#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cds s VAL 2 N 0.00 4.91 0.62 3.15 1.01 -1.26 -1.26 120.40 127.56 2cds s VAL 2 Ca 0.00 -0.88 -0.15 0.00 0.00 0.00 0.00 61.98 60.96 2cds s VAL 2 Cb 0.00 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 2cds s VAL 2 CO 0.00 -0.35 1.06 -0.36 0.00 0.00 0.00 175.10 175.45 2cds s PHE 3 N 1.60 2.99 0.38 5.22 0.08 -0.32 -5.00 117.98 122.94 2cds s PHE 3 Ca 0.03 1.50 -0.03 0.00 0.12 0.00 0.00 56.93 58.55 2cds s PHE 3 Cb -0.20 -2.99 -0.04 0.00 -0.57 0.00 0.00 43.02 39.22 2cds s PHE 3 CO 0.07 -1.17 0.63 0.20 -0.10 0.00 0.00 175.22 174.86 2cds s GLY 4 N -2.98 1.52 0.11 4.36 0.00 -1.26 -4.86 107.32 104.21 2cds s GLY 4 Ca 0.63 -0.68 -0.29 0.00 0.00 0.00 0.00 44.72 44.38 2cds s GLY 4 CO 0.41 -0.57 1.62 -0.09 0.00 0.00 0.00 173.10 174.46 2cds h ARG 5 N 0.80 -0.57 -0.22 2.90 2.43 -1.97 -1.07 114.38 116.68 2cds h ARG 5 Ca -0.48 0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 58.62 2cds h ARG 5 Cb 1.21 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.87 2cds h ARG 5 CO 0.63 -0.38 -0.33 0.00 -1.51 0.00 0.00 179.97 178.38 2cds h GLU 7 N 0.39 0.65 -0.42 0.00 4.81 -1.91 -1.55 114.58 116.55 2cds h GLU 7 Ca 0.05 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.15 2cds h GLU 7 Cb 0.77 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 2cds h GLU 7 CO 0.06 0.50 0.03 1.25 -0.73 0.00 0.00 179.01 180.12 2cds h LEU 8 N 0.62 0.70 -0.57 1.64 5.85 -1.04 -2.19 115.31 120.31 2cds h LEU 8 Ca 0.17 -0.29 0.08 0.00 0.84 0.00 0.00 57.88 58.68 2cds h LEU 8 Cb 0.03 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 40.81 2cds h LEU 8 CO -0.03 0.81 0.21 0.00 -0.34 0.00 0.00 178.44 179.09 2cds h ALA 9 N 0.91 0.72 -0.56 1.25 0.00 -1.09 0.56 119.26 121.05 2cds h ALA 9 Ca 0.12 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2cds h ALA 9 Cb 0.43 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2cds h ALA 9 CO 0.02 -0.19 0.16 0.00 0.00 0.00 0.00 179.25 179.23 2cds h ALA 10 N 1.39 0.74 -0.56 0.00 0.00 -1.16 -0.96 119.26 118.71 2cds h ALA 10 Ca 0.28 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2cds h ALA 10 Cb 0.33 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2cds h ALA 10 CO -0.28 0.42 0.09 0.00 0.00 0.00 0.00 179.25 179.48 2cds h ALA 11 N 1.03 0.75 -0.54 0.00 0.00 -0.73 -1.51 119.26 118.26 2cds h ALA 11 Ca 0.18 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 2cds h ALA 11 Cb 0.31 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2cds h ALA 11 CO -0.00 0.49 -0.08 0.52 0.00 0.00 0.00 179.25 180.19 2cds h MET 12 N 0.83 0.99 -0.44 0.00 2.86 -0.77 -2.18 114.93 116.22 2cds h MET 12 Ca 0.17 -0.34 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 2cds h MET 12 Cb 0.41 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2cds h MET 12 CO 0.01 1.02 0.14 -0.22 1.06 0.00 0.00 176.91 178.92 2cds h LYS 13 N 0.89 0.68 -0.11 1.72 3.64 -1.02 -1.80 116.57 120.57 2cds h LYS 13 Ca 0.15 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2cds h LYS 13 Cb 0.63 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 2cds h LYS 13 CO 0.04 0.66 -0.05 -0.09 -2.27 0.00 0.00 179.45 177.75 2cds h ARG 14 N 0.57 0.16 -0.31 1.90 2.43 -1.14 -1.49 114.38 116.50 2cds h ARG 14 Ca 0.14 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2cds h ARG 14 Cb 0.27 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2cds h ARG 14 CO -0.00 0.22 0.00 0.72 -1.51 0.00 0.00 179.97 179.40 2cds n HIS 15 N -4.39 0.38 -1.24 2.20 8.25 -0.83 -4.92 115.22 114.66 2cds n HIS 15 Ca -0.01 -0.18 -0.01 0.00 -0.26 