72 3kru h GLU 190 Cb 0.29 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 3kru h GLU 190 CO -0.01 0.90 -0.51 -0.91 -1.40 0.00 0.00 179.01 177.08 3kru h ASN 191 N 1.02 0.61 0.50 1.42 2.35 -1.70 -2.75 115.58 117.04 3kru h ASN 191 Ca 0.23 -0.31 -0.08 0.00 -0.55 0.00 0.00 56.30 55.59 3kru h ASN 191 Cb 0.24 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 3kru h ASN 191 CO -0.02 1.02 -0.37 0.03 -1.65 0.00 0.00 177.43 176.44 3kru h ARG 192 N 0.44 0.00 0.00 0.81 3.08 -0.72 -2.42 114.38 115.57 3kru h ARG 192 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3kru h ARG 192 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.09 3kru h ARG 192 CO 0.10 0.37 -0.04 0.00 -1.07 0.00 0.00 179.97 179.32 3kru n ALA 193 N -2.40 2.39 -0.12 0.04 0.00 -0.60 -3.94 120.51 115.88 3kru n ALA 193 Ca -0.01 -0.09 -0.07 0.00 0.00 0.00 0.00 53.44 53.26 3kru n ALA 193 Cb 0.43 -1.45 0.01 0.00 0.00 0.00 0.00 19.45 18.44 3kru n ALA 193 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3kru h ARG 194 N 0.00 0.45 -0.34 0.00 2.43 -1.13 -1.51 114.38 114.27 3kru h ARG 194 Ca 0.00 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.15 3kru h ARG 194 Cb 0.57 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 3kru h ARG 194 CO 0.00 0.30 0.21 0.35 -1.51 0.00 0.00 179.97 179.32 3kru h PHE 195 N 0.46 0.40 -0.45 2.20 3.57 -1.77 -0.30 116.94 121.05 3kru h PHE 195 Ca 0.16 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.67 3kru h PHE 195 Cb 0.01 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 3kru h PHE 195 CO -0.07 0.24 0.29 1.25 -2.23 0.00 0.00 178.31 177.79 3kru h LEU 196 N 0.43 0.52 -0.61 0.59 5.85 -1.73 -0.61 115.31 119.75 3kru h LEU 196 Ca 0.13 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 3kru h LEU 196 Cb -0.02 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 3kru h LEU 196 CO -0.05 0.38 0.31 0.40 -0.34 0.00 0.00 178.44 179.15 3kru h ILE 197 N 0.61 1.20 -0.68 4.05 2.04 -1.00 -0.74 117.51 123.00 3kru h ILE 197 Ca 0.16 -0.55 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 3kru h ILE 197 Cb -0.06 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 36.44 3kru h ILE 197 CO -0.03 0.23 0.24 -0.33 0.00 0.00 0.00 178.15 178.25 3kru h GLU 198 N 0.82 1.04 -0.25 2.37 5.08 -0.78 -1.05 114.58 121.81 3kru h GLU 198 Ca 0.21 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3kru h GLU 198 Cb 0.08 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 3kru h GLU 198 CO -0.03 0.88 0.14 0.28 -1.00 0.00 0.00 179.01 179.28 3kru h VAL 199 N 0.98 1.11 -0.60 3.13 2.07 -0.79 -0.89 116.25 121.26 3kru h VAL 199 Ca 0.22 -0.29 0.04 0.00 0.82 0.00 0.00 66.70 67.50 3kru h VAL 199 Cb 0.26 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 3kru h VAL 199 CO -0.01 0.11 0.34 0.40 0.02 0.00 0.00 177.57 178.42 3kru h ILE 200 N 0.29 1.00 -0.67 4.57 2.04 -0.93 0.63 117.51 124.44 3kru h ILE 200 Ca 0.09 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 3kru h ILE 200 Cb 0.05 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 3kru h ILE 200 CO -0.01 0.12 0.25 0.44 0.00 0.00 0.00 178.15 178.94 3kru h ASP 201 N 0.65 0.95 0.15 1.72 3.32 -0.85 -0.27 116.42 122.09 3kru h ASP 201 Ca 0.26 -0.19 -0.18 0.00 0.02 0.00 0.00 57.03 56.94 3kru h ASP 201 Cb 0.11 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 3kru h ASP 201 CO -0.14 0.88 -0.66 -0.08 -1.72 0.00 0.00 179.24 177.51 3kru h GLU 202 N 0.97 0.48 -0.52 3.56 4.57 -0.83 -2.27 114.58 120.54 3kru h GLU 202 Ca 0.22 -0.35 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 3kru h GLU 202 Cb 0.25 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 3kru h GLU 202 CO -0.01 0.98 0.31 0.28 -1.18 0.00 0.00 179.01 179.38 3kru h VAL 203 N 0.34 1.16 -0.28 0.32 2.07 -0.62 -2.82 116.25 116.42 3kru h VAL 203 Ca -0.02 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.12 3kru h VAL 203 Cb 1.23 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 3kru h VAL 203 CO 0.12 0.17 0.19 0.03 0.02 0.00 0.00 177.57 178.10 3kru h ARG 204 N 0.70 0.37 0.00 1.57 3.08 -0.74 0.41 114.38 119.77 3kru h ARG 204 Ca 0.19 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3kru h ARG 204 Cb 0.01 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.97 3kru h ARG 204 CO -0.03 0.25 0.00 0.87 -1.07 0.00 0.00 179.97 179.98 3kru h LYS 205 N 0.38 0.00 0.00 0.04 1.57 -1.16 -3.20 116.57 114.20 3kru h LYS 205 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3kru h LYS 205 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3kru h LYS 205 CO -0.02 0.00 -0.00 0.09 -0.57 0.00 0.00 179.45 178.95 3kru n ASN 206 N -2.42 1.74 -3.89 0.86 3.02 0.00 -5.01 115.26 109.56 3kru n ASN 206 Ca 0.02 -1.88 -0.21 0.00 -0.03 0.00 0.00 54.58 52.48 3kru n ASN 206 Cb 0.24 -0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.24 3kru n ASN 206 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3kru s TRP 207 N -0.89 0.80 0.24 3.10 -0.11 -0.42 -3.36 118.94 118.30 3kru s TRP 207 Ca 0.00 -0.23 -0.31 0.00 1.22 0.00 0.00 56.10 56.78 3kru s TRP 207 Cb 0.00 -0.71 -0.14 0.00 -1.50 0.00 0.00 33.47 31.13 3kru s TRP 207 CO 