#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 0.49 -0.10 2.46 2.10 -2.00 -0.87 117.51 119.60 3kru h ILE 3 Ca 0.00 0.00 0.03 0.00 1.08 0.00 0.00 64.86 65.97 3kru h ILE 3 Cb 0.00 0.72 -0.00 0.00 -1.09 0.00 0.00 36.82 36.44 3kru h ILE 3 CO 0.00 0.00 0.09 -0.07 -1.08 0.00 0.00 178.15 177.09 3kru h LEU 4 N 0.00 0.00 -1.14 2.19 3.38 -1.94 -2.33 115.31 115.47 3kru h LEU 4 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3kru h LEU 4 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3kru h LEU 4 CO -0.00 0.00 0.00 1.41 0.09 0.00 0.00 178.44 179.94 3kru n HIS 5 N -4.08 0.17 -2.64 1.13 8.25 -0.33 -0.86 115.22 116.85 3kru n HIS 5 Ca -0.01 -0.09 -0.42 0.00 -0.26 0.00 0.00 57.72 56.95 3kru n HIS 5 Cb 0.20 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.28 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 -1.83 4.51 0.74 -0.41 -1.94 -0.88 -4.63 119.30 114.87 3kru s MET 6 Ca 0.34 1.49 -0.13 0.00 -1.71 0.00 0.00 55.69 55.68 3kru s MET 6 Cb 0.18 -3.45 0.04 0.00 2.01 0.00 0.00 34.83 33.61 3kru s MET 6 CO 0.28 -0.14 1.13 -1.25 -0.01 0.00 0.00 175.02 175.03 3kru s PRO 7 N 1.20 2.25 -0.16 2.03 0.04 -1.24 -3.93 135.00 135.19 3kru s PRO 7 Ca 0.53 1.44 -0.01 0.00 0.04 0.00 0.00 61.00 63.00 3kru s PRO 7 Cb -0.22 -1.88 0.04 0.00 0.04 0.00 0.00 34.50 32.48 3kru s PRO 7 CO 0.27 -1.68 -0.05 -1.17 0.04 0.00 0.00 177.00 174.41 3kru s LEU 8 N -5.45 1.51 -0.14 -3.56 2.96 0.51 -4.93 118.68 109.58 3kru s LEU 8 Ca 0.67 -0.61 -0.14 0.00 -0.22 0.00 0.00 54.13 53.83 3kru s LEU 8 Cb -0.22 -0.87 -0.05 0.00 0.50 0.00 0.00 46.19 45.55 3kru s LEU 8 CO 0.48 -0.18 0.31 -0.75 -1.32 0.00 0.00 176.35 174.89 3kru s LYS 9 N 1.67 4.18 -0.10 1.98 2.20 -1.26 -0.74 119.74 127.66 3kru s LYS 9 Ca 0.01 0.14 -0.01 0.00 -0.36 0.00 0.00 55.97 55.75 3kru s LYS 9 Cb -0.15 -3.39 0.03 0.00 -1.51 0.00 0.00 37.83 32.81 3kru s LYS 9 CO -0.08 0.31 -0.04 0.42 -0.36 0.00 0.00 175.35 175.61 3kru s ILE 10 N 0.23 0.75 0.00 5.43 1.01 0.25 -4.99 121.20 123.87 3kru s ILE 10 Ca 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.68 3kru s ILE 10 Cb -0.13 -0.85 0.00 0.00 0.01 0.00 0.00 42.46 41.49 3kru s ILE 10 CO 0.05 0.29 0.00 0.29 0.00 0.00 0.00 174.94 175.58 3kru n LYS 11 N 5.03 0.00 -0.09 2.79 4.76 -1.26 -1.30 118.16 128.09 3kru n LYS 11 Ca -0.10 0.00 0.10 0.00 -2.87 0.00 0.00 58.31 55.44 3kru n LYS 11 Cb 0.50 0.00 0.36 0.00 -1.84 0.00 0.00 35.03 34.05 3kru n LYS 11 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 3kru n ASP 12 N 3.20 1.59 -4.59 4.39 9.92 -0.58 -4.88 116.55 125.60 3kru n ASP 12 Ca 0.00 -1.72 -0.35 0.00 -0.53 0.00 0.00 54.79 52.18 3kru n ASP 12 Cb 0.00 -0.11 -0.10 0.00 -0.64 0.00 0.00 41.12 40.26 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 -1.77 4.73 -0.29 0.53 -1.09 -0.42 -5.07 121.20 117.81 3kru s ILE 13 Ca 0.31 -0.05 -0.07 0.00 -2.23 0.00 0.00 60.65 58.61 3kru s ILE 13 Cb 0.16 -3.16 0.00 0.00 -1.58 0.00 0.00 42.46 37.89 3kru s ILE 13 CO 0.25 0.41 0.08 -0.89 -1.23 0.00 0.00 174.94 173.56 3kru s THR 14 N 0.77 4.03 -0.15 2.92 2.01 -1.26 -0.58 115.64 123.37 3kru s THR 14 Ca 0.04 -0.61 -0.22 0.00 0.31 0.00 0.00 61.69 61.21 3kru s THR 14 Cb -0.13 -3.04 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 3kru s THR 14 CO 0.02 0.12 0.66 -0.63 -0.69 0.00 0.00 174.62 174.10 3kru s ILE 15 N 1.52 5.03 -0.07 1.82 1.01 0.08 -4.90 121.20 125.69 3kru s ILE 15 Ca 0.03 1.29 0.31 0.00 0.00 0.00 0.00 60.65 62.28 3kru s ILE 15 Cb -0.17 -3.98 0.36 0.00 0.01 0.00 0.00 42.46 38.68 3kru s ILE 15 CO 0.03 0.16 1.90 0.07 0.00 0.00 0.00 174.94 177.10 3kru h LYS 16 N 7.18 0.00 0.00 2.79 2.10 -1.86 0.14 116.57 126.93 3kru h LYS 16 Ca -0.35 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.11 3kru h LYS 16 Cb 1.16 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.45 3kru h LYS 16 CO 0.77 0.00 -0.00 0.27 -2.00 0.00 0.00 179.45 178.49 3kru n ASN 17 N -2.87 -1.65 -1.56 7.07 0.23 -1.26 -3.62 115.26 111.61 3kru n ASN 17 Ca 0.01 -2.75 0.10 0.00 -0.53 0.00 0.00 54.58 51.41 3kru n ASN 17 Cb 0.30 2.92 0.35 0.00 -2.08 0.00 0.00 39.78 41.27 3kru n ASN 17 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3kru n ARG 18 N -0.55 3.66 -3.72 -3.83 5.12 -0.04 -4.58 116.66 112.72 3kru n ARG 18 Ca -0.03 -2.87 -0.37 0.00 -1.93 0.00 0.00 57.85 52.66 3kru n ARG 18 Cb 0.57 -1.87 -0.10 0.00 -1.16 0.00 0.00 32.46 29.91 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 -1.79 5.09 -0.11 0.55 -1.09 -1.26 -0.71 121.20 121.88 3kru s ILE 19 Ca 0.51 0.09 -0.01 0.00 -2.23 0.00 0.00 60.65 59.00 3kru s ILE 19 Cb 0.32 -3.37 -0.03 0.00 -1.58 0.00 0.00 42.46 37.80 3kru s ILE 19 CO 0.25 0.34 -0.05 -0.32 -1.23 0.00 0.00 174.94 173.93 3kru s MET 20 N 1.19 3.19 -0.39 2.79 -2.45 -0.22 -2.11 119.30 121.31 3kru s MET 20 Ca 0.06 -0.53 -0.29 0.00 -1.25 0.00 0.00 55.69 53.69 3kru s MET 20 Cb -0.14 -2.75 0.02 0.00 1.25 0.00 0.00 34.83 33.21 3kru s MET 20 CO 0.05 0.47 1.15 1.41 1.05 0.00 0.00 175.02 179.16 3kru s MET 21 N -0.28 3.88 0.42 4.11 1.75 0.15 -0.81 119.30 128.52 3kru s MET 21 Ca 0.04 0.88 -0.26 0.00 -1.25 0.00 0.00 55.69 55.10 3kru s MET 21 Cb -0.13 -3.84 -0.09 0.00 2.84 0.00 0.00 34.83 33.61 3kru s MET 21 CO 0.02 -1.17 1.46 0.45 -0.65 0.00 0.00 175.02 175.14 3kru s SER 22 N 2.27 6.02 0.11 1.11 0.15 -0.26 -2.01 113.70 121.09 3kru s SER 22 Ca 0.49 3.00 -0.31 0.00 0.70 0.00 0.00 55.95 59.83 3kru s SER 22 Cb -0.11 -2.66 -0.10 0.00 -1.71 0.00 0.00 66.02 61.44 3kru s SER 22 CO 0.24 -1.08 1.79 -2.16 1.20 0.00 0.00 173.24 173.22 3kru s PRO 23 N -2.33 4.15 -0.10 5.44 0.04 -1.24 -4.81 135.00 136.16 3kru s PRO 23 Ca 0.58 2.53 -0.02 0.00 0.04 0.00 0.00 61.00 64.13 3kru s PRO 23 Cb -0.45 -3.60 0.04 0.00 0.04 0.00 0.00 34.50 30.52 3kru s PRO 23 CO 0.60 -0.82 0.04 -1.64 0.04 0.00 0.00 177.00 175.22 3kru s MET 24 N 2.74 0.31 0.27 4.56 -1.94 -1.26 -4.85 119.30 119.13 3kru s MET 24 Ca 0.79 0.08 -0.31 0.00 -1.71 0.00 0.00 55.69 54.55 3kru s MET 24 Cb -0.44 -1.14 -0.12 0.00 2.01 0.00 0.00 34.83 35.14 3kru s MET 24 CO 0.35 -0.42 1.55 0.00 -0.01 0.00 0.00 175.02 176.49 3kru n MET 26 N 2.26 1.87 -4.08 0.00 2.81 -1.26 -5.01 117.12 113.71 3kru n MET 26 Ca 0.10 -0.02 -0.32 0.00 -1.81 0.00 0.00 57.70 55.65 3kru n MET 26 Cb 0.35 -1.22 -0.01 0.00 -0.71 0.00 0.00 33.22 31.63 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 -1.45 -1.88 -0.29 2.03 4.01 -1.26 -4.85 117.16 113.48 3kru n TYR 27 Ca 0.02 0.82 0.00 0.00 -0.16 0.00 0.00 57.90 58.58 3kru n TYR 27 Cb 0.25 -3.42 0.00 0.00 -0.31 0.00 0.00 39.34 35.87 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 -2.78 1.09 -4.92 7.72 7.64 -1.04 -4.87 113.62 116.47 3kru n SER 28 Ca -0.02 -1.38 -0.27 0.00 1.01 0.00 0.00 58.87 58.21 3kru n SER 28 Cb 0.54 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.78 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 -0.38 3.21 0.93 -0.43 0.00 -0.32 -4.82 121.76 119.95 3kru s ALA 29 Ca 0.00 -0.70 -0.15 0.00 0.00 0.00 0.00 51.96 51.12 3kru s ALA 29 Cb 0.00 -2.66 0.17 0.00 0.00 0.00 0.00 23.12 20.63 3kru s ALA 29 CO 0.00 -0.95 1.27 -1.54 0.00 0.00 0.00 175.76 174.54 3kru s SER 30 N -4.36 3.41 0.09 0.00 1.04 -1.24 -4.34 113.70 108.30 3kru s SER 30 Ca 0.56 0.44 0.16 0.00 0.48 0.00 0.00 55.95 57.58 3kru s SER 30 Cb -0.11 -0.62 0.68 0.00 0.10 0.00 0.00 66.02 66.07 3kru s SER 30 CO 0.46 -2.56 1.49 0.35 0.98 0.00 0.00 173.24 173.96 3kru n THR 31 N -3.69 1.07 1.65 2.02 -2.24 -1.19 -1.65 114.28 110.24 3kru n THR 31 Ca 0.13 0.30 0.15 0.00 -2.27 0.00 0.00 64.05 62.35 3kru n THR 31 Cb 0.60 -1.14 0.74 0.00 -2.10 0.00 0.00 70.33 68.43 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 -1.74 0.44 -0.67 3.42 5.68 -1.26 -4.93 116.55 117.48 3kru n ASP 32 Ca 0.02 -0.86 -0.09 0.00 -0.50 0.00 0.00 54.79 53.37 3kru n ASP 32 Cb 0.16 -0.05 -0.04 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 1.16 1.04 3.80 6.12 0.00 -0.66 -4.83 105.19 111.82 3kru n GLY 33 Ca 0.19 -0.46 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.58 4.30 0.83 1.61 -1.94 -1.26 -1.24 119.30 119.01 3kru s MET 34 Ca 0.00 0.86 -0.12 0.00 -1.71 0.00 0.00 55.69 54.72 3kru s MET 34 Cb 0.00 -3.20 0.09 0.00 2.01 0.00 0.00 34.83 33.73 3kru s MET 34 CO 0.00 0.59 1.10 -1.25 -0.01 0.00 0.00 175.02 175.46 3kru s PRO 35 N -1.23 1.84 0.16 2.03 0.04 -1.26 -3.66 135.00 132.92 3kru s PRO 35 Ca 0.32 0.59 0.01 0.00 0.04 0.00 0.00 61.00 61.97 3kru s PRO 35 Cb -0.20 -1.89 -0.00 0.00 0.04 0.00 0.00 34.50 32.44 3kru s PRO 35 CO 0.21 -1.78 0.19 0.27 0.04 0.00 0.00 177.00 175.93 3kru n ASN 36 N -3.53 -0.50 0.20 6.66 0.23 -1.26 -4.98 115.26 112.07 3kru n ASN 36 Ca 0.07 -1.99 0.14 0.00 -0.53 0.00 0.00 54.58 52.28 3kru n ASN 36 Cb 0.57 1.02 0.76 0.00 -2.08 0.00 0.00 39.78 40.04 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 0.97 0.00 -0.02 0.53 3.32 -1.97 -1.29 116.42 117.96 3kru h ASP 37 Ca -0.12 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 3kru h ASP 37 Cb 0.58 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.13 3kru h ASP 37 CO 0.17 0.00 0.01 -0.25 -1.72 0.00 0.00 179.24 177.45 3kru h TRP 38 N 0.00 0.02 -0.76 4.55 7.01 -1.96 -1.51 115.95 123.30 3kru h TRP 38 Ca 0.07 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.08 3kru h TRP 38 Cb 0.34 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 27.35 3kru h TRP 38 CO 0.00 0.10 0.49 0.45 -2.79 0.00 0.00 178.44 176.69 3kru h HIS 39 N -0.06 0.96 -0.19 2.65 3.86 -1.61 -0.55 115.15 120.21 3kru h HIS 39 Ca 0.01 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 3kru h HIS 39 Cb 0.08 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.22 3kru h HIS 39 CO -0.05 0.62 0.09 0.82 0.86 0.00 0.00 177.93 180.27 3kru h ILE 40 N 1.03 1.13 -0.33 2.45 2.04 -1.25 -1.33 117.51 121.24 3kru h ILE 40 Ca 0.28 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3kru h ILE 40 Cb -0.10 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3kru h ILE 40 CO -0.06 0.12 0.13 0.58 0.00 0.00 0.00 178.15 178.92 3kru h VAL 41 N 0.18 1.19 -0.28 1.67 2.07 -1.21 -1.18 116.25 118.70 3kru h VAL 41 Ca 0.07 -0.59 0.06 0.00 0.82 0.00 0.00 66.70 67.06 3kru h VAL 41 Cb 0.11 0.96 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 3kru h VAL 41 CO -0.01 0.21 -0.18 -0.74 0.02 0.00 0.00 177.57 176.87 3kru h HIS 42 N 0.39 -0.45 -0.06 1.57 -0.00 -0.83 0.40 115.15 116.16 3kru h HIS 42 Ca 0.11 0.03 -0.23 0.00 -0.00 0.00 0.00 60.37 60.28 3kru h HIS 42 Cb 0.20 0.24 0.02 0.00 -0.00 0.00 0.00 27.41 27.87 3kru h HIS 42 CO -0.00 -0.25 -0.86 1.88 -0.00 0.00 0.00 177.93 178.70 3kru h TYR 43 N -0.15 0.99 -0.87 5.26 0.05 -1.26 -3.24 116.97 117.74 3kru h TYR 43 Ca 0.15 -0.49 0.06 0.00 0.05 0.00 0.00 58.73 58.50 3kru h TYR 43 Cb 0.38 -0.13 -0.06 0.00 1.01 0.00 0.00 36.73 37.93 3kru h TYR 43 CO -0.36 1.32 0.57 0.00 -1.05 0.00 0.00 178.16 178.64 3kru h ALA 44 N 0.45 1.54 -0.82 3.88 0.00 -0.96 -1.89 119.26 121.45 3kru h ALA 44 Ca -0.09 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.88 3kru h ALA 44 Cb 1.51 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 3kru h ALA 44 CO 0.17 0.34 0.48 1.15 0.00 0.00 0.00 179.25 181.38 3kru h THR 45 N 0.99 0.93 0.00 0.00 2.02 -0.95 -0.68 112.91 115.23 3kru h THR 45 Ca 0.37 -0.28 -0.14 0.00 0.77 0.00 0.00 66.41 67.14 3kru h THR 45 Cb 0.19 