#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 3.32 -0.27 2.28 1.01 -1.26 -1.13 121.20 125.15 2bsd s ILE 3 Ca 0.00 -0.51 -0.09 0.00 0.00 0.00 0.00 60.65 60.05 2bsd s ILE 3 Cb 0.00 -2.50 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 2bsd s ILE 3 CO 0.00 0.43 0.13 -0.75 0.00 0.00 0.00 174.94 174.76 2bsd s LYS 4 N 1.41 3.69 -0.16 2.79 2.20 -0.17 -4.96 119.74 124.54 2bsd s LYS 4 Ca 0.05 -0.47 -0.08 0.00 -0.36 0.00 0.00 55.97 55.11 2bsd s LYS 4 Cb -0.14 -3.50 -0.04 0.00 -1.51 0.00 0.00 37.83 32.63 2bsd s LYS 4 CO -0.03 -0.24 0.11 -0.80 -0.36 0.00 0.00 175.35 174.03 2bsd s ASN 5 N 1.67 6.06 0.10 1.43 -0.87 -1.26 -0.89 114.94 121.18 2bsd s ASN 5 Ca 0.06 0.27 0.00 0.00 -1.57 0.00 0.00 52.86 51.62 2bsd s ASN 5 Cb -0.16 -2.00 0.00 0.00 -0.02 0.00 0.00 41.25 39.07 2bsd s ASN 5 CO 0.07 0.27 0.00 0.49 -2.57 0.00 0.00 177.10 175.36 2bsd n PHE 6 N 2.89 -0.16 -0.95 2.20 3.01 -1.07 -4.83 117.46 118.54 2bsd n PHE 6 Ca -0.18 0.03 -0.24 0.00 1.01 0.00 0.00 57.45 58.07 2bsd n PHE 6 Cb 0.53 0.04 -0.05 0.00 -0.01 0.00 0.00 39.48 39.99 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 -3.38 3.09 -3.81 4.37 -1.04 -1.12 -4.85 114.28 107.54 2bsd n THR 7 Ca 0.00 -1.77 -0.12 0.00 -2.04 0.00 0.00 64.05 60.11 2bsd n THR 7 Cb 0.00 -2.24 -0.12 0.00 -1.82 0.00 0.00 70.33 66.15 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 2.40 -0.19 0.00 -1.42 0.40 -1.26 -4.68 117.98 113.23 2bsd s PHE 8 Ca 0.54 0.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.34 2bsd s PHE 8 Cb 0.17 0.06 0.00 0.00 0.51 0.00 0.00 43.02 43.77 2bsd s PHE 8 CO -0.03 -0.09 0.00 1.19 0.70 0.00 0.00 175.22 176.98 2bsd n PHE 9 N 3.01 0.00 -3.72 0.36 0.99 -1.26 -4.99 117.46 111.84 2bsd n PHE 9 Ca -0.13 0.00 -0.37 0.00 -0.00 0.00 0.00 57.45 56.95 2bsd n PHE 9 Cb 0.59 0.00 -0.06 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 2.29 0.36 1.37 0.00 -1.26 -4.95 107.32 105.13 2bsd s GLY 19 Ca 0.00 -0.47 0.11 0.00 0.00 0.00 0.00 44.72 44.36 2bsd s GLY 19 CO 0.00 -0.15 1.82 1.76 0.00 0.00 0.00 173.10 176.52 2bsd h SER 20 N 4.90 0.08 0.21 1.64 0.02 -1.94 -2.75 113.55 115.72 2bsd h SER 20 Ca -0.53 -0.03 -0.17 0.00 -0.84 0.00 0.00 61.79 60.22 2bsd h SER 20 Cb 1.22 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 2bsd h SER 20 CO 0.60 0.42 -0.64 -0.55 -1.14 0.00 0.00 176.83 175.53 2bsd h ASN 21 N 0.07 0.47 -0.31 3.07 -1.07 -1.90 0.17 115.58 116.07 2bsd h ASN 21 Ca 0.01 -0.28 -0.11 0.00 0.07 0.00 0.00 56.30 55.99 2bsd h ASN 21 Cb 0.64 -0.14 -0.01 0.00 -2.07 0.00 0.00 38.32 36.74 2bsd h ASN 21 CO 0.05 0.98 -0.21 0.78 0.07 0.00 0.00 177.43 179.09 2bsd h ASN 22 N 0.30 0.80 -0.52 6.14 4.21 -1.86 -0.09 115.58 124.56 2bsd h ASN 22 Ca -0.01 -0.29 -0.05 0.00 1.21 0.00 0.00 56.30 57.16 2bsd h ASN 22 Cb 1.18 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 38.14 2bsd h ASN 22 CO 0.11 0.99 0.12 0.44 -1.29 0.00 0.00 177.43 177.80 2bsd h ASP 23 N 0.69 0.80 -0.23 5.81 3.32 -1.36 -1.33 116.42 124.12 2bsd h ASP 23 Ca 0.10 -0.24 0.03 0.00 0.02 0.00 0.00 57.03 56.94 2bsd h ASP 23 Cb 0.73 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.03 2bsd h ASP 23 CO 0.06 0.83 0.02 1.23 -1.72 0.00 0.00 179.24 179.66 2bsd h GLY 24 N 0.73 0.24 1.03 2.75 0.00 -0.30 0.54 103.07 108.06 2bsd h GLY 24 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.42 2bsd h GLY 24 CO 0.00 -0.02 0.07 0.50 0.00 0.00 0.00 176.54 177.09 2bsd h LYS 25 N 0.10 0.97 -0.15 4.80 1.57 -0.99 -1.41 116.57 121.47 2bsd h LYS 25 Ca 0.11 -0.27 0.03 0.00 -1.87 0.00 0.00 60.65 58.64 2bsd h LYS 25 Cb 0.12 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 2bsd h LYS 25 CO -0.16 0.93 -0.03 1.25 -0.57 0.00 0.00 179.45 180.87 2bsd h LEU 26 N 0.86 -0.13 -0.95 2.94 5.85 -0.86 -0.98 115.31 122.04 2bsd h LEU 26 Ca 0.17 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.84 2bsd h LEU 26 Cb 0.45 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 2bsd h LEU 26 CO 0.02 -0.05 -0.27 1.88 -0.34 0.00 0.00 178.44 179.68 2bsd h TYR 27 N 0.00 0.50 -0.23 1.25 0.05 -0.79 -1.70 116.97 116.06 2bsd h TYR 27 Ca 0.07 -0.11 -0.01 0.00 0.05 0.00 0.00 58.73 58.73 2bsd h TYR 27 Cb 0.10 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 2bsd h TYR 27 CO -0.18 0.68 0.11 0.52 -1.05 0.00 0.00 178.16 178.24 2bsd h MET 28 N 0.40 0.33 -0.26 4.88 2.86 -0.83 -2.52 114.93 119.79 2bsd h MET 28 Ca 0.06 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.56 2bsd h MET 28 Cb 0.68 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 2bsd h MET 28 CO 0.05 0.34 -0.22 0.52 1.06 0.00 0.00 176.91 178.66 2bsd h MET 29 N 0.24 0.48 -0.35 1.72 2.86 -0.95 -0.39 114.93 118.55 2bsd h MET 29 Ca 0.08 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.50 2bsd h MET 29 Cb 0.12 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 2bsd h MET 29 CO -0.01 0.68 0.03 -0.07 1.06 0.00 0.00 176.91 178.60 2bsd h LEU 30 N 0.43 0.58 -0.42 1.22 3.38 -1.17 -3.22 115.31 116.12 2bsd h LEU 30 Ca 0.07 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2bsd h LEU 30 Cb 0.63 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2bsd h LEU 30 CO 0.04 0.72 -0.36 1.07 0.09 0.00 0.00 178.44 180.00 2bsd n THR 31 N -4.54 0.00 -2.88 0.22 5.66 -0.96 -4.99 114.28 106.79 2bsd n THR 31 Ca -0.02 -0.11 -0.11 0.00 -3.05 0.00 0.00 64.05 60.77 2bsd n THR 31 Cb 0.25 0.48 0.06 0.00 -1.55 0.00 0.00 70.33 69.56 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 1.39 -0.15 3.38 1.09 0.00 -0.22 -4.65 105.19 106.04 2bsd n GLY 32 Ca 0.10 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.71 1.99 0.02 1.61 0.23 -0.82 0.44 119.30 118.05 2bsd s MET 33 Ca 0.05 -1.01 0.00 0.00 -1.03 0.00 0.00 55.69 53.71 2bsd s MET 33 Cb -0.01 -2.08 0.00 0.00 -1.53 0.00 0.00 34.83 31.22 2bsd s MET 33 CO 0.48 0.54 0.02 -0.40 -2.03 0.00 0.00 175.02 173.63 2bsd n ASP 34 N 1.89 0.51 0.00 -1.18 5.68 -1.26 -4.69 116.55 117.50 2bsd n ASP 34 Ca -0.17 -1.06 0.15 0.00 -0.50 0.00 0.00 54.79 53.21 2bsd n ASP 34 Cb 0.52 -0.01 0.79 0.00 -1.14 0.00 0.00 41.12 41.28 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 -0.83 0.00 -0.44 2.11 4.01 -1.26 -3.30 117.16 117.45 2bsd n TYR 35 Ca 0.00 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.84 2bsd n TYR 35 Cb 0.02 -0.19 0.29 0.00 -0.31 0.00 0.00 39.34 39.15 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 -1.19 3.08 -4.32 -0.72 1.74 -1.26 -4.26 116.66 109.73 2bsd n ARG 36 Ca 0.17 -2.59 -0.20 0.00 -0.77 0.00 0.00 57.85 54.47 2bsd n ARG 36 Cb 0.19 -1.60 -0.08 0.00 -1.02 0.00 0.00 32.46 29.94 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 -1.37 0.15 0.21 0.55 -1.32 -1.21 -4.97 115.64 107.68 2bsd s THR 37 Ca 0.42 -2.00 0.01 0.00 -1.21 0.00 0.00 61.69 58.92 2bsd s THR 37 Cb 0.25 -2.47 -0.05 0.00 -1.51 0.00 0.00 72.50 68.72 2bsd s THR 37 CO 0.25 0.00 0.06 0.27 -2.21 0.00 0.00 174.62 172.98 2bsd s ILE 38 N -3.50 0.55 -0.08 5.08 -0.00 -1.26 -4.64 121.20 117.35 2bsd s ILE 38 Ca 0.37 -1.99 -0.00 0.00 -0.00 0.00 0.00 60.65 59.03 2bsd s ILE 38 Cb 0.03 -2.39 -0.03 0.00 -0.00 0.00 0.00 42.46 40.07 2bsd s ILE 38 CO 0.22 -0.21 -0.05 -0.13 -0.00 0.00 0.00 174.94 174.77 2bsd s ARG 39 N -3.99 2.93 -0.14 0.37 1.81 -0.62 -4.31 118.95 115.00 2bsd s ARG 39 Ca 0.32 -0.51 -0.13 0.00 -1.72 0.00 0.00 55.73 53.69 2bsd s ARG 39 Cb 0.07 -2.68 0.04 0.00 -0.45 0.00 0.00 34.95 31.93 2bsd s ARG 39 CO 0.09 0.61 0.37 0.50 -0.68 0.00 0.00 175.30 176.20 2bsd s ARG 40 N -0.66 0.43 -0.14 3.54 3.00 -1.26 -0.27 118.95 123.58 2bsd s ARG 40 Ca 0.10 0.53 -0.06 0.00 -1.00 0.00 0.00 55.73 55.31 2bsd s ARG 40 Cb -0.12 0.20 0.07 0.00 0.00 0.00 0.00 34.95 35.10 2bsd s ARG 40 CO 0.02 -0.06 0.30 0.21 0.00 0.00 0.00 175.30 175.77 2bsd s LYS 41 N 0.28 0.20 -0.73 5.12 2.47 -0.80 -5.02 119.74 121.27 2bsd s LYS 41 Ca -0.01 0.80 -0.24 0.00 -1.56 0.00 0.00 55.97 54.96 2bsd s LYS 41 Cb -0.03 0.04 0.06 0.00 -1.46 0.00 0.00 37.83 36.44 2bsd s LYS 41 CO -0.00 -0.26 1.13 -0.51 0.16 0.00 0.00 175.35 175.86 2bsd s ASP 42 N 2.30 6.21 0.30 1.43 1.01 -1.26 -1.52 116.67 125.15 2bsd s ASP 42 Ca -0.01 -0.86 0.05 0.00 0.71 0.00 0.00 52.55 52.44 2bsd s ASP 42 Cb -0.12 -2.48 0.49 0.00 1.01 0.00 0.00 42.92 41.82 2bsd s ASP 42 CO -0.10 -1.58 1.74 -0.50 0.21 0.00 0.00 175.17 174.94 2bsd h TRP 43 N 9.73 0.38 -3.61 4.23 4.06 -1.04 -3.43 115.95 126.27 2bsd h TRP 43 Ca -0.23 -0.08 -0.55 0.00 2.06 0.00 0.00 58.89 