0.00 -0.21 1.33 -2.30 -4.62 0.00 0.00 176.95 171.15 3kru n PRO 208 N 4.12 1.85 0.22 5.86 -0.02 -1.26 -4.79 135.00 140.99 3kru n PRO 208 Ca -0.23 0.66 0.15 0.00 -2.02 0.00 0.00 63.50 62.06 3kru n PRO 208 Cb 0.51 -2.26 0.73 0.00 -0.02 0.00 0.00 33.50 32.45 3kru n PRO 208 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3kru h GLU 209 N 3.81 0.00 -0.57 -0.52 4.11 -2.00 -1.65 114.58 117.75 3kru h GLU 209 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 3kru h GLU 209 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 3kru h GLU 209 CO 0.73 0.00 0.00 0.27 0.07 0.00 0.00 179.01 180.08 3kru n ASN 210 N -2.64 3.13 -4.47 3.06 6.94 -1.26 -4.89 115.26 115.13 3kru n ASN 210 Ca -0.00 -2.05 -0.32 0.00 -0.02 0.00 0.00 54.58 52.19 3kru n ASN 210 Cb 0.17 -0.40 -0.13 0.00 -2.36 0.00 0.00 39.78 37.06 3kru n ASN 210 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3kru s LYS 211 N -1.32 2.35 0.60 -3.83 1.02 -0.62 -1.61 119.74 116.32 3kru s LYS 211 Ca 0.38 -0.80 -0.17 0.00 0.02 0.00 0.00 55.97 55.40 3kru s LYS 211 Cb 0.20 -2.31 -0.03 0.00 -0.52 0.00 0.00 37.83 35.18 3kru s LYS 211 CO 0.25 0.59 1.12 -2.14 -0.92 0.00 0.00 175.35 174.25 3kru s PRO 212 N -0.99 3.06 -0.17 -1.68 0.02 -1.26 -4.87 135.00 129.12 3kru s PRO 212 Ca 0.13 1.51 0.01 0.00 0.02 0.00 0.00 61.00 62.67 3kru s PRO 212 Cb -0.11 -1.98 0.01 0.00 0.02 0.00 0.00 34.50 32.45 3kru s PRO 212 CO 0.02 -1.06 -0.18 0.42 -0.33 0.00 0.00 177.00 175.87 3kru s ILE 213 N -2.05 2.26 0.16 2.83 1.01 -1.26 -2.83 121.20 121.32 3kru s ILE 213 Ca 0.70 -0.89 0.03 0.00 0.00 0.00 0.00 60.65 60.49 3kru s ILE 213 Cb -0.22 -1.95 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 3kru s ILE 213 CO 0.34 0.53 0.26 -0.36 0.00 0.00 0.00 174.94 175.71 3kru s PHE 214 N 1.14 3.41 -0.08 3.97 0.40 0.08 -0.67 117.98 126.23 3kru s PHE 214 Ca 0.01 0.08 0.00 0.00 -0.60 0.00 0.00 56.93 56.42 3kru s PHE 214 Cb -0.14 -1.63 0.02 0.00 0.51 0.00 0.00 43.02 41.79 3kru s PHE 214 CO -0.08 0.51 -0.07 0.08 0.70 0.00 0.00 175.22 176.37 3kru s VAL 215 N -1.76 0.84 -0.13 -0.44 1.01 -0.72 -1.01 120.40 118.19 3kru s VAL 215 Ca 0.34 -0.23 -0.18 0.00 0.00 0.00 0.00 61.98 61.91 3kru s VAL 215 Cb -0.11 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 3kru s VAL 215 CO 0.27 0.32 0.48 -0.60 0.00 0.00 0.00 175.10 175.57 3kru s ARG 216 N 1.35 4.32 0.16 2.72 3.52 -0.43 -0.83 118.95 129.75 3kru s ARG 216 Ca -0.03 0.43 0.08 0.00 -0.13 0.00 0.00 55.73 56.08 3kru s ARG 216 Cb -0.14 -3.46 -0.04 0.00 -1.56 0.00 0.00 34.95 29.76 3kru s ARG 216 CO -0.03 0.11 -0.17 0.14 -0.81 0.00 0.00 175.30 174.54 3kru s VAL 217 N 0.78 1.66 -0.42 7.11 -7.23 -0.76 -0.16 120.40 121.38 3kru s VAL 217 Ca 0.25 -1.90 -0.13 0.00 -1.81 0.00 0.00 61.98 58.39 3kru s VAL 217 Cb -0.15 -1.78 0.04 0.00 0.56 0.00 0.00 36.38 35.05 3kru s VAL 217 CO 0.10 -0.38 0.30 -0.44 -0.31 0.00 0.00 175.10 174.37 3kru s SER 218 N -2.68 5.97 0.00 4.85 0.01 -1.26 -0.83 113.70 119.76 3kru s SER 218 Ca 0.15 -1.11 0.31 0.00 1.31 0.00 0.00 55.95 56.60 3kru s SER 218 Cb -0.05 -2.11 1.62 0.00 0.21 0.00 0.00 66.02 65.69 3kru s SER 218 CO 0.05 -0.50 2.10 0.00 0.41 0.00 0.00 173.24 175.31 3kru n ALA 219 N 5.10 2.54 -3.62 1.44 0.00 -0.32 -4.76 120.51 120.88 3kru n ALA 219 Ca -0.11 -0.16 -0.10 0.00 0.00 0.00 0.00 53.44 53.07 3kru n ALA 219 Cb 0.45 -1.50 -0.10 0.00 0.00 0.00 0.00 19.45 18.31 3kru n ALA 219 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3kru s ASP 220 N -2.43 -0.62 0.03 0.00 -1.08 -1.26 -2.53 116.67 108.78 3kru s ASP 220 Ca 0.33 1.06 0.24 0.00 -0.52 0.00 0.00 52.55 53.66 3kru s ASP 220 Cb 0.21 0.96 0.33 0.00 -1.46 0.00 0.00 42.92 42.96 3kru s ASP 220 CO 0.44 -0.20 1.29 0.47 0.52 0.00 0.00 175.17 177.68 3kru n ASP 221 N 3.99 0.59 -2.47 -0.34 8.00 -0.20 -0.96 116.55 125.17 3kru n ASP 221 Ca -0.21 -0.24 -0.21 0.00 0.71 0.00 0.00 54.79 54.85 3kru n ASP 221 Cb 0.56 0.40 0.00 0.00 -0.02 0.00 0.00 41.12 42.06 3kru n ASP 221 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3kru n TYR 222 N -1.69 -1.22 -3.78 1.24 4.01 -1.26 -4.89 117.16 109.57 3kru n TYR 222 Ca 0.04 0.14 -0.13 0.00 -0.16 0.00 0.00 57.90 57.80 3kru n TYR 222 Cb 0.37 -4.03 -0.12 0.00 -0.31 0.00 0.00 39.34 35.25 3kru n TYR 222 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 3kru s MET 223 N -5.19 0.25 0.27 -0.72 -1.94 -1.26 -4.97 119.30 105.74 3kru s MET 223 Ca 0.08 0.37 -0.30 0.00 -1.71 0.00 0.00 55.69 54.13 3kru s MET 223 Cb -0.04 0.06 -0.13 0.00 2.01 0.00 0.00 34.83 36.74 3kru s MET 223 CO 0.10 -0.07 1.46 0.39 -0.01 0.00 0.00 175.02 176.90 3kru n GLU 224 N 3.30 2.29 -0.05 2.03 -0.58 -1.26 -1.41 120.64 124.95 3kru n GLU 224 Ca -0.16 0.81 0.00 0.00 -0.42 0.00 0.00 57.16 57.39 3kru n GLU 224 Cb 0.57 -2.51 0.00 0.00 -0.57 0.00 0.00 31.44 28.93 3kru n GLU 224 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3kru n GLY 225 N 1.98 1.73 1.13 0.62 0.00 -1.26 -5.03 105.19 104.36 3kru n GLY 225 Ca 0.10 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.06 3kru n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kru n GLY 226 N -2.00 1.72 3.77 -0.02 0.00 -0.50 -4.13 105.19 