#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bf0 n GLY 57 N 0.00 2.62 3.74 -0.13 0.00 -1.04 -4.78 105.19 105.60 3bf0 n GLY 57 Ca 0.00 -1.93 -0.34 0.00 0.00 0.00 0.00 46.02 43.75 3bf0 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bf0 s ALA 58 N -2.99 2.25 -0.13 4.61 0.00 0.01 -1.76 121.76 123.75 3bf0 s ALA 58 Ca 0.00 0.77 -0.19 0.00 0.00 0.00 0.00 51.96 52.54 3bf0 s ALA 58 Cb 0.00 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 3bf0 s ALA 58 CO 0.00 -1.64 0.51 -1.17 0.00 0.00 0.00 175.76 173.46 3bf0 s LEU 59 N -5.00 4.25 -0.43 0.00 2.96 0.40 -1.24 118.68 119.61 3bf0 s LEU 59 Ca 0.72 0.82 -0.15 0.00 -0.22 0.00 0.00 54.13 55.30 3bf0 s LEU 59 Cb -0.26 -2.74 0.04 0.00 0.50 0.00 0.00 46.19 43.73 3bf0 s LEU 59 CO 0.43 -0.06 0.32 -0.22 -1.32 0.00 0.00 176.35 175.51 3bf0 s LEU 60 N 0.90 5.23 -1.19 -0.68 0.20 0.77 -0.74 118.68 123.18 3bf0 s LEU 60 Ca 0.27 -1.04 -0.11 0.00 0.69 0.00 0.00 54.13 53.93 3bf0 s LEU 60 Cb -0.15 -2.16 0.20 0.00 -0.43 0.00 0.00 46.19 43.65 3bf0 s LEU 60 CO 0.11 -0.50 1.42 0.18 -0.29 0.00 0.00 176.35 177.26 3bf0 n LEU 61 N 5.16 5.54 -3.85 -0.68 4.77 0.85 -0.61 117.00 128.17 3bf0 n LEU 61 Ca -0.11 -4.66 -0.42 0.00 -0.03 0.00 0.00 56.01 50.78 3bf0 n LEU 61 Cb 0.46 -1.55 0.01 0.00 -2.33 0.00 0.00 43.42 40.01 3bf0 n LEU 61 CO 0.42 1.01 1.23 -0.90 -1.33 0.00 0.00 177.39 177.82 3bf0 n ASP 62 N 4.47 6.74 -4.76 -1.43 5.75 -1.26 -1.18 116.55 124.88 3bf0 n ASP 62 Ca 0.34 -3.52 -0.41 0.00 -0.01 0.00 0.00 54.79 51.19 3bf0 n ASP 62 Cb 0.40 -1.22 -0.02 0.00 -1.03 0.00 0.00 41.12 39.25 3bf0 n ASP 62 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3bf0 s ILE 63 N -3.38 2.69 -0.15 2.12 -1.09 -1.24 -4.98 121.20 115.17 3bf0 s ILE 63 Ca 0.34 0.65 -0.01 0.00 -2.23 0.00 0.00 60.65 59.40 3bf0 s ILE 63 Cb 0.10 -3.41 0.04 0.00 -1.58 0.00 0.00 42.46 37.61 3bf0 s ILE 63 CO 0.02 0.13 -0.06 -0.55 -1.23 0.00 0.00 174.94 173.26 3bf0 s SER 64 N -0.14 2.59 0.00 3.58 0.15 -1.26 -3.57 113.70 115.05 3bf0 s SER 64 Ca 0.53 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.64 3bf0 s SER 64 Cb -0.41 -0.86 0.00 0.00 -1.71 0.00 0.00 66.02 63.04 3bf0 s SER 64 CO 0.49 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.38 3bf0 n GLY 65 N 4.91 0.36 3.67 9.45 0.00 0.16 -3.53 105.19 120.21 3bf0 n GLY 65 Ca -0.12 -1.83 -0.23 0.00 0.00 0.00 0.00 46.02 43.84 3bf0 n GLY 65 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3bf0 s VAL 66 N 0.00 3.33 -0.16 1.61 -7.23 0.86 0.19 120.40 119.00 3bf0 s VAL 66 Ca 0.00 -1.85 -0.08 0.00 -1.81 0.00 0.00 61.98 58.24 3bf0 s VAL 66 Cb 0.00 -2.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.01 3bf0 s VAL 66 CO 0.00 -0.32 0.11 -0.63 -0.31 0.00 0.00 175.10 173.95 3bf0 s ILE 67 N -2.36 5.27 0.04 -0.62 -1.09 -0.86 -0.85 121.20 120.73 3bf0 s ILE 67 Ca 0.33 0.13 -0.02 0.00 -2.23 0.00 0.00 60.65 58.86 3bf0 s ILE 67 Cb -0.05 -3.34 -0.03 0.00 -1.58 0.00 0.00 42.46 37.46 3bf0 s ILE 67 CO 0.21 0.53 -0.00 0.68 -1.23 0.00 0.00 174.94 175.12 3bf0 s VAL 68 N -0.28 0.18 0.26 2.92 -7.23 -0.20 -4.69 120.40 111.36 3bf0 s VAL 68 Ca 0.10 -1.48 -0.05 0.00 -1.81 0.00 0.00 61.98 58.75 3bf0 s VAL 68 Cb -0.12 -1.15 0.26 0.00 0.56 0.00 0.00 36.38 35.94 3bf0 s VAL 68 CO 0.01 -0.82 1.92 0.44 -0.31 0.00 0.00 175.10 176.34 3bf0 h ASP 69 N 3.52 1.11 -1.63 4.85 5.19 -1.96 -1.32 116.42 126.18 3bf0 h ASP 69 Ca -0.33 -0.02 -0.10 0.00 -0.62 0.00 0.00 57.03 55.96 3bf0 h ASP 69 Cb 1.16 -0.27 -0.27 0.00 0.18 0.00 0.00 39.33 40.14 3bf0 h ASP 69 CO 0.58 0.78 -0.44 -0.75 -3.12 0.00 0.00 179.24 176.29 3bf0 s LYS 70 N -6.08 0.42 0.00 3.56 2.20 -1.26 -4.41 119.74 114.16 3bf0 s LYS 70 Ca -0.13 0.58 0.00 0.00 -0.36 0.00 0.00 55.97 56.06 3bf0 s LYS 70 Cb 0.19 -0.19 0.00 0.00 -1.51 0.00 0.00 37.83 36.31 3bf0 s LYS 70 CO 0.82 -0.71 0.00 -2.30 -0.36 0.00 0.00 175.35 172.79 3bf0 n PRO 71 N 5.38 -0.10 0.00 4.03 -0.02 -1.26 -5.07 135.00 137.96 3bf0 n PRO 71 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 3bf0 n PRO 71 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 3bf0 n PRO 71 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3bf0 n LEU 92 N 0.00 0.00 0.00 2.45 0.00 -1.25 -5.09 117.00 113.11 3bf0 n LEU 92 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 3bf0 n LEU 92 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 3bf0 n LEU 92 CO 0.00 0.00 -0.26 1.67 0.00 0.00 0.00 177.39 178.80 3bf0 n GLN 93 N 0.00 0.00 -3.54 1.96 7.27 -1.23 -4.33 117.38 117.52 3bf0 n GLN 93 Ca 0.00 0.00 -0.39 0.00 0.07 0.00 0.00 57.00 56.68 3bf0 n GLN 93 Cb 0.00 -0.70 -0.11 0.00 2.41 0.00 0.00 30.24 31.85 3bf0 n GLN 93 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 3bf0 s GLU 94 N -1.58 3.77 -0.08 3.69 2.02 -1.26 -0.10 118.70 125.16 3bf0 s GLU 94 Ca 0.00 -0.41 0.01 0.00 0.02 0.00 0.00 54.97 54.59 3bf0 s GLU 94 Cb 0.00 -3.72 -0.03 0.00 0.10 0.00 0.00 34.13 30.48 3bf0 s GLU 94 CO 0.00 -0.31 -0.09 -0.80 0.02 0.00 0.00 175.26 174.08 3bf0 s ASN 95 N 1.73 4.45 -0.08 -0.19 0.01 -0.03 -4.92 114.94 115.91 3bf0 s ASN 95 Ca 0.08 -0.10 -0.29 0.00 -0.71 0.00 0.00 52.86 51.84 3bf0 s ASN 95 Cb -0.16 -1.17 -0.02 0.00 0.41 0.00 0.00 41.25 40.31 3bf0 s ASN 95 CO 0.11 0.33 0.97 -0.55 -1.51 0.00 0.00 177.10 176.44 3bf0 s SER 96 N -0.60 7.23 0.22 -1.22 0.15 -1.26 -1.04 113.70 117.19 3bf0 s SER 96 Ca 0.09 1.51 -0.07 0.00 0.70 0.00 0.00 55.95 58.17 3bf0 s SER 96 Cb -0.12 -2.54 0.32 0.00 -1.71 0.00 0.00 66.02 61.97 3bf0 s SER 96 CO 0.02 -0.38 1.78 0.25 1.20 0.00 0.00 173.24 176.11 3bf0 h LEU 97 N 7.66 0.44 -0.09 3.45 5.85 -1.44 -2.27 115.31 128.91 3bf0 h LEU 97 Ca -0.34 0.06 -0.21 0.00 0.84 0.00 0.00 57.88 58.24 3bf0 h LEU 97 Cb 1.17 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 42.19 3bf0 h LEU 97 CO 0.82 0.26 -0.74 -0.26 -0.34 0.00 0.00 178.44 178.17 3bf0 h PHE 98 N 0.58 0.92 -0.84 1.25 0.04 -1.84 -2.29 116.94 114.77 3bf0 h PHE 98 Ca 0.34 -0.44 0.05 0.00 2.80 0.00 0.00 57.97 60.72 3bf0 h PHE 98 Cb 0.35 -0.13 -0.05 0.00 2.20 0.00 0.00 35.95 38.32 3bf0 h PHE 98 CO -0.11 1.26 0.55 -0.44 -0.60 0.00 0.00 178.31 178.97 3bf0 h ASP 99 N 0.33 0.86 0.44 2.17 3.32 -1.93 -0.26 116.42 121.35 3bf0 h ASP 99 Ca -0.07 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 3bf0 h ASP 99 Cb 1.39 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3bf0 h ASP 99 CO 0.15 0.58 -0.21 0.40 -1.72 0.00 0.00 179.24 178.44 3bf0 h ILE 100 N 0.99 0.54 -0.45 0.35 2.04 -1.23 -1.94 117.51 117.81 3bf0 h ILE 100 Ca 0.35 -0.30 0.05 0.00 1.00 0.00 0.00 64.86 65.96 3bf0 h ILE 100 Cb 0.12 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 36.82 3bf0 h ILE 100 CO -0.11 0.05 0.18 0.58 0.00 0.00 0.00 178.15 178.85 3bf0 h VAL 101 N -0.78 0.89 0.00 1.67 2.07 -1.29 -1.00 116.25 117.81 3bf0 h VAL 101 Ca -0.06 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 3bf0 h VAL 101 Cb 0.54 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 3bf0 h VAL 101 CO 0.10 0.07 -0.10 0.78 0.02 0.00 0.00 177.57 178.44 3bf0 h ASN 102 N 0.36 0.00 0.08 0.57 2.35 -1.07 -0.48 115.58 117.39 3bf0 h ASN 102 Ca 0.21 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.80 3bf0 h ASN 102 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 3bf0 h ASN 102 CO -0.19 0.10 -0.74 0.74 -1.65 0.00 0.00 177.43 175.68 3bf0 h THR 103 N 0.00 1.44 -0.41 2.81 2.02 -0.76 -0.33 112.91 117.68 3bf0 h THR 103 Ca -0.00 -2.42 0.08 0.00 0.77 0.00 0.00 66.41 64.84 3bf0 h THR 103 Cb 0.51 3.06 -0.07 0.00 -1.74 0.00 0.00 68.15 69.91 3bf0 h THR 103 CO 0.01 0.64 -0.03 0.40 0.37 0.00 0.00 175.52 176.91 3bf0 h ILE 104 N -0.61 0.66 -0.74 3.11 2.04 -1.06 0.35 117.51 121.27 3bf0 h ILE 104 Ca -0.16 -0.02 0.01 0.00 1.00 0.00 0.00 64.86 65.69 3bf0 h ILE 104 Cb 1.44 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 38.07 3bf0 h ILE 104 CO 0.05 0.01 0.49 0.03 0.00 0.00 0.00 178.15 178.73 3bf0 h ARG 105 N 0.07 0.97 -0.64 2.37 3.08 -1.13 -1.52 114.38 117.58 3bf0 h ARG 105 Ca 0.20 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 3bf0 h ARG 105 Cb 0.29 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 3bf0 h ARG 105 CO -0.36 0.64 0.20 0.37 -1.07 0.00 0.00 179.97 179.74 3bf0 h GLN 106 N 1.00 0.97 0.00 0.04 4.15 -0.54 -3.03 115.11 117.70 3bf0 h GLN 106 Ca 0.27 -0.19 -0.08 0.00 0.77 0.00 0.00 58.65 59.42 3bf0 h GLN 106 Cb -0.11 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.42 3bf0 h GLN 106 CO -0.06 0.83 -0.36 0.00 -1.93 0.00 0.00 178.83 177.31 3bf0 h ALA 107 N 1.27 1.25 -0.94 3.38 0.00 0.37 -2.49 119.26 122.10 3bf0 h ALA 107 Ca 0.21 -0.33 0.09 0.00 0.00 0.00 0.00 54.91 54.88 3bf0 h ALA 107 Cb 0.27 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 3bf0 h ALA 107 CO -0.01 0.46 0.61 -0.22 0.00 0.00 0.00 179.25 180.09 3bf0 h LYS 108 N 0.00 0.97 -0.01 0.00 3.64 -1.17 -2.90 116.57 117.10 3bf0 h LYS 108 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3bf0 h LYS 108 Cb 0.71 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 3bf0 h LYS 108 CO 0.05 0.64 -0.44 -0.25 -2.27 0.00 0.00 179.45 177.18 3bf0 n ASP 109 N -4.53 1.81 -4.58 4.20 8.00 -1.01 -4.86 116.55 115.57 3bf0 n ASP 109 Ca 0.16 -1.38 -0.43 0.00 0.71 0.00 0.00 54.79 53.85 3bf0 n ASP 109 Cb 0.27 0.42 -0.05 0.00 -0.02 0.00 0.00 41.12 41.74 3bf0 n ASP 109 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3bf0 s ASP 110 N -2.49 6.55 0.58 -2.24 -1.08 -0.97 -4.91 116.67 112.11 3bf0 s ASP 110 Ca 0.20 0.29 0.28 0.00 -0.52 0.00 0.00 52.55 52.80 3bf0 s ASP 110 Cb 0.18 -2.42 1.51 0.00 -1.46 0.00 0.00 42.92 40.74 3bf0 s ASP 110 CO 0.57 -0.83 1.96 0.08 0.52 0.00 0.00 175.17 177.46 3bf0 h ARG 111 N 8.65 0.00 0.00 4.34 0.11 -1.89 -2.03 114.38 123.55 3bf0 h ARG 111 Ca -0.24 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.77 3bf0 h ARG 111 Cb 1.09 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.16 3bf0 h ARG 111 CO 0.95 0.00 -0.30 -0.91 0.10 0.00 0.00 179.97 179.81 3bf0 h ASN 112 N 0.00 0.00 -3.35 0.08 2.35 -1.91 -3.42 115.58 109.33 3bf0 h ASN 112 Ca 0.19 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.37 3bf0 h ASN 112 Cb 0.99 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.29 3bf0 h ASN 112 CO -0.00 0.30 -0.02 -0.63 -1.65 0.00 0.00 177.43 175.43 3bf0 s ILE 113 N -3.15 5.12 -0.56 2.81 -1.09 -0.77 -2.49 121.20 121.07 3bf0 s ILE 113 Ca 0.04 1.19 0.06 0.00 -2.23 0.00 0.00 60.65 59.72 3bf0 s ILE 113 Cb 0.07 -3.93 0.15 0.00 -1.58 0.00 0.00 42.46 37.18 3bf0 s ILE 113 CO 0.70 0.28 1.08 0.35 -1.23 0.00 0.00 174.94 176.12 3bf0 n THR 114 N 3.76 0.86 0.00 2.92 -2.24 -0.73 -4.86 114.28 114.00 3bf0 n THR 114 Ca -0.04 -0.93 0.00 0.00 -2.27 0.00 0.00 64.05 60.81 3bf0 n THR 114 Cb 0.51 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 3bf0 n THR 114 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bf0 n GLY 115 N 0.11 0.43 3.04 3.38 0.00 -1.26 -4.17 105.19 106.72 3bf0 n GLY 115 Ca 0.06 -1.12 -0.25 0.00 0.00 0.00 0.00 46.02 44.71 3bf0 n GLY 115 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3bf0 s ILE 116 N -2.00 1.22 -0.21 -0.61 1.01 0.83 -0.45 121.20 120.99 3bf0 s ILE 116 Ca 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 60.65 60.09 3bf0 s ILE 116 Cb 0.00 -1.11 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 3bf0 s ILE 116 CO 0.00 0.37 -0.05 -0.69 0.00 0.00 0.00 174.94 174.58 3bf0 s VAL 117 N 0.66 3.40 -0.37 2.92 1.01 0.08 -0.03 120.40 128.07 3bf0 s VAL 117 Ca -0.14 -0.49 -0.21 0.00 0.00 0.00 0.00 61.98 61.14 3bf0 s VAL 117 Cb -0.16 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.70 3bf0 s VAL 117 CO 0.04 0.44 0.65 -0.04 0.00 0.00 0.00 175.10 176.18 3bf0 s MET 118 N 1.28 3.62 -0.45 2.72 -1.94 0.15 -0.11 119.30 124.56 3bf0 s MET 118 Ca 0.03 0.00 -0.03 0.00 -1.71 0.00 0.00 55.69 53.98 3bf0 s MET 118 Cb -0.14 -3.83 0.12 0.00 2.01 0.00 0.00 34.83 32.99 3bf0 s MET 118 CO -0.02 -0.79 0.26 0.34 -0.01 0.00 0.00 175.02 174.80 3bf0 s ASP 119 N 1.83 5.29 -0.29 3.03 -1.08 -0.33 -1.86 116.67 123.25 3bf0 s ASP 119 Ca 0.25 -2.18 0.11 0.00 -0.52 0.00 0.00 52.55 50.21 3bf0 s ASP 119 Cb -0.14 -1.85 0.67 0.00 -1.46 0.00 0.00 42.92 40.14 3bf0 s ASP 119 CO 0.16 -0.52 1.68 0.18 0.52 0.00 0.00 175.17 177.19 3bf0 n LEU 120 N 4.41 5.38 0.28 -1.34 4.77 -1.26 -3.70 117.00 125.54 3bf0 n LEU 120 Ca -0.01 -3.27 0.17 0.00 -0.03 0.00 0.00 56.01 52.87 3bf0 n LEU 120 Cb 0.41 -0.69 0.82 0.00 -2.33 0.00 0.00 43.42 41.63 3bf0 n LEU 120 CO 0.34 0.85 1.02 0.07 -1.33 0.00 0.00 177.39 178.34 3bf0 h LYS 121 N 2.23 0.00 -0.14 3.23 2.10 -1.89 -2.05 116.57 120.05 3bf0 h LYS 121 Ca 0.21 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.86 3bf0 h LYS 121 Cb 2.07 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 33.40 3bf0 h LYS 121 CO 0.59 0.06 -0.01 0.09 -2.00 0.00 0.00 179.45 178.18 3bf0 n ASN 122 N -3.30 3.11 -4.48 7.07 5.03 -1.26 -4.95 115.26 116.47 3bf0 n ASN 122 Ca -0.01 -3.08 -0.38 0.00 0.87 0.00 0.00 54.58 51.97 3bf0 n ASN 122 Cb 0.23 -0.49 -0.12 0.00 -1.02 0.00 0.00 39.78 38.38 3bf0 n ASN 122 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 3bf0 s PHE 123 N -2.87 3.17 -2.47 3.10 5.36 -0.77 0.35 117.98 123.84 3bf0 s PHE 123 Ca 0.37 -0.36 0.26 0.00 -0.96 0.00 0.00 56.93 56.25 3bf0 s PHE 123 Cb 0.32 -2.35 0.69 0.00 -0.34 0.00 0.00 43.02 41.34 3bf0 s PHE 123 CO 0.06 -0.36 1.54 0.00 -1.46 0.00 0.00 175.22 174.99 3bf0 n ALA 124 N 5.00 2.71 0.00 11.12 0.00 0.13 -4.72 120.51 134.74 3bf0 n ALA 124 Ca -0.14 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.78 3bf0 n ALA 124 Cb 0.50 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.91 3bf0 n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bf0 n GLY 125 N 1.27 1.87 3.71 0.00 0.00 -1.25 -4.95 105.19 105.84 3bf0 n GLY 125 Ca 0.16 -2.20 -0.09 0.00 0.00 0.00 0.00 46.02 43.89 3bf0 n GLY 125 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3bf0 s GLY 126 N 0.00 0.42 0.71 -0.02 0.00 -1.26 -2.03 107.32 105.13 3bf0 s GLY 126 Ca 0.00 -0.75 -0.11 0.00 0.00 0.00 0.00 44.72 43.86 3bf0 s GLY 126 CO 0.00 -0.44 1.07 0.51 0.00 0.00 0.00 173.10 174.24 3bf0 s ASP 127 N -3.02 5.24 0.16 1.64 1.47 -1.26 -4.90 116.67 115.99 3bf0 s ASP 127 Ca 0.18 1.66 -0.15 0.00 1.18 0.00 0.00 52.55 55.42 3bf0 s ASP 127 Cb -0.03 -2.50 0.03 0.00 -0.34 0.00 0.00 42.92 40.07 3bf0 s ASP 127 CO 0.10 -1.54 1.79 -0.61 0.68 0.00 0.00 175.17 175.60 3bf0 h GLN 128 N -0.75 0.60 -0.82 2.11 4.15 -1.96 -2.63 115.11 115.81 3bf0 h GLN 128 Ca -0.44 -0.05 0.16 0.00 0.77 0.00 0.00 58.65 59.09 3bf0 h GLN 128 Cb 1.21 -0.13 -0.06 0.00 0.21 0.00 0.00 27.48 28.72 3bf0 h GLN 128 CO 0.56 0.43 0.54 -1.35 -1.93 0.00 0.00 178.83 177.09 3bf0 h PRO 129 N 0.59 0.46 0.02 -2.39 0.11 -1.90 -0.98 132.00 127.91 3bf0 h PRO 129 Ca 0.16 -0.03 -0.23 0.00 0.11 0.00 0.00 66.00 66.01 3bf0 h PRO 129 Cb -0.02 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 30.99 3bf0 h PRO 129 CO -0.03 0.30 -0.98 0.77 -0.21 0.00 0.00 178.00 177.85 3bf0 h SER 130 N 0.47 0.51 0.89 -2.05 0.02 -1.79 -1.65 113.55 109.96 3bf0 h SER 130 Ca 0.41 -0.42 -0.21 0.00 -0.84 0.00 0.00 61.79 60.73 3bf0 h SER 130 Cb 0.91 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 3bf0 h SER 130 CO -0.15 1.24 -1.00 0.24 -1.14 0.00 0.00 176.83 176.02 3bf0 h MET 131 N 0.20 0.05 -0.32 3.45 2.86 -1.13 -2.04 114.93 118.01 3bf0 h MET 131 Ca -0.09 -0.08 -0.10 0.00 -2.06 0.00 0.00 59.70 57.38 3bf0 h MET 131 Cb 1.63 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 33.30 3bf0 h MET 131 CO 0.17 1.00 -0.21 0.37 1.06 0.00 0.00 176.91 179.30 3bf0 h GLN 132 N 0.02 0.59 -0.00 1.72 4.15 -1.09 0.30 115.11 120.80 3bf0 h GLN 132 Ca -0.03 -0.22 -0.00 0.00 0.77 0.00 0.00 58.65 59.17 3bf0 h GLN 132 Cb 1.73 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 29.38 3bf0 h GLN 132 CO 0.14 0.77 0.00 -0.92 -1.93 0.00 0.00 178.83 176.88 3bf0 h TYR 133 N 0.53 0.00 -0.43 3.99 3.20 -1.12 -1.14 116.97 122.00 3bf0 h TYR 133 Ca 0.08 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.90 3bf0 h TYR 133 Cb 0.65 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.90 3bf0 h TYR 133 CO 0.03 0.07 0.06 0.82 -1.64 0.00 0.00 178.16 177.50 3bf0 h ILE 134 N -0.06 1.21 -0.17 1.81 2.04 -1.01 -2.53 117.51 118.80 3bf0 h ILE 134 Ca 0.00 -0.78 0.04 0.00 1.00 0.00 0.00 64.86 65.12 3bf0 h ILE 134 Cb 0.06 0.81 -0.07 0.00 -0.74 0.00 0.00 36.82 36.89 3bf0 h ILE 134 CO -0.00 0.28 -0.50 1.23 0.00 0.00 0.00 178.15 179.15 3bf0 h GLY 135 N 0.88 -0.94 -0.62 5.37 0.00 -0.54 -2.38 103.07 104.84 3bf0 h GLY 135 Ca 0.14 0.63 0.29 0.00 0.00 0.00 0.00 47.33 48.39 3bf0 h GLY 135 CO 0.00 -0.20 0.34 1.70 0.00 0.00 0.00 176.54 178.39 3bf0 h LYS 136 N -0.53 0.18 -0.06 4.80 3.64 -0.78 0.26 116.57 124.09 3bf0 h LYS 136 Ca 0.05 -0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 59.27 3bf0 h LYS 136 Cb 0.66 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 3bf0 h LYS 136 CO -0.45 0.12 -0.66 0.00 -2.27 0.00 0.00 179.45 176.19 3bf0 h ALA 137 N 1.86 0.76 0.10 5.00 0.00 -1.35 -1.47 119.26 124.17 3bf0 h ALA 137 Ca 0.65 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3bf0 h ALA 137 Cb 1.45 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.16 3bf0 h ALA 137 CO -0.70 0.77 -0.05 -0.07 0.00 0.00 0.00 179.25 179.20 3bf0 h LEU 138 N 0.17 -0.12 -0.95 0.00 4.07 -0.24 -0.49 115.31 117.75 3bf0 h LEU 138 Ca -0.01 -0.33 0.27 0.00 0.08 0.00 0.00 57.88 57.89 3bf0 h LEU 138 Cb 1.20 0.03 -0.14 0.00 1.08 0.00 0.00 40.66 42.83 3bf0 h LEU 138 CO 0.10 0.28 0.45 0.11 -1.08 0.00 0.00 178.44 178.30 3bf0 h LYS 139 N -0.54 0.32 -0.23 1.13 1.57 -0.59 0.11 116.57 118.34 3bf0 h LYS 139 Ca -0.01 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 3bf0 h LYS 139 Cb 0.44 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.67 3bf0 h LYS 139 CO 0.02 0.21 -0.32 0.93 -0.57 0.00 0.00 179.45 179.72 3bf0 h GLU 140 N 0.33 0.62 -0.65 3.15 5.08 -1.03 0.17 114.58 122.25 3bf0 h GLU 140 Ca 0.65 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.65 3bf0 h GLU 140 Cb 1.37 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.62 3bf0 h GLU 140 CO -0.60 0.97 0.43 0.35 -1.00 0.00 0.00 179.01 179.16 3bf0 h PHE 141 N 0.33 0.82 -0.48 4.33 3.04 -0.61 -2.62 116.94 121.74 3bf0 h PHE 141 Ca 0.03 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.99 3bf0 h PHE 141 Cb 0.90 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 39.11 3bf0 h PHE 141 CO 0.08 0.52 0.29 0.00 -2.02 0.00 0.00 178.31 177.18 3bf0 h ARG 142 N 0.88 0.66 0.00 1.11 3.08 -0.60 -2.75 114.38 116.76 3bf0 h ARG 142 Ca 0.24 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.23 3bf0 h ARG 142 Cb -0.10 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 29.81 3bf0 h ARG 142 CO -0.05 0.48 0.00 -0.44 -1.07 0.00 0.00 179.97 178.89 3bf0 h ASP 143 N 0.65 0.00 0.05 7.04 5.19 -0.30 -1.64 116.42 127.41 3bf0 h ASP 143 Ca 0.17 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 3bf0 h ASP 143 Cb -0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.50 3bf0 h ASP 143 CO -0.03 0.00 -0.01 -1.54 -3.12 0.00 0.00 179.24 174.54 3bf0 n SER 144 N -2.44 0.48 0.00 6.45 3.41 -1.04 -4.94 113.62 115.54 3bf0 n SER 144 Ca -0.00 -1.07 0.00 0.00 -0.26 0.00 0.00 58.87 57.54 3bf0 n SER 144 Cb 0.12 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 3bf0 n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3bf0 n GLY 145 N 1.09 0.81 3.78 5.00 0.00 -0.61 -5.08 105.19 110.17 3bf0 n GLY 145 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 3bf0 n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bf0 s LYS 146 N -0.50 4.42 0.34 1.61 1.02 -1.24 -5.07 119.74 120.32 3bf0 s LYS 146 Ca 0.00 0.98 -0.26 0.00 0.02 0.00 0.00 55.97 56.71 3bf0 s LYS 146 Cb 0.00 -3.28 -0.09 0.00 -0.52 0.00 0.00 37.83 33.93 3bf0 s LYS 146 CO 0.00 0.52 1.00 -1.25 -0.92 0.00 0.00 175.35 174.69 3bf0 s PRO 147 N -0.83 4.47 -0.13 -1.68 0.04 -1.26 -4.23 135.00 131.38 3bf0 s PRO 147 Ca 0.34 1.45 0.03 0.00 0.04 0.00 0.00 61.00 62.86 3bf0 s PRO 147 Cb -0.21 -2.79 0.01 0.00 0.04 0.00 0.00 34.50 31.55 3bf0 s PRO 147 CO 0.23 0.15 -0.22 0.08 0.04 0.00 0.00 177.00 177.27 3bf0 s VAL 148 N -1.55 2.05 -0.00 -0.36 1.01 -1.26 -0.12 120.40 120.17 3bf0 s VAL 148 Ca 0.51 -0.99 0.08 0.00 0.00 0.00 0.00 61.98 61.59 3bf0 s VAL 148 Cb -0.22 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 3bf0 s VAL 148 CO 0.27 0.55 -0.24 -0.31 0.00 0.00 0.00 175.10 175.38 3bf0 s TYR 149 N 0.69 2.40 -0.16 5.22 2.02 0.95 0.32 117.35 128.78 3bf0 s TYR 149 Ca -0.10 -0.38 -0.01 0.00 -0.37 0.00 0.00 57.07 56.21 3bf0 s TYR 149 Cb -0.16 -1.49 -0.01 0.00 -0.40 0.00 0.00 41.96 39.90 3bf0 s TYR 149 CO 0.01 0.05 -0.11 0.00 -1.57 0.00 0.00 175.55 173.93 3bf0 s ALA 150 N -0.70 2.64 0.04 3.71 0.00 -0.38 0.29 121.76 127.37 3bf0 s ALA 150 Ca 0.11 -1.01 0.08 0.00 0.00 0.00 0.00 51.96 51.14 3bf0 s ALA 150 Cb -0.10 -1.36 -0.03 0.00 0.00 0.00 0.00 23.12 21.64 3bf0 s ALA 150 CO 0.00 -0.03 -0.22 0.14 0.00 0.00 0.00 175.76 175.66 3bf0 s VAL 151 N 0.80 1.80 -0.28 0.00 -7.23 -0.78 0.20 120.40 114.90 3bf0 s VAL 151 Ca -0.04 -1.23 -0.32 0.00 -1.81 0.00 0.00 61.98 58.58 3bf0 s VAL 151 Cb -0.15 -1.55 0.18 0.00 0.56 0.00 0.00 36.38 35.42 3bf0 s VAL 151 CO 0.01 0.27 1.36 -0.83 -0.31 0.00 0.00 175.10 175.60 3bf0 s GLY 152 N -1.14 -0.01 0.13 2.32 0.00 -1.05 -4.29 107.32 103.29 3bf0 s GLY 152 Ca 0.09 2.52 -0.15 0.00 0.00 0.00 0.00 44.72 47.17 3bf0 s GLY 152 CO 0.02 0.95 1.66 0.83 0.00 0.00 0.00 173.10 176.56 3bf0 h GLU 153 N 2.04 0.65 -4.35 2.90 4.39 -1.95 -3.00 114.58 115.25 3bf0 h GLU 153 Ca -0.06 -0.14 -0.16 0.00 0.34 0.00 0.00 59.36 59.34 3bf0 h GLU 153 Cb 1.17 -0.10 -0.15 0.00 -0.10 0.00 0.00 28.75 29.57 3bf0 h GLU 153 CO 0.21 0.63 -0.63 -0.80 -1.16 0.00 0.00 179.01 177.26 3bf0 s ASN 154 N -5.95 0.33 -0.09 1.42 0.01 -1.26 -3.73 114.94 105.67 3bf0 s ASN 154 Ca -0.13 -1.14 0.01 0.00 -0.71 0.00 0.00 52.86 50.89 3bf0 s ASN 154 Cb 0.10 0.28 0.02 0.00 0.41 0.00 0.00 41.25 42.07 3bf0 s ASN 154 CO 0.76 -0.71 -0.09 -0.31 -1.51 0.00 0.00 177.10 175.24 3bf0 s TYR 155 N -4.01 1.42 0.94 2.20 1.51 0.32 -4.94 117.35 114.79 3bf0 s TYR 155 Ca 0.20 -0.62 -0.12 0.00 -1.01 0.00 0.00 57.07 55.51 3bf0 s TYR 155 Cb 0.07 -1.13 0.15 0.00 -0.11 0.00 0.00 41.96 40.95 3bf0 s TYR 155 CO -0.01 -0.40 1.10 -1.54 -1.11 0.00 0.00 175.55 173.58 3bf0 s SER 156 N 1.27 3.14 0.40 2.29 1.04 -1.26 -0.94 113.70 119.63 3bf0 s SER 156 Ca -0.03 1.29 0.06 0.00 0.48 0.00 0.00 55.95 57.75 3bf0 s SER 156 Cb -0.14 -1.96 0.82 0.00 0.10 0.00 0.00 66.02 64.84 3bf0 s SER 156 CO -0.03 -2.82 2.04 -0.61 0.98 0.00 0.00 173.24 172.80 3bf0 h GLN 157 N -1.68 0.56 0.27 4.02 4.15 -1.91 -1.06 115.11 119.47 3bf0 h GLN 157 Ca -0.52 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 58.85 3bf0 h GLN 157 Cb 1.31 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.88 3bf0 h GLN 157 CO 0.57 0.39 -0.13 0.78 -1.93 0.00 0.00 178.83 178.51 3bf0 h GLY 158 N 0.61 -0.38 0.41 2.39 0.00 -1.93 -3.07 103.07 101.10 3bf0 h GLY 158 Ca 0.15 0.14 0.17 0.00 0.00 0.00 0.00 47.33 47.80 3bf0 h GLY 158 CO -0.03 -0.14 0.58 1.46 0.00 0.00 0.00 176.54 178.41 3bf0 h GLN 159 N -0.71 0.54 0.05 4.80 4.20 -1.77 -2.95 115.11 119.26 3bf0 h GLN 159 Ca -0.04 -0.03 -0.21 0.00 0.06 0.00 0.00 58.65 58.43 3bf0 h GLN 159 Cb 0.49 -0.12 0.02 0.00 0.30 0.00 0.00 27.48 28.16 3bf0 h GLN 159 CO 0.06 0.36 -0.84 -0.92 -0.67 0.00 0.00 178.83 176.82 3bf0 h TYR 160 N 0.55 0.75 -0.77 2.96 3.20 -1.25 0.81 116.97 123.23 3bf0 h TYR 160 Ca 0.46 -0.44 0.13 0.00 3.14 0.00 0.00 58.73 62.02 3bf0 h TYR 160 Cb 0.94 -0.07 -0.14 0.00 1.54 0.00 0.00 36.73 39.00 3bf0 h TYR 160 CO -0.00 1.28 -0.32 -0.92 -1.64 0.00 0.00 178.16 176.56 3bf0 h TYR 161 N 0.01 -0.86 -0.05 -3.82 5.03 -1.42 0.18 116.97 116.04 3bf0 h TYR 161 Ca -0.12 0.08 -0.01 0.00 2.58 0.00 0.00 58.73 61.26 3bf0 h TYR 161 Cb 1.55 0.49 -0.00 0.00 1.55 0.00 0.00 36.73 40.32 3bf0 h TYR 161 CO 0.14 -0.38 -0.01 -0.07 -1.32 0.00 0.00 178.16 176.52 3bf0 h LEU 162 N -0.07 0.10 -2.19 2.82 3.38 -1.40 -2.99 115.31 114.96 3bf0 h LEU 162 Ca 0.31 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.94 3bf0 h LEU 162 Cb 0.58 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 3bf0 h LEU 162 CO -0.82 0.45 0.10 0.00 0.09 0.00 0.00 178.44 178.26 3bf0 h ALA 163 N 0.66 1.88 0.00 1.53 0.00 -0.31 -1.96 119.26 121.05 3bf0 h ALA 163 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3bf0 h ALA 163 Cb 0.40 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3bf0 h ALA 163 CO 0.01 -0.15 0.00 -1.13 0.00 0.00 0.00 179.25 177.97 3bf0 n SER 164 N -4.14 0.00 -0.10 0.00 3.41 0.57 -0.52 113.62 112.85 3bf0 n SER 164 Ca -0.00 -0.37 0.13 0.00 -0.26 0.00 0.00 58.87 58.37 3bf0 n SER 164 Cb 0.21 -0.11 0.41 0.00 -0.26 0.00 0.00 64.21 64.46 3bf0 n SER 164 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3bf0 n PHE 165 N -1.11 0.00 -2.05 7.33 3.72 -0.74 -4.58 117.46 120.03 3bf0 n PHE 165 Ca 0.12 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.20 3bf0 n PHE 165 Cb 0.10 -0.23 0.01 0.00 -0.94 0.00 0.00 39.48 38.42 3bf0 n PHE 165 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3bf0 s ALA 166 N -2.73 2.82 0.27 4.37 0.00 0.33 -4.70 121.76 122.12 3bf0 s ALA 166 Ca 0.19 0.28 -0.02 0.00 0.00 0.00 0.00 51.96 52.41 3bf0 s ALA 166 Cb 0.19 -3.19 0.37 0.00 0.00 0.00 0.00 23.12 20.49 3bf0 s ALA 166 CO 0.58 -0.74 1.85 -0.91 0.00 0.00 0.00 175.76 176.53 3bf0 h ASN 167 N 0.34 0.86 -2.64 0.00 2.35 -0.46 -3.44 115.58 112.60 3bf0 h ASN 167 Ca -0.46 -0.12 -0.23 0.00 -0.55 0.00 0.00 56.30 54.93 3bf0 h ASN 167 Cb 1.21 -0.22 -0.33 0.00 0.05 0.00 0.00 38.32 39.03 3bf0 h ASN 167 CO 0.58 0.78 -0.55 -0.75 -1.65 0.00 0.00 177.43 175.84 3bf0 s LYS 168 N -5.41 0.19 -0.28 0.81 2.36 -1.20 -5.07 119.74 111.15 3bf0 s LYS 168 Ca -0.11 0.57 -0.08 0.00 -2.55 0.00 0.00 55.97 53.80 3bf0 s LYS 168 Cb 0.16 -0.42 -0.01 0.00 -1.05 0.00 0.00 37.83 36.50 3bf0 s LYS 168 CO 0.80 -0.44 0.10 0.42 1.55 0.00 0.00 175.35 177.79 3bf0 s ILE 169 N 2.41 4.36 -0.26 5.43 1.01 -1.26 -1.25 121.20 131.65 3bf0 s ILE 169 Ca 0.04 -0.37 -0.14 0.00 0.00 0.00 0.00 60.65 60.19 3bf0 s ILE 169 Cb -0.14 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.14 3bf0 s ILE 169 CO -0.11 0.18 0.30 0.26 0.00 0.00 0.00 174.94 175.58 3bf0 s TRP 170 N 1.59 3.27 0.11 3.97 0.51 0.13 0.14 118.94 128.67 3bf0 s TRP 170 Ca 0.05 0.35 0.08 0.00 -2.12 0.00 0.00 56.10 54.46 3bf0 s TRP 170 Cb -0.16 -2.48 -0.04 0.00 -0.81 0.00 0.00 33.47 29.98 3bf0 s TRP 170 CO 0.04 -0.13 -0.15 -1.17 -0.51 0.00 0.00 176.95 175.04 3bf0 s LEU 171 N 1.72 2.85 0.43 2.99 2.96 0.38 -2.52 118.68 127.49 3bf0 s LEU 171 Ca 0.13 -0.49 -0.24 0.00 -0.22 0.00 0.00 54.13 53.31 3bf0 s LEU 171 Cb -0.15 -1.67 -0.08 0.00 0.50 0.00 0.00 46.19 44.79 3bf0 s LEU 171 CO 0.09 0.18 1.19 -0.55 -1.32 0.00 0.00 176.35 175.94 3bf0 s SER 172 N -2.17 6.29 0.48 3.68 0.15 -1.13 -0.18 113.70 120.81 3bf0 s SER 172 Ca 0.19 2.37 0.32 0.00 0.70 0.00 0.00 55.95 59.54 3bf0 s SER 172 Cb -0.11 -2.61 1.58 0.00 -1.71 0.00 0.00 66.02 63.17 3bf0 s SER 172 CO 0.12 -0.84 1.98 -0.65 1.20 0.00 0.00 173.24 175.05 3bf0 h PRO 173 N 2.32 0.00 -0.42 5.44 0.11 -1.89 0.79 132.00 138.36 3bf0 h PRO 173 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3bf0 h PRO 173 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3bf0 h PRO 173 CO 0.61 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.44 3bf0 n GLN 174 N -2.73 2.43 -1.35 1.05 1.13 -1.26 -4.57 117.38 112.09 3bf0 n GLN 174 Ca -0.01 -2.18 -0.29 0.00 -1.94 0.00 0.00 57.00 52.58 3bf0 n GLN 174 Cb 0.15 -1.42 0.16 0.00 0.11 0.00 0.00 30.24 29.24 3bf0 n GLN 174 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 3bf0 s GLY 175 N -1.16 1.57 0.04 1.08 0.00 0.27 -4.80 107.32 104.31 3bf0 s GLY 175 Ca 0.34 -0.49 0.03 0.00 0.00 0.00 0.00 44.72 44.60 3bf0 s GLY 175 CO 0.26 0.12 -0.09 0.54 0.00 0.00 0.00 173.10 173.92 3bf0 s VAL 176 N -3.13 0.67 -0.30 1.40 0.11 -1.26 -2.26 120.40 115.63 3bf0 s VAL 176 Ca 0.65 -0.97 -0.08 0.00 -2.93 0.00 0.00 61.98 58.65 3bf0 s VAL 176 Cb -0.16 -0.68 -0.00 0.00 -1.53 0.00 0.00 36.38 34.01 3bf0 s VAL 176 CO 0.55 -0.23 0.12 -0.69 -3.33 0.00 0.00 175.10 171.52 3bf0 s VAL 177 N -1.10 4.33 -0.91 2.04 1.01 -1.26 -0.52 120.40 123.99 3bf0 s VAL 177 Ca -0.06 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 3bf0 s VAL 177 Cb -0.08 -3.22 0.23 0.00 0.00 0.00 0.00 36.38 33.31 3bf0 s VAL 177 CO 0.01 0.07 0.85 -0.62 0.00 0.00 0.00 175.10 175.41 3bf0 s ASP 178 N 1.57 6.65 -0.21 3.32 2.15 -0.12 -5.00 116.67 125.03 3bf0 s ASP 178 Ca 0.04 -3.20 -0.07 0.00 0.43 0.00 0.00 52.55 49.74 3bf0 s ASP 178 Cb -0.17 -2.12 -0.04 0.00 -0.30 0.00 0.00 42.92 40.29 3bf0 s ASP 178 CO 0.05 -0.38 0.07 -0.76 -0.17 0.00 0.00 175.17 173.97 3bf0 s LEU 179 N -0.61 3.69 0.00 -1.34 1.02 -1.26 -2.61 118.68 117.57 3bf0 s LEU 179 Ca 0.24 -0.02 0.00 0.00 0.02 0.00 0.00 54.13 54.37 3bf0 s LEU 179 Cb -0.11 -1.96 0.00 0.00 0.02 0.00 0.00 46.19 44.15 3bf0 s LEU 179 CO -0.08 0.10 0.00 0.00 0.02 0.00 0.00 176.35 176.38 3bf0 n HIS 180 N 4.06 0.00 0.00 0.29 1.44 -1.26 -5.10 115.22 114.64 3bf0 n HIS 180 Ca -0.16 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.55 3bf0 n HIS 180 Cb 0.52 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.63 3bf0 n HIS 180 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3bf0 n GLY 181 N 0.00 -1.00 3.30 -1.39 0.00 -1.26 -5.02 105.19 99.83 3bf0 n GLY 181 Ca 0.00 -2.12 -0.28 0.00 0.00 0.00 0.00 46.02 43.62 3bf0 n GLY 181 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3bf0 s PHE 182 N 0.00 2.06 -0.00 1.61 0.08 -1.26 -5.12 117.98 115.34 3bf0 s PHE 182 Ca 0.00 -0.39 -0.11 0.00 0.12 0.00 0.00 56.93 56.55 3bf0 s PHE 182 Cb 0.00 -1.21 0.01 0.00 -0.57 0.00 0.00 43.02 41.25 3bf0 s PHE 182 CO 0.00 0.14 0.22 0.00 -0.10 0.00 0.00 175.22 175.48 3bf0 s ALA 183 N -0.85 -0.55 0.20 5.36 0.00 -1.26 -5.07 121.76 119.59 3bf0 s ALA 183 Ca 0.10 0.08 0.10 0.00 0.00 0.00 0.00 51.96 52.23 3bf0 s ALA 183 Cb -0.09 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 3bf0 s ALA 183 CO 0.02 -0.24 -0.12 -0.08 0.00 0.00 0.00 175.76 175.34 3bf0 s THR 184 N -1.42 3.01 -0.28 0.00 -1.32 -1.26 -5.13 115.64 109.24 3bf0 s THR 184 Ca -0.14 -1.80 -0.18 0.00 -1.21 0.00 0.00 61.69 58.37 3bf0 s THR 184 Cb -0.06 -2.50 0.08 0.00 -1.51 0.00 0.00 72.50 68.51 3bf0 s THR 184 CO 0.03 -0.15 0.69 0.21 -2.21 0.00 0.00 174.62 173.19 3bf0 s ASN 185 N -2.92 -0.91 0.07 8.08 3.04 -1.26 -5.18 114.94 115.87 3bf0 s ASN 185 Ca 0.25 1.50 -0.09 0.00 0.04 0.00 0.00 52.86 54.56 3bf0 s ASN 185 Cb -0.08 1.40 0.00 0.00 -1.54 0.00 0.00 41.25 41.03 3bf0 s ASN 185 CO 0.15 -0.24 0.20 -0.83 -3.04 0.00 0.00 177.10 173.33 3bf0 s GLY 186 N 1.41 0.06 0.15 1.21 0.00 -1.26 -5.15 107.32 103.74 3bf0 s GLY 186 Ca -0.08 -0.49 -0.20 0.00 0.00 0.00 0.00 44.72 43.95 3bf0 s GLY 186 CO -0.16 -0.67 0.66 1.08 0.00 0.00 0.00 173.10 174.00 3bf0 s LEU 187 N -2.59 4.45 -0.02 0.66 1.43 -1.26 -5.07 118.68 116.28 3bf0 s LEU 187 Ca 0.01 1.36 0.05 0.00 -1.03 0.00 0.00 54.13 54.52 3bf0 s LEU 187 Cb 0.03 -3.27 -0.01 0.00 0.03 0.00 0.00 46.19 42.97 3bf0 s LEU 187 CO -0.09 0.15 -0.17 -0.31 0.23 0.00 0.00 176.35 176.17 3bf0 s TYR 188 N -1.32 1.61 -0.00 0.29 1.51 -1.26 -4.64 117.35 113.54 3bf0 s TYR 188 Ca 0.36 -0.36 0.00 0.00 -1.01 0.00 0.00 57.07 56.06 3bf0 s TYR 188 Cb -0.18 -1.05 0.01 0.00 -0.11 0.00 0.00 41.96 40.62 3bf0 s TYR 188 CO 0.21 -0.08 0.64 0.66 -1.11 0.00 0.00 175.55 175.88 3bf0 n TYR 189 N 2.84 0.00 -0.34 2.71 4.01 0.30 -4.90 117.16 121.78 3bf0 n TYR 189 Ca -0.16 -0.11 -0.01 0.00 -0.16 0.00 0.00 57.90 57.46 3bf0 n TYR 189 Cb 0.54 -0.02 0.04 0.00 -0.31 0.00 0.00 39.34 39.59 3bf0 n TYR 189 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3bf0 h LYS 190 N 0.00 -0.03 -0.57 -0.72 3.64 -1.46 -1.54 116.57 115.89 3bf0 h LYS 190 Ca 0.00 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 3bf0 h LYS 190 Cb 0.95 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 3bf0 h LYS 190 CO 0.00 -0.02 -0.07 0.77 -2.27 0.00 0.00 179.45 177.86 3bf0 h SER 191 N -0.03 1.04 0.00 4.20 0.02 -1.91 -1.95 113.55 114.93 3bf0 h SER 191 Ca 0.33 -0.33 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 3bf0 h SER 191 Cb 0.60 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 3bf0 h SER 191 CO -0.93 1.13 -0.16 0.25 -1.14 0.00 0.00 176.83 175.99 3bf0 h LEU 192 N 0.94 -0.45 -0.98 5.07 5.85 -1.75 -0.11 115.31 123.87 3bf0 h LEU 192 Ca 0.15 0.07 0.10 0.00 0.84 0.00 0.00 57.88 59.04 3bf0 h LEU 192 Cb 0.64 0.19 -0.08 0.00 0.37 0.00 0.00 40.66 41.78 3bf0 h LEU 192 CO 0.04 -0.22 0.61 -0.07 -0.34 0.00 0.00 178.44 178.47 3bf0 h LEU 193 N -0.26 0.92 -0.56 2.25 3.38 -1.15 0.92 115.31 120.82 3bf0 h LEU 193 Ca 0.05 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 3bf0 h LEU 193 Cb 0.33 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3bf0 h LEU 193 CO -0.15 0.52 0.14 0.44 0.09 0.00 0.00 178.44 179.48 3bf0 h ASP 194 N 1.01 0.84 -0.17 -0.43 3.32 -0.97 -0.26 116.42 119.76 3bf0 h ASP 194 Ca 0.47 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 57.24 3bf0 h ASP 194 Cb 0.39 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 3bf0 h ASP 194 CO -0.24 0.85 -0.02 0.11 -1.72 0.00 0.00 179.24 178.22 3bf0 h LYS 195 N 0.79 0.45 -0.00 3.56 1.57 0.09 -2.26 116.57 120.77 3bf0 h LYS 195 Ca 0.18 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3bf0 h LYS 195 Cb 0.33 