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.63 3kru h THR 45 CO -0.14 0.15 -0.65 0.03 0.37 0.00 0.00 175.52 175.28 3kru h ARG 46 N 0.82 0.00 -0.14 6.66 -0.00 -1.45 -0.34 114.38 119.92 3kru h ARG 46 Ca 0.39 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.86 3kru h ARG 46 Cb 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.28 3kru h ARG 46 CO -0.23 0.65 0.06 0.00 0.00 0.00 0.00 179.97 180.46 3kru h ALA 47 N 1.35 0.18 -0.99 0.04 0.00 -0.99 -2.00 119.26 116.85 3kru h ALA 47 Ca -0.01 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.88 3kru h ALA 47 Cb 1.41 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 19.08 3kru h ALA 47 CO 0.09 -0.24 0.64 0.82 0.00 0.00 0.00 179.25 180.56 3kru h ILE 48 N 0.08 1.09 0.00 0.00 1.08 -1.08 -1.81 117.51 116.88 3kru h ILE 48 Ca 0.05 -0.40 0.00 0.00 -0.39 0.00 0.00 64.86 64.12 3kru h ILE 48 Cb 0.15 -0.17 0.00 0.00 -3.07 0.00 0.00 36.82 33.73 3kru h ILE 48 CO -0.00 0.21 0.00 0.61 -0.69 0.00 0.00 178.15 178.28 3kru n GLY 49 N -1.37 -0.64 0.43 5.37 0.00 -0.15 -4.79 105.19 104.05 3kru n GLY 49 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 0.26 0.63 3.69 -0.02 0.00 -0.68 -2.92 105.19 106.16 3kru n GLY 50 Ca 0.14 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.72 3kru n GLY 50 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3kru n VAL 51 N -2.02 0.29 -0.03 1.61 0.31 -0.81 -4.92 118.33 112.76 3kru n VAL 51 Ca 0.00 -0.07 -0.12 0.00 -0.01 0.00 0.00 64.34 64.13 3kru n VAL 51 Cb 0.00 -1.68 -0.07 0.00 -0.91 0.00 0.00 33.84 31.17 3kru n VAL 51 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3kru h GLY 52 N 5.68 0.19 -7.06 2.92 0.00 -1.71 -3.41 103.07 99.68 3kru h GLY 52 Ca -0.45 -0.16 -0.51 0.00 0.00 0.00 0.00 47.33 46.22 3kru h GLY 52 CO 0.87 0.14 -0.78 -2.27 0.00 0.00 0.00 176.54 174.50 3kru s LEU 53 N -9.42 1.19 -0.35 3.11 0.20 -0.95 -1.41 118.68 111.04 3kru s LEU 53 Ca -0.15 -0.51 -0.17 0.00 0.69 0.00 0.00 54.13 54.00 3kru s LEU 53 Cb 0.04 -0.70 -0.00 0.00 -0.43 0.00 0.00 46.19 45.10 3kru s LEU 53 CO 0.70 -0.21 0.44 -0.63 -0.29 0.00 0.00 176.35 176.36 3kru s ILE 54 N 1.79 5.09 -0.43 6.68 1.01 -0.10 -0.67 121.20 134.56 3kru s ILE 54 Ca 0.02 0.14 -0.18 0.00 0.00 0.00 0.00 60.65 60.63 3kru s ILE 54 Cb -0.15 -3.91 0.03 0.00 0.01 0.00 0.00 42.46 38.44 3kru s ILE 54 CO -0.07 -0.19 0.50 -0.32 0.00 0.00 0.00 174.94 174.86 3kru s MET 55 N 2.21 3.14 0.39 2.79 1.75 -0.85 -0.52 119.30 128.20 3kru s MET 55 Ca 0.15 -0.68 -0.27 0.00 -1.25 0.00 0.00 55.69 53.64 3kru s MET 55 Cb -0.16 -3.97 -0.11 0.00 2.84 0.00 0.00 34.83 33.43 3kru s MET 55 CO 0.13 -0.92 1.35 0.94 -0.65 0.00 0.00 175.02 175.87 3kru n GLN 56 N 5.79 2.21 -0.88 4.11 7.27 -0.05 -3.60 117.38 132.24 3kru n GLN 56 Ca -0.06 0.78 -0.34 0.00 0.07 0.00 0.00 57.00 57.45 3kru n GLN 56 Cb 0.47 -2.47 0.09 0.00 2.41 0.00 0.00 30.24 30.74 3kru n GLN 56 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 3kru n GLU 57 N 0.25 -0.18 -1.60 3.69 0.28 -1.26 -2.57 120.64 119.24 3kru n GLU 57 Ca 0.05 -0.03 -0.60 0.00 -0.16 0.00 0.00 57.16 56.41 3kru n GLU 57 Cb 0.39 -1.52 -0.09 0.00 1.43 0.00 0.00 31.44 31.65 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 -3.17 -0.29 -3.97 -1.84 0.00 -1.26 -4.24 120.51 105.74 3kru n ALA 58 Ca 0.03 0.32 -0.33 0.00 0.00 0.00 0.00 53.44 53.46 3kru n ALA 58 Cb 0.55 -2.15 -0.15 0.00 0.00 0.00 0.00 19.45 17.70 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 4.37 2.37 0.11 0.00 2.01 0.14 -4.33 115.64 120.31 3kru s THR 59 Ca 1.06 -1.19 -0.31 0.00 0.31 0.00 0.00 61.69 61.56 3kru s THR 59 Cb -1.26 -2.20 -0.07 0.00 0.01 0.00 0.00 72.50 68.99 3kru s THR 59 CO 0.69 0.24 1.29 0.00 -0.69 0.00 0.00 174.62 176.15 3kru s ALA 60 N 1.24 3.50 -0.80 7.40 0.00 -0.57 -1.61 121.76 130.91 3kru s ALA 60 Ca -0.01 1.00 0.26 0.00 0.00 0.00 0.00 51.96 53.21 3kru s ALA 60 Cb -0.16 -3.49 0.64 0.00 0.00 0.00 0.00 23.12 20.11 3kru s ALA 60 CO -0.08 -0.52 1.55 1.33 0.00 0.00 0.00 175.76 178.05 3kru n VAL 61 N 3.66 0.26 -4.02 0.00 0.24 -0.56 -1.21 118.33 116.71 3kru n VAL 61 Ca 0.09 -0.17 -0.08 0.00 -2.04 0.00 0.00 64.34 62.14 3kru n VAL 61 Cb 0.44 -0.21 -0.10 0.00 -1.47 0.00 0.00 33.84 32.50 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 -3.09 0.45 0.31 7.34 2.02 -1.26 -4.34 118.70 120.13 3kru s GLU 62 Ca 0.10 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.24 3kru s GLU 62 Cb 0.15 0.16 0.50 0.00 0.10 0.00 0.00 34.13 35.04 3kru s GLU 62 CO 0.66 -0.08 1.90 0.66 0.02 0.00 0.00 175.26 178.41 3kru h SER 63 N 4.00 0.74 0.44 -0.19 4.64 -1.94 0.11 113.55 121.35 3kru h SER 63 Ca -0.33 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3kru h SER 63 Cb 1.18 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 3kru h SER 63 CO 0.51 0.66 0.00 -2.11 -0.87 0.00 0.00 176.83 175.03 3kru n ARG 64 N -4.33 0.15 -0.05 4.77 1.85 -1.26 -2.43 116.66 115.36 3kru n ARG 64 Ca 0.05 0.15 0.12 0.00 -1.00 0.00 0.00 57.85 57.17 3kru n ARG 64 Cb 0.16 -1.50 0.34 0.00 -1.05 0.00 0.00 32.46 30.41 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 0.26 0.56 3.77 2.89 0.00 0.02 -4.61 105.19 108.09 3kru n GLY 65 Ca 0.07 -0.54 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 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 3.07 -0.08 1.61 0.52 -1.02 -0.20 118.95 120.97 3kru s ARG 66 Ca 0.34 1.52 -0.23 0.00 -0.52 0.00 0.00 55.73 56.84 3kru s ARG 66 Cb 0.20 -1.97 -0.29 0.00 0.52 0.00 0.00 34.95 33.40 3kru s ARG 66 CO 0.30 -1.06 0.81 0.82 0.02 0.00 0.00 175.30 176.19 3kru h ILE 67 N 0.63 1.53 -3.69 1.52 2.04 -1.91 -3.39 117.51 114.24 3kru h ILE 67 Ca -0.48 -2.46 -0.31 0.00 1.00 0.00 0.00 64.86 62.61 3kru h ILE 67 Cb 1.26 3.19 -0.15 0.00 -0.74 0.00 0.00 36.82 40.38 3kru h ILE 67 CO 0.55 0.67 -0.66 0.42 0.00 0.00 0.00 178.15 179.14 3kru s THR 68 N -2.37 0.74 -0.84 -0.27 -4.23 -1.26 -0.51 115.64 106.89 3kru s THR 68 Ca -0.16 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 58.38 3kru s THR 68 Cb 0.00 -2.16 0.13 0.00 1.34 0.00 0.00 72.50 71.81 3kru s THR 68 CO 0.78 -0.45 0.72 -0.90 -0.54 0.00 0.00 174.62 174.24 3kru n ASP 69 N -0.27 1.83 -0.26 3.99 5.68 -1.26 -2.17 116.55 124.08 3kru n ASP 69 Ca -0.06 -2.15 0.08 0.00 -0.50 0.00 0.00 54.79 52.15 3kru n ASP 69 Cb 0.63 -0.53 0.14 0.00 -1.14 0.00 0.00 41.12 40.22 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 0.22 -2.92 2.11 8.25 -1.26 -3.17 115.22 118.56 3kru n HIS 70 Ca 0.05 -0.86 -0.31 0.00 -0.26 0.00 0.00 57.72 56.33 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 -2.26 6.63 0.56 0.41 1.11 -0.92 -1.17 116.67 121.04 3kru s ASP 71 Ca 0.28 1.24 -0.19 0.00 0.18 0.00 0.00 52.55 54.06 3kru s ASP 71 Cb 0.24 -2.36 -0.05 0.00 1.07 0.00 0.00 42.92 41.81 3kru s ASP 71 CO 0.04 -0.34 1.15 -0.76 1.18 0.00 0.00 175.17 176.44 3kru s LEU 72 N -3.53 3.72 0.15 1.23 1.43 -1.26 -4.22 118.68 116.19 3kru s LEU 72 Ca 0.53 2.22 0.05 0.00 -1.03 0.00 0.00 54.13 55.90 3kru s LEU 72 Cb -0.10 -4.58 -0.04 0.00 0.03 0.00 0.00 46.19 41.49 3kru s LEU 72 CO 0.26 -1.33 -0.11 -0.83 0.23 0.00 0.00 176.35 174.57 3kru s GLY 73 N -1.76 1.10 -0.24 -3.19 0.00 -0.38 -1.51 107.32 101.35 3kru s GLY 73 Ca 0.74 -1.51 0.21 0.00 0.00 0.00 0.00 44.72 44.16 3kru s GLY 73 CO 0.29 -1.61 1.19 4.51 0.00 0.00 0.00 173.10 177.49 3kru n ILE 74 N -0.21 0.88 1.13 0.90 3.06 -0.35 -4.81 119.36 119.96 3kru n ILE 74 Ca -0.10 -2.30 0.12 0.00 -2.50 0.00 0.00 62.75 57.97 3kru n ILE 74 Cb 0.61 1.20 0.19 0.00 0.54 0.00 0.00 39.64 42.17 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 -0.65 0.00 -4.15 9.51 2.14 -1.23 -4.52 117.44 118.55 3kru n TRP 75 Ca 0.01 0.00 -0.09 0.00 2.07 0.00 0.00 57.50 59.49 3kru n TRP 75 Cb 0.85 -0.04 -0.10 0.00 -0.81 0.00 0.00 31.31 31.20 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 -2.40 0.71 0.53 -0.67 2.20 -1.26 -4.96 114.94 109.08 3kru s ASN 76 Ca 0.23 -1.08 0.29 0.00 -0.94 0.00 0.00 52.86 51.37 3kru s ASN 76 Cb 0.19 0.19 1.46 0.00 -2.00 0.00 0.00 41.25 41.09 3kru s ASN 76 CO 0.51 -0.60 2.06 0.44 -2.94 0.00 0.00 177.10 176.57 3kru h ASP 77 N 2.97 0.00 0.33 3.54 3.32 -1.99 -2.85 116.42 121.73 3kru h ASP 77 Ca -0.35 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.60 3kru h ASP 77 Cb 1.17 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 3kru h ASP 77 CO 0.64 0.11 -0.41 -0.33 -1.72 0.00 0.00 179.24 177.52 3kru h GLU 78 N 0.00 0.11 0.00 3.56 3.07 -2.00 -2.89 114.58 116.43 3kru h GLU 78 Ca -0.00 -0.05 -0.04 0.00 -0.50 0.00 0.00 59.36 58.77 3kru h GLU 78 Cb 0.38 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.28 3kru h GLU 78 CO 0.01 0.51 -0.17 1.96 -1.40 0.00 0.00 179.01 179.93 3kru h GLN 79 N 0.10 0.00 -0.26 2.33 4.20 -1.85 -3.29 115.11 116.34 3kru h GLN 79 Ca 0.01 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.73 3kru h GLN 79 Cb 0.77 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 3kru h GLN 79 CO 0.06 0.17 0.14 0.28 -0.67 0.00 0.00 178.83 178.81 3kru h VAL 80 N 0.00 1.02 -0.17 -0.54 2.07 -1.65 -1.21 116.25 115.77 3kru h VAL 80 Ca -0.00 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 3kru h VAL 80 Cb 0.54 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 3kru h VAL 80 CO 0.02 0.05 0.08 0.50 0.02 0.00 0.00 177.57 178.24 3kru h LYS 81 N 0.29 0.23 0.09 1.57 3.64 -1.75 -0.73 116.57 119.92 3kru h LYS 81 Ca 0.10 -0.02 -0.17 0.00 -1.27 0.00 0.00 60.65 59.29 3kru h LYS 81 Cb 0.01 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 31.79 3kru h LYS 81 CO -0.06 0.19 -0.81 0.93 -2.27 0.00 0.00 179.45 177.43 3kru h GLU 82 N 0.24 0.19 -0.67 1.90 4.39 -1.66 -3.30 114.58 115.66 3kru h GLU 82 Ca 0.06 -0.33 0.07 0.00 0.34 0.00 0.00 59.36 59.50 3kru h GLU 82 Cb 0.04 0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 28.77 3kru h GLU 82 CO -0.01 1.16 0.44 -0.07 -1.16 0.00 0.00 179.01 179.37 3kru h LEU 83 N -0.55 0.56 -2.09 1.33 3.38 -0.96 -1.95 115.31 115.04 3kru h LEU 83 Ca -0.17 0.01 0.08 0.00 0.09 0.00 0.00 57.88 57.89 3kru h LEU 83 Cb 1.50 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 3kru h LEU 83 CO 0.07 0.36 0.23 0.50 0.09 0.00 0.00 178.44 179.68 3kru h LYS 84 N 0.63 0.00 -0.57 1.13 3.64 -1.22 -0.89 116.57 119.29 3kru h LYS 84 Ca 0.30 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.58 3kru h LYS 84 Cb 0.34 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 3kru h LYS 84 CO -0.10 0.00 -0.00 0.87 -2.27 0.00 0.00 179.45 177.95 3kru h LYS 85 N 0.00 1.00 0.07 1.90 1.57 -1.46 0.51 116.57 120.15 3kru h LYS 85 Ca 0.13 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3kru h LYS 85 Cb 0.58 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.79 3kru h LYS 85 CO -0.00 0.98 -0.03 0.82 -0.57 0.00 0.00 179.45 180.65 3kru h ILE 86 N 0.92 1.07 -0.31 1.86 2.04 -1.27 -2.87 117.51 118.94 3kru h ILE 86 Ca 0.17 -0.49 0.06 0.00 1.00 0.00 0.00 64.86 65.59 3kru h ILE 86 Cb 0.54 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.95 3kru h ILE 86 CO 0.03 0.12 -0.00 0.58 0.00 0.00 0.00 178.15 178.88 3kru h VAL 87 N -0.31 0.77 -0.57 1.67 2.07 -1.20 -2.30 116.25 116.38 3kru h VAL 87 Ca -0.01 -0.03 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 3kru h VAL 87 Cb 0.27 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3kru h VAL 87 CO 0.02 0.02 0.13 0.44 0.02 0.00 