0.00 0.00 57.72 57.26 2cds n HIS 15 Cb 0.18 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.27 2cds n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cds n GLY 16 N 0.87 0.42 0.17 -1.41 0.00 -0.56 -4.97 105.19 99.71 2cds n GLY 16 Ca 0.09 -1.01 0.11 0.00 0.00 0.00 0.00 46.02 45.21 2cds n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cds h LEU 17 N 0.00 0.00 -9.11 0.99 3.38 -1.51 -3.40 115.31 105.66 2cds h LEU 17 Ca -0.02 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.39 2cds h LEU 17 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 2cds h LEU 17 CO 0.03 0.03 1.30 -0.62 0.09 0.00 0.00 178.44 179.27 2cds s ASP 18 N -5.82 6.03 -0.47 -0.43 2.15 -1.26 -1.43 116.67 115.45 2cds s ASP 18 Ca 0.03 2.03 0.00 0.00 0.43 0.00 0.00 52.55 55.04 2cds s ASP 18 Cb 0.07 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.17 2cds s ASP 18 CO 0.73 -1.48 0.00 0.59 -0.17 0.00 0.00 175.17 174.84 2cds n ASN 19 N 9.47 -4.21 -4.67 -0.34 5.03 -0.20 -4.88 115.26 115.45 2cds n ASN 19 Ca 0.23 0.11 -0.42 0.00 0.87 0.00 0.00 54.58 55.37 2cds n ASN 19 Cb 0.44 -2.10 -0.03 0.00 -1.02 0.00 0.00 39.78 37.07 2cds n ASN 19 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 2cds s TYR 20 N -1.94 2.03 -1.89 3.10 5.04 -0.51 -1.40 117.35 121.78 2cds s TYR 20 Ca 0.00 0.12 0.00 0.00 -2.44 0.00 0.00 57.07 54.75 2cds s TYR 20 Cb 0.00 -4.00 0.00 0.00 0.35 0.00 0.00 41.96 38.31 2cds s TYR 20 CO 0.00 -4.20 0.00 0.54 -1.34 0.00 0.00 175.55 170.55 2cds n ARG 21 N 6.56 -1.61 -0.63 4.97 5.12 -1.26 -2.05 116.66 127.75 2cds n ARG 21 Ca 0.17 1.06 0.00 0.00 -1.93 0.00 0.00 57.85 57.15 2cds n ARG 21 Cb 0.41 -5.60 0.00 0.00 -1.16 0.00 0.00 32.46 26.11 2cds n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2cds n GLY 22 N -0.73 0.75 3.50 -0.13 0.00 -0.49 -5.04 105.19 103.05 2cds n GLY 22 Ca -0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 2cds n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cds s TYR 23 N -2.66 3.22 0.81 1.61 2.02 -0.87 -4.91 117.35 116.56 2cds s TYR 23 Ca 0.00 -0.35 -0.13 0.00 -0.37 0.00 0.00 57.07 56.22 2cds s TYR 23 Cb 0.00 -2.47 0.08 0.00 -0.40 0.00 0.00 41.96 39.17 2cds s TYR 23 CO 0.00 -0.42 1.18 -1.54 -1.57 0.00 0.00 175.55 173.20 2cds s SER 24 N 1.69 3.68 0.35 2.29 1.04 -1.26 -1.04 113.70 120.46 2cds s SER 24 Ca 0.06 2.27 0.11 0.00 0.48 0.00 0.00 55.95 58.87 2cds s SER 24 Cb -0.18 -2.58 0.91 0.00 0.10 0.00 0.00 66.02 64.27 2cds s SER 24 CO 0.10 -2.60 1.79 0.25 0.98 0.00 0.00 173.24 173.75 2cds h LEU 25 N -0.98 0.62 -1.67 2.42 5.85 -1.90 -0.50 115.31 119.16 2cds h LEU 25 Ca -0.46 0.09 0.13 0.00 0.84 0.00 0.00 57.88 58.48 2cds h LEU 25 Cb 1.28 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.25 2cds h LEU 25 CO 0.46 0.19 0.45 1.23 -0.34 0.00 0.00 178.44 180.44 2cds h GLY 26 N 0.59 0.54 0.97 3.75 0.00 -1.90 -1.75 103.07 105.27 2cds h GLY 26 Ca 0.57 -0.14 -0.07 0.00 0.00 0.00 0.00 47.33 47.69 2cds h GLY 26 CO -0.33 0.06 0.03 3.43 0.00 0.00 0.00 176.54 179.73 2cds h ASN 27 N 0.34 0.76 -0.46 0.19 4.21 -1.32 -1.71 115.58 117.59 2cds h ASN 27 Ca 0.32 -0.29 -0.13 0.00 1.21 0.00 0.00 56.30 57.41 2cds h ASN 27 Cb 0.78 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 37.76 2cds h ASN 27 CO -0.08 0.86 -0.20 -0.50 -1.29 0.00 0.00 177.43 176.22 2cds h TRP 28 N 0.63 1.10 -0.33 1.19 4.06 -1.41 -1.21 115.95 119.99 2cds h TRP 28 Ca 0.13 -0.26 -0.17 0.00 2.06 0.00 0.00 58.89 60.65 2cds h TRP 28 Cb 0.46 -0.26 -0.00 0.00 -1.00 0.00 0.00 29.16 28.35 2cds h TRP 28 CO 0.03 1.07 -0.47 0.28 -3.56 0.00 0.00 178.44 175.79 2cds