60.08 2bsd h TRP 43 Cb 1.06 -0.09 -0.20 0.00 -1.00 0.00 0.00 29.16 28.93 2bsd h TRP 43 CO 1.06 0.61 -0.81 -1.12 -3.56 0.00 0.00 178.44 174.62 2bsd s SER 44 N -6.85 2.69 0.24 -3.49 0.01 -0.93 -5.01 113.70 100.35 2bsd s SER 44 Ca -0.06 -0.78 -0.31 0.00 1.31 0.00 0.00 55.95 56.12 2bsd s SER 44 Cb 0.14 -0.16 -0.11 0.00 0.21 0.00 0.00 66.02 66.10 2bsd s SER 44 CO 0.77 0.03 1.56 -0.44 0.41 0.00 0.00 173.24 175.57 2bsd s SER 45 N -2.29 6.50 0.42 2.44 0.01 -1.26 -4.32 113.70 115.20 2bsd s SER 45 Ca 0.12 2.78 -0.25 0.00 1.31 0.00 0.00 55.95 59.91 2bsd s SER 45 Cb -0.08 -2.62 -0.08 0.00 0.21 0.00 0.00 66.02 63.45 2bsd s SER 45 CO 0.06 -0.84 1.31 -2.84 0.41 0.00 0.00 173.24 171.34 2bsd s PRO 46 N 0.07 3.87 -0.09 12.44 0.02 -1.26 -4.31 135.00 145.75 2bsd s PRO 46 Ca 0.65 2.15 -0.01 0.00 0.02 0.00 0.00 61.00 63.80 2bsd s PRO 46 Cb -0.45 -2.69 -0.03 0.00 0.02 0.00 0.00 34.50 31.35 2bsd s PRO 46 CO 0.41 -0.57 -0.02 -0.51 -0.33 0.00 0.00 177.00 175.98 2bsd s LEU 47 N -2.57 3.45 -0.19 -5.54 1.43 0.65 -4.92 118.68 110.99 2bsd s LEU 47 Ca 0.59 0.08 -0.03 0.00 -1.03 0.00 0.00 54.13 53.74 2bsd s LEU 47 Cb -0.38 -1.79 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 2bsd s LEU 47 CO 0.48 0.35 -0.08 0.20 0.23 0.00 0.00 176.35 177.54 2bsd s ASN 48 N -0.72 4.17 -0.04 2.29 0.01 -1.26 0.44 114.94 119.84 2bsd s ASN 48 Ca 0.11 -0.38 0.04 0.00 -0.71 0.00 0.00 52.86 51.92 2bsd s ASN 48 Cb -0.12 -1.69 -0.00 0.00 0.41 0.00 0.00 41.25 39.85 2bsd s ASN 48 CO 0.02 0.04 -0.14 0.28 -1.51 0.00 0.00 177.10 175.78 2bsd s THR 49 N 1.12 1.22 0.00 1.60 -1.32 -1.25 -4.98 115.64 112.03 2bsd s THR 49 Ca 0.01 -0.60 0.00 0.00 -1.21 0.00 0.00 61.69 59.90 2bsd s THR 49 Cb -0.15 -1.05 0.00 0.00 -1.51 0.00 0.00 72.50 69.79 2bsd s THR 49 CO -0.02 0.36 0.00 0.00 -2.21 0.00 0.00 174.62 172.75 2bsd n ALA 50 N 3.20 0.00 -1.71 11.08 0.00 -1.26 -2.12 120.51 129.71 2bsd n ALA 50 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.93 2bsd n ALA 50 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.95 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 7.10 -4.04 0.00 4.77 -1.25 -4.02 117.00 119.56 2bsd n LEU 51 Ca 0.00 -4.41 -0.09 0.00 -0.03 0.00 0.00 56.01 51.47 2bsd n LEU 51 Cb 0.00 -1.28 -0.11 0.00 -2.33 0.00 0.00 43.42 39.70 2bsd n LEU 51 CO 0.00 1.87 -0.37 0.20 -1.33 0.00 0.00 177.39 177.75 2bsd s ASN 52 N 0.32 0.50 -0.14 -1.43 0.01 -0.90 0.21 114.94 113.50 2bsd s ASN 52 Ca 0.57 -0.67 0.02 0.00 -0.71 0.00 0.00 52.86 52.07 2bsd s ASN 52 Cb 0.30 0.11 0.01 0.00 0.41 0.00 0.00 41.25 42.09 2bsd s ASN 52 CO -0.17 -0.36 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.17 2bsd s VAL 53 N -2.19 1.86 -0.34 1.60 1.01 -0.43 -3.75 120.40 118.16 2bsd s VAL 53 Ca -0.07 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 60.98 2bsd s VAL 53 Cb -0.05 -1.67 0.03 0.00 0.00 0.00 0.00 36.38 34.69 2bsd s VAL 53 CO -0.03 0.51 0.13 -1.58 0.00 0.00 0.00 175.10 174.13 2bsd s GLN 54 N 0.96 2.80 -0.45 2.72 0.74 0.17 -0.63 119.66 125.96 2bsd s GLN 54 Ca -0.05 -1.07 -0.29 0.00 0.05 0.00 0.00 55.36 54.00 2bsd s GLN 54 Cb -0.15 -3.51 0.02 0.00 1.10 0.00 0.00 33.01 30.47 2bsd s GLN 54 CO -0.04 -0.62 1.28 0.71 -0.55 0.00 0.00 175.29 176.08 2bsd s TYR 55 N 1.47 2.58 -0.07 1.67 2.02 0.19 -0.25 117.35 124.96 2bsd s TYR 55 Ca 0.00 0.67 -0.26 0.00 -0.37 0.00 0.00 57.07 57.12 2bsd s TYR 55 Cb -0.19 -4.39 -0.25 0.00 -0.40 0.00 0.00 41.96 36.74 2bsd s TYR 55 CO 0.04 -1.65 0.96 1.79 -1.57 0.00 0.00 175.55 175.12 2bsd h THR 56 N 6.36 1.60 -1.53 -0.71 1.35 -1.77 0.64 112.91 118.85 2bsd h THR 56 Ca -0.25 -2.05 -0.22 0.00 -0.55 0.00 0.00 66.41 63.34 2bsd h THR 56 Cb 1.08 2.93 -0.26 0.00 -1.73 0.00 0.00 68.15 70.18 2bsd h THR 56 CO 1.11 0.55 -0.57 0.21 -0.25 0.00 0.00 175.52 176.58 2bsd s ASN 57 N -6.30 -0.05 -0.10 5.36 3.84 -1.22 -2.07 114.94 114.41 2bsd s ASN 57 Ca -0.17 -1.07 0.01 0.00 0.21 0.00 0.00 52.86 51.85 2bsd s ASN 57 Cb -0.00 1.21 0.02 0.00 -0.55 0.00 0.00 41.25 41.93 2bsd s ASN 57 CO 0.73 -0.24 -0.12 -0.89 -2.79 0.00 0.00 177.10 173.79 2bsd s THR 58 N 1.78 1.27 0.09 -5.21 2.01 -0.69 -0.29 115.64 114.59 2bsd s THR 58 Ca 0.15 -0.50 -0.14 0.00 0.31 0.00 0.00 61.69 61.51 2bsd s THR 58 Cb -0.11 -1.19 -0.06 0.00 0.01 0.00 0.00 72.50 71.15 2bsd s THR 58 CO -0.09 0.40 0.49 -0.44 -0.69 0.00 0.00 174.62 174.29 2bsd s SER 59 N 1.14 6.83 -0.00 3.53 0.01 -0.57 0.04 113.70 124.67 2bsd s SER 59 Ca -0.05 1.03 0.02 0.00 1.31 0.00 0.00 55.95 58.27 2bsd s SER 59 Cb -0.14 -2.27 -0.01 0.00 0.21 0.00 0.00 66.02 63.81 2bsd s SER 59 CO -0.03 0.20 -0.07 -0.63 0.41 0.00 0.00 173.24 173.12 2bsd s ILE 60 N -1.30 0.55 -0.18 1.44 1.01 -0.35 -1.90 121.20 120.48 2bsd s ILE 60 Ca 0.32 -0.32 -0.02 0.00 0.00 0.00 0.00 60.65 60.63 2bsd s ILE 60 Cb -0.16 -0.47 -0.00 0.00 0.01 0.00 0.00 42.46 41.83 2bsd s ILE 60 CO 0.18 0.14 -0.10 -0.63 0.00 0.00 0.00 174.94 174.52 2bsd s ILE 61 N -0.20 3.00 -0.03 2.92 1.01 0.63 -1.40 121.20 127.13 2bsd s ILE 61 Ca 0.02 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.04 2bsd s ILE 61 Cb -0.03 -2.31 0.02 0.00 0.01 0.00 0.00 42.46 40.15 2bsd s ILE 61 CO -0.00 0.48 -0.02 0.00 0.00 0.00 0.00 174.94 175.40 2bsd s ALA 62 N 1.07 0.40 -1.37 9.38 0.00 -0.42 -1.58 121.76 129.23 2bsd s ALA 62 Ca 0.00 0.05 -0.05 0.00 0.00 0.00 0.00 51.96 51.96 2bsd s ALA 62 Cb -0.15 -0.29 0.03 0.00 0.00 0.00 0.00 23.12 22.71 2bsd s ALA 62 CO -0.02 -0.02 0.36 0.41 0.00 0.00 0.00 175.76 176.49 2bsd n GLY 63 N 3.87 -0.50 2.54 0.00 0.00 -1.26 -0.58 105.19 109.27 2bsd n GLY 63 Ca -0.24 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.19 0.42 3.62 -0.02 0.00 -1.26 -4.67 105.19 102.09 2bsd n GLY 64 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.56 3.94 -0.17 1.61 1.81 0.26 -4.26 118.95 121.58 2bsd s ARG 65 Ca 0.00 -0.36 -0.14 0.00 -1.72 0.00 0.00 55.73 53.51 2bsd s ARG 65 Cb 0.00 -3.22 -0.05 0.00 -0.45 0.00 0.00 34.95 31.23 2bsd s ARG 65 CO 0.00 0.23 0.29 -0.47 -0.68 0.00 0.00 175.30 174.67 2bsd s TYR 66 N 0.48 3.45 0.13 -0.53 5.04 -1.26 -1.31 117.35 123.36 2bsd s TYR 66 Ca 0.03 0.58 -0.05 0.00 -2.44 0.00 0.00 57.07 55.19 2bsd s TYR 66 Cb -0.13 -2.35 -0.02 0.00 0.35 0.00 0.00 41.96 39.81 2bsd s TYR 66 CO 0.01 0.21 0.16 -0.59 -1.34 0.00 0.00 175.55 174.00 2bsd s PHE 67 N 0.55 0.55 -0.02 4.97 -0.12 -0.49 -2.58 117.98 120.84 2bsd s PHE 67 Ca 0.16 -0.94 0.06 0.00 -0.05 0.00 0.00 56.93 56.15 2bsd s PHE 67 Cb -0.13 -0.25 -0.01 0.00 -0.63 0.00 0.00 43.02 42.00 2bsd s PHE 67 CO 0.04 -0.59 -0.19 -1.21 -0.05 0.00 0.00 175.22 173.22 2bsd s GLU 68 N -3.98 1.63 -0.41 1.99 2.02 -0.07 -1.21 118.70 118.68 2bsd s GLU 68 Ca 0.17 -0.68 -0.12 0.00 0.02 0.00 0.00 54.97 54.37 2bsd s GLU 68 Cb 0.05 -1.53 0.05 0.00 0.10 0.00 0.00 34.13 32.80 2bsd s GLU 68 CO -0.02 0.38 0.26 -0.51 0.02 0.00 0.00 175.26 175.39 2bsd s LEU 69 N -0.34 5.02 -0.34 1.80 1.43 0.11 -1.00 118.68 125.36 2bsd s LEU 69 Ca 0.05 -1.19 0.02 0.00 -1.03 0.00 0.00 54.13 51.98 2bsd s LEU 69 Cb -0.08 -2.05 0.10 0.00 0.03 0.00 0.00 46.19 44.18 2bsd s LEU 69 CO 0.00 -0.48 0.06 -0.76 0.23 0.00 0.00 176.35 175.41 2bsd s LEU 70 N 1.54 4.70 -1.37 1.79 1.43 -0.28 -1.71 118.68 124.78 2bsd s LEU 70 Ca 0.03 -2.02 -0.02 0.00 -1.03 0.00 0.00 54.13 51.09 2bsd s LEU 70 Cb -0.21 -1.67 0.01 0.00 0.03 0.00 0.00 46.19 44.35 2bsd s LEU 70 CO 0.06 -0.39 0.62 0.59 0.23 0.00 0.00 176.35 177.46 2bsd n ASN 71 N 4.35 -1.20 -4.60 2.29 5.03 0.06 -0.09 115.26 121.11 2bsd n ASN 71 Ca 0.00 -0.89 -0.38 0.00 0.87 0.00 0.00 54.58 54.18 2bsd n ASN 71 Cb 0.42 -3.66 -0.10 0.00 -1.02 0.00 0.00 39.78 35.42 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 -6.26 3.98 -0.17 3.52 2.56 -0.30 -2.83 118.70 119.20 2bsd s GLU 72 Ca 0.08 -0.16 -0.07 0.00 0.00 0.00 0.00 54.97 54.82 2bsd s GLU 72 Cb -0.04 -3.66 -0.04 0.00 2.00 0.00 0.00 34.13 32.39 2bsd s GLU 72 CO 0.84 -0.22 0.07 0.99 -0.56 0.00 0.00 175.26 176.38 2bsd s THR 73 N 1.90 4.87 -0.16 -1.70 2.01 -1.26 -0.64 115.64 120.65 2bsd s THR 73 Ca 0.11 -0.