0.00 177.57 178.20 3kru h ASP 88 N 0.09 0.86 0.07 0.57 3.32 -0.92 -0.97 116.42 119.43 3kru h ASP 88 Ca 0.15 -0.23 -0.19 0.00 0.02 0.00 0.00 57.03 56.78 3kru h ASP 88 Cb 0.20 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.52 3kru h ASP 88 CO -0.26 0.87 -0.67 -0.29 -1.72 0.00 0.00 179.24 177.17 3kru h ILE 89 N 0.81 1.33 -0.32 0.35 2.10 -1.38 -0.18 117.51 120.23 3kru h ILE 89 Ca 0.18 -1.97 -0.10 0.00 1.08 0.00 0.00 64.86 64.05 3kru h ILE 89 Cb 0.35 1.95 -0.01 0.00 -1.09 0.00 0.00 36.82 38.02 3kru h ILE 89 CO 0.00 0.61 -0.18 0.00 -1.08 0.00 0.00 178.15 177.50 3kru h LYS 91 N 0.45 1.04 -0.45 0.00 1.57 -1.15 -1.40 116.57 116.63 3kru h LYS 91 Ca 0.07 -0.31 0.04 0.00 -1.87 0.00 0.00 60.65 58.58 3kru h LYS 91 Cb 0.72 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 3kru h LYS 91 CO 0.05 1.00 0.30 0.00 -0.57 0.00 0.00 179.45 180.23 3kru h ALA 92 N 1.06 1.85 -0.57 3.86 0.00 -0.95 -2.04 119.26 122.47 3kru h ALA 92 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3kru h ALA 92 Cb 0.51 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3kru h ALA 92 CO 0.02 0.09 0.00 0.09 0.00 0.00 0.00 179.25 179.45 3kru n ASN 93 N -4.48 4.07 0.00 0.00 4.13 -0.93 -4.94 115.26 113.12 3kru n ASN 93 Ca 0.05 -2.33 0.00 0.00 1.68 0.00 0.00 54.58 53.98 3kru n ASN 93 Cb 0.18 -0.52 0.00 0.00 -1.54 0.00 0.00 39.78 37.90 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 1.09 0.65 3.89 7.41 0.00 -0.77 -4.36 105.19 113.12 3kru n GLY 94 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 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 3.69 0.09 4.61 0.00 -0.56 -4.91 121.76 122.68 3kru s ALA 95 Ca 0.00 -0.50 -0.27 0.00 0.00 0.00 0.00 51.96 51.19 3kru s ALA 95 Cb 0.00 -2.24 -0.06 0.00 0.00 0.00 0.00 23.12 20.82 3kru s ALA 95 CO 0.00 0.51 0.85 0.08 0.00 0.00 0.00 175.76 177.20 3kru s VAL 96 N -1.82 4.57 -0.20 0.00 1.01 -0.50 -3.90 120.40 119.56 3kru s VAL 96 Ca 0.43 1.84 -0.05 0.00 0.00 0.00 0.00 61.98 64.20 3kru s VAL 96 Cb -0.11 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 3kru s VAL 96 CO 0.25 0.37 -0.00 -0.32 0.00 0.00 0.00 175.10 175.40 3kru s MET 97 N -0.21 3.63 0.25 2.72 1.75 -1.26 -0.92 119.30 125.26 3kru s MET 97 Ca 0.42 -0.51 0.10 0.00 -1.25 0.00 0.00 55.69 54.44 3kru s MET 97 Cb -0.22 -3.07 -0.04 0.00 2.84 0.00 0.00 34.83 34.33 3kru s MET 97 CO 0.27 0.04 -0.04 0.20 -0.65 0.00 0.00 175.02 174.83 3kru s GLY 98 N 0.93 1.69 -0.05 2.11 0.00 0.32 -0.51 107.32 111.81 3kru s GLY 98 Ca 0.01 -1.63 0.03 0.00 0.00 0.00 0.00 44.72 43.14 3kru s GLY 98 CO 0.02 -1.68 -0.14 -1.50 0.00 0.00 0.00 173.10 169.80 3kru s ILE 99 N -2.19 1.22 -0.53 0.90 2.07 -0.61 -0.87 121.20 121.20 3kru s ILE 99 Ca 0.30 -0.57 -0.21 0.00 -1.41 0.00 0.00 60.65 58.76 3kru s ILE 99 Cb -0.07 -1.08 0.05 0.00 0.13 0.00 0.00 42.46 41.49 3kru s ILE 99 CO 0.18 0.37 0.75 -1.58 -1.91 0.00 0.00 174.94 172.75 3kru s GLN 100 N 0.35 3.20 -0.17 3.50 0.74 -1.06 -0.54 119.66 125.68 3kru s GLN 100 Ca -0.09 -0.65 -0.29 0.00 0.05 0.00 0.00 55.36 54.37 3kru s GLN 100 Cb -0.13 -4.08 -0.00 0.00 1.10 0.00 0.00 33.01 29.89 3kru s GLN 100 CO 0.03 -1.33 1.08 -0.51 -0.55 0.00 0.00 175.29 174.01 3kru s LEU 101 N 3.15 4.16 0.13 3.68 1.43 0.76 -0.68 118.68 131.31 3kru s LEU 101 Ca 0.21 1.51 0.06 0.00 -1.03 0.00 0.00 54.13 54.87 3kru s LEU 101 Cb -0.17 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 3kru s LEU 101 CO 0.15 -0.62 -0.14 0.00 0.23 0.00 0.00 176.35 175.96 3kru s ALA 102 N 2.88 1.54 -0.20 4.21 0.00 -0.64 -1.58 121.76 127.98 3kru s ALA 102 Ca 0.48 -1.34 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 3kru s ALA 102 Cb -0.18 -0.07 0.10 0.00 0.00 0.00 0.00 23.12 22.97 3kru s ALA 102 CO 0.12 0.09 0.31 -1.58 0.00 0.00 0.00 175.76 174.69 3kru s HIS 103 N -2.30 -0.55 -0.32 0.00 2.46 -1.26 -1.49 115.29 111.82 3kru s HIS 103 Ca 0.11 0.77 0.27 0.00 0.47 0.00 0.00 55.06 56.68 3kru s HIS 103 Cb -0.04 -0.07 1.08 0.00 -0.13 0.00 0.00 32.58 33.41 3kru s HIS 103 CO 0.03 -0.56 1.79 0.00 -2.47 0.00 0.00 174.74 173.54 3kru h ALA 104 N 8.25 1.00 -0.49 1.58 0.00 -0.84 -0.36 119.26 128.40 3kru h ALA 104 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3kru h ALA 104 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3kru h ALA 104 CO 0.22 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.88 3kru n GLY 105 N 0.09 3.09 0.00 0.00 0.00 -1.26 -1.39 105.19 105.72 3kru n GLY 105 Ca 0.02 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 0.01 -0.16 1.61 1.85 -0.86 -1.85 116.66 131.26 3kru n ARG 106 Ca 0.00 0.22 0.09 0.00 -1.00 0.00 0.00 57.85 57.16 3kru n ARG 106 Cb 0.00 -1.51 0.26 0.00 -1.05 0.00 0.00 32.46 30.16 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 -1.52 1.94 -1.95 2.89 5.02 -0.49 -4.60 118.16 119.45 3kru n LYS 107 Ca 0.04 -1.44 -0.42 0.00 -2.02 0.00 0.00 58.31 54.47 3kru n LYS 107 Cb 0.19 -1.37 -0.03 0.00 -0.02 0.00 0.00 35.03 33.80 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 4.45 3.33 -4.62 0.00 3.02 0.33 -4.82 115.26 116.95 3kru n ASN 109 Ca 0.14 -1.95 -0.42 0.00 -0.03 0.00 0.00 54.58 52.32 3kru n ASN 109 Cb 0.39 -0.25 -0.04 0.00 -0.61 0.00 0.00 39.78 39.28 3kru n ASN 109 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3kru s ILE 110 N -1.34 4.74 0.40 2.41 1.01 -1.26 -4.94 121.20 122.22 3kru s ILE 110 Ca 0.36 1.31 0.07 0.00 0.00 0.00 0.00 60.65 62.38 3kru s ILE 110 Cb 0.21 -4.19 0.27 0.00 0.01 0.00 0.00 42.46 38.75 3kru s ILE 110 CO 0.29 -0.28 2.05 0.28 0.00 0.00 0.00 174.94 177.27 3kru h SER 111 N 8.08 0.51 -0.31 3.58 0.02 -1.98 -2.35 113.55 121.11 3kru h SER 111 Ca -0.23 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 3kru h SER 111 Cb 1.09 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.50 3kru h SER 111 CO 0.91 0.36 0.00 0.00 -1.14 0.00 0.00 176.83 176.96 3kru n TYR 112 N -4.47 0.40 -2.83 3.45 0.18 -1.26 -4.94 117.16 107.68 3kru n TYR 112 Ca 0.04 -0.20 -0.25 0.00 1.88 0.00 0.00 57.90 59.38 3kru n TYR 112 Cb 0.07 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.05 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 -1.60 3.14 -1.01 -3.48 0.41 -0.88 -5.03 118.70 110.25 3kru s GLU 113 Ca 0.35 -0.26 -0.18 0.00 -0.41 0.00 0.00 54.97 54.47 3kru s GLU 113 Cb 0.19 -2.47 0.13 0.00 -1.78 0.00 0.00 34.13 30.20 3kru s GLU 113 CO 0.28 -0.32 1.25 0.34 -0.49 0.00 0.00 175.26 176.31 3kru s ASP 114 N -4.20 6.71 -0.20 -0.19 2.15 -1.26 -5.00 116.67 114.67 3kru s ASP 114 Ca 0.49 -2.19 -0.29 0.00 0.43 0.00 0.00 52.55 50.99 3kru s ASP 114 Cb -0.10 -2.43 -0.00 0.00 -0.30 0.00 0.00 42.92 40.09 3kru s ASP 114 CO 0.40 -1.05 1.14 -0.69 -0.17 0.00 0.00 175.17 174.80 3kru s VAL 115 N 2.77 4.49 0.18 1.11 1.01 -1.26 -4.84 120.40 123.86 3kru s VAL 115 Ca 0.37 1.80 0.09 0.00 0.00 0.00 0.00 61.98 64.24 3kru s VAL 115 Cb -0.04 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 3kru s VAL 115 CO -0.07 -0.17 -0.19 0.68 0.00 0.00 0.00 175.10 175.35 3kru s VAL 116 N 3.36 1.92 0.33 2.92 -7.23 -1.26 -0.56 120.40 119.88 3kru s VAL 116 Ca 0.49 -1.98 -0.12 0.00 -1.81 0.00 0.00 61.98 58.56 3kru s VAL 116 Cb -0.18 -1.92 0.02 0.00 0.56 0.00 0.00 36.38 34.86 3kru s VAL 116 CO 0.10 -0.31 0.61 -0.83 -0.31 0.00 0.00 175.10 174.36 3kru s GLY 117 N -2.76 0.70 0.25 2.32 0.00 -0.58 -2.02 107.32 105.23 3kru s GLY 117 Ca 0.18 -0.97 -0.00 0.00 0.00 0.00 0.00 44.72 43.93 3kru s GLY 117 CO 0.08 -0.57 1.69 -0.56 0.00 0.00 0.00 173.10 173.74 3kru h PRO 118 N 2.09 0.61 -4.03 2.90 0.13 -1.86 -2.02 132.00 129.82 3kru h PRO 118 Ca -0.28 -0.23 -0.17 0.00 -0.87 0.00 0.00 66.00 64.45 3kru h PRO 118 Cb 1.25 -0.04 -0.21 0.00 0.13 0.00 0.00 31.00 32.13 3kru h PRO 118 CO 0.37 0.79 -0.70 -1.12 -0.23 0.00 0.00 178.00 177.10 3kru s SER 119 N -6.78 0.29 -1.22 1.44 0.01 -1.26 -4.42 113.70 101.77 3kru s SER 119 Ca -0.08 -0.53 -0.18 0.00 1.31 0.00 0.00 55.95 56.47 3kru s SER 119 Cb 0.14 0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.45 3kru s SER 119 CO 0.81 -0.31 1.99 -0.81 0.41 0.00 0.00 173.24 175.33 3kru n PRO 120 N 1.51 2.44 -4.01 12.44 -0.04 -1.26 -4.78 135.00 141.31 3kru n PRO 120 Ca -0.23 -2.57 -0.18 0.00 -0.04 0.00 0.00 63.50 60.47 3kru n PRO 120 Cb 0.55 -3.32 -0.16 0.00 -0.04 0.00 0.00 33.50 30.53 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 4.99 0.29 0.59 0.52 1.01 -1.26 -4.89 121.20 122.45 3kru s ILE 121 Ca 0.54 0.02 -0.17 0.00 0.00 0.00 0.00 60.65 61.03 3kru s ILE 121 Cb 0.10 -0.37 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 3kru s ILE 121 CO 0.03 0.17 1.11 -0.54 0.00 0.00 0.00 174.94 175.71 3kru s LYS 122 N 0.98 3.19 0.43 2.79 1.02 -1.26 -4.52 119.74 122.36 3kru s LYS 122 Ca -0.10 1.46 0.30 0.00 0.02 0.00 0.00 55.97 57.65 3kru s LYS 122 Cb -0.14 -2.00 1.28 0.00 -0.52 0.00 0.00 37.83 36.45 3kru s LYS 122 CO -0.01 -0.95 1.89 0.00 -0.92 0.00 0.00 175.35 175.35 3kru h ALA 123 N 0.72 1.00 0.00 5.17 0.00 -1.82 -3.47 119.26 120.85 3kru h ALA 123 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3kru h ALA 123 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3kru h ALA 123 CO 0.56 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.22 3kru n GLY 124 N -0.11 0.87 0.00 0.00 0.00 -1.26 -4.48 105.19 100.20 3kru n GLY 124 Ca 0.01 -1.02 0.10 0.00 0.00 0.00 0.00 46.02 45.11 3kru n GLY 124 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3kru n ASP 125 N 0.00 0.00 -0.65 1.61 5.68 -1.26 -1.81 116.55 120.11 3kru n ASP 125 Ca 0.00 -0.02 0.12 0.00 -0.50 0.00 0.00 54.79 54.40 3kru n ASP 125 Cb 0.00 -0.28 0.22 0.00 -1.14 0.00 0.00 41.12 39.92 3kru n ASP 125 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3kru n ARG 126 N -1.28 1.75 -3.98 0.11 1.74 -1.26 -4.98 116.66 108.76 3kru n ARG 126 Ca 0.10 -1.31 -0.21 0.00 -0.77 0.00 0.00 57.85 55.65 3kru n ARG 126 Cb 0.17 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.11 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 -2.16 3.24 0.42 -1.55 2.02 -0.75 -5.10 117.35 113.47 3kru s TYR 127 Ca 0.28 -0.10 -0.23 0.00 -0.37 0.00 0.00 57.07 56.65 3kru s TYR 127 Cb 0.20 -1.55 -0.09 0.00 -0.40 0.00 0.00 41.96 40.12 3kru s TYR 127 CO 0.39 0.42 1.08 0.21 -1.57 0.00 0.00 175.55 176.07 3kru s LYS 128 N -3.94 4.03 0.05 -0.62 2.20 -1.26 -4.86 119.74 115.35 3kru s LYS 128 Ca 0.35 1.56 -0.30 0.00 -0.36 0.00 0.00 55.97 57.22 3kru s LYS 128 Cb -0.08 -2.47 -0.08 0.00 -1.51 0.00 0.00 37.83 33.69 3kru s LYS 128 CO 0.27 -0.27 1.70 -1.17 -0.36 0.00 0.00 175.35 175.53 3kru s LEU 129 N -2.81 4.37 0.49 5.43 2.96 -1.26 -4.62 118.68 123.23 3kru s LEU 129 Ca 0.60 2.50 -0.17 0.00 -0.22 0.00 0.00 54.13 56.84 3kru s LEU 129 Cb -0.23 -3.56 -0.08 0.00 0.50 0.00 0.00 46.19 42.82 3kru s LEU 129 CO 0.29 -0.92 0.96 -2.16 -1.32 0.00 0.00 176.35 173.20 3kru s PRO 130 N 3.02 4.00 -0.06 0.98 0.04 -1.26 -4.96 135.00 136.76 3kru s PRO 130 Ca 0.76 0.96 -0.27 0.00 0.04 0.00 0.00 61.00 62.49 3kru s PRO 130 Cb -0.40 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 31.95 3kru s PRO 130 CO 0.33 -0.20 0.85 0.50 0.04 0.00 0.00 177.00 178.52 3kru s ARG 131 N -3.85 4.46 -0.02 4.56 3.52 0.28 -4.37 118.95 123.52 3kru s ARG 131 Ca 0.59 1.14 -0.30 0.00 -0.13 0.00 0.00 55.73 57.03 3kru s ARG 131 Cb -0.10 -3.48 -0.05 0.00 -1.56 0.00 0.00 34.95 29.76 3kru s ARG 131 CO 0.27 -0.07 