#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 2.41 -0.26 2.28 1.01 -1.26 -1.00 121.20 124.37 2bsd s ILE 3 Ca 0.00 -1.02 -0.15 0.00 0.00 0.00 0.00 60.65 59.47 2bsd s ILE 3 Cb 0.00 -2.14 -0.04 0.00 0.01 0.00 0.00 42.46 40.30 2bsd s ILE 3 CO 0.00 0.36 0.40 -0.54 0.00 0.00 0.00 174.94 175.15 2bsd s LYS 4 N 1.29 4.04 -0.18 2.79 1.02 -0.41 -4.95 119.74 123.34 2bsd s LYS 4 Ca 0.02 0.10 -0.07 0.00 0.02 0.00 0.00 55.97 56.04 2bsd s LYS 4 Cb -0.15 -3.64 -0.04 0.00 -0.52 0.00 0.00 37.83 33.48 2bsd s LYS 4 CO -0.09 -0.26 0.05 -0.80 -0.92 0.00 0.00 175.35 173.33 2bsd s ASN 5 N 1.55 5.47 0.03 2.83 -0.87 -1.26 -0.90 114.94 121.78 2bsd s ASN 5 Ca 0.16 0.03 -0.01 0.00 -1.57 0.00 0.00 52.86 51.47 2bsd s ASN 5 Cb -0.16 -1.94 -0.00 0.00 -0.02 0.00 0.00 41.25 39.14 2bsd s ASN 5 CO 0.09 0.15 -0.02 0.49 -2.57 0.00 0.00 177.10 175.25 2bsd n PHE 6 N 3.66 0.00 -0.85 2.20 3.01 -1.07 -4.76 117.46 119.64 2bsd n PHE 6 Ca -0.17 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.04 2bsd n PHE 6 Cb 0.52 -0.03 -0.02 0.00 -0.01 0.00 0.00 39.48 39.95 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 -2.96 2.77 -3.93 4.37 -1.04 -1.13 -4.84 114.28 107.53 2bsd n THR 7 Ca -0.01 -1.66 -0.10 0.00 -2.04 0.00 0.00 64.05 60.24 2bsd n THR 7 Cb 0.03 -2.22 -0.10 0.00 -1.82 0.00 0.00 70.33 66.21 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 3.21 0.17 0.00 -1.42 0.40 -1.26 -4.56 117.98 114.51 2bsd s PHE 8 Ca 0.45 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 56.40 2bsd s PHE 8 Cb 0.12 -0.13 0.00 0.00 0.51 0.00 0.00 43.02 43.52 2bsd s PHE 8 CO -0.04 -0.29 0.00 1.19 0.70 0.00 0.00 175.22 176.79 2bsd n PHE 9 N 1.25 0.00 -4.00 0.36 0.99 -1.26 -4.94 117.46 109.87 2bsd n PHE 9 Ca -0.22 0.00 -0.25 0.00 -0.00 0.00 0.00 57.45 56.98 2bsd n PHE 9 Cb 0.56 0.00 -0.04 0.00 -1.00 0.00 0.00 39.48 39.01 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 0.00 1.65 0.27 1.37 0.00 -1.26 -4.94 107.32 104.41 2bsd s GLY 19 Ca 0.00 -1.12 0.01 0.00 0.00 0.00 0.00 44.72 43.60 2bsd s GLY 19 CO 0.00 -1.13 1.73 1.76 0.00 0.00 0.00 173.10 175.46 2bsd h SER 20 N 2.11 0.59 0.85 1.64 0.02 -1.93 -2.84 113.55 113.99 2bsd h SER 20 Ca -0.49 -0.18 -0.12 0.00 -0.84 0.00 0.00 61.79 60.16 2bsd h SER 20 Cb 1.20 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.56 2bsd h SER 20 CO 0.66 0.78 -0.58 -0.55 -1.14 0.00 0.00 176.83 175.99 2bsd h ASN 21 N 0.54 0.00 -0.40 3.07 -1.07 -1.92 0.30 115.58 116.09 2bsd h ASN 21 Ca 0.09 0.00 -0.11 0.00 0.07 0.00 0.00 56.30 56.35 2bsd h ASN 21 Cb 0.60 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.84 2bsd h ASN 21 CO 0.04 0.58 -0.18 0.78 0.07 0.00 0.00 177.43 178.73 2bsd h ASN 22 N 0.00 0.84 -0.65 6.14 4.21 -1.86 -2.04 115.58 122.22 2bsd h ASN 22 Ca -0.01 -0.40 -0.07 0.00 1.21 0.00 0.00 56.30 57.03 2bsd h ASN 22 Cb 1.17 -0.23 -0.03 0.00 -1.12 0.00 0.00 38.32 38.11 2bsd h ASN 22 CO 0.08 1.05 0.12 0.44 -1.29 0.00 0.00 177.43 177.83 2bsd h ASP 23 N 0.63 1.03 -0.14 5.81 3.32 -1.31 -1.64 116.42 124.12 2bsd h ASP 23 Ca 0.09 -0.23 0.04 0.00 0.02 0.00 0.00 57.03 56.95 2bsd h ASP 23 Cb 0.73 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.96 2bsd h ASP 23 CO 0.05 1.01 -0.14 1.23 -1.72 0.00 0.00 179.24 179.68 2bsd h GLY 24 N 1.05 -0.05 1.04 2.75 0.00 -0.28 0.12 103.07 107.71 2bsd h GLY 24 Ca 0.20 0.17 -0.11 0.00 0.00 0.00 0.00 47.33 47.59 2bsd h GLY 24 CO 0.01 -0.14 -0.14 0.50 0.00 0.00 0.00 176.54 176.77 2bsd h LYS 25 N -0.16 0.90 -0.37 4.80 1.57 -1.32 -1.48 116.57 120.50 2bsd h LYS 25 Ca 0.09 -0.36 0.07 0.00 -1.87 0.00 0.00 60.65 58.59 2bsd h LYS 25 Cb 0.30 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.50 2bsd h LYS 25 CO -0.23 1.01 -0.09 1.25 -0.57 0.00 0.00 179.45 180.82 2bsd h LEU 26 N 0.74 -0.34 -0.54 2.94 5.85 -1.07 -1.00 115.31 121.90 2bsd h LEU 26 Ca 0.11 0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 2bsd h LEU 26 Cb 0.70 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 2bsd h LEU 26 CO 0.05 -0.12 0.10 1.88 -0.34 0.00 0.00 178.44 180.02 2bsd h TYR 27 N 0.00 0.93 -0.66 1.25 0.05 -0.80 -1.14 116.97 116.60 2bsd h TYR 27 Ca 0.18 -0.12 0.06 0.00 0.05 0.00 0.00 58.73 58.89 2bsd h TYR 27 Cb 0.27 -0.26 -0.05 0.00 1.01 0.00 0.00 36.73 37.70 2bsd h TYR 27 CO -0.33 0.83 0.37 0.52 -1.05 0.00 0.00 178.16 178.49 2bsd h MET 28 N 0.77 0.66 -0.02 4.88 2.86 -0.99 -2.39 114.93 120.71 2bsd h MET 28 Ca 0.17 -0.04 -0.16 0.00 -2.06 0.00 0.00 59.70 57.61 2bsd h MET 28 Cb 0.38 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 2bsd h MET 28 CO 0.01 0.44 -0.70 0.52 1.06 0.00 0.00 176.91 178.23 2bsd h MET 29 N 0.68 0.12 -0.32 1.72 2.86 -0.93 -0.17 114.93 118.89 2bsd h MET 29 Ca 0.30 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.80 2bsd h MET 29 Cb 0.18 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 2bsd h MET 29 CO -0.18 0.77 0.07 -0.07 1.06 0.00 0.00 176.91 178.57 2bsd h LEU 30 N 0.08 0.48 0.00 1.22 3.38 -0.90 -3.24 115.31 116.34 2bsd h LEU 30 Ca -0.02 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2bsd h LEU 30 Cb 1.25 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2bsd h LEU 30 CO 0.10 0.59 -0.58 1.07 0.09 0.00 0.00 178.44 179.71 2bsd n THR 31 N -4.65 0.12 -2.62 0.22 5.66 -0.93 -4.99 114.28 107.10 2bsd n THR 31 Ca -0.02 -0.11 -0.09 0.00 -3.05 0.00 0.00 64.05 60.79 2bsd n THR 31 Cb 0.19 0.12 0.04 0.00 -1.55 0.00 0.00 70.33 69.14 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 1.44 -0.07 3.48 1.09 0.00 -0.19 -4.61 105.19 106.33 2bsd n GLY 32 Ca 0.05 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 -4.31 1.99 0.00 1.61 0.23 -0.52 -0.01 119.30 118.28 2bsd s MET 33 Ca 0.10 -1.05 0.00 0.00 -1.03 0.00 0.00 55.69 53.71 2bsd s MET 33 Cb -0.01 -2.18 0.00 0.00 -1.53 0.00 0.00 34.83 31.10 2bsd s MET 33 CO 0.39 0.52 0.00 -0.40 -2.03 0.00 0.00 175.02 173.50 2bsd n ASP 34 N 1.20 0.69 0.00 -1.18 5.68 -1.26 -4.67 116.55 117.00 2bsd n ASP 34 Ca -0.16 -0.92 0.13 0.00 -0.50 0.00 0.00 54.79 53.35 2bsd n ASP 34 Cb 0.52 0.00 0.63 0.00 -1.14 0.00 0.00 41.12 41.14 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 -0.61 0.00 -0.37 2.11 4.01 -1.26 -3.33 117.16 117.71 2bsd n TYR 35 Ca 0.00 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.84 2bsd n TYR 35 Cb 0.00 -0.40 0.33 0.00 -0.31 0.00 0.00 39.34 38.96 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 -1.40 3.11 -4.33 -0.72 1.74 -1.26 -4.39 116.66 109.41 2bsd n ARG 36 Ca 0.10 -2.64 -0.19 0.00 -0.77 0.00 0.00 57.85 54.35 2bsd n ARG 36 Cb 0.27 -1.70 -0.09 0.00 -1.02 0.00 0.00 32.46 29.92 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 -1.43 0.26 0.25 0.55 -1.32 -1.21 -4.95 115.64 107.78 2bsd s THR 37 Ca 0.48 -2.00 0.02 0.00 -1.21 0.00 0.00 61.69 58.98 2bsd s THR 37 Cb 0.28 -2.50 -0.05 0.00 -1.51 0.00 0.00 72.50 68.72 2bsd s THR 37 CO 0.28 0.00 0.05 0.27 -2.21 0.00 0.00 174.62 173.01 2bsd s ILE 38 N -3.60 0.79 -0.07 5.08 -0.00 -1.26 -4.60 121.20 117.54 2bsd s ILE 38 Ca 0.36 -2.01 0.01 0.00 -0.00 0.00 0.00 60.65 59.01 2bsd s ILE 38 Cb 0.05 -2.49 -0.03 0.00 -0.00 0.00 0.00 42.46 39.98 2bsd s ILE 38 CO 0.19 -0.17 -0.06 -0.13 -0.00 0.00 0.00 174.94 174.77 2bsd s ARG 39 N -3.95 2.77 -0.15 0.37 1.81 -0.43 -4.44 118.95 114.93 2bsd s ARG 39 Ca 0.33 -0.54 -0.10 0.00 -1.72 0.00 0.00 55.73 53.70 2bsd s ARG 39 Cb 0.07 -2.61 0.05 0.00 -0.45 0.00 0.00 34.95 32.01 2bsd s ARG 39 CO 0.11 0.67 0.37 0.50 -0.68 0.00 0.00 175.30 176.27 2bsd s ARG 40 N -0.85 0.38 -0.05 3.54 3.00 -1.26 0.09 118.95 123.80 2bsd s ARG 40 Ca 0.13 0.67 -0.02 0.00 -1.00 0.00 0.00 55.73 55.51 2bsd s ARG 40 Cb -0.11 0.03 0.03 0.00 0.00 0.00 0.00 34.95 34.90 2bsd s ARG 40 CO 0.02 -0.13 0.04 0.21 0.00 0.00 0.00 175.30 175.45 2bsd s LYS 41 N 1.02 0.09 -0.71 5.12 2.47 -0.27 -5.00 119.74 122.45 2bsd s LYS 41 Ca -0.07 0.31 -0.25 0.00 -1.56 0.00 0.00 55.97 54.40 2bsd s LYS 41 Cb -0.07 -0.61 0.05 0.00 -1.46 0.00 0.00 37.83 35.74 2bsd s LYS 41 CO -0.08 -0.32 1.15 -0.51 0.16 0.00 0.00 175.35 175.75 2bsd s ASP 42 N 2.08 6.17 0.36 1.43 1.01 -1.26 -1.30 116.67 125.17 2bsd s ASP 42 Ca 0.04 -0.71 0.15 0.00 0.71 0.00 0.00 52.55 52.75 2bsd s ASP 42 Cb -0.12 -2.50 0.67 0.00 1.01 0.00 0.00 42.92 41.98 2bsd s ASP 42 CO -0.03 -1.66 1.76 -0.50 0.21 0.00 0.00 175.17 174.94 2bsd h TRP 43 N 9.82 0.00 -3.69 4.23 4.06 -1.48 -3.44 115.95 125.46 2bsd h TRP 43 Ca -0.27 0.00 -0.37 0.00 2.06 0.00 0.00 58.89 60.31 2bsd h TRP 43 Cb 1.06 0.00 -0.18 0.00 -1.00 0.00 0.00 29.16 29.03 2bsd h TRP 43 CO 1.06 0.42 -0.75 0.45 -3.56 0.00 0.00 178.44 176.06 2bsd s SER 44 N -6.67 1.69 0.19 -3.49 0.15 -1.06 -5.02 113.70 99.49 2bsd s SER 44 Ca -0.01 -0.79 -0.30 0.00 0.70 0.00 0.00 55.95 55.54 2bsd s SER 44 Cb 0.13 -0.03 -0.09 0.00 -1.71 0.00 0.00 66.02 64.32 2bsd s SER 44 CO 0.71 -0.20 1.31 -0.44 1.20 0.00 0.00 173.24 175.82 2bsd s SER 45 N -2.38 6.90 0.38 5.45 0.01 -1.26 -4.43 113.70 118.37 2bsd s SER 45 Ca 0.06 2.39 -0.27 0.00 1.31 0.00 0.00 55.95 59.44 2bsd s SER 45 Cb -0.04 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.48 2bsd s SER 45 CO 0.01 -0.53 1.38 -2.84 0.41 0.00 0.00 173.24 171.67 2bsd s PRO 46 N -0.06 4.09 -0.13 12.44 0.02 -1.26 -4.36 135.00 145.74 2bsd s PRO 46 Ca 0.57 2.34 -0.02 0.00 0.02 0.00 0.00 61.00 63.91 2bsd s PRO 46 Cb -0.36 -2.90 -0.03 0.00 0.02 0.00 0.00 34.50 31.23 2bsd s PRO 46 CO 0.38 -0.46 -0.06 -0.51 -0.33 0.00 0.00 177.00 176.01 2bsd s LEU 47 N -2.18 3.13 -0.23 -5.54 1.43 0.63 -4.92 118.68 111.00 2bsd s LEU 47 Ca 0.54 -0.14 -0.08 0.00 -1.03 0.00 0.00 54.13 53.43 2bsd s LEU 47 Cb -0.42 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.04 2bsd s LEU 47 CO 0.56 0.22 0.08 0.20 0.23 0.00 0.00 176.35 177.63 2bsd s ASN 48 N 0.04 5.36 -0.17 2.29 0.01 -1.26 0.59 114.94 121.81 2bsd s ASN 48 Ca -0.01 -0.10 -0.02 0.00 -0.71 0.00 0.00 52.86 52.03 2bsd s ASN 48 Cb -0.14 -1.95 0.05 0.00 0.41 0.00 0.00 41.25 39.62 2bsd s ASN 48 CO 0.03 0.04 -0.01 0.28 -1.51 0.00 0.00 177.10 175.93 2bsd s THR 49 N 1.20 0.78 0.00 1.60 -1.32 -1.18 -5.02 115.64 111.69 2bsd s THR 49 Ca 0.05 -0.52 0.00 0.00 -1.21 0.00 0.00 61.69 60.01 2bsd s THR 49 Cb -0.14 -1.09 0.00 0.00 -1.51 0.00 0.00 72.50 69.75 2bsd s THR 49 CO 0.04 -0.01 0.00 0.00 -2.21 0.00 0.00 174.62 172.44 2bsd n ALA 50 N 4.98 0.00 -1.75 11.08 0.00 -1.26 -3.12 120.51 130.43 2bsd n ALA 50 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.94 2bsd n ALA 50 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.91 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 8.32 -3.77 0.00 4.77 -1.25 -4.14 117.00 120.93 2bsd n LEU 51 Ca 0.00 -4.71 -0.13 0.00 -0.03 0.00 0.00 56.01 51.14 2bsd n LEU 51 Cb 0.00 -1.43 -0.10 0.00 -2.33 0.00 0.00 43.42 39.56 2bsd n LEU 51 CO 0.00 2.07 -0.02 0.20 -1.33 0.00 0.00 177.39 178.31 2bsd s ASN 52 N 1.01 -0.22 -0.17 -1.43 0.01 -1.18 -0.81 114.94 112.15 2bsd s ASN 52 Ca 0.60 0.28 0.00 0.00 -0.71 0.00 0.00 52.86 53.03 2bsd s ASN 52 Cb 0.18 0.44 0.00 0.00 0.41 0.00 0.00 41.25 42.28 2bsd s ASN 52 CO -0.08 -0.30 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.37 2bsd s VAL 53 N -0.71 2.59 -0.29 1.60 1.01 -0.78 -3.13 120.40 120.69 2bsd s VAL 53 Ca -0.08 -0.79 -0.10 0.00 0.00 0.00 0.00 61.98 61.02 2bsd s VAL 53 Cb -0.04 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 2bsd s VAL 53 CO 0.02 0.51 0.15 -1.58 0.00 0.00 0.00 175.10 174.20 2bsd s GLN 54 N 0.97 3.54 -0.43 2.72 0.74 0.20 -0.87 119.66 126.53 2bsd s GLN 54 Ca -0.02 -0.58 -0.26 0.00 0.05 0.00 0.00 55.36 54.55 2bsd s GLN 54 Cb -0.15 -3.55 0.02 0.00 1.10 0.00 0.00 33.01 30.44 2bsd s GLN 54 CO -0.03 -0.32 0.94 0.71 -0.55 0.00 0.00 175.29 176.05 2bsd s TYR 55 N 1.65 2.97 -0.12 1.67 2.02 0.33 -0.27 117.35 125.60 2bsd s TYR 55 Ca 0.06 0.55 -0.25 0.00 -0.37 0.00 0.00 57.07 57.05 2bsd s TYR 55 Cb -0.16 -3.89 -0.22 0.00 -0.40 0.00 0.00 41.96 37.29 2bsd s TYR 55 CO 0.07 -1.02 0.73 1.79 -1.57 0.00 0.00 175.55 175.55 2bsd h THR 56 N 6.00 1.51 -1.75 -0.71 1.35 -1.77 0.15 112.91 117.69 2bsd h THR 56 Ca -0.24 -2.03 -0.28 0.00 -0.55 0.00 0.00 66.41 63.31 2bsd h THR 56 Cb 1.08 2.80 -0.29 0.00 -1.73 0.00 0.00 68.15 70.01 2bsd h THR 56 CO 1.02 0.49 -0.62 0.21 -0.25 0.00 0.00 175.52 176.37 2bsd s ASN 57 N -6.06 0.57 -0.10 5.36 3.84 -1.23 -1.67 114.94 115.65 2bsd s ASN 57 Ca -0.16 -1.22 0.01 0.00 0.21 0.00 0.00 52.86 51.70 2bsd s ASN 57 Cb -0.02 0.90 0.02 0.00 -0.55 0.00 0.00 41.25 41.60 2bsd s ASN 57 CO 0.60 -0.26 -0.10 -0.89 -2.79 0.00 0.00 177.10 173.65 2bsd s THR 58 N 1.72 1.13 -0.02 -5.21 2.01 -0.64 -1.03 115.64 113.61 2bsd s THR 58 Ca 0.15 -0.39 -0.17 0.00 0.31 0.00 0.00 61.69 61.59 2bsd s THR 58 Cb -0.13 -1.10 -0.05 0.00 0.01 0.00 0.00 72.50 71.23 2bsd s THR 58 CO -0.09 0.38 0.48 -0.44 -0.69 0.00 0.00 174.62 174.25 2bsd s SER 59 N 1.33 6.85 -0.00 3.53 0.01 -0.42 0.25 113.70 125.25 2bsd s SER 59 Ca -0.02 1.01 0.04 0.00 1.31 0.00 0.00 55.95 58.29 2bsd s SER 59 Cb -0.14 -2.29 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 2bsd s SER 59 CO -0.04 0.21 -0.13 -0.63 0.41 0.00 0.00 173.24 173.05 2bsd s ILE 60 N -0.55 1.02 -0.20 1.44 1.01 -0.34 -1.11 121.20 122.48 2bsd s ILE 60 Ca 0.26 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 60.25 2bsd s ILE 60 Cb -0.17 -0.87 -0.00 0.00 0.01 0.00 0.00 42.46 41.43 2bsd s ILE 60 CO 0.14 0.23 -0.09 -0.63 0.00 0.00 0.00 174.94 174.59 2bsd s ILE 61 N -0.41 3.09 -0.05 2.92 1.01 0.11 -1.33 121.20 126.54 2bsd s ILE 61 Ca 0.04 -0.60 -0.00 0.00 0.00 0.00 0.00 60.65 60.09 2bsd s ILE 61 Cb -0.05 -2.37 0.03 0.00 0.01 0.00 0.00 42.46 40.07 2bsd s ILE 61 CO -0.00 0.46 -0.01 0.00 0.00 0.00 0.00 174.94 175.39 2bsd s ALA 62 N 1.22 0.59 -1.55 9.38 0.00 -0.61 -1.31 121.76 129.48 2bsd s ALA 62 Ca 0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 51.96 51.92 2bsd s ALA 62 Cb -0.14 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.44 2bsd s ALA 62 CO -0.03 -0.23 0.37 0.41 0.00 0.00 0.00 175.76 176.27 2bsd n GLY 63 N 4.58 -0.51 2.49 0.00 0.00 -1.26 -1.38 105.19 109.10 2bsd n GLY 63 Ca -0.17 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.28 0.35 3.58 -0.02 0.00 -1.26 -4.69 105.19 101.88 2bsd n GLY 64 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.70 3.90 -0.12 1.61 1.81 -0.48 -4.31 118.95 120.66 2bsd s ARG 65 Ca 0.00 -0.37 -0.15 0.00 -1.72 0.00 0.00 55.73 53.48 2bsd s ARG 65 Cb 0.00 -3.30 -0.05 0.00 -0.45 0.00 0.00 34.95 31.15 2bsd s ARG 65 CO 0.00 0.10 0.38 -0.47 -0.68 0.00 0.00 175.30 174.63 2bsd s TYR 66 N 0.86 3.53 0.15 -0.53 5.04 -1.26 -1.57 117.35 123.57 2bsd s TYR 66 Ca 0.04 0.77 -0.07 0.00 -2.44 0.00 0.00 57.07 55.37 2bsd s TYR 66 Cb -0.14 -2.40 -0.01 0.00 0.35 0.00 0.00 41.96 39.76 2bsd s TYR 66 CO 0.03 0.29 0.23 -0.59 -1.34 0.00 0.00 175.55 174.16 2bsd s PHE 67 N 0.24 0.46 -0.07 4.97 -0.12 -0.45 -2.61 117.98 120.39 2bsd s PHE 67 Ca 0.21 -0.84 0.04 0.00 -0.05 0.00 0.00 56.93 56.30 2bsd s PHE 67 Cb -0.14 -0.14 0.00 0.00 -0.63 0.00 0.00 43.02 42.11 2bsd s PHE 67 CO 0.08 -0.66 -0.20 -1.21 -0.05 0.00 0.00 175.22 173.18 2bsd s GLU 68 N -3.97 2.38 -0.45 1.99 2.02 -0.08 -1.19 118.70 119.40 2bsd s GLU 68 Ca 0.17 -0.71 -0.19 0.00 0.02 0.00 0.00 54.97 54.25 2bsd s GLU 68 Cb 0.04 -1.90 0.03 0.00 0.10 0.00 0.00 34.13 32.40 2bsd s GLU 68 CO -0.01 0.19 0.58 -0.51 0.02 0.00 0.00 175.26 175.53 2bsd s LEU 69 N 0.28 4.71 -0.33 1.80 1.43 0.14 -1.28 118.68 125.43 2bsd s LEU 69 Ca -0.12 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.42 2bsd s LEU 69 Cb -0.15 -2.56 0.09 0.00 0.03 0.00 0.00 46.19 43.59 2bsd s LEU 69 CO 0.05 -0.76 0.04 -0.76 0.23 0.00 0.00 176.35 175.16 2bsd s LEU 70 N 2.59 4.50 -1.22 1.79 1.43 -0.17 -1.62 118.68 125.97 2bsd s LEU 70 Ca 0.18 -1.90 -0.12 0.00 -1.03 0.00 0.00 54.13 51.25 2bsd s LEU 70 Cb -0.16 -1.65 -0.01 0.00 0.03 0.00 0.00 46.19 44.40 2bsd s LEU 70 CO 0.16 -0.36 0.69 0.59 0.23 0.00 0.00 176.35 177.66 2bsd n ASN 71 N 4.38 -3.52 -4.41 2.29 5.03 0.36 -0.05 115.26 119.34 2bsd n ASN 71 Ca -0.02 -0.98 -0.36 0.00 0.87 0.00 0.00 54.58 54.09 2bsd n ASN 71 Cb 0.42 -3.46 -0.13 0.00 -1.02 0.00 0.00 39.78 35.59 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 -6.07 3.58 -0.18 3.52 2.56 -0.25 -1.91 118.70 119.96 2bsd s GLU 72 Ca 0.29 -0.52 -0.08 0.00 0.00 0.00 0.00 54.97 54.66 2bsd s GLU 72 Cb -0.10 -3.25 -0.04 0.00 2.00 0.00 0.00 34.13 32.73 2bsd s GLU 72 CO 0.86 -0.19 0.09 0.99 -0.56 0.00 0.00 175.26 176.44 2bsd s THR 73 N 1.58 5.06 -0.19 -1.70 2.01 -1.26 -0.52 115.64 120.63 2bsd s THR 73 Ca 0.06 0.06 -0.03 0.00 0.31 0.00 0.00 61.69 62.10 2bsd s THR 73 Cb -0.15 -3.28 -0.01 0.00 0.01 0.00 0.00 72.50 69.07 2bsd s THR 73 CO 0.02 0.47 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.66 2bsd s VAL 74 N 0.18 3.29 0.30 3.82 1.01 -0.05 -4.97 120.40 123.97 2bsd s VAL 74 Ca 0.06 -0.54 -0.29 0.00 0.00 0.00 0.00 61.98 61.21 2bsd s VAL 74 Cb -0.12 -2.46 -0.10 0.00 0.00 0.00 0.00 36.38 33.71 