#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bsd s ILE 3 N 0.00 3.54 -0.27 2.28 1.01 -1.26 -0.89 121.20 125.61 2bsd s ILE 3 Ca 0.00 -0.50 -0.12 0.00 0.00 0.00 0.00 60.65 60.03 2bsd s ILE 3 Cb 0.00 -2.65 -0.05 0.00 0.01 0.00 0.00 42.46 39.77 2bsd s ILE 3 CO 0.00 0.36 0.25 -0.54 0.00 0.00 0.00 174.94 175.00 2bsd s LYS 4 N 1.49 4.00 -0.22 2.79 1.02 -0.14 -4.95 119.74 123.73 2bsd s LYS 4 Ca 0.05 -0.19 -0.07 0.00 0.02 0.00 0.00 55.97 55.78 2bsd s LYS 4 Cb -0.15 -3.63 -0.03 0.00 -0.52 0.00 0.00 37.83 33.49 2bsd s LYS 4 CO -0.02 -0.16 0.07 -0.80 -0.92 0.00 0.00 175.35 173.52 2bsd s ASN 5 N 1.58 5.35 -0.07 2.83 0.02 -1.26 -0.69 114.94 122.70 2bsd s ASN 5 Ca 0.10 -0.09 -0.09 0.00 -1.02 0.00 0.00 52.86 51.76 2bsd s ASN 5 Cb -0.15 -1.94 -0.04 0.00 0.02 0.00 0.00 41.25 39.13 2bsd s ASN 5 CO 0.09 0.05 -0.18 0.49 0.02 0.00 0.00 177.10 177.57 2bsd n PHE 6 N 4.37 0.00 -1.13 2.20 3.01 -0.86 -4.67 117.46 120.37 2bsd n PHE 6 Ca -0.16 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 57.96 2bsd n PHE 6 Cb 0.52 -0.31 -0.03 0.00 -0.01 0.00 0.00 39.48 39.65 2bsd n PHE 6 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2bsd n THR 7 N -3.92 3.62 -3.82 4.37 -1.04 -1.10 -4.82 114.28 107.56 2bsd n THR 7 Ca -0.12 -2.19 -0.13 0.00 -2.04 0.00 0.00 64.05 59.57 2bsd n THR 7 Cb 0.36 -2.45 -0.14 0.00 -1.82 0.00 0.00 70.33 66.28 2bsd n THR 7 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2bsd s PHE 8 N 2.67 -0.05 0.07 -1.42 0.40 -1.26 -4.69 117.98 113.70 2bsd s PHE 8 Ca 0.59 0.17 0.00 0.00 -0.60 0.00 0.00 56.93 57.08 2bsd s PHE 8 Cb 0.15 -0.05 0.00 0.00 0.51 0.00 0.00 43.02 43.63 2bsd s PHE 8 CO -0.05 -0.05 0.00 1.19 0.70 0.00 0.00 175.22 177.01 2bsd n PHE 9 N 3.43 -2.15 -2.89 0.36 0.99 -1.26 -4.97 117.46 110.96 2bsd n PHE 9 Ca -0.17 0.25 -0.41 0.00 -0.00 0.00 0.00 57.45 57.12 2bsd n PHE 9 Cb 0.57 0.91 -0.04 0.00 -1.00 0.00 0.00 39.48 39.92 2bsd n PHE 9 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 2bsd s GLY 19 N -1.63 2.69 0.26 1.37 0.00 -1.26 -4.90 107.32 103.84 2bsd s GLY 19 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 44.72 45.02 2bsd s GLY 19 CO 0.00 1.45 1.68 1.76 0.00 0.00 0.00 173.10 177.99 2bsd h SER 20 N 6.83 0.58 0.29 1.64 0.02 -1.93 -2.61 113.55 118.38 2bsd h SER 20 Ca -0.40 -0.21 -0.08 0.00 -0.84 0.00 0.00 61.79 60.27 2bsd h SER 20 Cb 1.20 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 2bsd h SER 20 CO 0.76 0.82 -0.34 -0.55 -1.14 0.00 0.00 176.83 176.38 2bsd h ASN 21 N 0.51 0.08 -0.28 3.07 -1.07 -1.90 -1.14 115.58 114.84 2bsd h ASN 21 Ca 0.07 -0.03 -0.09 0.00 0.07 0.00 0.00 56.30 56.32 2bsd h ASN 21 Cb 0.70 -0.02 -0.01 0.00 -2.07 0.00 0.00 38.32 36.93 2bsd h ASN 21 CO 0.05 0.42 -0.18 0.78 0.07 0.00 0.00 177.43 178.57 2bsd h ASN 22 N 0.07 0.65 -0.59 6.14 -0.26 -1.82 -2.27 115.58 117.50 2bsd h ASN 22 Ca 0.01 -0.43 -0.02 0.00 -0.56 0.00 0.00 56.30 55.29 2bsd h ASN 22 Cb 0.64 -0.18 -0.03 0.00 -1.06 0.00 0.00 38.32 37.69 2bsd h ASN 22 CO 0.05 0.95 0.29 0.44 -1.06 0.00 0.00 177.43 178.09 2bsd h ASP 23 N 0.37 0.78 -0.47 5.81 3.32 -1.33 -1.71 116.42 123.19 2bsd h ASP 23 Ca 0.06 -0.13 0.07 0.00 0.02 0.00 0.00 57.03 57.05 2bsd h ASP 23 Cb 0.72 -0.20 -0.06 0.00 0.22 0.00 0.00 39.33 40.01 2bsd h ASP 23 CO 0.05 0.69 0.13 1.23 -1.72 0.00 0.00 179.24 179.62 2bsd h GLY 24 N 0.81 0.59 0.92 2.75 0.00 -1.17 0.15 103.07 107.12 2bsd h GLY 24 Ca 0.20 -0.06 -0.06 0.00 0.00 0.00 0.00 47.33 47.42 2bsd h GLY 24 CO -0.03 -0.03 -0.03 0.50 0.00 0.00 0.00 176.54 176.96 2bsd h LYS 25 N 0.28 0.63 -0.22 4.80 1.57 -1.28 -0.62 116.57 121.73 2bsd h LYS 25 Ca 0.23 -0.22 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 2bsd h LYS 25 Cb 0.27 -0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.47 2bsd h LYS 25 CO -0.27 0.77 -0.21 1.25 -0.57 0.00 0.00 179.45 180.42 2bsd h LEU 26 N 0.43 -0.66 -0.86 2.94 5.85 -1.05 -1.34 115.31 120.61 2bsd h LEU 26 Ca 0.09 0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 2bsd h LEU 26 Cb 0.51 0.32 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 2bsd h LEU 26 CO 0.02 -0.25 0.17 1.88 -0.34 0.00 0.00 178.44 179.93 2bsd h TYR 27 N -0.22 1.06 -0.96 1.25 0.05 -0.86 -0.56 116.97 116.73 2bsd h TYR 27 Ca 0.13 -0.11 0.03 0.00 0.05 0.00 0.00 58.73 58.83 2bsd h TYR 27 Cb 0.41 -0.30 -0.05 0.00 1.01 0.00 0.00 36.73 37.79 2bsd h TYR 27 CO -0.36 0.86 0.63 0.52 -1.05 0.00 0.00 178.16 178.77 2bsd h MET 28 N 0.97 1.19 0.01 4.88 2.86 -0.79 -2.49 114.93 121.55 2bsd h MET 28 Ca 0.21 -0.07 -0.24 0.00 -2.06 0.00 0.00 59.70 57.53 2bsd h MET 28 Cb 0.33 -0.27 0.01 0.00 0.06 0.00 0.00 31.60 31.73 2bsd h MET 28 CO -0.00 0.79 -0.99 0.52 1.06 0.00 0.00 176.91 178.28 2bsd h MET 29 N 1.23 0.51 -0.59 1.72 2.86 -0.71 -1.31 114.93 118.64 2bsd h MET 29 Ca 0.38 -0.56 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 2bsd h MET 29 Cb -0.01 0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 2bsd h MET 29 CO -0.11 1.19 0.32 -0.07 1.06 0.00 0.00 176.91 179.30 2bsd h LEU 30 N 0.28 0.73 -0.30 1.22 3.38 -0.91 -3.18 115.31 116.54 2bsd h LEU 30 Ca -0.10 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2bsd h LEU 30 Cb 1.64 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.20 2bsd h LEU 30 CO 0.18 0.61 -0.62 1.07 0.09 0.00 0.00 178.44 179.77 2bsd n THR 31 N -4.59 0.00 -2.72 0.22 5.66 -0.96 -5.00 114.28 106.89 2bsd n THR 31 Ca 0.04 -0.08 -0.09 0.00 -3.05 0.00 0.00 64.05 60.87 2bsd n THR 31 Cb 0.08 0.74 0.05 0.00 -1.55 0.00 0.00 70.33 69.65 2bsd n THR 31 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2bsd n GLY 32 N 1.45 -0.12 3.50 1.09 0.00 -0.64 -4.66 105.19 105.81 2bsd n GLY 32 Ca 0.07 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 2bsd n GLY 32 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2bsd s MET 33 N -4.45 2.10 0.22 1.61 0.23 -0.59 -0.48 119.30 117.93 2bsd s MET 33 Ca 0.09 -0.99 0.03 0.00 -1.03 0.00 0.00 55.69 53.79 2bsd s MET 33 Cb -0.01 -2.24 0.03 0.00 -1.53 0.00 0.00 34.83 31.08 2bsd s MET 33 CO 0.43 0.53 0.25 -0.40 -2.03 0.00 0.00 175.02 173.79 2bsd n ASP 34 N 1.27 1.16 0.00 -1.18 5.68 -1.26 -4.70 116.55 117.52 2bsd n ASP 34 Ca -0.15 -1.64 0.10 0.00 -0.50 0.00 0.00 54.79 52.59 2bsd n ASP 34 Cb 0.52 -0.10 0.49 0.00 -1.14 0.00 0.00 41.12 40.89 2bsd n ASP 34 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2bsd n TYR 35 N -1.28 0.00 -0.68 2.11 4.01 -1.26 -3.40 117.16 116.65 2bsd n TYR 35 Ca 0.03 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.86 2bsd n TYR 35 Cb 0.23 -0.39 0.34 0.00 -0.31 0.00 0.00 39.34 39.21 2bsd n TYR 35 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2bsd n ARG 36 N -1.39 3.74 -4.22 -0.72 1.74 -1.26 -4.40 116.66 110.15 2bsd n ARG 36 Ca 0.08 -2.86 -0.16 0.00 -0.77 0.00 0.00 57.85 54.13 2bsd n ARG 36 Cb 0.20 -1.89 -0.08 0.00 -1.02 0.00 0.00 32.46 29.67 2bsd n ARG 36 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2bsd s THR 37 N -2.04 0.00 0.25 0.55 -1.32 -1.22 -4.94 115.64 106.91 2bsd s THR 37 Ca 0.48 -1.91 0.02 0.00 -1.21 0.00 0.00 61.69 59.07 2bsd s THR 37 Cb 0.33 -2.51 -0.05 0.00 -1.51 0.00 0.00 72.50 68.75 2bsd s THR 37 CO 0.21 0.00 0.07 0.27 -2.21 0.00 0.00 174.62 172.95 2bsd s ILE 38 N -3.59 0.67 -0.09 5.08 -0.00 -1.26 -4.66 121.20 117.35 2bsd s ILE 38 Ca 0.38 -2.00 -0.01 0.00 -0.00 0.00 0.00 60.65 59.02 2bsd s ILE 38 Cb 0.03 -2.54 -0.03 0.00 -0.00 0.00 0.00 42.46 39.92 2bsd s ILE 38 CO 0.22 -0.11 -0.05 -0.13 -0.00 0.00 0.00 174.94 174.87 2bsd s ARG 39 N -3.99 2.98 -0.09 0.37 1.81 -0.77 -4.31 118.95 114.96 2bsd s ARG 39 Ca 0.35 -0.52 -0.07 0.00 -1.72 0.00 0.00 55.73 53.77 2bsd s ARG 39 Cb 0.07 -2.69 0.03 0.00 -0.45 0.00 0.00 34.95 31.92 2bsd s ARG 39 CO 0.12 0.58 0.23 0.50 -0.68 0.00 0.00 175.30 176.04 2bsd s ARG 40 N -0.56 0.24 -0.09 3.54 3.00 -1.26 -0.47 118.95 123.35 2bsd s ARG 40 Ca 0.09 0.38 -0.03 0.00 -1.00 0.00 0.00 55.73 55.16 2bsd s ARG 40 Cb -0.12 0.04 0.05 0.00 0.00 0.00 0.00 34.95 34.92 2bsd s ARG 40 CO 0.02 -0.08 0.17 0.21 0.00 0.00 0.00 175.30 175.62 2bsd s LYS 41 N 0.52 0.05 -0.67 5.12 2.47 -0.65 -5.01 119.74 121.58 2bsd s LYS 41 Ca -0.03 0.55 -0.25 0.00 -1.56 0.00 0.00 55.97 54.68 2bsd s LYS 41 Cb -0.05 -0.23 0.05 0.00 -1.46 0.00 0.00 37.83 36.14 2bsd s LYS 41 CO -0.03 -0.28 1.09 -0.51 0.16 0.00 0.00 175.35 175.78 2bsd s ASP 42 N 2.13 6.20 0.30 1.43 1.01 -1.26 -1.00 116.67 125.48 2bsd s ASP 42 Ca 0.01 -0.66 0.12 0.00 0.71 0.00 0.00 52.55 52.73 2bsd s ASP 42 Cb -0.12 -2.48 0.45 0.00 1.01 0.00 0.00 42.92 41.78 2bsd s ASP 42 CO -0.06 -1.56 1.66 -0.50 0.21 0.00 0.00 175.17 174.92 2bsd h TRP 43 N 9.70 0.00 -3.96 4.23 4.06 -1.34 -3.43 115.95 125.20 2bsd h TRP 43 Ca -0.28 0.00 -0.49 0.00 2.06 0.00 0.00 58.89 