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.08 2bsd s THR 73 Cb -0.16 -3.18 -0.01 0.00 0.01 0.00 0.00 72.50 69.16 2bsd s THR 73 CO 0.10 0.48 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.73 2bsd s VAL 74 N 0.19 3.19 0.10 3.82 1.01 0.20 -4.97 120.40 123.93 2bsd s VAL 74 Ca 0.05 -0.59 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 2bsd s VAL 74 Cb -0.12 -2.38 -0.06 0.00 0.00 0.00 0.00 36.38 33.82 2bsd s VAL 74 CO 0.00 0.49 1.05 0.00 0.00 0.00 0.00 175.10 176.64 2bsd s ALA 75 N 0.77 3.29 0.08 5.51 0.00 -1.26 -1.32 121.76 128.83 2bsd s ALA 75 Ca -0.04 0.68 0.05 0.00 0.00 0.00 0.00 51.96 52.65 2bsd s ALA 75 Cb -0.15 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 2bsd s ALA 75 CO 0.01 -0.19 -0.01 -0.51 0.00 0.00 0.00 175.76 175.06 2bsd s LEU 76 N 0.30 3.42 0.13 0.00 1.43 0.13 -4.64 118.68 119.45 2bsd s LEU 76 Ca 0.51 -0.18 -0.23 0.00 -1.03 0.00 0.00 54.13 53.20 2bsd s LEU 76 Cb -0.26 -2.13 -0.07 0.00 0.03 0.00 0.00 46.19 43.76 2bsd s LEU 76 CO 0.31 0.19 0.69 -1.59 0.23 0.00 0.00 176.35 176.18 2bsd s LYS 77 N -2.20 4.42 0.64 1.70 -2.85 -1.26 -4.80 119.74 115.38 2bsd s LYS 77 Ca 0.24 0.99 -0.16 0.00 -1.00 0.00 0.00 55.97 56.04 2bsd s LYS 77 Cb -0.12 -3.24 -0.01 0.00 -2.06 0.00 0.00 37.83 32.41 2bsd s LYS 77 CO 0.17 0.59 1.11 0.20 0.10 0.00 0.00 175.35 177.52 2bsd s GLY 78 N -1.15 2.21 -1.42 0.59 0.00 -1.26 -4.02 107.32 102.27 2bsd s GLY 78 Ca 0.33 0.56 -0.08 0.00 0.00 0.00 0.00 44.72 45.54 2bsd s GLY 78 CO 0.23 0.91 0.63 1.22 0.00 0.00 0.00 173.10 176.09 2bsd n ASP 79 N -2.25 -4.81 -3.96 1.64 8.00 0.66 -4.95 116.55 110.88 2bsd n ASP 79 Ca 0.10 -0.41 -0.10 0.00 0.71 0.00 0.00 54.79 55.09 2bsd n ASP 79 Cb 0.52 -3.91 -0.07 0.00 -0.02 0.00 0.00 41.12 37.64 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 -2.82 -0.01 -0.36 -2.24 1.04 -1.23 -4.94 113.70 103.15 2bsd s SER 80 Ca 0.41 -0.87 -0.24 0.00 0.48 0.00 0.00 55.95 55.73 2bsd s SER 80 Cb -0.20 0.48 0.01 0.00 0.10 0.00 0.00 66.02 66.40 2bsd s SER 80 CO 0.51 -0.95 0.81 -0.69 0.98 0.00 0.00 173.24 173.89 2bsd s VAL 81 N -3.98 4.72 -0.26 5.02 1.01 -1.26 -1.54 120.40 124.10 2bsd s VAL 81 Ca 0.19 0.98 -0.10 0.00 0.00 0.00 0.00 61.98 63.04 2bsd s VAL 81 Cb 0.02 -4.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.13 2bsd s VAL 81 CO 0.02 -0.43 0.16 0.20 0.00 0.00 0.00 175.10 175.06 2bsd s ASN 82 N 1.82 5.96 -0.40 3.32 0.01 0.82 -4.63 114.94 121.83 2bsd s ASN 82 Ca 0.33 0.02 -0.17 0.00 -0.71 0.00 0.00 52.86 52.32 2bsd s ASN 82 Cb -0.13 -2.09 0.01 0.00 0.41 0.00 0.00 41.25 39.45 2bsd s ASN 82 CO 0.17 0.00 0.45 -0.31 -1.51 0.00 0.00 177.10 175.90 2bsd s TYR 83 N 1.44 3.17 -0.11 2.20 2.02 0.37 -0.14 117.35 126.30 2bsd s TYR 83 Ca 0.07 -0.22 -0.26 0.00 -0.37 0.00 0.00 57.07 56.29 2bsd s TYR 83 Cb -0.15 -2.91 -0.02 0.00 -0.40 0.00 0.00 41.96 38.48 2bsd s TYR 83 CO 0.08 -0.66 0.84 0.42 -1.57 0.00 0.00 175.55 174.66 2bsd s ILE 84 N 2.22 4.91 0.08 2.71 -1.09 0.73 -1.11 121.20 129.65 2bsd s ILE 84 Ca 0.14 1.70 0.09 0.00 -2.23 0.00 0.00 60.65 60.34 2bsd s ILE 84 Cb -0.16 -4.16 -0.04 0.00 -1.58 0.00 0.00 42.46 36.52 2bsd s ILE 84 CO 0.14 0.10 -0.21 -1.00 -1.23 0.00 0.00 174.94 172.74 2bsd s HIS 85 N 1.62 2.48 -0.20 3.97 3.76 0.19 -1.21 115.29 125.89 2bsd s HIS 85 Ca 0.41 -0.30 -0.08 0.00 -0.15 0.00 0.00 55.06 54.94 2bsd s HIS 85 Cb -0.18 -1.38 -0.04 0.00 1.11 0.00 0.00 32.58 32.09 2bsd s HIS 85 CO 0.17 0.29 0.08 0.00 -0.85 0.00 0.00 174.74 174.43 2bsd s ALA 86 N -1.00 3.40 -0.20 -1.40 0.00 0.11 -1.82 121.76 120.85 2bsd s ALA 86 Ca 0.15 -0.83 -0.02 0.00 0.00 0.00 0.00 51.96 51.26 2bsd s ALA 86 Cb -0.10 -2.01 0.00 0.00 0.00 0.00 0.00 23.12 21.01 2bsd s ALA 86 CO 0.06 0.01 -0.11 -0.80 0.00 0.00 0.00 175.76 174.93 2bsd s ASN 87 N 0.68 3.85 -0.27 0.00 0.01 0.13 -1.83 114.94 117.51 2bsd s ASN 87 Ca 0.04 -0.48 -0.05 0.00 -0.71 0.00 0.00 52.86 51.67 2bsd s ASN 87 Cb -0.13 -1.63 0.01 0.00 0.41 0.00 0.00 41.25 39.91 2bsd s ASN 87 CO 0.02 0.01 0.01 -0.63 -1.51 0.00 0.00 177.10 175.00 2bsd s ILE 88 N 1.29 3.52 -0.29 0.60 1.09 0.24 -1.01 121.20 126.64 2bsd s ILE 88 Ca 0.04 -0.76 0.02 0.00 -1.10 0.00 0.00 60.65 58.84 2bsd s ILE 88 Cb -0.14 -2.77 0.08 0.00 -1.06 0.00 0.00 42.46 38.57 2bsd s ILE 88 CO -0.06 0.18 0.01 -0.62 -0.10 0.00 0.00 174.94 174.36 2bsd s ASP 89 N 1.44 4.25 0.55 3.58 -1.08 0.13 -1.32 116.67 124.23 2bsd s ASP 89 Ca 0.02 -1.64 0.34 0.00 -0.52 0.00 0.00 52.55 50.75 2bsd s ASP 89 Cb -0.16 -1.29 1.35 0.00 -1.46 0.00 0.00 42.92 41.35 2bsd s ASP 89 CO -0.01 -0.32 1.98 -0.07 0.52 0.00 0.00 175.17 177.27 2bsd h LEU 90 N 7.85 0.00 -1.21 -1.34 3.38 -1.83 -2.37 115.31 119.80 2bsd h LEU 90 Ca -0.12 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2bsd h LEU 90 Cb 1.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 2bsd h LEU 90 CO 0.47 0.00 -0.09 0.71 0.09 0.00 0.00 178.44 179.61 2bsd h THR 91 N 0.00 0.23 -1.41 0.22 1.35 -1.95 -3.37 112.91 107.98 2bsd h THR 91 Ca -0.00 -0.80 -0.71 0.00 -0.55 0.00 0.00 66.41 64.35 2bsd h THR 91 Cb 0.52 1.65 -0.12 0.00 -1.73 0.00 0.00 68.15 68.47 2bsd h THR 91 CO 0.00 0.09 1.88 0.00 -0.25 0.00 0.00 175.52 177.24 2bsd n GLN 92 N -3.21 3.28 -0.19 4.72 1.13 -0.89 -4.87 117.38 117.34 2bsd n GLN 92 Ca 0.01 -3.51 -0.00 0.00 -1.94 0.00 0.00 57.00 51.56 2bsd n GLN 92 Cb 0.37 -3.26 0.10 0.00 0.11 0.00 0.00 30.24 27.57 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 4.98 0.70 -0.21 5.09 2.02 -1.84 -1.10 112.91 122.55 2bsd h THR 93 Ca 0.40 -0.11 -0.10 0.00 0.77 0.00 0.00 66.41 67.37 2bsd h THR 93 Cb 0.85 0.37 -0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2bsd h THR 93 CO 1.40 0.06 -0.26 0.00 0.37 0.00 0.00 175.52 177.08 2bsd h ALA 94 N 1.44 0.32 -2.57 6.16 0.00 -1.95 -3.40 119.26 119.26 2bsd h ALA 94 Ca 0.30 -0.39 -0.60 0.00 0.00 0.00 0.00 54.91 54.22 2bsd h ALA 94 Cb 0.42 -0.06 -0.39 0.00 0.00 0.00 0.00 17.79 17.75 2bsd h ALA 94 CO -0.36 0.31 -0.86 0.09 0.00 0.00 0.00 179.25 178.44 2bsd n ASN 95 N -4.36 0.60 0.24 0.00 3.02 -0.98 -4.98 115.26 108.81 2bsd n ASN 95 Ca -0.05 -2.63 0.13 0.00 -0.03 0.00 0.00 54.58 51.99 2bsd n ASN 95 Cb 0.45 -0.61 0.52 0.00 -0.61 0.00 0.00 39.78 39.53 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 5.53 0.00 -5.34 3.52 0.13 -1.41 -3.44 132.00 130.99 2bsd h PRO 96 Ca 0.23 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.70 2bsd h PRO 96 Cb 0.86 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.72 2bsd h PRO 96 CO 0.48 0.12 -0.78 0.08 -0.23 0.00 0.00 178.00 177.67 2bsd s VAL 97 N -3.62 2.95 0.09 1.56 1.01 -1.26 0.22 120.40 121.36 2bsd s VAL 97 Ca 0.01 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.32 2bsd s VAL 97 Cb 0.09 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2bsd s VAL 97 CO 0.60 0.53 -0.08 -0.94 0.00 0.00 0.00 175.10 175.21 2bsd s SER 98 N 0.32 1.23 0.14 3.32 1.04 -0.18 -4.97 113.70 114.60 2bsd s SER 98 Ca -0.11 -0.90 0.06 0.00 0.48 0.00 0.00 55.95 55.48 2bsd s SER 98 Cb -0.16 0.06 -0.04 0.00 0.10 0.00 0.00 66.02 65.98 2bsd s SER 98 CO 0.06 -0.37 0.01 -0.76 0.98 0.00 0.00 173.24 173.16 2bsd s LEU 99 N -2.72 3.42 0.02 2.42 1.43 -1.26 0.17 118.68 122.15 2bsd s LEU 99 Ca 0.08 -0.28 -0.09 0.00 -1.03 0.00 0.00 54.13 52.80 2bsd s LEU 99 Cb 0.01 -2.10 0.00 0.00 0.03 0.00 0.00 46.19 44.14 2bsd s LEU 99 CO -0.02 0.12 0.18 -0.94 0.23 0.00 0.00 176.35 175.92 2bsd s SER 100 N -2.71 0.01 -0.22 2.29 1.04 -0.76 -4.97 113.70 108.37 2bsd s SER 100 Ca 0.27 -0.25 -0.05 0.00 0.48 0.00 0.00 55.95 56.40 2bsd s SER 100 Cb -0.10 0.25 -0.02 0.00 0.10 0.00 0.00 66.02 66.25 2bsd s SER 100 CO 0.19 -0.47 0.00 0.00 0.98 0.00 0.00 173.24 173.94 2bsd s ALA 101 N -1.93 2.97 0.21 5.32 0.00 -1.26 -0.64 121.76 126.43 2bsd s ALA 101 Ca -0.10 -1.11 0.07 0.00 0.00 0.00 0.00 51.96 50.82 2bsd s ALA 101 Cb -0.04 -1.82 -0.05 0.00 0.00 0.00 0.00 23.12 21.21 2bsd s ALA 101 CO -0.01 -0.36 -0.12 -1.21 0.00 0.00 0.00 175.76 174.06 2bsd s GLU 102 N 1.37 1.32 0.00 0.00 2.02 -0.27 -4.90 118.70 118.24 2bsd s GLU 102 Ca 0.05 -1.59 0.29 0.00 0.02 0.00 0.00 54.97 53.73 2bsd s GLU 102 Cb -0.15 -1.03 1.28 0.00 0.10 0.00 0.00 34.13 34.33 2bsd s GLU 102 CO 0.00 0.14 1.93 0.25 0.02 0.00 0.00 175.26 177.60 2bsd n THR 103 N -0.38 0.00 -3.70 3.63 -2.24 -1.26 -0.48 114.28 109.85 2bsd n THR 103 Ca -0.08 -0.01 -0.10 0.00 -2.27 0.00 0.00 64.05 61.60 2bsd n THR 103 Cb 0.61 -0.40 -0.05 0.00 -2.10 0.00 0.00 70.33 68.38 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 -2.80 -0.71 -0.53 6.98 0.00 -1.26 -4.87 121.76 118.57 2bsd s ALA 104 Ca 0.20 -0.22 -0.27 0.00 0.00 0.00 0.00 51.96 51.66 2bsd s ALA 104 Cb 0.19 0.62 -0.01 0.00 0.00 0.00 0.00 23.12 23.92 2bsd s ALA 104 CO 0.51 -0.60 1.74 1.21 0.00 0.00 0.00 175.76 178.63 2bsd s ASN 105 N -2.81 5.63 -0.31 0.00 3.84 -1.26 -4.77 