2bsd s VAL 74 CO -0.00 0.46 1.23 0.00 0.00 0.00 0.00 175.10 176.79 2bsd s ALA 75 N 1.07 3.47 0.20 5.51 0.00 -1.26 -1.86 121.76 128.89 2bsd s ALA 75 Ca 0.01 1.11 0.10 0.00 0.00 0.00 0.00 51.96 53.17 2bsd s ALA 75 Cb -0.15 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 2bsd s ALA 75 CO -0.01 -0.45 -0.13 -0.51 0.00 0.00 0.00 175.76 174.66 2bsd s LEU 76 N -1.45 2.83 -0.08 0.00 1.43 0.01 -4.60 118.68 116.82 2bsd s LEU 76 Ca 0.48 -0.70 -0.10 0.00 -1.03 0.00 0.00 54.13 52.79 2bsd s LEU 76 Cb -0.37 -1.49 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 2bsd s LEU 76 CO 0.47 0.09 0.24 -1.59 0.23 0.00 0.00 176.35 175.79 2bsd s LYS 77 N -2.93 3.65 0.51 1.70 -2.85 -1.26 -4.84 119.74 113.72 2bsd s LYS 77 Ca 0.25 0.06 -0.21 0.00 -1.00 0.00 0.00 55.97 55.08 2bsd s LYS 77 Cb -0.08 -3.21 -0.06 0.00 -2.06 0.00 0.00 37.83 32.41 2bsd s LYS 77 CO 0.14 0.72 1.15 0.20 0.10 0.00 0.00 175.35 177.66 2bsd s GLY 78 N -0.97 2.69 -1.37 0.59 0.00 -1.26 -4.09 107.32 102.91 2bsd s GLY 78 Ca 0.18 0.87 -0.07 0.00 0.00 0.00 0.00 44.72 45.70 2bsd s GLY 78 CO 0.07 1.27 1.05 1.22 0.00 0.00 0.00 173.10 176.71 2bsd n ASP 79 N -0.99 -4.63 -3.79 1.64 8.00 0.72 -4.92 116.55 112.58 2bsd n ASP 79 Ca 0.10 -0.64 -0.08 0.00 0.71 0.00 0.00 54.79 54.87 2bsd n ASP 79 Cb 0.50 -4.68 -0.03 0.00 -0.02 0.00 0.00 41.12 36.89 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 -3.63 -0.28 -0.33 -2.24 1.04 -1.21 -4.96 113.70 102.09 2bsd s SER 80 Ca 0.43 -0.54 -0.21 0.00 0.48 0.00 0.00 55.95 56.11 2bsd s SER 80 Cb -0.20 0.67 -0.00 0.00 0.10 0.00 0.00 66.02 66.59 2bsd s SER 80 CO 0.76 -1.22 0.69 -0.69 0.98 0.00 0.00 173.24 173.76 2bsd s VAL 81 N -3.90 4.86 -0.21 5.02 1.01 -1.26 -1.22 120.40 124.71 2bsd s VAL 81 Ca 0.11 0.85 -0.16 0.00 0.00 0.00 0.00 61.98 62.78 2bsd s VAL 81 Cb -0.04 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 2bsd s VAL 81 CO 0.03 -0.26 0.39 0.20 0.00 0.00 0.00 175.10 175.46 2bsd s ASN 82 N 1.71 6.42 -0.42 3.32 0.01 0.15 -4.66 114.94 121.47 2bsd s ASN 82 Ca 0.27 0.49 -0.17 0.00 -0.71 0.00 0.00 52.86 52.75 2bsd s ASN 82 Cb -0.14 -2.23 0.02 0.00 0.41 0.00 0.00 41.25 39.31 2bsd s ASN 82 CO 0.14 -0.08 0.39 -0.31 -1.51 0.00 0.00 177.10 175.73 2bsd s TYR 83 N 1.36 3.19 -0.15 2.20 2.02 -0.08 -0.30 117.35 125.58 2bsd s TYR 83 Ca 0.18 -0.47 -0.26 0.00 -0.37 0.00 0.00 57.07 56.16 2bsd s TYR 83 Cb -0.15 -2.82 -0.02 0.00 -0.40 0.00 0.00 41.96 38.58 2bsd s TYR 83 CO 0.08 -0.68 0.85 0.42 -1.57 0.00 0.00 175.55 174.65 2bsd s ILE 84 N 1.98 4.88 0.05 2.71 -1.09 0.80 -1.10 121.20 129.43 2bsd s ILE 84 Ca 0.09 1.68 0.07 0.00 -2.23 0.00 0.00 60.65 60.26 2bsd s ILE 84 Cb -0.18 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.51 2bsd s ILE 84 CO 0.12 0.04 -0.17 -1.00 -1.23 0.00 0.00 174.94 172.70 2bsd s HIS 85 N 2.03 2.59 -0.17 3.97 3.76 0.34 -1.29 115.29 126.53 2bsd s HIS 85 Ca 0.40 -0.23 -0.10 0.00 -0.15 0.00 0.00 55.06 54.98 2bsd s HIS 85 Cb -0.17 -1.46 -0.05 0.00 1.11 0.00 0.00 32.58 32.01 2bsd s HIS 85 CO 0.14 0.29 0.16 0.00 -0.85 0.00 0.00 174.74 174.47 2bsd s ALA 86 N -0.97 3.73 -0.19 -1.40 0.00 0.14 -1.82 121.76 121.26 2bsd s ALA 86 Ca 0.16 -0.63 0.01 0.00 0.00 0.00 0.00 51.96 51.49 2bsd s ALA 86 Cb -0.11 -2.15 0.02 0.00 0.00 0.00 0.00 23.12 20.89 2bsd s ALA 86 CO 0.06 0.29 -0.19 -0.80 0.00 0.00 0.00 175.76 175.13 2bsd s ASN 87 N -0.07 3.29 -0.27 0.00 0.01 0.10 -1.46 114.94 116.54 2bsd s ASN 87 Ca 0.12 -0.71 -0.04 0.00 -0.71 0.00 0.00 52.86 51.52 2bsd s ASN 87 Cb -0.12 -1.50 0.02 0.00 0.41 0.00 0.00 41.25 40.06 2bsd s ASN 87 CO 0.01 -0.02 0.01 -0.63 -1.51 0.00 0.00 177.10 174.96 2bsd s ILE 88 N 1.28 3.42 -0.34 0.60 1.09 0.11 -1.74 121.20 125.62 2bsd s ILE 88 Ca 0.04 -0.83 0.02 0.00 -1.10 0.00 0.00 60.65 58.78 2bsd s ILE 88 Cb -0.14 -2.73 0.10 0.00 -1.06 0.00 0.00 42.46 38.63 2bsd s ILE 88 CO -0.12 0.16 0.08 -0.62 -0.10 0.00 0.00 174.94 174.35 2bsd s ASP 89 N 1.42 4.43 0.22 3.58 -1.08 0.98 -1.53 116.67 124.69 2bsd s ASP 89 Ca 0.02 -2.01 0.23 0.00 -0.52 0.00 0.00 52.55 50.26 2bsd s ASP 89 Cb -0.17 -1.32 0.93 0.00 -1.46 0.00 0.00 42.92 40.91 2bsd s ASP 89 CO -0.01 -0.38 1.69 0.18 0.52 0.00 0.00 175.17 177.16 2bsd n LEU 90 N 4.40 0.59 0.25 -1.34 4.77 -1.26 -2.00 117.00 122.41 2bsd n LEU 90 Ca 0.02 0.64 0.15 0.00 -0.03 0.00 0.00 56.01 56.79 2bsd n LEU 90 Cb 0.41 -0.56 0.51 0.00 -2.33 0.00 0.00 43.42 41.45 2bsd n LEU 90 CO 0.18 -0.51 0.92 0.71 -1.33 0.00 0.00 177.39 177.36 2bsd h THR 91 N 0.00 0.07 -2.47 -5.08 1.35 -1.93 -3.37 112.91 101.47 2bsd h THR 91 Ca 0.00 -0.74 -0.73 0.00 -0.55 0.00 0.00 66.41 64.39 2bsd h THR 91 Cb 0.36 1.69 -0.19 0.00 -1.73 0.00 0.00 68.15 68.28 2bsd h THR 91 CO 0.00 0.03 1.04 -1.10 -0.25 0.00 0.00 175.52 175.24 2bsd s GLN 92 N -3.52 3.93 0.28 4.72 -1.52 -0.85 -4.91 119.66 117.79 2bsd s GLN 92 Ca 0.03 -2.39 -0.02 0.00 -1.95 0.00 0.00 55.36 51.02 2bsd s GLN 92 Cb 0.08 -4.93 0.38 0.00 -0.22 0.00 0.00 33.01 28.32 2bsd s GLN 92 CO 0.59 -1.69 1.85 1.15 -0.25 0.00 0.00 175.29 176.94 2bsd h THR 93 N 4.92 1.22 -0.26 -0.19 2.02 -1.84 -1.23 112.91 117.55 2bsd h THR 93 Ca 0.24 -0.72 -0.17 0.00 0.77 0.00 0.00 66.41 66.54 2bsd h THR 93 Cb 0.93 0.49 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 2bsd h THR 93 CO 1.15 0.28 -0.50 0.00 0.37 0.00 0.00 175.52 176.83 2bsd h ALA 94 N 1.35 0.61 -2.28 6.16 0.00 -1.95 -3.39 119.26 119.76 2bsd h ALA 94 Ca 0.21 -0.49 -0.58 0.00 0.00 0.00 0.00 54.91 54.04 2bsd h ALA 94 Cb 0.20 -0.09 -0.39 0.00 0.00 0.00 0.00 17.79 17.51 2bsd h ALA 94 CO -0.02 0.68 -0.98 0.09 0.00 0.00 0.00 179.25 179.02 2bsd n ASN 95 N -4.00 0.07 0.25 0.00 3.02 -1.04 -4.98 115.26 108.58 2bsd n ASN 95 Ca -0.03 -2.56 0.13 0.00 -0.03 0.00 0.00 54.58 52.09 2bsd n ASN 95 Cb 0.59 -0.60 0.62 0.00 -0.61 0.00 0.00 39.78 39.79 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 5.04 0.00 -5.76 3.52 0.13 -1.43 -3.43 132.00 130.07 2bsd h PRO 96 Ca 0.20 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.66 2bsd h PRO 96 Cb 0.88 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 31.78 2bsd h PRO 96 CO 0.44 0.13 -0.73 0.08 -0.23 0.00 0.00 178.00 177.68 2bsd s VAL 97 N -3.80 3.36 0.05 1.56 1.01 -1.26 -0.01 120.40 121.30 2bsd s VAL 97 Ca -0.00 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2bsd s VAL 97 Cb 0.11 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 2bsd s VAL 97 CO 0.59 0.55 -0.05 -0.94 0.00 0.00 0.00 175.10 175.25 2bsd s SER 98 N -0.19 0.61 0.02 3.32 1.04 -0.71 -4.99 113.70 112.80 2bsd s SER 98 Ca 0.01 -0.73 0.01 0.00 0.48 0.00 0.00 55.95 55.72 2bsd s SER 98 Cb -0.13 0.11 -0.04 0.00 0.10 0.00 0.00 66.02 66.06 2bsd s SER 98 CO 0.03 -0.39 0.04 -0.76 0.98 0.00 0.00 173.24 173.14 2bsd s LEU 99 N -2.15 3.69 0.03 2.42 1.43 -1.26 -0.72 118.68 122.12 2bsd s LEU 99 Ca -0.04 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.11 2bsd s LEU 99 Cb -0.03 -2.19 -0.02 0.00 0.03 0.00 0.00 46.19 43.98 2bsd s LEU 99 CO -0.04 0.25 -0.05 -0.94 0.23 0.00 0.00 176.35 175.81 2bsd s SER 100 N -1.80 0.48 -0.23 2.29 1.04 -0.75 -4.99 113.70 109.73 2bsd s SER 100 Ca 0.23 -0.53 -0.06 0.00 0.48 0.00 0.00 55.95 56.07 2bsd s SER 100 Cb -0.12 0.08 -0.02 0.00 0.10 0.00 0.00 66.02 66.06 2bsd s SER 100 CO 0.14 -0.27 0.02 0.00 0.98 0.00 0.00 173.24 174.10 2bsd s ALA 101 N -1.49 3.00 0.25 5.32 0.00 -1.26 -0.51 121.76 127.07 2bsd s ALA 101 Ca -0.13 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.76 2bsd s ALA 101 Cb -0.10 -1.90 -0.05 0.00 0.00 0.00 0.00 23.12 21.07 2bsd s ALA 101 CO -0.01 -0.45 -0.08 -1.21 0.00 0.00 0.00 175.76 174.01 2bsd s GLU 102 N 1.53 1.45 0.47 0.00 2.02 -0.26 -4.88 118.70 119.02 2bsd s GLU 102 Ca 0.06 -1.70 0.26 0.00 0.02 0.00 0.00 54.97 53.61 2bsd s GLU 102 Cb -0.15 -1.08 0.66 0.00 0.10 0.00 0.00 34.13 33.66 2bsd s GLU 102 CO 0.00 0.08 1.73 1.79 0.02 0.00 0.00 175.26 178.88 2bsd h THR 103 N 2.40 0.00 -4.34 3.63 1.35 -1.87 -0.19 112.91 113.90 2bsd h THR 103 Ca -0.39 -0.84 -0.22 0.00 -0.55 0.00 0.00 66.41 64.41 2bsd h THR 103 Cb 1.23 1.84 -0.15 0.00 -1.73 0.00 0.00 68.15 69.34 2bsd h THR 103 CO 0.65 0.00 -0.64 0.00 -0.25 0.00 0.00 175.52 175.28 2bsd s ALA 104 N -3.35 1.03 -0.38 6.62 0.00 -1.26 -4.83 121.76 119.59 2bsd s ALA 104 Ca 0.05 -1.55 -0.29 0.00 0.00 0.00 0.00 51.96 50.17 2bsd s ALA 104 Cb 0.06 0.94 -0.00 0.00 0.00 0.00 0.00 23.12 24.12 2bsd s ALA 104 CO 0.63 -0.48 1.54 1.21 0.00 0.00 0.00 175.76 178.65 2bsd s ASN 105 N -3.10 