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.58 3bf0 h LYS 195 CO 0.00 0.49 -0.30 1.28 -0.57 0.00 0.00 179.45 180.35 3bf0 n LEU 196 N -4.29 0.34 -0.58 2.94 4.77 0.21 -4.94 117.00 115.45 3bf0 n LEU 196 Ca 0.01 0.17 -0.07 0.00 -0.03 0.00 0.00 56.01 56.09 3bf0 n LEU 196 Cb 0.24 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 40.97 3bf0 n LEU 196 CO 0.38 0.08 -0.07 0.29 -1.33 0.00 0.00 177.39 176.74 3bf0 n LYS 197 N -1.45 -0.50 -2.31 3.23 5.02 -0.21 -4.34 118.16 117.59 3bf0 n LYS 197 Ca 0.07 0.70 -0.40 0.00 -2.02 0.00 0.00 58.31 56.66 3bf0 n LYS 197 Cb 0.33 -4.51 -0.03 0.00 -0.02 0.00 0.00 35.03 30.80 3bf0 n LYS 197 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3bf0 s VAL 198 N -2.27 3.14 -0.23 -0.18 1.01 -0.59 -3.84 120.40 117.43 3bf0 s VAL 198 Ca 0.00 1.10 -0.12 0.00 0.00 0.00 0.00 61.98 62.96 3bf0 s VAL 198 Cb 0.00 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 3bf0 s VAL 198 CO 0.00 0.23 0.23 -0.44 0.00 0.00 0.00 175.10 175.12 3bf0 s SER 199 N -0.80 6.21 -0.16 3.32 0.01 -0.26 -4.66 113.70 117.35 3bf0 s SER 199 Ca 0.49 0.22 -0.06 0.00 1.31 0.00 0.00 55.95 57.91 3bf0 s SER 199 Cb -0.34 -2.14 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 3bf0 s SER 199 CO 0.45 0.01 0.03 -0.89 0.41 0.00 0.00 173.24 173.25 3bf0 s THR 200 N 1.18 4.51 -0.20 1.44 2.01 -1.26 -1.47 115.64 121.84 3bf0 s THR 200 Ca 0.11 -0.14 0.01 0.00 0.31 0.00 0.00 61.69 61.98 3bf0 s THR 200 Cb -0.14 -3.00 0.04 0.00 0.01 0.00 0.00 72.50 69.40 3bf0 s THR 200 CO 0.06 0.49 -0.14 -1.00 -0.69 0.00 0.00 174.62 173.34 3bf0 s HIS 201 N 0.23 2.71 -0.16 4.92 3.76 0.43 -4.98 115.29 122.21 3bf0 s HIS 201 Ca 0.02 -1.75 -0.02 0.00 -0.15 0.00 0.00 55.06 53.15 3bf0 s HIS 201 Cb -0.13 -1.79 -0.02 0.00 1.11 0.00 0.00 32.58 31.75 3bf0 s HIS 201 CO 0.01 -0.79 -0.07 0.08 -0.85 0.00 0.00 174.74 173.12 3bf0 s VAL 202 N 1.30 3.50 -0.17 -0.90 1.01 -1.26 -0.01 120.40 123.87 3bf0 s VAL 202 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.48 3bf0 s VAL 202 Cb -0.16 -2.52 0.04 0.00 0.00 0.00 0.00 36.38 33.74 3bf0 s VAL 202 CO -0.09 0.49 -0.09 -0.36 0.00 0.00 0.00 175.10 175.05 3bf0 s PHE 203 N 0.52 2.10 -0.07 5.22 0.08 -0.34 -5.01 117.98 120.48 3bf0 s PHE 203 Ca -0.05 -1.31 -0.12 0.00 0.12 0.00 0.00 56.93 55.57 3bf0 s PHE 203 Cb -0.15 -1.51 0.02 0.00 -0.57 0.00 0.00 43.02 40.81 3bf0 s PHE 203 CO 0.03 -0.68 0.29 0.50 -0.10 0.00 0.00 175.22 175.27 3bf0 s ARG 204 N 1.50 0.49 -0.24 0.44 3.52 -1.26 -0.24 118.95 123.16 3bf0 s ARG 204 Ca 0.01 0.11 -0.03 0.00 -0.13 0.00 0.00 55.73 55.69 3bf0 s ARG 204 Cb -0.15 0.22 0.08 0.00 -1.56 0.00 0.00 34.95 33.54 3bf0 s ARG 204 CO -0.09 -0.10 0.08 0.08 -0.81 0.00 0.00 175.30 174.47 3bf0 s VAL 205 N -0.55 0.30 0.00 7.11 1.01 -0.85 -4.94 120.40 122.47 3bf0 s VAL 205 Ca -0.07 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.22 3bf0 s VAL 205 Cb -0.04 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.30 3bf0 s VAL 205 CO 0.02 -0.46 0.00 0.61 0.00 0.00 0.00 175.10 175.27 3bf0 n GLY 206 N 5.11 0.57 0.32 4.51 0.00 -1.26 -3.00 105.19 111.45 3bf0 n GLY 206 Ca -0.06 0.42 0.16 0.00 0.00 0.00 0.00 46.02 46.54 3bf0 n GLY 206 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3bf0 h THR 207 N 0.00 0.17 -0.51 2.61 2.02 -1.95 -0.74 112.91 114.51 3bf0 h THR 207 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3bf0 h THR 207 Cb 0.00 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.46 3bf0 h THR 207 CO 0.00 0.02 0.00 -1.22 0.37 0.00 0.00 175.52 174.69 3bf0 n TYR 208 N -5.33 0.68 -2.67 3.16 4.01 -0.20 -4.68 117.16 112.14 3bf0 n TYR 208 Ca 0.24 -0.34 -0.43 0.00 -0.16 0.00 0.00 57.90 57.21 3bf0 n TYR 208 Cb 0.78 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.81 3bf0 n TYR 208 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 3bf0 s LYS 209 N -1.32 3.96 0.05 -0.72 2.47 -0.28 -4.01 119.74 119.89 3bf0 s LYS 209 Ca 0.41 -2.03 0.23 0.00 -1.56 0.00 0.00 55.97 53.02 3bf0 s LYS 209 Cb 0.22 -5.40 0.19 0.00 -1.46 0.00 0.00 37.83 31.38 3bf0 s LYS 209 CO 0.30 -2.13 1.16 -1.13 0.16 0.00 0.00 175.35 173.71 3bf0 n SER 210 N 7.80 0.63 0.00 1.43 3.41 -1.26 -3.86 113.62 121.76 3bf0 n SER 210 Ca 0.44 -0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 3bf0 n SER 210 Cb 0.46 0.55 0.00 0.00 -0.26 0.00 0.00 64.21 64.96 3bf0 n SER 210 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3bf0 n ALA 211 N -1.75 1.05 0.22 7.33 0.00 -1.26 0.18 120.51 126.29 3bf0 n ALA 211 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.59 3bf0 n ALA 211 Cb 0.41 -0.98 0.04 0.00 0.00 0.00 0.00 19.45 18.93 3bf0 n ALA 211 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3bf0 h VAL 212 N 0.00 0.00 -0.83 0.00 2.07 -2.00 -3.41 116.25 112.09 3bf0 h VAL 212 Ca 0.00 -0.88 0.13 0.00 0.82 0.00 0.00 66.70 66.77 3bf0 h VAL 212 Cb 0.02 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.14 3bf0 h VAL 212 CO 0.00 0.00 0.54 -0.33 0.02 0.00 0.00 177.57 177.80 3bf0 h GLU 213 N 0.00 0.63 -0.12 1.57 5.08 -0.53 -2.59 114.58 118.63 3bf0 h GLU 213 Ca 0.00 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 3bf0 h GLU 213 Cb 0.94 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 3bf0 h GLU 213 CO 0.00 0.42 0.15 -1.35 -1.00 0.00 0.00 179.01 177.23 3bf0 h PRO 214 N 0.65 0.00 0.00 2.33 0.11 -1.79 0.22 132.00 133.52 3bf0 h PRO 214 Ca 0.40 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.41 3bf0 h PRO 214 Cb 0.64 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.74 3bf0 h PRO 214 CO -0.16 0.00 -0.73 0.74 -0.21 0.00 0.00 178.00 177.64 3bf0 h PHE 215 N 0.00 0.00 0.00 0.65 -1.00 -1.80 0.90 116.94 115.69 3bf0 h PHE 215 Ca 0.06 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.84 3bf0 h PHE 215 Cb 0.35 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.91 3bf0 h PHE 215 CO 0.00 0.42 0.00 0.44 -1.61 0.00 0.00 178.31 177.56 3bf0 n ILE 216 N -3.07 0.00 -4.39 -0.55 -5.35 -0.73 -4.29 119.36 100.97 3bf0 n ILE 216 Ca -0.01 -0.46 -0.20 0.00 -0.27 0.00 0.00 62.75 61.81 3bf0 n ILE 216 Cb 0.72 1.03 -0.10 0.00 -1.74 0.00 0.00 39.64 39.55 3bf0 n ILE 216 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 3bf0 s ARG 217 N -0.57 1.46 0.00 6.28 0.52 0.68 -4.85 118.95 122.48 3bf0 s ARG 217 Ca 0.00 -1.72 0.21 0.00 -0.52 0.00 0.00 55.73 53.70 3bf0 s ARG 217 Cb 0.00 -1.08 -0.16 0.00 0.52 0.00 0.00 34.95 34.23 3bf0 s ARG 217 CO 0.00 0.06 0.94 -0.25 0.02 0.00 0.00 175.30 176.07 3bf0 n ASP 218 N -0.51 1.29 -4.01 0.23 8.00 -1.26 -2.44 116.55 117.85 3bf0 n ASP 218 Ca -0.06 -1.15 -0.10 0.00 0.71 0.00 0.00 54.79 54.20 3bf0 n ASP 218 Cb 0.63 0.85 -0.07 0.00 -0.02 0.00 0.00 41.12 42.50 3bf0 n ASP 218 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 3bf0 s ASP 219 N -2.81 0.01 0.31 -2.24 1.47 -1.26 -4.78 116.67 107.37 3bf0 s ASP 219 Ca 0.11 -0.98 -0.30 0.00 1.18 0.00 0.00 52.55 52.56 3bf0 s ASP 219 Cb 0.16 0.48 -0.11 0.00 -0.34 0.00 0.00 42.92 43.11 3bf0 s ASP 219 CO 0.77 -0.97 1.59 -0.32 0.68 0.00 0.00 175.17 176.92 3bf0 s MET 220 N -4.02 4.11 0.58 2.11 -2.45 -1.26 -4.95 119.30 113.42 3bf0 s MET 220 Ca 0.23 2.60 -0.18 0.00 -1.25 0.00 0.00 55.69 57.08 3bf0 s MET 220 Cb 0.03 -3.01 -0.04 0.00 1.25 0.00 0.00 34.83 33.06 3bf0 s MET 220 CO 0.05 -0.63 1.13 -1.54 1.05 0.00 0.00 175.02 175.08 3bf0 s SER 221 N 0.39 5.50 0.28 1.11 1.04 -1.26 -4.84 113.70 115.92 3bf0 s SER 221 Ca 0.62 2.13 0.02 0.00 0.48 0.00 0.00 55.95 59.20 3bf0 s SER 221 Cb -0.48 -2.57 0.65 0.00 0.10 0.00 0.00 66.02 63.71 3bf0 s SER 221 CO 0.51 -1.37 1.72 -0.65 0.98 0.00 0.00 173.24 174.43 3bf0 h PRO 222 N 0.82 0.46 -0.96 4.02 0.11 -2.00 -1.03 132.00 133.41 3bf0 h PRO 222 Ca -0.49 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.63 3bf0 h PRO 222 Cb 1.26 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 3bf0 h PRO 222 CO 0.56 0.30 0.63 0.00 -0.21 0.00 0.00 178.00 179.28 3bf0 h ALA 223 N 1.65 1.27 -0.24 -0.75 0.00 -1.93 -2.34 119.26 116.91 3bf0 h ALA 223 Ca 0.52 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 55.22 3bf0 h ALA 223 Cb 0.90 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3bf0 h ALA 223 CO -0.47 0.52 -0.49 0.00 0.00 0.00 0.00 179.25 178.81 3bf0 h ALA 224 N 1.39 0.67 -0.55 0.00 0.00 -1.61 -2.44 119.26 116.72 3bf0 h ALA 224 Ca 0.38 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3bf0 h ALA 224 Cb -0.02 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3bf0 h ALA 224 CO -0.12 0.68 0.31 -0.09 0.00 0.00 0.00 179.25 180.03 3bf0 h ARG 225 N 0.53 0.76 0.03 0.00 2.43 -0.91 -0.49 114.38 116.74 3bf0 h ARG 225 Ca 0.02 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3bf0 h ARG 225 Cb 1.05 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 3bf0 h ARG 225 CO 0.10 0.58 -0.02 0.93 -1.51 0.00 0.00 179.97 180.05 3bf0 h GLU 226 N 0.74 -0.04 -0.55 0.20 5.08 -1.36 -0.86 114.58 117.78 3bf0 h GLU 226 Ca 0.20 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.62 3bf0 h GLU 226 Cb 0.03 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.24 3bf0 h GLU 226 CO -0.03 0.16 0.27 0.00 -1.00 0.00 0.00 179.01 178.40 3bf0 h ALA 227 N 0.72 0.71 -0.00 3.43 0.00 -1.32 -0.19 119.26 122.60 3bf0 h ALA 227 Ca -0.00 0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 3bf0 h ALA 227 Cb 0.22 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3bf0 h ALA 227 CO 0.01 -0.10 -0.92 -0.44 0.00 0.00 0.00 179.25 177.80 3bf0 h ASP 228 N 0.50 0.47 -0.58 0.00 3.32 -1.06 -3.01 116.42 116.06 3bf0 h ASP 228 Ca 0.25 -0.38 -0.06 0.00 0.02 0.00 0.00 57.03 56.87 3bf0 h ASP 228 Cb 0.20 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 3bf0 h ASP 228 CO -0.19 1.18 0.14 0.28 -1.72 0.00 0.00 179.24 178.92 3bf0 h SER 229 N 0.21 0.89 -0.02 6.45 0.02 -0.96 -0.46 113.55 119.67 3bf0 h SER 229 Ca -0.07 -0.23 0.01 0.00 -0.84 0.00 0.00 61.79 60.66 3bf0 h SER 229 Cb 1.56 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.84 3bf0 h SER 229 CO 0.16 0.89 -0.26 -0.09 -1.14 0.00 0.00 176.83 176.39 3bf0 h ARG 230 N 0.84 -0.30 -0.08 3.45 9.65 -0.96 0.23 114.38 127.22 3bf0 h ARG 230 Ca 0.18 0.02 -0.12 0.00 -1.10 0.00 0.00 59.98 58.97 3bf0 h ARG 230 Cb 0.35 0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 3bf0 h ARG 230 CO 0.00 -0.20 -0.48 0.11 2.80 0.00 0.00 179.97 182.20 3bf0 h TRP 231 N -0.31 0.23 -0.24 2.20 5.08 -1.47 -1.60 115.95 119.84 3bf0 h TRP 231 Ca 0.01 -0.07 -0.18 0.00 1.08 0.00 0.00 58.89 59.73 3bf0 h TRP 231 Cb 0.34 -0.05 -0.00 0.00 -3.00 0.00 0.00 29.16 26.45 3bf0 h TRP 231 CO -0.46 0.63 -0.57 0.97 -1.28 0.00 0.00 178.44 177.74 3bf0 h ILE 232 N 0.15 1.29 -0.27 0.12 2.10 -1.02 -1.43 117.51 118.45 3bf0 h ILE 232 Ca 0.01 -1.78 0.07 0.00 1.08 0.00 0.00 64.86 64.23 3bf0 h ILE 232 Cb 0.91 1.72 -0.07 0.00 -1.09 0.00 0.00 36.82 38.28 3bf0 h ILE 232 CO 0.07 0.57 -0.22 1.23 -1.08 0.00 0.00 178.15 178.72 3bf0 h GLY 233 N 0.84 -0.09 0.98 8.18 0.00 -0.15 -1.76 103.07 111.08 3bf0 h GLY 233 Ca 0.01 0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.59 3bf0 h GLY 233 CO 0.12 -0.19 0.25 0.83 0.00 0.00 0.00 176.54 177.55 3bf0 h GLU 234 N -0.21 0.81 -0.14 4.80 5.08 -1.13 -2.00 114.58 121.80 3bf0 h GLU 234 Ca 0.15 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 3bf0 h GLU 234 Cb 0.43 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 3bf0 h GLU 234 CO -0.39 0.68 -0.28 -0.07 -1.00 0.00 0.00 179.01 177.95 3bf0 h LEU 235 N 0.75 0.25 -0.03 1.33 4.07 -0.80 0.59 115.31 121.47 3bf0 h LEU 235 Ca 0.19 -0.08 -0.19 0.00 0.08 0.00 0.00 57.88 57.88 3bf0 h LEU 235 Cb 0.15 -0.07 0.01 0.00 1.08 0.00 0.00 40.66 41.84 3bf0 h LEU 235 CO -0.02 0.53 -0.73 -0.25 -1.08 0.00 0.00 178.44 176.89 3bf0 h TRP 236 N 0.23 0.80 -0.98 1.13 2.91 -1.08 -1.09 115.95 117.88 3bf0 h TRP 236 Ca 0.03 -0.41 0.12 0.00 1.13 0.00 0.00 58.89 59.76 3bf0 h TRP 236 Cb 0.61 -0.10 -0.08 0.00 -0.51 0.00 0.00 29.16 29.08 3bf0 h TRP 236 CO 0.01 1.23 0.61 0.37 -1.03 0.00 0.00 178.44 179.63 3bf0 h GLN 237 N 0.14 0.94 -0.41 2.65 5.75 -1.05 0.15 115.11 123.28 3bf0 h GLN 237 Ca -0.08 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.34 3bf0 h GLN 237 Cb 1.41 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 29.73 3bf0 h GLN 237 CO 0.15 0.62 0.17 -0.91 -2.65 0.00 0.00 178.83 176.20 3bf0 h ASN 238 N 0.96 0.56 -0.14 -0.69 -0.26 -0.60 0.72 115.58 116.14 3bf0 h ASN 238 Ca 0.48 -0.16 0.05 0.00 -0.56 0.00 0.00 56.30 56.10 3bf0 h ASN 238 Cb 0.47 -0.15 -0.06 0.00 -1.06 0.00 0.00 38.32 37.52 3bf0 h ASN 238 CO -0.26 0.57 -0.25 0.22 -1.06 0.00 0.00 177.43 176.65 3bf0 h TYR 239 N 0.52 -0.66 0.11 1.19 5.03 -0.28 -1.78 116.97 121.09 3bf0 h TYR 239 Ca 0.14 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.47 3bf0 h TYR 239 Cb 0.18 0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.78 3bf0 h TYR 239 CO -0.00 -0.33 -0.05 -0.07 -1.32 0.00 0.00 178.16 176.39 3bf0 h LEU 240 N -0.31 -0.12 -1.33 2.82 3.38 -0.26 -1.66 115.31 117.83 3bf0 h LEU 240 Ca 0.10 -0.13 0.18 0.00 0.09 0.00 0.00 57.88 58.12 3bf0 h LEU 240 Cb 0.46 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.17 3bf0 h LEU 240 CO -0.31 0.05 0.59 0.78 0.09 0.00 0.00 178.44 179.64 3bf0 h ASN 241 N -0.29 0.58 -0.03 -0.43 -0.26 -0.81 0.92 115.58 115.25 3bf0 h ASN 241 Ca -0.01 0.05 -0.18 0.00 -0.56 0.00 0.00 56.30 55.59 3bf0 h ASN 241 Cb 0.24 -0.06 0.01 0.00 -1.06 0.00 0.00 38.32 37.46 3bf0 h ASN 241 CO 0.02 0.25 -0.70 0.74 -1.06 0.00 0.00 177.43 176.69 3bf0 h THR 242 N 0.59 1.37 -0.14 2.81 2.02 -1.09 -0.81 112.91 117.65 3bf0 h THR 242 Ca 0.48 -2.06 -0.17 0.00 0.77 0.00 0.00 66.41 65.43 3bf0 h THR 242 Cb 0.94 2.42 0.01 0.00 -1.74 0.00 0.00 68.15 69.78 3bf0 h THR 242 CO -0.22 0.62 -0.58 0.58 0.37 0.00 0.00 175.52 176.28 3bf0 h VAL 243 N 0.11 1.33 -0.37 3.16 2.07 -0.52 -0.43 116.25 121.60 3bf0 h VAL 243 Ca -0.08 -1.84 0.04 0.00 0.82 0.00 0.00 66.70 65.64 3bf0 h VAL 243 Cb 1.38 2.04 -0.05 0.00 -1.52 0.00 0.00 31.29 33.14 3bf0 h VAL 243 CO 0.14 0.57 -0.28 0.00 0.02 0.00 0.00 177.57 178.02 3bf0 h ALA 244 N 0.53 -0.37 -0.89 1.67 0.00 0.78 -0.83 119.26 120.15 3bf0 h ALA 244 Ca -0.03 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3bf0 h ALA 244 Cb 1.21 1.08 -0.06 0.00 0.00 0.00 0.00 17.79 20.02 3bf0 h ALA 244 CO 0.12 -0.54 0.57 0.00 0.00 0.00 0.00 179.25 179.40 3bf0 h ALA 245 N -0.44 1.20 -0.07 0.00 0.00 -0.93 0.25 119.26 119.27 3bf0 h ALA 245 Ca 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3bf0 h ALA 245 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3bf0 h ALA 245 CO -0.39 0.38 -0.08 -0.91 0.00 0.00 0.00 179.25 178.25 3bf0 h ASN 246 N 1.07 0.09 -0.01 0.00 4.21 -0.82 -2.93 115.58 117.19 3bf0 h ASN 246 Ca 0.37 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.87 3bf0 h ASN 246 Cb 0.08 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.26 3bf0 h ASN 246 CO -0.14 0.19 -0.72 0.54 -1.29 0.00 0.00 177.43 176.00 3bf0 n ARG 247 N -4.38 0.86 -2.89 0.81 5.12 0.43 -4.90 116.66 111.71 3bf0 n ARG 247 Ca -0.02 -0.40 -0.19 0.00 -1.93 0.00 0.00 57.85 55.31 3bf0 n ARG 247 Cb 0.19 -1.43 0.03 0.00 -1.16 0.00 0.00 32.46 30.10 3bf0 n ARG 247 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3bf0 n GLN 248 N -0.86 -4.12 -4.26 5.56 1.13 0.59 -5.02 117.38 110.40 3bf0 n GLN 248 Ca 0.06 0.79 -0.16 0.00 -1.94 0.00 0.00 57.00 55.75 3bf0 n GLN 248 Cb 0.36 -5.38 -0.10 0.00 0.11 0.00 0.00 30.24 25.23 3bf0 n GLN 248 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 3bf0 s ILE 249 N -3.08 1.28 0.54 5.09 -4.36 -1.17 -5.05 121.20 114.44 3bf0 s ILE 249 Ca 0.25 -1.97 -0.22 0.00 -0.26 0.00 0.00 60.65 58.46 3bf0 s ILE 249 Cb -0.11 -1.76 -0.05 0.00 1.25 0.00 0.00 42.46 41.79 3bf0 s ILE 249 CO 0.31 -0.63 1.31 -2.84 0.24 0.00 0.00 174.94 173.33 3bf0 s PRO 250 N -3.39 3.23 0.28 0.37 0.02 -1.26 -4.58 135.00 129.66 3bf0 s PRO 250 Ca 0.15 2.12 0.01 0.00 0.02 0.00 0.00 61.00 63.30 3bf0 s PRO 250 Cb -0.00 -2.25 0.65 0.00 0.02 0.00 0.00 34.50 32.91 3bf0 s PRO 250 CO 0.02 -1.08 1.70 0.00 -0.33 0.00 0.00 177.00 177.30 3bf0 h ALA 251 N 1.51 1.30 0.00 -1.55 0.00 -1.93 0.10 119.26 118.69 3bf0 h ALA 251 Ca -0.51 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3bf0 h ALA 251 Cb 1.29 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.24 3bf0 h ALA 251 CO 0.58 -0.32 0.00 -0.85 0.00 0.00 0.00 179.25 178.65 3bf0 n GLU 252 N -5.06 0.11 0.01 0.00 0.28 -1.26 -1.77 120.64 112.95 3bf0 n GLU 252 Ca 0.20 0.11 -0.12 0.00 -0.16 0.00 0.00 57.16 57.19 3bf0 n GLU 252 Cb 0.59 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.82 3bf0 n GLU 252 CO 0.00 0.00 0.00 0.37 -0.16 0.00 0.00 177.13 177.34 3bf0 h GLN 253 N 0.00 0.09 0.01 3.44 4.15 -1.16 -2.19 115.11 119.44 3bf0 h GLN 253 Ca 0.00 -0.15 0.02 0.00 0.77 0.00 0.00 