114.94 115.26 2bsd s ASN 105 Ca 0.03 0.57 0.09 0.00 0.21 0.00 0.00 52.86 53.76 2bsd s ASN 105 Cb 0.03 -2.53 0.59 0.00 -0.55 0.00 0.00 41.25 38.79 2bsd s ASN 105 CO -0.12 -2.05 1.62 0.59 -2.79 0.00 0.00 177.10 174.35 2bsd n ASN 106 N 11.38 3.47 -4.63 -4.21 3.02 -1.26 -5.01 115.26 118.01 2bsd n ASN 106 Ca 0.19 -3.50 -0.51 0.00 -0.03 0.00 0.00 54.58 50.74 2bsd n ASN 106 Cb 0.50 -0.68 -0.06 0.00 -0.61 0.00 0.00 39.78 38.93 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 -0.83 2.25 -0.07 6.41 7.64 -1.26 -4.84 113.62 122.92 2bsd n SER 107 Ca 0.38 1.09 0.03 0.00 1.01 0.00 0.00 58.87 61.39 2bsd n SER 107 Cb 1.22 -1.26 -0.02 0.00 -1.01 0.00 0.00 64.21 63.14 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 3.36 0.61 -1.77 6.43 0.23 -0.78 -5.01 115.26 118.33 2bsd n ASN 108 Ca 0.19 -0.80 -0.20 0.00 -0.53 0.00 0.00 54.58 53.23 2bsd n ASN 108 Cb 0.22 0.75 -0.07 0.00 -2.08 0.00 0.00 39.78 38.60 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 0.95 1.41 3.72 4.83 0.00 -1.26 -4.93 105.19 109.91 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 -2.80 2.82 -0.92 1.61 1.01 -1.26 -4.81 120.40 116.05 2bsd s VAL 110 Ca 0.00 0.60 -0.23 0.00 0.00 0.00 0.00 61.98 62.35 2bsd s VAL 110 Cb 0.00 -3.38 0.07 0.00 0.00 0.00 0.00 36.38 33.06 2bsd s VAL 110 CO 0.00 0.05 1.31 -0.62 0.00 0.00 0.00 175.10 175.84 2bsd s ASP 111 N 1.07 6.44 0.00 3.32 -1.08 -1.26 -4.71 116.67 120.45 2bsd s ASP 111 Ca 0.68 -1.37 0.28 0.00 -0.52 0.00 0.00 52.55 51.62 2bsd s ASP 111 Cb -0.42 -2.52 1.28 0.00 -1.46 0.00 0.00 42.92 39.81 2bsd s ASP 111 CO 0.32 -1.47 1.94 2.30 0.52 0.00 0.00 175.17 178.78 2bsd n ILE 112 N 6.43 0.06 0.08 4.11 -0.00 -1.26 -2.23 119.36 126.55 2bsd n ILE 112 Ca 0.23 0.01 0.08 0.00 -0.00 0.00 0.00 62.75 63.08 2bsd n ILE 112 Cb 0.50 -0.53 -0.02 0.00 -0.00 0.00 0.00 39.64 39.58 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 -1.43 0.86 -0.00 7.28 3.02 -1.26 -4.31 115.26 119.41 2bsd n ASN 113 Ca 0.09 0.34 0.03 0.00 -0.03 0.00 0.00 54.58 55.02 2bsd n ASN 113 Cb 0.30 0.36 -0.04 0.00 -0.61 0.00 0.00 39.78 39.79 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 -2.74 1.05 -1.49 6.41 3.02 -1.23 -4.85 115.26 115.43 2bsd n ASN 114 Ca -0.03 -0.51 -0.04 0.00 -0.03 0.00 0.00 54.58 53.98 2bsd n ASN 114 Cb 0.63 1.08 -0.01 0.00 -0.61 0.00 0.00 39.78 40.87 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 1.38 2.93 4.00 7.41 0.00 -0.95 -5.14 105.19 114.83 2bsd n GLY 115 Ca 0.01 -1.45 -0.18 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.53 5.67 0.00 1.61 1.04 -1.26 -4.48 113.70 114.74 2bsd s SER 116 Ca 0.07 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.17 2bsd s SER 116 Cb -0.00 -0.78 0.00 0.00 0.10 0.00 0.00 66.02 65.34 2bsd s SER 116 CO 0.05 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.13 2bsd n GLY 117 N -1.87 2.44 3.56 7.32 0.00 -1.26 -4.85 105.19 110.52 2bsd n GLY 117 Ca 0.07 -2.16 -0.36 0.00 0.00 0.00 0.00 46.02 43.57 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 -1.95 4.72 -0.05 1.61 1.01 -1.26 -4.66 120.40 119.82 2bsd s VAL 118 Ca 0.00 -0.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.68 2bsd s VAL 118 Cb 0.00 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 2bsd s VAL 118 CO 0.00 0.37 0.81 -0.22 0.00 0.00 0.00 175.10 176.06 2bsd s LEU 119 N 1.12 4.33 -0.16 3.92 2.96 -0.43 -4.75 118.68 125.66 2bsd s LEU 119 Ca 0.05 1.36 0.00 0.00 -0.22 0.00 0.00 54.13 55.32 2bsd s LEU 119 Cb -0.14 -3.27 0.00 0.00 0.50 0.00 0.00 46.19 43.29 2bsd s LEU 119 CO 0.04 -0.19 -0.16 -0.54 -1.32 0.00 0.00 176.35 174.18 2bsd s LYS 120 N 0.96 3.16 -0.04 1.98 1.02 -1.26 -0.59 119.74 124.96 2bsd s LYS 120 Ca 0.43 -0.77 0.01 0.00 0.02 0.00 0.00 55.97 55.66 2bsd s LYS 120 Cb -0.19 -2.61 0.02 0.00 -0.52 0.00 0.00 37.83 34.53 2bsd s LYS 120 CO 0.21 -0.04 -0.06 0.08 -0.92 0.00 0.00 175.35 174.62 2bsd s VAL 121 N 0.94 0.67 0.05 3.17 1.01 -0.76 -1.87 120.40 123.62 2bsd s VAL 121 Ca -0.03 -0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.44 2bsd s VAL 121 Cb -0.15 -0.66 -0.05 0.00 0.00 0.00 0.00 36.38 35.53 2bsd s VAL 121 CO -0.03 0.25 0.92 0.00 0.00 0.00 0.00 175.10 176.24 2bsd n PHE 123 N 3.21 0.00 -3.89 0.00 1.16 -0.35 -4.85 117.46 112.73 2bsd n PHE 123 Ca 0.03 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.50 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 -0.84 0.07 -0.15 5.98 2.15 -1.18 -1.80 116.67 120.90 2bsd s ASP 124 Ca 0.00 -0.25 0.00 0.00 0.43 0.00 0.00 52.55 52.73 2bsd s ASP 124 Cb 0.00 0.18 0.03 0.00 -0.30 0.00 0.00 42.92 42.83 2bsd s ASP 124 CO 0.00 -0.34 -0.11 -0.63 -0.17 0.00 0.00 175.17 173.92 2bsd s ILE 125 N -1.33 1.41 -0.15 4.11 1.01 0.44 -0.19 121.20 126.50 2bsd s ILE 125 Ca -0.14 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 59.89 2bsd s ILE 125 Cb -0.08 -1.40 0.02 0.00 0.01 0.00 0.00 42.46 41.01 2bsd s ILE 125 CO 0.01 0.34 -0.16 -0.69 0.00 0.00 0.00 174.94 174.44 2bsd s VAL 126 N 1.54 1.68 -0.17 2.92 1.01 0.81 -0.25 120.40 127.94 2bsd s VAL 126 Ca 0.03 -0.72 -0.07 0.00 0.00 0.00 0.00 61.98 61.22 2bsd s VAL 126 Cb -0.14 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 2bsd s VAL 126 CO -0.09 0.48 0.07 -0.89 0.00 0.00 0.00 175.10 174.66 2bsd s THR 127 N 1.30 4.86 0.23 3.92 2.01 0.67 -0.13 115.64 128.49 2bsd s THR 127 Ca 0.02 -0.01 0.09 0.00 0.31 0.00 0.00 61.69 62.09 2bsd s THR 127 Cb -0.13 -3.17 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 2bsd s THR 127 CO -0.09 0.48 -0.02 0.42 -0.69 0.00 0.00 174.62 174.73 2bsd s THR 128 N 0.15 3.48 0.00 -0.82 -4.23 -0.59 -0.62 115.64 113.01 2bsd s THR 128 Ca 0.05 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 58.82 2bsd s THR 128 Cb -0.12 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 70.91 2bsd s THR 128 CO 0.00 -0.26 0.00 -1.54 -0.54 0.00 0.00 174.62 172.28 2bsd n SER 129 N -0.54 0.00 0.23 3.99 3.41 0.42 -3.49 113.62 117.63 2bsd n SER 129 Ca -0.08 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.63 2bsd n SER 129 Cb 0.57 0.00 0.49 0.00 -0.26 0.00 0.00 64.21 65.01 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 0.19 103.07 106.30 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 -0.12 -1.30 0.00 0.00 0.00 176.54 175.12 2bsd n THR 131 N -3.44 0.00 -3.83 4.70 -2.24 -1.26 -4.78 114.28 103.43 2bsd n THR 131 Ca -0.00 -0.15 -0.10 0.00 -2.27 0.00 0.00 64.05 61.53 2bsd n THR 131 Cb 0.41 0.78 0.02 0.00 -2.10 0.00 0.00 70.33 69.44 2bsd n THR 131 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bsd n GLY 132 N 0.59 1.09 3.73 3.38 0.00 -1.26 -3.82 105.19 108.90 2bsd n GLY 132 Ca 0.00 -1.30 -0.39 0.00 0.00 0.00 0.00 46.02 44.33 2bsd n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bsd s VAL 133 N -2.17 5.03 -0.07 1.61 1.01 -1.26 -0.44 120.40 124.11 2bsd s VAL 133 Ca 0.17 1.34 0.12 0.00 0.00 0.00 0.00 61.98 63.61 2bsd s VAL 133 Cb -0.05 -3.99 -0.17 0.00 0.00 0.00 0.00 36.38 32.17 2bsd s VAL 133 CO 0.13 0.30 0.15 0.35 0.00 0.00 0.00 175.10 176.03 2bsd n THR 134 N 3.53 0.46 -3.55 3.92 -2.24 0.21 -4.89 114.28 111.73 2bsd n THR 134 Ca -0.03 -0.42 -0.15 0.00 -2.27 0.00 0.00 64.05 61.17 2bsd n THR 134 Cb 0.51 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.41 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 -4.05 -0.53 -0.01 3.42 1.04 -1.09 -5.02 113.70 107.46 2bsd s SER 135 Ca -0.05 0.39 0.01 0.00 0.48 0.00 0.00 55.95 56.78 2bsd s SER 135 Cb 0.06 0.51 -0.00 0.00 0.10 0.00 0.00 66.02 66.68 2bsd s SER 135 CO 0.52 -0.67 -0.05 0.42 0.98 0.00 0.00 173.24 174.44 2bsd s THR 136 N -1.92 0.39 -0.07 2.02 -4.23 -1.26 -0.24 115.64 110.33 2bsd s THR 136 Ca -0.08 -0.20 -0.01 0.00 -1.18 0.00 0.00 61.69 60.23 2bsd s THR 136 Cb -0.01 -0.33 0.03 0.00 1.34 0.00 0.00 72.50 73.52 2bsd s THR 136 CO 0.03 0.11 -0.02 -0.75 -0.54 0.00 0.00 174.62 173.46 2bsd s LYS 137 N -0.05 0.76 0.48 3.99 2.20 0.66 -5.00 119.74 122.77 2bsd s LYS 137 Ca 0.01 0.02 -0.22 0.00 -0.36 0.00 0.00 55.97 55.42 2bsd s LYS 137 Cb -0.03 -1.01 -0.07 0.00 -1.51 0.00 0.00 37.83 35.21 2bsd s LYS 137 CO -0.00 -0.25 1.15 -1.25 -0.36 0.00 0.00 175.35 174.64 2bsd s PRO 138 N 1.70 3.69 0.25 4.03 0.04 -1.26 -0.42 135.00 143.03 2bsd s PRO 138 Ca 0.01 1.72 -0.30 0.00 0.04 0.00 0.00 61.00 62.48 2bsd s PRO 138 Cb -0.13 -2.32 -0.09 0.00 0.04 0.00 0.00 34.50 32.00 2bsd s PRO 138 CO -0.04 -0.60 1.12 0.42 0.04 0.00 0.00 177.00 177.94 2bsd