1.39 -2.00 -0.81 0.00 0.00 175.30 174.08 3kru s GLU 132 N 1.19 4.28 0.26 5.12 2.12 -1.26 -1.53 118.70 128.87 3kru s GLU 132 Ca 0.44 1.93 -0.30 0.00 0.36 0.00 0.00 54.97 57.40 3kru s GLU 132 Cb -0.19 -3.62 -0.09 0.00 0.26 0.00 0.00 34.13 30.49 3kru s GLU 132 CO 0.21 -0.60 1.10 -0.51 -0.54 0.00 0.00 175.26 174.92 3kru s LEU 133 N 2.60 4.54 0.67 2.70 1.43 -0.76 -4.95 118.68 124.92 3kru s LEU 133 Ca 0.63 2.23 -0.11 0.00 -1.03 0.00 0.00 54.13 55.85 3kru s LEU 133 Cb -0.30 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.29 3kru s LEU 133 CO 0.25 -0.15 1.07 -0.94 0.23 0.00 0.00 176.35 176.80 3kru s SER 134 N -0.73 5.76 0.35 2.29 1.04 -1.26 -4.89 113.70 116.26 3kru s SER 134 Ca 0.45 1.29 0.04 0.00 0.48 0.00 0.00 55.95 58.22 3kru s SER 134 Cb -0.31 -2.21 0.68 0.00 0.10 0.00 0.00 66.02 64.28 3kru s SER 134 CO 0.40 -1.16 1.97 0.58 0.98 0.00 0.00 173.24 176.01 3kru h VAL 135 N -0.52 1.07 -0.65 5.02 2.07 -1.99 0.00 116.25 121.25 3kru h VAL 135 Ca -0.45 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 3kru h VAL 135 Cb 1.22 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3kru h VAL 135 CO 0.62 0.15 0.18 -0.33 0.02 0.00 0.00 177.57 178.22 3kru h GLU 136 N 0.83 1.03 -0.42 1.57 3.07 -1.99 -1.50 114.58 117.16 3kru h GLU 136 Ca 0.30 -0.23 -0.13 0.00 -0.50 0.00 0.00 59.36 58.80 3kru h GLU 136 Cb 0.15 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 3kru h GLU 136 CO -0.09 0.91 -0.26 0.93 -1.40 0.00 0.00 179.01 179.10 3kru h GLU 137 N 0.96 0.89 -0.53 2.33 5.08 -1.72 -2.08 114.58 119.51 3kru h GLU 137 Ca 0.21 -0.39 0.05 0.00 -1.00 0.00 0.00 59.36 58.22 3kru h GLU 137 Cb 0.33 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.51 3kru h GLU 137 CO -0.00 1.04 0.27 0.82 -1.00 0.00 0.00 179.01 180.14 3kru h ILE 138 N 0.76 0.95 -0.76 3.13 2.04 -0.80 -1.58 117.51 121.26 3kru h ILE 138 Ca 0.09 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 65.79 3kru h ILE 138 Cb 0.81 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 3kru h ILE 138 CO 0.07 0.09 0.50 0.11 0.00 0.00 0.00 178.15 178.92 3kru h LYS 139 N 0.52 0.95 -0.51 2.37 1.79 -0.98 -0.74 116.57 119.96 3kru h LYS 139 Ca 0.23 -0.06 -0.09 0.00 -2.18 0.00 0.00 60.65 58.56 3kru h LYS 139 Cb 0.15 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.56 3kru h LYS 139 CO -0.16 0.63 -0.05 0.77 -1.08 0.00 0.00 179.45 179.55 3kru h SER 140 N 0.98 0.89 -0.25 0.86 0.02 -0.68 -0.96 113.55 114.40 3kru h SER 140 Ca 0.29 -0.25 -0.14 0.00 -0.84 0.00 0.00 61.79 60.84 3kru h SER 140 Cb -0.04 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.26 3kru h SER 140 CO -0.07 0.98 -0.39 0.40 -1.14 0.00 0.00 176.83 176.61 3kru h ILE 141 N 0.83 1.31 -0.54 3.27 2.04 -0.75 -0.63 117.51 123.03 3kru h ILE 141 Ca 0.15 -1.59 0.11 0.00 1.00 0.00 0.00 64.86 64.53 3kru h ILE 141 Cb 0.56 1.71 -0.09 0.00 -0.74 0.00 0.00 36.82 38.26 3kru h ILE 141 CO 0.03 0.50 0.00 0.58 0.00 0.00 0.00 178.15 179.27 3kru h VAL 142 N 0.44 0.57 -0.95 1.67 2.07 -1.06 -0.90 116.25 118.10 3kru h VAL 142 Ca 0.02 -0.04 0.06 0.00 0.82 0.00 0.00 66.70 67.56 3kru h VAL 142 Cb 0.98 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 31.13 3kru h VAL 142 CO 0.09 0.02 0.60 0.50 0.02 0.00 0.00 177.57 178.81 3kru h LYS 143 N 0.12 1.07 -0.77 1.57 3.64 -0.88 -2.19 116.57 119.12 3kru h LYS 143 Ca 0.28 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.55 3kru h LYS 143 Cb 0.42 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 3kru h LYS 143 CO -0.45 0.71 0.31 0.00 -2.27 0.00 0.00 179.45 177.75 3kru h ALA 144 N 1.43 1.01 -0.61 5.00 0.00 -0.03 -0.05 119.26 126.00 3kru h ALA 144 Ca 0.41 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 3kru h ALA 144 Cb 0.15 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3kru h ALA 144 CO -0.17 0.63 0.32 0.74 0.00 0.00 0.00 179.25 180.77 3kru h PHE 145 N 1.12 0.86 -0.38 0.00 0.04 -0.87 -0.02 116.94 117.69 3kru h PHE 145 Ca 0.26 -0.03 0.05 0.00 2.80 0.00 0.00 57.97 61.05 3kru h PHE 145 Cb 0.21 -0.27 -0.05 0.00 2.20 0.00 0.00 35.95 38.04 3kru h PHE 145 CO 0.02 0.63 0.09 0.78 -0.60 0.00 0.00 178.31 179.23 3kru h GLY 146 N 0.83 0.45 1.48 -1.45 0.00 -0.78 -1.59 103.07 102.00 3kru h GLY 146 Ca 0.21 -0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.42 3kru h GLY 146 CO -0.03 -0.02 -0.15 0.83 0.00 0.00 0.00 176.54 177.17 3kru h GLU 147 N 0.22 0.62 -0.68 4.80 5.08 -0.73 -2.01 114.58 121.87 3kru h GLU 147 Ca 0.18 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3kru h GLU 147 Cb 0.20 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 3kru h GLU 147 CO -0.22 0.75 0.32 0.00 -1.00 0.00 0.00 179.01 178.85 3kru h ALA 148 N 1.27 0.87 -0.59 3.43 0.00 -0.74 -1.26 119.26 122.25 3kru h ALA 148 Ca 0.10 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3kru h ALA 148 Cb 0.58 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3kru h ALA 148 CO 0.04 0.45 0.18 0.00 0.00 0.00 0.00 179.25 179.91 3kru h ALA 149 N 1.15 0.77 -0.43 0.00 0.00 -0.95 0.11 119.26 119.91 3kru h ALA 149 Ca 0.23 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.00 3kru h ALA 149 Cb 0.13 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 3kru h ALA 149 CO -0.03 0.45 0.14 -0.22 0.00 0.00 0.00 179.25 179.59 3kru h LYS 150 N 0.84 0.29 -0.67 0.00 3.64 -1.10 -1.09 116.57 118.47 3kru h LYS 150 Ca 0.19 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.48 3kru h LYS 150 Cb 0.30 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 3kru h LYS 150 CO -0.00 0.19 0.12 0.00 -2.27 0.00 0.00 179.45 177.49 3kru h ARG 151 N 0.30 1.10 -0.89 1.90 3.08 -0.96 -2.18 114.38 116.73 3kru h ARG 151 Ca 0.21 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 3kru h ARG 151 Cb 0.21 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.09 3kru h ARG 151 CO -0.22 1.00 0.52 0.00 -1.07 0.00 0.00 179.97 180.19 3kru h ALA 152 N 1.09 1.13 -0.50 0.04 0.00 -0.37 -0.12 119.26 120.53 3kru h ALA 152 Ca 0.21 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3kru h ALA 152 Cb 0.42 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3kru h ALA 152 CO 0.01 0.61 0.15 -0.97 0.00 0.00 0.00 179.25 179.05 3kru h ASN 153 N 1.22 0.73 -0.49 0.00 -1.24 -1.00 -1.61 115.58 113.18 3kru h ASN 153 Ca 0.32 -0.21 -0.01 0.00 0.71 0.00 0.00 56.30 57.10 3kru h ASN 153 Cb -0.02 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 38.81 3kru h ASN 153 CO -0.06 0.74 0.27 -0.07 -1.29 0.00 0.00 177.43 177.02 3kru h LEU 154 N 0.67 0.64 -1.12 0.34 3.38 -0.94 -1.98 115.31 116.31 3kru h LEU 154 Ca 0.16 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3kru h LEU 154 Cb 0.28 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3kru h LEU 154 CO -0.00 0.54 -0.03 0.00 0.09 0.00 0.00 178.44 179.03 3kru h ALA 155 N 1.57 1.00 0.00 1.53 0.00 -0.67 -3.47 119.26 119.21 3kru h ALA 155 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3kru h ALA 155 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3kru h ALA 155 CO -0.03 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3kru n GLY 156 N 0.27 0.98 3.75 0.00 0.00 -0.66 -4.46 105.19 105.06 3kru n GLY 156 Ca 0.01 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.04 2.45 0.02 1.61 4.01 -0.90 -4.94 117.16 117.38 3kru n TYR 157 Ca 0.00 0.44 -0.04 0.00 -0.16 0.00 0.00 57.90 58.14 3kru n TYR 157 Cb 0.00 -2.41 -0.10 0.00 -0.31 0.00 0.00 39.34 36.52 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 1.88 0.00 -3.73 7.72 3.32 -1.15 -3.44 116.42 121.02 3kru h ASP 158 Ca -0.51 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.24 3kru h ASP 158 Cb 1.29 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 40.54 3kru h ASP 158 CO 0.59 0.80 -0.74 -0.69 -1.72 0.00 0.00 179.24 177.48 3kru s VAL 159 N -2.76 0.22 -0.10 -1.35 1.01 -1.02 -4.08 120.40 112.31 3kru s VAL 159 Ca -0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.88 3kru s VAL 159 Cb 0.08 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 36.21 3kru s VAL 159 CO 0.81 0.09 -0.04 0.68 0.00 0.00 0.00 175.10 176.64 3kru s VAL 160 N 0.27 3.89 -0.13 2.92 -7.23 -1.14 -1.58 120.40 117.39 3kru s VAL 160 Ca -0.02 -0.39 0.01 0.00 -1.81 0.00 0.00 61.98 59.77 3kru s VAL 160 Cb -0.05 -2.64 -0.00 0.00 0.56 0.00 0.00 36.38 34.24 3kru s VAL 160 CO -0.01 0.56 -0.17 -0.70 -0.31 0.00 0.00 175.10 174.48 3kru s GLU 161 N -0.40 3.22 -0.18 4.82 2.12 0.30 -0.47 118.70 128.12 3kru s GLU 161 Ca 0.06 -0.76 -0.23 0.00 0.36 0.00 0.00 54.97 54.40 3kru s GLU 161 Cb -0.12 -2.55 -0.02 0.00 0.26 0.00 0.00 34.13 31.70 3kru s GLU 161 CO 0.02 0.11 0.72 0.42 -0.54 0.00 0.00 175.26 175.99 3kru s ILE 162 N 0.56 4.97 -0.80 -3.70 1.01 -0.05 -0.17 121.20 123.02 3kru s ILE 162 Ca -0.10 1.39 -0.22 0.00 0.00 0.00 0.00 60.65 61.71 3kru s ILE 162 Cb -0.16 -4.03 0.08 0.00 0.01 0.00 0.00 42.46 38.36 3kru s ILE 162 CO 0.04 0.09 1.13 -2.28 0.00 0.00 0.00 174.94 173.92 3kru s HIS 163 N 1.91 2.70 -0.28 3.97 2.46 -0.61 -1.18 115.29 124.26 3kru s HIS 163 Ca 0.33 -0.74 0.11 0.00 0.47 0.00 0.00 55.06 55.24 3kru s HIS 163 Cb -0.16 -4.41 0.61 0.00 -0.13 0.00 0.00 32.58 28.48 3kru s HIS 163 CO 0.12 -1.72 1.60 0.00 -2.47 0.00 0.00 174.74 172.26 3kru n ALA 164 N 7.86 4.08 -4.33 1.58 0.00 0.08 -4.57 120.51 125.21 3kru n ALA 164 Ca 0.10 -2.61 -0.21 0.00 0.00 0.00 0.00 53.44 50.72 3kru n ALA 164 Cb 0.48 -0.95 -0.05 0.00 0.00 0.00 0.00 19.45 18.93 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 -0.62 0.38 -2.18 0.00 0.00 -1.10 -3.55 120.51 113.43 3kru n ALA 165 Ca 0.34 -1.56 -0.21 0.00 0.00 0.00 0.00 53.44 52.01 3kru n ALA 165 Cb 1.15 0.98 -0.03 0.00 0.00 0.00 0.00 19.45 21.55 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 -0.76 -0.72 -0.95 0.00 8.25 -1.19 -2.43 115.22 117.41 3kru n HIS 166 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 3kru n HIS 166 Cb 0.45 -3.85 0.00 0.00 1.12 0.00 0.00 29.99 27.71 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 -0.85 0.56 0.00 -1.41 0.00 -1.25 -4.49 105.19 97.74 3kru n GLY 167 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.99 0.06 1.61 4.01 -1.02 -4.57 117.16 111.37 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 -0.06 0.00 -0.31 0.00 0.00 39.34 38.97 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 -0.23 -0.46 7.72 5.85 -1.16 -0.34 115.31 126.69 3kru h LEU 169 Ca 0.00 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 3kru h LEU 169 Cb 0.00 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3kru h LEU 169 CO 0.00 -0.12 0.09 0.40 -0.34 0.00 0.00 178.44 178.47 3kru h ILE 170 N -0.16 1.24 -0.88 4.05 2.04 -1.80 -1.87 117.51 120.13 3kru h ILE 170 Ca 0.02 -0.87 0.06 0.00 1.00 0.00 0.00 64.86 65.07 3kru h ILE 170 Cb 0.18 0.92 -0.06 0.00 -0.74 0.00 0.00 36.82 37.13 3kru h ILE 170 CO -0.06 0.31 0.57 -0.74 0.00 0.00 0.00 178.15 178.23 3kru h HIS 171 N 0.63 1.01 -0.55 1.37 2.76 -1.53 -1.30 115.15 117.54 3kru h HIS 171 Ca 0.14 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.31 3kru h HIS 171 Cb 0.36 -0.33 -0.03 0.00 1.55 0.00 0.00 27.41 28.96 3kru h HIS 171 CO 0.02 0.53 0.22 0.93 -1.30 0.00 0.00 177.93 178.33 3kru h GLU 172 N 0.99 0.80 -0.38 5.26 5.08 -0.27 -1.51 114.58 124.54 3kru h GLU 172 Ca 0.38 -0.12 -0.14 0.00 -1.00 0.00 0.00 59.36 58.48 3kru h GLU 172 Cb 