6.20 -0.18 0.00 3.84 -1.26 -4.71 114.94 115.73 2bsd s ASN 105 Ca 0.28 1.01 0.16 0.00 0.21 0.00 0.00 52.86 54.51 2bsd s ASN 105 Cb 0.07 -2.54 0.44 0.00 -0.55 0.00 0.00 41.25 38.67 2bsd s ASN 105 CO 0.05 -1.51 1.32 0.59 -2.79 0.00 0.00 177.10 174.76 2bsd n ASN 106 N 9.25 3.00 -4.60 -4.21 3.02 -1.26 -5.03 115.26 115.43 2bsd n ASN 106 Ca 0.19 -3.22 -0.55 0.00 -0.03 0.00 0.00 54.58 50.97 2bsd n ASN 106 Cb 0.47 -0.52 -0.07 0.00 -0.61 0.00 0.00 39.78 39.06 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 -0.97 1.40 -0.07 6.41 7.64 -1.26 -4.85 113.62 121.92 2bsd n SER 107 Ca 0.21 1.12 0.03 0.00 1.01 0.00 0.00 58.87 61.25 2bsd n SER 107 Cb 0.82 -1.12 -0.02 0.00 -1.01 0.00 0.00 64.21 62.88 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 2.78 0.62 -2.45 6.43 0.23 -0.74 -5.01 115.26 117.12 2bsd n ASN 108 Ca 0.20 -0.81 -0.18 0.00 -0.53 0.00 0.00 54.58 53.27 2bsd n ASN 108 Cb 0.15 0.77 -0.01 0.00 -2.08 0.00 0.00 39.78 38.61 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 0.99 -0.50 3.72 4.83 0.00 -1.26 -4.94 105.19 108.04 2bsd n GLY 109 Ca 0.02 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.89 3.69 -1.16 1.61 1.01 -1.26 -4.83 120.40 116.57 2bsd s VAL 110 Ca 0.02 1.25 -0.19 0.00 0.00 0.00 0.00 61.98 63.06 2bsd s VAL 110 Cb -0.01 -3.80 0.09 0.00 0.00 0.00 0.00 36.38 32.66 2bsd s VAL 110 CO 0.02 0.12 1.54 -0.62 0.00 0.00 0.00 175.10 176.16 2bsd s ASP 111 N 0.87 6.75 0.05 3.32 -1.08 -1.26 -4.63 116.67 120.69 2bsd s ASP 111 Ca 0.59 -2.19 0.24 0.00 -0.52 0.00 0.00 52.55 50.66 2bsd s ASP 111 Cb -0.33 -2.53 0.97 0.00 -1.46 0.00 0.00 42.92 39.57 2bsd s ASP 111 CO 0.31 -1.19 1.75 2.30 0.52 0.00 0.00 175.17 178.86 2bsd n ILE 112 N 6.16 0.46 1.01 4.11 -0.00 -1.26 -2.24 119.36 127.60 2bsd n ILE 112 Ca 0.39 0.06 0.12 0.00 -0.00 0.00 0.00 62.75 63.33 2bsd n ILE 112 Cb 0.47 -0.73 0.31 0.00 -0.00 0.00 0.00 39.64 39.70 2bsd n ILE 112 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 2bsd n ASN 113 N -1.67 0.44 0.00 7.28 3.02 -1.26 -4.31 115.26 118.76 2bsd n ASN 113 Ca 0.05 -0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 2bsd n ASN 113 Cb 0.29 0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 2bsd n ASN 113 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2bsd n ASN 114 N -1.47 4.58 -2.23 6.41 3.02 -1.18 -4.83 115.26 119.55 2bsd n ASN 114 Ca 0.06 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.52 2bsd n ASN 114 Cb 0.34 0.87 -0.01 0.00 -0.61 0.00 0.00 39.78 40.36 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 2.34 2.30 3.92 7.41 0.00 -0.95 -5.15 105.19 115.06 2bsd n GLY 115 Ca 0.00 -1.47 -0.27 0.00 0.00 0.00 0.00 46.02 44.28 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 -2.35 4.52 0.00 1.61 1.04 -1.26 -4.39 113.70 112.87 2bsd s SER 116 Ca 0.17 0.51 0.00 0.00 0.48 0.00 0.00 55.95 57.10 2bsd s SER 116 Cb -0.01 -1.03 0.00 0.00 0.10 0.00 0.00 66.02 65.08 2bsd s SER 116 CO 0.12 -1.83 0.00 0.61 0.98 0.00 0.00 173.24 173.13 2bsd n GLY 117 N -3.13 2.52 3.38 7.32 0.00 -1.26 -4.84 105.19 109.17 2bsd n GLY 117 Ca 0.09 -2.10 -0.34 0.00 0.00 0.00 0.00 46.02 43.67 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 -1.91 3.51 0.02 1.61 1.01 -1.26 -4.69 120.40 118.69 2bsd s VAL 118 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 2bsd s VAL 118 Cb 0.00 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 2bsd s VAL 118 CO 0.00 0.45 0.97 -0.22 0.00 0.00 0.00 175.10 176.30 2bsd s LEU 119 N 1.02 4.40 -0.14 3.92 2.96 -0.58 -4.69 118.68 125.57 2bsd s LEU 119 Ca 0.01 1.68 0.02 0.00 -0.22 0.00 0.00 54.13 55.61 2bsd s LEU 119 Cb -0.15 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.00 2bsd s LEU 119 CO 0.00 -0.21 -0.20 -0.54 -1.32 0.00 0.00 176.35 174.08 2bsd s LYS 120 N 0.77 2.81 -0.03 1.98 1.02 -1.26 0.04 119.74 125.07 2bsd s LYS 120 Ca 0.51 -0.77 0.01 0.00 0.02 0.00 0.00 55.97 55.74 2bsd s LYS 120 Cb -0.21 -2.33 0.02 0.00 -0.52 0.00 0.00 37.83 34.78 2bsd s LYS 120 CO 0.28 -0.07 -0.05 0.08 -0.92 0.00 0.00 175.35 174.67 2bsd s VAL 121 N 0.98 0.54 -0.04 3.17 1.01 -0.54 -1.79 120.40 123.73 2bsd s VAL 121 Ca -0.04 -0.17 -0.25 0.00 0.00 0.00 0.00 61.98 61.52 2bsd s VAL 121 Cb -0.15 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 2bsd s VAL 121 CO -0.04 0.21 0.78 0.00 0.00 0.00 0.00 175.10 176.04 2bsd n PHE 123 N 3.74 0.00 -3.81 0.00 1.16 -0.41 -4.84 117.46 113.30 2bsd n PHE 123 Ca 0.01 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.46 2bsd n PHE 123 Cb 0.51 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.28 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 -1.28 -0.14 -0.20 5.98 2.15 -1.19 -1.38 116.67 120.61 2bsd s ASP 124 Ca 0.00 0.15 0.01 0.00 0.43 0.00 0.00 52.55 53.14 2bsd s ASP 124 Cb 0.00 0.35 0.04 0.00 -0.30 0.00 0.00 42.92 43.01 2bsd s ASP 124 CO 0.00 -0.28 -0.11 -0.63 -0.17 0.00 0.00 175.17 173.98 2bsd s ILE 125 N -0.76 1.68 -0.19 4.11 1.01 0.71 -0.14 121.20 127.62 2bsd s ILE 125 Ca -0.09 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 59.57 2bsd s ILE 125 Cb -0.05 -1.72 0.01 0.00 0.01 0.00 0.00 42.46 40.71 2bsd s ILE 125 CO 0.02 0.21 -0.17 -0.69 0.00 0.00 0.00 174.94 174.31 2bsd s VAL 126 N 1.39 2.33 -0.12 2.92 1.01 0.59 -0.15 120.40 128.36 2bsd s VAL 126 Ca -0.01 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 2bsd s VAL 126 Cb -0.16 -2.00 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 2bsd s VAL 126 CO -0.09 0.52 0.25 -0.89 0.00 0.00 0.00 175.10 174.89 2bsd s THR 127 N 1.32 5.32 0.27 3.92 2.01 0.54 0.34 115.64 129.37 2bsd s THR 127 Ca 0.05 0.47 0.12 0.00 0.31 0.00 0.00 61.69 62.64 2bsd s THR 127 Cb -0.13 -3.56 -0.05 0.00 0.01 0.00 0.00 72.50 68.76 2bsd s THR 127 CO -0.11 0.50 -0.18 0.42 -0.69 0.00 0.00 174.62 174.55 2bsd s THR 128 N -0.26 2.57 0.00 -0.82 -4.23 -0.36 -0.90 115.64 111.64 2bsd s THR 128 Ca 0.16 -2.33 0.00 0.00 -1.18 0.00 0.00 61.69 58.35 2bsd s THR 128 Cb -0.13 -2.34 0.00 0.00 1.34 0.00 0.00 72.50 71.37 2bsd s THR 128 CO 0.05 -0.37 0.00 -1.54 -0.54 0.00 0.00 174.62 172.22 2bsd n SER 129 N -0.57 0.00 0.24 3.99 3.41 0.80 -3.28 113.62 118.21 2bsd n SER 129 Ca -0.06 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.68 2bsd n SER 129 Cb 0.60 0.00 0.52 0.00 -0.26 0.00 0.00 64.21 65.07 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 -1.95 0.21 103.07 106.32 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 -0.69 -1.30 0.00 0.00 0.00 176.54 174.55 2bsd n THR 131 N -3.27 0.00 -3.83 4.70 -2.24 -1.26 -4.79 114.28 103.59 2bsd n THR 131 Ca 0.00 -0.05 -0.06 0.00 -2.27 0.00 0.00 64.05 61.67 2bsd n THR 131 Cb 0.39 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 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 -1.47 0.06 -0.08 3.38 0.00 -1.26 -3.86 107.32 104.09 2bsd s GLY 132 Ca 0.00 -0.37 -0.30 0.00 0.00 0.00 0.00 44.72 44.05 2bsd s GLY 132 CO 0.00 0.24 1.03 0.14 0.00 0.00 0.00 173.10 174.51 2bsd s VAL 133 N -3.00 4.72 -0.15 1.40 1.01 -1.26 -0.14 120.40 122.98 2bsd s VAL 133 Ca 0.14 1.98 0.18 0.00 0.00 0.00 0.00 61.98 64.29 2bsd s VAL 133 Cb -0.04 -4.27 -0.26 0.00 0.00 0.00 0.00 36.38 31.80 2bsd s VAL 133 CO 0.07 0.04 0.17 0.35 0.00 0.00 0.00 175.10 175.73 2bsd n THR 134 N 4.42 0.98 -3.55 3.92 -2.24 -0.08 -4.90 114.28 112.82 2bsd n THR 134 Ca 0.08 -0.73 -0.15 0.00 -2.27 0.00 0.00 64.05 60.99 2bsd n THR 134 Cb 0.49 -0.35 -0.06 0.00 -2.10 0.00 0.00 70.33 68.31 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 -5.12 -0.55 0.08 3.42 1.04 -1.16 -5.03 113.70 106.38 2bsd s SER 135 Ca -0.09 0.66 0.07 0.00 0.48 0.00 0.00 55.95 57.08 2bsd s SER 135 Cb 0.08 0.53 -0.03 0.00 0.10 0.00 0.00 66.02 66.70 2bsd s SER 135 CO 0.81 -0.47 -0.19 0.42 0.98 0.00 0.00 173.24 174.79 2bsd s THR 136 N -0.99 1.56 -0.10 2.02 -4.23 -1.26 -0.33 115.64 112.31 2bsd s THR 136 Ca -0.06 -1.37 -0.04 0.00 -1.18 0.00 0.00 61.69 59.04 2bsd s THR 136 Cb -0.01 -1.41 0.05 0.00 1.34 0.00 0.00 72.50 72.47 2bsd s THR 136 CO 0.06 -0.01 0.19 -0.75 -0.54 0.00 0.00 174.62 173.57 2bsd s LYS 137 N -1.63 0.07 0.53 3.99 2.20 0.78 -5.00 119.74 120.68 2bsd s LYS 137 Ca 0.05 0.62 -0.19 0.00 -0.36 0.00 0.00 55.97 56.09 2bsd s LYS 137 Cb -0.09 -0.20 -0.06 0.00 -1.51 0.00 0.00 37.83 35.97 2bsd s LYS 137 CO 0.03 -0.30 1.11 -1.25 -0.36 0.00 0.00 175.35 174.58 2bsd s PRO 138 N 2.32 3.44 0.26 4.03 0.04 -1.26 -0.21 135.00 143.62 2bsd s PRO 138 Ca 0.02 1.54 -0.30 0.00 0.04 0.00 0.00 61.00 62.31 