104.03 3kru n GLY 226 Ca 0.00 -2.13 -0.41 0.00 0.00 0.00 0.00 46.02 43.48 3kru n GLY 226 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kru s ILE 227 N -0.16 2.40 0.30 -0.61 1.01 -1.26 -4.88 121.20 117.99 3kru s ILE 227 Ca 0.18 0.39 0.03 0.00 0.00 0.00 0.00 60.65 61.24 3kru s ILE 227 Cb -0.01 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 3kru s ILE 227 CO 0.11 0.09 0.14 0.54 0.00 0.00 0.00 174.94 175.82 3kru s ASN 228 N -0.15 1.53 0.34 3.58 2.20 -1.25 -1.03 114.94 120.14 3kru s ASN 228 Ca 0.53 -1.52 0.03 0.00 -0.94 0.00 0.00 52.86 50.96 3kru s ASN 228 Cb -0.43 0.33 0.62 0.00 -2.00 0.00 0.00 41.25 39.77 3kru s ASN 228 CO 0.55 -0.84 1.97 -0.29 -2.94 0.00 0.00 177.10 175.54 3kru h ILE 229 N 2.23 1.10 -0.60 0.54 6.09 -1.89 -1.13 117.51 123.84 3kru h ILE 229 Ca -0.35 -0.31 -0.09 0.00 -1.37 0.00 0.00 64.86 62.75 3kru h ILE 229 Cb 1.25 0.12 -0.02 0.00 0.47 0.00 0.00 36.82 38.64 3kru h ILE 229 CO 0.55 0.16 0.04 0.44 -3.07 0.00 0.00 178.15 176.27 3kru h ASP 230 N 0.90 1.01 -0.61 2.19 3.32 -1.97 -0.81 116.42 120.45 3kru h ASP 230 Ca 0.30 -0.29 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 3kru h ASP 230 Cb 0.08 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 3kru h ASP 230 CO -0.09 1.05 0.14 -0.03 -1.72 0.00 0.00 179.24 178.59 3kru h MET 231 N 0.94 0.98 -0.49 3.56 4.05 -1.72 -2.38 114.93 119.88 3kru h MET 231 Ca 0.18 -0.24 -0.11 0.00 -0.28 0.00 0.00 59.70 59.25 3kru h MET 231 Cb 0.50 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 31.16 3kru h MET 231 CO 0.02 0.90 -0.12 1.98 0.23 0.00 0.00 176.91 179.91 3kru h MET 232 N 0.89 0.91 -0.78 0.39 1.85 -0.97 -1.71 114.93 115.50 3kru h MET 232 Ca 0.19 -0.33 0.09 0.00 -0.61 0.00 0.00 59.70 59.04 3kru h MET 232 Cb 0.36 -0.06 -0.07 0.00 0.43 0.00 0.00 31.60 32.26 3kru h MET 232 CO 0.00 0.98 0.44 0.28 -0.40 0.00 0.00 176.91 178.20 3kru h VAL 233 N 0.81 0.90 -0.45 -5.77 2.07 -0.97 0.22 116.25 113.06 3kru h VAL 233 Ca 0.13 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.41 3kru h VAL 233 Cb 0.65 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 3kru h VAL 233 CO 0.05 0.13 0.28 -0.33 0.02 0.00 0.00 177.57 177.72 3kru h GLU 234 N 0.74 0.55 -0.38 1.57 5.08 -0.91 -1.24 114.58 120.00 3kru h GLU 234 Ca 0.38 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.66 3kru h GLU 234 Cb 0.35 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3kru h GLU 234 CO -0.25 0.37 0.08 1.88 -1.00 0.00 0.00 179.01 180.09 3kru h TYR 235 N 0.57 0.64 -0.50 4.33 0.05 -0.56 -2.68 116.97 118.82 3kru h TYR 235 Ca 0.17 -0.08 -0.03 0.00 0.05 0.00 0.00 58.73 58.85 3kru h TYR 235 Cb -0.02 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.52 3kru h TYR 235 CO -0.06 0.63 0.20 0.82 -1.05 0.00 0.00 178.16 178.70 3kru h ILE 236 N 0.46 1.19 0.00 -2.88 1.08 -0.42 -1.66 117.51 115.28 3kru h ILE 236 Ca 0.12 -0.58 -0.03 0.00 -0.39 0.00 0.00 64.86 63.97 3kru h ILE 236 Cb 0.32 0.59 -0.00 0.00 -3.07 0.00 0.00 36.82 34.66 3kru h ILE 236 CO 0.00 0.23 -0.16 0.78 -0.69 0.00 0.00 178.15 178.31 3kru h ASN 237 N 0.71 0.00 0.87 1.72 2.35 -0.91 0.03 115.58 120.35 3kru h ASN 237 Ca 0.17 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.85 3kru h ASN 237 Cb 0.14 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 3kru h ASN 237 CO -0.02 0.16 -0.33 0.24 -1.65 0.00 0.00 177.43 175.83 3kru h MET 238 N 0.00 0.00 -0.00 0.81 2.86 -1.02 -3.35 114.93 114.23 3kru h MET 238 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3kru h MET 238 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 3kru h MET 238 CO 0.02 0.33 -0.09 0.44 1.06 0.00 0.00 176.91 178.67 3kru n ILE 239 N -3.50 0.00 0.29 -1.22 -5.35 -0.71 -4.78 119.36 104.09 3kru n ILE 239 Ca -0.00 -0.45 0.16 0.00 -0.27 0.00 0.00 62.75 62.18 3kru n ILE 239 Cb 0.49 1.02 0.86 0.00 -1.74 0.00 0.00 39.64 40.27 3kru n ILE 239 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 3kru h LYS 240 N 0.18 0.00 0.00 6.28 2.10 -1.16 -0.20 116.57 123.76 3kru h LYS 240 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3kru h LYS 240 Cb 0.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.41 3kru h LYS 240 CO 0.00 0.06 0.00 -0.25 -2.00 0.00 0.00 179.45 177.26 3kru n ASP 241 N -3.48 0.00 -0.00 7.07 8.00 -1.26 -3.80 116.55 123.08 3kru n ASP 241 Ca -0.02 -0.14 0.01 0.00 0.71 0.00 0.00 54.79 55.36 3kru n ASP 241 Cb 0.18 -0.28 -0.01 0.00 -0.02 0.00 0.00 41.12 40.99 3kru n ASP 241 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3kru n LYS 242 N -1.28 5.03 -4.40 -1.24 5.02 -0.11 -5.05 118.16 116.13 3kru n LYS 242 Ca 0.14 -0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.23 3kru n LYS 242 Cb 0.23 -0.70 -0.10 0.00 -0.02 0.00 0.00 35.03 34.44 3kru n LYS 242 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3kru s VAL 243 N -1.40 1.16 -0.05 -0.18 -7.23 -1.07 -4.91 120.40 106.72 3kru s VAL 243 Ca 0.01 -2.03 0.11 0.00 -1.81 0.00 0.00 61.98 58.25 3kru s VAL 243 Cb 0.02 -2.58 -0.16 0.00 0.56 0.00 0.00 36.38 34.22 3kru s VAL 243 CO 0.09 -0.16 0.16 0.47 -0.31 0.00 0.00 175.10 175.36 3kru n ASP 244 N -0.56 2.42 -3.63 4.85 8.00 0.16 -4.83 116.55 122.95 3kru n ASP 244 Ca -0.03 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.33 3kru n ASP 244 Cb 0.65 1.21 -0.07 0.00 -0.02 0.00 0.00 41.12 42.89 3kru n ASP 244 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3kru s LEU 245 N -4.18 -0.77 -0.26 0.64 0.20 -1.21 -4.16 118.68 108.94 3kru s LEU 245 Ca -0.05 1.46 -0.09 0.00 0.69 0.00 0.00 54.13 56.14 3kru s LEU 245 Cb 0.06 2.46 -0.04 0.00 -0.43 0.00 0.00 46.19 48.24 3kru s LEU 245 CO 0.45 -0.25 0.13 -0.63 -0.29 0.00 0.00 176.35 175.76 3kru s ILE 246 N 0.49 4.77 -0.58 6.68 -1.09 -0.40 -1.75 121.20 129.31 3kru s ILE 246 Ca -0.01 -0.03 -0.22 0.00 -2.23 0.00 0.00 60.65 58.17 3kru s ILE 246 Cb -0.05 -3.25 0.06 0.00 -1.58 0.00 0.00 42.46 37.64 3kru s ILE 246 CO -0.01 0.29 0.83 -0.62 -1.23 0.00 0.00 174.94 174.20 3kru s ASP 247 N 1.68 6.23 -0.28 3.58 -1.08 -0.01 -1.25 116.67 125.54 3kru s ASP 247 Ca 0.07 -0.86 -0.15 0.00 -0.52 0.00 0.00 52.55 51.08 3kru s ASP 247 Cb -0.16 -2.37 -0.03 0.00 -1.46 0.00 0.00 42.92 38.90 3kru s ASP 247 CO 0.07 -1.19 0.39 -0.69 0.52 0.00 0.00 175.17 174.27 3kru s VAL 248 N 3.45 5.16 0.00 1.11 1.01 -0.95 -1.83 120.40 128.35 3kru s VAL 248 Ca 0.21 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.74 3kru s VAL 248 Cb -0.17 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.47 3kru s VAL 248 CO 0.12 0.11 0.00 -0.24 0.00 0.00 0.00 175.10 175.10 3kru n SER 249 N 5.38 0.98 -3.73 3.32 2.88 -0.01 -4.09 113.62 118.35 3kru n SER 249 Ca -0.08 -0.13 -0.08 0.00 -1.33 0.00 0.00 58.87 57.26 3kru n SER 249 Cb 0.50 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.95 3kru n SER 249 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3kru s SER 250 N 0.74 -0.32 0.16 -3.46 1.04 -1.26 -1.18 113.70 109.43 3kru s SER 250 Ca 0.00 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.02 3kru s SER 250 Cb 0.00 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.76 3kru s SER 250 CO 0.00 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.68 3kru n GLY 251 N -0.43 -2.03 0.00 7.32 0.00 -0.13 -4.78 105.19 105.14 3kru n GLY 251 Ca -0.07 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3kru n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kru n GLY 252 N -1.39 3.29 0.18 -0.02 0.00 -1.26 -3.35 105.19 102.63 3kru n GLY 252 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3kru n GLY 252 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kru h LEU 253 N 0.00 0.55 -7.75 0.99 5.85 -1.86 -3.32 115.31 109.76 3kru h LEU 253 Ca 0.00 -0.38 -0.14 0.00 0.84 0.00 0.00 57.88 58.20 3kru h LEU 253 Cb 0.00 -0.15 -0.20 0.00 0.37 0.00 0.00 40.66 40.68 3kru h LEU 253 CO 0.00 0.81 -0.47 -0.76 -0.34 0.00 0.00 178.44 177.67 3kru s LEU 254 N -9.27 1.52 0.05 2.25 1.43 -1.26 -4.85 118.68 108.55 3kru s LEU 254 Ca -0.13 -0.25 -0.33 0.00 -1.03 0.00 0.00 54.13 52.39 3kru s LEU 254 Cb 0.08 0.73 -0.12 0.00 0.03 0.00 0.00 46.19 46.91 3kru s LEU 254 CO 0.78 -0.41 1.77 0.59 0.23 0.00 0.00 176.35 179.30 3kru n ASN 255 N 1.28 3.47 -3.85 2.29 3.02 -1.26 -4.98 115.26 115.22 3kru n ASN 255 Ca -0.22 1.01 -0.11 0.00 -0.03 0.00 0.00 54.58 55.23 3kru n ASN 255 Cb 0.56 -1.43 -0.10 0.00 -0.61 0.00 0.00 39.78 38.20 3kru n ASN 255 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3kru s VAL 256 N 2.69 0.06 0.03 2.41 -7.23 -1.26 -5.13 120.40 111.97 3kru s VAL 256 Ca 0.85 -0.53 -0.30 0.00 -1.81 0.00 0.00 61.98 60.19 3kru s VAL 256 Cb -0.64 -0.40 -0.05 0.00 0.56 0.00 0.00 36.38 35.86 3kru s VAL 256 CO 0.43 -0.29 1.17 -1.81 -0.31 0.00 0.00 175.10 174.29 3kru s ASP 257 N -1.06 7.11 -0.04 4.85 1.01 -1.26 -5.03 116.67 122.25 3kru s ASP 257 Ca -0.12 1.92 0.03 0.00 0.71 0.00 0.00 52.55 55.10 3kru s ASP 257 Cb -0.06 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.30 3kru s ASP 257 CO 0.01 -0.47 -0.12 -0.63 0.21 0.00 0.00 175.17 174.18 3kru s ILE 258 N 1.33 1.02 -0.16 0.77 1.01 -1.26 -5.07 121.20 118.83 3kru s ILE 258 Ca 0.57 -0.47 -0.29 0.00 0.00 0.00 0.00 60.65 60.46 3kru s ILE 258 Cb -0.27 -0.90 -0.02 0.00 0.01 0.00 0.00 42.46 41.27 3kru s ILE 258 CO 0.27 0.31 1.38 0.21 0.00 0.00 0.00 174.94 177.11 3kru s ASN 259 N 0.25 6.81 -0.16 3.58 2.47 -1.26 -5.02 114.94 121.61 3kru s ASN 259 Ca -0.05 1.74 -0.04 0.00 0.42 0.00 0.00 52.86 54.92 3kru s ASN 259 Cb -0.11 -2.54 -0.03 0.00 -1.45 0.00 0.00 41.25 37.13 3kru s ASN 259 CO 0.01 -0.87 -0.01 -0.76 -3.72 0.00 0.00 177.10 171.75 3kru s LEU 260 N 3.85 3.40 0.11 3.21 1.43 -1.26 -4.97 118.68 124.45 3kru s LEU 260 Ca 0.60 -0.07 -0.25 0.00 -1.03 0.00 0.00 54.13 53.38 3kru s LEU 260 Cb -0.24 -1.83 0.07 0.00 0.03 0.00 0.00 46.19 44.23 3kru s LEU 260 CO 0.20 0.18 0.82 -0.72 0.23 0.00 0.00 176.35 177.06 3kru s TYR 261 N 0.29 -0.32 0.12 0.29 -0.85 -1.26 -5.08 117.35 110.55 3kru s TYR 261 Ca -0.02 0.08 -0.33 0.00 -0.52 0.00 0.00 57.07 56.29 3kru s TYR 261 Cb -0.14 0.59 -0.12 0.00 0.38 0.00 0.00 41.96 42.68 3kru s TYR 261 CO 0.02 -0.78 1.75 -2.30 -1.52 0.00 0.00 175.55 172.73 3kru n PRO 262 N -0.36 2.53 -0.99 -3.49 -0.02 -1.26 -2.04 135.00 129.37 3kru n PRO 262 Ca -0.09 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3kru