0.20 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3kru h GLU 172 CO -0.14 0.66 -0.32 0.74 -1.00 0.00 0.00 179.01 178.95 3kru h PHE 173 N 0.79 1.01 -0.11 4.33 -1.00 -0.77 -3.20 116.94 117.98 3kru h PHE 173 Ca 0.19 -0.28 -0.11 0.00 2.81 0.00 0.00 57.97 60.58 3kru h PHE 173 Cb 0.16 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 39.48 3kru h PHE 173 CO 0.01 1.06 -0.43 -0.07 -1.61 0.00 0.00 178.31 177.27 3kru h LEU 174 N 0.72 0.28 -9.34 1.54 3.38 -0.51 -3.44 115.31 107.95 3kru h LEU 174 Ca 0.07 -0.12 -0.57 0.00 0.09 0.00 0.00 57.88 57.35 3kru h LEU 174 Cb 0.89 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 41.48 3kru h LEU 174 CO 0.08 0.68 -0.11 -0.55 0.09 0.00 0.00 178.44 178.63 3kru s SER 175 N -6.88 6.72 0.65 -0.43 0.15 -0.64 -4.90 113.70 108.37 3kru s SER 175 Ca -0.05 0.86 0.39 0.00 0.70 0.00 0.00 55.95 57.85 3kru s SER 175 Cb 0.13 -2.30 2.15 0.00 -1.71 0.00 0.00 66.02 64.29 3kru s SER 175 CO 0.78 -0.01 2.26 -0.65 1.20 0.00 0.00 173.24 176.82 3kru h PRO 176 N 6.70 0.00 0.00 5.44 0.11 -1.82 -1.01 132.00 141.42 3kru h PRO 176 Ca -0.41 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.64 3kru h PRO 176 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3kru h PRO 176 CO 0.75 0.00 -0.26 -0.07 -0.21 0.00 0.00 178.00 178.21 3kru h LEU 177 N 0.00 0.00 0.00 2.35 3.38 -1.93 -3.32 115.31 115.79 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 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3kru h LEU 177 CO -0.00 0.26 -0.79 -1.54 0.09 0.00 0.00 178.44 176.46 3kru n SER 178 N -3.41 2.65 -4.20 -0.43 3.41 -0.95 -4.93 113.62 105.76 3kru n SER 178 Ca 0.00 -0.22 -0.37 0.00 -0.26 0.00 0.00 58.87 58.02 3kru n SER 178 Cb 0.46 1.11 -0.12 0.00 -0.26 0.00 0.00 64.21 65.40 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 -2.02 5.32 -0.09 4.04 3.84 -0.43 -4.09 114.94 121.52 3kru s ASN 179 Ca -0.00 -1.58 0.14 0.00 0.21 0.00 0.00 52.86 51.62 3kru s ASN 179 Cb 0.02 -1.86 0.41 0.00 -0.55 0.00 0.00 41.25 39.27 3kru s ASN 179 CO 0.15 -0.46 1.32 0.29 -2.79 0.00 0.00 177.10 175.62 3kru n LYS 180 N 4.74 2.85 -2.04 0.43 4.76 -1.26 -4.62 118.16 123.02 3kru n LYS 180 Ca -0.08 -2.45 -0.35 0.00 -2.87 0.00 0.00 58.31 52.56 3kru n LYS 180 Cb 0.43 -1.56 0.03 0.00 -1.84 0.00 0.00 35.03 32.09 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 -1.99 3.06 0.00 1.97 0.52 -1.26 -4.94 118.95 116.31 3kru s ARG 181 Ca 0.32 1.66 0.03 0.00 -0.52 0.00 0.00 55.73 57.22 3kru s ARG 181 Cb 0.23 -1.96 0.08 0.00 0.52 0.00 0.00 34.95 33.82 3kru s ARG 181 CO 0.11 -1.09 1.00 1.63 0.02 0.00 0.00 175.30 176.97 3kru n LYS 182 N -1.67 2.44 -0.17 3.54 4.76 -1.26 -2.99 118.16 122.81 3kru n LYS 182 Ca 0.12 -1.51 0.00 0.00 -2.87 0.00 0.00 58.31 54.05 3kru n LYS 182 Cb 0.51 -1.07 0.00 0.00 -1.84 0.00 0.00 35.03 32.62 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 -0.16 0.00 0.00 4.39 5.68 -1.26 -4.91 116.55 120.30 3kru n ASP 183 Ca 0.03 -0.28 0.06 0.00 -0.50 0.00 0.00 54.79 54.11 3kru n ASP 183 Cb 0.27 0.00 0.29 0.00 -1.14 0.00 0.00 41.12 40.54 3kru n ASP 183 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3kru n GLU 184 N -0.28 0.04 -0.29 0.11 0.00 -1.26 -1.98 120.64 116.98 3kru n GLU 184 Ca 0.00 0.25 0.11 0.00 0.00 0.00 0.00 57.16 57.53 3kru n GLU 184 Cb 0.00 -1.50 0.28 0.00 0.00 0.00 0.00 31.44 30.22 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 -1.46 0.77 -4.04 -1.84 4.01 -1.26 -4.51 117.16 108.84 3kru n TYR 185 Ca 0.04 -0.38 -0.11 0.00 -0.16 0.00 0.00 57.90 57.29 3kru n TYR 185 Cb 0.14 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.12 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 -1.16 0.86 -0.03 2.72 0.00 -0.84 -3.85 107.32 105.01 3kru s GLY 186 Ca 0.43 -1.12 0.00 0.00 0.00 0.00 0.00 44.72 44.03 3kru s GLY 186 CO 0.31 -0.79 0.00 -2.01 0.00 0.00 0.00 173.10 170.61 3kru n ASN 187 N -0.65 -3.66 -3.51 1.64 5.15 -1.16 -4.59 115.26 108.48 3kru n ASN 187 Ca -0.01 0.01 -0.14 0.00 -0.60 0.00 0.00 54.58 53.84 3kru n ASN 187 Cb 0.62 -1.18 -0.04 0.00 -0.53 0.00 0.00 39.78 38.65 3kru n ASN 187 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3kru s SER 188 N -2.06 -0.53 0.33 1.20 1.04 -1.26 -5.01 113.70 107.41 3kru s SER 188 Ca 0.00 0.20 0.01 0.00 0.48 0.00 0.00 55.95 56.64 3kru s SER 188 Cb 0.00 0.54 0.56 0.00 0.10 0.00 0.00 66.02 67.22 3kru s SER 188 CO 0.00 -0.80 1.97 -0.29 0.98 0.00 0.00 173.24 175.11 3kru h ILE 189 N 2.51 1.18 -0.57 -1.02 2.10 -1.99 0.58 117.51 120.30 3kru h ILE 189 Ca -0.31 -0.40 -0.09 0.00 1.08 0.00 0.00 64.86 65.13 3kru h ILE 189 Cb 1.24 0.25 -0.02 0.00 -1.09 0.00 0.00 36.82 37.20 3kru h ILE 189 CO 0.40 0.19 -0.02 -0.33 -1.08 0.00 0.00 178.15 177.31 3kru h GLU 190 N 0.90 1.00 -0.28 2.19 3.07 -1.97 -1.97 114.58 117.53 3kru h GLU 190 Ca 0.24 -0.32 -0.12 0.00 -0.50 0.00 0.00 59.36 58.66 3kru h GLU 190 Cb -0.04 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 27.77 3kru h GLU 190 CO -0.05 1.00 -0.31 -0.91 -1.40 0.00 0.00 179.01 177.34 3kru h ASN 191 N 0.92 0.76 0.20 1.42 2.35 -1.63 -2.77 115.58 116.83 3kru h ASN 191 Ca 0.16 -0.48 -0.03 0.00 -0.55 0.00 0.00 56.30 55.39 3kru h ASN 191 Cb 0.56 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.71 3kru h ASN 191 CO 0.03 1.09 -0.17 0.03 -1.65 0.00 0.00 177.43 176.76 3kru h ARG 192 N 0.44 0.00 0.00 0.81 3.08 -0.80 -2.21 114.38 115.70 3kru h ARG 192 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 3kru h ARG 192 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.94 3kru h ARG 192 CO 0.08 0.17 0.00 0.00 -1.07 0.00 0.00 179.97 179.14 3kru h ALA 193 N 1.83 1.00 -0.44 0.04 0.00 -1.26 -3.34 119.26 117.10 3kru h ALA 193 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.98 3kru h ALA 193 Cb 0.31 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 3kru h ALA 193 CO 0.02 0.00 0.06 -0.09 0.00 0.00 0.00 179.25 179.24 3kru h ARG 194 N 0.00 0.18 -0.21 0.00 2.43 -1.10 -0.89 114.38 114.78 3kru h ARG 194 Ca 0.00 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 3kru h ARG 194 Cb 0.76 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.25 3kru h ARG 194 CO 0.00 0.12 0.09 0.35 -1.51 0.00 0.00 179.97 179.01 3kru h PHE 195 N 0.18 0.16 -0.53 2.20 3.57 -1.77 0.32 116.94 121.07 3kru h PHE 195 Ca 0.22 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.78 3kru h PHE 195 Cb 0.29 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.95 3kru h PHE 195 CO -0.24 0.08 0.26 1.25 -2.23 0.00 0.00 178.31 177.44 3kru h LEU 196 N 0.19 0.37 -0.55 0.59 5.85 -1.65 -0.37 115.31 119.74 3kru h LEU 196 Ca 0.09 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 3kru h LEU 196 Cb 0.05 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3kru h LEU 196 CO -0.08 0.25 0.17 0.40 -0.34 0.00 0.00 178.44 178.84 3kru h ILE 197 N 0.50 1.24 -0.74 4.05 2.04 -0.78 -1.19 117.51 122.63 3kru h ILE 197 Ca 0.24 -0.80 -0.04 0.00 1.00 0.00 0.00 64.86 65.26 3kru h ILE 197 Cb 0.16 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 3kru h ILE 197 CO -0.17 0.30 0.30 -0.33 0.00 0.00 0.00 178.15 178.25 3kru h GLU 198 N 0.76 1.10 -0.12 2.37 5.08 -0.62 -0.77 114.58 122.38 3kru h GLU 198 Ca 0.18 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3kru h GLU 198 Cb 0.28 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3kru h GLU 198 CO -0.01 0.90 0.07 0.28 -1.00 0.00 0.00 179.01 179.25 3kru h VAL 199 N 1.06 1.02 -0.28 3.13 2.07 -0.80 -0.76 116.25 121.69 3kru h VAL 199 Ca 0.25 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.74 3kru h VAL 199 Cb 0.20 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 3kru h VAL 199 CO -0.02 0.03 0.13 0.40 0.02 0.00 0.00 177.57 178.12 3kru h ILE 200 N 0.15 0.97 -0.85 4.57 2.04 -1.00 0.38 117.51 123.76 3kru h ILE 200 Ca 0.04 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 3kru h ILE 200 Cb -0.01 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.70 3kru h ILE 200 CO -0.02 0.05 0.48 0.44 0.00 0.00 0.00 178.15 179.10 3kru h ASP 201 N 0.27 1.05 -0.14 1.72 3.32 -0.97 -0.85 116.42 120.82 3kru h ASP 201 Ca 0.12 -0.08 -0.19 0.00 0.02 0.00 0.00 57.03 56.90 3kru h ASP 201 Cb 0.06 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.34 3kru h ASP 201 CO -0.10 0.84 -0.60 -0.08 -1.72 0.00 0.00 179.24 177.58 3kru h GLU 202 N 1.19 0.75 -0.61 3.56 4.57 -0.76 -2.15 114.58 121.12 3kru h GLU 202 Ca 0.30 -0.51 0.03 0.00 -1.18 0.00 0.00 59.36 58.01 3kru h GLU 202 Cb 0.01 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.63 3kru h GLU 202 CO -0.05 1.13 0.37 0.28 -1.18 0.00 0.00 179.01 179.55 3kru h VAL 203 N 0.56 1.05 -0.14 0.32 2.07 -0.59 -2.70 116.25 116.82 3kru h VAL 203 Ca -0.00 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 3kru h VAL 203 Cb 1.20 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 3kru h VAL 203 CO 0.12 0.13 -0.16 0.03 0.02 0.00 0.00 177.57 177.71 3kru h ARG 204 N 0.71 0.23 0.00 1.57 2.47 -0.96 0.25 114.38 118.64 3kru h ARG 204 Ca 0.25 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.90 3kru h ARG 204 Cb 0.05 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.34 3kru h ARG 204 CO -0.12 0.39 -0.06 0.87 0.56 0.00 0.00 179.97 181.62 3kru h LYS 205 N 0.22 0.00 -0.15 0.04 1.57 -1.06 -3.11 116.57 114.07 3kru h LYS 205 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3kru h LYS 205 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 3kru h LYS 205 CO 0.03 0.06 0.00 0.09 -0.57 0.00 0.00 179.45 179.06 3kru n ASN 206 N -3.77 2.58 -3.86 0.86 3.02 -0.05 -4.99 115.26 109.06 3kru n ASN 206 Ca -0.02 -2.25 -0.21 0.00 -0.03 0.00 0.00 54.58 52.07 3kru n ASN 206 Cb 0.16 -0.20 -0.17 0.00 -0.61 0.00 0.00 39.78 38.96 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 -1.43 0.73 0.30 3.10 -0.11 -0.48 -3.37 118.94 117.69 3kru s TRP 207 Ca 0.17 -0.21 -0.29 0.00 1.22 0.00 0.00 56.10 56.99 3kru s TRP 207 Cb 0.11 -0.71 -0.13 0.00 -1.50 0.00 0.00 33.47 31.25 3kru s TRP 207 CO 0.07 -0.24 1.32 -2.30 -4.62 0.00 0.00 176.95 171.19 3kru n PRO 208 N 4.37 2.07 0.31 5.86 -0.02 -1.26 -4.79 135.00 141.55 3kru n PRO 208 Ca -0.20 0.73 0.19 0.00 -2.02 0.00 0.00 63.50 62.20 3kru n PRO 208 Cb 0.51 -2.33 1.05 0.00 -0.02 0.00 0.00 33.50 32.70 3kru n PRO 208 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3kru h GLU 209 N 3.18 0.00 -0.38 -0.52 4.57 -2.00 -1.58 114.58 117.84 3kru h GLU 209 Ca -0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 3kru h GLU 209 Cb 1.28 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 3kru h GLU 209 CO 0.68 0.01 0.00 0.27 -1.18 0.00 0.00 179.01 178.79 3kru n ASN 210 N -3.42 2.53 -4.55 1.04 6.94 -1.26 -4.86 115.26 111.69 3kru n ASN 210 Ca -0.03 -1.92 -0.34 0.00 -0.02 0.00 0.00 54.58 52.28 3kru n ASN 210 Cb 0.10 -0.25 -0.12 0.00 -2.36 0.00 0.00 39.78 37.15 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 -1.49 2.73 0.57 -3.83 1.02 -0.60 -1.53 119.74 116.61 3kru s LYS 211 Ca 0.34 -0.59 -0.19 0.00 0.02 0.00 0.00 55.97 55.55 3kru s LYS 211 Cb 0.18 -2.55 -0.04 0.00 -0.52 0.00 0.00 37.83 34.90 3kru s LYS 211 CO 0.25 0.63 1.16 -2.14 -0.92 0.00 0.00 175.35 174.34 3kru s PRO 212 N -0.73 3.14 -0.15 -1.68 0.02 -1.26 -4.86 135.00 129.48 3kru s PRO 212 Ca 0.11 1.69 0.01 0.00 0.02 0.00 0.00 61.00 62.83 3kru s PRO 212 Cb -0.11 