s ILE 139 N -1.60 3.54 0.32 0.56 -1.09 -0.75 -4.86 121.20 117.31 2bsd s ILE 139 Ca 0.65 1.46 -0.29 0.00 -2.23 0.00 0.00 60.65 60.24 2bsd s ILE 139 Cb -0.27 -3.93 -0.13 0.00 -1.58 0.00 0.00 42.46 36.55 2bsd s ILE 139 CO 0.32 0.31 1.26 0.55 -1.23 0.00 0.00 174.94 176.16 2bsd n VAL 140 N 1.62 1.82 -3.44 2.92 3.14 -1.26 -4.94 118.33 118.20 2bsd n VAL 140 Ca 0.01 -0.46 -0.42 0.00 -2.96 0.00 0.00 64.34 60.50 2bsd n VAL 140 Cb 0.45 -1.46 -0.10 0.00 -1.06 0.00 0.00 33.84 31.67 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 -1.58 3.11 -0.22 1.45 -0.21 -1.26 -4.59 119.66 116.35 2bsd s GLN 141 Ca 0.58 -0.88 -0.14 0.00 0.02 0.00 0.00 55.36 54.94 2bsd s GLN 141 Cb -0.61 -3.94 -0.04 0.00 1.00 0.00 0.00 33.01 29.42 2bsd s GLN 141 CO 0.60 -0.71 0.31 0.99 -2.12 0.00 0.00 175.29 174.36 2bsd s THR 142 N 1.79 5.25 -0.36 -0.19 2.01 -1.26 -5.03 115.64 117.85 2bsd s THR 142 Ca 0.07 0.50 -0.14 0.00 0.31 0.00 0.00 61.69 62.43 2bsd s THR 142 Cb -0.18 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.68 2bsd s THR 142 CO 0.11 0.27 0.27 -0.44 -0.69 0.00 0.00 174.62 174.14 2bsd s SER 143 N 1.14 6.09 -0.48 3.53 0.01 -1.26 -4.50 113.70 118.23 2bsd s SER 143 Ca 0.14 -0.55 -0.15 0.00 1.31 0.00 0.00 55.95 56.70 2bsd s SER 143 Cb -0.14 -2.15 0.08 0.00 0.21 0.00 0.00 66.02 64.01 2bsd s SER 143 CO 0.07 -0.32 0.40 -0.89 0.41 0.00 0.00 173.24 172.91 2bsd s THR 144 N 1.75 5.12 0.39 1.44 2.01 0.17 -5.04 115.64 121.48 2bsd s THR 144 Ca 0.06 -1.16 0.08 0.00 0.31 0.00 0.00 61.69 60.98 2bsd s THR 144 Cb -0.18 -4.10 -0.07 0.00 0.01 0.00 0.00 72.50 68.17 2bsd s THR 144 CO 0.11 -0.61 0.03 -0.76 -0.69 0.00 0.00 174.62 172.69 2bsd s LEU 145 N 1.61 2.92 0.00 4.42 1.43 -1.26 -4.63 118.68 123.17 2bsd s LEU 145 Ca 0.04 -1.23 0.00 0.00 -1.03 0.00 0.00 54.13 51.91 2bsd s LEU 145 Cb -0.25 -1.09 0.00 0.00 0.03 0.00 0.00 46.19 44.88 2bsd s LEU 145 CO 0.06 -0.40 0.00 -0.67 0.23 0.00 0.00 176.35 175.57 2bsd n ASP 146 N -0.99 0.00 -4.16 2.29 2.03 -1.26 -5.02 116.55 109.44 2bsd n ASP 146 Ca -0.04 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 54.96 2bsd n ASP 146 Cb 0.65 -0.06 -0.17 0.00 -0.72 0.00 0.00 41.12 40.82 2bsd n ASP 146 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2bsd s SER 147 N -1.24 2.88 -0.10 1.67 0.15 -1.26 -5.12 113.70 110.69 2bsd s SER 147 Ca 0.00 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.12 2bsd s SER 147 Cb 0.00 -1.32 -0.02 0.00 -1.71 0.00 0.00 66.02 62.97 2bsd s SER 147 CO 0.00 0.10 -0.10 -0.63 1.20 0.00 0.00 173.24 173.81 2bsd s ILE 148 N 0.60 3.37 -0.15 6.45 1.01 -1.26 -5.10 121.20 126.11 2bsd s ILE 148 Ca -0.13 -0.58 -0.00 0.00 0.00 0.00 0.00 60.65 59.93 2bsd s ILE 148 Cb -0.17 -2.39 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 2bsd s ILE 148 CO 0.04 0.56 -0.13 -0.55 0.00 0.00 0.00 174.94 174.85 2bsd s SER 149 N -0.23 3.85 0.01 3.58 0.15 -1.26 -5.13 113.70 114.67 2bsd s SER 149 Ca 0.02 -0.41 -0.02 0.00 0.70 0.00 0.00 55.95 56.24 2bsd s SER 149 Cb -0.13 -1.60 -0.01 0.00 -1.71 0.00 0.00 66.02 62.57 2bsd s SER 149 CO 0.03 0.10 0.02 0.54 1.20 0.00 0.00 173.24 175.13 2bsd s VAL 150 N 0.73 0.10 -0.08 4.45 0.11 -1.26 -5.08 120.40 119.36 2bsd s VAL 150 Ca -0.06 -0.81 -0.01 0.00 -2.93 0.00 0.00 61.98 58.18 2bsd s VAL 150 Cb -0.15 -0.30 -0.00 0.00 -1.53 0.00 0.00 36.38 34.39 2bsd s VAL 150 CO 0.01 -0.44 0.02 0.78 -3.33 0.00 0.00 175.10 172.14 2bsd h ASN 151 N 4.61 -0.02 -4.43 3.54 2.35 -2.09 -3.48 115.58 116.06 2bsd h ASN 151 Ca -0.31 0.00 -0.43 0.00 -0.55 0.00 0.00 56.30 55.01 2bsd h ASN 151 Cb 1.21 0.00 -0.22 0.00 0.05 0.00 0.00 38.32 39.36 2bsd h ASN 151 CO 0.41 0.41 -0.79 -1.81 -1.65 0.00 0.00 177.43 174.00 2bsd s ASP 152 N -5.15 1.75 -0.00 5.81 1.01 -1.26 -5.15 116.67 113.68 2bsd s ASP 152 Ca -0.00 -0.60 0.01 0.00 0.71 0.00 0.00 52.55 52.66 2bsd s ASP 152 Cb 0.00 -0.06 0.00 0.00 1.01 0.00 0.00 42.92 43.87 2bsd s ASP 152 CO 0.01 -0.05 -0.02 -0.32 0.21 0.00 0.00 175.17 175.00 2bsd s MET 153 N -1.68 0.22 -0.07 8.23 -2.45 -1.26 -5.14 119.30 117.14 2bsd s MET 153 Ca -0.01 -0.07 0.04 0.00 -1.25 0.00 0.00 55.69 54.40 2bsd s MET 153 Cb -0.10 -0.23 -0.00 0.00 1.25 0.00 0.00 34.83 35.75 2bsd s MET 153 CO 0.02 0.03 -0.20 -0.08 1.05 0.00 0.00 175.02 175.84 2bsd s THR 154 N 0.06 1.75 -0.14 10.11 -1.32 -1.26 -5.13 115.64 119.71 2bsd s THR 154 Ca -0.00 -0.86 0.02 0.00 -1.21 0.00 0.00 61.69 59.64 2bsd s THR 154 Cb -0.02 -1.51 0.01 0.00 -1.51 0.00 0.00 72.50 69.46 2bsd s THR 154 CO -0.00 0.49 -0.20 -0.69 -2.21 0.00 0.00 174.62 172.01 2bsd s VAL 155 N 0.23 2.24 -0.13 5.08 1.01 -1.26 -5.01 120.40 122.55 2bsd s VAL 155 Ca -0.12 -0.92 0.20 0.00 0.00 0.00 0.00 61.98 61.14 2bsd s VAL 155 Cb -0.15 -1.91 -0.18 0.00 0.00 0.00 0.00 36.38 34.15 2bsd s VAL 155 CO 0.05 0.54 0.67 -1.54 0.00 0.00 0.00 175.10 174.83 2bsd n SER 156 N 4.01 0.51 0.00 3.32 3.41 -1.26 -4.85 113.62 118.75 2bsd n SER 156 Ca -0.20 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2bsd n SER 156 Cb 0.52 0.83 0.00 0.00 -0.26 0.00 0.00 64.21 65.29 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 1.36 0.03 3.20 5.00 0.00 -1.26 -5.13 105.19 108.39 2bsd n GLY 157 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.81 -0.21 -0.16 1.61 0.01 -1.26 -5.14 113.70 107.73 2bsd s SER 158 Ca 0.00 0.27 -0.13 0.00 1.31 0.00 0.00 55.95 57.40 2bsd s SER 158 Cb 0.00 0.43 -0.05 0.00 0.21 0.00 0.00 66.02 66.61 2bsd s SER 158 CO 0.00 -0.29 0.25 -0.63 0.41 0.00 0.00 173.24 172.98 2bsd s ILE 159 N -0.71 5.33 -0.28 1.44 1.01 -1.26 -5.09 121.20 121.65 2bsd s ILE 159 Ca -0.08 0.45 -0.08 0.00 0.00 0.00 0.00 60.65 60.94 2bsd s ILE 159 Cb -0.04 -3.58 -0.02 0.00 0.01 0.00 0.00 42.46 38.82 2bsd s ILE 159 CO 0.02 0.42 0.11 -0.62 0.00 0.00 0.00 174.94 174.87 2bsd s ASP 160 N 0.33 5.36 0.28 3.58 -1.08 -1.26 -5.10 116.67 118.78 2bsd s ASP 160 Ca 0.15 -0.32 0.10 0.00 -0.52 0.00 0.00 52.55 51.95 2bsd s ASP 160 Cb -0.13 -1.97 -0.05 0.00 -1.46 0.00 0.00 42.92 39.32 2bsd s ASP 160 CO 0.03 -0.10 -0.04 0.68 0.52 0.00 0.00 175.17 176.25 2bsd s VAL 161 N 1.62 3.15 0.39 1.11 -7.23 -1.26 -5.11 120.40 113.08 2bsd s VAL 161 Ca 0.06 -2.03 -0.27 0.00 -1.81 0.00 0.00 61.98 57.93 2bsd s VAL 161 Cb -0.16 -2.72 -0.10 0.00 0.56 0.00 0.00 36.38 33.96 2bsd s VAL 161 CO 0.05 -0.36 1.47 -2.84 -0.31 0.00 0.00 175.10 173.11 2bsd s PRO 162 N -3.64 4.01 -0.11 4.82 0.02 -1.26 -4.77 135.00 134.06 2bsd s PRO 162 Ca 0.32 2.53 0.01 0.00 0.02 0.00 0.00 61.00 63.88 2bsd s PRO 162 Cb -0.05 -2.89 0.02 0.00 0.02 0.00 0.00 34.50 31.59 2bsd s PRO 162 CO 0.19 -0.60 -0.13 0.08 -0.33 0.00 0.00 177.00 176.21 2bsd s VAL 163 N -1.14 1.38 0.11 3.83 1.01 -1.26 -1.68 120.40 122.65 2bsd s VAL 163 Ca 0.55 -0.55 0.09 0.00 0.00 0.00 0.00 61.98 62.06 2bsd s VAL 163 Cb -0.46 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 2bsd s VAL 163 CO 0.62 0.42 -0.20 -1.10 0.00 0.00 0.00 175.10 174.84 2bsd s GLN 164 N 1.21 1.74 0.01 2.72 -0.21 -0.21 -4.98 119.66 119.93 2bsd s GLN 164 Ca -0.03 -1.19 0.03 0.00 0.02 0.00 0.00 55.36 54.20 2bsd s GLN 164 Cb -0.14 -2.08 -0.01 0.00 1.00 0.00 0.00 33.01 31.78 2bsd s GLN 164 CO -0.04 0.48 -0.11 0.99 -2.12 0.00 0.00 175.29 174.49 2bsd s THR 165 N -1.10 0.84 -0.10 -0.19 2.01 -1.26 -0.68 115.64 115.17 2bsd s THR 165 Ca 0.17 -0.63 -0.07 0.00 0.31 0.00 0.00 61.69 61.47 2bsd s THR 165 Cb -0.10 -0.74 0.03 0.00 0.01 0.00 0.00 72.50 71.70 2bsd s THR 165 CO 0.09 0.11 0.24 -0.22 -0.69 0.00 0.00 174.62 174.14 2bsd s LEU 166 N -0.59 0.77 -0.18 4.42 2.96 -0.44 -5.01 118.68 120.61 2bsd s LEU 166 Ca 0.02 0.49 -0.07 0.00 -0.22 0.00 0.00 54.13 54.35 2bsd s LEU 166 Cb -0.05 0.76 -0.04 0.00 0.50 0.00 0.00 46.19 47.36 2bsd s LEU 166 CO 0.00 -0.12 0.05 -0.89 -1.32 0.00 0.00 176.35 174.07 2bsd s THR 167 N 0.68 4.64 -0.18 3.68 2.01 -1.26 -0.38 115.64 124.83 2bsd s THR 167 Ca -0.05 -0.09 0.00 0.00 0.31 0.00 0.00 61.69 61.87 2bsd s THR 167 Cb -0.06 -3.09 0.01 0.00 0.01 0.00 0.00 72.50 69.37 2bsd s THR 167 CO -0.04 0.45 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.49 2bsd s VAL 168 N 0.48 2.40 -0.96 3.82 1.01 0.44 -5.00 120.40 122.59 2bsd s VAL 168 Ca 0.02 -0.84 -0.20 0.00 0.00 0.00 0.00 61.98 60.96 2bsd s VAL 168 Cb -0.13 -2.02 0.10 0.00 0.00 0.00 0.00 36.38 34.33 2bsd s VAL 168 CO 0.01 0.52 1.24 -1.61 0.00 0.00 0.00 175.10 175.26 2bsd s GLU 169 N 1.17 3.59 0.23 2.72 0.41 -1.26 -0.73 118.70 124.82 2bsd s