n PRO 262 Cb 0.62 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 3kru n PRO 262 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kru n GLY 263 N 3.97 0.41 0.26 -1.23 0.00 -0.87 -4.94 105.19 102.79 3kru n GLY 263 Ca 0.18 -0.91 0.18 0.00 0.00 0.00 0.00 46.02 45.46 3kru n GLY 263 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3kru h TYR 264 N 0.00 0.00 -0.24 1.61 -0.00 -1.54 -1.47 116.97 115.33 3kru h TYR 264 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 3kru h TYR 264 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 3kru h TYR 264 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 178.16 179.20 3kru n GLN 265 N -2.76 1.96 -0.04 0.10 6.02 -1.26 -4.67 117.38 116.73 3kru n GLN 265 Ca -0.02 -1.83 -0.05 0.00 -0.01 0.00 0.00 57.00 55.09 3kru n GLN 265 Cb 0.11 -1.33 0.15 0.00 1.02 0.00 0.00 30.24 30.18 3kru n GLN 265 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3kru h VAL 266 N 2.94 1.27 -0.43 5.09 2.07 -1.52 -2.68 116.25 122.98 3kru h VAL 266 Ca 0.00 -1.27 -0.03 0.00 0.82 0.00 0.00 66.70 66.22 3kru h VAL 266 Cb 0.73 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 3kru h VAL 266 CO 0.00 0.42 0.15 0.11 0.02 0.00 0.00 177.57 178.27 3kru h LYS 267 N 0.56 0.61 -0.51 1.57 1.57 -1.83 -0.76 116.57 117.78 3kru h LYS 267 Ca 0.08 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 3kru h LYS 267 Cb 0.68 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 3kru h LYS 267 CO 0.05 0.52 0.19 1.88 -0.57 0.00 0.00 179.45 181.52 3kru h TYR 268 N 0.61 0.79 -0.70 -1.35 0.05 -1.81 -1.48 116.97 113.07 3kru h TYR 268 Ca 0.15 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.85 3kru h TYR 268 Cb 0.15 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.63 3kru h TYR 268 CO 0.01 0.66 0.40 0.00 -1.05 0.00 0.00 178.16 178.18 3kru h ALA 269 N 1.04 0.89 -0.01 3.88 0.00 -1.13 -1.86 119.26 122.07 3kru h ALA 269 Ca 0.17 -0.10 -0.19 0.00 0.00 0.00 0.00 54.91 54.79 3kru h ALA 269 Cb 0.22 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3kru h ALA 269 CO -0.01 0.39 -0.82 1.05 0.00 0.00 0.00 179.25 179.85 3kru h GLU 270 N 0.96 0.22 -0.28 0.00 4.11 -0.88 -1.68 114.58 117.03 3kru h GLU 270 Ca 0.25 -0.22 -0.06 0.00 0.07 0.00 0.00 59.36 59.40 3kru h GLU 270 Cb 0.00 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3kru h GLU 270 CO -0.04 0.93 -0.07 1.15 0.07 0.00 0.00 179.01 181.05 3kru h THR 271 N 0.13 1.28 -0.44 -1.06 2.02 -1.14 -1.40 112.91 112.30 3kru h THR 271 Ca -0.04 -1.09 -0.03 0.00 0.77 0.00 0.00 66.41 66.03 3kru h THR 271 Cb 1.43 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 69.24 3kru h THR 271 CO 0.13 0.34 0.18 0.40 0.37 0.00 0.00 175.52 176.94 3kru h ILE 272 N 0.29 1.20 -0.26 3.11 2.04 -1.35 0.20 117.51 122.75 3kru h ILE 272 Ca 0.07 -0.63 0.04 0.00 1.00 0.00 0.00 64.86 65.33 3kru h ILE 272 Cb 0.54 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 3kru h ILE 272 CO 0.03 0.23 0.04 0.50 0.00 0.00 0.00 178.15 178.95 3kru h LYS 273 N 0.58 0.13 0.02 2.37 3.64 -1.23 -1.06 116.57 121.00 3kru h LYS 273 Ca 0.15 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 3kru h LYS 273 Cb 0.20 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.00 3kru h LYS 273 CO -0.01 0.08 -0.32 0.87 -2.27 0.00 0.00 179.45 177.80 3kru h LYS 274 N 0.13 0.19 -0.25 1.90 1.79 -1.13 -1.04 116.57 118.17 3kru h LYS 274 Ca 0.12 -0.23 -0.14 0.00 -2.18 0.00 0.00 60.65 58.23 3kru h LYS 274 Cb 0.13 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 3kru h LYS 274 CO -0.17 0.98 -0.42 0.00 -1.08 0.00 0.00 179.45 178.76 3kru h ARG 275 N -0.50 0.60 0.00 3.15 3.08 -0.98 -3.25 114.38 116.47 3kru h ARG 275 Ca -0.04 -0.32 0.00 0.00 0.07 0.00 0.00 59.98 59.69 3kru h ARG 275 Cb 1.11 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.17 3kru h ARG 275 CO 0.06 0.91 -1.02 0.00 -1.07 0.00 0.00 179.97 178.85 3kru n ASN 277 N -1.78 -5.12 -3.95 0.00 5.15 -0.40 -5.00 115.26 104.15 3kru n ASN 277 Ca 0.03 -0.82 -0.10 0.00 -0.60 0.00 0.00 54.58 53.09 3kru n ASN 277 Cb 0.40 -4.47 -0.11 0.00 -0.53 0.00 0.00 39.78 35.07 3kru n ASN 277 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 3kru s ILE 278 N -3.45 0.10 0.42 -1.44 2.07 -1.15 -5.07 121.20 112.67 3kru s ILE 278 Ca 0.37 -0.80 -0.26 0.00 -1.41 0.00 0.00 60.65 58.55 3kru s ILE 278 Cb -0.08 -0.27 -0.08 0.00 0.13 0.00 0.00 42.46 42.15 3kru s ILE 278 CO 0.79 -0.44 1.34 -0.54 -1.91 0.00 0.00 174.94 174.18 3kru s LYS 279 N -1.33 3.86 0.13 3.50 1.02 -1.26 -4.29 119.74 121.38 3kru s LYS 279 Ca -0.15 2.24 0.03 0.00 0.02 0.00 0.00 55.97 58.12 3kru s LYS 279 Cb -0.09 -2.71 -0.04 0.00 -0.52 0.00 0.00 37.83 34.46 3kru s LYS 279 CO -0.00 -0.61 -0.07 0.95 -0.92 0.00 0.00 175.35 174.70 3kru s THR 280 N -1.25 0.89 0.06 2.17 -4.23 -1.26 -1.28 115.64 110.74 3kru s THR 280 Ca 0.58 -1.99 0.08 0.00 -1.18 0.00 0.00 61.69 59.18 3kru s THR 280 Cb -0.40 -1.83 -0.03 0.00 1.34 0.00 0.00 72.50 71.58 3kru s THR 280 CO 0.51 -0.75 -0.21 -0.94 -0.54 0.00 0.00 174.62 172.69 3kru s SER 281 N -3.12 3.59 -0.04 3.99 1.04 -0.38 0.09 113.70 118.87 3kru s SER 281 Ca 0.16 -0.51 