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.44 3kru s PRO 212 CO 0.01 -1.04 -0.17 0.42 -0.33 0.00 0.00 177.00 175.89 3kru s ILE 213 N -1.74 2.47 0.15 2.83 1.01 -1.26 -2.90 121.20 121.75 3kru s ILE 213 Ca 0.74 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 60.59 3kru s ILE 213 Cb -0.26 -2.03 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 3kru s ILE 213 CO 0.31 0.53 0.19 -0.36 0.00 0.00 0.00 174.94 175.60 3kru s PHE 214 N 0.84 3.29 -0.09 3.97 0.40 0.38 -0.88 117.98 125.88 3kru s PHE 214 Ca -0.05 0.05 0.01 0.00 -0.60 0.00 0.00 56.93 56.34 3kru s PHE 214 Cb -0.15 -1.59 0.02 0.00 0.51 0.00 0.00 43.02 41.81 3kru s PHE 214 CO -0.01 0.52 -0.12 0.08 0.70 0.00 0.00 175.22 176.39 3kru s VAL 215 N -1.70 1.20 -0.11 -0.44 1.01 -0.77 -0.87 120.40 118.72 3kru s VAL 215 Ca 0.32 -0.47 -0.18 0.00 0.00 0.00 0.00 61.98 61.65 3kru s VAL 215 Cb -0.11 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 3kru s VAL 215 CO 0.25 0.38 0.49 -0.60 0.00 0.00 0.00 175.10 175.62 3kru s ARG 216 N 1.05 4.34 0.19 2.72 3.52 -0.33 -0.89 118.95 129.55 3kru s ARG 216 Ca -0.07 0.47 0.07 0.00 -0.13 0.00 0.00 55.73 56.08 3kru s ARG 216 Cb -0.15 -3.43 -0.05 0.00 -1.56 0.00 0.00 34.95 29.77 3kru s ARG 216 CO -0.01 0.17 -0.14 0.14 -0.81 0.00 0.00 175.30 174.64 3kru s VAL 217 N 0.59 1.66 -0.40 7.11 -7.23 -0.75 -0.74 120.40 120.63 3kru s VAL 217 Ca 0.27 -2.18 -0.12 0.00 -1.81 0.00 0.00 61.98 58.14 3kru s VAL 217 Cb -0.15 -2.00 0.04 0.00 0.56 0.00 0.00 36.38 34.82 3kru s VAL 217 CO 0.11 -0.60 0.26 -0.44 -0.31 0.00 0.00 175.10 174.12 3kru s SER 218 N -3.26 5.86 0.00 4.85 0.01 -1.26 -0.51 113.70 119.39 3kru s SER 218 Ca 0.21 -1.11 0.27 0.00 1.31 0.00 0.00 55.95 56.63 3kru s SER 218 Cb -0.01 -2.07 1.23 0.00 0.21 0.00 0.00 66.02 65.38 3kru s SER 218 CO 0.06 -0.46 1.88 0.00 0.41 0.00 0.00 173.24 175.13 3kru n ALA 219 N 5.05 2.27 -3.58 1.44 0.00 -0.09 -4.77 120.51 120.83 3kru n ALA 219 Ca -0.11 -0.11 -0.11 0.00 0.00 0.00 0.00 53.44 53.11 3kru n ALA 219 Cb 0.45 -1.43 -0.10 0.00 0.00 0.00 0.00 19.45 18.37 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 -2.82 -0.57 0.02 0.00 -1.08 -1.26 -2.95 116.67 108.00 3kru s ASP 220 Ca 0.18 1.01 0.24 0.00 -0.52 0.00 0.00 52.55 53.46 3kru s ASP 220 Cb 0.18 0.93 0.30 0.00 -1.46 0.00 0.00 42.92 42.86 3kru s ASP 220 CO 0.45 -0.19 1.26 0.47 0.52 0.00 0.00 175.17 177.68 3kru n ASP 221 N 3.79 0.61 -2.76 -0.34 8.00 0.04 -1.40 116.55 124.50 3kru n ASP 221 Ca -0.20 -0.32 -0.22 0.00 0.71 0.00 0.00 54.79 54.77 3kru n ASP 221 Cb 0.56 0.45 0.01 0.00 -0.02 0.00 0.00 41.12 42.13 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 -1.64 -1.55 -3.73 1.24 4.01 -1.26 -4.89 117.16 109.33 3kru n TYR 222 Ca 0.04 0.29 -0.12 0.00 -0.16 0.00 0.00 57.90 57.95 3kru n TYR 222 Cb 0.36 -4.21 -0.12 0.00 -0.31 0.00 0.00 39.34 35.06 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 -5.42 0.32 0.23 -0.72 -1.94 -1.26 -4.99 119.30 105.51 3kru s MET 223 Ca 0.17 0.56 -0.32 0.00 -1.71 0.00 0.00 55.69 54.40 3kru s MET 223 Cb -0.08 0.02 -0.13 0.00 2.01 0.00 0.00 34.83 36.65 3kru s MET 223 CO 0.21 -0.12 1.54 -1.91 -0.01 0.00 0.00 175.02 174.73 3kru n GLU 224 N 3.75 2.32 0.00 2.03 4.07 -1.26 -1.43 120.64 130.12 3kru n GLU 224 Ca -0.20 0.83 0.00 0.00 -0.06 0.00 0.00 57.16 57.73 3kru n GLU 224 Cb 0.55 -2.57 0.00 0.00 -0.06 0.00 0.00 31.44 29.36 3kru n GLU 224 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3kru n GLY 225 N 2.69 1.87 0.00 8.31 0.00 -1.26 -5.04 105.19 111.76 3kru n GLY 225 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 1.40 3.75 -0.02 0.00 -0.51 -4.34 105.19 103.47 3kru n GLY 226 Ca 0.00 -2.04 -0.41 0.00 0.00 0.00 0.00 46.02 43.57 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 0.79 2.40 0.37 -0.61 1.01 -1.26 -4.87 121.20 119.03 3kru s ILE 227 Ca 0.00 0.34 0.05 0.00 0.00 0.00 0.00 60.65 61.04 3kru s ILE 227 Cb 0.00 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 3kru s ILE 227 CO 0.00 0.06 0.19 0.54 0.00 0.00 0.00 174.94 175.73 3kru s ASN 228 N 0.37 2.30 0.28 3.58 2.20 -1.26 -0.78 114.94 121.64 3kru s ASN 228 Ca 0.60 -1.71 -0.03 0.00 -0.94 0.00 0.00 52.86 50.78 3kru s ASN 228 Cb -0.44 0.54 0.39 0.00 -2.00 0.00 0.00 41.25 39.74 3kru s ASN 228 CO 0.46 -0.99 1.93 -0.29 -2.94 0.00 0.00 177.10 175.27 3kru h ILE 229 N 1.94 1.22 -0.50 0.54 6.09 -1.93 -0.96 117.51 123.91 3kru h ILE 229 Ca -0.31 -0.48 0.02 0.00 -1.37 0.00 0.00 64.86 62.72 3kru h ILE 229 Cb 1.26 0.06 -0.03 0.00 0.47 0.00 0.00 36.82 38.58 3kru h ILE 229 CO 0.48 0.23 0.31 0.44 -3.07 0.00 0.00 178.15 176.54 3kru h ASP 230 N 1.12 0.50 -0.59 2.19 3.32 -1.97 -0.48 116.42 120.51 3kru h ASP 230 Ca 0.29 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.25 3kru h ASP 230 Cb -0.06 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 3kru h ASP 230 CO -0.06 0.36 0.01 -0.03 -1.72 0.00 0.00 179.24 177.80 3kru h MET 231 N 0.61 1.04 -0.28 3.56 4.05 -1.74 -2.57 114.93 119.60 3kru h MET 231 Ca 0.20 -0.32 -0.12 0.00 -0.28 0.00 0.00 59.70 59.18 3kru h MET 231 Cb 0.00 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.70 3kru h MET 231 CO -0.08 1.02 -0.33 1.98 0.23 0.00 0.00 176.91 179.73 3kru h MET 232 N 0.93 0.59 -0.76 0.39 1.85 -0.91 -1.49 114.93 115.53 3kru h MET 232 Ca 0.17 -0.27 0.06 0.00 -0.61 0.00 0.00 59.70 59.05 3kru h MET 232 Cb 0.54 -0.01 -0.06 0.00 0.43 0.00 0.00 31.60 32.50 3kru h MET 232 CO 0.03 0.84 0.45 0.28 -0.40 0.00 0.00 176.91 178.11 3kru h VAL 233 N 0.50 1.01 -0.61 -5.77 2.07 -0.96 0.58 116.25 113.07 3kru h VAL 233 Ca 0.06 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 3kru h VAL 233 Cb 0.81 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 3kru h VAL 233 CO 0.07 0.15 0.32 -0.33 0.02 0.00 0.00 177.57 177.80 3kru h GLU 234 N 0.83 0.87 -0.46 1.57 5.08 -1.02 -0.47 114.58 120.98 3kru h GLU 234 Ca 0.33 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 3kru h GLU 234 Cb 0.16 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3kru h GLU 234 CO -0.17 0.68 0.19 1.88 -1.00 0.00 0.00 179.01 180.58 3kru h TYR 235 N 0.84 0.69 -0.57 4.33 0.05 -0.60 -2.82 116.97 118.88 3kru h TYR 235 Ca 0.21 -0.05 -0.07 0.00 0.05 0.00 0.00 58.73 58.88 3kru h TYR 235 Cb 0.07 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.58 3kru h TYR 235 CO -0.01 0.58 0.08 0.82 -1.05 0.00 0.00 178.16 178.59 3kru h ILE 236 N 0.59 1.25 -0.14 -2.88 1.08 -0.67 -1.86 117.51 114.88 3kru h ILE 236 Ca 0.15 -0.96 0.04 0.00 -0.39 0.00 0.00 64.86 63.70 3kru h ILE 236 Cb 0.18 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 34.64 3kru h ILE 236 CO -0.01 0.35 0.11 0.78 -0.69 0.00 0.00 178.15 178.69 3kru h ASN 237 N 0.87 0.00 1.16 1.72 2.35 -0.90 0.83 115.58 121.61 3kru h ASN 237 Ca 0.18 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.87 3kru h ASN 237 Cb 0.40 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 3kru h ASN 237 CO 0.01 0.00 -0.29 0.24 -1.65 0.00 0.00 177.43 175.74 3kru h MET 238 N 0.00 0.00 -0.00 0.81 2.86 -1.09 -3.34 114.93 114.16 3kru h MET 238 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3kru h MET 238 Cb 0.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.95 3kru h MET 238 CO -0.00 0.29 -0.11 0.44 1.06 0.00 0.00 176.91 178.59 3kru n ILE 239 N -3.33 0.00 0.27 -1.22 -5.35 -0.63 -4.81 119.36 104.29 3kru n ILE 239 Ca 0.01 -0.44 0.15 0.00 -0.27 0.00 0.00 62.75 62.19 3kru n ILE 239 Cb 0.52 1.03 0.77 0.00 -1.74 0.00 0.00 39.64 40.23 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 0.31 0.00 -0.00 6.28 2.10 -1.01 -0.01 116.57 124.25 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 0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 3kru h LYS 240 CO 0.00 0.09 -0.03 -0.25 -2.00 0.00 0.00 179.45 177.26 3kru n ASP 241 N -3.46 0.17 -0.00 7.07 8.00 -1.26 -3.77 116.55 123.30 3kru n ASP 241 Ca -0.01 -0.56 0.04 0.00 0.71 0.00 0.00 54.79 54.96 3kru n ASP 241 Cb 0.24 -0.14 -0.05 0.00 -0.02 0.00 0.00 41.12 41.16 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 -1.06 3.73 -4.25 -1.24 5.02 -0.04 -5.05 118.16 115.26 3kru n LYS 242 Ca 0.17 -0.01 -0.14 0.00 -2.02 0.00 0.00 58.31 56.31 3kru n LYS 242 Cb 0.22 -0.91 -0.10 0.00 -0.02 0.00 0.00 35.03 34.21 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 -1.86 0.67 -0.09 -0.18 -7.23 -1.07 -4.89 120.40 105.75 3kru s VAL 243 Ca 0.02 -1.98 0.13 0.00 -1.81 0.00 0.00 61.98 58.33 3kru s VAL 243 Cb 0.06 -2.17 -0.19 0.00 0.56 0.00 0.00 36.38 34.64 3kru s VAL 243 CO 0.31 -0.42 0.15 0.47 -0.31 0.00 0.00 175.10 175.29 3kru n ASP 244 N -0.27 1.75 -3.63 4.85 8.00 -0.06 -4.83 116.55 122.37 3kru n ASP 244 Ca -0.06 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.30 3kru n ASP 244 Cb 0.63 1.14 -0.07 0.00 -0.02 0.00 0.00 41.12 42.81 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 -4.59 -0.73 -0.26 0.64 0.20 -1.22 -4.21 118.68 108.51 3kru s LEU 245 Ca -0.06 1.40 -0.08 0.00 0.69 0.00 0.00 54.13 56.09 3kru s LEU 245 Cb 0.06 2.44 -0.03 0.00 -0.43 0.00 0.00 46.19 48.23 3kru s LEU 245 CO 0.56 -0.25 0.08 -0.63 -0.29 0.00 0.00 176.35 175.82 3kru s ILE 246 N 0.34 4.37 -0.59 6.68 -1.09 -0.28 -1.85 121.20 128.79 3kru s ILE 246 Ca -0.00 -0.20 -0.22 0.00 -2.23 0.00 0.00 60.65 57.99 3kru s ILE 246 Cb -0.05 -3.08 0.06 0.00 -1.58 0.00 0.00 42.46 37.81 3kru s ILE 246 CO 0.01 0.29 0.87 -0.62 -1.23 0.00 0.00 174.94 174.27 3kru s ASP 247 N 1.62 6.24 -0.29 3.58 -1.08 -0.07 -1.26 116.67 125.40 3kru s ASP 247 Ca 0.06 -0.77 -0.15 0.00 -0.52 0.00 0.00 52.55 51.17 3kru s ASP 247 Cb -0.15 -2.39 -0.03 0.00 -1.46 0.00 0.00 42.92 38.88 3kru s ASP 247 CO 0.04 -1.24 0.36 -0.69 0.52 0.00 0.00 175.17 174.16 3kru s VAL 248 N 3.66 5.18 0.00 1.11 1.01 -0.88 -1.81 120.40 128.67 3kru s VAL 248 Ca 0.23 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.58 3kru s VAL 248 Cb -0.16 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.49 3kru s VAL 248 CO 0.14 0.08 0.00 -0.24 0.00 0.00 0.00 175.10 175.07 3kru n SER 249 N 5.34 1.23 -3.48 3.32 2.88 0.34 -4.10 113.62 119.15 3kru n SER 249 Ca -0.09 -0.07 -0.10 0.00 -1.33 0.00 0.00 58.87 57.27 3kru n SER 249 Cb 0.50 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.94 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 0.86 -0.48 0.23 -3.46 1.04 -1.26 -0.91 113.70 109.72 3kru s SER 250 Ca 0.00 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.38 3kru s SER 250 Cb 0.00 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.67 3kru s SER 250 CO 0.00 -0.90 0.00 0.61 0.98 0.00 0.00 173.24 173.93 3kru n GLY 251 N -0.35 -1.89 0.00 7.32 0.00 -0.49 -4.76 105.19 105.02 3kru n GLY 251 Ca -0.14 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.61 3.10 0.05 -0.02 0.00 -1.26 -3.19 105.19 103.26 3kru n GLY 252 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 -8.16 0.99 5.85 -1.86 -3.32 115.31 108.82 3kru h LEU 253 Ca 0.00 -0.43 -0.19 0.00 0.84 0.00 0.00 57.88 58.11 3kru h LEU 253 Cb 0.00 -0.00 -0.19 0.00 0.37 0.00 0.00 40.66 40.84 3kru h LEU 253 CO 0.00 0.43 -0.70 -0.76 -0.34 0.00 0.00 178.44 177.07 3kru s LEU 254 N -9.35 2.35 0.05 2.25 1.43 -1.26 -4.83 118.68 109.31 3kru s LEU 254 Ca -0.16 -0.72 -0.30 0.00 -1.03 0.00 0.00 54.13 51.92 3kru s LEU 254 Cb 0.02 0.04 -0.08 0.00 0.03 0.00 0.00 46.19 46.20 3kru