60.18 2bsd h TRP 43 Cb 1.06 0.00 -0.22 0.00 -1.00 0.00 0.00 29.16 29.00 2bsd h TRP 43 CO 1.02 0.56 -0.81 -1.12 -3.56 0.00 0.00 178.44 174.53 2bsd s SER 44 N -6.83 2.11 0.16 -3.49 0.01 -1.06 -5.03 113.70 99.58 2bsd s SER 44 Ca -0.01 -0.63 -0.32 0.00 1.31 0.00 0.00 55.95 56.30 2bsd s SER 44 Cb 0.13 -0.10 -0.10 0.00 0.21 0.00 0.00 66.02 66.15 2bsd s SER 44 CO 0.75 0.01 1.57 -0.44 0.41 0.00 0.00 173.24 175.54 2bsd s SER 45 N -1.72 6.59 0.44 2.44 0.01 -1.26 -4.33 113.70 115.87 2bsd s SER 45 Ca 0.03 2.61 -0.25 0.00 1.31 0.00 0.00 55.95 59.64 2bsd s SER 45 Cb -0.10 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.45 2bsd s SER 45 CO 0.03 -0.82 1.42 -2.65 0.41 0.00 0.00 173.24 171.62 2bsd n PRO 46 N 4.01 2.24 -4.65 12.44 -0.02 -1.26 -4.41 135.00 143.35 2bsd n PRO 46 Ca 0.14 0.80 -0.33 0.00 -2.02 0.00 0.00 63.50 62.08 2bsd n PRO 46 Cb 0.39 -2.60 -0.14 0.00 -0.02 0.00 0.00 33.50 31.12 2bsd n PRO 46 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2bsd s LEU 47 N -2.51 2.86 -0.05 2.45 1.43 0.58 -4.94 118.68 118.50 2bsd s LEU 47 Ca 0.61 -0.28 -0.19 0.00 -1.03 0.00 0.00 54.13 53.23 2bsd s LEU 47 Cb -0.46 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.05 2bsd s LEU 47 CO 0.58 0.16 0.55 0.20 0.23 0.00 0.00 176.35 178.07 2bsd s ASN 48 N 0.39 6.86 -0.07 2.29 0.01 -1.26 -0.10 114.94 123.06 2bsd s ASN 48 Ca -0.09 1.02 -0.03 0.00 -0.71 0.00 0.00 52.86 53.06 2bsd s ASN 48 Cb -0.15 -2.33 0.04 0.00 0.41 0.00 0.00 41.25 39.21 2bsd s ASN 48 CO 0.05 0.06 0.15 0.28 -1.51 0.00 0.00 177.10 176.13 2bsd s THR 49 N 0.13 -0.06 0.00 1.60 -1.32 -1.09 -5.00 115.64 109.91 2bsd s THR 49 Ca 0.29 0.19 0.00 0.00 -1.21 0.00 0.00 61.69 60.96 2bsd s THR 49 Cb -0.17 -0.25 0.00 0.00 -1.51 0.00 0.00 72.50 70.57 2bsd s THR 49 CO 0.14 0.08 0.00 0.00 -2.21 0.00 0.00 174.62 172.63 2bsd n ALA 50 N 4.27 0.00 -2.50 11.08 0.00 -1.26 -1.76 120.51 130.34 2bsd n ALA 50 Ca -0.25 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.78 2bsd n ALA 50 Cb 0.52 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.98 2bsd n ALA 50 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2bsd n LEU 51 N 0.00 7.49 -3.81 0.00 4.77 -1.25 -3.53 117.00 120.67 2bsd n LEU 51 Ca 0.00 -5.26 -0.12 0.00 -0.03 0.00 0.00 56.01 50.60 2bsd n LEU 51 Cb 0.00 -1.22 -0.09 0.00 -2.33 0.00 0.00 43.42 39.77 2bsd n LEU 51 CO 0.00 2.03 -0.07 0.20 -1.33 0.00 0.00 177.39 178.22 2bsd s ASN 52 N -0.94 -0.11 -0.19 -1.43 0.01 -0.73 -0.46 114.94 111.10 2bsd s ASN 52 Ca 0.42 0.00 -0.01 0.00 -0.71 0.00 0.00 52.86 52.57 2bsd s ASN 52 Cb 0.18 0.29 0.01 0.00 0.41 0.00 0.00 41.25 42.14 2bsd s ASN 52 CO -0.11 -0.38 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.27 2bsd s VAL 53 N -1.20 2.59 -0.32 1.60 1.01 -0.71 -2.66 120.40 120.71 2bsd s VAL 53 Ca -0.13 -0.77 -0.16 0.00 0.00 0.00 0.00 61.98 60.93 2bsd s VAL 53 Cb -0.06 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 2bsd s VAL 53 CO 0.03 0.50 0.40 -1.58 0.00 0.00 0.00 175.10 174.45 2bsd s GLN 54 N 1.24 3.70 -0.44 2.72 0.74 0.85 -1.39 119.66 127.09 2bsd s GLN 54 Ca 0.03 -0.23 -0.28 0.00 0.05 0.00 0.00 55.36 54.93 2bsd s GLN 54 Cb -0.14 -3.76 0.03 0.00 1.10 0.00 0.00 33.01 30.23 2bsd s GLN 54 CO -0.07 -0.49 1.07 0.71 -0.55 0.00 0.00 175.29 175.96 2bsd s TYR 55 N 2.12 2.92 -0.07 1.67 2.02 -0.27 -0.31 117.35 125.43 2bsd s TYR 55 Ca 0.14 0.74 -0.24 0.00 -0.37 0.00 0.00 57.07 57.34 2bsd s TYR 55 Cb -0.16 -4.14 -0.28 0.00 -0.40 0.00 0.00 41.96 36.98 2bsd s TYR 55 CO 0.12 -1.11 0.89 1.79 -1.57 0.00 0.00 175.55 175.67 2bsd h THR 56 N 6.08 1.60 -1.14 -0.71 1.35 -1.77 -0.23 112.91 118.09 2bsd h THR 56 Ca -0.23 -2.35 -0.10 0.00 -0.55 0.00 0.00 66.41 63.19 2bsd h THR 56 Cb 1.06 3.15 -0.21 0.00 -1.73 0.00 0.00 68.15 70.43 2bsd h THR 56 CO 1.08 0.64 -0.48 0.21 -0.25 0.00 0.00 175.52 176.73 2bsd s ASN 57 N -6.61 -1.16 -0.10 5.36 2.47 -1.22 -2.31 114.94 111.38 2bsd s ASN 57 Ca -0.16 -0.81 0.01 0.00 0.42 0.00 0.00 52.86 52.32 2bsd s ASN 57 Cb -0.00 1.77 0.02 0.00 -1.45 0.00 0.00 41.25 41.59 2bsd s ASN 57 CO 0.77 -0.19 -0.12 -0.89 -3.72 0.00 0.00 177.10 172.95 2bsd s THR 58 N 1.88 1.25 0.06 -5.21 2.01 -0.68 -0.77 115.64 114.19 2bsd s THR 58 Ca 0.16 -0.49 -0.13 0.00 0.31 0.00 0.00 61.69 61.54 2bsd s THR 58 Cb -0.06 -1.18 -0.06 0.00 0.01 0.00 0.00 72.50 71.21 2bsd s THR 58 CO -0.08 0.39 0.45 -0.44 -0.69 0.00 0.00 174.62 174.25 2bsd s SER 59 N 1.15 6.78 0.01 3.53 0.01 -0.17 0.17 113.70 125.18 2bsd s SER 59 Ca -0.04 0.95 0.02 0.00 1.31 0.00 0.00 55.95 58.19 2bsd s SER 59 Cb -0.14 -2.24 -0.01 0.00 0.21 0.00 0.00 66.02 63.83 2bsd s SER 59 CO -0.03 0.23 -0.06 -0.63 0.41 0.00 0.00 173.24 173.15 2bsd s ILE 60 N -1.26 0.49 -0.18 1.44 1.01 -0.13 -1.63 121.20 120.93 2bsd s ILE 60 Ca 0.30 -0.52 -0.00 0.00 0.00 0.00 0.00 60.65 60.43 2bsd s ILE 60 Cb -0.16 -0.46 0.01 0.00 0.01 0.00 0.00 42.46 41.86 2bsd s ILE 60 CO 0.16 -0.03 -0.14 -0.63 0.00 0.00 0.00 174.94 174.30 2bsd s ILE 61 N -0.53 2.58 -0.03 2.92 1.01 0.38 -1.19 121.20 126.34 2bsd s ILE 61 Ca -0.02 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 59.87 2bsd s ILE 61 Cb -0.05 -2.12 0.02 0.00 0.01 0.00 0.00 42.46 40.33 2bsd s ILE 61 CO 0.00 0.50 -0.03 0.00 0.00 0.00 0.00 174.94 175.42 2bsd s ALA 62 N 1.20 0.48 -1.44 9.38 0.00 -0.76 -1.84 121.76 128.78 2bsd s ALA 62 Ca 0.02 0.03 -0.04 0.00 0.00 0.00 0.00 51.96 51.97 2bsd s ALA 62 Cb -0.14 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.67 2bsd s ALA 62 CO -0.06 -0.02 0.38 0.41 0.00 0.00 0.00 175.76 176.47 2bsd n GLY 63 N 3.95 -0.51 2.52 0.00 0.00 -1.26 -0.74 105.19 109.16 2bsd n GLY 63 Ca -0.25 0.08 -0.03 0.00 0.00 0.00 0.00 46.02 45.82 2bsd n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bsd n GLY 64 N -1.23 0.46 3.59 -0.02 0.00 -1.26 -4.65 105.19 102.08 2bsd n GLY 64 Ca -0.12 -0.11 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 2bsd n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bsd s ARG 65 N -1.57 3.94 -0.01 1.61 1.81 0.09 -4.19 118.95 120.62 2bsd s ARG 65 Ca 0.00 -0.34 -0.22 0.00 -1.72 0.00 0.00 55.73 53.45 2bsd s ARG 65 Cb 0.00 -3.46 -0.05 0.00 -0.45 0.00 0.00 34.95 30.99 2bsd s ARG 65 CO 0.00 -0.01 0.66 -0.47 -0.68 0.00 0.00 175.30 174.80 2bsd s TYR 66 N 1.22 3.67 0.12 -0.53 5.04 -1.26 -1.82 117.35 123.79 2bsd s TYR 66 Ca 0.06 1.28 -0.13 0.00 -2.44 0.00 0.00 57.07 55.84 2bsd s TYR 66 Cb -0.14 -2.71 0.02 0.00 0.35 0.00 0.00 41.96 39.47 2bsd s TYR 66 CO 0.05 0.26 0.33 -0.59 -1.34 0.00 0.00 175.55 174.26 2bsd s PHE 67 N 0.11 0.00 -0.06 4.97 -0.12 -0.33 -2.04 117.98 120.51 2bsd s PHE 67 Ca 0.34 -0.36 0.05 0.00 -0.05 0.00 0.00 56.93 56.91 2bsd s PHE 67 Cb -0.19 0.12 -0.01 0.00 -0.63 0.00 0.00 43.02 42.32 2bsd s PHE 67 CO 0.19 -0.67 -0.22 -1.21 -0.05 0.00 0.00 175.22 173.25 2bsd s GLU 68 N -3.85 2.32 -0.47 1.99 2.02 0.13 -0.95 118.70 119.89 2bsd s GLU 68 Ca 0.06 -0.80 -0.16 0.00 0.02 0.00 0.00 54.97 54.09 2bsd s GLU 68 Cb 0.03 -1.96 0.06 0.00 0.10 0.00 0.00 34.13 32.36 2bsd s GLU 68 CO -0.09 0.32 0.42 -0.51 0.02 0.00 0.00 175.26 175.42 2bsd s LEU 69 N -0.05 5.39 -0.33 1.80 1.43 0.13 -0.97 118.68 126.08 2bsd s LEU 69 Ca -0.05 -1.15 0.03 0.00 -1.03 0.00 0.00 54.13 51.94 2bsd s LEU 69 Cb -0.13 -2.24 0.09 0.00 0.03 0.00 0.00 46.19 43.94 2bsd s LEU 69 CO 0.04 -0.66 0.03 -0.76 0.23 0.00 0.00 176.35 175.23 2bsd s LEU 70 N 1.85 4.54 -1.25 1.79 1.43 -0.07 -1.68 118.68 125.30 2bsd s LEU 70 Ca 0.07 -2.01 -0.12 0.00 -1.03 0.00 0.00 54.13 51.04 2bsd s LEU 70 Cb -0.22 -1.62 -0.00 0.00 0.03 0.00 0.00 46.19 44.37 2bsd s LEU 70 CO 0.09 -0.35 0.66 0.59 0.23 0.00 0.00 176.35 177.56 2bsd n ASN 71 N 4.30 -3.15 -4.35 2.29 5.03 -0.20 -0.72 115.26 118.47 2bsd n ASN 71 Ca 0.00 -0.99 -0.37 0.00 0.87 0.00 0.00 54.58 54.09 2bsd n ASN 71 Cb 0.42 -3.34 -0.13 0.00 -1.02 0.00 0.00 39.78 35.71 2bsd n ASN 71 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2bsd s GLU 72 N -6.18 3.22 -0.19 3.52 2.56 -0.60 -2.14 118.70 118.88 2bsd s GLU 72 Ca 0.26 -0.76 -0.11 0.00 0.00 0.00 0.00 54.97 54.36 2bsd s GLU 72 Cb -0.09 -3.28 -0.05 0.00 2.00 0.00 0.00 34.13 32.71 2bsd s GLU 72 CO 0.87 -0.36 0.16 0.99 -0.56 0.00 0.00 175.26 176.36 2bsd s THR 73 N 1.50 5.39 -0.16 -1.70 2.01 -1.26 -1.11 115.64 120.31 2bsd s THR 73 Ca 0.04 0.26 -0.05 0.00 0.31 0.00 0.00 61.69 62.24 2bsd s THR 73 Cb -0.16 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 68.82 2bsd s THR 73 CO 0.01 0.44 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.69 2bsd s VAL 74 N 0.33 4.22 0.17 3.82 1.01 -0.49 -4.98 120.40 124.49 2bsd s VAL 74 Ca 0.10 -0.24 -0.27 0.00 0.00 0.00 0.00 61.98 61.57 2bsd s VAL 74 Cb -0.11 -2.87 -0.08 0.00 0.00 0.00 0.00 36.38 33.32 2bsd s VAL 74 CO -0.01 0.49 0.83 