2bsd s PRO 138 Cb -0.12 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 2bsd s PRO 138 CO -0.07 -0.77 1.07 0.42 0.04 0.00 0.00 177.00 177.70 2bsd s ILE 139 N -1.84 3.64 0.36 0.56 -1.09 -0.48 -4.83 121.20 117.51 2bsd s ILE 139 Ca 0.71 1.61 -0.28 0.00 -2.23 0.00 0.00 60.65 60.46 2bsd s ILE 139 Cb -0.22 -4.02 -0.11 0.00 -1.58 0.00 0.00 42.46 36.52 2bsd s ILE 139 CO 0.26 0.37 1.52 0.55 -1.23 0.00 0.00 174.94 176.40 2bsd n VAL 140 N 1.43 1.77 -3.33 2.92 3.14 -1.26 -4.93 118.33 118.07 2bsd n VAL 140 Ca -0.01 -0.44 -0.43 0.00 -2.96 0.00 0.00 64.34 60.50 2bsd n VAL 140 Cb 0.45 -1.98 -0.09 0.00 -1.06 0.00 0.00 33.84 31.17 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 -1.74 3.10 -0.18 1.45 -0.21 -1.26 -4.64 119.66 116.19 2bsd s GLN 141 Ca 0.56 -0.76 -0.18 0.00 0.02 0.00 0.00 55.36 54.99 2bsd s GLN 141 Cb -0.48 -3.96 -0.04 0.00 1.00 0.00 0.00 33.01 29.53 2bsd s GLN 141 CO 0.60 -0.83 0.50 0.99 -2.12 0.00 0.00 175.29 174.43 2bsd s THR 142 N 2.10 5.13 -0.37 -0.19 2.01 -1.26 -5.05 115.64 118.01 2bsd s THR 142 Ca 0.12 0.94 -0.13 0.00 0.31 0.00 0.00 61.69 62.92 2bsd s THR 142 Cb -0.17 -3.83 0.01 0.00 0.01 0.00 0.00 72.50 68.52 2bsd s THR 142 CO 0.13 0.22 0.25 -0.44 -0.69 0.00 0.00 174.62 174.09 2bsd s SER 143 N 1.00 5.96 -0.39 3.53 0.01 -1.26 -4.58 113.70 117.96 2bsd s SER 143 Ca 0.24 -0.76 -0.18 0.00 1.31 0.00 0.00 55.95 56.57 2bsd s SER 143 Cb -0.15 -2.11 0.01 0.00 0.21 0.00 0.00 66.02 63.98 2bsd s SER 143 CO 0.10 -0.35 0.47 -0.89 0.41 0.00 0.00 173.24 172.97 2bsd s THR 144 N 1.66 5.05 0.23 1.44 2.01 0.98 -5.04 115.64 121.96 2bsd s THR 144 Ca 0.05 -0.07 0.08 0.00 0.31 0.00 0.00 61.69 62.06 2bsd s THR 144 Cb -0.18 -4.01 -0.05 0.00 0.01 0.00 0.00 72.50 68.27 2bsd s THR 144 CO 0.09 -0.35 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.78 2bsd s LEU 145 N 2.27 2.54 0.00 4.42 1.43 -1.26 -4.57 118.68 123.51 2bsd s LEU 145 Ca 0.15 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.19 2bsd s LEU 145 Cb -0.16 -0.69 0.00 0.00 0.03 0.00 0.00 46.19 45.37 2bsd s LEU 145 CO 0.14 -0.20 0.00 -0.67 0.23 0.00 0.00 176.35 175.85 2bsd n ASP 146 N -0.44 0.00 -4.24 2.29 -0.08 -1.26 -4.99 116.55 107.82 2bsd n ASP 146 Ca -0.07 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 52.88 2bsd n ASP 146 Cb 0.61 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.91 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 3.46 -0.09 1.67 0.15 -1.26 -5.12 113.70 111.52 2bsd s SER 147 Ca 0.00 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.15 2bsd s SER 147 Cb 0.00 -1.51 -0.03 0.00 -1.71 0.00 0.00 66.02 62.77 2bsd s SER 147 CO 0.00 0.10 -0.09 -0.63 1.20 0.00 0.00 173.24 173.83 2bsd s ILE 148 N 0.69 3.53 -0.17 6.45 1.01 -1.26 -5.10 121.20 126.36 2bsd s ILE 148 Ca -0.08 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.04 2bsd s ILE 148 Cb -0.16 -2.46 0.01 0.00 0.01 0.00 0.00 42.46 39.86 2bsd s ILE 148 CO 0.01 0.57 -0.17 -0.55 0.00 0.00 0.00 174.94 174.80 2bsd s SER 149 N -0.43 3.45 0.04 3.58 0.15 -1.26 -5.12 113.70 114.10 2bsd s SER 149 Ca 0.06 -0.55 0.02 0.00 0.70 0.00 0.00 55.95 56.19 2bsd s SER 149 Cb -0.12 -1.53 -0.02 0.00 -1.71 0.00 0.00 66.02 62.64 2bsd s SER 149 CO 0.02 0.05 -0.07 0.54 1.20 0.00 0.00 173.24 174.97 2bsd s VAL 150 N 1.03 0.51 -0.10 4.45 0.11 -1.26 -5.08 120.40 120.06 2bsd s VAL 150 Ca -0.01 -0.99 -0.02 0.00 -2.93 0.00 0.00 61.98 58.03 2bsd s VAL 150 Cb -0.15 -0.57 -0.01 0.00 -1.53 0.00 0.00 36.38 34.13 2bsd s VAL 150 CO -0.05 -0.34 -0.03 0.78 -3.33 0.00 0.00 175.10 172.13 2bsd h ASN 151 N 4.64 0.00 -4.38 3.54 2.35 -2.09 -3.48 115.58 116.17 2bsd h ASN 151 Ca -0.35 0.00 -0.43 0.00 -0.55 0.00 0.00 56.30 54.97 2bsd h ASN 151 Cb 1.20 0.00 -0.24 0.00 0.05 0.00 0.00 38.32 39.34 2bsd h ASN 151 CO 0.42 0.50 -0.79 -1.81 -1.65 0.00 0.00 177.43 174.10 2bsd s ASP 152 N -5.38 1.64 -0.03 5.81 1.01 -1.26 -5.15 116.67 113.32 2bsd s ASP 152 Ca -0.03 -0.51 0.02 0.00 0.71 0.00 0.00 52.55 52.75 2bsd s ASP 152 Cb 0.00 -0.08 0.01 0.00 1.01 0.00 0.00 42.92 43.86 2bsd s ASP 152 CO 0.04 -0.01 -0.06 -0.32 0.21 0.00 0.00 175.17 175.03 2bsd s MET 153 N -1.33 0.80 -0.09 8.23 -2.45 -1.26 -5.14 119.30 118.07 2bsd s MET 153 Ca 0.00 -0.20 0.04 0.00 -1.25 0.00 0.00 55.69 54.28 2bsd s MET 153 Cb -0.08 -0.77 -0.01 0.00 1.25 0.00 0.00 34.83 35.21 2bsd s MET 153 CO 0.02 0.04 -0.21 -0.08 1.05 0.00 0.00 175.02 175.83 2bsd s THR 154 N 0.41 2.34 -0.14 10.11 -1.32 -1.26 -5.12 115.64 120.66 2bsd s THR 154 Ca -0.06 -0.94 0.02 0.00 -1.21 0.00 0.00 61.69 59.51 2bsd s THR 154 Cb -0.10 -1.90 0.01 0.00 -1.51 0.00 0.00 72.50 69.00 2bsd s THR 154 CO 0.00 0.56 -0.22 -0.69 -2.21 0.00 0.00 174.62 172.06 2bsd s VAL 155 N 0.07 2.07 -0.17 5.08 1.01 -1.26 -5.01 120.40 122.19 2bsd s VAL 155 Ca -0.09 -0.97 0.20 0.00 0.00 0.00 0.00 61.98 61.11 2bsd s VAL 155 Cb -0.15 -1.83 -0.09 0.00 0.00 0.00 0.00 36.38 34.31 2bsd s VAL 155 CO 0.06 0.55 0.88 -1.54 0.00 0.00 0.00 175.10 175.05 2bsd n SER 156 N 4.10 0.76 0.00 3.32 3.41 -1.26 -4.86 113.62 119.10 2bsd n SER 156 Ca -0.20 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 2bsd n SER 156 Cb 0.51 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.94 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 1.29 0.36 3.01 5.00 0.00 -1.26 -5.14 105.19 108.45 2bsd n GLY 157 Ca -0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.55 0.23 -0.18 1.61 0.01 -1.26 -5.13 113.70 108.43 2bsd s SER 158 Ca 0.00 -0.50 -0.13 0.00 1.31 0.00 0.00 55.95 56.63 2bsd s SER 158 Cb 0.00 0.12 -0.05 0.00 0.21 0.00 0.00 66.02 66.31 2bsd s SER 158 CO 0.00 -0.34 0.27 -0.63 0.41 0.00 0.00 173.24 172.95 2bsd s ILE 159 N -1.67 5.32 -0.27 1.44 1.01 -1.26 -5.08 121.20 120.68 2bsd s ILE 159 Ca -0.14 0.48 -0.10 0.00 0.00 0.00 0.00 60.65 60.90 2bsd s ILE 159 Cb -0.08 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 2bsd s ILE 159 CO -0.01 0.38 0.14 -0.62 0.00 0.00 0.00 174.94 174.83 2bsd s ASP 160 N 0.54 5.63 0.26 3.58 -1.08 -1.26 -5.09 116.67 119.25 2bsd s ASP 160 Ca 0.15 -0.16 0.10 0.00 -0.52 0.00 0.00 52.55 52.12 2bsd s ASP 160 Cb -0.13 -2.03 -0.05 0.00 -1.46 0.00 0.00 42.92 39.25 2bsd s ASP 160 CO 0.03 -0.07 -0.09 0.68 0.52 0.00 0.00 175.17 176.25 2bsd s VAL 161 N 1.69 3.07 0.47 1.11 -7.23 -1.26 -5.11 120.40 113.14 2bsd s VAL 161 Ca 0.06 -2.07 -0.24 0.00 -1.81 0.00 0.00 61.98 57.92 2bsd s VAL 161 Cb -0.16 -2.62 -0.07 0.00 0.56 0.00 0.00 36.38 34.09 2bsd s VAL 161 CO 0.08 -0.35 1.40 -2.84 -0.31 0.00 0.00 175.10 173.07 2bsd s PRO 162 N -3.52 3.58 -0.08 4.82 0.02 -1.26 -4.76 135.00 133.81 2bsd s PRO 162 Ca 0.30 2.34 0.01 0.00 0.02 0.00 0.00 61.00 63.68 2bsd s PRO 162 Cb -0.06 -2.57 0.02 0.00 0.02 0.00 0.00 34.50 31.91 2bsd s PRO 162 CO 0.18 -0.87 -0.11 0.08 -0.33 0.00 0.00 177.00 175.94 2bsd s VAL 163 N -1.24 1.09 -0.02 3.83 1.01 -1.26 -1.63 120.40 122.18 2bsd s VAL 163 Ca 0.63 -0.41 0.08 0.00 0.00 0.00 0.00 61.98 62.27 2bsd s VAL 163 Cb -0.42 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.91 2bsd s VAL 163 CO 0.53 0.35 -0.25 -1.10 0.00 0.00 0.00 175.10 174.64 2bsd s GLN 164 N 0.97 2.01 0.09 2.72 -0.21 0.10 -4.99 119.66 120.35 2bsd s GLN 164 Ca -0.09 -0.88 0.09 0.00 0.02 0.00 0.00 55.36 54.50 2bsd s GLN 164 Cb -0.15 -1.94 -0.03 0.00 1.00 0.00 0.00 33.01 31.89 2bsd s GLN 164 CO 0.00 0.53 -0.23 0.99 -2.12 0.00 0.00 175.29 174.46 2bsd s THR 165 N -0.57 1.92 -0.14 -0.19 2.01 -1.26 -0.27 115.64 117.14 2bsd s THR 165 Ca 0.09 -1.51 -0.11 0.00 0.31 0.00 0.00 61.69 60.47 2bsd s THR 165 Cb -0.10 -1.70 0.04 0.00 0.01 0.00 0.00 72.50 70.75 2bsd s THR 165 CO -0.01 0.11 0.37 -0.22 -0.69 0.00 0.00 174.62 174.18 2bsd s LEU 166 N -1.69 0.43 -0.17 4.42 2.96 -0.66 -5.02 118.68 118.94 2bsd s LEU 166 Ca 0.10 0.76 -0.03 0.00 -0.22 0.00 0.00 54.13 54.73 2bsd s LEU 166 Cb -0.10 1.24 -0.02 0.00 0.50 0.00 0.00 46.19 47.82 2bsd s LEU 166 CO 0.04 -0.15 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.98 2bsd s THR 167 N 0.54 3.60 -0.20 3.68 2.01 -1.26 -0.65 115.64 123.37 2bsd s THR 167 Ca -0.03 -0.45 -0.01 0.00 0.31 0.00 0.00 61.69 61.52 2bsd s THR 167 Cb -0.04 -2.59 0.01 0.00 0.01 0.00 0.00 72.50 69.89 2bsd s THR 167 CO -0.03 0.47 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.55 2bsd s VAL 168 N 0.74 2.57 -1.00 3.82 1.01 -0.09 -4.99 120.40 122.47 2bsd s VAL 168 Ca -0.02 -0.82 -0.21 0.00 0.00 0.00 0.00 61.98 60.92 2bsd s VAL 168 Cb -0.15 -2.15 0.08 0.00 0.00 0.00 0.00 36.38 34.17 2bsd s VAL 168 CO 0.02 0.45 1.33 -1.61 0.00 0.00 0.00 175.10 175.29 2bsd s GLU 169 N 1.35 3.61 0.56 2.72 0.41 -1.26 -1.22 118.70 124.87 2bsd s GLU 169 Ca 0.04 -1.42 0.34 0.00 -0.41 0.00 0.00 54.97 53.53 2bsd s GLU 169 Cb -0.14 -5.19 1.52 0.00 -1.78 0.00 0.00 34.13 28.54 2bsd s GLU 169 CO -0.09 -2.04 2.04 0.00 -0.49 0.00 0.00 175.26 174.69 2bsd h ALA 170 N 9.32 1.02 0.00 5.21 0.00 -1.35 -1.17 119.26 132.29 2bsd h ALA 170 Ca 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2bsd h ALA 170 Cb 1.