s LEU 254 CO 0.67 -0.38 1.79 0.21 0.23 0.00 0.00 176.35 178.87 3kru s ASN 255 N -2.11 6.53 -0.03 2.29 2.47 -1.26 -4.98 114.94 117.85 3kru s ASN 255 Ca -0.04 2.55 -0.04 0.00 0.42 0.00 0.00 52.86 55.75 3kru s ASN 255 Cb -0.03 -2.55 0.01 0.00 -1.45 0.00 0.00 41.25 37.23 3kru s ASN 255 CO -0.04 -0.97 0.11 0.68 -3.72 0.00 0.00 177.10 173.16 3kru s VAL 256 N 3.51 0.02 -0.43 -5.21 -7.23 -1.26 -5.12 120.40 104.68 3kru s VAL 256 Ca 0.80 -0.18 -0.26 0.00 -1.81 0.00 0.00 61.98 60.54 3kru s VAL 256 Cb -0.41 -0.21 0.02 0.00 0.56 0.00 0.00 36.38 36.34 3kru s VAL 256 CO 0.35 -0.10 0.93 -1.81 -0.31 0.00 0.00 175.10 174.17 3kru s ASP 257 N -0.28 6.56 0.21 4.85 1.01 -1.26 -5.03 116.67 122.73 3kru s ASP 257 Ca -0.03 0.28 0.11 0.00 0.71 0.00 0.00 52.55 53.61 3kru s ASP 257 Cb -0.03 -2.46 -0.05 0.00 1.01 0.00 0.00 42.92 41.40 3kru s ASP 257 CO 0.00 -1.00 -0.21 0.27 0.21 0.00 0.00 175.17 174.45 3kru s ILE 258 N 3.70 2.23 -0.27 0.77 -4.36 -1.26 -5.09 121.20 116.92 3kru s ILE 258 Ca 0.38 -2.13 -0.29 0.00 -0.26 0.00 0.00 60.65 58.35 3kru s ILE 258 Cb -0.11 -2.11 -0.02 0.00 1.25 0.00 0.00 42.46 41.48 3kru s ILE 258 CO 0.24 -0.27 1.54 0.21 0.24 0.00 0.00 174.94 176.90 3kru s ASN 259 N -2.95 6.38 -0.16 4.36 2.47 -1.26 -5.00 114.94 118.78 3kru s ASN 259 Ca 0.22 1.41 -0.06 0.00 0.42 0.00 0.00 52.86 54.84 3kru s ASN 259 Cb -0.06 -2.53 -0.04 0.00 -1.45 0.00 0.00 41.25 37.17 3kru s ASN 259 CO 0.10 -1.29 0.06 -0.76 -3.72 0.00 0.00 177.10 171.50 3kru s LEU 260 N 5.23 3.86 0.10 3.21 1.43 -1.26 -4.97 118.68 126.28 3kru s LEU 260 Ca 0.68 0.15 -0.26 0.00 -1.03 0.00 0.00 54.13 53.67 3kru s LEU 260 Cb -0.22 -1.95 0.08 0.00 0.03 0.00 0.00 46.19 44.13 3kru s LEU 260 CO 0.29 0.24 0.86 -0.72 0.23 0.00 0.00 176.35 177.25 3kru s TYR 261 N -0.04 -0.28 0.18 0.29 -0.85 -1.26 -5.08 117.35 110.31 3kru s TYR 261 Ca 0.06 0.05 -0.32 0.00 -0.52 0.00 0.00 57.07 56.34 3kru s TYR 261 Cb -0.12 0.59 -0.12 0.00 0.38 0.00 0.00 41.96 42.69 3kru s TYR 261 CO 0.01 -0.75 1.74 -2.30 -1.52 0.00 0.00 175.55 172.73 3kru n PRO 262 N -0.36 2.73 -1.43 -3.49 -0.02 -1.26 -2.15 135.00 129.02 3kru n PRO 262 Ca -0.09 0.99 -0.06 0.00 -2.02 0.00 0.00 63.50 62.32 3kru n PRO 262 Cb 0.62 -2.84 -0.02 0.00 -0.02 0.00 0.00 33.50 31.24 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 3.99 0.63 0.13 -1.23 0.00 -0.82 -4.93 105.19 102.97 3kru n GLY 263 Ca 0.17 -0.76 0.10 0.00 0.00 0.00 0.00 46.02 45.54 3kru n GLY 263 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3kru n TYR 264 N -3.15 0.69 0.31 1.61 0.18 -0.91 -1.45 117.16 114.42 3kru n TYR 264 Ca -0.06 0.32 0.06 0.00 1.88 0.00 0.00 57.90 60.09 3kru n TYR 264 Cb 0.29 -1.01 0.07 0.00 -0.38 0.00 0.00 39.34 38.31 3kru n TYR 264 CO 0.00 0.00 0.00 1.04 -2.08 0.00 0.00 176.86 175.82 3kru n GLN 265 N -2.17 1.11 -0.12 -3.48 6.02 -1.26 -4.71 117.38 112.76 3kru n GLN 265 Ca 0.00 -1.38 -0.05 0.00 -0.01 0.00 0.00 57.00 55.57 3kru n GLN 265 Cb 0.12 -1.23 0.14 0.00 1.02 0.00 0.00 30.24 30.29 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 2.14 1.25 -0.19 5.09 2.07 -1.51 -2.82 116.25 122.27 3kru h VAL 266 Ca 0.00 -1.03 -0.05 0.00 0.82 0.00 0.00 66.70 66.45 3kru h VAL 266 Cb 0.53 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3kru h VAL 266 CO 0.00 0.36 -0.09 0.11 0.02 0.00 0.00 177.57 177.98 3kru h LYS 267 N 0.77 0.30 -0.45 1.57 1.57 -1.84 -0.72 116.57 117.77 3kru h LYS 267 Ca 0.15 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.80 3kru h LYS 267 Cb 0.47 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 3kru h LYS 267 CO 0.02 0.40 0.03 1.88 -0.57 0.00 0.00 179.45 181.21 3kru h TYR 268 N 0.29 0.84 -0.46 -1.35 0.05 -1.84 -0.76 116.97 113.73 3kru h TYR 268 Ca 0.06 -0.14 0.00 0.00 0.05 0.00 0.00 58.73 58.71 3kru h TYR 268 Cb 0.34 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.83 3kru h TYR 268 CO 0.01 0.81 0.30 0.00 -1.05 0.00 0.00 178.16 178.23 3kru h ALA 269 N 0.92 0.59 -0.50 3.88 0.00 -1.17 -1.36 119.26 121.62 3kru h ALA 269 Ca 0.13 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 3kru h ALA 269 Cb 0.46 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3kru h ALA 269 CO 0.02 0.05 -0.19 1.49 0.00 0.00 0.00 179.25 180.61 3kru h GLU 270 N 0.63 1.01 -0.45 0.00 4.81 -0.75 -2.24 114.58 117.58 3kru h GLU 270 Ca 0.17 -0.42 -0.07 0.00 -0.13 0.00 0.00 59.36 58.91 3kru h GLU 270 Cb -0.06 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 3kru h GLU 270 CO -0.04 1.10 0.02 1.15 -0.73 0.00 0.00 179.01 180.51 3kru h THR 271 N 0.87 1.26 -0.64 0.32 2.02 -0.98 -1.61 112.91 114.15 3kru h THR 271 Ca 0.12 -1.02 -0.09 0.00 0.77 0.00 0.00 66.41 66.19 3kru h THR 271 Cb 0.77 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 3kru h THR 271 CO 0.06 0.35 0.06 0.40 0.37 0.00 0.00 175.52 176.77 3kru h ILE 272 N 0.64 1.26 -0.48 3.11 2.04 -1.28 -0.40 117.51 122.40 3kru h ILE 272 Ca 0.13 -1.09 0.03 0.00 1.00 0.00 0.00 64.86 64.93 3kru h ILE 272 Cb 0.47 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 3kru h ILE 272 CO 0.02 0.40 0.28 0.50 0.00 0.00 0.00 178.15 179.35 3kru h LYS 273 N 1.00 0.54 0.08 2.37 3.64 -1.11 -1.15 116.57 121.94 3kru h LYS 273 Ca 0.19 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.39 3kru h LYS 273 Cb 0.49 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 32.20 3kru h LYS 273 CO 0.02 0.35 -0.70 0.87 -2.27 0.00 0.00 179.45 177.73 3kru h LYS 274 N 0.55 0.17 0.00 1.90 1.79 -1.24 -1.58 116.57 118.17 3kru h LYS 274 Ca 0.20 -0.30 -0.11 0.00 -2.18 0.00 0.00 60.65 58.26 3kru h LYS 274 Cb 0.04 0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.79 3kru h LYS 274 CO -0.10 1.14 -0.53 0.00 -1.08 0.00 0.00 179.45 178.88 3kru h ARG 275 N -0.60 0.00 -0.00 3.15 3.08 -1.10 -3.24 114.38 115.66 3kru h ARG 275 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.91 3kru h ARG 275 Cb 1.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.49 3kru h ARG 275 CO 0.06 0.53 -0.69 0.00 -1.07 0.00 0.00 179.97 178.80 3kru n ASN 277 N -1.10 -5.38 -3.97 0.00 5.15 -0.62 -4.99 115.26 104.36 3kru n ASN 277 Ca 0.04 -0.96 -0.09 0.00 -0.60 0.00 0.00 54.58 52.97 3kru n ASN 277 Cb 0.28 -3.73 -0.11 0.00 -0.53 0.00 0.00 39.78 35.70 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 -3.46 0.11 0.53 -1.44 2.07 -1.08 -5.06 121.20 112.87 3kru s ILE 278 Ca 0.45 -0.93 -0.22 0.00 -1.41 0.00 0.00 60.65 58.55 3kru s ILE 278 Cb -0.14 -0.37 -0.05 0.00 0.13 0.00 0.00 42.46 42.02 3kru s ILE 278 CO 0.84 -0.51 1.29 -0.54 -1.91 0.00 0.00 174.94 174.11 3kru s LYS 279 N -1.61 3.27 0.04 3.50 1.02 -1.26 -4.29 119.74 120.42 3kru s LYS 279 Ca -0.14 2.07 -0.01 0.00 0.02 0.00 0.00 55.97 57.91 3kru s LYS 279 Cb -0.08 -2.26 -0.03 0.00 -0.52 0.00 0.00 37.83 34.94 3kru s LYS 279 CO -0.01 -1.03 -0.03 0.95 -0.92 0.00 0.00 175.35 174.30 3kru s THR 280 N -1.39 0.21 -0.03 2.17 -4.23 -1.26 -1.13 115.64 109.98 3kru s THR 280 Ca 0.70 -1.53 0.03 0.00 -1.18 0.00 0.00 61.69 59.71 3kru s THR 280 Cb -0.36 -1.13 -0.03 0.00 1.34 0.00 0.00 72.50 72.32 3kru s THR 280 CO 0.43 -0.83 -0.10 -0.55 -0.54 0.00 0.00 174.62 173.03 3kru s SER 281 N -2.46 4.42 -0.04 3.99 0.15 -0.39 -0.02 113.70 119.35 3kru s SER 281 Ca -0.00 -0.14 -0.01 0.00 0.70 0.00 0.00 55.95 56.49 3kru s SER 281 Cb 0.02 -1.01 -0.04 0.00 -1.71 0.00 0.00 66.02 63.29 3kru s SER 281 CO -0.07 0.32 0.06 0.00 1.20 0.00 0.00 173.24 174.75 3kru s ALA 282 N -0.87 3.52 -0.02 5.45 0.00 -0.68 -2.07 121.76 127.09 3kru s ALA 282 Ca 0.14 -0.83 -0.16 0.00 0.00 0.00 0.00 51.96 51.10 3kru s ALA 282 Cb -0.11 -1.58 0.03 0.00 0.00 0.00 0.00 23.12 21.46 3kru s ALA 282 CO 0.04 0.65 0.35 0.54 0.00 0.00 0.00 175.76 177.34 3kru s VAL 283 N -1.09 0.05 0.00 0.00 0.11 -1.26 -0.60 120.40 117.61 3kru s VAL 283 Ca 0.19 -0.42 0.00 0.00 -2.93 0.00 0.00 61.98 58.82 3kru s VAL 283 Cb -0.12 -0.65 0.00 0.00 -1.53 0.00 0.00 36.38 34.08 3kru s VAL 283 CO 0.10 -0.23 0.00 0.61 -3.33 0.00 0.00 175.10 172.24 3kru n GLY 284 N 1.25 2.36 2.68 6.54 0.00 -1.26 -4.32 105.19 112.44 3kru n GLY 284 Ca -0.21 -0.47 -0.21 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.24 -4.64 0.99 4.77 -1.26 -1.94 117.00 112.69 3kru n LEU 285 Ca 0.00 -0.13 -0.39 0.00 -0.03 0.00 0.00 56.01 55.46 3kru n LEU 285 Cb 0.00 -2.93 -0.08 0.00 -2.33 0.00 0.00 43.42 38.07 3kru n LEU 285 CO 0.00 -0.02 0.08 -0.63 -1.33 0.00 0.00 177.39 175.49 3kru s ILE 286 N -3.09 5.19 0.00 -0.08 1.01 -1.26 -4.01 121.20 118.96 3kru s ILE 286 Ca 0.13 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.41 3kru s ILE 286 Cb -0.06 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.70 3kru s ILE 286 CO 0.17 0.21 0.00 0.35 0.00 0.00 0.00 174.94 175.66 3kru n THR 287 N 4.72 0.00 -4.00 2.92 -2.24 -1.26 -4.73 114.28 109.69 3kru n THR 287 Ca -0.08 -0.05 -0.32 0.00 -2.27 0.00 0.00 64.05 61.33 3kru n THR 287 Cb 0.51 0.39 -0.06 0.00 -2.10 0.00 0.00 70.33 69.07 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 -0.78 5.00 0.35 4.28 -4.23 -1.26 -4.99 115.64 114.01 3kru s THR 288 Ca 0.00 -0.44 0.05 0.00 -1.18 0.00 0.00 61.69 60.12 3kru s THR 288 Cb 0.00 -3.37 0.29 0.00 1.34 0.00 0.00 72.50 70.76 3kru s THR 288 CO 0.00 0.23 1.96 -0.61 -0.54 0.00 0.00 174.62 175.66 3kru h GLN 289 N 3.56 0.78 0.22 3.99 4.15 -1.98 -1.81 115.11 124.02 3kru h GLN 289 Ca -0.47 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 58.89 3kru h GLN 289 Cb 1.17 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.69 3kru h GLN 289 CO 0.68 0.51 -0.11 1.49 -1.93 0.00 0.00 178.83 179.48 3kru h GLU 290 N 0.80 -0.29 -0.53 1.69 4.81 -1.99 0.25 114.58 119.32 3kru h GLU 290 Ca 0.32 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.46 3kru h GLU 290 Cb 0.22 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 3kru h GLU 290 CO -0.10 -0.19 -0.07 1.25 -0.73 0.00 0.00 179.01 179.16 3kru h LEU 291 N -0.30 0.96 -0.42 1.64 5.85 -1.94 -1.46 115.31 119.63 3kru h LEU 291 Ca -0.03 -0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.43 3kru h LEU 291 Cb 0.23 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 3kru h LEU 291 CO 0.05 1.05 0.21 0.00 -0.34 0.00 0.00 178.44 179.41 3kru h ALA 292 N 1.03 0.53 -0.70 1.25 0.00 -1.11 -1.22 119.26 119.05 3kru h ALA 292 Ca 0.15 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3kru h ALA 292 Cb 0.61 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3kru h ALA 292 CO 0.04 -0.15 0.33 0.93 0.00 0.00 0.00 179.25 180.40 3kru h GLU 293 N 0.42 1.01 -0.50 0.00 5.08 -0.76 -2.30 114.58 117.54 3kru h GLU 293 Ca 0.18 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3kru h GLU 293 Cb 0.10 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3kru h GLU 293 CO -0.13 0.80 0.31 1.49 -1.00 0.00 0.00 179.01 180.48 3kru h GLU 294 N 0.98 0.67 -0.29 2.33 4.22 -0.95 0.32 114.58 121.86 3kru h GLU 294 Ca 0.24 -0.06 0.01 0.00 0.08 0.00 0.00 59.36 59.64 3kru h GLU 294 Cb 0.13 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 3kru h GLU 294 CO -0.03 0.48 0.17 0.82 -2.18 0.00 0.00 179.01 178.26 3kru h ILE 295 N 0.67 1.03 -0.20 2.32 2.04 -1.02 -0.28 117.51 122.06 3kru h ILE 295 Ca 0.18 -0.12 -0.14 0.00 1.00 0.00 0.00 64.86 65.78 3kru h ILE 295 Cb -0.03 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3kru h ILE 295 CO -0.04 0.06 -0.42 -0.07 0.00 0.00 