0.00 0.00 0.00 0.00 175.10 176.40 2bsd s ALA 75 N 0.32 3.41 0.24 5.51 0.00 -1.26 -1.74 121.76 128.23 2bsd s ALA 75 Ca -0.01 0.43 0.10 0.00 0.00 0.00 0.00 51.96 52.47 2bsd s ALA 75 Cb -0.13 -3.04 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 2bsd s ALA 75 CO 0.02 0.24 -0.06 -0.51 0.00 0.00 0.00 175.76 175.45 2bsd s LEU 76 N -1.01 3.06 -0.02 0.00 1.43 0.39 -4.55 118.68 117.97 2bsd s LEU 76 Ca 0.38 -0.66 -0.15 0.00 -1.03 0.00 0.00 54.13 52.67 2bsd s LEU 76 Cb -0.24 -1.63 -0.05 0.00 0.03 0.00 0.00 46.19 44.30 2bsd s LEU 76 CO 0.28 0.04 0.40 -1.59 0.23 0.00 0.00 176.35 175.71 2bsd s LYS 77 N -3.36 3.96 0.45 1.70 -2.85 -1.26 -4.88 119.74 113.50 2bsd s LYS 77 Ca 0.29 0.39 -0.23 0.00 -1.00 0.00 0.00 55.97 55.43 2bsd s LYS 77 Cb -0.07 -3.25 -0.08 0.00 -2.06 0.00 0.00 37.83 32.38 2bsd s LYS 77 CO 0.18 0.63 1.12 0.20 0.10 0.00 0.00 175.35 177.59 2bsd s GLY 78 N -0.88 2.74 -1.32 0.59 0.00 -1.26 -4.09 107.32 103.10 2bsd s GLY 78 Ca 0.23 0.85 -0.05 0.00 0.00 0.00 0.00 44.72 45.75 2bsd s GLY 78 CO 0.13 1.28 1.01 1.22 0.00 0.00 0.00 173.10 176.74 2bsd n ASP 79 N -0.44 -3.75 -3.11 1.64 8.00 -0.14 -4.94 116.55 113.81 2bsd n ASP 79 Ca 0.07 -0.65 -0.11 0.00 0.71 0.00 0.00 54.79 54.81 2bsd n ASP 79 Cb 0.49 -4.74 -0.00 0.00 -0.02 0.00 0.00 41.12 36.85 2bsd n ASP 79 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2bsd s SER 80 N -3.86 0.28 -0.34 -2.24 1.04 -1.19 -4.95 113.70 102.43 2bsd s SER 80 Ca 0.29 -1.22 -0.13 0.00 0.48 0.00 0.00 55.95 55.37 2bsd s SER 80 Cb -0.14 0.78 -0.02 0.00 0.10 0.00 0.00 66.02 66.75 2bsd s SER 80 CO 0.76 -1.53 0.26 -0.69 0.98 0.00 0.00 173.24 173.02 2bsd s VAL 81 N -2.68 5.27 -0.24 5.02 1.01 -1.26 -1.01 120.40 126.50 2bsd s VAL 81 Ca 0.20 -0.19 -0.13 0.00 0.00 0.00 0.00 61.98 61.87 2bsd s VAL 81 Cb -0.04 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2bsd s VAL 81 CO 0.14 -0.03 0.27 0.20 0.00 0.00 0.00 175.10 175.68 2bsd s ASN 82 N 1.72 6.22 -0.38 3.32 0.01 0.14 -4.65 114.94 121.33 2bsd s ASN 82 Ca 0.07 0.25 -0.15 0.00 -0.71 0.00 0.00 52.86 52.31 2bsd s ASN 82 Cb -0.17 -2.16 0.00 0.00 0.41 0.00 0.00 41.25 39.33 2bsd s ASN 82 CO 0.11 -0.03 0.35 -0.31 -1.51 0.00 0.00 177.10 175.70 2bsd s TYR 83 N 1.38 3.21 -0.24 2.20 2.02 -0.22 0.37 117.35 126.06 2bsd s TYR 83 Ca 0.12 -0.30 -0.23 0.00 -0.37 0.00 0.00 57.07 56.29 2bsd s TYR 83 Cb -0.15 -2.68 -0.01 0.00 -0.40 0.00 0.00 41.96 38.73 2bsd s TYR 83 CO 0.07 -0.53 0.74 0.42 -1.57 0.00 0.00 175.55 174.68 2bsd s ILE 84 N 1.91 4.90 -0.00 2.71 -1.09 0.45 -1.08 121.20 129.01 2bsd s ILE 84 Ca 0.09 1.38 0.04 0.00 -2.23 0.00 0.00 60.65 59.93 2bsd s ILE 84 Cb -0.17 -4.04 -0.03 0.00 -1.58 0.00 0.00 42.46 36.64 2bsd s ILE 84 CO 0.12 -0.02 -0.09 -1.00 -1.23 0.00 0.00 174.94 172.71 2bsd s HIS 85 N 2.66 2.83 -0.18 3.97 3.76 0.22 -1.11 115.29 127.44 2bsd s HIS 85 Ca 0.31 -0.08 -0.14 0.00 -0.15 0.00 0.00 55.06 55.01 2bsd s HIS 85 Cb -0.15 -1.60 -0.05 0.00 1.11 0.00 0.00 32.58 31.89 2bsd s HIS 85 CO 0.08 0.34 0.28 0.00 -0.85 0.00 0.00 174.74 174.59 2bsd s ALA 86 N -0.95 3.59 -0.16 -1.40 0.00 0.18 -2.08 121.76 120.94 2bsd s ALA 86 Ca 0.16 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.59 2bsd s ALA 86 Cb -0.11 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.61 2bsd s ALA 86 CO 0.06 -0.00 -0.16 -0.80 0.00 0.00 0.00 175.76 174.85 2bsd s ASN 87 N 0.63 3.52 -0.24 0.00 0.01 0.26 -1.53 114.94 117.58 2bsd s ASN 87 Ca 0.15 -0.52 -0.01 0.00 -0.71 0.00 0.00 52.86 51.77 2bsd s ASN 87 Cb -0.13 -1.54 0.03 0.00 0.41 0.00 0.00 41.25 40.01 2bsd s ASN 87 CO 0.04 0.06 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.98 2bsd s ILE 88 N 0.98 2.79 -0.31 0.60 1.09 0.61 -1.20 121.20 125.76 2bsd s ILE 88 Ca -0.02 -1.04 0.03 0.00 -1.10 0.00 0.00 60.65 58.52 2bsd s ILE 88 Cb -0.15 -2.41 0.08 0.00 -1.06 0.00 0.00 42.46 38.92 2bsd s ILE 88 CO -0.03 0.21 -0.01 -0.62 -0.10 0.00 0.00 174.94 174.39 2bsd s ASP 89 N 1.31 4.59 0.44 3.58 -1.08 0.76 -1.94 116.67 124.34 2bsd s ASP 89 Ca 0.00 -1.82 0.23 0.00 -0.52 0.00 0.00 52.55 50.43 2bsd s ASP 89 Cb -0.17 -1.56 1.01 0.00 -1.46 0.00 0.00 42.92 40.75 2bsd s ASP 89 CO -0.05 -0.30 1.88 -0.07 0.52 0.00 0.00 175.17 177.15 2bsd h LEU 90 N 7.70 0.00 -1.99 -1.34 3.38 -1.82 -2.26 115.31 118.96 2bsd h LEU 90 Ca -0.10 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2bsd h LEU 90 Cb 1.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 2bsd h LEU 90 CO 0.49 0.24 -0.10 0.71 0.09 0.00 0.00 178.44 179.88 2bsd h THR 91 N 0.00 0.70 -1.04 0.22 1.35 -1.95 -3.33 112.91 108.86 2bsd h THR 91 Ca -0.00 -0.40 -0.71 0.00 -0.55 0.00 0.00 66.41 64.74 2bsd h THR 91 Cb 0.64 1.24 -0.10 0.00 -1.73 0.00 0.00 68.15 68.20 2bsd h THR 91 CO 0.03 0.10 2.20 0.00 -0.25 0.00 0.00 175.52 177.60 2bsd n GLN 92 N -3.88 3.22 -0.24 4.72 1.13 -0.85 -4.86 117.38 116.62 2bsd n GLN 92 Ca -0.02 -3.29 0.01 0.00 -1.94 0.00 0.00 57.00 51.75 2bsd n GLN 92 Cb 0.19 -3.25 0.08 0.00 0.11 0.00 0.00 30.24 27.37 2bsd n GLN 92 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 2bsd h THR 93 N 4.69 0.31 -0.06 5.09 2.02 -1.83 -0.98 112.91 122.14 2bsd h THR 93 Ca 0.44 -0.00 -0.20 0.00 0.77 0.00 0.00 66.41 67.42 2bsd h THR 93 Cb 0.78 0.31 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 2bsd h THR 93 CO 1.54 0.00 -0.79 0.00 0.37 0.00 0.00 175.52 176.64 2bsd h ALA 94 N 1.69 0.52 -2.18 6.16 0.00 -1.94 -3.38 119.26 120.13 2bsd h ALA 94 Ca 0.33 -0.63 -0.58 0.00 0.00 0.00 0.00 54.91 54.03 2bsd h ALA 94 Cb 0.51 -0.05 -0.39 0.00 0.00 0.00 0.00 17.79 17.86 2bsd h ALA 94 CO -0.71 0.77 -1.01 0.09 0.00 0.00 0.00 179.25 178.39 2bsd n ASN 95 N -3.82 0.33 0.28 0.00 3.02 -0.93 -4.99 115.26 109.16 2bsd n ASN 95 Ca -0.05 -2.66 0.17 0.00 -0.03 0.00 0.00 54.58 52.01 2bsd n ASN 95 Cb 0.74 -0.62 0.68 0.00 -0.61 0.00 0.00 39.78 39.97 2bsd n ASN 95 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2bsd h PRO 96 N 4.61 0.00 -5.60 3.52 0.13 -1.39 -3.43 132.00 129.84 2bsd h PRO 96 Ca 0.15 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.61 2bsd h PRO 96 Cb 0.87 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.74 2bsd h PRO 96 CO 0.47 0.01 -0.76 0.08 -0.23 0.00 0.00 178.00 177.57 2bsd s VAL 97 N -3.67 3.10 0.07 1.56 1.01 -1.26 -0.17 120.40 121.04 2bsd s VAL 97 Ca 0.01 -0.66 -0.00 0.00 0.00 0.00 0.00 61.98 61.32 2bsd s VAL 97 Cb 0.09 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 2bsd s VAL 97 CO 0.55 0.54 -0.02 -0.94 0.00 0.00 0.00 175.10 175.23 2bsd s SER 98 N 0.04 0.59 0.03 3.32 1.04 -0.34 -4.98 113.70 113.40 2bsd s SER 98 Ca -0.04 -1.03 0.05 0.00 0.48 0.00 0.00 55.95 55.41 2bsd s SER 98 Cb -0.14 0.19 -0.03 0.00 0.10 0.00 0.00 66.02 66.14 2bsd s SER 98 CO 0.04 -0.59 -0.12 -0.76 0.98 0.00 0.00 173.24 172.79 2bsd s LEU 99 N -2.96 2.91 0.03 2.42 1.43 -1.26 -0.58 118.68 120.67 2bsd s LEU 99 Ca 0.10 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 2bsd s LEU 99 Cb 0.07 -1.69 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 2bsd s LEU 99 CO -0.07 0.26 -0.04 -0.94 0.23 0.00 0.00 176.35 175.78 2bsd s SER 100 N -1.54 0.41 -0.18 2.29 1.04 -0.88 -4.99 113.70 109.85 2bsd s SER 100 Ca 0.17 -0.56 -0.03 0.00 0.48 0.00 0.00 55.95 56.01 2bsd s SER 100 Cb -0.11 0.09 -0.02 0.00 0.10 0.00 0.00 66.02 66.09 2bsd s SER 100 CO 0.07 -0.31 -0.05 0.00 0.98 0.00 0.00 173.24 173.94 2bsd s ALA 101 N -1.67 2.88 0.15 5.32 0.00 -1.26 -0.61 121.76 126.56 2bsd s ALA 101 Ca -0.12 -0.96 0.03 0.00 0.00 0.00 0.00 51.96 50.91 2bsd s ALA 101 Cb -0.08 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.43 2bsd s ALA 101 CO -0.01 -0.01 -0.06 -1.21 0.00 0.00 0.00 175.76 174.46 2bsd s GLU 102 N 0.77 1.04 0.00 0.00 2.02 -0.24 -4.91 118.70 117.38 2bsd s GLU 102 Ca -0.02 -1.46 0.28 0.00 0.02 0.00 0.00 54.97 53.79 2bsd s GLU 102 Cb -0.15 -0.45 1.29 0.00 0.10 0.00 0.00 34.13 34.92 2bsd s GLU 102 CO 0.02 -0.01 1.93 0.25 0.02 0.00 0.00 175.26 177.48 2bsd n THR 103 N -0.19 0.07 -3.86 3.63 -2.24 -1.26 -1.05 114.28 109.37 2bsd n THR 103 Ca -0.09 0.02 -0.09 0.00 -2.27 0.00 0.00 64.05 61.61 2bsd n THR 103 Cb 0.61 -0.54 -0.06 0.00 -2.10 0.00 0.00 70.33 68.25 2bsd n THR 103 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bsd s ALA 104 N -2.85 -0.32 -0.44 6.98 0.00 -1.26 -4.90 121.76 118.98 2bsd s ALA 104 Ca 0.18 -0.61 -0.28 0.00 0.00 0.00 0.00 51.96 51.25 2bsd s ALA 104 Cb 0.19 0.74 -0.00 0.00 0.00 0.00 0.00 23.12 24.05 2bsd s ALA 104 CO 0.49 -0.64 1.59 1.21 0.00 0.00 0.00 175.76 178.42 2bsd s ASN 105 N -2.91 6.02 -0.25 0.00 3.84 -1.26 -4.72 114.94 115.66 2bsd s ASN 105 Ca 0.11 0.83 0.12 0.00 0.21 0.00 0.00 52.86 54.13 2bsd s ASN 105 Cb 0.03 -2.54 0.53 0.00 -0.55 0.00 0.00 41.25 38.73 2bsd s ASN 105 CO -0.05 -1.69 