58.65 59.29 3bf0 h GLN 253 Cb 0.32 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 3bf0 h GLN 253 CO 0.00 0.80 -0.11 0.28 -1.93 0.00 0.00 178.83 177.86 3bf0 h VAL 254 N 0.02 0.72 -2.69 2.39 2.07 -0.87 -3.41 116.25 114.48 3bf0 h VAL 254 Ca -0.25 0.00 -0.37 0.00 0.82 0.00 0.00 66.70 66.90 3bf0 h VAL 254 Cb 1.98 0.72 -0.38 0.00 -1.52 0.00 0.00 31.29 32.09 3bf0 h VAL 254 CO 0.11 0.00 -0.67 0.12 0.02 0.00 0.00 177.57 177.15 3bf0 s PHE 255 N -6.15 -0.11 -2.06 1.57 5.36 -1.03 -5.03 117.98 110.53 3bf0 s PHE 255 Ca -0.14 0.02 0.13 0.00 -0.96 0.00 0.00 56.93 55.98 3bf0 s PHE 255 Cb 0.08 -0.48 0.66 0.00 -0.34 0.00 0.00 43.02 42.94 3bf0 s PHE 255 CO 0.66 -0.58 1.45 -0.35 -1.46 0.00 0.00 175.22 174.94 3bf0 n PRO 256 N 5.30 1.24 0.00 10.12 -0.04 -0.82 -4.46 135.00 146.35 3bf0 n PRO 256 Ca -0.06 -0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 3bf0 n PRO 256 Cb 0.49 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 3bf0 n PRO 256 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3bf0 n GLY 257 N 0.82 -0.73 0.48 0.55 0.00 -1.26 -4.06 105.19 100.98 3bf0 n GLY 257 Ca 0.11 -1.68 -0.17 0.00 0.00 0.00 0.00 46.02 44.28 3bf0 n GLY 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bf0 h ALA 258 N 0.00 -1.04 -0.44 4.61 0.00 -1.97 -0.05 119.26 120.37 3bf0 h ALA 258 Ca 0.00 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.87 3bf0 h ALA 258 Cb 0.00 0.84 -0.09 0.00 0.00 0.00 0.00 17.79 18.54 3bf0 h ALA 258 CO 0.00 -1.14 -0.20 0.37 0.00 0.00 0.00 179.25 178.29 3bf0 h GLN 259 N -0.81 -0.10 -0.90 0.00 5.75 -1.99 0.51 115.11 117.56 3bf0 h GLN 259 Ca -0.02 0.01 0.08 0.00 -0.15 0.00 0.00 58.65 58.56 3bf0 h GLN 259 Cb 0.78 0.02 -0.06 0.00 1.07 0.00 0.00 27.48 29.29 3bf0 h GLN 259 CO -0.21 -0.07 0.58 0.78 -2.65 0.00 0.00 178.83 177.26 3bf0 h GLY 260 N -0.11 1.32 1.77 2.39 0.00 -1.63 0.18 103.07 106.99 3bf0 h GLY 260 Ca 0.21 -0.39 -0.17 0.00 0.00 0.00 0.00 47.33 46.98 3bf0 h GLY 260 CO -0.51 0.25 -0.73 -2.00 0.00 0.00 0.00 176.54 173.55 3bf0 h LEU 261 N 0.96 0.26 -0.20 3.11 5.85 0.69 -2.38 115.31 123.60 3bf0 h LEU 261 Ca 0.40 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.87 3bf0 h LEU 261 Cb 0.30 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 3bf0 h LEU 261 CO -0.16 0.91 -0.17 0.25 -0.34 0.00 0.00 178.44 178.92 3bf0 h LEU 262 N 0.15 0.50 -1.55 2.25 6.46 0.41 -1.96 115.31 121.56 3bf0 h LEU 262 Ca -0.02 -0.46 -0.05 0.00 -0.12 0.00 0.00 57.88 57.23 3bf0 h LEU 262 Cb 1.30 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 41.08 3bf0 h LEU 262 CO 0.11 0.86 -0.23 -0.33 -0.62 0.00 0.00 178.44 178.23 3bf0 h GLU 263 N 0.15 0.00 0.00 1.25 5.08 -0.67 -0.71 114.58 119.68 3bf0 h GLU 263 Ca 0.04 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 3bf0 h GLU 263 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 3bf0 h GLU 263 CO 0.04 0.23 -0.78 0.78 -1.00 0.00 0.00 179.01 178.28 3bf0 h GLY 264 N 0.71 0.00 0.80 -3.84 0.00 -1.32 -3.01 103.07 96.42 3bf0 h GLY 264 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 3bf0 h GLY 264 CO 0.03 0.00 -1.20 1.41 0.00 0.00 0.00 176.54 176.78 3bf0 h LEU 265 N 0.00 0.55 -0.38 3.11 4.07 -0.86 -3.31 115.31 118.49 3bf0 h LEU 265 Ca -0.04 -0.92 0.05 0.00 0.08 0.00 0.00 57.88 57.05 3bf0 h LEU 265 Cb 1.23 -0.18 -0.08 0.00 1.08 0.00 0.00 40.66 42.71 3bf0 h LEU 265 CO 0.03 1.56 -0.52 0.74 -1.08 0.00 0.00 178.44 179.17 3bf0 h THR 266 N -0.20 0.03 0.00 0.22 2.02 -1.25 0.26 112.91 114.00 3bf0 h THR 266 Ca -0.23 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.95 3bf0 h THR 266 Cb 1.83 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 3bf0 h THR 266 CO 0.16 0.00 0.39 0.50 0.37 0.00 0.00 175.52 176.94 3bf0 h LYS 267 N -0.39 0.00 -0.13 6.66 3.64 -1.66 0.14 116.57 124.83 3bf0 h LYS 267 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3bf0 h LYS 267 Cb 0.60 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3bf0 h LYS 267 CO -0.58 0.00 0.00 -2.37 -2.27 0.00 0.00 179.45 174.23 3bf0 n THR 268 N -2.24 0.90 -1.64 1.00 5.66 -0.35 -4.96 114.28 112.65 3bf0 n THR 268 Ca -0.01 -0.95 -0.09 0.00 -3.05 0.00 0.00 64.05 59.95 3bf0 n THR 268 Cb 0.41 0.56 -0.03 0.00 -1.55 0.00 0.00 70.33 69.73 3bf0 n THR 268 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3bf0 n GLY 269 N -0.04 0.65 2.33 1.09 0.00 0.49 -2.45 105.19 107.25 3bf0 n GLY 269 Ca 0.05 -0.56 -0.06 0.00 0.00 0.00 0.00 46.02 45.44 3bf0 n GLY 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bf0 n GLY 270 N -1.50 0.84 3.56 -0.02 0.00 0.77 -4.99 105.19 103.86 3bf0 n GLY 270 Ca -0.10 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 3bf0 n GLY 270 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3bf0 s ASP 271 N -2.61 6.18 0.40 1.61 -1.08 -1.02 -4.88 116.67 115.26 3bf0 s ASP 271 Ca 0.00 -0.23 0.07 0.00 -0.52 0.00 0.00 52.55 51.87 3bf0 s ASP 271 Cb 0.00 -2.56 0.82 0.00 -1.46 0.00 0.00 42.92 39.72 3bf0 s ASP 271 CO 0.00 -1.78 2.03 0.71 0.52 0.00 0.00 175.17 176.65 3bf0 h THR 272 N 6.13 1.12 0.02 1.71 1.35 -1.91 -2.09 112.91 119.24 3bf0 h THR 272 Ca -0.27 -0.30 -0.27 0.00 -0.55 0.00 0.00 66.41 65.02 3bf0 h THR 272 Cb 1.06 0.60 0.02 0.00 -1.73 0.00 0.00 68.15 68.10 3bf0 h THR 272 CO 1.25 0.13 -1.07 0.00 -0.25 0.00 0.00 175.52 175.58 3bf0 h ALA 273 N 1.71 0.13 -0.76 6.62 0.00 -1.69 -1.81 119.26 123.45 3bf0 h ALA 273 Ca 0.14 -0.71 -0.05 0.00 0.00 0.00 0.00 54.91 54.28 3bf0 h ALA 273 Cb 0.01 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3bf0 h ALA 273 CO -0.02 0.70 0.27 -0.22 0.00 0.00 0.00 179.25 179.98 3bf0 h LYS 274 N 0.36 1.15 -0.75 0.00 3.64 -1.82 -0.61 116.57 118.55 3bf0 h LYS 274 Ca -0.14 -0.23 0.07 0.00 -1.27 0.00 0.00 60.65 59.09 3bf0 h LYS 274 Cb 1.73 -0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 33.31 3bf0 h LYS 274 CO 0.21 0.95 0.44 -0.92 -2.27 0.00 0.00 179.45 177.86 3bf0 h TYR 275 N 1.11 0.80 -0.37 1.91 5.03 -1.24 0.01 116.97 124.22 3bf0 h TYR 275 Ca 0.25 0.03 -0.16 0.00 2.58 0.00 0.00 58.73 61.42 3bf0 h TYR 275 Cb 0.26 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.28 3bf0 h TYR 275 CO 0.02 0.38 -0.41 0.00 -1.32 0.00 0.00 178.16 176.84 3bf0 h ALA 276 N 1.38 0.57 -0.16 1.82 0.00 -0.85 -2.28 119.26 119.74 3bf0 h ALA 276 Ca 0.34 -0.46 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 3bf0 h ALA 276 Cb 0.21 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.89 3bf0 h ALA 276 CO -0.19 0.68 -0.64 1.25 0.00 0.00 0.00 179.25 180.35 3bf0 h LEU 277 N 0.75 0.84 -1.33 0.00 5.85 -0.87 0.13 115.31 120.68 3bf0 h LEU 277 Ca 0.05 -0.61 -0.07 0.00 0.84 0.00 0.00 57.88 58.09 3bf0 h LEU 277 Cb 1.00 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 3bf0 h LEU 277 CO 0.10 1.32 -0.33 -0.33 -0.34 0.00 0.00 178.44 178.85 3bf0 h GLU 278 N 0.43 0.00 -0.38 1.25 5.08 -1.03 -2.91 114.58 117.02 3bf0 h GLU 278 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3bf0 h GLU 278 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3bf0 h GLU 278 CO 0.13 0.33 0.00 0.09 -1.00 0.00 0.00 179.01 178.57 3bf0 n ASN 279 N -4.06 3.30 -0.77 1.42 3.02 -0.86 -4.96 115.26 112.34 3bf0 n ASN 279 Ca -0.02 -1.97 -0.08 0.00 -0.03 0.00 0.00 54.58 52.48 3bf0 n ASN 279 Cb 0.38 -0.25 -0.02 0.00 -0.61 0.00 0.00 39.78 39.28 3bf0 n ASN 279 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3bf0 n LYS 280 N 1.38 -0.62 0.23 3.52 5.02 0.30 -4.83 118.16 123.15 3bf0 n LYS 280 Ca 0.19 0.64 0.08 0.00 -2.02 0.00 0.00 58.31 57.20 3bf0 n LYS 280 Cb 0.58 -4.54 0.53 0.00 -0.02 0.00 0.00 35.03 31.58 3bf0 n LYS 280 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3bf0 h LEU 281 N 0.00 0.00 -8.36 -0.35 3.38 -1.46 -3.45 115.31 105.07 3bf0 h LEU 281 Ca -0.18 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.54 3bf0 h LEU 281 Cb 0.79 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.37 3bf0 h LEU 281 CO 0.25 0.23 -0.71 -0.69 0.09 0.00 0.00 178.44 177.60 3bf0 s VAL 282 N -4.22 0.66 -0.05 1.22 1.01 -1.21 -4.95 120.40 112.87 3bf0 s VAL 282 Ca -0.03 -1.66 0.14 0.00 0.00 0.00 0.00 61.98 60.44 3bf0 s VAL 282 Cb 0.14 -1.34 -0.21 0.00 0.00 0.00 0.00 36.38 34.97 3bf0 s VAL 282 CO 0.66 -0.71 0.25 0.47 0.00 0.00 0.00 175.10 175.77 3bf0 n ASP 283 N 0.45 1.66 -3.66 3.32 8.00 0.12 -4.65 116.55 121.79 3bf0 n ASP 283 Ca -0.16 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.21 3bf0 n ASP 283 Cb 0.59 1.46 -0.08 0.00 -0.02 0.00 0.00 41.12 43.07 3bf0 n ASP 283 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3bf0 s ALA 284 N -2.84 -1.58 -0.10 2.24 0.00 -0.92 -4.99 121.76 113.58 3bf0 s ALA 284 Ca -0.06 1.79 -0.19 0.00 0.00 0.00 0.00 51.96 53.51 3bf0 s ALA 284 Cb 0.08 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 3bf0 s ALA 284 CO 0.59 -0.30 0.51 -0.51 0.00 0.00 0.00 175.76 176.05 3bf0 s LEU 285 N 0.33 4.30 -0.17 0.00 1.43 -1.25 -0.47 118.68 122.84 3bf0 s LEU 285 Ca -0.00 0.89 -0.30 0.00 -1.03 0.00 0.00 54.13 53.69 3bf0 s LEU 285 Cb -0.04 -2.76 0.14 0.00 0.03 0.00 0.00 46.19 43.56 3bf0 s LEU 285 CO 0.01 0.01 1.07 0.00 0.23 0.00 0.00 176.35 177.66 3bf0 s ALA 286 N 0.51 -1.97 0.47 4.21 0.00 0.75 -4.85 121.76 120.88 3bf0 s ALA 286 Ca 0.28 1.60 -0.07 0.00 0.00 0.00 0.00 51.96 53.77 3bf0 s ALA 286 Cb -0.16 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.17 3bf0 s ALA 286 CO 0.12 -0.34 0.80 0.45 0.00 0.00 0.00 175.76 176.79 3bf0 s SER 287 N -1.24 6.34 0.28 0.00 0.15 -1.26 -4.03 113.70 113.93 3bf0 s SER 287 Ca 0.01 1.04 -0.02 0.00 0.70 0.00 0.00 55.95 57.68 3bf0 s SER 287 Cb -0.01 -2.29 0.61 0.00 -1.71 0.00 0.00 66.02 62.62 3bf0 s SER 287 CO -0.01 -0.55 1.61 -1.28 1.20 0.00 0.00 173.24 174.20 3bf0 h SER 288 N 0.50 -0.39 1.09 5.45 0.87 -1.99 0.11 113.55 119.20 3bf0 h SER 288 Ca -0.47 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 3bf0 h SER 288 Cb 1.20 0.41 0.00 0.00 -0.44 0.00 0.00 62.40 63.57 3bf0 h SER 288 CO 0.62 -0.26 -0.41 0.00 -0.53 0.00 0.00 176.83 176.25 3bf0 h ALA 289 N 1.85 0.73 -0.19 6.23 0.00 -1.99 -0.42 119.26 125.47 3bf0 h ALA 289 Ca 0.52 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 55.27 3bf0 h ALA 289 Cb 1.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3bf0 h ALA 289 CO -0.79 0.00 -0.53 0.93 0.00 0.00 0.00 179.25 178.86 3bf0 h GLU 290 N 0.00 0.54 -0.05 0.00 5.08 -1.24 -2.83 114.58 116.08 3bf0 h GLU 290 Ca 0.00 -0.33 -0.05 0.00 -1.00 0.00 0.00 59.36 57.98 3bf0 h GLU 290 Cb 0.75 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.04 3bf0 h GLU 290 CO 0.00 0.93 -0.18 0.82 -1.00 0.00 0.00 179.01 179.59 3bf0 h ILE 291 N 0.42 1.45 -0.59 3.13 2.04 -0.83 -2.49 117.51 120.64 3bf0 h ILE 291 Ca 0.01 -1.59 0.09 0.00 1.00 0.00 0.00 64.86 64.38 3bf0 h ILE 291 Cb 1.06 2.35 -0.11 0.00 -0.74 0.00 0.00 36.82 39.38 3bf0 h ILE 291 CO 0.10 0.44 -0.41 -0.08 0.00 0.00 0.00 178.15 178.20 3bf0 h GLU 292 N -0.32 -0.20 0.45 2.37 4.81 -1.16 0.42 114.58 120.95 3bf0 h GLU 292 Ca -0.01 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3bf0 h GLU 292 Cb 0.81 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.22 3bf0 h GLU 292 CO 0.04 -0.13 -0.34 0.87 -0.73 0.00 0.00 179.01 178.71 3bf0 h LYS 293 N -0.21 -0.75 -0.59 1.92 1.57 -1.53 0.43 116.57 117.41 3bf0 h LYS 293 Ca 0.19 0.05 0.12 0.00 -1.87 0.00 0.00 60.65 59.15 3bf0 h LYS 293 Cb 0.56 0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.01 3bf0 h LYS 293 CO -0.69 -0.50 0.40 0.00 -0.57 0.00 0.00 179.45 178.09 3bf0 h ALA 294 N -0.35 2.19 0.05 3.86 0.00 -1.08 0.14 119.26 124.07 3bf0 h ALA 294 Ca -0.04 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.62 3bf0 h ALA 294 Cb 0.67 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3bf0 h ALA 294 CO 0.00 -0.34 -1.03 -0.07 0.00 0.00 0.00 179.25 177.81 3bf0 h LEU 295 N 0.26 0.33 -0.31 0.00 3.38 0.10 -3.00 115.31 116.07 3bf0 h LEU 295 Ca 0.28 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 3bf0 h LEU 295 Cb 0.74 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3bf0 h LEU 295 CO -0.06 1.17 -0.39 0.71 0.09 0.00 0.00 178.44 179.96 3bf0 h THR 296 N 0.10 0.72 -0.61 0.22 1.35 0.15 -0.28 112.91 114.56 3bf0 h THR 296 Ca -0.08 -1.82 -0.10 0.00 -0.55 0.00 0.00 66.41 63.86 3bf0 h THR 296 Cb 1.72 2.21 -0.02 0.00 -1.73 0.00 0.00 68.15 70.32 3bf0 h THR 296 CO 0.16 0.38 -0.01 0.50 -0.25 0.00 0.00 175.52 176.30 3bf0 h LYS 297 N 0.00 1.08 0.16 4.72 3.64 -0.84 0.26 116.57 125.59 3bf0 h LYS 297 Ca -0.00 -0.35 -0.29 0.00 -1.27 0.00 0.00 60.65 58.74 3bf0 h LYS 297 Cb 1.18 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 32.91 3bf0 h LYS 297 CO 0.05 1.06 -1.30 1.49 -2.27 0.00 0.00 179.45 178.48 3bf0 h GLU 298 N 0.98 0.36 0.00 1.90 4.57 -1.35 -3.38 114.58 117.66 3bf0 h GLU 298 Ca 0.17 -0.60 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 3bf0 h GLU 298 Cb 0.58 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.39 3bf0 h GLU 298 CO 0.03 1.28 -0.44 1.19 -1.18 0.00 0.00 179.01 179.90 3bf0 n PHE 299 N -3.60 0.00 0.00 0.92 3.72 -0.14 -5.08 117.46 113.29 3bf0 n PHE 299 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 3bf0 n PHE 299 Cb 1.04 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.55 3bf0 n PHE 299 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3bf0 n GLY 300 N 1.34 -1.58 3.80 1.37 0.00 0.91 -3.93 105.19 107.11 3bf0 n GLY 300 Ca 0.01 -1.53 -0.36 0.00 0.00 0.00 0.00 46.02 44.13 3bf0 n GLY 300 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3bf0 s TRP 301 N -3.05 3.53 -0.60 1.61 -0.11 -1.26 -0.17 118.94 118.90 3bf0 s TRP 301 Ca 0.00 0.55 -0.13 0.00 1.22 0.00 0.00 56.10 57.74 3bf0 s TRP 301 Cb 0.00 -2.13 0.15 0.00 -1.50 0.00 0.00 33.47 29.99 3bf0 s TRP 301 CO 0.00 0.50 0.52 0.45 -4.62 0.00 0.00 176.95 173.80 3bf0 s SER 302 N -0.34 6.14 0.59 5.86 0.15 -0.15 -4.89 113.70 121.06 3bf0 s SER 302 Ca 0.14 -2.11 0.33 0.00 0.70 0.00 0.00 55.95 55.01 3bf0 s SER 302 Cb -0.13 -2.13 1.28 0.00 -1.71 0.00 0.00 66.02 63.33 3bf0 s SER 302 CO 0.04 -0.71 1.56 0.11 1.20 0.00 0.00 173.24 175.43 3bf0 h LYS 303 N 8.38 0.00 0.13 5.44 1.79 -1.97 0.58 116.57 130.92 3bf0 h LYS 303 Ca -0.16 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.13 3bf0 h LYS 303 Cb 1.07 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.74 3bf0 h LYS 303 CO 0.90 0.00 -0.81 1.15 -1.08 0.00 0.00 179.45 179.61 3bf0 h THR 304 N 0.00 1.49 0.00 -0.16 2.02 -1.94 -3.37 112.91 110.96 3bf0 h THR 304 Ca 0.51 -2.51 0.00 0.00 0.77 0.00 0.00 66.41 65.18 3bf0 h THR 304 Cb 2.57 3.18 0.00 0.00 -1.74 0.00 0.00 68.15 72.16 3bf0 h THR 304 CO -0.01 0.71 -1.47 0.47 0.37 0.00 0.00 175.52 175.59 3bf0 n ASP 305 N -4.15 0.51 -3.23 4.18 8.00 -0.81 -5.00 116.55 116.05 3bf0 n ASP 305 Ca -0.15 -0.49 -0.15 0.00 0.71 0.00 0.00 54.79 54.71 3bf0 n ASP 305 Cb 0.80 1.46 0.08 0.00 -0.02 0.00 0.00 41.12 43.44 3bf0 n ASP 305 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3bf0 n LYS 306 N -1.88 -5.27 -3.86 -1.24 5.02 0.13 -5.03 118.16 106.03 3bf0 n LYS 306 Ca 0.00 0.79 -0.08 0.00 -2.02 0.00 0.00 58.31 57.01 3bf0 n LYS 306 Cb 0.45 -5.61 -0.01 0.00 -0.02 0.00 0.00 35.03 29.83 3bf0 n LYS 306 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3bf0 s ASN 307 N -4.07 -0.15 0.81 4.39 3.84 -1.24 -5.01 114.94 113.51 3bf0 s ASN 307 Ca 0.09 -0.80 -0.12 0.00 0.21 0.00 0.00 52.86 52.25 3bf0 s ASN 307 Cb -0.01 0.75 0.08 0.00 -0.55 0.00 0.00 41.25 41.53 3bf0 s ASN 307 CO 0.68 -1.43 1.15 -0.72 -2.79 0.00 0.00 177.10 173.99 3bf0 s TYR 308 N -3.46 2.05 -0.15 0.43 -0.85 -1.26 -0.98 117.35 113.12 3bf0 s TYR 308 Ca 0.13 1.67 -0.29 0.00 -0.52 0.00 0.00 57.07 58.06 3bf0 s TYR 308 Cb -0.05 -3.29 -0.02 0.00 0.38 0.00 0.00 41.96 38.97 3bf0 s TYR 308 CO 0.09 -2.42 1.34 1.03 -1.52 0.00 0.00 175.55 174.07 3bf0 s ARG 309 N -4.46 4.20 -0.29 -3.49 0.52 0.77 -4.72 118.95 111.47 3bf0 s ARG 309 Ca 0.67 1.73 -0.20 0.00 -0.52 0.00 0.00 55.73 57.41 3bf0 s ARG 309 Cb -0.23 -3.82 0.13 0.00 0.52 0.00 0.00 34.95 31.56 3bf0 s ARG 309 CO 0.53 -0.77 1.00 0.00 0.02 0.00 0.00 175.30 176.08 3bf0 s ALA 310 N 3.68 -2.11 -0.07 2.13 0.00 -1.26 -0.80 121.76 123.33 3bf0 s ALA 310 Ca 0.58 2.05 0.03 0.00 0.00 0.00 0.00 51.96 54.62 3bf0 s ALA 310 Cb -0.23 -1.57 -0.02 0.00 0.00 0.00 0.00 23.12 21.29 3bf0 s ALA 310 CO 0.18 -0.29 -0.14 -1.50 0.00 0.00 0.00 175.76 174.01 3bf0 s ILE 311 N 0.80 3.03 0.31 0.00 2.07 -0.38 -4.91 121.20 122.11 3bf0 s ILE 311 Ca -0.03 -0.72 -0.28 0.00 -1.41 0.00 0.00 60.65 58.21 3bf0 s ILE 311 Cb -0.04 -2.21 -0.09 0.00 0.13 0.00 0.00 42.46 40.25 3bf0 s ILE 311 CO -0.11 0.57 1.05 -0.55 -1.91 0.00 0.00 174.94 173.99 3bf0 s SER 312 N -0.43 7.21 0.43 4.50 0.15 -1.26 -0.16 113.70 124.14 3bf0 s SER 312 Ca 0.05 2.12 0.25 0.00 0.70 0.00 0.00 55.95 59.07 3bf0 s SER 312 Cb -0.12 -2.61 1.26 0.00 -1.71 0.00 0.00 66.02 62.84 3bf0 s SER 312 CO 0.02 -0.17 1.73 0.22 1.20 0.00 0.00 173.24 176.24 3bf0 h TYR 313 N 3.49 0.52 0.00 3.44 3.20 -1.22 0.23 116.97 126.64 3bf0 h TYR 313 Ca -0.47 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.42 3bf0 h TYR 313 Cb 1.21 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 39.33 3bf0 h TYR 313 CO 0.59 -0.02 0.00 1.88 -1.64 0.00 0.00 178.16 178.97 3bf0 h TYR 314 N 0.25 0.00 -0.00 -3.82 0.05 -1.92 -3.03 116.97 108.50 3bf0 h TYR 314 Ca 0.65 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.43 3bf0 h TYR 314 Cb 1.93 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.67 3bf0 h TYR 314 CO -0.00 0.00 -0.32 -0.25 -1.05 0.00 0.00 178.16 176.53 3bf0 n ASP 315 N -2.36 0.91 -4.50 3.88 8.00 0.68 -4.93 116.55 118.23 3bf0 n ASP 315 Ca 0.04 -0.95 -0.43 0.00 0.71 0.00 0.00 54.79 54.15 3bf0 n ASP 315 Cb 0.35 0.70 -0.05 0.00 -0.02 0.00 0.00 41.12 42.09 3bf0 n ASP 315 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3bf0 s TYR 316 N -1.62 2.95 -0.14 1.24 5.04 -0.34 -4.94 117.35 119.54 3bf0 s TYR 316 Ca 0.07 -0.19 -0.29 0.00 -2.44 0.00 0.00 57.07 54.21 3bf0 s TYR 316 Cb 0.08 -3.72 -0.05 0.00 0.35 0.00 0.00 41.96 38.62 3bf0 s TYR 316 CO 0.32 -1.12 1.75 0.00 -1.34 0.00 0.00 175.55 175.16 3bf0 s ALA 317 N 3.22 3.34 -0.04 3.97 0.00 -1.26 -4.93 121.76 126.06 3bf0 s ALA 317 Ca 0.24 0.76 -0.30 0.00 0.00 0.00 0.00 51.96 52.66 3bf0 s ALA 317 Cb -0.15 -3.85 -0.03 0.00 0.00 0.00 0.00 23.12 19.09 3bf0 s ALA 317 CO 0.17 -1.85 1.06 -1.17 0.00 0.00 0.00 175.76 173.97 3bf0 s LEU 318 N 5.16 4.31 0.30 0.00 2.96 -1.26 -5.02 118.68 125.13 3bf0 s LEU 318 Ca 0.78 1.69 -0.29 0.00 -0.22 0.00 0.00 54.13 56.09 3bf0 s LEU 318 Cb -0.31 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 42.72 3bf0 s LEU 318 CO 0.32 -0.42 1.29 -0.54 -1.32 0.00 0.00 176.35 175.68 3bf0 s LYS 319 N 1.63 4.39 -0.46 1.98 1.02 -1.26 -4.97 119.74 122.07 3bf0 s LYS 319 Ca 0.52 2.16 -0.27 0.00 0.02 0.00 0.00 55.97 58.40 3bf0 s LYS 319 Cb -0.22 -3.10 0.03 0.00 -0.52 0.00 0.00 37.83 34.02 3bf0 s LYS 319 CO 0.23 -0.17 1.03 0.95 -0.92 0.00 0.00 175.35 176.47 3bf0 s THR 320 N -0.90 4.36 0.52 2.17 -4.23 -1.26 -5.01 115.64 111.29 3bf0 s THR 320 Ca 0.50 1.03 -0.21 0.00 -1.18 0.00 0.00 61.69 61.83 3bf0 s THR 320 Cb -0.39 -4.51 -0.06 0.00 1.34 0.00 0.00 72.50 68.89 3bf0 s THR 320 CO 0.49 -0.88 1.23 -2.84 -0.54 0.00 0.00 174.62 172.08 3bf0 s PRO 321 N 4.05 3.36 0.36 3.99 0.02 -1.26 -4.95 135.00 140.57 3bf0 s PRO 321 Ca 0.42 1.91 -0.28 0.00 0.02 0.00 0.00 61.00 63.07 3bf0 s PRO 321 Cb -0.09 -2.22 -0.11 0.00 0.02 0.00 0.00 34.50 32.10 3bf0 s PRO 321 CO 0.28 -0.91 1.48 0.00 -0.33 0.00 0.00 177.00 177.51 3bf0 s ALA 322 N -1.50 3.59 -0.82 -1.55 0.00 -1.26 -4.96 121.76 115.27 3bf0 s ALA 322 Ca 0.70 1.53 -0.25 0.00 0.00 0.00 0.00 51.96 53.93 3bf0 s ALA 322 Cb -0.32 -3.60 0.01 0.00 0.00 0.00 0.00 23.12 19.21 3bf0 s ALA 322 CO 0.38 -0.99 1.55 -0.51 0.00 0.00 0.00 175.76 176.19 3bf0 s ASP 323 N -0.08 5.92 0.07 0.00 1.01 -1.26 -4.89 116.67 117.43 3bf0 s ASP 323 Ca 0.54 -0.61 -0.28 0.00 0.71 0.00 0.00 52.55 52.91 3bf0 s ASP 323 Cb -0.46 -2.56 -0.13 0.00 1.01 0.00 0.00 42.92 40.78 3bf0 s ASP 323 CO 0.59 -2.00 1.44 0.74 0.21 0.00 0.00 175.17 176.15 3bf0 h THR 324 N 6.61 0.00 0.00 -1.27 2.02 -1.92 -3.48 112.91 114.87 3bf0 h THR 324 Ca -0.08 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.10 3bf0 h THR 324 Cb 1.05 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 3bf0 h THR 324 CO 1.30 0.00 0.00 0.61 0.37 0.00 0.00 175.52 177.80 3bf0 n GLY 325 N -1.44 -0.06 2.81 2.16 0.00 -1.26 -5.11 105.19 102.30 3bf0 n GLY 325 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 3bf0 n GLY 325 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3bf0 s ASP 326 N -0.17 2.73 0.30 1.61 1.11 -1.26 -4.85 116.67 116.15 3bf0 s ASP 326 Ca 0.00 -0.67 0.10 0.00 0.18 0.00 0.00 52.55 52.16 3bf0 s ASP 326 Cb 0.00 -0.73 -0.05 0.00 1.07 0.00 0.00 42.92 43.21 3bf0 s ASP 326 CO 0.00 -0.24 -0.09 -0.94 1.18 0.00 0.00 175.17 175.08 3bf0 s SER 327 N 1.76 3.93 -0.17 0.27 1.04 0.07 -2.81 113.70 117.79 3bf0 s SER 327 Ca 0.00 -0.98 0.01 0.00 0.48 0.00 0.00 55.95 55.46 3bf0 s SER 327 Cb -0.16 -0.46 0.01 0.00 0.10 0.00 0.00 66.02 65.51 3bf0 s SER 327 CO -0.07 -0.08 -0.18 -0.63 0.98 0.00 0.00 173.24 173.26 3bf0 s ILE 328 N -2.50 2.32 0.06 -1.02 1.01 -0.17 -0.08 121.20 120.82 3bf0 s ILE 328 Ca 0.32 -0.87 -0.27 0.00 0.00 0.00 0.00 60.65 59.83 3bf0 s ILE 328 Cb -0.03 -1.97 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 3bf0 s ILE 328 CO 0.17 0.52 0.86 -0.83 0.00 0.00 0.00 174.94 175.66 3bf0 s GLY 329 N 1.10 2.88 -0.21 6.18 0.00 -0.62 -1.07 107.32 115.57 3bf0 s GLY 329 Ca 0.00 0.41 -0.03 0.00 0.00 0.00 0.00 44.72 45.10 3bf0 s GLY 329 CO -0.07 1.29 -0.06 0.14 0.00 0.00 0.00 173.10 174.40 3bf0 s VAL 330 N 0.10 3.25 -0.09 1.40 1.01 0.30 -1.02 120.40 125.36 3bf0 s VAL 330 Ca 0.43 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.90 3bf0 s VAL 330 Cb -0.21 -2.46 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 3bf0 s VAL 330 CO 0.26 0.44 -0.19 -0.69 0.00 0.00 0.00 175.10 174.92 3bf0 s VAL 331 N 1.36 2.56 -0.15 2.92 1.01 -0.50 -3.65 120.40 123.94 3bf0 s VAL 331 Ca 0.04 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.04 3bf0 s VAL 331 Cb -0.14 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 3bf0 s VAL 331 CO -0.03 0.55 0.24 -0.36 0.00 0.00 0.00 175.10 175.50 3bf0 s PHE 332 N 0.06 3.48 -0.71 5.22 0.40 -1.26 -0.17 117.98 125.00 3bf0 s PHE 332 Ca -0.08 0.54 0.04 0.00 -0.60 0.00 0.00 56.93 56.84 3bf0 s PHE 332 Cb -0.15 -2.24 0.23 0.00 0.51 0.00 0.00 43.02 41.37 3bf0 s PHE 332 CO 0.05 0.34 0.74 0.00 0.70 0.00 0.00 175.22 177.06 3bf0 n ALA 333 N 3.24 3.98 -2.95 5.36 0.00 -0.62 -4.95 120.51 124.57 3bf0 n ALA 333 Ca -0.14 -4.71 -0.44 0.00 0.00 0.00 0.00 53.44 48.15 3bf0 n ALA 333 Cb 0.52 -1.10 -0.08 0.00 0.00 0.00 0.00 19.45 18.80 3bf0 n ALA 333 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3bf0 s ASN 334 N -2.02 6.10 0.00 0.00 2.47 -1.26 -2.08 114.94 118.15 3bf0 s ASN 334 Ca 0.35 -1.39 0.00 0.00 0.42 0.00 0.00 52.86 52.24 3bf0 s ASN 334 Cb 0.08 -2.17 0.00 0.00 -1.45 0.00 0.00 41.25 37.71 3bf0 s ASN 334 CO -0.05 -0.66 0.00 0.61 -3.72 0.00 0.00 177.10 173.28 3bf0 n GLY 335 N 5.18 0.58 3.77 1.21 0.00 0.07 -4.14 105.19 111.86 3bf0 n GLY 335 Ca -0.12 -2.22 -0.37 0.00 0.00 0.00 0.00 46.02 43.31 3bf0 n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bf0 s ALA 336 N -1.50 2.90 -0.28 4.61 0.00 -1.26 -4.16 121.76 122.08 3bf0 s ALA 336 Ca 0.00 0.91 -0.14 0.00 0.00 0.00 0.00 51.96 52.73 3bf0 s ALA 336 Cb 0.00 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 3bf0 s ALA 336 CO 0.00 -0.70 0.34 0.42 0.00 0.00 0.00 175.76 175.83 3bf0 s ILE 337 N -1.60 5.20 0.03 0.00 1.01 0.39 -0.00 121.20 126.22 3bf0 s ILE 337 Ca 0.66 0.47 0.04 0.00 0.00 0.00 0.00 60.65 61.82 3bf0 s ILE 337 Cb -0.28 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 3bf0 s ILE 337 CO 0.33 0.16 -0.05 -0.04 0.00 0.00 0.00 174.94 175.34 3bf0 s MET 338 N 2.01 2.52 0.32 2.79 -1.94 0.40 -0.22 119.30 125.18 3bf0 s MET 338 Ca 0.13 -0.77 0.05 0.00 -1.71 0.00 0.00 55.69 53.39 3bf0 s MET 338 Cb -0.16 -2.50 0.67 0.00 2.01 0.00 0.00 34.83 34.85 3bf0 s MET 338 CO 0.10 0.58 1.88 -0.44 -0.01 0.00 0.00 175.02 177.13 3bf0 h ASP 339 N 4.17 0.79 0.00 3.03 5.19 -1.90 0.30 116.42 127.99 3bf0 h ASP 339 Ca -0.48 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 3bf0 h ASP 339 Cb 1.17 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.55 3bf0 h ASP 339 CO 0.55 0.44 0.00 0.61 -3.12 0.00 0.00 179.24 177.72 3bf0 n GLY 340 N -1.40 -0.17 3.85 2.75 0.00 -1.26 -4.21 105.19 104.74 3bf0 n GLY 340 Ca 0.16 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.41 3bf0 n GLY 340 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3bf0 s GLU 341 N 0.00 2.60 -0.64 1.61 -1.05 -1.26 -2.65 118.70 117.31 3bf0 s GLU 341 Ca 0.00 -1.43 -0.18 0.00 -0.15 0.00 0.00 54.97 53.22 3bf0 s GLU 341 Cb 0.00 -2.40 -0.15 0.00 -0.44 0.00 0.00 34.13 31.14 3bf0 s GLU 341 CO 0.00 -0.02 1.67 -1.91 0.95 0.00 0.00 175.26 175.95 3bf0 n GLU 342 N -1.41 0.00 -4.35 -4.83 4.07 -1.26 -4.60 120.64 108.25 3bf0 n GLU 342 Ca 0.00 0.00 -0.30 0.00 -0.06 0.00 0.00 57.16 56.80 3bf0 n GLU 342 Cb 0.61 -0.91 -0.10 0.00 -0.06 0.00 0.00 31.44 30.97 3bf0 n GLU 342 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 3bf0 s THR 343 N 4.91 3.30 0.00 6.31 -1.32 -1.26 -4.95 115.64 122.62 3bf0 s THR 343 Ca 0.86 -1.17 0.00 0.00 -1.21 0.00 0.00 61.69 60.18 3bf0 s THR 343 Cb -0.77 -2.50 0.00 0.00 -1.51 0.00 0.00 72.50 67.73 3bf0 s THR 343 CO 0.32 0.21 0.00 0.00 -2.21 0.00 0.00 174.62 172.94 3bf0 n GLN 344 N 1.02 0.00 -2.48 7.08 6.02 -1.26 -0.34 117.38 127.42 3bf0 n GLN 344 Ca -0.14 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.51 3bf0 n GLN 344 Cb 0.52 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.79 3bf0 n GLN 344 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3bf0 n GLY 345 N 0.00 5.82 3.53 1.08 0.00 -1.26 -5.04 105.19 109.33 3bf0 n GLY 345 Ca 0.00 -2.66 -0.25 0.00 0.00 0.00 0.00 46.02 43.11 3bf0 n GLY 345 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3bf0 s ASN 346 N -2.43 2.94 -0.18 1.61 0.02 0.54 -4.54 114.94 112.90 3bf0 s ASN 346 Ca 0.47 -1.48 -0.12 0.00 -1.02 0.00 0.00 52.86 50.71 3bf0 s ASN 346 Cb 0.34 0.09 -0.05 0.00 0.02 0.00 0.00 41.25 41.65 3bf0 s ASN 346 CO -0.23 -0.69 0.23 -0.69 0.02 0.00 0.00 177.10 175.74 3bf0 s VAL 347 N -3.13 5.35 -0.40 1.60 1.01 0.99 -4.39 120.40 121.43 3bf0 s VAL 347 Ca 0.29 0.40 -0.13 0.00 0.00 0.00 0.00 61.98 62.54 3bf0 s VAL 347 Cb 0.07 -3.57 0.03 0.00 0.00 0.00 0.00 36.38 32.91 3bf0 s VAL 347 CO 0.14 0.41 0.27 -0.83 0.00 0.00 0.00 175.10 175.09 3bf0 s GLY 348 N 0.43 1.98 0.14 4.51 0.00 -1.26 0.15 107.32 113.26 3bf0 s GLY 348 Ca 0.13 -1.78 -0.03 0.00 0.00 0.00 0.00 44.72 43.04 3bf0 s GLY 348 CO 0.01 0.91 0.74 0.61 0.00 0.00 0.00 173.10 175.38 3bf0 n GLY 349 N 5.09 -0.78 0.09 0.20 0.00 0.10 -1.12 105.19 108.78 3bf0 n GLY 349 Ca -0.11 0.50 -0.13 0.00 0.00 0.00 0.00 46.02 46.28 3bf0 n GLY 349 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3bf0 h ASP 350 N 0.00 0.24 -0.45 1.61 5.19 -1.68 -0.22 116.42 121.11 3bf0 h ASP 350 Ca 0.24 -0.30 -0.05 0.00 -0.62 0.00 0.00 57.03 56.30 3bf0 h ASP 350 Cb 0.39 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.80 3bf0 h ASP 350 CO -0.48 1.25 0.12 0.74 -3.12 0.00 0.00 179.24 177.75 3bf0 h THR 351 N 0.04 1.22 0.09 0.35 2.02 -1.42 -1.85 112.91 113.35 3bf0 h THR 351 Ca -0.16 -0.78 -0.13 0.00 0.77 0.00 0.00 66.41 66.11 3bf0 h THR 351 Cb 1.94 0.69 0.01 0.00 -1.74 0.00 0.00 68.15 69.06 3bf0 h THR 351 CO 0.15 0.29 -0.57 0.74 0.37 0.00 0.00 175.52 176.50 3bf0 h THR 352 N 0.75 1.58 -0.98 3.16 2.02 -1.09 -2.60 112.91 115.75 3bf0 h THR 352 Ca 0.17 -2.42 0.20 0.00 0.77 0.00 0.00 66.41 65.13 3bf0 h THR 352 Cb 0.28 3.17 -0.09 0.00 -1.74 0.00 0.00 68.15 69.77 3bf0 h THR 352 CO -0.00 0.67 0.62 0.00 0.37 0.00 0.00 175.52 177.18 3bf0 h ALA 353 N 0.09 1.90 0.00 6.16 0.00 -1.04 -1.54 119.26 124.84 3bf0 h ALA 353 Ca -0.10 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 3bf0 h ALA 353 Cb 1.42 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 3bf0 h ALA 353 CO 0.11 -0.25 -0.38 0.00 0.00 0.00 0.00 179.25 178.73 3bf0 h ALA 354 N 1.63 0.78 0.13 0.00 0.00 -1.29 -1.27 119.26 119.24 3bf0 h ALA 354 Ca 0.55 -0.34 -0.28 0.00 0.00 0.00 0.00 54.91 54.84 3bf0 h ALA 354 Cb 1.05 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.80 3bf0 h ALA 354 CO -0.31 0.47 -1.23 1.96 0.00 0.00 0.00 179.25 180.14 3bf0 h GLN 355 N 0.00 0.41 -0.35 0.00 4.20 -0.90 -1.59 115.11 116.88 3bf0 h GLN 355 Ca -0.00 -0.60 -0.11 0.00 0.06 0.00 0.00 58.65 57.99 3bf0 h GLN 355 Cb 1.23 0.21 -0.01 0.00 0.30 0.00 0.00 27.48 29.21 3bf0 h GLN 355 CO 0.05 1.26 -0.24 0.82 -0.67 0.00 0.00 178.83 180.06 3bf0 h ILE 356 N 0.15 1.27 -0.39 2.54 2.04 -1.30 -2.53 117.51 119.30 3bf0 h ILE 356 Ca -0.15 -1.33 -0.05 0.00 1.00 0.00 0.00 64.86 64.32 3bf0 h ILE 356 Cb 1.92 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 39.24 3bf0 h ILE 356 CO 0.22 0.44 0.05 -0.09 0.00 0.00 0.00 178.15 178.76 3bf0 h ARG 357 N 0.61 0.65 -0.40 2.37 2.43 -1.17 0.27 114.38 119.14 3bf0 h ARG 357 Ca 0.08 -0.18 0.08 0.00 -0.81 0.00 0.00 59.98 59.15 3bf0 h ARG 357 Cb 0.73 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.13 3bf0 h ARG 357 CO 0.06 0.72 -0.05 0.22 -1.51 0.00 0.00 179.97 179.40 3bf0 h ASP 358 N 0.49 -0.28 -0.12 -3.80 3.58 -1.24 -2.72 116.42 112.32 3bf0 h ASP 358 Ca 0.12 0.11 -0.20 0.00 0.42 0.00 0.00 57.03 57.47 3bf0 h ASP 358 Cb 0.39 0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.66 3bf0 h ASP 358 CO 0.01 -0.09 -0.69 0.00 -2.88 0.00 0.00 179.24 175.58 3bf0 h ALA 359 N 1.38 0.42 0.00 -0.78 0.00 -1.03 -1.86 119.26 117.40 3bf0 h ALA 359 Ca 0.20 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3bf0 h ALA 359 Cb 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3bf0 h ALA 359 CO -0.38 0.69 0.00 -2.13 0.00 0.00 0.00 179.25 177.44 3bf0 n ARG 360 N -3.95 0.11 0.00 0.00 0.63 0.92 -2.97 116.66 111.41 3bf0 n ARG 360 Ca -0.06 0.49 0.00 0.00 -0.92 0.00 0.00 57.85 57.37 3bf0 n ARG 360 Cb 0.70 -1.78 0.00 0.00 0.45 0.00 0.00 32.46 31.83 3bf0 n ARG 360 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3bf0 n LEU 361 N -2.00 0.26 -4.63 6.15 4.77 -1.05 -4.93 117.00 115.57 3bf0 n LEU 361 Ca 0.01 -0.47 -0.43 0.00 -0.03 0.00 0.00 56.01 55.09 3bf0 n LEU 361 Cb 0.10 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 3bf0 n LEU 361 CO 0.11 0.07 0.95 -0.62 -1.33 0.00 0.00 177.39 176.57 3bf0 s ASP 362 N -0.42 6.87 0.52 -1.43 -1.08 -0.71 -4.92 116.67 115.49 3bf0 s ASP 362 Ca 0.00 0.94 0.30 0.00 -0.52 0.00 0.00 52.55 53.27 3bf0 s ASP 362 Cb 0.00 -2.54 1.31 0.00 -1.46 0.00 0.00 42.92 40.24 3bf0 s ASP 362 CO 0.00 -0.93 1.98 1.55 0.52 0.00 0.00 175.17 178.29 3bf0 h PRO 363 N 8.27 0.00 0.00 4.34 0.13 -1.92 -2.01 132.00 140.82 3bf0 h PRO 363 Ca -0.21 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.88 3bf0 h PRO 363 Cb 1.