0.01 0.00 0.48 0.00 0.00 55.95 56.09 3kru s SER 281 Cb 0.04 -0.48 -0.03 0.00 0.10 0.00 0.00 66.02 65.65 3kru s SER 281 CO -0.01 0.24 -0.03 0.00 0.98 0.00 0.00 173.24 174.42 3kru s ALA 282 N -0.92 3.15 0.00 5.32 0.00 -0.66 -2.25 121.76 126.41 3kru s ALA 282 Ca 0.14 -0.92 -0.11 0.00 0.00 0.00 0.00 51.96 51.07 3kru s ALA 282 Cb -0.10 -1.30 0.01 0.00 0.00 0.00 0.00 23.12 21.73 3kru s ALA 282 CO 0.05 0.61 0.22 0.54 0.00 0.00 0.00 175.76 177.18 3kru s VAL 283 N -0.95 0.08 0.00 0.00 0.11 -1.26 -0.65 120.40 117.73 3kru s VAL 283 Ca 0.16 -0.63 0.00 0.00 -2.93 0.00 0.00 61.98 58.58 3kru s VAL 283 Cb -0.11 -0.59 0.00 0.00 -1.53 0.00 0.00 36.38 34.14 3kru s VAL 283 CO 0.06 -0.35 0.00 0.61 -3.33 0.00 0.00 175.10 172.09 3kru n GLY 284 N 1.23 2.49 2.46 6.54 0.00 -1.26 -4.31 105.19 112.34 3kru n GLY 284 Ca -0.22 -0.58 -0.20 0.00 0.00 0.00 0.00 46.02 45.02 3kru n GLY 284 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kru n LEU 285 N 0.00 -1.76 -4.66 0.99 4.77 -1.26 -2.06 117.00 113.02 3kru n LEU 285 Ca 0.00 0.17 -0.40 0.00 -0.03 0.00 0.00 56.01 55.75 3kru n LEU 285 Cb 0.00 -2.85 -0.06 0.00 -2.33 0.00 0.00 43.42 38.19 3kru n LEU 285 CO 0.00 -0.52 0.40 -0.63 -1.33 0.00 0.00 177.39 175.31 3kru s ILE 286 N -2.92 5.00 0.00 -0.08 1.01 -1.26 -4.16 121.20 118.79 3kru s ILE 286 Ca 0.00 1.23 0.00 0.00 0.00 0.00 0.00 60.65 61.88 3kru s ILE 286 Cb 0.00 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.50 3kru s ILE 286 CO 0.00 0.10 0.00 0.35 0.00 0.00 0.00 174.94 175.39 3kru n THR 287 N 4.70 0.00 -3.92 2.92 -2.24 -1.26 -4.74 114.28 109.74 3kru n THR 287 Ca -0.01 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.44 3kru n THR 287 Cb 0.50 0.20 -0.05 0.00 -2.10 0.00 0.00 70.33 68.88 3kru n THR 287 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3kru s THR 288 N -0.89 5.38 0.30 4.28 -4.23 -1.26 -5.00 115.64 114.22 3kru s THR 288 Ca 0.00 -0.19 0.04 0.00 -1.18 0.00 0.00 61.69 60.36 3kru s THR 288 Cb 0.00 -3.52 0.30 0.00 1.34 0.00 0.00 72.50 70.62 3kru s THR 288 CO 0.00 0.32 1.83 -0.61 -0.54 0.00 0.00 174.62 175.62 3kru h GLN 289 N 3.80 0.86 0.07 3.99 4.15 -1.98 -1.84 115.11 124.16 3kru h GLN 289 Ca -0.49 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 58.88 3kru h GLN 289 Cb 1.19 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.68 3kru h GLN 289 CO 0.69 0.57 -0.03 1.49 -1.93 0.00 0.00 178.83 179.62 3kru h GLU 290 N 0.89 -0.09 -0.39 1.69 4.81 -1.99 0.04 114.58 119.53 3kru h GLU 290 Ca 0.51 0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.62 3kru h GLU 290 Cb 0.63 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 3kru h GLU 290 CO -0.28 -0.04 -0.27 1.25 -0.73 0.00 0.00 179.01 178.94 3kru h LEU 291 N -0.11 0.85 -0.62 1.64 5.85 -1.94 -1.63 115.31 119.35 3kru h LEU 291 Ca -0.01 -0.33 0.03 0.00 0.84 0.00 0.00 57.88 58.41 3kru h LEU 291 Cb 0.09 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 3kru h LEU 291 CO 0.02 1.07 0.37 0.00 -0.34 0.00 0.00 178.44 179.56 3kru h ALA 292 N 0.98 0.81 -0.51 1.25 0.00 -1.03 -1.26 119.26 119.50 3kru h ALA 292 Ca 0.09 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 3kru h ALA 292 Cb 0.81 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3kru h ALA 292 CO 0.07 0.10 0.09 0.93 0.00 0.00 0.00 179.25 180.45 3kru h GLU 293 N 0.73 0.84 -0.81 0.00 5.08 -0.79 -2.21 114.58 117.42 3kru h GLU 293 Ca 0.26 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 3kru h GLU 293 Cb 0.05 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.16 3kru h GLU 293 CO -0.12 0.82 0.49 1.49 -1.00 0.00 0.00 179.01 180.69 3kru h GLU 294 N 0.72 1.10 -0.37 2.33 4.22 -0.94 0.75 114.58 122.39 3kru h GLU 294 Ca 0.16 -0.10 -0.02 0.00 0.08 0.00 0.00 59.36 59.47 3kru h GLU 294 Cb 0.38 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3kru h GLU 294 CO 0.01 0.78 0.13 0.82 -2.18 0.00 0.00 179.01 178.57 3kru h ILE 295 N 1.11 1.20 -0.14 2.32 2.04 -1.03 -0.71 117.51 122.30 3kru h ILE 295 Ca 0.29 -0.62 -0.06 0.00 1.00 0.00 0.00 64.86 65.47 3kru h ILE 295 Cb -0.04 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 3kru h ILE 295 CO -0.05 0.22 -0.14 -0.07 0.00 0.00 0.00 178.15 178.10 3kru h LEU 296 N 0.44 0.37 -0.78 1.44 3.38 -1.23 -0.61 115.31 118.32 3kru h LEU 296 Ca 0.12 -0.49 -0.13 0.00 0.09 0.00 0.00 57.88 57.48 3kru h LEU 296 Cb 0.21 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3kru h LEU 296 CO -0.01 0.78 -0.60 0.28 0.09 0.00 0.00 178.44 178.98 3kru h SER 297 N -0.04 0.00 -0.15 -0.43 0.02 -0.79 -1.95 113.55 110.22 3kru h SER 297 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3kru h SER 297 Cb 0.68 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.22 3kru h SER 297 CO 0.04 0.60 0.00 0.59 -1.14 0.00 0.00 176.83 176.92 3kru n ASN 298 N -3.80 0.90 -3.82 3.07 5.03 -0.28 -4.91 115.26 111.45 3kru n ASN 298 Ca -0.01 -2.02 -0.29 0.00 0.87 0.00 0.00 54.58 53.13 3kru n ASN 298 Cb 0.61 -0.14 0.03 0.00 -1.02 0.00 0.00 39.78 39.26 3kru n ASN 298 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3kru n GLU 299 N -0.04 -5.66 0.12 3.52 1.02 -0.73 -4.88 120.64 114.00 3kru n GLU 