1.48 0.59 -2.79 0.00 0.00 177.10 174.65 2bsd n ASN 106 N 9.92 3.23 -4.61 -4.21 3.02 -1.26 -5.02 115.26 116.32 2bsd n ASN 106 Ca 0.18 -3.42 -0.51 0.00 -0.03 0.00 0.00 54.58 50.80 2bsd n ASN 106 Cb 0.48 -0.61 -0.06 0.00 -0.61 0.00 0.00 39.78 38.98 2bsd n ASN 106 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2bsd n SER 107 N -0.84 1.89 -0.08 6.41 7.64 -1.26 -4.83 113.62 122.55 2bsd n SER 107 Ca 0.30 1.11 0.02 0.00 1.01 0.00 0.00 58.87 61.31 2bsd n SER 107 Cb 1.02 -1.23 -0.01 0.00 -1.01 0.00 0.00 64.21 62.99 2bsd n SER 107 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2bsd n ASN 108 N 2.74 0.69 -1.99 6.43 0.23 -0.78 -5.01 115.26 117.56 2bsd n ASN 108 Ca 0.18 -0.84 -0.20 0.00 -0.53 0.00 0.00 54.58 53.19 2bsd n ASN 108 Cb 0.20 0.60 -0.05 0.00 -2.08 0.00 0.00 39.78 38.46 2bsd n ASN 108 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bsd n GLY 109 N 0.78 0.71 3.73 4.83 0.00 -1.26 -4.93 105.19 109.04 2bsd n GLY 109 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2bsd n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bsd s VAL 110 N -2.85 3.14 -1.18 1.61 1.01 -1.26 -4.83 120.40 116.04 2bsd s VAL 110 Ca 0.00 0.90 -0.17 0.00 0.00 0.00 0.00 61.98 62.71 2bsd s VAL 110 Cb 0.00 -3.57 0.12 0.00 0.00 0.00 0.00 36.38 32.93 2bsd s VAL 110 CO 0.00 0.11 1.48 -0.62 0.00 0.00 0.00 175.10 176.08 2bsd s ASP 111 N 0.60 6.88 0.00 3.32 -1.08 -1.26 -4.67 116.67 120.46 2bsd s ASP 111 Ca 0.60 -2.54 0.24 0.00 -0.52 0.00 0.00 52.55 50.33 2bsd s ASP 111 Cb -0.38 -2.47 1.01 0.00 -1.46 0.00 0.00 42.92 39.63 2bsd s ASP 111 CO 0.36 -1.00 1.76 2.30 0.52 0.00 0.00 175.17 179.11 2bsd n ILE 112 N 5.51 0.37 0.33 4.11 -0.00 -1.26 -1.97 119.36 126.45 2bsd n ILE 112 Ca 0.38 0.09 0.12 0.00 -0.00 0.00 0.00 62.75 63.34 2bsd n ILE 112 Cb 0.45 -0.69 0.12 0.00 -0.00 0.00 0.00 39.64 39.53 2bsd n ILE 112 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.55 177.33 2bsd h ASN 113 N 0.00 0.00 0.00 7.28 2.35 -1.90 -3.38 115.58 119.94 2bsd h ASN 113 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 2bsd h ASN 113 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2bsd h ASN 113 CO 0.00 0.04 -0.29 0.59 -1.65 0.00 0.00 177.43 176.12 2bsd n ASN 114 N -2.52 1.07 -0.80 5.81 3.02 -1.17 -4.82 115.26 115.84 2bsd n ASN 114 Ca 0.02 -0.42 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 2bsd n ASN 114 Cb 0.50 1.02 0.00 0.00 -0.61 0.00 0.00 39.78 40.68 2bsd n ASN 114 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bsd n GLY 115 N 1.34 3.02 4.00 7.41 0.00 -0.83 -5.14 105.19 114.99 2bsd n GLY 115 Ca 0.00 -1.22 -0.18 0.00 0.00 0.00 0.00 46.02 44.62 2bsd n GLY 115 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bsd s SER 116 N -0.48 5.77 0.00 1.61 1.04 -1.26 -4.51 113.70 115.87 2bsd s SER 116 Ca 0.00 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.18 2bsd s SER 116 Cb 0.00 -0.97 0.00 0.00 0.10 0.00 0.00 66.02 65.15 2bsd s SER 116 CO 0.00 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.18 2bsd n GLY 117 N -1.81 1.72 3.31 7.32 0.00 -1.26 -4.83 105.19 109.65 2bsd n GLY 117 Ca 0.04 -2.10 -0.35 0.00 0.00 0.00 0.00 46.02 43.62 2bsd n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bsd s VAL 118 N -1.42 3.26 -0.09 1.61 1.01 -1.26 -4.65 120.40 118.86 2bsd s VAL 118 Ca 0.00 -0.54 -0.27 0.00 0.00 0.00 0.00 61.98 61.17 2bsd s VAL 118 Cb 0.00 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 2bsd s VAL 118 CO 0.00 0.45 0.89 -0.22 0.00 0.00 0.00 175.10 176.21 2bsd s LEU 119 N 1.27 4.26 -0.15 3.92 2.96 -0.82 -4.72 118.68 125.40 2bsd s LEU 119 Ca 0.03 1.38 0.01 0.00 -0.22 0.00 0.00 54.13 55.33 2bsd s LEU 119 Cb -0.14 -3.37 -0.00 0.00 0.50 0.00 0.00 46.19 43.18 2bsd s LEU 119 CO -0.03 -0.33 -0.16 -0.54 -1.32 0.00 0.00 176.35 173.98 2bsd s LYS 120 N 1.60 3.19 -0.05 1.98 1.02 -1.26 -0.29 119.74 125.93 2bsd s LYS 120 Ca 0.44 -0.76 0.02 0.00 0.02 0.00 0.00 55.97 55.68 2bsd s LYS 120 Cb -0.18 -2.60 0.02 0.00 -0.52 0.00 0.00 37.83 34.54 2bsd s LYS 120 CO 0.18 0.01 -0.07 0.08 -0.92 0.00 0.00 175.35 174.63 2bsd s VAL 121 N 0.82 0.75 0.03 3.17 1.01 -0.58 -1.88 120.40 123.72 2bsd s VAL 121 Ca -0.05 -0.27 -0.25 0.00 0.00 0.00 0.00 61.98 61.41 2bsd s VAL 121 Cb -0.15 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 2bsd s VAL 121 CO -0.00 0.27 0.76 0.00 0.00 0.00 0.00 175.10 176.12 2bsd n PHE 123 N 2.92 0.00 -3.90 0.00 1.16 -0.27 -4.85 117.46 112.53 2bsd n PHE 123 Ca -0.02 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.45 2bsd n PHE 123 Cb 0.50 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.27 2bsd n PHE 123 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2bsd s ASP 124 N -1.04 0.08 -0.16 5.98 2.15 -1.18 -1.51 116.67 120.98 2bsd s ASP 124 Ca 0.00 -0.26 0.01 0.00 0.43 0.00 0.00 52.55 52.73 2bsd s ASP 124 Cb 0.00 0.18 0.02 0.00 -0.30 0.00 0.00 42.92 42.82 2bsd s ASP 124 CO 0.00 -0.32 -0.15 -0.63 -0.17 0.00 0.00 175.17 173.89 2bsd s ILE 125 N -1.28 1.71 -0.15 4.11 1.01 0.30 -0.41 121.20 126.49 2bsd s ILE 125 Ca -0.14 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.77 2bsd s ILE 125 Cb -0.08 -1.60 0.03 0.00 0.01 0.00 0.00 42.46 40.82 2bsd s ILE 125 CO 0.01 0.46 -0.12 -0.69 0.00 0.00 0.00 174.94 174.60 2bsd s VAL 126 N 1.43 1.47 -0.15 2.92 1.01 0.16 -0.54 120.40 126.70 2bsd s VAL 126 Ca 0.05 -0.64 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 2bsd s VAL 126 Cb -0.13 -1.44 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 2bsd s VAL 126 CO -0.11 0.37 0.19 -0.89 0.00 0.00 0.00 175.10 174.66 2bsd s THR 127 N 1.52 5.39 0.22 3.92 2.01 0.49 0.28 115.64 129.45 2bsd s THR 127 Ca 0.04 0.33 0.11 0.00 0.31 0.00 0.00 61.69 62.48 2bsd s THR 127 Cb -0.13 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 2bsd s THR 127 CO -0.10 0.50 -0.16 0.42 -0.69 0.00 0.00 174.62 174.59 2bsd s THR 128 N -0.21 2.74 0.00 -0.82 -4.23 -0.18 -0.56 115.64 112.37 2bsd s THR 128 Ca 0.14 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 2bsd s THR 128 Cb -0.12 -2.37 0.00 0.00 1.34 0.00 0.00 72.50 71.34 2bsd s THR 128 CO 0.03 -0.20 0.00 -1.54 -0.54 0.00 0.00 174.62 172.36 2bsd n SER 129 N -0.12 0.00 0.24 3.99 3.41 0.99 -3.18 113.62 118.94 2bsd n SER 129 Ca -0.10 -0.24 0.12 0.00 -0.26 0.00 0.00 58.87 58.39 2bsd n SER 129 Cb 0.57 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 65.02 2bsd n SER 129 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2bsd h GLY 130 N 0.00 0.00 0.00 5.00 0.00 -1.96 -0.35 103.07 105.76 2bsd h GLY 130 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bsd h GLY 130 CO 0.00 0.00 -0.40 -1.30 0.00 0.00 0.00 176.54 174.84 2bsd n THR 131 N -3.30 0.00 -3.82 4.70 -2.24 -1.26 -4.83 114.28 103.52 2bsd n THR 131 Ca 0.00 -0.21 -0.06 0.00 -2.27 0.00 0.00 64.05 61.52 2bsd n THR 131 Cb 0.41 0.71 0.01 0.00 -2.10 0.00 0.00 70.33 69.35 2bsd n THR 131 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2bsd s GLY 132 N -1.22 0.07 0.02 3.38 0.00 -1.26 -3.82 107.32 104.49 2bsd s GLY 132 Ca 0.00 -0.35 -0.30 0.00 0.00 0.00 0.00 44.72 44.07 2bsd s GLY 132 CO 0.00 0.50 1.01 0.14 0.00 0.00 0.00 173.10 174.75 2bsd s VAL 133 N -2.82 4.72 -0.11 1.40 1.01 -1.23 -0.01 120.40 123.35 2bsd s VAL 133 Ca 0.15 1.97 0.14 0.00 0.00 0.00 0.00 61.98 64.25 2bsd s VAL 133 Cb -0.04 -4.26 -0.20 0.00 0.00 0.00 0.00 36.38 31.87 2bsd s VAL 133 CO 0.07 0.17 0.14 0.35 0.00 0.00 0.00 175.10 175.82 2bsd n THR 134 N 3.80 0.75 -3.54 3.92 -2.24 0.27 -4.88 114.28 112.36 2bsd n THR 134 Ca 0.06 -0.56 -0.16 0.00 -2.27 0.00 0.00 64.05 61.12 2bsd n THR 134 Cb 0.50 -0.40 -0.06 0.00 -2.10 0.00 0.00 70.33 68.27 2bsd n THR 134 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2bsd s SER 135 N -4.58 -0.57 0.16 3.42 1.04 -1.18 -5.02 113.70 106.97 2bsd s SER 135 Ca -0.07 0.65 0.08 0.00 0.48 0.00 0.00 55.95 57.09 2bsd s SER 135 Cb 0.06 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 2bsd s SER 135 CO 0.63 -0.51 -0.17 0.42 0.98 0.00 0.00 173.24 174.59 2bsd s THR 136 N -1.09 1.68 -0.18 2.02 -4.23 -1.26 -0.38 115.64 112.20 2bsd s THR 136 Ca -0.08 -1.91 -0.07 0.00 -1.18 0.00 0.00 61.69 58.45 2bsd s THR 136 Cb -0.00 -1.80 0.08 0.00 1.34 0.00 0.00 72.50 72.12 2bsd s THR 136 CO 0.07 -0.38 0.39 -0.75 -0.54 0.00 0.00 174.62 173.40 2bsd s LYS 137 N -2.90 0.31 0.60 3.99 2.20 0.30 -5.01 119.74 119.24 2bsd s LYS 137 Ca 0.15 0.91 -0.15 0.00 -0.36 0.00 0.00 55.97 56.52 2bsd s LYS 137 Cb -0.05 0.17 -0.03 0.00 -1.51 0.00 0.00 37.83 36.41 2bsd s LYS 137 CO 0.06 -0.23 1.05 -1.25 -0.36 0.00 0.00 175.35 174.62 2bsd s PRO 138 N 2.23 3.31 0.23 4.03 0.04 -1.26 -0.53 135.00 143.04 2bsd s PRO 138 Ca -0.04 1.17 -0.29 0.00 0.04 0.00 0.00 61.00 61.89 2bsd s PRO 138 Cb -0.11 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.31 2bsd s PRO 138 CO -0.12 -0.81 0.90 0.42 0.04 0.00 0.00 177.00 177.42 2bsd s ILE 139 N -2.51 4.15 0.34 0.56 -1.09 -0.57 -4.84 121.20 117.25 2bsd s ILE 139 Ca 0.63 1.98 -0.28 0.00 -2.23 0.00 0.00 60.65 60.74 2bsd s ILE 139 Cb -0.16 -4.27 -0.12 0.00 -1.58 0.00 0.00 42.46 36.34 2bsd s ILE 139 CO 0.38 0.49 1.33 0.55 -1.23 0.00 0.00 174.94 176.46 2bsd n VAL 140 N 1.47 1.91 -3.32 2.92 3.14 -1.26 -4.95 118.33 118.24 2bsd n VAL 140 Ca -0.03 -0.48 -0.42 0.00 -2.96 0.00 0.00 64.34 60.45 2bsd n VAL 140 Cb 0.48 -1.63 -0.09 0.00 -1.06 0.00 0.00 33.84 31.54 2bsd n VAL 140 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2bsd s GLN 141 N -1.79 3.36 -0.19 1.45 -0.21 -1.26 -4.60 119.66 116.42 2bsd s GLN 141 Ca 0.56 -0.52 -0.16 0.00 0.02 0.00 0.00 55.36 55.27 2bsd s GLN 141 Cb -0.56 -3.88 -0.04 0.00 1.00 0.00 0.00 33.01 29.53 2bsd s GLN 141 CO 0.61 -0.71 0.38 0.99 -2.12 0.00 0.00 175.29 174.44 2bsd s THR 142 N 2.18 5.22 -0.34 -0.19 2.01 -1.26 -5.04 115.64 118.22 2bsd s THR 142 Ca 0.14 0.68 -0.11 0.00 0.31 0.00 0.00 61.69 62.71 2bsd s THR 142 Cb -0.16 -3.71 0.00 0.00 0.01 0.00 0.00 72.50 68.64 2bsd s THR 142 CO 0.13 0.28 0.19 -0.44 -0.69 0.00 0.00 174.62 174.10 2bsd s SER 143 N 0.91 5.73 -0.46 3.53 0.01 -1.26 -4.56 113.70 117.60 2bsd s SER 143 Ca 0.19 -0.66 -0.17 0.00 1.31 0.00 0.00 55.95 56.62 2bsd s SER 143 Cb -0.14 -2.04 0.05 0.00 0.21 0.00 0.00 66.02 64.09 2bsd s SER 143 CO 0.07 -0.27 0.43 -0.89 0.41 0.00 0.00 173.24 173.00 2bsd s THR 144 N 1.62 5.13 0.27 1.44 2.01 0.36 -5.05 115.64 121.43 2bsd s THR 144 Ca 0.04 -0.71 0.11 0.00 0.31 0.00 0.00 61.69 61.43 2bsd s THR 144 Cb -0.18 -4.11 -0.05 0.00 0.01 0.00 0.00 72.50 68.17 2bsd s THR 144 CO 0.07 -0.54 -0.17 -0.76 -0.69 0.00 0.00 174.62 172.53 2bsd s LEU 145 N 1.96 2.60 0.00 4.42 1.43 -1.26 -4.61 118.68 123.21 2bsd s LEU 145 Ca 0.08 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.12 2bsd s LEU 145 Cb -0.21 -0.98 0.00 0.00 0.03 0.00 0.00 46.19 45.03 2bsd s LEU 145 CO 0.10 -0.05 0.00 -0.67 0.23 0.00 0.00 176.35 175.96 2bsd n ASP 146 N -0.60 0.00 -4.19 2.29 -0.08 -1.26 -4.99 116.55 107.72 2bsd n ASP 146 Ca -0.06 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.90 2bsd n ASP 146 Cb 0.61 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 43.90 2bsd n ASP 146 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2bsd s SER 147 N -1.00 3.12 -0.13 1.67 0.15 -1.26 -5.11 113.70 111.13 2bsd s SER 147 Ca 0.00 -0.58 -0.03 0.00 0.70 0.00 0.00 55.95 56.04 2bsd s SER 147 Cb 0.00 -1.44 -0.03 0.00 -1.71 0.00 0.00 66.02 62.85 2bsd s SER 147 CO 0.00 0.11 -0.04 -0.63 1.20 0.00 0.00 173.24 173.88 2bsd s ILE 148 N 0.63 3.92 -0.15 6.45 1.01 -1.26 -5.10 121.20 126.70 2bsd s ILE 148 Ca -0.12 -0.36 0.01 0.00 0.00 0.00 0.00 60.65 60.18 2bsd s ILE 148 Cb -0.16 -2.69 -0.00 0.00 0.01 0.00 0.00 42.46 39.61 2bsd s ILE 148 CO 0.02 0.52 -0.16 -0.55 0.00 0.00 0.00 174.94 174.77 2bsd s SER 149 N 0.03 3.58 0.01 3.58 0.15 -1.26 -5.12 113.70 114.66 2bsd s SER 149 Ca 0.00 -0.48 -0.05 0.00 0.70 0.00 0.00 55.95 56.12 2bsd s SER 149 Cb -0.13 -1.54 -0.00 0.00 -1.71 0.00 0.00 66.02 62.63 2bsd s SER 149 CO 0.03 0.09 0.09 0.54 1.20 0.00 0.00 173.24 175.18 2bsd s VAL 150 N 0.78 0.09 -0.12 4.45 0.11 -1.26 -5.08 120.40 119.36 2bsd s VAL 150 Ca -0.06 -0.73 -0.16 0.00 -2.93 0.00 0.00 61.98 58.10 2bsd s VAL 150 Cb -0.15 -0.37 -0.15 0.00 -1.53 0.00 0.00 36.38 34.18 2bsd s VAL 150 CO 0.00 -0.40 0.44 0.78 -3.33 0.00 0.00 175.10 172.60 2bsd h ASN 151 N 4.46 -0.00 -4.98 3.54 2.35 -2.09 -3.48 115.58 115.37 2bsd h ASN 151 Ca -0.31 -0.55 -0.18 0.00 -0.55 0.00 0.00 56.30 54.71 2bsd h ASN 151 Cb 1.20 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 39.37 2bsd h ASN 151 CO 0.41 0.77 -0.70 -1.81 -1.65 0.00 0.00 177.43 174.45 2bsd s ASP 152 N -5.91 0.38 -0.01 5.81 1.01 -1.26 -5.16 116.67 111.53 2bsd s ASP 152 Ca -0.11 -0.60 0.00 0.00 0.71 0.00 0.00 52.55 52.56 2bsd s ASP 152 Cb -0.02 0.11 0.01 0.00 1.01 0.00 0.00 42.92 44.03 2bsd s ASP 152 CO 0.39 -0.34 0.00 -0.32 0.21 0.00 0.00 175.17 175.11 2bsd s MET 153 N -1.92 0.07 -0.12 8.23 -2.45 -1.26 -5.14 119.30 116.71 2bsd s MET 153 Ca -0.11 0.02 0.03 0.00 -1.25 0.00 0.00 55.69 54.39 2bsd s MET 153 Cb -0.07 -0.14 0.00 0.00 1.25 0.00 0.00 34.83 35.87 2bsd s MET 153 CO -0.02 -0.03 -0.23 -0.08 1.05 0.00 0.00 175.02 175.70 2bsd s THR 154 N 0.30 2.05 -0.14 10.11 -1.32 -1.26 -5.13 115.64 120.25 2bsd s THR 154 Ca -0.03 -0.99 -0.01 0.00 -1.21 0.00 0.00 61.69 59.45 2bsd s THR 154 Cb -0.04 -1.79 -0.02 0.00 -1.51 0.00 0.00 72.50 69.14 2bsd s THR 154 CO -0.01 0.55 -0.11 -0.69 -2.21 0.00 0.00 174.62 172.15 2bsd s VAL 155 N 0.56 3.19 -0.13 5.08 1.01 -1.26 -5.02 120.40 123.84 2bsd s VAL 155 Ca -0.13 -0.61 0.19 0.00 0.00 0.00 0.00 61.98 61.43 2bsd s VAL 155 Cb -0.17 -2.36 -0.19 0.00 0.00 0.00 0.00 36.38 33.66 2bsd s VAL 155 CO 0.04 0.51 0.61 -1.54 0.00 0.00 0.00 175.10 174.73 2bsd n SER 156 N 3.63 0.45 0.00 3.32 3.41 -1.26 -4.87 113.62 118.30 2bsd n SER 156 Ca -0.18 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2bsd n SER 156 Cb 0.52 0.89 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 2bsd n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bsd n GLY 157 N 1.39 0.25 3.02 5.00 0.00 -1.26 -5.14 105.19 108.45 2bsd n GLY 157 Ca -0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 2bsd n GLY 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bsd s SER 158 N -0.86 0.24 -0.23 1.61 0.01 -1.26 -5.13 113.70 108.08 2bsd s SER 158 Ca 0.00 -0.52 -0.11 0.00 1.31 0.00 0.00 55.95 56.62 2bsd s SER 158 Cb 0.00 0.13 -0.05 0.00 0.21 0.00 0.00 66.02 66.31 2bsd s SER 158 CO 0.00 -0.36 0.19 -0.63 0.41 0.00 0.00 173.24 172.86 2bsd s ILE 159 N -1.80 5.34 -0.31 1.44 1.01 -1.26 -5.08 121.20 120.54 2bsd s ILE 159 Ca -0.13 0.26 -0.14 0.00 0.00 0.00 0.00 60.65 60.64 2bsd s ILE 159 Cb -0.07 -3.53 -0.03 0.00 0.01 0.00 0.00 42.46 38.84 2bsd s ILE 159 CO -0.02 0.35 0.32 -0.62 0.00 0.00 0.00 174.94 174.96 2bsd s ASP 160 N 0.96 6.15 0.28 3.58 -1.08 -1.26 -5.08 116.67 120.22 2bsd s ASP 160 Ca 0.09 -0.10 0.09 0.00 -0.52 0.00 0.00 52.55 52.11 2bsd s ASP 160 Cb -0.13 -2.18 -0.04 0.00 -1.46 0.00 0.00 42.92 39.11 2bsd s ASP 160 CO 0.04 -0.24 0.04 0.68 0.52 0.00 0.00 175.17 176.21 2bsd s VAL 161 N 1.94 3.39 0.40 1.11 -7.23 -1.26 -5.10 120.40 113.65 2bsd s VAL 161 Ca 0.11 -1.84 -0.27 0.00 -1.81 0.00 0.00 61.98 58.17 2bsd s VAL 161 Cb -0.16 -2.90 -0.10 0.00 0.56 0.00 0.00 36.38 33.77 2bsd s VAL 161 CO 0.11 -0.33 1.35 -2.65 -0.31 0.00 0.00 175.10 173.28 2bsd n PRO 162 N -0.96 2.21 -4.27 4.82 -0.02 -1.26 -4.76 135.00 130.76 2bsd n PRO 162 Ca -0.06 0.78 -0.27 0.00 -2.02 0.00 0.00 63.50 61.93 2bsd n PRO 162 Cb 0.59 -2.48 -0.17 0.00 -0.02 0.00 0.00 33.50 31.43 2bsd n PRO 162 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bsd s VAL 163 N -1.15 1.25 0.01 -1.45 1.01 -1.26 -1.53 120.40 117.28 2bsd s VAL 163 Ca 0.58 -0.48 0.08 0.00 0.00 0.00 0.00 61.98 62.15 2bsd s VAL 163 Cb -0.51 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 2bsd s VAL 163 CO 0.60 0.39 -0.23 -1.10 0.00 0.00 0.00 175.10 174.77 2bsd s GLN 164 N 1.18 2.05 -0.02 2.72 -0.21 0.27 -4.99 119.66 120.67 2bsd s GLN 164 Ca -0.04 -0.97 0.05 0.00 0.02 0.00 0.00 55.36 54.42 2bsd s GLN 164 Cb -0.14 -2.10 -0.01 0.00 1.00 0.00 0.00 33.01 31.76 2bsd s GLN 164 CO -0.03 0.55 -0.16 0.99 -2.12 0.00 0.00 175.29 174.52 2bsd s THR 165 N -0.76 1.26 -0.13 -0.19 2.01 -1.26 -0.11 115.64 116.45 2bsd s THR 165 Ca 0.12 -0.66 -0.09 0.00 0.31 0.00 0.00 61.69 61.36 2bsd s THR 165 Cb -0.10 -1.06 0.04 0.00 0.01 0.00 0.00 72.50 71.39 2bsd s THR 165 CO 0.02 0.36 0.33 -0.22 -0.69 0.00 0.00 174.62 174.41 2bsd s LEU 166 N -0.23 0.49 -0.19 4.42 2.96 0.06 -5.01 118.68 121.17 2bsd s LEU 166 Ca 0.03 0.68 -0.04 0.00 -0.22 0.00 0.00 54.13 54.58 2bsd s LEU 166 Cb -0.08 1.08 -0.02 0.00 0.50 0.00 0.00 46.19 47.68 2bsd s LEU 166 CO 0.00 -0.14 -0.02 -0.89 -1.32 0.00 0.00 176.35 173.97 2bsd s THR 167 N 0.69 3.73 -0.21 3.68 2.01 -1.26 0.16 115.64 124.44 2bsd s THR 167 Ca -0.04 -0.39 -0.05 0.00 0.31 0.00 0.00 61.69 61.52 2bsd s THR 167 Cb -0.05 -2.68 -0.02 0.00 0.01 0.00 0.00 72.50 69.76 2bsd s THR 167 CO -0.04 0.44 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.63 2bsd s VAL 168 N 0.99 3.81 -1.09 3.82 1.01 0.62 -4.98 120.40 124.59 2bsd s VAL 168 Ca 0.01 -0.35 -0.19 0.00 0.00 0.00 0.00 61.98 61.44 2bsd s VAL 168 Cb -0.14 -2.73 0.10 0.00 0.00 0.00 0.00 36.38 33.60 2bsd s VAL 168 CO 0.01 0.42 1.42 -1.61 0.00 0.00 0.00 175.10 175.34 2bsd s GLU 169 N 1.21 3.76 0.38 2.72 0.41 -1.26 -1.29 118.70 124.63 2bsd s GLU 169 Ca 0.03 -1.73 0.28 0.00 -0.41 0.00 0.00 54.97 53.14 2bsd s GLU 169 Cb -0.15 -5.23 1.19 0.00 -1.78 0.00 0.00 34.13 28.17 2bsd s GLU 169 CO 0.01 -2.03 1.83 0.00 -0.49 0.00 0.00 175.26 174.59 2bsd h ALA 170 N 8.62 1.00 0.00 5.21 0.00 -1.59 -0.88 119.26 131.62 2bsd h ALA 170 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2bsd h ALA 170 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2bsd h ALA 170 CO 1.32 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.98 2bsd n GLY 171 N -0.11 2.21 2.83 0.00 0.00 -1.24 -0.95 105.19 107.92 2bsd n GLY 171 Ca 0.01 -1.96 -0.07 0.00 0.00 0.00 0.00 46.02 44.00 2bsd n GLY 171 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bsd n ASN 172 N 0.00 -5.73 0.00 1.61 3.02 -1.26 -1.52 115.26 111.38 2bsd n ASN 172 Ca 0.00 0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 2bsd n ASN 172 Cb 0.00 -3.88 0.00 0.00 -0.61 0.00 0.00 39.78 35.29 2bsd n ASN 172 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bsd n GLY 173 N 0.37 0.30 3.74 7.41 0.00 -1.24 -2.12 105.19 113.65 2bsd n GLY 173 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 2bsd n GLY 173 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bsd s LEU 174 N 0.00 4.52 -0.09 0.99 2.96 -0.58 -2.01 118.68 124.47 2bsd s LEU 174 Ca 0.00 1.94 0.04 0.00 -0.22 0.00 0.00 54.13 55.89 2bsd s LEU 174 Cb 0.00 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 43.09 2bsd s LEU 174 CO 0.00 -0.09 -0.23 -1.58 -1.32 0.00 0.00 176.35 173.12 2bsd s GLN 175 N -0.33 2.85 -0.17 1.98 0.74 -0.28 -1.93 119.66 122.52 2bsd s GLN 175 Ca 0.47 -0.85 -0.03 0.00 0.05 0.00 0.00 55.36 55.01 2bsd s GLN 175 Cb -0.26 -2.20 -0.02 0.00 1.10 0.00 0.00 33.01 31.63 2bsd s GLN 175 CO 0.32 0.20 -0.07 -0.51 -0.55 0.00 0.00 175.29 174.69 2bsd s LEU 176 N 0.27 2.94 -0.34 3.68 1.43 -0.41 -0.65 118.68 125.60 2bsd s LEU 176 Ca -0.16 -0.29 -0.06 0.00 -1.03 0.00 0.00 54.13 52.58 2bsd s LEU 176 Cb -0.17 -1.71 0.04 0.00 0.03 0.00 0.00 46.19 44.38 2bsd s LEU 176 CO 0.08 0.10 0.10 -1.58 0.23 0.00 0.00 176.35 175.28 2bsd s GLN 177 N 0.77 2.62 -0.17 1.70 0.74 -0.01 -0.27 119.66 125.04 2bsd s GLN 177 Ca -0.03 -1.18 -0.07 0.00 0.05 0.00 0.00 55.36 54.14 2bsd s GLN 177 Cb -0.15 -3.46 -0.04 0.00 1.10 0.00 0.00 33.01 30.46 2bsd s GLN 177 CO 0.02 -0.66 0.05 -0.51 -0.55 0.00 0.00 175.29 173.64 2bsd s LEU 178 N 1.40 3.79 -0.15 3.68 1.02 0.12 -0.88 118.68 127.67 2bsd s LEU 178 Ca -0.02 0.09 0.02 0.00 0.02 0.00 0.00 54.13 54.24 2bsd s LEU 178 Cb -0.19 -1.95 0.02 0.00 0.02 0.00 0.00 46.19 44.08 2bsd s LEU 178 CO 0.03 0.20 -0.19 -0.89 0.02 0.00 0.00 176.35 175.52 2bsd s THR 179 N 0.21 1.91 -0.10 5.49 2.01 -0.70 -0.76 115.64 123.70 2bsd s THR 179 Ca 0.04 -0.87 0.03 0.00 0.31 0.00 0.00 61.69 61.20 2bsd s THR 179 Cb -0.12 -1.71 -0.01 0.00 0.01 0.00 0.00 72.50 70.66 2bsd s THR 179 CO 0.01 0.52 -0.18 -0.75 -0.69 0.00 0.00 174.62 173.52 2bsd s LYS 180 N 1.07 3.00 0.02 4.92 2.20 0.84 -1.44 119.74 130.34 2bsd s LYS 180 Ca -0.02 -0.77 0.05 0.00 -0.36 0.00 0.00 55.97 54.87 2bsd s LYS 180 Cb -0.14 -2.42 -0.02 0.00 -1.51 0.00 0.00 37.83 33.74 2bsd s LYS 180 CO -0.06 0.31 -0.16 0.15 -0.36 0.00 0.00 175.35 175.23 2bsd s LYS 181 N 0.07 1.14 -1.45 4.03 1.02 -0.17 -0.56 119.74 123.82 2bsd s LYS 181 Ca -0.08 -0.69 0.00 0.00 0.02 0.00 0.00 55.97 55.22 2bsd s LYS 181 Cb -0.15 -1.15 0.00 0.00 -0.52 0.00 0.00 37.83 36.01 2bsd s LYS 181 CO 0.05 0.30 0.00 -1.71 -0.92 0.00 0.00 175.35 173.07 2bsd n ASN 182 N 2.25 -4.68 -2.14 2.83 5.15 -0.58 -1.71 115.26 116.37 2bsd n ASN 182 Ca -0.16 0.17 -0.12 0.00 -0.60 0.00 0.00 54.58 53.86 2bsd n ASN 182 Cb 0.54 -4.00 -0.02 0.00 -0.53 0.00 0.00 39.78 35.78 2bsd n ASN 182 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2bsd n ASN 183 N -1.67 -3.67 0.12 1.20 5.15 -1.26 -4.70 115.26 110.43 2bsd n ASN 183 Ca -0.19 0.23 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 2bsd n ASN 183 Cb 0.62 -3.21 0.00 0.00 -0.53 0.00 0.00 39.78 36.66 2bsd n ASN 183 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2bsd n ASP 184 N -1.41 -0.36 -4.66 1.20 2.03 -0.70 -4.80 116.55 107.85 2bsd n ASP 184 Ca -0.14 0.41 -0.41 0.00 0.52 0.00 0.00 54.79 55.17 2bsd n ASP 184 Cb 0.55 0.52 -0.05 0.00 -0.72 0.00 0.00 41.12 41.42 2bsd n ASP 184 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2bsd s LEU 185 N -6.51 4.16 -0.09 -2.67 2.96 -0.88 -0.60 118.68 115.05 2bsd s LEU 185 Ca 0.00 1.05 0.03 0.00 -0.22 0.00 0.00 54.13 54.99 2bsd s LEU 185 Cb 0.00 -3.11 -0.01 0.00 0.50 0.00 0.00 46.19 43.57 2bsd s LEU 185 CO 0.00 -0.36 -0.18 -0.69 -1.32 0.00 0.00 176.35 173.80 2bsd s VAL 186 N 2.10 2.66 -0.18 1.68 1.01 -0.10 -0.99 120.40 126.58 2bsd s VAL 186 Ca 0.35 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 2bsd s VAL 186 Cb -0.16 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 2bsd s VAL 186 CO 0.11 0.56 -0.11 -0.63 0.00 0.00 0.00 175.10 175.03 2bsd s ILE 187 N -0.05 2.99 -0.16 2.22 1.01 -0.52 -1.35 121.20 125.33 2bsd s ILE 187 Ca -0.04 -0.65 -0.08 0.00 0.00 0.00 0.00 60.65 59.87 2bsd s ILE 187 Cb -0.14 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 2bsd s ILE 187 CO 0.04 0.49 0.12 -0.69 0.00 0.00 0.00 174.94 174.90 2bsd s VAL 188 N 1.00 5.37 -0.14 2.92 1.01 0.10 -1.72 120.40 128.93 2bsd s VAL 188 Ca -0.01 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2bsd s VAL 188 Cb -0.15 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.83 2bsd s VAL 188 CO -0.01 0.52 -0.14 -0.13 0.00 0.00 0.00 175.10 175.33 2bsd s ARG 189 N -0.22 3.30 0.02 2.72 0.52 -0.06 -1.35 118.95 123.89 2bsd s ARG 189 Ca 0.10 -0.72 -0.24 0.00 -0.52 0.00 0.00 55.73 54.36 2bsd s ARG 189 Cb -0.11 -2.63 -0.05 0.00 0.52 0.00 0.00 34.95 32.67 2bsd s ARG 189 CO 0.01 0.12 0.73 -0.06 0.02 0.00 0.00 175.30 176.11 2bsd s PHE 190 N 0.58 3.70 0.36 -0.53 0.08 -0.42 -0.83 117.98 120.92 2bsd s PHE 190 Ca -0.08 1.39 0.06 0.00 0.12 0.00 0.00 56.93 58.42 2bsd s PHE 190 Cb -0.16 -2.79 -0.03 0.00 -0.57 0.00 0.00 43.02 39.48 2bsd s PHE 190 CO 0.03 0.25 0.23 -0.06 -0.10 0.00 0.00 175.22 175.58 2bsd s PHE 191 N 0.07 1.76 0.00 0.36 0.08 0.17 -3.96 117.98 116.46 2bsd s PHE 191 Ca 0.37 -1.55 0.00 0.00 0.12 0.00 0.00 56.93 55.87 2bsd s PHE 191 Cb -0.20 -0.86 0.00 0.00 -0.57 0.00 0.00 43.02 41.39 2bsd s PHE 191 CO 0.21 -0.69 0.00 0.41 -0.10 0.00 0.00 175.22 175.05 2bsd n GLY 192 N -0.72 -0.89 3.13 4.36 0.00 -1.26 -1.12 105.19 108.68 2bsd n GLY 192 Ca 0.03 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.74 2bsd n GLY 192 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bsd s SER 193 N -4.00 0.08 -0.06 1.61 0.01 -0.85 -1.69 113.70 108.80 2bsd s SER 193 Ca 0.00 -0.35 0.03 0.00 1.31 0.00 0.00 55.95 56.94 2bsd s SER 193 Cb 0.00 0.23 -0.03 0.00 0.21 0.00 0.00 66.02 66.43 2bsd s SER 193 CO 0.00 -0.46 -0.14 -0.69 0.41 0.00 0.00 173.24 172.37 2bsd s VAL 194 N -2.06 3.12 0.21 3.43 1.01 -0.43 -2.46 120.40 123.22 2bsd s VAL 194 Ca -0.09 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.04 2bsd s VAL 194 Cb -0.04 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 34.12 2bsd s VAL 194 CO -0.02 0.59 0.46 -0.94 0.00 0.00 0.00 175.10 175.19 2bsd s SER 195 N -0.67 -0.14 -1.30 3.32 1.04 -0.90 -1.73 113.70 113.32 2bsd s SER 195 Ca 0.10 -0.71 -0.00 0.00 0.48 0.00 0.00 55.95 55.82 2bsd s SER 195 Cb -0.11 0.55 -0.00 0.00 0.10 0.00 0.00 66.02 66.56 2bsd s SER 195 CO 0.01 -1.05 0.70 0.59 0.98 0.00 0.00 173.24 174.47 2bsd n ASN 196 N -0.33 -1.25 -3.91 7.02 4.13 -0.01 -4.77 115.26 116.14 2bsd n ASN 196 Ca -0.07 -0.82 -0.11 0.00 1.68 0.00 0.00 54.58 55.27 2bsd n ASN 196 Cb 0.62 -4.07 -0.12 0.00 -1.54 0.00 0.00 39.78 34.67 2bsd n ASN 196 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 2bsd s ILE 197 N -3.66 0.07 0.19 2.41 1.10 -0.77 -5.02 121.20 115.53 2bsd s ILE 197 Ca 0.01 -0.57 0.10 0.00 -0.51 0.00 0.00 60.65 59.69 2bsd s ILE 197 Cb -0.00 -0.24 -0.04 0.00 0.15 0.00 0.00 42.46 42.32 2bsd s ILE 197 CO 0.81 -0.31 -0.16 -1.10 -2.11 0.00 0.00 174.94 172.07 2bsd s GLN 198 N -0.96 1.81 0.29 3.50 -0.21 -1.26 -0.25 119.66 122.57 2bsd s GLN 198 Ca -0.11 -1.41 -0.30 0.00 0.02 0.00 0.00 55.36 53.57 2bsd s GLN 198 Cb -0.06 -2.00 -0.13 0.00 1.00 0.00 0.00 33.01 31.81 2bsd s GLN 198 CO -0.00 0.41 1.32 0.36 -2.12 0.00 0.00 175.29 175.26 2bsd n LYS 199 N 0.08 2.00 -0.59 2.91 2.85 -1.26 -2.08 118.16 122.08 2bsd n LYS 199 Ca -0.11 0.71 0.00 0.00 -1.05 0.00 0.00 58.31 57.86 2bsd n LYS 199 Cb 0.56 -2.30 0.00 0.00 -0.65 0.00 0.00 35.03 32.64 2bsd n LYS 199 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2bsd n GLY 200 N 1.47 1.71 3.78 2.58 0.00 0.68 -5.01 105.19 110.39 2bsd n GLY 200 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 