GLU 169 Ca 0.02 -1.51 0.24 0.00 -0.41 0.00 0.00 54.97 53.30 2bsd s GLU 169 Cb -0.14 -5.07 0.93 0.00 -1.78 0.00 0.00 34.13 28.08 2bsd s GLU 169 CO -0.07 -1.93 1.72 0.00 -0.49 0.00 0.00 175.26 174.48 2bsd n ALA 170 N 7.42 1.81 0.00 5.21 0.00 -0.81 -0.82 120.51 133.32 2bsd n ALA 170 Ca 0.27 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2bsd n ALA 170 Cb 0.50 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.55 2bsd n ALA 170 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bsd n GLY 171 N 0.32 2.73 2.66 0.00 0.00 -1.25 -1.00 105.19 108.66 2bsd n GLY 171 Ca 0.03 -1.93 -0.11 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 -5.36 0.00 1.61 3.02 -1.26 -1.93 115.26 111.34 2bsd n ASN 172 Ca 0.00 0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 2bsd n ASN 172 Cb 0.00 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.34 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 -0.26 0.83 3.76 7.41 0.00 -1.24 -2.12 105.19 113.57 2bsd n GLY 173 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 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 4.59 -0.09 0.99 2.96 -0.81 -2.24 118.68 124.07 2bsd s LEU 174 Ca 0.00 2.11 0.02 0.00 -0.22 0.00 0.00 54.13 56.04 2bsd s LEU 174 Cb 0.00 -3.64 0.01 0.00 0.50 0.00 0.00 46.19 43.07 2bsd s LEU 174 CO 0.00 -0.01 -0.14 -1.58 -1.32 0.00 0.00 176.35 173.30 2bsd s GLN 175 N -1.36 1.97 -0.13 1.98 0.74 -0.52 -1.92 119.66 120.43 2bsd s GLN 175 Ca 0.43 -0.48 -0.04 0.00 0.05 0.00 0.00 55.36 55.32 2bsd s GLN 175 Cb -0.29 -1.66 -0.03 0.00 1.10 0.00 0.00 33.01 32.13 2bsd s GLN 175 CO 0.36 -0.02 0.02 -0.51 -0.55 0.00 0.00 175.29 174.59 2bsd s LEU 176 N 0.86 3.62 -0.25 3.68 1.43 0.09 -0.56 118.68 127.56 2bsd s LEU 176 Ca -0.10 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 2bsd s LEU 176 Cb -0.15 -1.86 0.04 0.00 0.03 0.00 0.00 46.19 44.24 2bsd s LEU 176 CO 0.01 0.29 -0.10 -1.58 0.23 0.00 0.00 176.35 175.20 2bsd s GLN 177 N -0.32 2.60 -0.13 1.70 -0.44 -0.20 -0.42 119.66 122.45 2bsd s GLN 177 Ca 0.07 -1.12 -0.04 0.00 -2.50 0.00 0.00 55.36 51.77 2bsd s GLN 177 Cb -0.12 -2.89 -0.03 0.00 -1.64 0.00 0.00 33.01 28.32 2bsd s GLN 177 CO 0.02 -0.45 0.01 -0.51 0.50 0.00 0.00 175.29 174.86 2bsd s LEU 178 N 1.23 3.58 -0.16 3.68 1.02 0.48 -0.58 118.68 127.92 2bsd s LEU 178 Ca -0.03 0.06 0.01 0.00 0.02 0.00 0.00 54.13 54.19 2bsd s LEU 178 Cb -0.18 -1.86 0.03 0.00 0.02 0.00 0.00 46.19 44.21 2bsd s LEU 178 CO -0.06 0.27 -0.13 -0.89 0.02 0.00 0.00 176.35 175.55 2bsd s THR 179 N -0.21 1.62 -0.14 5.49 2.01 -0.58 -1.33 115.64 122.51 2bsd s THR 179 Ca 0.06 -0.76 -0.03 0.00 0.31 0.00 0.00 61.69 61.27 2bsd s THR 179 Cb -0.12 -1.56 -0.03 0.00 0.01 0.00 0.00 72.50 70.79 2bsd s THR 179 CO 0.02 0.38 -0.03 -0.75 -0.69 0.00 0.00 174.62 173.55 2bsd s LYS 180 N 1.45 3.47 0.02 4.92 2.20 0.14 -1.48 119.74 130.47 2bsd s LYS 180 Ca 0.03 -0.50 0.07 0.00 -0.36 0.00 0.00 55.97 55.21 2bsd s LYS 180 Cb -0.14 -2.87 -0.02 0.00 -1.51 0.00 0.00 37.83 33.29 2bsd s LYS 180 CO -0.10 0.36 -0.21 0.15 -0.36 0.00 0.00 175.35 175.19 2bsd s LYS 181 N 0.04 1.50 -1.54 4.03 1.02 0.23 -1.05 119.74 123.97 2bsd s LYS 181 Ca 0.01 -0.86 0.00 0.00 0.02 0.00 0.00 55.97 55.14 2bsd s LYS 181 Cb -0.13 -1.55 0.00 0.00 -0.52 0.00 0.00 37.83 35.63 2bsd s LYS 181 CO 0.03 0.41 0.00 -1.71 -0.92 0.00 0.00 175.35 173.15 2bsd n ASN 182 N 2.14 -5.04 -3.44 2.83 5.15 -0.68 -1.93 115.26 114.29 2bsd n ASN 182 Ca -0.16 0.12 -0.24 0.00 -0.60 0.00 0.00 54.58 53.69 2bsd n ASN 182 Cb 0.53 -4.27 -0.01 0.00 -0.53 0.00 0.00 39.78 35.51 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 -1.80 -3.62 0.12 1.20 5.15 -1.26 -4.72 115.26 110.33 2bsd n ASN 183 Ca -0.20 -0.44 0.00 0.00 -0.60 0.00 0.00 54.58 53.34 2bsd n ASN 183 Cb 0.65 -2.99 0.00 0.00 -0.53 0.00 0.00 39.78 36.90 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 -2.31 -1.41 -4.68 1.20 2.03 -0.84 -4.78 116.55 105.77 2bsd n ASP 184 Ca -0.00 0.45 -0.42 0.00 0.52 0.00 0.00 54.79 55.33 2bsd n ASP 184 Cb 0.53 1.47 -0.03 0.00 -0.72 0.00 0.00 41.12 42.38 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 -6.22 4.22 -0.09 -2.67 2.96 -0.81 -0.45 118.68 115.62 2bsd s LEU 185 Ca 0.00 1.40 0.03 0.00 -0.22 0.00 0.00 54.13 55.35 2bsd s LEU 185 Cb 0.00 -3.44 0.00 0.00 0.50 0.00 0.00 46.19 43.26 2bsd s LEU 185 CO 0.00 -0.43 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.71 2bsd s VAL 186 N 2.04 1.81 -0.17 1.68 1.01 -0.37 -0.60 120.40 125.80 2bsd s VAL 186 Ca 0.45 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.52 2bsd s VAL 186 Cb -0.18 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 2bsd s VAL 186 CO 0.16 0.50 -0.04 -0.63 0.00 0.00 0.00 175.10 175.09 2bsd s ILE 187 N 0.47 3.74 -0.16 2.22 1.01 -0.55 -1.40 121.20 126.54 2bsd s ILE 187 Ca -0.17 -0.40 -0.06 0.00 0.00 0.00 0.00 60.65 60.02 2bsd s ILE 187 Cb -0.17 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 2bsd s ILE 187 CO 0.07 0.48 0.04 -0.69 0.00 0.00 0.00 174.94 174.83 2bsd s VAL 188 N 0.61 4.61 -0.19 2.92 1.01 0.27 -1.52 120.40 128.11 2bsd s VAL 188 Ca -0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 61.98 61.81 2bsd s VAL 188 Cb -0.14 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 2bsd s VAL 188 CO 0.02 0.49 -0.03 -0.13 0.00 0.00 0.00 175.10 175.45 2bsd s ARG 189 N 0.15 3.52 0.12 2.72 0.52 0.26 -0.79 118.95 125.46 2bsd s ARG 189 Ca 0.03 -0.57 -0.24 0.00 -0.52 0.00 0.00 55.73 54.43 2bsd s ARG 189 Cb -0.13 -2.98 -0.07 0.00 0.52 0.00 0.00 34.95 32.29 2bsd s ARG 189 CO 0.01 -0.00 0.74 -0.06 0.02 0.00 0.00 175.30 176.01 2bsd s PHE 190 N 0.99 3.85 0.33 -0.53 0.08 -0.25 -1.03 117.98 121.43 2bsd s PHE 190 Ca 0.01 1.55 0.04 0.00 0.12 0.00 0.00 56.93 58.64 2bsd s PHE 190 Cb -0.15 -2.74 -0.02 0.00 -0.57 0.00 0.00 43.02 39.54 2bsd s PHE 190 CO 0.01 0.47 0.34 -0.06 -0.10 0.00 0.00 175.22 175.88 2bsd s PHE 191 N -0.89 1.54 0.00 0.36 0.08 0.28 -4.00 117.98 115.35 2bsd s PHE 191 Ca 0.35 -1.55 0.00 0.00 0.12 0.00 0.00 56.93 55.85 2bsd s PHE 191 Cb -0.22 -0.52 0.00 0.00 -0.57 0.00 0.00 43.02 41.71 2bsd s PHE 191 CO 0.24 -0.95 0.00 0.41 -0.10 0.00 0.00 175.22 174.82 2bsd n GLY 192 N -0.60 -0.70 3.10 4.36 0.00 -1.26 -1.43 105.19 108.66 2bsd n GLY 192 Ca 0.05 -1.15 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.09 -0.09 1.61 0.01 -0.95 -1.50 113.70 108.69 2bsd s SER 193 Ca 0.00 0.07 -0.02 0.00 1.31 0.00 0.00 55.95 57.31 2bsd s SER 193 Cb 0.00 0.29 -0.03 0.00 0.21 0.00 0.00 66.02 66.49 2bsd s SER 193 CO 0.00 -0.24 0.02 -0.69 0.41 0.00 0.00 173.24 172.73 2bsd s VAL 194 N -0.74 4.46 0.15 3.43 1.01 0.07 -2.91 120.40 125.86 2bsd s VAL 194 Ca -0.08 -0.19 -0.17 0.00 0.00 0.00 0.00 61.98 61.53 2bsd s VAL 194 Cb -0.05 -2.88 0.04 0.00 0.00 0.00 0.00 36.38 33.49 2bsd s VAL 194 CO 0.01 0.61 0.46 -0.94 0.00 0.00 0.00 175.10 175.24 2bsd s SER 195 N -0.90 -0.29 -1.12 3.32 1.04 -0.90 -1.35 113.70 113.49 2bsd s SER 195 Ca 0.13 -0.31 -0.13 0.00 0.48 0.00 0.00 55.95 56.12 2bsd s SER 195 Cb -0.11 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.49 2bsd s SER 195 CO 0.02 -0.92 0.83 0.59 0.98 0.00 0.00 173.24 174.75 2bsd n ASN 196 N -0.28 -5.34 -3.76 7.02 5.03 -0.59 -4.76 115.26 112.58 2bsd n ASN 196 Ca -0.15 -0.88 -0.13 0.00 0.87 0.00 0.00 54.58 54.30 2bsd n ASN 196 Cb 0.64 -4.16 -0.09 0.00 -1.02 0.00 0.00 39.78 35.14 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 0.04 0.26 2.41 1.10 -1.08 -5.00 121.20 115.47 2bsd s ILE 197 Ca 0.41 -0.35 0.10 0.00 -0.51 0.00 0.00 60.65 60.31 2bsd s ILE 197 Cb -0.11 -0.57 -0.04 0.00 0.15 0.00 0.00 42.46 41.89 2bsd s ILE 197 CO 0.81 -0.19 -0.07 -1.10 -2.11 0.00 0.00 174.94 172.28 2bsd s GLN 198 N -0.90 2.10 0.28 3.50 -0.21 -1.26 -0.91 119.66 122.26 2bsd s GLN 198 Ca -0.10 -1.50 -0.30 0.00 0.02 0.00 0.00 55.36 53.48 2bsd s GLN 198 Cb -0.04 -2.05 -0.12 0.00 1.00 0.00 0.00 33.01 31.80 2bsd s GLN 198 CO 0.03 0.36 1.59 0.36 -2.12 0.00 0.00 175.29 175.51 2bsd n LYS 199 N -0.73 2.64 -0.37 2.91 2.85 -1.26 -2.29 118.16 121.90 2bsd n LYS 199 Ca -0.06 0.94 0.00 0.00 -1.05 0.00 0.00 58.31 58.14 2bsd n LYS 199 Cb 0.59 -2.72 0.00 0.00 -0.65 0.00 0.00 35.03 32.25 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 2.27 1.48 3.74 2.58 0.00 0.44 -5.02 105.19 110.68 2bsd n GLY 200 Ca 0.09 0.00 -0.40 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 -3.09 3.87 0.18 1.61 0.52 -0.97 -4.81 118.94 116.24 2bsd s TRP 201 Ca 0.00 1.77 -0.31 0.00 0.02 0.00 0.00 56.10 57.58 2bsd s TRP 201 Cb 0.00 -2.96 -0.09 0.00 -1.15 0.00 0.00 33.47 29.27 2bsd s TRP 201 CO 0.00 0.33 1.37 -0.80 0.02 0.00 0.00 176.95 177.88 2bsd s ASN 202 N -0.51 6.81 0.52 2.95 0.01 -1.26 -1.03 114.94 122.42 2bsd s ASN 202 Ca 0.42 2.43 -0.21 0.00 -0.71 0.00 0.00 52.86 54.79 2bsd s ASN 202 Cb -0.24 -2.60 -0.06 0.00 0.41 0.00 0.00 41.25 38.76 2bsd s ASN 202 CO 0.29 -0.62 1.19 -0.04 -1.51 0.00 0.00 177.10 176.41 2bsd s MET 203 N 0.33 3.44 0.00 -0.60 -1.94 0.06 -4.92 119.30 115.68 2bsd s MET 203 Ca 0.61 1.79 0.18 0.00 -1.71 0.00 0.00 55.69 56.56 2bsd s MET 203 Cb -0.38 -2.20 0.74 0.00 2.01 0.00 0.00 34.83 35.00 2bsd s MET 203 CO 0.36 -0.82 1.52 -1.13 -0.01 0.00 0.00 175.02 174.94 2bsd n SER 204 N -0.96 1.30 0.00 3.03 3.41 -1.23 -4.82 113.62 114.35 2bsd n SER 204 Ca 0.10 -1.