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 3bf0 h PRO 363 CO 1.04 0.11 -0.17 0.87 -0.23 0.00 0.00 178.00 179.62 3bf0 h LYS 364 N 0.00 0.00 -5.85 0.86 1.57 -1.91 -3.42 116.57 107.81 3bf0 h LYS 364 Ca -0.00 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.19 3bf0 h LYS 364 Cb 0.51 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.74 3bf0 h LYS 364 CO 0.01 0.17 0.53 0.08 -0.57 0.00 0.00 179.45 179.68 3bf0 s VAL 365 N -4.24 4.80 -0.09 0.50 1.01 -0.76 -0.75 120.40 120.87 3bf0 s VAL 365 Ca -0.03 1.62 0.21 0.00 0.00 0.00 0.00 61.98 63.78 3bf0 s VAL 365 Cb 0.14 -4.16 -0.27 0.00 0.00 0.00 0.00 36.38 32.09 3bf0 s VAL 365 CO 0.63 -0.12 0.51 0.29 0.00 0.00 0.00 175.10 176.41 3bf0 n LYS 366 N 6.10 0.65 -3.77 2.72 4.76 0.89 -4.91 118.16 124.60 3bf0 n LYS 366 Ca 0.07 -0.10 -0.09 0.00 -2.87 0.00 0.00 58.31 55.32 3bf0 n LYS 366 Cb 0.47 -1.58 -0.03 0.00 -1.84 0.00 0.00 35.03 32.05 3bf0 n LYS 366 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3bf0 s ALA 367 N -3.29 -1.06 -0.02 7.82 0.00 -1.25 -4.21 121.76 119.75 3bf0 s ALA 367 Ca -0.07 -0.24 0.06 0.00 0.00 0.00 0.00 51.96 51.72 3bf0 s ALA 367 Cb 0.12 0.88 -0.02 0.00 0.00 0.00 0.00 23.12 24.10 3bf0 s ALA 367 CO 0.87 -0.90 -0.22 0.42 0.00 0.00 0.00 175.76 175.94 3bf0 s ILE 368 N -3.89 1.71 -0.21 0.00 1.01 0.67 -1.59 121.20 118.89 3bf0 s ILE 368 Ca 0.10 -0.92 -0.03 0.00 0.00 0.00 0.00 60.65 59.80 3bf0 s ILE 368 Cb -0.03 -1.42 -0.01 0.00 0.01 0.00 0.00 42.46 41.02 3bf0 s ILE 368 CO 0.01 0.48 -0.07 -0.69 0.00 0.00 0.00 174.94 174.68 3bf0 s VAL 369 N -0.46 3.19 -0.46 2.92 1.01 -0.19 0.81 120.40 127.22 3bf0 s VAL 369 Ca 0.07 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.32 3bf0 s VAL 369 Cb -0.09 -2.44 0.05 0.00 0.00 0.00 0.00 36.38 33.90 3bf0 s VAL 369 CO -0.00 0.44 0.48 -0.22 0.00 0.00 0.00 175.10 175.80 3bf0 s LEU 370 N 1.40 5.13 -0.56 3.92 2.96 0.41 -1.41 118.68 130.53 3bf0 s LEU 370 Ca 0.05 -0.95 -0.23 0.00 -0.22 0.00 0.00 54.13 52.78 3bf0 s LEU 370 Cb -0.14 -2.34 0.05 0.00 0.50 0.00 0.00 46.19 44.26 3bf0 s LEU 370 CO -0.04 -0.69 0.87 -0.60 -1.32 0.00 0.00 176.35 174.56 3bf0 s ARG 371 N 2.13 3.24 -0.19 1.98 6.06 0.76 -1.19 118.95 131.73 3bf0 s ARG 371 Ca 0.10 -0.52 -0.07 0.00 -2.50 0.00 0.00 55.73 52.74 3bf0 s ARG 371 Cb -0.20 -4.10 -0.04 0.00 0.06 0.00 0.00 34.95 30.68 3bf0 s ARG 371 CO 0.11 -1.48 0.06 0.08 -2.50 0.00 0.00 175.30 171.56 3bf0 s VAL 372 N 3.64 4.63 -0.38 7.11 1.01 -0.07 -1.58 120.40 134.76 3bf0 s VAL 372 Ca 0.25 -0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.18 3bf0 s VAL 372 Cb -0.15 -3.10 0.16 0.00 0.00 0.00 0.00 36.38 33.29 3bf0 s VAL 372 CO 0.16 0.44 0.38 0.21 0.00 0.00 0.00 175.10 176.28 3bf0 s ASN 373 N 0.61 1.20 -0.15 3.32 2.47 -0.89 -0.57 114.94 120.93 3bf0 s ASN 373 Ca 0.03 -1.80 -0.13 0.00 0.42 0.00 0.00 52.86 51.38 3bf0 s ASN 373 Cb -0.13 0.45 0.04 0.00 -1.45 0.00 0.00 41.25 40.17 3bf0 s ASN 373 CO 0.01 -0.24 0.40 -0.55 -3.72 0.00 0.00 177.10 173.00 3bf0 s SER 374 N 1.22 -0.44 0.00 -4.21 0.15 0.90 -0.75 113.70 110.56 3bf0 s SER 374 Ca 0.19 0.82 0.27 0.00 0.70 0.00 0.00 55.95 57.93 3bf0 s SER 374 Cb -0.14 0.80 1.18 0.00 -1.71 0.00 0.00 66.02 66.15 3bf0 s SER 374 CO -0.04 -0.15 1.87 -0.81 1.20 0.00 0.00 173.24 175.31 3bf0 n PRO 375 N 3.22 0.07 0.00 5.44 -0.04 -1.26 -1.89 135.00 140.55 3bf0 n PRO 375 Ca -0.16 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 3bf0 n PRO 375 Cb 0.57 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 3bf0 n PRO 375 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3bf0 n GLY 376 N 1.21 0.77 0.00 0.55 0.00 -1.22 -4.43 105.19 102.07 3bf0 n GLY 376 Ca 0.08 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.50 3bf0 n GLY 376 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bf0 n GLY 377 N 0.00 0.28 3.60 -0.02 0.00 -1.26 0.15 105.19 107.93 3bf0 n GLY 377 Ca 0.00 -1.36 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 3bf0 n GLY 377 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3bf0 s SER 378 N -4.00 5.96 0.29 1.61 0.15 0.70 -4.83 113.70 113.58 3bf0 s SER 378 Ca 0.00 1.09 0.04 0.00 0.70 0.00 0.00 55.95 57.78 3bf0 s SER 378 Cb 0.00 -2.53 0.76 0.00 -1.71 0.00 0.00 66.02 62.54 3bf0 s SER 378 CO 0.00 -1.69 1.67 0.58 1.20 0.00 0.00 173.24 175.00 3bf0 h VAL 379 N 6.72 0.39 -0.33 4.45 2.07 -1.97 0.54 116.25 128.12 3bf0 h VAL 379 Ca -0.31 -0.11 -0.11 0.00 0.82 0.00 0.00 66.70 66.99 3bf0 h VAL 379 Cb 1.15 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 3bf0 h VAL 379 CO 1.06 0.06 -0.22 0.71 0.02 0.00 0.00 177.57 179.20 3bf0 h THR 380 N 0.31 1.29 0.00 2.57 1.35 -1.98 -1.78 112.91 114.68 3bf0 h THR 380 Ca 0.57 -1.36 -0.02 0.00 -0.55 0.00 0.00 66.41 65.05 3bf0 h THR 380 Cb 1.15 1.46 -0.00 0.00 -1.73 0.00 0.00 68.15 69.02 3bf0 h THR 380 CO -0.59 0.44 -0.09 0.00 -0.25 0.00 0.00 175.52 175.03 3bf0 h ALA 381 N 0.75 1.09 0.18 6.62 0.00 -1.73 -2.96 119.26 123.22 3bf0 h ALA 381 Ca 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3bf0 h ALA 381 Cb 0.78 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3bf0 h ALA 381 CO 0.06 0.11 -0.09 0.77 0.00 0.00 0.00 179.25 180.11 3bf0 h SER 382 N 0.00 -0.20 -1.00 0.00 0.02 0.87 -3.20 113.55 110.04 3bf0 h SER 382 Ca -0.00 -0.21 0.14 0.00 -0.84 0.00 0.00 61.79 60.87 3bf0 h SER 382 Cb 0.46 0.05 -0.09 0.00 0.14 0.00 0.00 62.40 62.96 3bf0 h SER 382 CO 0.01 0.11 0.62 -0.33 -1.14 0.00 0.00 176.83 176.10 3bf0 h GLU 383 N -0.53 0.90 -0.68 3.45 4.39 -1.22 0.05 114.58 120.94 3bf0 h GLU 383 Ca -0.02 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 3bf0 h GLU 383 Cb 0.40 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 3bf0 h GLU 383 CO 0.04 0.60 0.39 0.28 -1.16 0.00 0.00 179.01 179.16 3bf0 h VAL 384 N 0.93 1.20 -0.10 3.13 2.07 -1.52 0.16 116.25 122.12 3bf0 h VAL 384 Ca 0.51 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 3bf0 h VAL 384 Cb 0.58 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3bf0 h VAL 384 CO -0.29 0.22 -0.04 0.40 0.02 0.00 0.00 177.57 177.88 3bf0 h ILE 385 N 0.92 1.31 -0.90 4.57 2.04 -1.24 -2.82 117.51 121.39 3bf0 h ILE 385 Ca 0.24 -1.01 0.05 0.00 1.00 0.00 0.00 64.86 65.14 3bf0 h ILE 385 Cb 0.01 1.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.81 3bf0 h ILE 385 CO -0.04 0.29 0.57 -0.09 0.00 0.00 0.00 178.15 178.88 3bf0 h ARG 386 N -0.15 1.05 -0.19 2.37 2.43 -0.65 -2.27 114.38 116.96 3bf0 h ARG 386 Ca 0.02 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 3bf0 h ARG 386 Cb 0.47 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 3bf0 h ARG 386 CO 0.01 0.69 -0.29 0.00 -1.51 0.00 0.00 179.97 178.87 3bf0 h ALA 387 N 1.39 1.15 0.00 2.80 0.00 -0.63 -0.51 119.26 123.46 3bf0 h ALA 387 Ca 0.37 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 3bf0 h ALA 387 Cb 0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3bf0 h ALA 387 CO -0.14 0.54 -0.45 0.93 0.00 0.00 0.00 179.25 180.13 3bf0 h GLU 388 N 0.32 0.00 -0.03 0.00 4.39 -1.20 -1.85 114.58 116.22 3bf0 h GLU 388 Ca 0.04 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.65 3bf0 h GLU 388 Cb 0.69 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.34 3bf0 h GLU 388 CO 0.05 0.45 -0.36 1.25 -1.16 0.00 0.00 179.01 179.24 3bf0 h LEU 389 N 0.00 0.37 -0.97 1.33 5.85 -0.85 -2.13 115.31 118.91 3bf0 h LEU 389 Ca -0.00 -0.72 -0.01 0.00 0.84 0.00 0.00 57.88 57.99 3bf0 h LEU 389 Cb 1.02 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.90 3bf0 h LEU 389 CO 0.06 1.03 0.55 0.00 -0.34 0.00 0.00 178.44 179.74 3bf0 h ALA 390 N 0.34 1.23 -0.66 1.25 0.00 -1.09 -1.85 119.26 118.48 3bf0 h ALA 390 Ca -0.04 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.82 3bf0 h ALA 390 Cb 1.06 -0.37 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 3bf0 h ALA 390 CO 0.07 0.66 0.38 0.00 0.00 0.00 0.00 179.25 180.36 3bf0 h ALA 391 N 1.33 0.87 -0.53 0.00 0.00 -1.25 0.21 119.26 119.88 3bf0 h ALA 391 Ca 0.33 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 3bf0 h ALA 391 Cb -0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3bf0 h ALA 391 CO -0.06 0.08 0.31 0.00 0.00 0.00 0.00 179.25 179.57 3bf0 h ALA 392 N 1.33 0.68 -0.43 0.00 0.00 -0.84 -0.71 119.26 119.28 3bf0 h ALA 392 Ca 0.29 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 3bf0 h ALA 392 Cb 0.14 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3bf0 h ALA 392 CO -0.16 0.18 -0.30 -0.09 0.00 0.00 0.00 179.25 178.88 3bf0 h ARG 393 N 0.71 0.95 -0.52 0.00 2.43 -0.77 -1.59 114.38 115.59 3bf0 h ARG 393 Ca 0.19 -0.45 -0.04 0.00 -0.81 0.00 0.00 59.98 58.86 3bf0 h ARG 393 Cb 0.02 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3bf0 h ARG 393 CO -0.03 1.12 0.14 0.00 -1.51 0.00 0.00 179.97 179.69 3bf0 h ALA 394 N 0.84 1.27 0.00 2.80 0.00 -0.30 -0.25 119.26 123.63 3bf0 h ALA 394 Ca 0.09 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3bf0 h ALA 394 Cb 0.89 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3bf0 h ALA 394 CO 0.08 0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.84 3bf0 n ALA 395 N -2.46 2.29 -0.29 0.00 0.00 -0.30 -4.90 120.51 114.84 3bf0 n ALA 395 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3bf0 n ALA 395 Cb 0.21 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.27 3bf0 n ALA 395 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bf0 n GLY 396 N 0.65 0.84 3.58 0.00 0.00 -0.10 -5.07 105.19 105.09 3bf0 n GLY 396 Ca 0.14 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3bf0 n GLY 396 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bf0 s LYS 397 N -0.67 3.73 0.37 1.61 1.02 -0.62 -5.01 119.74 120.16 3bf0 s LYS 397 Ca 0.00 0.09 -0.28 0.00 0.02 0.00 0.00 55.97 55.79 3bf0 s LYS 397 Cb 0.00 -3.79 -0.11 0.00 -0.52 0.00 0.00 37.83 33.41 3bf0 s LYS 397 CO 0.00 -0.68 1.46 -2.14 -0.92 0.00 0.00 175.35 173.07 3bf0 s PRO 398 N 2.64 4.14 -0.21 -1.68 0.02 -1.26 -3.54 135.00 135.11 3bf0 s PRO 398 Ca 0.24 2.52 -0.01 0.00 0.02 0.00 0.00 61.00 63.77 3bf0 s PRO 398 Cb -0.15 -2.98 0.02 0.00 0.02 0.00 0.00 34.50 31.41 3bf0 s PRO 398 CO 0.14 -0.49 -0.12 0.08 -0.33 0.00 0.00 177.00 176.28 3bf0 s VAL 399 N -1.10 2.58 -0.18 3.83 1.01 -1.26 -0.24 120.40 125.05 3bf0 s VAL 399 Ca 0.52 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 3bf0 s VAL 399 Cb -0.46 -2.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 3bf0 s VAL 399 CO 0.61 0.40 -0.10 -0.69 0.00 0.00 0.00 175.10 175.33 3bf0 s VAL 400 N 1.33 3.11 0.02 2.92 1.01 0.24 -0.98 120.40 128.06 3bf0 s VAL 400 Ca 0.03 -0.61 -0.19 0.00 0.00 0.00 0.00 61.98 61.21 3bf0 s VAL 400 Cb -0.15 -2.36 -0.06 0.00 0.00 0.00 0.00 36.38 33.81 3bf0 s VAL 400 CO -0.08 0.48 0.56 -0.69 0.00 0.00 0.00 175.10 175.37 3bf0 s VAL 401 N 0.96 4.86 -0.29 2.92 1.01 -0.91 -0.45 120.40 128.50 3bf0 s VAL 401 Ca -0.01 1.18 0.02 0.00 0.00 0.00 0.00 61.98 63.17 3bf0 s VAL 401 Cb -0.15 -3.89 0.08 0.00 0.00 0.00 0.00 36.38 32.42 3bf0 s VAL 401 CO -0.01 0.49 -0.01 -0.55 0.00 0.00 0.00 175.10 175.03 3bf0 s SER 402 N -0.63 4.36 0.05 3.32 0.15 -0.33 -1.93 113.70 118.70 3bf0 s SER 402 Ca 0.29 -1.67 -0.26 0.00 0.70 0.00 0.00 55.95 55.01 3bf0 s SER 402 Cb -0.18 -1.39 -0.05 0.00 -1.71 0.00 0.00 66.02 62.68 3bf0 s SER 402 CO 0.17 -0.31 0.82 -0.04 1.20 0.00 0.00 173.24 175.09 3bf0 s MET 403 N 1.17 4.54 -0.42 5.44 -1.94 -0.06 -0.89 119.30 127.15 3bf0 s MET 403 Ca 0.02 1.16 0.10 0.00 -1.71 0.00 0.00 55.69 55.26 3bf0 s MET 403 Cb -0.19 -3.37 0.32 0.00 2.01 0.00 0.00 34.83 33.59 3bf0 s MET 403 CO -0.09 0.24 0.70 0.41 -0.01 0.00 0.00 175.02 176.27 3bf0 n GLY 404 N 2.41 3.74 0.00 -0.03 0.00 0.27 -4.02 105.19 107.55 3bf0 n GLY 404 Ca -0.01 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.15 3bf0 n GLY 404 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bf0 n GLY 405 N 0.55 2.28 2.99 -0.02 0.00 -1.26 -4.79 105.19 104.94 3bf0 n GLY 405 Ca 0.25 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.52 3bf0 n GLY 405 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3bf0 s MET 406 N 0.00 0.47 -0.47 1.61 1.00 -1.26 -1.56 119.30 119.09 3bf0 s MET 406 Ca 0.00 -0.36 0.06 0.00 0.00 0.00 0.00 55.69 55.40 3bf0 s MET 406 Cb 0.00 -0.40 0.22 0.00 0.00 0.00 0.00 34.83 34.65 3bf0 s MET 406 CO 0.00 0.10 0.72 0.00 0.00 0.00 0.00 175.02 175.84 3bf0 n ALA 407 N 2.52 -0.31 -2.52 3.03 0.00 -0.54 -0.07 120.51 122.62 3bf0 n ALA 407 Ca -0.16 -1.89 -0.24 0.00 0.00 0.00 0.00 53.44 51.16 3bf0 n ALA 407 Cb 0.57 -1.21 -0.09 0.00 0.00 0.00 0.00 19.45 18.72 3bf0 n ALA 407 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3bf0 s ALA 408 N 0.30 2.88 0.00 0.00 0.00 -0.79 -3.38 121.76 120.77 3bf0 s ALA 408 Ca 0.32 -1.86 0.00 0.00 0.00 0.00 0.00 51.96 50.43 3bf0 s ALA 408 Cb 0.14 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.91 3bf0 s ALA 408 CO -0.17 0.25 0.00 0.45 0.00 0.00 0.00 175.76 176.29 3bf0 n SER 409 N -0.71 0.00 0.09 0.00 2.88 0.77 0.90 113.62 117.55 3bf0 n SER 409 Ca -0.05 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.61 3bf0 n SER 409 Cb 0.60 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 64.52 3bf0 n SER 409 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3bf0 n GLY 410 N 0.00 -1.48 0.17 0.46 0.00 -1.26 -0.95 105.19 102.13 3bf0 n GLY 410 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 46.02 45.97 3bf0 n GLY 410 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3bf0 h GLY 411 N 3.73 0.22 1.61 -0.02 0.00 0.30 -2.80 103.07 106.11 3bf0 h GLY 411 Ca 0.00 -0.27 -0.27 0.00 0.00 0.00 0.00 47.33 46.79 3bf0 h GLY 411 CO 0.00 0.24 -1.26 -1.82 0.00 0.00 0.00 176.54 173.70 3bf0 h TYR 412 N 0.15 0.44 -0.13 5.60 3.20 -1.22 -3.30 116.97 121.71 3bf0 h TYR 412 Ca -0.00 -0.32 0.04 0.00 3.14 0.00 0.00 58.73 61.59 3bf0 h TYR 412 Cb 1.07 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 39.28 3bf0 h TYR 412 CO 0.02 1.26 -0.18 2.35 -1.64 0.00 0.00 178.16 179.98 3bf0 h TRP 413 N 0.07 -0.45 0.00 -3.82 2.91 -1.02 -0.83 115.95 112.80 3bf0 h TRP 413 Ca -0.14 0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.91 3bf0 h TRP 413 Cb 1.96 0.22 0.00 0.00 -0.51 0.00 0.00 29.16 30.83 3bf0 h TRP 413 CO 0.06 -0.25 0.00 0.44 -1.03 0.00 0.00 178.44 177.66 3bf0 n ILE 414 N -5.32 1.40 0.01 2.65 -5.35 -1.06 -3.03 119.36 108.66 3bf0 n ILE 414 Ca -0.03 0.35 0.04 0.00 -0.27 0.00 0.00 62.75 62.84 3bf0 n ILE 414 Cb 0.23 -1.21 -0.10 0.00 -1.74 0.00 0.00 39.64 36.82 3bf0 n ILE 414 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3bf0 n SER 415 N -1.52 0.47 -0.32 7.28 7.64 -0.37 -4.51 113.62 122.30 3bf0 n SER 415 Ca 0.02 0.20 0.14 0.00 1.01 0.00 0.00 58.87 60.24 3bf0 n SER 415 Cb 0.10 0.88 0.29 0.00 -1.01 0.00 0.00 64.21 64.47 3bf0 n SER 415 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 3bf0 h THR 416 N 0.00 0.12 0.00 0.44 2.02 -1.33 -2.63 112.91 111.53 3bf0 h THR 416 Ca -0.15 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.01 3bf0 h THR 416 Cb 1.41 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 3bf0 h THR 416 CO 0.02 0.01 0.00 -0.81 0.37 0.00 0.00 175.52 175.11 3bf0 n PRO 417 N -5.40 0.88 -2.28 6.66 -0.04 -1.26 -4.83 135.00 128.73 3bf0 n PRO 417 Ca 0.22 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.32 3bf0 n PRO 417 Cb 0.74 -1.29 -0.01 0.00 -0.04 0.00 0.00 33.50 32.90 3bf0 n PRO 417 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3bf0 s ALA 418 N -2.00 2.85 0.26 0.55 0.00 -0.99 -4.83 121.76 117.60 3bf0 s ALA 418 Ca 0.24 0.86 -0.05 0.00 0.00 0.00 0.00 51.96 53.02 3bf0 s ALA 418 Cb 0.11 -3.36 0.31 0.00 0.00 0.00 0.00 23.12 20.18 3bf0 s ALA 418 CO 0.19 -0.68 1.93 -0.91 0.00 0.00 0.00 175.76 176.29 3bf0 h ASN 419 N 1.67 1.11 -3.80 0.00 2.35 -1.41 -3.45 115.58 112.06 3bf0 h ASN 419 Ca -0.50 -0.02 -0.18 0.00 -0.55 0.00 0.00 56.30 55.05 3bf0 h ASN 419 Cb 1.25 -0.27 -0.26 0.00 0.05 0.00 0.00 38.32 39.09 3bf0 h ASN 419 CO 0.59 0.79 -0.51 -0.47 -1.65 0.00 0.00 177.43 176.18 3bf0 s TYR 420 N -6.08 -0.20 -0.17 1.19 5.04 -1.23 -5.09 117.35 110.81 3bf0 s TYR 420 Ca -0.13 0.49 0.00 0.00 -2.44 0.00 0.00 57.07 54.99 3bf0 s TYR 420 Cb 0.18 0.07 0.04 0.00 0.35 0.00 0.00 41.96 42.60 3bf0 s TYR 420 CO 0.81 -0.10 -0.08 0.42 -1.34 0.00 0.00 175.55 175.27 3bf0 s ILE 421 N 0.10 1.32 -0.18 3.14 1.01 -1.26 -2.14 121.20 123.19 3bf0 s ILE 421 Ca -0.00 -0.71 -0.04 0.00 0.00 0.00 0.00 60.65 59.90 3bf0 s ILE 421 Cb -0.01 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 41.02 3bf0 s ILE 421 CO 0.00 0.21 -0.03 0.54 0.00 0.00 0.00 174.94 175.66 3bf0 s VAL 422 N 1.55 3.80 0.04 2.92 0.11 -0.81 -0.29 120.40 127.73 3bf0 s VAL 422 Ca 0.01 -0.38 0.08 0.00 -2.93 0.00 0.00 61.98 58.77 3bf0 s VAL 422 Cb -0.15 -2.69 -0.03 0.00 -1.53 0.00 0.00 36.38 31.98 3bf0 s VAL 422 CO -0.08 0.46 -0.23 0.00 -3.33 0.00 0.00 175.10 171.92 3bf0 s ALA 423 N 0.73 2.40 0.55 1.54 0.00 -0.89 -0.88 121.76 125.21 3bf0 s ALA 423 Ca -0.01 -1.24 -0.21 0.00 0.00 0.00 0.00 51.96 50.50 3bf0 s ALA 423 Cb -0.14 -0.58 -0.06 0.00 0.00 0.00 0.00 23.12 22.34 3bf0 s ALA 423 CO 0.02 0.55 1.12 -1.71 0.00 0.00 0.00 175.76 175.74 3bf0 n ASN 424 N 1.68 1.57 0.29 0.00 5.15 -0.92 -2.20 115.26 120.83 3bf0 n ASN 424 Ca -0.17 0.91 0.15 0.00 -0.60 0.00 0.00 54.58 54.87 3bf0 n ASN 424 Cb 0.52 -1.45 0.87 0.00 -0.53 0.00 0.00 39.78 39.19 3bf0 n ASN 424 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 3bf0 h PRO 425 N 1.01 0.00 -0.01 1.20 0.11 -1.90 -2.44 132.00 129.96 3bf0 h PRO 425 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3bf0 h PRO 425 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 3bf0 h PRO 425 CO 0.54 0.03 -0.06 0.43 -0.21 0.00 0.00 178.00 178.73 3bf0 n SER 426 N -3.77 1.41 -4.75 -2.05 7.64 -1.26 -3.07 113.62 107.76 3bf0 n SER 426 Ca -0.03 -1.36 -0.39 0.00 1.01 0.00 0.00 58.87 58.11 3bf0 n SER 426 Cb 0.12 0.03 0.03 0.00 -1.01 0.00 0.00 64.21 63.39 3bf0 n SER 426 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3bf0 s THR 427 N -2.12 2.12 -0.22 0.44 2.01 -0.92 -4.79 115.64 112.15 3bf0 s THR 427 Ca 0.35 0.09 -0.04 0.00 0.31 0.00 0.00 61.69 62.40 3bf0 s THR 427 Cb 0.21 -3.05 -0.01 0.00 0.01 0.00 0.00 72.50 69.66 3bf0 s THR 427 CO 0.38 0.00 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.51 3bf0 s LEU 428 N -3.29 2.92 0.00 4.42 1.02 -0.60 0.17 118.68 123.32 3bf0 s LEU 428 Ca 0.68 -0.42 0.00 0.00 0.02 0.00 0.00 54.13 54.42 3bf0 s LEU 428 Cb -0.41 -1.74 0.00 0.00 0.02 0.00 0.00 46.19 44.06 3bf0 s LEU 428 CO 0.49 -0.03 0.00 1.07 0.02 0.00 0.00 176.35 177.91 3bf0 n THR 429 N 4.79 0.00 0.00 5.49 5.66 0.15 -1.47 114.28 128.91 3bf0 n THR 429 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 3bf0 n THR 429 Cb 0.51 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.29 3bf0 n THR 429 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3bf0 n GLY 430 N 0.00 2.91 3.64 1.09 0.00 -1.25 -1.88 105.19 109.70 3bf0 n GLY 430 Ca 0.00 -0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 3bf0 n GLY 430 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3bf0 n SER 431 N 6.46 -1.51 -4.51 1.61 2.88 -0.47 -0.17 113.62 117.90 3bf0 n SER 431 Ca 0.00 -0.78 -0.42 0.00 -1.33 0.00 0.00 58.87 56.33 3bf0 n SER 431 Cb 0.00 -4.27 -0.03 0.00 -0.75 0.00 0.00 