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2bsd h ALA 170 CO 1.30 0.04 0.00 0.41 0.00 0.00 0.00 179.25 181.00 2bsd n GLY 171 N -0.20 2.93 2.71 0.00 0.00 -1.24 -0.32 105.19 109.06 2bsd n GLY 171 Ca -0.00 -1.94 -0.06 0.00 0.00 0.00 0.00 46.02 44.01 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 -5.32 0.00 1.61 3.02 -1.26 -1.89 115.26 111.42 2bsd n ASN 172 Ca 0.00 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.70 2bsd n ASN 172 Cb 0.00 -3.36 0.00 0.00 -0.61 0.00 0.00 39.78 35.81 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 -0.12 0.10 3.73 7.41 0.00 -1.25 -2.59 105.19 112.46 2bsd n GLY 173 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.07 0.99 2.96 0.31 -1.30 118.68 126.10 2bsd s LEU 174 Ca 0.00 1.85 0.05 0.00 -0.22 0.00 0.00 54.13 55.82 2bsd s LEU 174 Cb 0.00 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.09 2bsd s LEU 174 CO 0.00 -0.05 -0.24 -1.58 -1.32 0.00 0.00 176.35 173.16 2bsd s GLN 175 N -0.24 2.71 -0.08 1.98 0.74 -0.44 -1.17 119.66 123.16 2bsd s GLN 175 Ca 0.46 -0.89 0.01 0.00 0.05 0.00 0.00 55.36 55.00 2bsd s GLN 175 Cb -0.24 -2.22 -0.02 0.00 1.10 0.00 0.00 33.01 31.62 2bsd s GLN 175 CO 0.31 0.33 -0.11 -0.51 -0.55 0.00 0.00 175.29 174.76 2bsd s LEU 176 N -0.03 2.90 -0.30 3.68 1.43 -0.36 -0.90 118.68 125.10 2bsd s LEU 176 Ca -0.07 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 2bsd s LEU 176 Cb -0.15 -1.63 0.07 0.00 0.03 0.00 0.00 46.19 44.51 2bsd s LEU 176 CO 0.05 0.29 -0.02 -1.58 0.23 0.00 0.00 176.35 175.31 2bsd s GLN 177 N -0.38 2.11 -0.10 1.70 -0.44 -0.17 -0.91 119.66 121.47 2bsd s GLN 177 Ca 0.05 -1.47 -0.05 0.00 -2.50 0.00 0.00 55.36 51.38 2bsd s GLN 177 Cb -0.12 -3.08 -0.04 0.00 -1.64 0.00 0.00 33.01 28.13 2bsd s GLN 177 CO 0.02 -0.70 0.08 -0.51 0.50 0.00 0.00 175.29 174.68 2bsd s LEU 178 N 1.10 4.03 -0.13 3.68 1.02 0.18 -0.59 118.68 127.98 2bsd s LEU 178 Ca -0.03 0.33 0.00 0.00 0.02 0.00 0.00 54.13 54.45 2bsd s LEU 178 Cb -0.20 -1.96 0.02 0.00 0.02 0.00 0.00 46.19 44.07 2bsd s LEU 178 CO -0.05 0.40 -0.11 -0.89 0.02 0.00 0.00 176.35 175.72 2bsd s THR 179 N -0.97 1.26 -0.15 5.49 2.01 -0.56 -1.66 115.64 121.07 2bsd s THR 179 Ca 0.14 -0.44 -0.02 0.00 0.31 0.00 0.00 61.69 61.68 2bsd s THR 179 Cb -0.12 -1.23 -0.02 0.00 0.01 0.00 0.00 72.50 71.15 2bsd s THR 179 CO 0.03 0.41 -0.09 -0.75 -0.69 0.00 0.00 174.62 173.53 2bsd s LYS 180 N 1.56 3.48 0.02 4.92 2.20 0.63 -1.40 119.74 131.16 2bsd s LYS 180 Ca 0.04 -0.62 0.08 0.00 -0.36 0.00 0.00 55.97 55.11 2bsd s LYS 180 Cb -0.13 -2.77 -0.02 0.00 -1.51 0.00 0.00 37.83 33.40 2bsd s LYS 180 CO -0.09 0.17 -0.25 0.15 -0.36 0.00 0.00 175.35 174.97 2bsd s LYS 181 N 0.49 1.83 -1.66 4.03 1.02 -0.18 -0.72 119.74 124.54 2bsd s LYS 181 Ca -0.07 -1.01 0.00 0.00 0.02 0.00 0.00 55.97 54.92 2bsd s LYS 181 Cb -0.15 -1.91 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 2bsd s LYS 181 CO 0.04 0.50 0.00 -1.71 -0.92 0.00 0.00 175.35 173.26 2bsd n ASN 182 N 2.04 -5.01 -3.53 2.83 5.15 -0.64 -1.89 115.26 114.20 2bsd n ASN 182 Ca -0.17 0.20 -0.26 0.00 -0.60 0.00 0.00 54.58 53.76 2bsd n ASN 182 Cb 0.52 -4.30 0.00 0.00 -0.53 0.00 0.00 39.78 35.47 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 -1.60 -4.15 0.18 1.20 5.15 -1.26 -4.74 115.26 110.05 2bsd n ASN 183 Ca -0.20 -0.52 0.00 0.00 -0.60 0.00 0.00 54.58 53.26 2bsd n ASN 183 Cb 0.63 -3.39 0.00 0.00 -0.53 0.00 0.00 39.78 36.49 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 -2.46 -2.34 -4.66 1.20 2.03 -0.79 -4.80 116.55 104.73 2bsd n ASP 184 Ca -0.00 0.66 -0.41 0.00 0.52 0.00 0.00 54.79 55.56 2bsd n ASP 184 Cb 0.54 2.29 -0.04 0.00 -0.72 0.00 0.00 41.12 43.19 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 -6.71 4.14 -0.12 -2.67 2.96 -0.79 -0.70 118.68 114.79 2bsd s LEU 185 Ca 0.00 1.10 0.02 0.00 -0.22 0.00 0.00 54.13 55.03 2bsd s LEU 185 Cb 0.00 -3.19 -0.00 0.00 0.50 0.00 0.00 46.19 43.50 2bsd s LEU 185 CO 0.00 -0.43 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.72 2bsd s VAL 186 N 2.37 2.45 -0.18 1.68 1.01 -0.30 -1.01 120.40 126.43 2bsd s VAL 186 Ca 0.36 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 2bsd s VAL 186 Cb -0.16 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 2bsd s VAL 186 CO 0.10 0.54 -0.04 -0.63 0.00 0.00 0.00 175.10 175.07 2bsd s ILE 187 N 0.46 3.65 -0.17 2.22 1.01 -0.49 -1.22 121.20 126.66 2bsd s ILE 187 Ca -0.13 -0.42 -0.07 0.00 0.00 0.00 0.00 60.65 60.02 2bsd s ILE 187 Cb -0.17 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 2bsd s ILE 187 CO 0.06 0.46 0.06 -0.69 0.00 0.00 0.00 174.94 174.83 2bsd s VAL 188 N 0.81 4.78 -0.21 2.92 1.01 0.24 -1.50 120.40 128.46 2bsd s VAL 188 Ca -0.01 -0.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.88 2bsd s VAL 188 Cb -0.15 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 2bsd s VAL 188 CO 0.02 0.48 -0.02 -0.13 0.00 0.00 0.00 175.10 175.45 2bsd s ARG 189 N 0.19 3.53 0.01 2.72 0.52 0.25 -1.10 118.95 125.07 2bsd s ARG 189 Ca 0.04 -0.56 -0.27 0.00 -0.52 0.00 0.00 55.73 54.42 2bsd s ARG 189 Cb -0.12 -3.05 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 2bsd s ARG 189 CO 0.00 -0.07 0.86 -0.06 0.02 0.00 0.00 175.30 176.06 2bsd s PHE 190 N 1.18 3.69 0.23 -0.53 0.08 -0.18 -1.00 117.98 121.45 2bsd s PHE 190 Ca 0.03 1.56 0.04 0.00 0.12 0.00 0.00 56.93 58.67 2bsd s PHE 190 Cb -0.15 -2.96 -0.01 0.00 -0.57 0.00 0.00 43.02 39.33 2bsd s PHE 190 CO 0.00 0.12 0.14 1.19 -0.10 0.00 0.00 175.22 176.58 2bsd n PHE 191 N 3.41 -0.26 -4.06 0.36 3.72 -0.08 -3.92 117.46 116.63 2bsd n PHE 191 Ca 0.02 -1.73 0.00 0.00 -0.05 0.00 0.00 57.45 55.68 2bsd n PHE 191 Cb 0.51 0.11 0.00 0.00 -0.94 0.00 0.00 39.48 39.15 2bsd n PHE 191 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bsd n GLY 192 N -0.10 0.42 3.44 1.37 0.00 -1.26 -1.32 105.19 107.73 2bsd n GLY 192 Ca 0.01 -0.92 -0.09 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.06 -0.01 1.61 0.01 -0.42 -2.44 113.70 108.39 2bsd s SER 193 Ca 0.00 -0.80 0.04 0.00 1.31 0.00 0.00 55.95 56.50 2bsd s SER 193 Cb 0.00 0.51 -0.01 0.00 0.21 0.00 0.00 66.02 66.73 2bsd s SER 193 CO 0.00 -0.99 -0.13 -0.69 0.41 0.00 0.00 173.24 171.84 2bsd s VAL 194 N -3.96 0.99 0.12 3.43 1.01 -0.64 -0.53 120.40 120.82 2bsd s VAL 194 Ca 0.17 -0.56 -0.20 0.00 0.00 0.00 0.00 61.98 61.39 2bsd s VAL 194 Cb 0.01 -0.83 0.05 0.00 0.00 0.00 0.00 36.38 35.62 2bsd s VAL 194 CO 0.02 0.26 0.50 -0.94 0.00 0.00 0.00 175.10 174.94 2bsd s SER 195 N -0.34 -0.40 -1.14 3.32 1.04 -1.07 -1.67 113.70 113.45 2bsd s SER 195 Ca 0.05 -0.10 -0.09 0.00 0.48 0.00 0.00 55.95 56.29 2bsd s SER 195 Cb -0.05 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.56 2bsd s SER 195 CO -0.00 -0.86 0.85 0.59 0.98 0.00 0.00 173.24 174.79 2bsd n ASN 196 N -0.14 -4.82 -3.80 7.02 5.03 -0.18 -4.79 115.26 113.58 2bsd n ASN 196 Ca -0.17 -0.81 -0.12 0.00 0.87 0.00 0.00 54.58 54.35 2bsd n ASN 196 Cb 0.63 -4.47 -0.09 0.00 -1.02 0.00 0.00 39.78 34.83 2bsd n ASN 196 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 2bsd s ILE 197 N -3.46 0.06 0.19 2.41 2.07 -0.95 -5.01 121.20 116.51 2bsd s ILE 197 Ca 0.34 -0.49 0.09 0.00 -1.41 0.00 0.00 60.65 59.18 2bsd s ILE 197 Cb -0.08 -0.51 -0.04 0.00 0.13 0.00 0.00 42.46 41.96 2bsd s ILE 197 CO 0.79 -0.27 -0.10 -1.10 -1.91 0.00 0.00 174.94 172.35 2bsd s GLN 198 N -1.14 2.03 0.13 3.50 -0.21 -1.26 -0.88 119.66 121.83 2bsd s GLN 198 Ca -0.12 -1.32 -0.35 0.00 0.02 0.00 0.00 55.36 53.59 2bsd s GLN 198 Cb -0.06 -2.12 -0.16 0.00 1.00 0.00 0.00 33.01 31.67 2bsd s GLN 198 CO 0.03 0.42 1.36 0.36 -2.12 0.00 0.00 175.29 175.33 2bsd n LYS 199 N -0.05 1.44 -0.50 2.91 2.85 -1.26 -1.87 118.16 121.68 2bsd n LYS 199 Ca -0.10 0.52 0.00 0.00 -1.05 0.00 0.00 58.31 57.67 2bsd n LYS 199 Cb 0.56 -2.15 0.00 0.00 -0.65 0.00 0.00 35.03 32.78 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 2.56 1.44 3.73 2.58 0.00 0.16 -5.01 