299 Ca 0.05 0.63 0.06 0.00 -0.02 0.00 0.00 57.16 57.88 3kru n GLU 299 Cb 0.15 -5.53 0.02 0.00 -0.02 0.00 0.00 31.44 26.07 3kru n GLU 299 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kru h ARG 300 N -2.07 0.00 -2.72 3.49 3.08 -1.32 -3.48 114.38 111.35 3kru h ARG 300 Ca -0.57 0.00 0.06 0.00 0.07 0.00 0.00 59.98 59.54 3kru h ARG 300 Cb 1.37 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.31 3kru h ARG 300 CO 0.65 0.24 0.32 0.00 -1.07 0.00 0.00 179.97 180.12 3kru s ALA 301 N -3.09 -1.60 -0.12 0.04 0.00 -1.22 -2.52 121.76 113.25 3kru s ALA 301 Ca 0.02 0.45 0.18 0.00 0.00 0.00 0.00 51.96 52.60 3kru s ALA 301 Cb 0.08 0.72 -0.22 0.00 0.00 0.00 0.00 23.12 23.70 3kru s ALA 301 CO 0.75 -0.83 0.51 -0.25 0.00 0.00 0.00 175.76 175.94 3kru n ASP 302 N -0.37 0.45 -4.18 0.00 8.00 0.11 -4.47 116.55 116.09 3kru n ASP 302 Ca -0.11 0.20 -0.18 0.00 0.71 0.00 0.00 54.79 55.40 3kru n ASP 302 Cb 0.63 0.70 -0.12 0.00 -0.02 0.00 0.00 41.12 42.31 3kru n ASP 302 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3kru s LEU 303 N -5.52 2.29 -0.18 0.64 1.43 -1.00 -4.87 118.68 111.46 3kru s LEU 303 Ca -0.06 -0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 52.38 3kru s LEU 303 Cb 0.09 -0.52 -0.01 0.00 0.03 0.00 0.00 46.19 45.77 3kru s LEU 303 CO 0.83 -0.08 -0.08 -0.69 0.23 0.00 0.00 176.35 176.57 3kru s VAL 304 N -1.34 3.26 -0.14 -1.59 1.01 0.01 -1.65 120.40 119.95 3kru s VAL 304 Ca -0.01 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.29 3kru s VAL 304 Cb -0.10 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 3kru s VAL 304 CO 0.02 0.47 0.25 0.00 0.00 0.00 0.00 175.10 175.84 3kru s ALA 305 N 1.00 3.66 -0.14 5.51 0.00 0.18 -1.17 121.76 130.81 3kru s ALA 305 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.46 3kru s ALA 305 Cb -0.15 -2.29 -0.01 0.00 0.00 0.00 0.00 23.12 20.68 3kru s ALA 305 CO -0.00 0.23 -0.15 -0.51 0.00 0.00 0.00 175.76 175.33 3kru s LEU 306 N 0.05 2.58 0.00 0.00 1.43 -0.33 -4.42 118.68 117.99 3kru s LEU 306 Ca 0.15 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 3kru s LEU 306 Cb -0.13 -1.58 0.00 0.00 0.03 0.00 0.00 46.19 44.51 3kru s LEU 306 CO 0.04 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.36 3kru n GLY 307 N 3.73 -0.08 0.32 -3.19 0.00 -1.26 -1.20 105.19 103.50 3kru n GLY 307 Ca -0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.91 3kru n GLY 307 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3kru h ARG 308 N 0.00 0.42 -0.60 1.61 3.08 -1.96 -1.14 114.38 115.79 3kru h ARG 308 Ca 0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3kru h ARG 308 Cb 0.00 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 3kru h ARG 308 CO 0.00 0.27 0.33 1.49 -1.07 0.00 0.00 179.97 180.99 3kru h GLU 309 N 0.43 0.83 0.00 0.04 4.57 -1.88 -1.38 114.58 117.19 3kru h GLU 309 Ca 0.18 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 3kru h GLU 309 Cb 0.18 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 3kru h GLU 309 CO -0.04 0.62 0.00 -0.07 -1.18 0.00 0.00 179.01 178.33 3kru h LEU 310 N 0.84 0.00 -0.06 1.64 3.38 -1.41 0.91 115.31 120.61 3kru h LEU 310 Ca 0.21 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 3kru h LEU 310 Cb 0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 3kru h LEU 310 CO -0.03 0.00 -0.07 -0.07 0.09 0.00 0.00 178.44 178.35 3kru h LEU 311 N 0.00 0.16 0.00 1.67 3.38 -1.08 -3.20 115.31 116.24 3kru h LEU 311 Ca 0.00 -0.52 -0.10 0.00 0.09 0.00 0.00 57.88 57.35 3kru h LEU 311 Cb 0.72 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 3kru h LEU 311 CO 0.00 0.65 -0.63 0.08 0.09 0.00 0.00 178.44 178.62 3kru h ARG 312 N -0.32 0.00 -2.01 1.13 0.11 -1.36 -3.40 114.38 108.52 3kru h ARG 312 Ca 0.01 0.00 -0.56 0.00 0.10 0.00 0.00 59.98 59.53 3kru h ARG 312 Cb 0.61 0.00 -0.39 0.00 1.11 0.00 0.00 29.97 31.30 3kru h ARG 312 CO 0.02 0.40 -1.08 -1.71 0.10 0.00 0.00 179.97 177.69 3kru n ASN 313 N -3.13 0.38 0.28 0.08 5.15 0.31 -4.99 115.26 113.33 3kru n ASN 313 Ca 0.00 -2.74 0.14 0.00 -0.60 0.00 0.00 54.58 51.38 3kru n ASN 313 Cb 0.73 -0.64 0.83 0.00 -0.53 0.00 0.00 39.78 40.17 3kru n ASN 313 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3kru h PRO 314 N 3.99 0.00 -0.67 1.20 0.13 -1.75 -2.52 132.00 132.37 3kru h PRO 314 Ca 0.08 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.05 3kru h PRO 314 Cb 0.87 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.90 3kru h PRO 314 CO 0.48 0.06 0.20 0.66 -0.23 0.00 0.00 178.00 179.17 3kru n TYR 315 N -3.70 2.28 -0.29 1.56 4.02 -1.26 -4.50 117.16 115.26 3kru n TYR 315 Ca -0.02 -1.11 0.07 0.00 -0.01 0.00 0.00 57.90 56.83 3kru n TYR 315 Cb 0.16 -0.63 0.17 0.00 -0.02 0.00 0.00 39.34 39.02 3kru n TYR 315 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 176.86 178.20 3kru h TRP 316 N 2.84 -0.19 -0.74 -0.72 7.01 -1.68 0.25 115.95 122.72 3kru h TRP 316 Ca 0.20 0.07 -0.05 0.00 2.11 0.00 0.00 58.89 61.21 3kru h TRP 316 Cb 2.21 0.22 -0.03 0.00 -2.10 0.00 0.00 29.16 29.46 3kru h TRP 316 CO 1.21 -0.33 0.25 0.28 -2.79 0.00 0.00 178.44 177.06 3kru h VAL 317 N 0.05 1.26 -0.83 2.65 2.07 -1.83 -2.47 116.25 117.15 3kru h VAL 317 Ca 0.46 -0.88 0.07 0.00 0.82 0.00 0.00 66.70 67.17 3kru h VAL 317 Cb 0.81 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.96 3kru h VAL 317 CO -0.80 0.35 0.54 -0.07 0.02 0.00 0.00 177.57 177.60 3kru h LEU 318 N 1.09 0.77 -0.73 2.57 3.38 -0.73 -0.39 115.31 121.27 3kru h LEU 318 Ca 0.24 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.22 3kru h LEU 318 Cb 0.28 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3kru h LEU 318 CO -0.01 0.49 0.00 1.41 0.09 0.00 0.00 178.44 180.42 3kru n HIS 319 N -4.49 0.78 0.80 1.13 8.25 -0.94 -2.08 115.22 118.67 3kru n HIS 319 Ca 0.13 0.31 0.12 0.00 -0.26 0.00 0.00 57.72 58.02 3kru n HIS 319 Cb 0.24 -1.00 0.21 0.00 1.12 0.00 0.00 29.99 30.56 3kru n HIS 319 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3kru n THR 320 N -2.21 0.14 -2.39 1.59 -2.24 -0.16 -4.94 114.28 104.07 3kru n THR 320 Ca 0.02 -0.12 -0.37 0.00 -2.27 0.00 0.00 64.05 61.31 3kru n THR 320 Cb 0.21 0.08 -0.02 0.00 -2.10 0.00 0.00 70.33 68.50 3kru n THR 320 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3kru s TYR 321 N -3.08 3.09 -2.22 4.78 2.02 -0.88 -4.93 117.35 116.13 3kru s TYR 321 Ca 0.09 1.59 0.18 0.00 -0.37 0.00 0.00 57.07 58.55 3kru s TYR 321 Cb 0.16 -3.27 0.16 0.00 -0.40 0.00 0.00 41.96 38.61 3kru s TYR 321 CO 0.71 -1.08 1.09 0.25 -1.57 0.00 0.00 175.55 174.95 3kru n THR 322 N -0.19 0.05 -3.93 -0.71 -2.24 -1.26 -4.97 114.28 101.04 3kru n THR 322 Ca 0.06 -0.53 -0.10 0.00 -2.27 0.00 0.00 64.05 61.21 3kru n THR 322 Cb 0.48 1.33 -0.11 0.00 -2.10 0.00 0.00 70.33 69.94 3kru n THR 322 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3kru s SER 323 N -1.48 0.13 0.53 3.42 1.04 -1.26 -5.04 113.70 111.04 3kru s SER 323 Ca 0.22 -0.34 0.34 0.00 0.48 0.00 0.00 55.95 56.64 3kru s SER 323 Cb 0.15 0.15 1.47 0.00 0.10 0.00 0.00 66.02 67.89 3kru s SER 323 CO 0.23 -0.32 2.00 0.07 0.98 0.00 0.00 173.24 176.20 3kru h LYS 324 N 4.56 0.00 0.00 4.02 2.10 -1.93 -2.40 116.57 122.92 3kru h LYS 324 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 3kru h LYS 324 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3kru h LYS 324 CO 0.41 0.00 0.00 0.93 -2.00 0.00 0.00 179.45 178.79 3kru h GLU 325 N 0.00 0.00 0.00 0.07 3.07 -1.96 -1.89 114.58 113.87 3kru h GLU 325 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3kru h GLU 325 Cb 0.41 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 3kru h GLU 325 CO 0.00 0.00 0.00 -0.44 -1.40 0.00 0.00 179.01 177.17 3kru h ASP 326 N 0.00 0.00 -3.90 1.42 3.32 -1.87 -3.46 116.42 111.93 3kru h ASP 326 Ca 0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 3kru h ASP 326 Cb 0.41 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.98 3kru h ASP 326 CO 0.00 0.00 0.22 0.26 -1.72 0.00 0.00 179.24 178.00 3kru s TRP 327 N -3.14 3.50 0.37 4.55 0.52 -0.71 -5.02 118.94 119.01 3kru s TRP 327 Ca 0.10 1.15 -0.27 0.00 0.02 0.00 0.00 56.10 57.10 3kru s TRP 327 Cb 0.11 -2.55 -0.11 0.00 -1.15 0.00 0.00 33.47 29.77 3kru s TRP 327 CO 0.59 -0.28 1.22 -2.30 0.02 0.00 0.00 176.95 176.20 3kru n PRO 328 N -1.73 1.89 0.01 4.98 -0.02 -1.26 -4.81 135.00 134.05 3kru n PRO 328 Ca 0.04 0.67 0.03 0.00 -2.02 0.00 0.00 63.50 62.21 3kru n PRO 328 Cb 0.54 -2.26 0.40 0.00 -0.02 0.00 0.00 33.50 32.16 3kru n PRO 328 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3kru h LYS 329 N 2.21 0.52 0.00 -0.52 1.63 -1.94 -0.55 116.57 117.93 3kru h LYS 329 Ca -0.46 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.27 3kru h LYS 329 Cb 1.30 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 32.82 3kru h LYS 329 CO 0.61 0.40 -0.08 1.96 -3.45 0.00 0.00 179.45 178.88 3kru h GLN 330 N 0.53 0.00 -0.21 1.90 7.50 -2.00 -2.92 115.11 119.91 3kru h GLN 330 Ca 0.14 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.29 3kru h GLN 330 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.57 3kru h GLN 330 CO -0.02 0.08 0.00 0.66 -1.50 0.00 0.00 178.83 178.05 3kru n TYR 331 N -4.06 0.27 -0.29 2.96 4.01 -0.25 -4.64 117.16 115.16 3kru n TYR 331 Ca -0.03 -0.23 0.15 0.00 -0.16 0.00 0.00 57.90 57.63 3kru n TYR 331 Cb 0.17 -0.01 0.41 0.00 -0.31 0.00 0.00 39.34 39.60 3kru n TYR 331 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 3kru h GLU 332 N 2.60 0.59 0.00 -0.72 4.81 -1.27 0.31 114.58 120.89 3kru h GLU 332 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3kru h GLU 332 Cb 0.67 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3kru h GLU 332 CO 0.00 0.39 0.00 0.00 -0.73 0.00 0.00 179.01 178.67 3kru h ARG 333 N 0.60 0.00 -0.01 1.92 -0.00 -1.83 -1.90 114.38 113.17 3kru h ARG 333 Ca 0.50 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.98 3kru h ARG 333 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.94 3kru h ARG 333 CO -0.25 0.00 -0.31 0.00 0.00 0.00 0.00 179.97 179.41 3kru n ALA 334 N -2.06 3.20 0.33 0.04 0.00 0.10 -5.25 120.51 116.86 3kru n ALA 334 Ca -0.03 -0.46 0.03 0.00 0.00 0.00 0.00 53.44 52.98 3kru n ALA 334 Cb 0.09 -1.05 0.16 0.00 0.00 0.00 0.00 19.45 18.64 3kru n ALA 334 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84