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.01 2bsd n SER 204 Cb 0.49 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 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 1.03 3.56 3.73 5.00 0.00 -0.17 -4.84 105.19 113.50 2bsd n GLY 205 Ca 0.15 -1.64 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 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 4.48 4.13 0.63 2.61 2.01 -0.00 -4.82 115.64 124.66 2bsd s THR 206 Ca 0.00 1.72 -0.12 0.00 0.31 0.00 0.00 61.69 63.60 2bsd s THR 206 Cb 0.00 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 2bsd s THR 206 CO 0.00 0.24 1.03 0.26 -0.69 0.00 0.00 174.62 175.47 2bsd s TRP 207 N 0.18 3.39 0.08 4.92 0.52 -1.26 -4.38 118.94 122.39 2bsd s TRP 207 Ca 0.51 1.38 -0.31 0.00 0.02 0.00 0.00 56.10 57.70 2bsd s TRP 207 Cb -0.27 -2.80 -0.06 0.00 -1.15 0.00 0.00 33.47 29.18 2bsd s TRP 207 CO 0.32 -0.85 1.27 0.08 0.02 0.00 0.00 176.95 177.80 2bsd s VAL 208 N -2.99 3.76 0.64 4.03 1.01 0.48 -4.99 120.40 122.33 2bsd s VAL 208 Ca 0.57 1.26 -0.18 0.00 0.00 0.00 0.00 61.98 63.64 2bsd s VAL 208 Cb -0.12 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2bsd s VAL 208 CO 0.49 0.10 0.98 0.47 0.00 0.00 0.00 175.10 177.14 2bsd n ASP 209 N 3.95 0.77 -0.21 3.32 8.00 -1.26 -4.62 116.55 126.49 2bsd n ASP 209 Ca 0.10 0.77 0.00 0.00 0.71 0.00 0.00 54.79 56.37 2bsd n ASP 209 Cb 0.45 -1.40 0.08 0.00 -0.02 0.00 0.00 41.12 40.22 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 0.29 0.03 0.00 -1.24 3.08 -1.96 -1.50 114.38 113.08 2bsd h ARG 210 Ca -0.49 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2bsd h ARG 210 Cb 1.36 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.40 2bsd h ARG 210 CO 0.50 0.02 0.00 -2.30 -1.07 0.00 0.00 179.97 177.12 2bsd n PRO 211 N -5.38 0.08 0.00 0.04 -0.02 -1.26 -1.94 135.00 126.51 2bsd n PRO 211 Ca 0.08 0.53 0.07 0.00 -2.02 0.00 0.00 63.50 62.17 2bsd n PRO 211 Cb 0.35 -1.74 -0.03 0.00 -0.02 0.00 0.00 33.50 32.05 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 -1.90 0.00 -2.11 6.00 3.72 -0.57 -5.00 117.46 117.59 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 0.05 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.56 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 -1.99 4.29 0.53 -1.08 0.52 -0.82 -4.99 118.95 115.41 2bsd s ARG 213 Ca 0.09 2.14 -0.17 0.00 -0.52 0.00 0.00 55.73 57.27 2bsd s ARG 213 Cb 0.11 -3.30 -0.07 0.00 0.52 0.00 0.00 34.95 32.22 2bsd s ARG 213 CO 0.45 -0.51 1.00 -1.25 0.02 0.00 0.00 175.30 175.02 2bsd s PRO 214 N 1.39 3.80 0.47 3.54 0.04 -1.26 -4.91 135.00 138.06 2bsd s PRO 214 Ca 0.66 1.04 0.23 0.00 0.04 0.00 0.00 61.00 62.97 2bsd s PRO 214 Cb -0.38 -2.11 1.15 0.00 0.04 0.00 0.00 34.50 33.20 2bsd s PRO 214 CO 0.30 -0.40 1.96 0.00 0.04 0.00 0.00 177.00 178.90 2bsd h ALA 215 N 0.87 1.25 -3.03 8.56 0.00 -1.64 -3.37 119.26 121.90 2bsd h ALA 215 Ca -0.47 -0.19 -0.30 0.00 0.00 0.00 0.00 54.91 53.96 2bsd h ALA 215 Cb 1.19 -0.03 -0.20 0.00 0.00 0.00 0.00 17.79 18.75 2bsd h ALA 215 CO 0.60 0.26 -0.74 0.00 0.00 0.00 0.00 179.25 179.37 2bsd s ALA 216 N -4.08 0.80 0.19 0.00 0.00 -1.26 -4.86 121.76 112.55 2bsd s ALA 216 Ca -0.02 -0.94 -0.33 0.00 0.00 0.00 0.00 51.96 50.67 2bsd s ALA 216 Cb 0.13 0.03 -0.14 0.00 0.00 0.00 0.00 23.12 23.14 2bsd s ALA 216 CO 0.63 -0.02 1.46 1.55 0.00 0.00 0.00 175.76 179.39 2bsd n VAL 217 N 1.12 0.42 -4.62 0.00 3.14 -1.26 -4.68 118.33 112.45 2bsd n VAL 217 Ca -0.20 -0.11 -0.33 0.00 -2.96 0.00 0.00 64.34 60.74 2bsd n VAL 217 Cb 0.56 -1.40 -0.16 0.00 -1.06 0.00 0.00 33.84 31.77 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 0.28 3.08 -0.34 1.45 -1.52 -0.49 -4.96 119.66 117.15 2bsd s GLN 218 Ca 0.75 -0.82 -0.18 0.00 -1.95 0.00 0.00 55.36 53.15 2bsd s GLN 218 Cb -0.70 -2.49 -0.01 0.00 -0.22 0.00 0.00 33.01 29.59 2bsd s GLN 218 CO 0.44 -0.01 0.52 -1.12 -0.25 0.00 0.00 175.29 174.88 2bsd s SER 219 N 0.82 6.34 -0.21 5.90 0.01 -1.26 -0.72 113.70 124.57 2bsd s SER 219 Ca -0.06 0.06 -0.04 0.00 1.31 0.00 0.00 55.95 57.22 2bsd s SER 219 Cb -0.15 -2.28 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 2bsd s SER 219 CO -0.01 -0.46 -0.05 -0.76 0.41 0.00 0.00 173.24 172.36 2bsd s LEU 220 N 2.41 2.89 0.07 2.44 1.43 0.12 -4.96 118.68 123.09 2bsd s LEU 220 Ca 0.20 -0.38 -0.25 0.00 -1.03 0.00 0.00 54.13 52.67 2bsd s LEU 220 Cb -0.15 -1.73 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 2bsd s LEU 220 CO 0.13 -0.00 0.75 -0.69 0.23 0.00 0.00 176.35 176.77 2bsd s VAL 221 N 1.37 4.67 0.37 -1.59 1.01 -1.26 -1.37 120.40 123.60 2bsd s VAL 221 Ca 0.05 1.61 0.04 0.00 0.00 0.00 0.00 61.98 63.68 2bsd s VAL 221 Cb -0.14 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 2bsd s VAL 221 CO -0.03 0.40 0.12 -0.83 0.00 0.00 0.00 175.10 174.77 2bsd s GLY 222 N -0.31 2.38 0.03 4.51 0.00 0.32 -4.62 107.32 109.64 2bsd s GLY 222 Ca 0.37 -1.51 0.03 0.00 0.00 0.00 0.00 44.72 43.62 2bsd s GLY 222 CO 0.23 -1.78 -0.11 -1.58 0.00 0.00 0.00 173.10 169.87 2bsd s HIS 223 N -3.31 0.92 -0.34 1.90 2.46 0.44 -2.27 115.29 115.09 2bsd s HIS 223 Ca 0.29 -0.34 -0.22 0.00 0.47 0.00 0.00 55.06 55.26 2bsd s HIS 223 Cb 0.04 -0.55 0.00 0.00 -0.13 0.00 0.00 32.58 31.94 2bsd s HIS 223 CO 0.15 -0.01 0.71 -0.06 -2.47 0.00 0.00 174.74 173.06 2bsd s PHE 224 N -0.86 3.16 0.18 3.88 0.08 -1.02 -1.09 117.98 122.31 2bsd s PHE 224 Ca -0.02 0.54 -0.33 0.00 0.12 0.00 0.00 56.93 57.24 2bsd s PHE 224 Cb -0.07 -3.21 -0.13 0.00 -0.57 0.00 0.00 43.02 39.04 2bsd s PHE 224 CO 0.01 -0.62 1.57 0.00 -0.10 0.00 0.00 175.22 176.08 2bsd n ALA 225 N 6.16 1.57 -1.01 5.36 0.00 -0.78 -1.88 120.51 129.92 2bsd n ALA 225 Ca 0.01 0.43 -0.00 0.00 0.00 0.00 0.00 53.44 53.88 2bsd n ALA 225 Cb 0.48 -2.37 -0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 3.26 0.46 3.37 0.00 0.00 -1.26 -4.84 105.19 106.18 2bsd n GLY 226 Ca 0.16 -0.14 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.57 1.50 -0.18 1.61 0.52 -0.79 -5.05 118.95 115.99 2bsd s ARG 227 Ca 0.00 -1.81 0.16 0.00 -0.52 0.00 0.00 55.73 53.55 2bsd s ARG 227 Cb 0.00 -0.57 0.72 0.00 0.52 0.00 0.00 34.95 35.61 2bsd s ARG 227 CO 0.00 -0.22 1.63 -0.40 0.02 0.00 0.00 175.30 176.33 2bsd n ASP 228 N -0.55 4.98 -4.84 0.23 5.68 -1.26 -4.78 116.55 116.02 2bsd n ASP 228 Ca -0.02 -2.78 -0.21 0.00 -0.50 0.00 0.00 54.79 51.28 2bsd n ASP 228 Cb 0.66 -0.61 -0.04 0.00 -1.14 0.00 0.00 41.12 39.99 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 -2.45 3.22 0.06 2.12 -4.23 -1.26 -5.06 115.64 108.05 2bsd s THR 229 Ca 0.50 -1.42 -0.01 0.00 -1.18 0.00 0.00 61.69 59.57 2bsd s THR 229 Cb 0.37 -3.10 -0.04 0.00 1.34 0.00 0.00 72.50 71.06 2bsd s THR 229 CO 0.17 -0.13 -0.01 -0.55 -0.54 0.00 0.00 174.62 173.56 2bsd s SER 230 N -4.00 0.45 0.21 3.99 0.15 -1.26 -2.44 113.70 110.80 2bsd s SER 230 Ca 0.42 -1.02 -0.11 0.00 0.70 0.00 0.00 55.95 55.94 2bsd s SER 230 Cb -0.04 0.22 -0.01 0.00 -1.71 0.00 0.00 66.02 64.48 2bsd s SER 230 CO 0.26 -0.62 0.38 0.72 1.20 0.00 0.00 173.24 175.17 2bsd s PHE 231 N -3.94 0.41 0.04 3.44 -0.12 -0.96 -4.69 117.98 112.16 2bsd s PHE 231 Ca 0.09 -0.75 0.00 0.00 -0.05 0.00 0.00 56.93 56.22 2bsd s PHE 231 Cb 0.08 0.04 -0.03 0.00 -0.63 0.00 0.00 43.02 42.48 2bsd s PHE 231 CO -0.08 -0.85 -0.04 -3.38 -0.05 0.00 0.00 175.22 170.82 2bsd s HIS 232 N -4.00 0.49 0.16 3.49 -3.43 -1.26 -0.52 115.29 110.22 2bsd s HIS 232 Ca 0.21 -0.77 0.09 0.00 -0.80 0.00 0.00 55.06 53.79 2bsd s HIS 232 Cb 0.02 -0.33 -0.04 0.00 -1.43 0.00 0.00 32.58 30.79 2bsd s HIS 