0.00 178.15 177.69 3kru h LEU 296 N 0.34 0.72 -0.57 1.44 3.38 -1.27 -0.55 115.31 118.80 3kru h LEU 296 Ca 0.11 -0.55 -0.15 0.00 0.09 0.00 0.00 57.88 57.38 3kru h LEU 296 Cb 0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3kru h LEU 296 CO -0.06 1.14 -0.56 0.28 0.09 0.00 0.00 178.44 179.33 3kru h SER 297 N 0.33 0.50 -0.11 -0.43 0.02 -0.80 -2.01 113.55 111.06 3kru h SER 297 Ca 0.01 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 3kru h SER 297 Cb 1.02 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.41 3kru h SER 297 CO 0.09 0.96 0.00 0.59 -1.14 0.00 0.00 176.83 177.33 3kru n ASN 298 N -3.94 0.61 -3.62 3.07 5.03 -0.13 -4.92 115.26 111.36 3kru n ASN 298 Ca -0.03 -1.93 -0.25 0.00 0.87 0.00 0.00 54.58 53.24 3kru n ASN 298 Cb 0.60 -0.07 0.06 0.00 -1.02 0.00 0.00 39.78 39.35 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 -0.20 -7.17 0.12 3.52 1.02 -0.75 -4.88 120.64 112.29 3kru n GLU 299 Ca 0.05 0.78 0.12 0.00 -0.02 0.00 0.00 57.16 58.09 3kru n GLU 299 Cb 0.11 -5.78 0.09 0.00 -0.02 0.00 0.00 31.44 25.83 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 -2.46 0.00 -2.41 3.49 3.08 -1.32 -3.48 114.38 111.29 3kru h ARG 300 Ca -0.57 0.00 0.12 0.00 0.07 0.00 0.00 59.98 59.60 3kru h ARG 300 Cb 1.37 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.30 3kru h ARG 300 CO 0.59 0.00 0.45 0.00 -1.07 0.00 0.00 179.97 179.93 3kru s ALA 301 N -3.28 -1.72 -0.13 0.04 0.00 -1.24 -2.32 121.76 113.11 3kru s ALA 301 Ca 0.03 0.61 0.16 0.00 0.00 0.00 0.00 51.96 52.76 3kru s ALA 301 Cb 0.10 0.56 -0.24 0.00 0.00 0.00 0.00 23.12 23.54 3kru s ALA 301 CO 0.74 -0.83 0.38 -0.25 0.00 0.00 0.00 175.76 175.80 3kru n ASP 302 N -0.34 0.38 -4.18 0.00 8.00 0.98 -4.54 116.55 116.84 3kru n ASP 302 Ca -0.09 0.18 -0.19 0.00 0.71 0.00 0.00 54.79 55.40 3kru n ASP 302 Cb 0.62 0.62 -0.12 0.00 -0.02 0.00 0.00 41.12 42.22 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 -5.65 2.27 -0.20 0.64 1.43 -1.06 -4.87 118.68 111.23 3kru s LEU 303 Ca -0.07 -0.61 -0.04 0.00 -1.03 0.00 0.00 54.13 52.38 3kru s LEU 303 Cb 0.07 -0.57 -0.01 0.00 0.03 0.00 0.00 46.19 45.71 3kru s LEU 303 CO 0.83 -0.05 -0.04 -0.69 0.23 0.00 0.00 176.35 176.63 3kru s VAL 304 N -1.22 3.53 -0.17 -1.59 1.01 0.12 -1.68 120.40 120.39 3kru s VAL 304 Ca -0.01 -0.45 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 3kru s VAL 304 Cb -0.10 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.65 3kru s VAL 304 CO 0.02 0.44 0.20 0.00 0.00 0.00 0.00 175.10 175.76 3kru s ALA 305 N 1.18 3.67 -0.13 5.51 0.00 0.23 -1.05 121.76 131.17 3kru s ALA 305 Ca 0.02 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.40 3kru s ALA 305 Cb -0.14 -2.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.72 3kru s ALA 305 CO -0.01 0.19 -0.15 -0.51 0.00 0.00 0.00 175.76 175.28 3kru s LEU 306 N 0.23 2.62 0.00 0.00 1.43 0.01 -4.45 118.68 118.53 3kru s LEU 306 Ca 0.12 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 3kru s LEU 306 Cb -0.12 -1.58 0.00 0.00 0.03 0.00 0.00 46.19 44.52 3kru s LEU 306 CO 0.01 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.36 3kru n GLY 307 N 3.55 0.00 0.37 -3.19 0.00 -1.26 -1.10 105.19 103.57 3kru n GLY 307 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.97 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 0.54 -0.71 1.61 3.08 -1.96 -0.35 114.38 116.60 3kru h ARG 308 Ca 0.00 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.05 3kru h ARG 308 Cb 0.00 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 29.89 3kru h ARG 308 CO 0.00 0.36 0.47 1.49 -1.07 0.00 0.00 179.97 181.22 3kru h GLU 309 N 0.56 0.84 0.00 0.04 4.57 -1.88 -1.51 114.58 117.19 3kru h GLU 309 Ca 0.40 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 3kru h GLU 309 Cb 0.76 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 3kru h GLU 309 CO -0.16 0.56 0.00 1.28 -1.18 0.00 0.00 179.01 179.51 3kru n LEU 310 N -4.45 0.76 -0.03 1.64 4.77 -0.16 -0.28 117.00 119.25 3kru n LEU 310 Ca 0.09 0.58 -0.15 0.00 -0.03 0.00 0.00 56.01 56.50 3kru n LEU 310 Cb 0.11 -0.34 -0.11 0.00 -2.33 0.00 0.00 43.42 40.75 3kru n LEU 310 CO 0.35 -0.19 0.45 -0.07 -1.33 0.00 0.00 177.39 176.59 3kru h LEU 311 N 0.00 0.21 -0.01 2.23 3.38 -1.08 -3.24 115.31 116.80 3kru h LEU 311 Ca 0.00 -0.71 -0.13 0.00 0.09 0.00 0.00 57.88 57.13 3kru h LEU 311 Cb 0.70 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 3kru h LEU 311 CO 0.00 0.89 -0.60 0.08 0.09 0.00 0.00 178.44 178.90 3kru h ARG 312 N -0.45 0.00 -2.02 1.13 0.11 -1.36 -3.40 114.38 108.39 3kru h ARG 312 Ca -0.02 0.00 -0.56 0.00 0.10 0.00 0.00 59.98 59.50 3kru h ARG 312 Cb 0.90 0.00 -0.39 0.00 1.11 0.00 0.00 29.97 31.59 3kru h ARG 312 CO 0.04 0.60 -1.06 -1.71 0.10 0.00 0.00 179.97 177.94 3kru n ASN 313 N -3.26 0.57 0.30 0.08 5.15 0.61 -5.00 115.26 113.72 3kru n ASN 313 Ca 0.02 -2.79 0.18 0.00 -0.60 0.00 0.00 54.58 51.39 3kru n ASN 313 Cb 0.78 -0.64 0.93 0.00 -0.53 0.00 0.00 39.78 40.31 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 3.95 0.00 -0.64 1.20 0.13 -1.76 -2.37 132.00 132.51 3kru h PRO 314 Ca 0.08 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.08 3kru h PRO 314 Cb 0.86 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.91 3kru h PRO 314 CO 0.50 0.03 0.16 0.66 -0.23 0.00 0.00 178.00 179.12 3kru n TYR 315 N -3.28 2.19 -0.30 1.56 4.02 -1.26 -4.48 117.16 115.62 3kru n TYR 315 Ca -0.02 -1.05 0.13 0.00 -0.01 0.00 0.00 57.90 56.95 3kru n TYR 315 Cb 0.18 -0.60 0.28 0.00 -0.02 0.00 0.00 39.34 39.18 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 2.96 0.28 -0.47 -0.72 7.01 -1.65 -0.30 115.95 123.06 3kru h TRP 316 Ca 0.16 0.05 -0.08 0.00 2.11 0.00 0.00 58.89 61.14 3kru h TRP 316 Cb 2.15 0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 29.21 3kru h TRP 316 CO 1.17 -0.24 -0.01 0.28 -2.79 0.00 0.00 178.44 176.85 3kru h VAL 317 N 0.17 1.26 -0.88 2.65 2.07 -1.83 -2.81 116.25 116.88 3kru h VAL 317 Ca 0.55 -1.08 0.06 0.00 0.82 0.00 0.00 66.70 67.05 3kru h VAL 317 Cb 1.11 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.84 3kru h VAL 317 CO -0.69 0.37 0.57 -0.07 0.02 0.00 0.00 177.57 177.78 3kru h LEU 318 N 0.70 0.89 -1.88 2.57 3.38 -0.94 0.02 115.31 120.05 3kru h LEU 318 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3kru h LEU 318 Cb 0.52 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3kru h LEU 318 CO 0.03 0.58 0.00 0.45 0.09 0.00 0.00 178.44 179.58 3kru h HIS 319 N 1.01 0.00 0.00 1.13 3.86 -1.18 -1.68 115.15 118.29 3kru h HIS 319 Ca 0.37 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.58 3kru h HIS 319 Cb 0.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.64 3kru h HIS 319 CO -0.00 0.00 -0.40 0.25 0.86 0.00 0.00 177.93 178.63 3kru n THR 320 N -2.84 0.22 -2.41 2.45 -2.24 -0.01 -4.92 114.28 104.54 3kru n THR 320 Ca -0.01 -0.15 -0.37 0.00 -2.27 0.00 0.00 64.05 61.26 3kru n THR 320 Cb 0.17 -0.14 -0.03 0.00 -2.10 0.00 0.00 70.33 68.24 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 3.07 -1.56 4.78 2.02 -0.63 -4.90 117.35 117.06 3kru s TYR 321 Ca 0.09 1.59 0.14 0.00 -0.37 0.00 0.00 57.07 58.53 3kru s TYR 321 Cb 0.15 -3.24 0.24 0.00 -0.40 0.00 0.00 41.96 38.72 3kru s TYR 321 CO 0.67 -1.04 1.13 0.25 -1.57 0.00 0.00 175.55 174.99 3kru n THR 322 N -0.31 0.45 -3.94 -0.71 -2.24 -1.26 -4.97 114.28 101.30 3kru n THR 322 Ca 0.06 -0.72 -0.12 0.00 -2.27 0.00 0.00 64.05 61.00 3kru n THR 322 Cb 0.49 0.95 -0.13 0.00 -2.10 0.00 0.00 70.33 69.53 3kru n THR 322 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3kru s SER 323 N -1.12 0.17 0.49 3.42 0.15 -1.26 -5.04 113.70 110.50 3kru s SER 323 Ca 0.23 -0.11 0.18 0.00 0.70 0.00 0.00 55.95 56.95 3kru s SER 323 Cb 0.14 0.01 1.21 0.00 -1.71 0.00 0.00 66.02 65.66 3kru s SER 323 CO 0.19 -0.04 2.06 0.07 1.20 0.00 0.00 173.24 176.72 3kru h LYS 324 N 5.83 0.00 0.00 5.44 2.10 -1.93 -2.09 116.57 125.92 3kru h LYS 324 Ca -0.26 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.39 3kru h LYS 324 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 3kru h LYS 324 CO 0.49 0.12 0.00 -0.85 -2.00 0.00 0.00 179.45 177.21 3kru n GLU 325 N -4.21 0.00 0.12 0.07 0.00 -1.26 -1.90 120.64 113.47 3kru n GLU 325 Ca -0.03 0.20 0.13 0.00 0.00 0.00 0.00 57.16 57.46 3kru n GLU 325 Cb 0.20 -1.50 0.33 0.00 0.00 0.00 0.00 31.44 30.47 3kru n GLU 325 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 3kru h ASP 326 N 0.00 0.00 -4.11 -1.84 3.32 -1.81 -3.47 116.42 108.52 3kru h ASP 326 Ca 0.00 -0.02 -0.50 0.00 0.02 0.00 0.00 57.03 56.53 3kru h ASP 326 Cb 0.30 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.90 3kru h ASP 326 CO 0.00 0.01 0.32 0.26 -1.72 0.00 0.00 179.24 178.11 3kru s TRP 327 N -3.13 3.58 0.23 4.55 0.52 -0.80 -5.01 118.94 118.88 3kru s TRP 327 Ca 0.09 1.18 -0.31 0.00 0.02 0.00 0.00 56.10 57.09 3kru s TRP 327 Cb 0.11 -2.61 -0.14 0.00 -1.15 0.00 0.00 33.47 29.68 3kru s TRP 327 CO 0.62 -0.51 1.34 -2.30 0.02 0.00 0.00 176.95 176.13 3kru n PRO 328 N -2.38 1.85 -0.34 4.98 -0.02 -1.26 -4.80 135.00 133.04 3kru n PRO 328 Ca 0.05 0.66 0.14 0.00 -2.02 0.00 0.00 63.50 62.32 3kru n PRO 328 Cb 0.54 -2.27 0.34 0.00 -0.02 0.00 0.00 33.50 32.10 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 3.88 0.71 0.00 -0.52 1.63 -1.93 0.87 116.57 121.21 3kru h LYS 329 Ca -0.45 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.30 3kru h LYS 329 Cb 1.29 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.76 3kru h LYS 329 CO 0.73 0.47 -0.05 1.96 -3.45 0.00 0.00 179.45 179.11 3kru h GLN 330 N 0.73 0.00 -0.18 1.90 7.50 -2.01 -2.86 115.11 120.19 3kru h GLN 330 Ca 0.56 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.71 3kru h GLN 330 Cb 0.91 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.44 3kru h GLN 330 CO -0.34 0.05 0.00 0.66 -1.50 0.00 0.00 178.83 177.70 3kru n TYR 331 N -3.43 0.24 -0.32 2.96 4.01 0.26 -4.67 117.16 116.20 3kru n TYR 331 Ca -0.02 -0.26 0.18 0.00 -0.16 0.00 0.00 57.90 57.64 3kru n TYR 331 Cb 0.18 -0.01 0.43 0.00 -0.31 0.00 0.00 39.34 39.62 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 2.09 0.53 0.00 -0.72 4.81 -1.21 0.32 114.58 120.40 3kru h GLU 332 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3kru h GLU 332 Cb 0.60 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.86 3kru h GLU 332 CO 0.00 0.35 0.00 0.00 -0.73 0.00 0.00 179.01 178.63 3kru h ARG 333 N 0.55 0.00 -0.01 1.92 -0.00 -1.83 -2.42 114.38 112.59 3kru h ARG 333 Ca 0.58 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 60.06 3kru h ARG 333 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.18 3kru h ARG 333 CO -0.34 0.00 -0.25 0.00 0.00 0.00 0.00 179.97 179.38 3kru n ALA 334 N -1.91 3.07 -1.80 0.04 0.00 0.10 -4.94 120.51 115.06 3kru n ALA 334 Ca -0.00 -0.42 -0.41 0.00 0.00 0.00 0.00 53.44 52.61 3kru n ALA 334 Cb 0.17 -1.12 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 3kru n ALA 334 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3kru s PHE 335 N -2.47 2.83 0.00 0.00 5.36 -0.92 -5.18 117.98 117.60 3kru s PHE 335 Ca 0.25 1.03 0.00 0.00 -0.96 0.00 0.00 56.93 57.25 3kru s PHE 335 Cb 0.19 -3.93 0.00 0.00 -0.34 0.00 0.00 43.02 38.94 3kru s PHE 335 CO 0.51 -2.94 0.00 0.36 -1.46 0.00 0.00 175.22 171.69