64.21 59.16 3bf0 n SER 431 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3bf0 s ILE 432 N -3.60 4.06 0.00 2.46 1.01 -1.26 -3.14 121.20 120.72 3bf0 s ILE 432 Ca 0.02 0.16 -0.28 0.00 0.00 0.00 0.00 60.65 60.55 3bf0 s ILE 432 Cb -0.00 -4.77 0.10 0.00 0.01 0.00 0.00 42.46 37.79 3bf0 s ILE 432 CO 0.80 -1.57 1.26 -0.83 0.00 0.00 0.00 174.94 174.60 3bf0 s GLY 433 N 3.53 -0.13 -0.11 6.18 0.00 -1.26 -1.23 107.32 114.30 3bf0 s GLY 433 Ca 0.30 0.05 -0.14 0.00 0.00 0.00 0.00 44.72 44.94 3bf0 s GLY 433 CO 0.15 4.88 0.36 -1.50 0.00 0.00 0.00 173.10 177.00 3bf0 s ILE 434 N -2.07 0.01 0.01 0.90 2.07 -1.16 -4.97 121.20 115.98 3bf0 s ILE 434 Ca 0.27 -0.10 -0.19 0.00 -1.41 0.00 0.00 60.65 59.23 3bf0 s ILE 434 Cb -0.00 -0.55 0.04 0.00 0.13 0.00 0.00 42.46 42.07 3bf0 s ILE 434 CO -0.00 -0.06 0.41 0.72 -1.91 0.00 0.00 174.94 174.10 3bf0 s PHE 435 N -0.16 -0.28 0.01 3.50 -0.71 -1.26 -2.02 117.98 117.06 3bf0 s PHE 435 Ca -0.03 0.37 0.01 0.00 -1.04 0.00 0.00 56.93 56.24 3bf0 s PHE 435 Cb -0.03 0.19 -0.01 0.00 -1.21 0.00 0.00 43.02 41.96 3bf0 s PHE 435 CO 0.01 -0.50 -0.04 0.20 -1.34 0.00 0.00 175.22 173.56 3bf0 s GLY 436 N -1.60 0.22 -0.10 1.99 0.00 0.67 -5.00 107.32 103.50 3bf0 s GLY 436 Ca -0.10 -0.29 0.03 0.00 0.00 0.00 0.00 44.72 44.36 3bf0 s GLY 436 CO 0.02 -0.29 -0.19 0.14 0.00 0.00 0.00 173.10 172.78 3bf0 s VAL 437 N -0.46 1.70 -0.16 1.40 1.01 -1.26 -1.20 120.40 121.43 3bf0 s VAL 437 Ca -0.03 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.16 3bf0 s VAL 437 Cb -0.04 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.85 3bf0 s VAL 437 CO -0.00 0.48 -0.18 -0.63 0.00 0.00 0.00 175.10 174.77 3bf0 s ILE 438 N 0.58 2.35 -0.14 2.22 -1.09 0.98 -4.97 121.20 121.13 3bf0 s ILE 438 Ca -0.15 -0.87 0.00 0.00 -2.23 0.00 0.00 60.65 57.41 3bf0 s ILE 438 Cb -0.17 -1.98 -0.01 0.00 -1.58 0.00 0.00 42.46 38.73 3bf0 s ILE 438 CO 0.05 0.53 -0.15 0.42 -1.23 0.00 0.00 174.94 174.55 3bf0 s THR 439 N 0.97 2.73 0.29 2.92 -4.23 -1.26 0.16 115.64 117.23 3bf0 s THR 439 Ca -0.03 -0.76 0.11 0.00 -1.18 0.00 0.00 61.69 59.84 3bf0 s THR 439 Cb -0.15 -2.14 -0.05 0.00 1.34 0.00 0.00 72.50 71.50 3bf0 s THR 439 CO -0.04 0.52 -0.13 0.42 -0.54 0.00 0.00 174.62 174.85 3bf0 s THR 440 N 0.65 2.68 -0.12 3.99 -4.23 -0.55 -4.84 115.64 113.22 3bf0 s THR 440 Ca -0.08 -2.25 0.14 0.00 -1.18 0.00 0.00 61.69 58.33 3bf0 s THR 440 Cb -0.16 -2.49 0.31 0.00 1.34 0.00 0.00 72.50 71.50 3bf0 s THR 440 CO 0.02 -0.36 1.16 1.33 -0.54 0.00 0.00 174.62 176.23 3bf0 n VAL 441 N -0.72 1.48 -0.10 2.29 0.24 -0.25 -1.11 118.33 120.17 3bf0 n VAL 441 Ca -0.05 -2.12 -0.09 0.00 -2.04 0.00 0.00 64.34 60.04 3bf0 n VAL 441 Cb 0.60 0.03 -0.02 0.00 -1.47 0.00 0.00 33.84 32.99 3bf0 n VAL 441 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 3bf0 h GLU 442 N 0.48 0.44 0.00 7.34 9.09 -1.77 -1.09 114.58 129.07 3bf0 h GLU 442 Ca -0.03 -0.04 -0.06 0.00 0.05 0.00 0.00 59.36 59.28 3bf0 h GLU 442 Cb 1.18 -0.09 -0.01 0.00 -1.65 0.00 0.00 28.75 28.18 3bf0 h GLU 442 CO 0.01 0.35 -0.29 -0.91 0.05 0.00 0.00 179.01 178.23 3bf0 h ASN 443 N 0.41 0.00 -0.09 3.06 2.35 -1.89 0.05 115.58 119.46 3bf0 h ASN 443 Ca 0.12 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.79 3bf0 h ASN 443 Cb 0.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.40 3bf0 h ASN 443 CO -0.02 0.29 -0.24 0.28 -1.65 0.00 0.00 177.43 176.09 3bf0 h SER 444 N 0.00 0.37 -0.55 5.81 0.02 -1.47 -2.59 113.55 115.14 3bf0 h SER 444 Ca -0.00 -0.59 -0.03 0.00 -0.84 0.00 0.00 61.79 60.33 3bf0 h SER 444 Cb 0.61 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 3bf0 h SER 444 CO 0.04 0.89 0.24 -0.07 -1.14 0.00 0.00 176.83 176.79 3bf0 h LEU 445 N -0.13 0.75 -0.99 5.07 3.38 -1.12 -3.17 115.31 119.10 3bf0 h LEU 445 Ca -0.00 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 57.87 3bf0 h LEU 445 Cb 0.84 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 3bf0 h LEU 445 CO 0.05 0.70 0.64 -0.78 0.09 0.00 0.00 178.44 179.14 3bf0 h ASP 446 N 0.75 1.03 0.38 -0.43 3.58 -0.86 -1.05 116.42 119.83 3bf0 h ASP 446 Ca 0.19 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.56 3bf0 h ASP 446 Cb 0.17 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 3bf0 h ASP 446 CO -0.02 0.68 -0.39 0.77 -2.88 0.00 0.00 179.24 177.40 3bf0 h SER 447 N 1.18 0.01 -0.31 2.28 4.64 -1.45 -1.06 113.55 118.85 3bf0 h SER 447 Ca 0.41 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 3bf0 h SER 447 Cb 0.11 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3bf0 h SER 447 CO -0.16 0.40 0.00 2.30 -0.87 0.00 0.00 176.83 178.50 3bf0 n ILE 448 N -4.08 0.97 -2.51 0.95 -5.35 -0.51 -4.94 119.36 103.89 3bf0 n ILE 448 Ca -0.02 -0.59 -0.12 0.00 -0.27 0.00 0.00 62.75 61.75 3bf0 n ILE 448 Cb 0.42 -0.14 0.01 0.00 -1.74 0.00 0.00 39.64 38.19 3bf0 n ILE 448 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3bf0 n GLY 449 N 0.61 -0.03 3.26 3.28 0.00 -0.40 -5.03 105.19 106.88 3bf0 n GLY 449 Ca 0.13 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 3bf0 n GLY 449 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bf0 s VAL 450 N -2.77 2.53 0.34 1.61 1.01 -0.53 -5.00 120.40 117.59 3bf0 s VAL 450 Ca 0.10 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.30 3bf0 s VAL 450 Cb -0.05 -2.04 -0.07 0.00 0.00 0.00 0.00 36.38 34.23 3bf0 s VAL 450 CO 0.13 0.53 0.05 -1.00 0.00 0.00 0.00 175.10 174.81 3bf0 s HIS 451 N 0.67 2.05 0.22 5.22 3.76 -1.26 -3.00 115.29 122.94 3bf0 s HIS 451 Ca -0.09 -0.92 0.06 0.00 -0.15 0.00 0.00 55.06 53.96 3bf0 s HIS 451 Cb -0.16 -1.36 -0.05 0.00 1.11 0.00 0.00 32.58 32.12 3bf0 s HIS 451 CO 0.02 0.07 -0.07 0.95 -0.85 0.00 0.00 174.74 174.86 3bf0 s THR 452 N -3.21 1.40 0.01 1.30 -4.23 -1.26 -5.11 115.64 104.54 3bf0 s THR 452 Ca 0.36 -2.11 -0.29 0.00 -1.18 0.00 0.00 61.69 58.48 3bf0 s THR 452 Cb 0.09 -2.19 0.10 0.00 1.34 0.00 0.00 72.50 71.84 3bf0 s THR 452 CO 0.16 -0.48 0.96 -0.62 -0.54 0.00 0.00 174.62 174.11 3bf0 s ASP 453 N -3.31 -0.28 0.00 3.99 -1.08 -1.26 -5.14 116.67 109.58 3bf0 s ASP 453 Ca 0.25 -0.10 0.00 0.00 -0.52 0.00 0.00 52.55 52.18 3bf0 s ASP 453 Cb 0.03 0.37 0.00 0.00 -1.46 0.00 0.00 42.92 41.86 3bf0 s ASP 453 CO 0.07 -0.62 0.00 0.61 0.52 0.00 0.00 175.17 175.75 3bf0 n GLY 454 N -0.29 -1.57 3.41 2.66 0.00 -1.26 -5.15 105.19 102.98 3bf0 n GLY 454 Ca -0.07 -1.06 -0.30 0.00 0.00 0.00 0.00 46.02 44.60 3bf0 n GLY 454 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3bf0 s VAL 455 N -2.39 2.43 0.08 1.61 -7.23 -1.26 -5.15 120.40 108.49 3bf0 s VAL 455 Ca 0.00 -1.53 0.03 0.00 -1.81 0.00 0.00 61.98 58.67 3bf0 s VAL 455 Cb 0.00 -2.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.86 3bf0 s VAL 455 CO 0.00 0.20 -0.08 -0.94 -0.31 0.00 0.00 175.10 173.96 3bf0 s SER 456 N -1.78 1.20 0.13 4.85 1.04 -1.26 -5.04 113.70 112.84 3bf0 s SER 456 Ca 0.14 -0.79 0.22 0.00 0.48 0.00 0.00 55.95 56.00 3bf0 s SER 456 Cb -0.10 0.04 -0.10 0.00 0.10 0.00 0.00 66.02 65.96 3bf0 s SER 456 CO 0.06 -0.30 0.87 0.35 0.98 0.00 0.00 173.24 175.19 3bf0 n THR 457 N 0.64 0.54 -3.83 2.02 -2.24 -1.26 -4.88 114.28 105.27 3bf0 n THR 457 Ca -0.17 -0.56 -0.12 0.00 -2.27 0.00 0.00 64.05 60.93 3bf0 n THR 457 Cb 0.58 -0.30 -0.12 0.00 -2.10 0.00 0.00 70.33 68.39 3bf0 n THR 457 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3bf0 s SER 458 N -5.20 -0.11 0.62 3.42 0.15 -1.26 -5.01 113.70 106.31 3bf0 s SER 458 Ca -0.03 0.16 0.33 0.00 0.70 0.00 0.00 55.95 57.11 3bf0 s SER 458 Cb 0.10 0.30 1.84 0.00 -1.71 0.00 0.00 66.02 66.55 3bf0 s SER 458 CO 0.82 -0.16 2.13 1.55 1.20 0.00 0.00 173.24 178.77 3bf0 h PRO 459 N 5.34 0.00 0.00 5.44 0.13 -1.97 0.23 132.00 141.17 3bf0 h PRO 459 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3bf0 h PRO 459 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3bf0 h PRO 459 CO 0.40 0.00 0.00 -0.07 -0.23 0.00 0.00 178.00 178.10 3bf0 h LEU 460 N 0.00 0.00 0.00 1.56 4.07 -1.95 -2.02 115.31 116.98 3bf0 h LEU 460 Ca 0.05 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.96 3bf0 h LEU 460 Cb 0.41 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.15 3bf0 h LEU 460 CO -0.00 0.00 -0.82 0.00 -1.08 0.00 0.00 178.44 176.53 3bf0 h ALA 461 N 2.01 0.65 -0.45 1.53 0.00 -0.95 -3.41 119.26 118.64 3bf0 h ALA 461 Ca 0.00 -0.23 -0.72 0.00 0.00 0.00 0.00 54.91 53.96 3bf0 h ALA 461 Cb 0.11 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 3bf0 h ALA 461 CO 0.00 0.26 2.84 -3.47 0.00 0.00 0.00 179.25 178.88 3bf0 n ASP 462 N -2.87 7.52 -3.84 0.00 2.03 -0.76 -4.86 116.55 113.77 3bf0 n ASP 462 Ca -0.01 -2.95 -0.30 0.00 0.52 0.00 0.00 54.79 52.05 3bf0 n ASP 462 Cb 0.63 -1.46 -0.15 0.00 -0.72 0.00 0.00 41.12 39.42 3bf0 n ASP 462 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3bf0 s VAL 463 N 0.36 1.34 0.16 5.18 1.01 -1.26 -4.53 120.40 122.66 3bf0 s VAL 463 Ca 0.56 -1.63 -0.21 0.00 0.00 0.00 0.00 61.98 60.71 3bf0 s VAL 463 Cb 0.17 -1.96 0.06 0.00 0.00 0.00 0.00 36.38 34.65 3bf0 s VAL 463 CO -0.07 -0.57 0.55 -0.55 0.00 0.00 0.00 175.10 174.46 3bf0 s SER 464 N 1.39 -0.46 0.40 3.32 0.15 -1.26 -5.06 113.70 112.18 3bf0 s SER 464 Ca 0.08 -0.13 0.11 0.00 0.70 0.00 0.00 55.95 56.71 3bf0 s SER 464 Cb -0.18 0.57 0.82 0.00 -1.71 0.00 0.00 66.02 65.52 3bf0 s SER 464 CO -0.18 -0.96 1.91 -0.29 1.20 0.00 0.00 173.24 174.93 3bf0 h ILE 465 N 2.10 1.18 -0.00 6.45 2.10 -1.98 -2.66 117.51 124.70 3bf0 h ILE 465 Ca -0.33 -0.85 0.00 0.00 1.08 0.00 0.00 64.86 64.76 3bf0 h ILE 465 Cb 1.29 1.34 0.00 0.00 -1.09 0.00 0.00 36.82 38.36 3bf0 h ILE 465 CO 0.40 0.25 -0.11 0.35 -1.08 0.00 0.00 178.15 177.96 3bf0 n THR 466 N -4.25 0.00 -4.33 2.19 -2.24 -1.26 -1.09 114.28 103.30 3bf0 n THR 466 Ca -0.01 -0.04 -0.28 0.00 -2.27 0.00 0.00 64.05 61.45 3bf0 n THR 466 Cb 0.29 -0.18 -0.11 0.00 -2.10 0.00 0.00 70.33 68.23 3bf0 n THR 466 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3bf0 s ARG 467 N -2.57 1.78 0.49 -0.78 1.81 -1.01 -4.04 118.95 114.64 3bf0 s ARG 467 Ca 0.26 -1.29 -0.23 0.00 -1.72 0.00 0.00 55.73 52.75 3bf0 s ARG 467 Cb 0.20 -2.05 -0.08 0.00 -0.45 0.00 0.00 34.95 32.57 3bf0 s ARG 467 CO 0.49 0.45 1.14 0.00 -0.68 0.00 0.00 175.30 176.70 3bf0 n ALA 468 N 0.47 0.79 -2.53 2.13 0.00 -1.26 -4.65 120.51 115.46 3bf0 n ALA 468 Ca -0.14 0.16 -0.43 0.00 0.00 0.00 0.00 53.44 53.03 3bf0 n ALA 468 Cb 0.54 -2.20 -0.02 0.00 0.00 0.00 0.00 19.45 17.77 3bf0 n ALA 468 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3bf0 s LEU 469 N -1.84 4.01 0.28 0.00 2.96 -1.26 -4.86 118.68 117.96 3bf0 s LEU 469 Ca 0.67 1.31 -0.30 0.00 -0.22 0.00 0.00 54.13 55.60 3bf0 s LEU 469 Cb -0.48 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.57 3bf0 s LEU 469 CO 0.53 -0.87 1.46 -2.84 -1.32 0.00 0.00 176.35 173.31 3bf0 s PRO 470 N 3.68 4.23 0.50 0.98 0.02 -1.26 -4.84 135.00 138.31 3bf0 s PRO 470 Ca 0.50 2.38 0.27 0.00 0.02 0.00 0.00 61.00 64.18 3bf0 s PRO 470 Cb -0.16 -3.07 1.36 0.00 0.02 0.00 0.00 34.50 32.65 3bf0 s PRO 470 CO 0.16 -0.45 1.87 -1.00 -0.33 0.00 0.00 177.00 177.24 3bf0 h PRO 471 N 4.58 0.13 -0.23 5.54 0.13 -1.95 0.22 132.00 140.42 3bf0 h PRO 471 Ca -0.47 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 3bf0 h PRO 471 Cb 1.22 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 3bf0 h PRO 471 CO 0.75 0.08 0.11 0.93 -0.23 0.00 0.00 178.00 179.65 3bf0 h GLU 472 N 0.13 0.33 -0.96 0.86 3.07 -1.92 -1.80 114.58 114.30 3bf0 h GLU 472 Ca 0.46 -0.05 0.05 0.00 -0.50 0.00 0.00 59.36 59.32 3bf0 h GLU 472 Cb 1.60 -0.06 -0.06 0.00 -0.84 0.00 0.00 28.75 29.39 3bf0 h GLU 472 CO -0.07 0.35 0.62 0.00 -1.40 0.00 0.00 179.01 178.51 3bf0 h ALA 473 N 0.97 1.43 -0.41 3.43 0.00 -0.90 -2.72 119.26 121.06 3bf0 h ALA 473 Ca 0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3bf0 h ALA 473 Cb 0.12 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3bf0 h ALA 473 CO -0.01 0.45 0.16 1.96 0.00 0.00 0.00 179.25 181.81 3bf0 h GLN 474 N 1.15 0.61 -0.42 0.00 4.20 -0.91 -2.00 115.11 117.74 3bf0 h GLN 474 Ca 0.40 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.98 3bf0 h GLN 474 Cb 0.12 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 3bf0 h GLN 474 CO -0.14 0.58 0.17 -0.07 -0.67 0.00 0.00 178.83 178.70 3bf0 h LEU 475 N 0.52 0.53 -0.01 1.46 3.38 -1.07 0.21 115.31 120.33 3bf0 h LEU 475 Ca 0.14 -0.05 -0.27 0.00 0.09 0.00 0.00 57.88 57.79 3bf0 h LEU 475 Cb 0.20 -0.14 0.02 0.00 0.09 0.00 0.00 40.66 40.83 3bf0 h LEU 475 CO -0.01 0.48 -1.07 0.24 0.09 0.00 0.00 178.44 178.17 3bf0 h MET 476 N 0.59 0.62 -0.29 1.13 2.86 -1.34 -2.04 114.93 116.46 3bf0 h MET 476 Ca 0.15 -0.71 -0.12 0.00 -2.06 0.00 0.00 59.70 56.96 3bf0 h MET 476 Cb 0.12 0.21 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 3bf0 h MET 476 CO -0.02 1.30 -0.28 0.52 1.06 0.00 0.00 176.91 179.50 3bf0 h MET 477 N 0.33 0.71 -0.59 1.72 2.86 -1.08 -0.30 114.93 118.58 3bf0 h MET 477 Ca -0.13 -0.37 0.09 0.00 -2.06 0.00 0.00 59.70 57.23 3bf0 h MET 477 Cb 1.73 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 33.33 3bf0 h MET 477 CO 0.20 0.98 0.21 0.37 1.06 0.00 0.00 176.91 179.74 3bf0 h GLN 478 N 0.45 0.38 -0.65 1.72 5.75 -1.00 -2.12 115.11 119.64 3bf0 h GLN 478 Ca 0.05 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 3bf0 h GLN 478 Cb 0.84 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.28 3bf0 h GLN 478 CO 0.07 0.25 0.11 1.25 -2.65 0.00 0.00 178.83 177.87 3bf0 h LEU 479 N 0.39 1.03 -1.28 -2.39 5.85 -1.18 -1.73 115.31 116.01 3bf0 h LEU 479 Ca 0.29 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 3bf0 h LEU 479 Cb 0.36 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3bf0 h LEU 479 CO -0.30 1.02 -0.12 -1.28 -0.34 0.00 0.00 178.44 177.42 3bf0 h SER 480 N 0.99 0.32 0.27 1.25 0.87 -0.73 -1.95 113.55 114.58 3bf0 h SER 480 Ca 0.20 -0.07 -0.28 0.00 -1.23 0.00 0.00 61.79 60.41 3bf0 h SER 480 Cb 0.43 -0.09 0.02 0.00 -0.44 0.00 0.00 62.40 62.32 3bf0 h SER 480 CO 0.01 0.48 -1.16 0.40 -0.53 0.00 0.00 176.83 176.03 3bf0 h ILE 481 N 0.32 1.35 -0.58 2.23 5.03 -1.02 -0.40 117.51 124.44 3bf0 h ILE 481 Ca 0.06 -2.56 -0.00 0.00 -0.12 0.00 0.00 64.86 62.24 3bf0 h ILE 481 Cb 0.42 2.66 -0.03 0.00 -3.03 0.00 0.00 36.82 36.84 3bf0 h ILE 481 CO 0.02 0.77 0.34 -0.33 -0.68 0.00 0.00 178.15 178.28 3bf0 h GLU 482 N 0.23 0.78 -0.00 2.37 5.08 -1.23 -1.29 114.58 120.53 3bf0 h GLU 482 Ca -0.15 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.13 3bf0 h GLU 482 Cb 1.84 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.92 3bf0 h GLU 482 CO 0.21 0.55 -0.07 -0.97 -1.00 0.00 0.00 179.01 177.73 3bf0 h ASN 483 N 0.80 0.07 -0.91 1.42 -0.73 -1.19 -2.59 115.58 112.44 3bf0 h ASN 483 Ca 0.21 -0.78 0.22 0.00 1.87 0.00 0.00 56.30 57.82 3bf0 h ASN 483 Cb -0.02 -0.02 -0.12 0.00 0.27 0.00 0.00 38.32 38.42 3bf0 h ASN 483 CO -0.04 0.83 0.43 1.23 -0.37 0.00 0.00 177.43 179.51 3bf0 h GLY 484 N -0.70 1.58 0.91 1.57 0.00 -0.97 0.77 103.07 106.23 3bf0 h GLY 484 Ca -0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 3bf0 h GLY 484 CO 0.01 -0.25 0.02 -1.82 0.00 0.00 0.00 176.54 174.50 3bf0 h TYR 485 N 0.44 0.06 -0.75 5.60 3.20 -1.23 -1.51 116.97 122.78 3bf0 h TYR 485 Ca 0.57 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.49 3bf0 h TYR 485 Cb 1.06 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 39.27 3bf0 h TYR 485 CO -0.11 0.14 0.49 -0.22 -1.64 0.00 0.00 178.16 176.82 3bf0 h LYS 486 N -0.04 0.80 -0.18 1.82 3.64 -0.92 -1.43 116.57 120.26 3bf0 h LYS 486 Ca 0.01 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 3bf0 h LYS 486 Cb 0.10 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 3bf0 h LYS 486 CO -0.00 0.53 0.07 -0.09 -2.27 0.00 0.00 179.45 177.69 3bf0 h ARG 487 N 0.83 0.26 0.45 1.90 9.65 -0.55 -2.07 114.38 124.86 3bf0 h ARG 487 Ca 0.32 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 59.14 3bf0 h ARG 487 Cb 0.20 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.71 3bf0 h ARG 487 CO -0.10 0.33 -0.41 0.35 2.80 0.00 0.00 179.97 182.94 3bf0 h PHE 488 N 0.14 -1.11 0.00 2.20 3.04 -0.54 -1.22 116.94 119.45 3bf0 h PHE 488 Ca 0.06 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.99 3bf0 h PHE 488 Cb 0.17 0.42 -0.00 0.00 2.56 0.00 0.00 35.95 39.10 3bf0 h PHE 488 CO -0.01 -0.57 -0.12 -0.84 -2.02 0.00 0.00 178.31 174.74 3bf0 h ILE 489 N -0.86 0.60 -0.01 1.41 3.07 -1.30 -2.07 117.51 118.34 3bf0 h ILE 489 Ca -0.04 -0.55 -0.03 0.00 1.55 0.00 0.00 64.86 65.79 3bf0 h ILE 489 Cb 0.75 1.35 0.00 0.00 -0.27 0.00 0.00 36.82 38.66 3bf0 h ILE 489 CO -0.04 0.12 -0.09 0.74 -1.05 0.00 0.00 178.15 177.83 3bf0 h THR 490 N 0.00 1.53 -0.99 0.16 2.02 -1.08 0.22 112.91 114.78 3bf0 h THR 490 Ca -0.00 -1.70 0.21 0.00 0.77 0.00 0.00 66.41 65.69 3bf0 