232 CO 0.05 -0.24 -0.15 0.96 -2.00 0.00 0.00 174.74 173.36 2bsd s ILE 233 N -2.60 2.95 -0.26 -5.38 -4.36 -0.47 -0.94 121.20 110.14 2bsd s ILE 233 Ca -0.03 -1.64 -0.08 0.00 -0.26 0.00 0.00 60.65 58.63 2bsd s ILE 233 Cb -0.02 -2.41 -0.03 0.00 1.25 0.00 0.00 42.46 41.25 2bsd s ILE 233 CO -0.04 -0.03 0.10 -1.81 0.24 0.00 0.00 174.94 173.40 2bsd s ASP 234 N -2.53 5.31 -0.42 4.36 1.11 0.22 -0.70 116.67 124.02 2bsd s ASP 234 Ca 0.22 -0.22 -0.22 0.00 0.18 0.00 0.00 52.55 52.50 2bsd s ASP 234 Cb -0.09 -1.96 0.02 0.00 1.07 0.00 0.00 42.92 41.95 2bsd s ASP 234 CO 0.12 -0.06 0.71 -0.63 1.18 0.00 0.00 175.17 176.49 2bsd s ILE 235 N 1.63 4.77 0.45 0.77 1.01 0.10 -0.86 121.20 129.06 2bsd s ILE 235 Ca 0.06 0.39 -0.12 0.00 0.00 0.00 0.00 60.65 60.99 2bsd s ILE 235 Cb -0.15 -4.22 -0.07 0.00 0.01 0.00 0.00 42.46 38.03 2bsd s ILE 235 CO 0.05 -0.57 0.84 0.20 0.00 0.00 0.00 174.94 175.46 2bsd s ASN 236 N 1.99 6.53 0.53 3.58 0.01 -0.38 -1.40 114.94 125.80 2bsd s ASN 236 Ca 0.26 1.26 0.22 0.00 -0.71 0.00 0.00 52.86 53.89 2bsd s ASN 236 Cb -0.13 -2.38 1.36 0.00 0.41 0.00 0.00 41.25 40.50 2bsd s ASN 236 CO 0.19 -0.48 2.06 -0.65 -1.51 0.00 0.00 177.10 176.71 2bsd h PRO 237 N 1.04 0.00 0.00 -0.60 0.11 -1.84 -0.38 132.00 130.34 2bsd h PRO 237 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2bsd h PRO 237 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2bsd h PRO 237 CO 0.63 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.69 2bsd n ASN 238 N -4.43 0.00 0.00 -2.05 6.94 -1.26 -4.67 115.26 109.79 2bsd n ASN 238 Ca 0.05 -0.07 0.00 0.00 -0.02 0.00 0.00 54.58 54.54 2bsd n ASN 238 Cb 0.41 -0.29 0.00 0.00 -2.36 0.00 0.00 39.78 37.54 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 0.92 1.13 3.76 4.83 0.00 -0.15 -4.89 105.19 110.79 2bsd n GLY 239 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 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 4.76 -0.12 1.61 1.04 -1.26 -0.39 113.70 117.54 2bsd s SER 240 Ca 0.00 1.97 0.03 0.00 0.48 0.00 0.00 55.95 58.43 2bsd s SER 240 Cb 0.00 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.58 2bsd s SER 240 CO 0.00 -1.86 -0.21 -0.63 0.98 0.00 0.00 173.24 171.52 2bsd s ILE 241 N -2.51 1.93 -0.18 -1.02 1.01 -1.26 -1.25 121.20 117.91 2bsd s ILE 241 Ca 0.66 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 60.34 2bsd s ILE 241 Cb -0.20 -1.70 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 2bsd s ILE 241 CO 0.47 0.53 -0.00 -0.89 0.00 0.00 0.00 174.94 175.05 2bsd s THR 242 N 0.67 4.08 -0.06 2.92 2.01 -0.04 -0.76 115.64 124.46 2bsd s THR 242 Ca -0.12 -0.28 -0.30 0.00 0.31 0.00 0.00 61.69 61.31 2bsd s THR 242 Cb -0.16 -2.83 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 2bsd s THR 242 CO 0.02 0.45 1.15 0.86 -0.69 0.00 0.00 174.62 176.42 2bsd s TRP 243 N 0.68 3.29 -0.10 4.92 -0.11 -0.20 -0.61 118.94 126.82 2bsd s TRP 243 Ca -0.00 1.32 0.16 0.00 1.22 0.00 0.00 56.10 58.80 2bsd s TRP 243 Cb -0.14 -3.36 0.36 0.00 -1.50 0.00 0.00 33.47 28.83 2bsd s TRP 243 CO 0.02 -1.03 1.17 0.91 -4.62 0.00 0.00 176.95 173.40 2bsd n TRP 244 N 5.04 0.00 -1.83 5.86 7.02 -0.11 -0.42 117.44 133.00 2bsd n TRP 244 Ca 0.10 -0.89 -0.12 0.00 -1.02 0.00 0.00 57.50 55.57 2bsd n TRP 244 Cb 0.47 -0.18 0.08 0.00 -2.42 0.00 0.00 31.31 29.26 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 -0.42 -0.46 3.71 6.99 0.00 -1.17 -4.04 105.19 109.80 2bsd n GLY 245 Ca 0.12 -1.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.03 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 -3.55 1.22 0.28 4.61 0.00 -1.26 -4.08 121.76 118.98 2bsd s ALA 246 Ca 0.33 -0.64 -0.30 0.00 0.00 0.00 0.00 51.96 51.35 2bsd s ALA 246 Cb -0.01 -3.00 -0.11 0.00 0.00 0.00 0.00 23.12 20.00 2bsd s ALA 246 CO 0.22 -2.83 1.52 -0.80 0.00 0.00 0.00 175.76 173.88 2bsd s ASN 247 N -3.88 6.48 -0.14 0.00 0.01 -1.26 -4.48 114.94 111.68 2bsd s ASN 247 Ca 0.67 2.85 0.01 0.00 -0.71 0.00 0.00 52.86 55.68 2bsd s ASN 247 Cb -0.14 -2.63 -0.00 0.00 0.41 0.00 0.00 41.25 38.88 2bsd s ASN 247 CO 0.55 -0.82 -0.17 -0.63 -1.51 0.00 0.00 177.10 174.52 2bsd s ILE 248 N -0.13 2.59 0.00 0.60 -1.09 -0.09 -5.02 121.20 118.07 2bsd s ILE 248 Ca 0.61 -0.81 0.00 0.00 -2.23 0.00 0.00 60.65 58.22 2bsd s ILE 248 Cb -0.45 -2.07 0.00 0.00 -1.58 0.00 0.00 42.46 38.36 2bsd s ILE 248 CO 0.48 0.53 0.00 -0.90 -1.23 0.00 0.00 174.94 173.81 2bsd n ASP 249 N 3.83 0.00 0.21 3.58 5.75 -1.26 -2.60 116.55 126.06 2bsd n ASP 249 Ca -0.19 0.00 0.05 0.00 -0.01 0.00 0.00 54.79 54.65 2bsd n ASP 249 Cb 0.52 0.00 0.45 0.00 -1.03 0.00 0.00 41.12 41.06 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 -6.19 0.11 1.57 -1.97 -1.56 116.57 108.52 2bsd h LYS 250 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 2bsd h LYS 250 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 2bsd h LYS 250 CO 0.00 0.30 0.87 0.99 -0.57 0.00 0.00 179.45 181.05 2bsd s THR 251 N -4.13 4.42 0.34 -0.16 2.01 -1.26 -4.74 115.64 112.11 2bsd s THR 251 Ca -0.02 1.68 -0.29 0.00 0.31 0.00 0.00 61.69 63.37 2bsd s THR 251 Cb 0.14 -4.20 -0.11 0.00 0.01 0.00 0.00 72.50 68.34 2bsd s THR 251 CO 0.69 -0.28 1.39 -2.84 -0.69 0.00 0.00 174.62 172.89 2bsd s PRO 252 N 3.56 4.26 -0.10 4.92 0.02 -1.26 -4.72 135.00 141.67 2bsd s PRO 252 Ca 0.50 2.35 0.03 0.00 0.02 0.00 0.00 61.00 63.90 2bsd s PRO 252 Cb -0.17 -3.04 0.01 0.00 0.02 0.00 0.00 34.50 31.32 2bsd s PRO 252 CO 0.14 -0.33 -0.18 0.42 -0.33 0.00 0.00 177.00 176.72 2bsd s ILE 253 N -1.01 1.63 0.16 2.83 1.01 -0.46 -4.88 121.20 120.50 2bsd s ILE 253 Ca 0.51 -0.75 -0.31 0.00 0.00 0.00 0.00 60.65 60.10 2bsd s ILE 253 Cb -0.42 -1.46 -0.11 0.00 0.01 0.00 0.00 42.46 40.48 2bsd s ILE 253 CO 0.55 0.47 1.76 0.00 0.00 0.00 0.00 174.94 177.73 2bsd s ALA 254 N 0.72 3.85 -0.12 9.38 0.00 -1.26 -0.75 121.76 133.58 2bsd s ALA 254 Ca -0.12 1.51 -0.00 0.00 0.00 0.00 0.00 51.96 53.35 2bsd s ALA 254 Cb -0.16 -3.72 -0.02 0.00 0.00 0.00 0.00 23.12 19.22 2bsd s ALA 254 CO 0.02 -1.06 -0.12 0.95 0.00 0.00 0.00 175.76 175.56 2bsd s THR 255 N 1.94 3.20 0.17 0.00 -4.23 -0.56 -1.88 115.64 114.28 2bsd s THR 255 Ca 0.77 -0.62 -0.04 0.00 -1.18 0.00 0.00 61.69 60.63 2bsd s THR 255 Cb -0.48 -2.34 -0.03 0.00 1.34 0.00 0.00 72.50 71.00 2bsd s THR 255 CO 0.34 0.53 0.17 -0.13 -0.54 0.00 0.00 174.62 174.99 2bsd s ARG 256 N 0.18 1.12 0.00 3.99 1.81 -0.25 -3.20 118.95 122.60 2bsd s ARG 256 Ca -0.07 -1.42 0.00 0.00 -1.72 0.00 0.00 55.73 52.53 2bsd s ARG 256 Cb -0.15 0.30 0.00 0.00 -0.45 0.00 0.00 34.95 34.66 2bsd s ARG 256 CO 0.05 -0.38 0.00 0.41 -0.68 0.00 0.00 175.30 174.70 2bsd n GLY 257 N -0.20 3.81 3.65 -3.53 0.00 -1.26 -0.42 105.19 107.25 2bsd n GLY 257 Ca -0.03 -1.68 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 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 5.70 0.06 1.61 -0.87 -1.26 -1.09 114.94 119.09 2bsd s ASN 258 Ca 0.00 0.11 0.07 0.00 -1.57 0.00 0.00 52.86 51.47 2bsd s ASN 258 Cb 0.00 -1.97 -0.03 0.00 -0.02 0.00 0.00 41.25 39.24 2bsd s ASN 258 CO 0.00 0.19 -0.19 -0.83 -2.57 0.00 0.00 177.10 173.70 2bsd s GLY 259 N 0.30 1.05 0.07 0.66 0.00 0.03 -4.89 107.32 104.54 2bsd s GLY 259 Ca 0.04 -1.04 0.05 0.00 0.00 0.00 0.00 44.72 43.77 2bsd s GLY 259 CO -0.00 -1.01 -0.14 -1.35 0.00 0.00 0.00 173.10 170.60 2bsd s SER 260 N -1.39 1.63 0.10 1.64 1.04 -1.26 0.98 113.70 116.43 2bsd s SER 260 Ca 0.05 -0.60 -0.15 0.00 0.48 0.00 0.00 55.95 55.73 2bsd s SER 260 Cb -0.09 -0.05 0.03 0.00 0.10 0.00 0.00 66.02 66.01 2bsd s SER 260 CO 0.02 -0.08 0.37 -0.72 0.98 0.00 0.00 173.24 173.81 2bsd s TYR 261 N -1.25 -0.16 -0.02 5.02 -0.85 -0.49 -5.01 117.35 114.58 2bsd s TYR 261 Ca -0.02 -0.10 -0.15 0.00 -0.52 0.00 0.00 57.07 56.27 2bsd s TYR 261 Cb -0.10 0.20 -0.05 0.00 0.38 0.00 0.00 41.96 42.38 2bsd s TYR 261 CO 0.02 -0.64 0.40 -0.06 -1.52 0.00 0.00 175.55 173.75 2bsd s PHE 262 N -3.46 3.69 0.07 -3.49 0.08 -1.26 -1.23 117.98 112.38 2bsd s PHE 262 Ca 0.01 0.95 -0.11 0.00 0.12 0.00 0.00 56.93 57.90 2bsd s PHE 262 Cb 0.02 -2.31 -0.26 0.00 -0.57 0.00 0.00 43.02 39.90 2bsd s PHE 262 CO -0.09 0.58 1.14 0.82 -0.10 0.00 0.00 175.22 177.56 2bsd h ILE 263 N 3.87 1.34 -0.03 0.64 2.04 -1.08 -3.43 117.51 120.87 2bsd h ILE 263 Ca -0.50 -2.58 0.00 0.00 1.00 0.00 0.00 64.86 62.78 2bsd h ILE 263 Cb 1.21 2.71 0.00 0.00 -0.74 0.00 0.00 36.82 40.01 2bsd h ILE 263 CO 0.64 0.78 0.00 0.29 0.00 0.00 0.00 178.15 179.85