2bsd n GLY 200 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2bsd s TRP 201 N -3.54 3.89 0.32 1.61 0.52 -0.88 -4.84 118.94 116.01 2bsd s TRP 201 Ca 0.00 1.65 -0.28 0.00 0.02 0.00 0.00 56.10 57.49 2bsd s TRP 201 Cb 0.00 -2.78 -0.09 0.00 -1.15 0.00 0.00 33.47 29.44 2bsd s TRP 201 CO 0.00 0.49 1.12 -0.80 0.02 0.00 0.00 176.95 177.77 2bsd s ASN 202 N -1.21 7.05 0.53 2.95 0.01 -1.26 -1.08 114.94 121.93 2bsd s ASN 202 Ca 0.37 2.28 -0.18 0.00 -0.71 0.00 0.00 52.86 54.63 2bsd s ASN 202 Cb -0.23 -2.62 -0.07 0.00 0.41 0.00 0.00 41.25 38.75 2bsd s ASN 202 CO 0.26 -0.30 1.04 -0.04 -1.51 0.00 0.00 177.10 176.55 2bsd s MET 203 N -1.75 3.63 0.00 -0.60 -1.94 -0.27 -4.90 119.30 113.47 2bsd s MET 203 Ca 0.48 1.26 0.19 0.00 -1.71 0.00 0.00 55.69 55.92 2bsd s MET 203 Cb -0.31 -2.07 0.85 0.00 2.01 0.00 0.00 34.83 35.30 2bsd s MET 203 CO 0.40 -0.56 1.59 -1.13 -0.01 0.00 0.00 175.02 175.30 2bsd n SER 204 N -1.43 1.08 0.00 3.03 3.41 -1.23 -4.85 113.62 113.63 2bsd n SER 204 Ca 0.09 -1.62 0.00 0.00 -0.26 0.00 0.00 58.87 57.07 2bsd n SER 204 Cb 0.53 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2bsd n SER 204 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bsd n GLY 205 N 1.00 3.29 3.76 5.00 0.00 -0.13 -4.82 105.19 113.29 2bsd n GLY 205 Ca 0.15 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.93 2bsd n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bsd s THR 206 N 2.92 3.07 0.57 2.61 2.01 -0.34 -4.83 115.64 121.67 2bsd s THR 206 Ca 0.00 1.04 -0.13 0.00 0.31 0.00 0.00 61.69 62.92 2bsd s THR 206 Cb 0.00 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.79 2bsd s THR 206 CO 0.00 0.23 1.00 0.26 -0.69 0.00 0.00 174.62 175.42 2bsd s TRP 207 N -0.93 3.56 0.12 4.92 0.52 -1.26 -4.40 118.94 121.48 2bsd s TRP 207 Ca 0.49 1.32 -0.31 0.00 0.02 0.00 0.00 56.10 57.61 2bsd s TRP 207 Cb -0.36 -2.72 -0.09 0.00 -1.15 0.00 0.00 33.47 29.15 2bsd s TRP 207 CO 0.46 -0.55 1.55 0.08 0.02 0.00 0.00 176.95 178.52 2bsd s VAL 208 N -2.95 2.89 0.59 4.03 1.01 0.51 -4.97 120.40 121.50 2bsd s VAL 208 Ca 0.56 0.56 -0.19 0.00 0.00 0.00 0.00 61.98 62.91 2bsd s VAL 208 Cb -0.11 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 2bsd s VAL 208 CO 0.45 0.03 1.01 0.47 0.00 0.00 0.00 175.10 177.07 2bsd n ASP 209 N 4.47 1.02 -0.26 3.32 8.00 -1.26 -4.61 116.55 127.23 2bsd n ASP 209 Ca 0.14 0.84 -0.01 0.00 0.71 0.00 0.00 54.79 56.47 2bsd n ASP 209 Cb 0.40 -1.41 0.05 0.00 -0.02 0.00 0.00 41.12 40.14 2bsd n ASP 209 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2bsd h ARG 210 N 0.65 -0.06 0.00 -1.24 3.08 -1.96 -1.58 114.38 113.27 2bsd h ARG 210 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 2bsd h ARG 210 Cb 1.36 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.42 2bsd h ARG 210 CO 0.52 -0.04 0.00 -2.30 -1.07 0.00 0.00 179.97 177.08 2bsd n PRO 211 N -5.48 0.09 0.00 0.04 -0.02 -1.26 -1.59 135.00 126.78 2bsd n PRO 211 Ca 0.08 0.53 0.09 0.00 -2.02 0.00 0.00 63.50 62.18 2bsd n PRO 211 Cb 0.38 -1.75 0.02 0.00 -0.02 0.00 0.00 33.50 32.12 2bsd n PRO 211 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2bsd n PHE 212 N -1.93 0.00 -2.33 6.00 3.72 -0.60 -4.98 117.46 117.34 2bsd n PHE 212 Ca -0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 2bsd n PHE 212 Cb 0.06 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.57 2bsd n PHE 212 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2bsd s ARG 213 N -1.92 4.42 0.65 -1.08 0.52 -0.62 -4.99 118.95 115.93 2bsd s ARG 213 Ca 0.16 1.91 -0.11 0.00 -0.52 0.00 0.00 55.73 57.17 2bsd s ARG 213 Cb 0.15 -3.27 -0.02 0.00 0.52 0.00 0.00 34.95 32.32 2bsd s ARG 213 CO 0.39 -0.25 1.04 -1.25 0.02 0.00 0.00 175.30 175.26 2bsd s PRO 214 N 0.54 3.32 0.29 3.54 0.04 -1.26 -4.90 135.00 136.57 2bsd s PRO 214 Ca 0.58 0.81 0.12 0.00 0.04 0.00 0.00 61.00 62.55 2bsd s PRO 214 Cb -0.33 -2.04 0.41 0.00 0.04 0.00 0.00 34.50 32.58 2bsd s PRO 214 CO 0.33 -0.79 1.64 0.00 0.04 0.00 0.00 177.00 178.21 2bsd h ALA 215 N -0.48 0.99 -2.92 8.56 0.00 -1.72 -3.38 119.26 120.30 2bsd h ALA 215 Ca -0.44 -0.52 -0.36 0.00 0.00 0.00 0.00 54.91 53.59 2bsd h ALA 215 Cb 1.20 -0.09 -0.19 0.00 0.00 0.00 0.00 17.79 18.71 2bsd h ALA 215 CO 0.60 0.72 -0.75 0.00 0.00 0.00 0.00 179.25 179.82 2bsd s ALA 216 N -3.63 1.19 0.19 0.00 0.00 -1.26 -4.84 121.76 113.40 2bsd s ALA 216 Ca -0.01 -1.15 -0.33 0.00 0.00 0.00 0.00 51.96 50.47 2bsd s ALA 216 Cb 0.12 -0.02 -0.14 0.00 0.00 0.00 0.00 23.12 23.09 2bsd s ALA 216 CO 0.75 0.04 1.52 1.55 0.00 0.00 0.00 175.76 179.61 2bsd n VAL 217 N 0.74 0.34 -4.52 0.00 3.14 -1.26 -4.68 118.33 112.09 2bsd n VAL 217 Ca -0.17 -0.09 -0.33 0.00 -2.96 0.00 0.00 64.34 60.79 2bsd n VAL 217 Cb 0.57 -1.51 -0.16 0.00 -1.06 0.00 0.00 33.84 31.68 2bsd n VAL 217 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2bsd s GLN 218 N 0.42 3.10 -0.23 1.45 -1.52 -0.67 -4.96 119.66 117.24 2bsd s GLN 218 Ca 0.75 -0.81 -0.16 0.00 -1.95 0.00 0.00 55.36 53.19 2bsd s GLN 218 Cb -0.67 -2.54 -0.04 0.00 -0.22 0.00 0.00 33.01 29.55 2bsd s GLN 218 CO 0.42 -0.04 0.42 -1.12 -0.25 0.00 0.00 175.29 174.73 2bsd s SER 219 N 0.90 6.40 -0.18 5.90 0.01 -1.26 -0.70 113.70 124.77 2bsd s SER 219 Ca -0.04 0.48 0.00 0.00 1.31 0.00 0.00 55.95 57.69 2bsd s SER 219 Cb -0.15 -2.24 0.01 0.00 0.21 0.00 0.00 66.02 63.85 2bsd s SER 219 CO -0.03 -0.15 -0.17 -0.76 0.41 0.00 0.00 173.24 172.54 2bsd s LEU 220 N 1.71 2.27 0.08 2.44 1.43 0.26 -4.96 118.68 121.91 2bsd s LEU 220 Ca 0.19 -0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 52.39 2bsd s LEU 220 Cb -0.15 -1.53 -0.05 0.00 0.03 0.00 0.00 46.19 44.49 2bsd s LEU 220 CO 0.09 0.00 1.07 -0.69 0.23 0.00 0.00 176.35 177.05 2bsd s VAL 221 N 1.29 4.32 0.37 -1.59 1.01 -1.26 -1.63 120.40 122.91 2bsd s VAL 221 Ca 0.04 1.78 0.06 0.00 0.00 0.00 0.00 61.98 63.87 2bsd s VAL 221 Cb -0.13 -4.14 -0.07 0.00 0.00 0.00 0.00 36.38 32.03 2bsd s VAL 221 CO -0.10 0.20 0.01 -0.83 0.00 0.00 0.00 175.10 174.38 2bsd s GLY 222 N 0.58 2.32 0.03 4.51 0.00 0.10 -4.64 107.32 110.22 2bsd s GLY 222 Ca 0.52 -2.20 0.04 0.00 0.00 0.00 0.00 44.72 43.09 2bsd s GLY 222 CO 0.30 -2.00 -0.13 -1.58 0.00 0.00 0.00 173.10 169.70 2bsd s HIS 223 N -2.89 1.12 -0.41 1.90 2.46 0.49 -1.97 115.29 115.99 2bsd s HIS 223 Ca 0.35 -0.33 -0.21 0.00 0.47 0.00 0.00 55.06 55.34 2bsd s HIS 223 Cb 0.09 -0.68 0.02 0.00 -0.13 0.00 0.00 32.58 31.88 2bsd s HIS 223 CO 0.17 0.01 0.66 -0.06 -2.47 0.00 0.00 174.74 173.05 2bsd s PHE 224 N -0.76 3.09 0.18 3.88 0.08 -1.03 -0.81 117.98 122.61 2bsd s PHE 224 Ca 0.01 0.12 -0.33 0.00 0.12 0.00 0.00 56.93 56.84 2bsd s PHE 224 Cb -0.07 -3.31 -0.14 0.00 -0.57 0.00 0.00 43.02 38.93 2bsd s PHE 224 CO 0.01 -0.79 1.45 0.00 -0.10 0.00 0.00 175.22 175.78 2bsd n ALA 225 N 6.23 0.73 -0.98 5.36 0.00 -0.85 -1.55 120.51 129.45 2bsd n ALA 225 Ca -0.01 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2bsd n ALA 225 Cb 0.48 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.68 2bsd n ALA 225 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bsd n GLY 226 N 2.75 0.49 3.49 0.00 0.00 -1.26 -4.81 105.19 105.85 2bsd n GLY 226 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 2bsd n GLY 226 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bsd s ARG 227 N -0.33 1.77 -0.15 1.61 0.52 -0.60 -5.05 118.95 116.73 2bsd s ARG 227 Ca 0.00 -2.03 0.16 0.00 -0.52 0.00 0.00 55.73 53.34 2bsd s ARG 227 Cb 0.00 -0.80 0.61 0.00 0.52 0.00 0.00 34.95 35.27 2bsd s ARG 227 CO 0.00 -0.30 1.52 -0.40 0.02 0.00 0.00 175.30 176.14 2bsd n ASP 228 N -0.92 4.35 -4.84 0.23 5.68 -1.26 -4.81 116.55 114.97 2bsd n ASP 228 Ca -0.04 -2.70 -0.21 0.00 -0.50 0.00 0.00 54.79 51.33 2bsd n ASP 228 Cb 0.66 -0.53 -0.04 0.00 -1.14 0.00 0.00 41.12 40.07 2bsd n ASP 228 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2bsd s THR 229 N -2.28 3.87 0.19 2.12 -4.23 -1.26 -5.06 115.64 108.99 2bsd s THR 229 Ca 0.44 -1.40 0.03 0.00 -1.18 0.00 0.00 61.69 59.59 2bsd s THR 229 Cb 0.32 -3.26 -0.05 0.00 1.34 0.00 0.00 72.50 70.85 2bsd s THR 229 CO 0.15 -0.24 -0.03 -0.44 -0.54 0.00 0.00 174.62 173.52 2bsd s SER 230 N -3.93 1.70 0.22 3.99 0.01 -1.26 -2.45 113.70 111.98 2bsd s SER 230 Ca 0.38 -1.15 -0.10 0.00 1.31 0.00 0.00 55.95 56.40 2bsd s SER 230 Cb -0.07 0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.18 2bsd s SER 230 CO 0.26 -0.47 0.36 0.72 0.41 0.00 0.00 173.24 174.52 2bsd s PHE 231 N -3.43 0.53 0.04 2.43 -0.12 -0.83 -4.71 117.98 111.88 2bsd s PHE 231 Ca 0.24 -0.86 -0.00 0.00 -0.05 0.00 0.00 56.93 56.26 2bsd s PHE 231 Cb 0.05 -0.02 -0.03 0.00 -0.63 0.00 0.00 43.02 42.39 2bsd s PHE 231 CO 0.05 -0.86 -0.04 -3.38 -0.05 0.00 0.00 175.22 170.95 2bsd s HIS 232 N -4.03 0.46 0.15 