h THR 490 Cb 0.34 2.63 -0.10 0.00 -1.74 0.00 0.00 68.15 69.28 3bf0 h THR 490 CO 0.02 0.45 0.62 -0.07 0.37 0.00 0.00 175.52 176.91 3bf0 h LEU 491 N -0.57 0.63 0.15 2.58 3.38 -0.85 0.76 115.31 121.39 3bf0 h LEU 491 Ca -0.01 0.09 -0.34 0.00 0.09 0.00 0.00 57.88 57.71 3bf0 h LEU 491 Cb 0.79 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 3bf0 h LEU 491 CO 0.02 0.20 -1.74 0.58 0.09 0.00 0.00 178.44 177.59 3bf0 h VAL 492 N 0.60 0.92 0.39 1.22 2.07 -1.23 -2.40 116.25 117.82 3bf0 h VAL 492 Ca 0.57 -2.56 -0.01 0.00 0.82 0.00 0.00 66.70 65.51 3bf0 h VAL 492 Cb 1.11 2.69 -0.01 0.00 -1.52 0.00 0.00 31.29 33.56 3bf0 h VAL 492 CO -0.33 0.83 -0.26 0.00 0.02 0.00 0.00 177.57 177.83 3bf0 h ALA 493 N 0.26 -0.63 -0.99 1.67 0.00 -0.21 0.14 119.26 119.50 3bf0 h ALA 493 Ca -0.33 -0.12 0.14 0.00 0.00 0.00 0.00 54.91 54.60 3bf0 h ALA 493 Cb 2.06 0.33 -0.09 0.00 0.00 0.00 0.00 17.79 20.09 3bf0 h ALA 493 CO 0.15 -0.87 0.62 -0.44 0.00 0.00 0.00 179.25 178.71 3bf0 h ASP 494 N -0.63 0.85 1.05 0.00 5.19 -0.95 -1.31 116.42 120.61 3bf0 h ASP 494 Ca -0.04 0.06 -0.14 0.00 -0.62 0.00 0.00 57.03 56.29 3bf0 h ASP 494 Cb 0.53 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.91 3bf0 h ASP 494 CO 0.03 0.41 -1.01 0.00 -3.12 0.00 0.00 179.24 175.54 3bf0 h ALA 495 N 1.58 0.64 -0.32 3.45 0.00 -1.03 -3.31 119.26 120.27 3bf0 h ALA 495 Ca 0.51 -0.69 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 3bf0 h ALA 495 Cb 0.65 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 3bf0 h ALA 495 CO -0.29 0.82 -0.00 0.54 0.00 0.00 0.00 179.25 180.32 3bf0 n ARG 496 N -3.06 2.46 -3.71 0.00 5.12 0.46 -4.98 116.66 112.96 3bf0 n ARG 496 Ca -0.04 -2.98 -0.22 0.00 -1.93 0.00 0.00 57.85 52.68 3bf0 n ARG 496 Cb 0.80 -1.85 0.03 0.00 -1.16 0.00 0.00 32.46 30.29 3bf0 n ARG 496 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3bf0 n HIS 497 N -0.79 -1.92 -4.38 -1.55 8.25 -0.92 -4.98 115.22 108.93 3bf0 n HIS 497 Ca 0.27 0.84 -0.21 0.00 -0.26 0.00 0.00 57.72 58.37 3bf0 n HIS 497 Cb 0.98 -4.38 -0.09 0.00 1.12 0.00 0.00 29.99 27.62 3bf0 n HIS 497 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3bf0 s SER 498 N -4.34 1.90 0.12 0.41 0.15 -0.54 -5.06 113.70 106.34 3bf0 s SER 498 Ca 0.02 -1.60 -0.05 0.00 0.70 0.00 0.00 55.95 55.02 3bf0 s SER 498 Cb -0.01 0.41 -0.05 0.00 -1.71 0.00 0.00 66.02 64.66 3bf0 s SER 498 CO 0.81 -0.90 0.36 0.42 1.20 0.00 0.00 173.24 175.13 3bf0 s THR 499 N -3.48 5.18 0.25 6.45 -4.23 -1.26 -4.16 115.64 114.38 3bf0 s THR 499 Ca 0.33 0.07 -0.09 0.00 -1.18 0.00 0.00 61.69 60.82 3bf0 s THR 499 Cb 0.04 -3.62 0.32 0.00 1.34 0.00 0.00 72.50 70.58 3bf0 s THR 499 CO 0.18 0.09 1.61 -0.65 -0.54 0.00 0.00 174.62 175.31 3bf0 h PRO 500 N 3.01 0.03 -0.02 3.99 0.11 -1.92 -1.04 132.00 136.15 3bf0 h PRO 500 Ca -0.46 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 3bf0 h PRO 500 Cb 1.17 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3bf0 h PRO 500 CO 0.72 0.02 -0.01 0.93 -0.21 0.00 0.00 178.00 179.45 3bf0 h GLU 501 N 0.04 0.03 0.15 1.05 5.08 -1.95 -0.15 114.58 118.82 3bf0 h GLU 501 Ca 0.41 -0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.46 3bf0 h GLU 501 Cb 0.68 -0.01 0.03 0.00 0.50 0.00 0.00 28.75 29.96 3bf0 h GLU 501 CO -0.77 0.04 -1.29 1.96 -1.00 0.00 0.00 179.01 177.95 3bf0 h GLN 502 N 0.03 0.54 -0.09 2.33 1.08 -1.64 -3.13 115.11 114.23 3bf0 h GLN 502 Ca 0.01 -0.78 -0.05 0.00 -1.45 0.00 0.00 58.65 56.37 3bf0 h GLN 502 Cb 0.04 0.27 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 3bf0 h GLN 502 CO 0.00 1.36 -0.19 0.82 -0.95 0.00 0.00 178.83 179.87 3bf0 h ILE 503 N 0.21 1.19 0.21 2.54 1.08 -0.68 -2.59 117.51 119.47 3bf0 h ILE 503 Ca -0.19 -0.86 0.01 0.00 -0.39 0.00 0.00 64.86 63.43 3bf0 h ILE 503 Cb 1.97 1.33 -0.02 0.00 -3.07 0.00 0.00 36.82 37.04 3bf0 h ILE 503 CO 0.24 0.26 -0.24 -0.78 -0.69 0.00 0.00 178.15 176.94 3bf0 h ASP 504 N 0.14 -0.64 0.00 1.72 3.58 -1.02 0.76 116.42 120.96 3bf0 h ASP 504 Ca 0.03 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.54 3bf0 h ASP 504 Cb 0.43 0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.70 3bf0 h ASP 504 CO 0.03 -0.34 0.13 0.29 -2.88 0.00 0.00 179.24 176.47 3bf0 n LYS 505 N -5.36 0.00 -0.13 0.28 5.02 -0.98 -0.44 118.16 116.55 3bf0 n LYS 505 Ca -0.08 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 3bf0 n LYS 505 Cb 0.27 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 3bf0 n LYS 505 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 3bf0 n ILE 506 N -1.24 0.00 0.00 -0.18 -5.35 -0.97 -4.97 119.36 106.65 3bf0 n ILE 506 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 3bf0 n ILE 506 Cb 0.13 0.82 0.00 0.00 -1.74 0.00 0.00 39.64 38.85 3bf0 n ILE 506 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3bf0 n ALA 507 N 0.00 0.06 -2.55 -1.28 0.00 0.42 -4.82 120.51 112.33 3bf0 n ALA 507 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 3bf0 n ALA 507 Cb 0.55 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.97 3bf0 n ALA 507 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3bf0 n GLN 508 N 0.00 -0.91 0.00 0.00 1.13 -1.20 -0.96 117.38 115.44 3bf0 n GLN 508 Ca 0.00 0.04 0.00 0.00 -1.94 0.00 0.00 57.00 55.10 3bf0 n GLN 508 Cb 0.00 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.85 3bf0 n GLN 508 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3bf0 n GLY 509 N -0.77 2.78 3.70 1.08 0.00 -0.36 -1.03 105.19 110.58 3bf0 n GLY 509 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 3bf0 n GLY 509 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3bf0 s HIS 510 N -2.52 2.46 0.20 1.61 2.46 -0.13 -3.98 115.29 115.39 3bf0 s HIS 510 Ca 0.00 0.13 -0.21 0.00 0.47 0.00 0.00 55.06 55.46 3bf0 s HIS 510 Cb 0.00 -4.16 -0.08 0.00 -0.13 0.00 0.00 32.58 28.21 3bf0 s HIS 510 CO 0.00 -4.63 0.72 0.54 -2.47 0.00 0.00 174.74 168.90 3bf0 s VAL 511 N 2.09 4.55 0.01 0.89 0.11 -1.26 -1.37 120.40 125.42 3bf0 s VAL 511 Ca 0.78 1.35 0.03 0.00 -2.93 0.00 0.00 61.98 61.22 3bf0 s VAL 511 Cb -0.47 -3.92 -0.01 0.00 -1.53 0.00 0.00 36.38 30.45 3bf0 s VAL 511 CO 0.35 0.30 -0.11 0.26 -3.33 0.00 0.00 175.10 172.57 3bf0 s TRP 512 N -1.41 0.98 0.67 1.54 0.23 -0.79 -4.90 118.94 115.26 3bf0 s TRP 512 Ca 0.40 -0.24 -0.13 0.00 -2.03 0.00 0.00 56.10 54.11 3bf0 s TRP 512 Cb -0.18 -0.61 -0.00 0.00 0.03 0.00 0.00 33.47 32.70 3bf0 s TRP 512 CO 0.22 -0.01 1.06 0.95 0.96 0.00 0.00 176.95 180.13 3bf0 s THR 513 N -0.47 3.87 0.32 2.01 -4.23 -1.26 0.33 115.64 116.21 3bf0 s THR 513 Ca 0.02 0.71 0.09 0.00 -1.18 0.00 0.00 61.69 61.33 3bf0 s THR 513 Cb -0.05 -3.34 0.37 0.00 1.34 0.00 0.00 72.50 70.82 3bf0 s THR 513 CO 0.00 -0.69 1.49 0.61 -0.54 0.00 0.00 174.62 175.48 3bf0 n GLY 514 N -1.52 -1.06 0.06 3.99 0.00 0.13 -0.99 105.19 105.80 3bf0 n GLY 514 Ca 0.08 0.86 -0.12 0.00 0.00 0.00 0.00 46.02 46.84 3bf0 n GLY 514 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3bf0 h GLN 515 N 0.00 -0.03 0.00 1.61 5.75 -1.75 0.14 115.11 120.83 3bf0 h GLN 515 Ca 0.66 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 59.10 3bf0 h GLN 515 Cb 1.56 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 30.11 3bf0 h GLN 515 CO -0.83 0.11 -0.30 -0.44 -2.65 0.00 0.00 178.83 174.72 3bf0 h ASP 516 N -0.17 0.00 0.14 -0.69 5.19 -1.59 -2.20 116.42 117.10 3bf0 h ASP 516 Ca -0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 3bf0 h ASP 516 Cb 0.15 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.67 3bf0 h ASP 516 CO 0.01 0.30 -0.07 0.00 -3.12 0.00 0.00 179.24 176.36 3bf0 h ALA 517 N 1.70 -0.19 -0.87 3.45 0.00 -0.80 -2.12 119.26 120.43 3bf0 h ALA 517 Ca -0.00 -0.22 0.22 0.00 0.00 0.00 0.00 54.91 54.90 3bf0 h ALA 517 Cb 0.55 0.07 -0.13 0.00 0.00 0.00 0.00 17.79 18.29 3bf0 h ALA 517 CO 0.04 -0.35 0.31 -0.22 0.00 0.00 0.00 179.25 179.03 3bf0 h LYS 518 N -0.69 0.31 -0.13 0.00 1.63 -0.92 -1.53 116.57 115.22 3bf0 h LYS 518 Ca -0.02 -0.02 -0.12 0.00 -0.85 0.00 0.00 60.65 59.64 3bf0 h LYS 518 Cb 0.51 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.06 3bf0 h LYS 518 CO 0.03 0.20 -0.44 0.00 -3.45 0.00 0.00 179.45 175.80 3bf0 h ALA 519 N 1.72 1.01 -0.51 5.00 0.00 -1.18 -3.03 119.26 122.26 3bf0 h ALA 519 Ca 0.54 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3bf0 h ALA 519 Cb 1.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3bf0 h ALA 519 CO -0.57 0.62 0.00 0.27 0.00 0.00 0.00 179.25 179.58 3bf0 n ASN 520 N -4.00 3.90 0.00 0.00 2.04 -0.82 -4.98 115.26 111.41 3bf0 n ASN 520 Ca -0.02 -2.30 0.00 0.00 -0.44 0.00 0.00 54.58 51.82 3bf0 n ASN 520 Cb 0.51 -0.45 0.00 0.00 -2.53 0.00 0.00 39.78 37.31 3bf0 n ASN 520 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3bf0 n GLY 521 N 0.79 0.06 0.27 4.83 0.00 -0.67 -4.92 105.19 105.56 3bf0 n GLY 521 Ca 0.20 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.39 3bf0 n GLY 521 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3bf0 h LEU 522 N 0.00 0.00 -8.28 0.99 3.38 -1.58 -3.44 115.31 106.38 3bf0 h LEU 522 Ca 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 3bf0 h LEU 522 Cb 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 40.54 3bf0 h LEU 522 CO 0.00 0.04 -0.74 -0.69 0.09 0.00 0.00 178.44 177.13 3bf0 s VAL 523 N -3.69 0.74 -0.16 1.22 1.01 -1.15 -4.92 120.40 113.45 3bf0 s VAL 523 Ca 0.01 -1.24 -0.02 0.00 0.00 0.00 0.00 61.98 60.73 3bf0 s VAL 523 Cb 0.09 -0.86 -0.23 0.00 0.00 0.00 0.00 36.38 35.38 3bf0 s VAL 523 CO 0.56 -0.38 0.18 0.47 0.00 0.00 0.00 175.10 175.92 3bf0 n ASP 524 N 1.24 1.91 -3.54 3.32 8.00 0.60 -4.35 116.55 123.74 3bf0 n ASP 524 Ca -0.21 0.10 -0.12 0.00 0.71 0.00 0.00 54.79 55.27 3bf0 n ASP 524 Cb 0.55 -0.59 -0.04 0.00 -0.02 0.00 0.00 41.12 41.02 3bf0 n ASP 524 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3bf0 s SER 525 N -6.75 -0.43 -0.18 -2.24 1.04 -1.09 -5.02 113.70 99.03 3bf0 s SER 525 Ca -0.25 -0.02 -0.16 0.00 0.48 0.00 0.00 55.95 56.01 3bf0 s SER 525 Cb 0.07 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.68 3bf0 s SER 525 CO 0.72 -0.84 0.38 -0.76 0.98 0.00 0.00 173.24 173.72 3bf0 s LEU 526 N -2.47 4.19 0.00 2.42 1.43 -1.26 -2.09 118.68 120.91 3bf0 s LEU 526 Ca -0.01 0.54 0.00 0.00 -1.03 0.00 0.00 54.13 53.63 3bf0 s LEU 526 Cb 0.00 -2.49 0.00 0.00 0.03 0.00 0.00 46.19 43.73 3bf0 s LEU 526 CO -0.08 -0.02 0.00 0.61 0.23 0.00 0.00 176.35 177.08 3bf0 n GLY 527 N 3.74 0.93 0.55 -3.19 0.00 -0.93 -4.96 105.19 101.32 3bf0 n GLY 527 Ca -0.09 -0.35 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 3bf0 n GLY 527 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3bf0 n ASP 528 N 0.00 0.71 -0.19 1.61 5.68 -1.26 -2.17 116.55 120.94 3bf0 n ASP 528 Ca 0.00 -1.36 0.30 0.00 -0.50 0.00 0.00 54.79 53.22 3bf0 n ASP 528 Cb 0.00 0.20 0.72 0.00 -1.14 0.00 0.00 41.12 40.90 3bf0 n ASP 528 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 3bf0 h PHE 529 N 1.13 0.00 -0.44 2.11 3.57 -1.95 -0.61 116.94 120.75 3bf0 h PHE 529 Ca -0.05 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.40 3bf0 h PHE 529 Cb 0.20 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 3bf0 h PHE 529 CO 0.00 0.00 0.07 -0.44 -2.23 0.00 0.00 178.31 175.71 3bf0 h ASP 530 N 0.00 0.70 0.43 0.41 3.32 -1.99 -1.77 116.42 117.51 3bf0 h ASP 530 Ca 0.44 -0.26 -0.14 0.00 0.02 0.00 0.00 57.03 57.09 3bf0 h ASP 530 Cb 1.87 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 41.22 3bf0 h ASP 530 CO -0.00 0.78 -0.59 0.44 -1.72 0.00 0.00 179.24 178.15 3bf0 h ASP 531 N 0.58 0.18 -0.06 6.45 3.32 -1.51 -1.11 116.42 124.28 3bf0 h ASP 531 Ca 0.13 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 3bf0 h ASP 531 Cb 0.38 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.89 3bf0 h ASP 531 CO 0.01 0.73 -0.48 0.00 -1.72 0.00 0.00 179.24 177.77 3bf0 h ALA 532 N 1.28 0.14 -0.62 3.45 0.00 -1.37 0.66 119.26 122.80 3bf0 h ALA 532 Ca -0.00 -0.51 0.08 0.00 0.00 0.00 0.00 54.91 54.48 3bf0 h ALA 532 Cb 1.07 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 3bf0 h ALA 532 CO 0.09 0.31 0.27 0.28 0.00 0.00 0.00 179.25 180.20 3bf0 h VAL 533 N -0.04 0.83 -0.55 0.00 2.07 -1.29 -1.31 116.25 115.95 3bf0 h VAL 533 Ca -0.04 -0.17 -0.08 0.00 0.82 0.00 0.00 66.70 67.23 3bf0 h VAL 533 Cb 1.15 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 3bf0 h VAL 533 CO 0.10 0.09 0.02 0.00 0.02 0.00 0.00 177.57 177.80 3bf0 h ALA 534 N 1.40 0.74 -0.05 1.67 0.00 -0.87 -1.07 119.26 121.07 3bf0 h ALA 534 Ca 0.30 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3bf0 h ALA 534 Cb 0.33 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3bf0 h ALA 534 CO -0.27 0.55 -0.27 -0.22 0.00 0.00 0.00 179.25 179.03 3bf0 h LYS 535 N 0.84 0.09 0.27 0.00 1.63 -0.58 -1.93 116.57 116.89 3bf0 h LYS 535 Ca 0.16 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.92 3bf0 h LYS 535 Cb 0.51 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 3bf0 h LYS 535 CO 0.02 0.36 -0.13 0.00 -3.45 0.00 0.00 179.45 176.25 3bf0 h ALA 536 N 1.65 -0.36 -0.66 5.00 0.00 -0.06 -1.34 119.26 123.49 3bf0 h ALA 536 Ca 0.01 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 54.90 3bf0 h ALA 536 Cb 0.53 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 3bf0 h ALA 536 CO 0.04 -0.43 0.46 0.00 0.00 0.00 0.00 179.25 179.32 3bf0 h ALA 537 N -0.51 2.42 0.00 0.00 0.00 -1.26 -2.10 119.26 117.81 3bf0 h ALA 537 Ca -0.04 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 3bf0 h ALA 537 Cb 0.50 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 3bf0 h ALA 537 CO 0.06 -0.60 -0.91 1.49 0.00 0.00 0.00 179.25 179.28 3bf0 h GLU 538 N 0.14 0.00 0.00 0.00 4.81 -1.23 -1.60 114.58 116.70 3bf0 h GLU 538 Ca 0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 3bf0 h GLU 538 Cb 1.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.44 3bf0 h GLU 538 CO -0.04 0.91 0.00 1.28 -0.73 0.00 0.00 179.01 180.43 3bf0 n LEU 539 N -3.38 0.67 0.00 1.64 4.77 -0.52 -4.59 117.00 115.58 3bf0 n LEU 539 Ca 0.00 0.65 0.00 0.00 -0.03 0.00 0.00 56.01 56.63 3bf0 n LEU 539 Cb 0.89 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3bf0 n LEU 539 CO 0.46 -0.52 0.00 0.00 -1.33 0.00 0.00 177.39 176.00 3bf0 n ALA 540 N -1.77 0.00 -3.22 -1.18 0.00 -1.16 -4.89 120.51 108.29 3bf0 n ALA 540 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.34 3bf0 n ALA 540 Cb 0.25 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.68 3bf0 n ALA 540 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3bf0 s LYS 541 N 1.13 2.02 0.00 0.00 1.02 -0.61 -5.07 119.74 118.25 3bf0 s LYS 541 Ca 0.00 -1.64 0.22 0.00 0.02 0.00 0.00 55.97 54.57 3bf0 s LYS 541 Cb 0.00 0.51 0.02 0.00 -0.52 0.00 0.00 37.83 37.83 3bf0 s LYS 541 CO 0.00 -0.88 1.07 0.28 -0.92 0.00 0.00 175.35 174.89 3bf0 n VAL 542 N -0.55 0.01 -5.01 3.17 0.31 -1.26 -4.75 118.33 110.24 3bf0 n VAL 542 Ca -0.02 -0.02 -0.29 0.00 -0.01 0.00 0.00 64.34 64.00 3bf0 n VAL 542 Cb 0.61 0.72 -0.17 0.00 -0.91 0.00 0.00 33.84 34.09 3bf0 n VAL 542 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 3bf0 s LYS 543 N -3.01 2.52 0.05 5.55 2.20 -1.26 -5.13 119.74 120.65 3bf0 s LYS 543 Ca 0.09 -0.72 -0.05 0.00 -0.36 0.00 0.00 55.97 54.92 3bf0 s LYS 543 Cb 0.16 -1.97 -0.01 0.00 -1.51 0.00 0.00 37.83 34.50 3bf0 s LYS 543 CO 0.81 0.15 0.09 1.14 -0.36 0.00 0.00 175.35 177.19 3bf0 s GLN 544 N 0.37 0.64 0.13 4.03 0.00 -1.26 -4.64 119.66 118.93 3bf0 s GLN 544 Ca -0.15 -0.87 0.01 0.00 -0.00 0.00 0.00 55.36 54.35 3bf0 s GLN 544 Cb -0.17 0.25 -0.04 0.00 0.00 0.00 0.00 33.01 33.05 3bf0 s GLN 544 CO 0.07 -0.16 -0.02 1.67 0.00 0.00 0.00 175.29 176.84 3bf0 s TRP 545 N -3.05 1.02 -0.02 9.60 1.48 -1.12 -4.95 118.94 121.89 3bf0 s TRP 545 Ca -0.01 -1.00 -0.15 0.00 -1.06 0.00 0.00 56.10 53.87 3bf0 s TRP 545 Cb 0.01 -0.59 -0.06 0.00 -1.16 0.00 0.00 33.47 31.68 3bf0 s TRP 545 CO -0.07 -0.23 0.42 -1.01 -4.06 0.00 0.00 176.95 172.00 3bf0 s HIS 546 N -3.70 3.70 -0.18 1.66 3.76 -1.26 -1.00 115.29 118.28 3bf0 s HIS 546 Ca 0.18 0.98 -0.02 0.00 -0.15 0.00 0.00 55.06 56.05 3bf0 s HIS 546 Cb 0.06 -2.33 -0.01 0.00 1.11 0.00 0.00 32.58 31.41 3bf0 s HIS 546 CO -0.00 0.57 -0.10 -1.17 -0.85 0.00 0.00 174.74 173.19 3bf0 s LEU 547 N -0.81 2.75 0.21 0.89 1.98 -0.24 -4.90 118.68 118.56 3bf0 s LEU 547 Ca 0.24 -0.38 0.05 0.00 -2.89 0.00 0.00 54.13 51.15 3bf0 s LEU 547 Cb -0.16 -1.66 -0.03 0.00 0.66 0.00 0.00 46.19 44.99 3bf0 s LEU 547 CO 0.13 0.07 0.23 -1.61 -1.89 0.00 0.00 176.35 173.28 3bf0 s GLU 548 N 0.95 3.12 0.00 1.98 8.01 -1.26 0.11 118.70 131.61 3bf0 s GLU 548 Ca -0.02 -0.87 0.00 0.00 0.01 0.00 0.00 54.97 54.10 3bf0 s GLU 548 Cb -0.15 -2.72 0.00 0.00 -4.31 0.00 0.00 34.13 26.95 3bf0 s GLU 548 CO -0.00 0.45 0.44 0.66 0.01 0.00 0.00 175.26 176.82