105.19 110.65 2bsd n GLY 200 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.29 3.84 0.19 1.61 0.52 -0.78 -4.81 118.94 116.21 2bsd s TRP 201 Ca 0.00 1.82 -0.30 0.00 0.02 0.00 0.00 56.10 57.64 2bsd s TRP 201 Cb 0.00 -3.05 -0.08 0.00 -1.15 0.00 0.00 33.47 29.19 2bsd s TRP 201 CO 0.00 0.23 1.23 -0.80 0.02 0.00 0.00 176.95 177.64 2bsd s ASN 202 N -0.17 7.02 0.47 2.95 0.01 -1.26 -1.13 114.94 122.83 2bsd s ASN 202 Ca 0.46 2.30 -0.23 0.00 -0.71 0.00 0.00 52.86 54.68 2bsd s ASN 202 Cb -0.24 -2.61 -0.07 0.00 0.41 0.00 0.00 41.25 38.74 2bsd s ASN 202 CO 0.30 -0.42 1.26 -0.04 -1.51 0.00 0.00 177.10 176.69 2bsd s MET 203 N -0.26 3.61 -0.02 -0.60 -1.94 0.30 -4.90 119.30 115.49 2bsd s MET 203 Ca 0.54 2.01 0.09 0.00 -1.71 0.00 0.00 55.69 56.62 2bsd s MET 203 Cb -0.34 -2.44 0.30 0.00 2.01 0.00 0.00 34.83 34.36 2bsd s MET 203 CO 0.38 -0.74 1.21 -1.13 -0.01 0.00 0.00 175.02 174.73 2bsd n SER 204 N -0.51 2.00 0.00 3.03 3.41 -1.22 -4.80 113.62 115.53 2bsd n SER 204 Ca 0.07 -2.07 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 2bsd n SER 204 Cb 0.46 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 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 0.90 3.29 3.74 5.00 0.00 0.56 -4.82 105.19 113.86 2bsd n GLY 205 Ca 0.11 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 43.97 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 3.76 3.37 0.57 2.61 2.01 -0.44 -4.82 115.64 122.69 2bsd s THR 206 Ca 0.00 1.20 -0.15 0.00 0.31 0.00 0.00 61.69 63.05 2bsd s THR 206 Cb 0.00 -3.76 -0.06 0.00 0.01 0.00 0.00 72.50 68.69 2bsd s THR 206 CO 0.00 0.21 1.01 0.26 -0.69 0.00 0.00 174.62 175.42 2bsd s TRP 207 N -0.30 3.42 0.10 4.92 0.52 -1.26 -4.41 118.94 121.92 2bsd s TRP 207 Ca 0.52 1.42 -0.31 0.00 0.02 0.00 0.00 56.10 57.75 2bsd s TRP 207 Cb -0.34 -2.81 -0.08 0.00 -1.15 0.00 0.00 33.47 29.09 2bsd s TRP 207 CO 0.39 -0.61 1.45 0.08 0.02 0.00 0.00 176.95 178.28 2bsd s VAL 208 N -2.78 3.22 0.60 4.03 1.01 0.10 -4.98 120.40 121.60 2bsd s VAL 208 Ca 0.58 0.83 -0.18 0.00 0.00 0.00 0.00 61.98 63.21 2bsd s VAL 208 Cb -0.11 -3.53 -0.06 0.00 0.00 0.00 0.00 36.38 32.68 2bsd s VAL 208 CO 0.40 0.05 0.76 0.47 0.00 0.00 0.00 175.10 176.78 2bsd n ASP 209 N 4.37 -0.09 -0.19 3.32 9.92 -1.26 -4.59 116.55 128.03 2bsd n ASP 209 Ca 0.13 0.76 -0.04 0.00 -0.53 0.00 0.00 54.79 55.11 2bsd n ASP 209 Cb 0.42 -1.29 0.03 0.00 -0.64 0.00 0.00 41.12 39.63 2bsd n ASP 209 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2bsd h ARG 210 N 0.31 -0.12 0.00 -1.24 3.08 -1.96 -1.54 114.38 112.91 2bsd h ARG 210 Ca -0.47 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.59 2bsd h ARG 210 Cb 1.38 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.46 2bsd h ARG 210 CO 0.49 -0.08 0.00 -2.30 -1.07 0.00 0.00 179.97 177.01 2bsd n PRO 211 N -5.43 0.03 0.00 0.04 -0.02 -1.26 -1.81 135.00 126.54 2bsd n PRO 211 Ca 0.05 0.43 0.08 0.00 -2.02 0.00 0.00 63.50 62.04 2bsd n PRO 211 Cb 0.34 -1.57 0.01 0.00 -0.02 0.00 0.00 33.50 32.26 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 -1.62 0.00 -2.45 6.00 3.72 -0.59 -4.99 117.46 117.52 2bsd n PHE 212 Ca 0.01 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.99 2bsd n PHE 212 Cb 0.07 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.58 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 -1.84 4.46 0.64 -1.08 0.52 -0.75 -5.00 118.95 115.91 2bsd s ARG 213 Ca 0.14 1.74 -0.13 0.00 -0.52 0.00 0.00 55.73 56.96 2bsd s ARG 213 Cb 0.13 -3.35 -0.02 0.00 0.52 0.00 0.00 34.95 32.24 2bsd s ARG 213 CO 0.38 -0.21 1.05 -1.25 0.02 0.00 0.00 175.30 175.29 2bsd s PRO 214 N 0.90 3.19 0.36 3.54 0.04 -1.26 -4.90 135.00 136.86 2bsd s PRO 214 Ca 0.57 1.00 0.08 0.00 0.04 0.00 0.00 61.00 62.70 2bsd s PRO 214 Cb -0.29 -2.02 0.67 0.00 0.04 0.00 0.00 34.50 32.90 2bsd s PRO 214 CO 0.30 -0.90 1.85 0.00 0.04 0.00 0.00 177.00 178.29 2bsd h ALA 215 N -0.23 1.38 -2.24 8.56 0.00 -1.56 -3.38 119.26 121.80 2bsd h ALA 215 Ca -0.45 -0.27 -0.23 0.00 0.00 0.00 0.00 54.91 53.96 2bsd h ALA 215 Cb 1.21 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.76 2bsd h ALA 215 CO 0.58 0.43 -0.70 0.00 0.00 0.00 0.00 179.25 179.56 2bsd s ALA 216 N -4.57 1.04 0.18 0.00 0.00 -1.26 -4.82 121.76 112.33 2bsd s ALA 216 Ca -0.05 -1.38 -0.33 0.00 0.00 0.00 0.00 51.96 50.20 2bsd s ALA 216 Cb 0.15 0.19 -0.13 0.00 0.00 0.00 0.00 23.12 23.32 2bsd s ALA 216 CO 0.75 -0.23 1.61 1.55 0.00 0.00 0.00 175.76 179.43 2bsd n VAL 217 N -0.07 0.10 -4.40 0.00 3.14 -1.26 -4.64 118.33 111.20 2bsd n VAL 217 Ca -0.11 -0.02 -0.34 0.00 -2.96 0.00 0.00 64.34 60.90 2bsd n VAL 217 Cb 0.61 -1.68 -0.14 0.00 -1.06 0.00 0.00 33.84 31.57 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 0.85 3.35 -0.30 1.45 -1.52 -0.44 -4.95 119.66 118.10 2bsd s GLN 218 Ca 0.76 -0.67 -0.16 0.00 -1.95 0.00 0.00 55.36 53.34 2bsd s GLN 218 Cb -0.62 -2.76 -0.02 0.00 -0.22 0.00 0.00 33.01 29.38 2bsd s GLN 218 CO 0.37 0.03 0.43 -1.12 -0.25 0.00 0.00 175.29 174.76 2bsd s SER 219 N 0.83 6.29 -0.18 5.90 0.01 -1.26 -0.10 113.70 125.18 2bsd s SER 219 Ca -0.03 0.14 -0.01 0.00 1.31 0.00 0.00 55.95 57.35 2bsd s SER 219 Cb -0.15 -2.24 -0.00 0.00 0.21 0.00 0.00 66.02 63.84 2bsd s SER 219 CO 0.01 -0.31 -0.11 -0.76 0.41 0.00 0.00 173.24 172.47 2bsd s LEU 220 N 2.19 2.66 -0.00 2.44 1.43 0.16 -4.95 118.68 122.62 2bsd s LEU 220 Ca 0.16 -0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 52.59 2bsd s LEU 220 Cb -0.16 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 2bsd s LEU 220 CO 0.11 0.05 0.77 -0.69 0.23 0.00 0.00 176.35 176.82 2bsd s VAL 221 N 1.03 4.87 0.40 -1.59 1.01 -1.26 -1.61 120.40 123.24 2bsd s VAL 221 Ca -0.01 1.62 0.04 0.00 0.00 0.00 0.00 61.98 63.63 2bsd s VAL 221 Cb -0.15 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 2bsd s VAL 221 CO -0.02 0.29 0.05 -0.83 0.00 0.00 0.00 175.10 174.60 2bsd s GLY 222 N 0.41 2.46 0.05 4.51 0.00 -0.21 -4.64 107.32 109.90 2bsd s GLY 222 Ca 0.40 -1.65 0.04 0.00 0.00 0.00 0.00 44.72 43.51 2bsd s GLY 222 CO 0.22 -1.96 -0.12 -1.58 0.00 0.00 0.00 173.10 169.66 2bsd s HIS 223 N -3.06 1.01 -0.34 1.90 2.46 0.66 -2.26 115.29 115.67 2bsd s HIS 223 Ca 0.28 -0.43 -0.21 0.00 0.47 0.00 0.00 55.06 55.17 2bsd s HIS 223 Cb 0.07 -0.59 -0.00 0.00 -0.13 0.00 0.00 32.58 31.93 2bsd s HIS 223 CO 0.14 0.01 0.66 -0.06 -2.47 0.00 0.00 174.74 173.01 2bsd s PHE 224 N -1.15 3.17 0.08 3.88 0.08 -1.06 -0.72 117.98 122.26 2bsd s PHE 224 Ca -0.03 0.48 -0.35 0.00 0.12 0.00 0.00 56.93 57.15 2bsd s PHE 224 Cb -0.09 -3.11 -0.14 0.00 -0.57 0.00 0.00 43.02 39.11 2bsd s PHE 224 CO 0.01 -0.58 1.62 0.00 -0.10 0.00 0.00 175.22 176.17 2bsd n ALA 225 N 6.03 0.87 -1.00 5.36 0.00 -0.73 -1.78 120.51 129.25 2bsd n ALA 225 Ca -0.00 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2bsd n ALA 225 Cb 0.49 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.60 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 3.53 0.54 3.54 0.00 0.00 -1.26 -4.85 105.19 106.70 2bsd n GLY 226 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.02 1.87 -0.21 1.61 0.52 -0.73 -5.05 118.95 116.93 2bsd s ARG 227 Ca 0.00 -2.10 0.15 0.00 -0.52 0.00 0.00 55.73 53.26 2bsd s ARG 227 Cb 0.00 -0.99 0.71 0.00 0.52 0.00 0.00 34.95 35.19 2bsd s ARG 227 CO 0.00 -0.29 1.62 -0.40 0.02 0.00 0.00 175.30 176.25 2bsd n ASP 228 N -1.01 4.99 -4.70 0.23 5.68 -1.26 -4.83 116.55 115.65 2bsd n ASP 228 Ca -0.07 -2.96 -0.23 0.00 -0.50 0.00 0.00 54.79 51.03 2bsd n ASP 228 Cb 0.66 -0.63 -0.06 0.00 -1.14 0.00 0.00 41.12 39.95 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 -2.78 3.49 0.18 2.12 -4.23 -1.26 -5.07 115.64 108.09 2bsd s THR 229 Ca 0.50 -1.75 0.03 0.00 -1.18 0.00 0.00 61.69 59.28 2bsd s THR 229 Cb 0.39 -2.98 -0.05 0.00 1.34 0.00 0.00 72.50 71.20 2bsd s THR 229 CO 0.13 -0.31 -0.02 -0.94 -0.54 0.00 0.00 174.62 172.94 2bsd s SER 230 N -3.76 1.49 0.21 3.99 1.04 -1.26 -2.57 113.70 112.84 2bsd s SER 230 Ca 0.34 -1.15 -0.04 0.00 0.48 0.00 0.00 55.95 55.58 2bsd s SER 230 Cb -0.05 0.06 -0.03 0.00 0.10 0.00 0.00 66.02 66.10 2bsd s SER 230 CO 0.22 -0.50 0.23 0.72 0.98 0.00 0.00 173.24 174.88 2bsd s PHE 231 N -3.53 0.91 0.02 5.02 -0.12 -0.96 -4.68 117.98 114.65 2bsd s PHE 231 Ca 0.23 -1.18 -0.05 0.00 -0.05 0.00 0.00 56.93 55.88 2bsd s PHE 231 Cb 0.05 -0.34 -0.01 0.00 -0.63 0.00 0.00 43.02 42.09 2bsd s PHE 231 CO 0.04 -0.73 0.09 -3.38 -0.05 0.00 0.00 175.22 171.19 2bsd s HIS 232 N -4.11 0.16 0.16 3.49 -3.43 -1.26 -1.04 115.29 109.26 2bsd s HIS 232 Ca 0.33 -0.39 0.10 0.00 -0.80 0.00 0.00 55.06 54.30 2bsd s HIS 232 Cb 0.05 -0.12 -0.04 0.00 -1.43 0.00 0.00 32.58 31.03 2bsd s HIS 232 CO 0.10 -0.31 -0.20 0.96 -2.00 0.00 0.00 174.74 173.29 2bsd s ILE 233 N -2.05 2.62 -0.23 -5.38 -4.36 -0.63 -0.42 121.20 110.74 2bsd s ILE 233 Ca -0.10 -1.80 -0.07 0.00 -0.26 0.00 0.00 60.65 58.42 2bsd s ILE 233 Cb -0.04 -2.24 -0.03 0.00 1.25 0.00 0.00 42.46 41.39 2bsd s ILE 233 CO -0.02 -0.03 0.07 -1.81 0.24 0.00 0.00 174.94 173.39 2bsd s ASP 234 N -2.49 5.29 -0.42 4.36 1.01 0.37 -0.66 116.67 124.12 2bsd s ASP 234 Ca 0.20 -0.13 -0.21 0.00 0.71 0.00 0.00 52.55 53.12 2bsd s ASP 234 Cb -0.09 -1.94 0.02 0.00 1.01 0.00 0.00 42.92 41.92 2bsd s ASP 234 CO 0.10 0.02 0.67 -0.63 0.21 0.00 0.00 175.17 175.55 2bsd s ILE 235 N 1.29 4.80 0.41 0.77 1.01 0.85 -1.10 121.20 129.23 2bsd s ILE 235 Ca 0.05 0.30 -0.16 0.00 0.00 0.00 0.00 60.65 60.84 2bsd s ILE 235 Cb -0.15 -4.20 -0.09 0.00 0.01 0.00 0.00 42.46 38.04 2bsd s ILE 235 CO 0.04 -0.55 0.85 0.20 0.00 0.00 0.00 174.94 175.47 2bsd s ASN 236 N 1.98 6.74 0.51 3.58 0.01 -0.39 -1.33 114.94 126.04 2bsd s ASN 236 Ca 0.25 1.42 0.29 0.00 -0.71 0.00 0.00 52.86 54.11 2bsd s ASN 236 Cb -0.14 -2.43 1.40 0.00 0.41 0.00 0.00 41.25 40.49 2bsd s ASN 236 CO 0.19 -0.36 1.86 -0.65 -1.51 0.00 0.00 177.10 176.62 2bsd h PRO 237 N 1.69 0.10 0.00 -0.60 0.11 -1.82 -0.45 132.00 131.03 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 0.06 0.00 0.27 -0.21 0.00 0.00 178.00 178.75 2bsd n ASN 238 N -4.33 0.00 0.00 -2.05 0.23 -1.26 -4.67 115.26 103.19 2bsd n ASN 238 Ca 0.21 -0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.25 2bsd n ASN 238 Cb 0.97 -0.33 0.00 0.00 -2.08 0.00 0.00 39.78 38.34 2bsd n ASN 238 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bsd n GLY 239 N 1.20 0.14 3.82 4.83 0.00 -0.18 -4.89 105.19 110.11 2bsd n GLY 239 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.10 5.62 -0.15 1.61 1.04 -1.26 0.02 113.70 118.49 2bsd s SER 240 Ca 0.00 1.63 0.01 0.00 0.48 0.00 0.00 55.95 58.07 2bsd s SER 240 Cb 0.00 -2.50 0.02 0.00 0.10 0.00 0.00 66.02 63.64 2bsd s SER 240 CO 0.00 -1.28 -0.17 -0.63 0.98 0.00 0.00 173.24 172.15 2bsd s ILE 241 N -2.93 1.75 -0.22 -1.02 1.01 -1.26 -1.26 121.20 117.28 2bsd s ILE 241 Ca 0.59 -0.76 -0.09 0.00 0.00 0.00 0.00 60.65 60.39 2bsd s ILE 241 Cb -0.14 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 2bsd s ILE 241 CO 0.50 0.49 0.11 -0.89 0.00 0.00 0.00 174.94 175.15 2bsd s THR 242 N 1.28 5.01 -0.01 2.92 2.01 -0.26 -0.54 115.64 126.05 2bsd s THR 242 Ca 0.02 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.77 2bsd s THR 242 Cb -0.13 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.03 2bsd s THR 242 CO -0.09 0.40 1.19 0.86 -0.69 0.00 0.00 174.62 176.29 2bsd s TRP 243 N 0.81 3.30 -0.08 4.92 -0.11 -0.28 -0.48 118.94 127.03 2bsd s TRP 243 Ca 0.06 1.27 0.15 0.00 1.22 0.00 0.00 56.10 58.79 2bsd s TRP 243 Cb -0.13 -3.41 0.30 0.00 -1.50 0.00 0.00 33.47 28.73 2bsd s TRP 243 CO 0.02 -1.24 1.14 0.91 -4.62 0.00 0.00 176.95 173.16 2bsd n TRP 244 N 4.65 0.00 -1.34 5.86 7.02 0.44 0.40 117.44 134.47 2bsd n TRP 244 Ca 0.10 -0.72 -0.03 0.00 -1.02 0.00 0.00 57.50 55.82 2bsd n TRP 244 Cb 0.46 -0.15 0.02 0.00 -2.42 0.00 0.00 31.31 29.23 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 -0.36 -0.79 3.72 6.99 0.00 -1.15 -4.15 105.19 109.46 2bsd n GLY 245 Ca 0.10 -1.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 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 -3.76 1.27 0.20 4.61 0.00 -1.26 -4.21 121.76 118.62 2bsd s ALA 246 Ca 0.09 -0.58 -0.31 0.00 0.00 0.00 0.00 51.96 51.16 2bsd s ALA 246 Cb -0.00 -3.03 -0.10 0.00 0.00 0.00 0.00 23.12 19.99 2bsd s ALA 246 CO 0.06 -2.73 1.57 -0.80 0.00 0.00 0.00 175.76 173.85 2bsd s ASN 247 N -3.83 6.55 -0.14 0.00 0.01 -1.26 -4.49 114.94 111.77 2bsd s ASN 247 Ca 0.66 2.70 -0.01 0.00 -0.71 0.00 0.00 52.86 55.51 2bsd s ASN 247 Cb -0.15 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 38.89 2bsd s ASN 247 CO 0.55 -0.83 -0.12 -0.63 -1.51 0.00 0.00 177.10 174.56 2bsd s ILE 248 N 0.77 3.05 0.00 0.60 -1.09 -0.06 -5.02 121.20 119.45 2bsd s ILE 248 Ca 0.68 -0.65 0.00 0.00 -2.23 0.00 0.00 60.65 58.44 2bsd s ILE 248 Cb -0.45 -2.30 0.00 0.00 -1.58 0.00 0.00 42.46 38.14 2bsd s ILE 248 CO 0.36 0.51 0.00 -0.90 -1.23 0.00 0.00 174.94 173.68 2bsd n ASP 249 N 3.72 0.00 0.25 3.58 5.68 -1.26 -2.24 116.55 126.27 2bsd n ASP 249 Ca -0.18 0.00 0.13 0.00 -0.50 0.00 0.00 54.79 54.24 2bsd n ASP 249 Cb 0.52 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.10 2bsd n ASP 249 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2bsd h LYS 250 N 0.00 0.00 -6.16 0.11 1.57 -1.97 -0.46 116.57 109.66 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 -0.07 0.00 0.08 0.00 0.00 32.23 32.24 2bsd h LYS 250 CO 0.00 0.12 0.78 0.99 -0.57 0.00 0.00 179.45 180.78 2bsd s THR 251 N -3.74 4.61 0.27 -0.16 2.01 -1.26 -4.80 115.64 112.57 2bsd s THR 251 Ca 0.00 1.82 -0.29 0.00 0.31 0.00 0.00 61.69 63.52 2bsd s THR 251 Cb 0.10 -4.34 -0.10 0.00 0.01 0.00 0.00 72.50 68.17 2bsd s THR 251 CO 0.59 -0.33 1.26 -2.84 -0.69 0.00 0.00 174.62 172.61 2bsd s PRO 252 N 3.39 4.43 -0.11 4.92 0.02 -1.26 -4.71 135.00 141.68 2bsd s PRO 252 Ca 0.44 2.07 0.03 0.00 0.02 0.00 0.00 61.00 63.55 2bsd s PRO 252 Cb -0.14 -3.14 0.01 0.00 0.02 0.00 0.00 34.50 31.25 2bsd s PRO 252 CO 0.11 -0.12 -0.21 0.42 -0.33 0.00 0.00 177.00 176.87 2bsd s ILE 253 N -0.72 1.91 0.13 2.83 1.01 -0.67 -4.91 121.20 120.79 2bsd s ILE 253 Ca 0.50 -0.91 -0.31 0.00 0.00 0.00 0.00 60.65 59.93 2bsd s ILE 253 Cb -0.37 -1.68 -0.11 0.00 0.01 0.00 0.00 42.46 40.31 2bsd s ILE 253 CO 0.45 0.52 1.84 0.00 0.00 0.00 0.00 174.94 177.75 2bsd n ALA 254 N 3.83 2.24 -3.14 9.38 0.00 -1.26 -1.62 120.51 129.94 2bsd n ALA 254 Ca -0.20 0.32 -0.33 0.00 0.00 0.00 0.00 53.44 53.23 2bsd n ALA 254 Cb 0.52 -2.59 -0.14 0.00 0.00 0.00 0.00 19.45 17.24 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 2.68 3.26 0.10 0.00 -4.23 -1.02 -1.77 115.64 114.65 2bsd s THR 255 Ca 0.82 -0.58 -0.01 0.00 -1.18 0.00 0.00 61.69 60.74 2bsd s THR 255 Cb -0.48 -2.40 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 2bsd s THR 255 CO 0.37 0.50 0.04 -0.13 -0.54 0.00 0.00 174.62 174.86 2bsd s ARG 256 N 0.55 0.82 0.00 3.99 1.81 0.10 -3.27 118.95 122.94 2bsd s ARG 256 Ca -0.07 -1.34 0.00 0.00 -1.72 0.00 0.00 55.73 52.61 2bsd s ARG 256 Cb -0.15 0.24 0.00 0.00 -0.45 0.00 0.00 34.95 34.59 2bsd s ARG 256 CO 0.03 -0.21 0.00 0.41 -0.68 0.00 0.00 175.30 174.85 2bsd n GLY 257 N -0.02 4.17 3.68 -3.53 0.00 -1.25 -0.24 105.19 108.00 2bsd n GLY 257 Ca -0.09 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.05 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 5.79 0.06 1.61 -0.87 -1.26 -1.01 114.94 119.26 2bsd s ASN 258 Ca 0.00 0.15 0.05 0.00 -1.57 0.00 0.00 52.86 51.49 2bsd s ASN 258 Cb 0.00 -1.96 -0.03 0.00 -0.02 0.00 0.00 41.25 39.24 2bsd s ASN 258 CO 0.00 0.21 -0.14 -0.83 -2.57 0.00 0.00 177.10 173.78 2bsd s GLY 259 N 0.13 0.81 0.07 0.66 0.00 -0.26 -4.91 107.32 103.82 2bsd s GLY 259 Ca 0.06 -0.93 0.05 0.00 0.00 0.00 0.00 44.72 43.91 2bsd s GLY 259 CO 0.00 -0.94 -0.14 -1.35 0.00 0.00 0.00 173.10 170.67 2bsd s SER 260 N -1.54 1.69 0.10 1.64 1.04 -1.26 0.82 113.70 116.19 2bsd s SER 260 Ca -0.02 -0.62 -0.14 0.00 0.48 0.00 0.00 55.95 55.66 2bsd s SER 260 Cb -0.09 -0.05 0.02 0.00 0.10 0.00 0.00 66.02 66.00 2bsd s SER 260 CO 0.02 -0.08 0.33 -0.72 0.98 0.00 0.00 173.24 173.77 2bsd s TYR 261 N -1.28 -0.09 -0.06 5.02 -0.85 -0.36 -5.01 117.35 114.72 2bsd s TYR 261 Ca -0.02 -0.22 -0.14 0.00 -0.52 0.00 0.00 57.07 56.17 2bsd s TYR 261 Cb -0.10 0.14 -0.05 0.00 0.38 0.00 0.00 41.96 42.33 2bsd s TYR 261 CO 0.02 -0.62 0.37 -0.06 -1.52 0.00 0.00 175.55 173.75 2bsd s PHE 262 N -3.56 3.63 0.07 -3.49 0.08 -1.26 -1.15 117.98 112.29 2bsd s PHE 262 Ca 0.02 0.85 -0.16 0.00 0.12 0.00 0.00 56.93 57.77 2bsd s PHE 262 Cb 0.02 -2.32 -0.18 0.00 -0.57 0.00 0.00 43.02 39.97 2bsd s PHE 262 CO -0.10 0.49 1.24 0.82 -0.10 0.00 0.00 175.22 177.57 2bsd h ILE 263 N 4.11 1.32 -0.03 0.64 2.04 -1.24 -3.42 117.51 120.93 2bsd h ILE 263 Ca -0.48 -1.97 0.00 0.00 1.00 0.00 0.00 64.86 63.42 2bsd h ILE 263 Cb 1.20 2.18 0.00 0.00 -0.74 0.00 0.00 36.82 39.46 2bsd h ILE 263 CO 0.67 0.60 0.00 0.29 0.00 0.00 0.00 178.15 179.71