3.49 -3.43 -1.26 0.01 115.29 110.67 2bsd s HIS 232 Ca 0.24 -0.82 0.10 0.00 -0.80 0.00 0.00 55.06 53.79 2bsd s HIS 232 Cb 0.02 -0.32 -0.04 0.00 -1.43 0.00 0.00 32.58 30.80 2bsd s HIS 232 CO 0.07 -0.27 -0.22 0.96 -2.00 0.00 0.00 174.74 173.28 2bsd s ILE 233 N -2.81 2.55 -0.24 -5.38 -4.36 -0.65 -0.85 121.20 109.47 2bsd s ILE 233 Ca -0.02 -1.74 -0.08 0.00 -0.26 0.00 0.00 60.65 58.55 2bsd s ILE 233 Cb -0.00 -2.18 -0.03 0.00 1.25 0.00 0.00 42.46 41.50 2bsd s ILE 233 CO -0.06 0.02 0.08 -1.81 0.24 0.00 0.00 174.94 173.41 2bsd s ASP 234 N -2.31 5.30 -0.41 4.36 1.11 0.04 -0.58 116.67 124.18 2bsd s ASP 234 Ca 0.18 -0.13 -0.20 0.00 0.18 0.00 0.00 52.55 52.58 2bsd s ASP 234 Cb -0.10 -1.94 0.02 0.00 1.07 0.00 0.00 42.92 41.97 2bsd s ASP 234 CO 0.09 0.01 0.58 -0.63 1.18 0.00 0.00 175.17 176.40 2bsd s ILE 235 N 1.34 4.92 0.43 0.77 1.01 0.12 -0.59 121.20 129.20 2bsd s ILE 235 Ca 0.05 0.11 -0.15 0.00 0.00 0.00 0.00 60.65 60.66 2bsd s ILE 235 Cb -0.15 -4.12 -0.08 0.00 0.01 0.00 0.00 42.46 38.12 2bsd s ILE 235 CO 0.04 -0.47 0.86 0.20 0.00 0.00 0.00 174.94 175.57 2bsd s ASN 236 N 1.90 6.69 0.50 3.58 0.01 -0.02 -1.67 114.94 125.93 2bsd s ASN 236 Ca 0.20 1.41 0.29 0.00 -0.71 0.00 0.00 52.86 54.05 2bsd s ASN 236 Cb -0.15 -2.43 1.39 0.00 0.41 0.00 0.00 41.25 40.47 2bsd s ASN 236 CO 0.17 -0.41 1.85 -0.65 -1.51 0.00 0.00 177.10 176.55 2bsd h PRO 237 N 1.49 0.11 -0.00 -0.60 0.11 -1.83 0.00 132.00 131.27 2bsd h PRO 237 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2bsd h PRO 237 Cb 1.18 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2bsd h PRO 237 CO 0.63 0.07 -0.02 0.27 -0.21 0.00 0.00 178.00 178.74 2bsd n ASN 238 N -4.33 0.14 0.00 -2.05 6.94 -1.26 -4.70 115.26 110.00 2bsd n ASN 238 Ca 0.21 -0.56 0.00 0.00 -0.02 0.00 0.00 54.58 54.21 2bsd n ASN 238 Cb 0.98 -0.14 0.00 0.00 -2.36 0.00 0.00 39.78 38.26 2bsd n ASN 238 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2bsd n GLY 239 N 1.19 0.71 3.77 4.83 0.00 -0.01 -4.88 105.19 110.80 2bsd n GLY 239 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2bsd n GLY 239 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bsd s SER 240 N -1.80 5.14 -0.13 1.61 1.04 -1.26 -0.37 113.70 117.93 2bsd s SER 240 Ca 0.00 2.08 0.02 0.00 0.48 0.00 0.00 55.95 58.53 2bsd s SER 240 Cb 0.00 -2.56 0.01 0.00 0.10 0.00 0.00 66.02 63.56 2bsd s SER 240 CO 0.00 -1.61 -0.21 -0.63 0.98 0.00 0.00 173.24 171.77 2bsd s ILE 241 N -2.18 2.19 -0.19 -1.02 1.01 -1.26 -0.84 121.20 118.90 2bsd s ILE 241 Ca 0.69 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 60.33 2bsd s ILE 241 Cb -0.22 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 2bsd s ILE 241 CO 0.39 0.55 0.03 -0.89 0.00 0.00 0.00 174.94 175.01 2bsd s THR 242 N 0.70 4.28 -0.05 2.92 2.01 0.24 -1.11 115.64 124.62 2bsd s THR 242 Ca -0.10 -0.21 -0.30 0.00 0.31 0.00 0.00 61.69 61.40 2bsd s THR 242 Cb -0.16 -2.93 -0.04 0.00 0.01 0.00 0.00 72.50 69.38 2bsd s THR 242 CO 0.01 0.44 1.32 0.86 -0.69 0.00 0.00 174.62 176.56 2bsd s TRP 243 N 0.77 2.92 -0.09 4.92 -0.11 -0.24 -0.78 118.94 126.33 2bsd s TRP 243 Ca 0.01 0.96 0.13 0.00 1.22 0.00 0.00 56.10 58.42 2bsd s TRP 243 Cb -0.14 -3.56 0.24 0.00 -1.50 0.00 0.00 33.47 28.51 2bsd s TRP 243 CO 0.02 -1.99 1.12 0.91 -4.62 0.00 0.00 176.95 172.39 2bsd n TRP 244 N 5.61 0.00 -1.31 5.86 7.02 -0.03 -0.23 117.44 134.36 2bsd n TRP 244 Ca 0.13 -0.75 -0.15 0.00 -1.02 0.00 0.00 57.50 55.71 2bsd n TRP 244 Cb 0.45 -0.14 0.11 0.00 -2.42 0.00 0.00 31.31 29.31 2bsd n TRP 244 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2bsd n GLY 245 N -0.82 -1.59 3.70 6.99 0.00 -1.16 -4.15 105.19 108.16 2bsd n GLY 245 Ca 0.11 -1.64 -0.29 0.00 0.00 0.00 0.00 46.02 44.20 2bsd n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bsd s ALA 246 N -3.78 1.14 0.27 4.61 0.00 -1.26 -4.13 121.76 118.60 2bsd s ALA 246 Ca 0.37 -0.71 -0.30 0.00 0.00 0.00 0.00 51.96 51.32 2bsd s ALA 246 Cb -0.01 -2.98 -0.11 0.00 0.00 0.00 0.00 23.12 20.02 2bsd s ALA 246 CO 0.26 -2.95 1.55 -0.80 0.00 0.00 0.00 175.76 173.83 2bsd s ASN 247 N -3.90 6.47 -0.12 0.00 -0.87 -1.26 -4.47 114.94 110.79 2bsd s ASN 247 Ca 0.68 2.84 0.03 0.00 -1.57 0.00 0.00 52.86 54.84 2bsd s ASN 247 Cb -0.13 -2.63 0.01 0.00 -0.02 0.00 0.00 41.25 38.48 2bsd s ASN 247 CO 0.56 -0.85 -0.23 -0.63 -2.57 0.00 0.00 177.10 173.38 2bsd s ILE 248 N 0.12 2.08 0.00 0.60 -1.09 0.65 -5.01 121.20 118.55 2bsd s ILE 248 Ca 0.63 -0.99 0.00 0.00 -2.23 0.00 0.00 60.65 58.06 2bsd s ILE 248 Cb -0.46 -1.81 0.00 0.00 -1.58 0.00 0.00 42.46 38.61 2bsd s ILE 248 CO 0.45 0.55 0.00 -0.90 -1.23 0.00 0.00 174.94 173.81 2bsd n ASP 249 N 3.84 0.00 0.24 3.58 5.75 -1.26 -1.84 116.55 126.86 2bsd n ASP 249 Ca -0.20 0.00 0.11 0.00 -0.01 0.00 0.00 54.79 54.70 2bsd n ASP 249 Cb 0.52 0.00 0.52 0.00 -1.03 0.00 0.00 41.12 41.13 2bsd n ASP 249 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 2bsd h LYS 250 N 0.00 0.00 -6.12 0.11 1.57 -1.96 0.00 116.57 110.17 2bsd h LYS 250 Ca 0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 2bsd h LYS 250 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 2bsd h LYS 250 CO 0.00 0.18 0.80 0.99 -0.57 0.00 0.00 179.45 180.85 2bsd s THR 251 N -3.70 4.65 0.25 -0.16 2.01 -1.26 -4.76 115.64 112.68 2bsd s THR 251 Ca 0.00 1.96 -0.30 0.00 0.31 0.00 0.00 61.69 63.67 2bsd s THR 251 Cb 0.10 -4.33 -0.10 0.00 0.01 0.00 0.00 72.50 68.19 2bsd s THR 251 CO 0.62 -0.24 1.38 -2.84 -0.69 0.00 0.00 174.62 172.85 2bsd s PRO 252 N 3.28 4.32 -0.13 4.92 0.02 -1.26 -4.70 135.00 141.44 2bsd s PRO 252 Ca 0.44 2.22 0.02 0.00 0.02 0.00 0.00 61.00 63.70 2bsd s PRO 252 Cb -0.14 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.25 2bsd s PRO 252 CO 0.08 -0.33 -0.19 0.42 -0.33 0.00 0.00 177.00 176.65 2bsd s ILE 253 N -0.23 2.37 0.16 2.83 1.01 -0.71 -4.89 121.20 121.75 2bsd s ILE 253 Ca 0.56 -0.89 -0.32 0.00 0.00 0.00 0.00 60.65 60.01 2bsd s ILE 253 Cb -0.40 -1.96 -0.12 0.00 0.01 0.00 0.00 42.46 40.00 2bsd s ILE 253 CO 0.44 0.54 1.77 0.00 0.00 0.00 0.00 174.94 177.69 2bsd n ALA 254 N 3.84 2.45 -2.96 9.38 0.00 -1.26 -1.32 120.51 130.64 2bsd n ALA 254 Ca -0.19 0.36 -0.33 0.00 0.00 0.00 0.00 53.44 53.28 2bsd n ALA 254 Cb 0.52 -2.55 -0.13 0.00 0.00 0.00 0.00 19.45 17.29 2bsd n ALA 254 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2bsd s THR 255 N 1.90 3.46 0.13 0.00 -4.23 -0.68 -2.02 115.64 114.20 2bsd s THR 255 Ca 0.79 -0.52 -0.05 0.00 -1.18 0.00 0.00 61.69 60.72 2bsd s THR 255 Cb -0.51 -2.47 -0.02 0.00 1.34 0.00 0.00 72.50 70.84 2bsd s THR 255 CO 0.35 0.52 0.16 -0.13 -0.54 0.00 0.00 174.62 174.98 2bsd s ARG 256 N 0.21 0.97 0.00 3.99 1.81 0.01 -3.30 118.95 122.65 2bsd s ARG 256 Ca -0.05 -1.25 0.00 0.00 -1.72 0.00 0.00 55.73 52.71 2bsd s ARG 256 Cb -0.15 0.31 0.00 0.00 -0.45 0.00 0.00 34.95 34.66 2bsd s ARG 256 CO 0.04 -0.31 0.00 0.41 -0.68 0.00 0.00 175.30 174.76 2bsd n GLY 257 N -0.12 4.18 3.61 -3.53 0.00 -1.25 -0.38 105.19 107.70 2bsd n GLY 257 Ca -0.08 -1.56 -0.34 0.00 0.00 0.00 0.00 46.02 44.03 2bsd n GLY 257 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bsd s ASN 258 N 0.00 5.35 0.02 1.61 -0.87 -1.26 -1.31 114.94 118.48 2bsd s ASN 258 Ca 0.00 0.05 0.03 0.00 -1.57 0.00 0.00 52.86 51.36 2bsd s ASN 258 Cb 0.00 -1.83 -0.01 0.00 -0.02 0.00 0.00 41.25 39.39 2bsd s ASN 258 CO 0.00 0.22 -0.08 -0.83 -2.57 0.00 0.00 177.10 173.84 2bsd s GLY 259 N 0.09 0.46 0.14 0.66 0.00 -0.46 -4.90 107.32 103.32 2bsd s GLY 259 Ca 0.03 -0.54 0.09 0.00 0.00 0.00 0.00 44.72 44.30 2bsd s GLY 259 CO 0.01 -0.53 -0.20 -1.35 0.00 0.00 0.00 173.10 171.03 2bsd s SER 260 N -0.82 2.73 0.13 1.64 1.04 -1.26 0.00 113.70 117.16 2bsd s SER 260 Ca -0.02 -0.78 -0.15 0.00 0.48 0.00 0.00 55.95 55.47 2bsd s SER 260 Cb -0.06 -0.16 0.03 0.00 0.10 0.00 0.00 66.02 65.93 2bsd s SER 260 CO 0.00 0.03 0.39 -0.72 0.98 0.00 0.00 173.24 173.92 2bsd s TYR 261 N -1.59 -0.13 -0.07 5.02 -0.85 -0.46 -5.02 117.35 114.25 2bsd s TYR 261 Ca 0.12 -0.20 -0.08 0.00 -0.52 0.00 0.00 57.07 56.39 2bsd s TYR 261 Cb -0.08 0.22 -0.04 0.00 0.38 0.00 0.00 41.96 42.44 2bsd s TYR 261 CO 0.06 -0.71 0.20 -0.06 -1.52 0.00 0.00 175.55 173.52 2bsd s PHE 262 N -3.82 3.61 0.04 -3.49 0.08 -1.26 -0.92 117.98 112.21 2bsd s PHE 262 Ca 0.04 0.59 -0.12 0.00 0.12 0.00 0.00 56.93 57.56 2bsd s PHE 262 Cb 0.02 -1.99 -0.33 0.00 -0.57 0.00 0.00 43.02 40.15 2bsd s PHE 262 CO -0.10 0.70 1.03 0.82 -0.10 0.00 0.00 175.22 177.56 2bsd h ILE 263 N 3.68 1.33 -0.03 0.64 2.04 -1.18 -3.43 117.51 120.57 2bsd h ILE 263 Ca -0.53 -2.80 0.00 0.00 1.00 0.00 0.00 64.86 62.52 2bsd h ILE 263 Cb 1.22 3.01 0.00 0.00 -0.74 0.00 0.00 36.82 40.31 2bsd h ILE 263 CO 0.61 0.84 0.00 0.29 0.00 0.00 0.00 178.15 179.88