h VAL 29 N 0.84 1.27 -0.57 1.49 2.07 -1.42 -2.02 116.25 117.91 2cds h VAL 29 Ca 0.11 -1.65 -0.03 0.00 0.82 0.00 0.00 66.70 65.95 2cds h VAL 29 Cb 0.76 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 2cds h VAL 29 CO 0.06 0.54 0.25 0.00 0.02 0.00 0.00 177.57 178.44 2cds h ALA 31 N 1.09 0.46 -0.55 0.00 0.00 -1.14 -2.24 119.26 116.88 2cds h ALA 31 Ca 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2cds h ALA 31 Cb 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2cds h ALA 31 CO -0.02 0.03 0.30 0.00 0.00 0.00 0.00 179.25 179.56 2cds h ALA 32 N 1.01 0.70 -0.21 0.00 0.00 -1.21 0.18 119.26 119.74 2cds h ALA 32 Ca 0.12 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.99 2cds h ALA 32 Cb 0.14 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2cds h ALA 32 CO -0.01 0.22 -0.14 -0.22 0.00 0.00 0.00 179.25 179.09 2cds h LYS 33 N 0.73 -0.13 0.00 0.00 1.63 -0.94 -0.65 116.57 117.21 2cds h LYS 33 Ca 0.19 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.00 2cds h LYS 33 Cb 0.05 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.71 2cds h LYS 33 CO -0.03 -0.09 -0.34 1.19 -3.45 0.00 0.00 179.45 176.73 2cds n PHE 34 N -5.30 0.20 -0.00 1.91 0.99 -0.86 -0.68 117.46 113.72 2cds n PHE 34 Ca -0.02 0.06 -0.22 0.00 -0.00 0.00 0.00 57.45 57.28 2cds n PHE 34 Cb 0.22 -0.47 -0.14 0.00 -1.00 0.00 0.00 39.48 38.09 2cds n PHE 34 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 2cds h GLU 35 N 0.00 0.24 0.00 -1.08 4.39 -0.34 -3.44 114.58 114.35 2cds h GLU 35 Ca 0.00 -0.40 0.00 0.00 0.34 0.00 0.00 59.36 59.30 2cds h GLU 35 Cb 0.57 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2cds h GLU 35 CO 0.00 1.19 0.00 -1.13 -1.16 0.00 0.00 179.01 177.91 2cds n SER 36 N -3.82 0.26 -2.64 1.42 3.41 -0.30 -4.81 113.62 107.13 2cds n SER 36 Ca -0.28 -0.89 -0.20 0.00 -0.26 0.00 0.00 58.87 57.25 2cds n SER 36 Cb 0.94 0.04 0.03 0.00 -0.26 0.00 0.00 64.21 64.96 2cds n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2cds n ASN 37 N -0.04 -5.56 -0.53 4.04 5.15 0.14 -2.12 115.26 116.34 2cds n ASN 37 Ca 0.00 -0.25 -0.07 0.00 -0.60 0.00 0.00 54.58 53.66 2cds n ASN 37 Cb 0.15 -4.39 -0.03 0.00 -0.53 0.00 0.00 39.78 34.98 2cds n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2cds n PHE 38 N -4.36 0.00 -3.40 1.20 3.72 -1.20 -4.86 117.46 108.56 2cds n PHE 38 Ca -0.10 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.89 2cds n PHE 38 Cb 0.61 -1.86 -0.09 0.00 -0.94 0.00 0.00 39.48 37.20 2cds n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2cds s ASN 39 N -2.45 6.18 0.61 4.37 3.84 -0.90 -1.17 114.94 125.41 2cds s ASN 39 Ca 0.00 -0.23 0.39 0.00 0.21 0.00 0.00 52.86 53.23 2cds s ASN 39 Cb 0.00 -2.20 1.87 0.00 -0.55 0.00 0.00 41.25 40.38 2cds s ASN 39 CO 0.00 -0.34 2.17 0.71 -2.79 0.00 0.00 177.10 176.85 2cds h THR 40 N 5.54 0.02 -0.32 -5.21 1.35 -1.50 -2.80 112.91 109.99 2cds h THR 40 Ca -0.30 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 2cds h THR 40 Cb 1.14 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 2cds h THR 40 CO 0.69 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.97 2cds n GLN 41 N -3.11 2.19 -1.96 4.72 6.02 -1.26 -4.06 117.38 119.92 2cds n GLN 41 Ca -0.01 -1.80 -0.41 0.00 -0.01 0.00 0.00 57.00 54.77 2cds n GLN 41 Cb 0.19 -1.46 -0.02 0.00 1.02 0.00 0.00 30.24 29.98 2cds n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2cds s ALA 42 N -1.58 3.63 0.01 -1.58 0.00 -1.06 -4.82 121.76 116.36 2cds s ALA 42 Ca 0.36 1.39 0.01 0.00 0.00 0.00 0.00 51.96 53.72 2cds s ALA 42 Cb 0.20 -3.57 -0.01 0.00 0.00 0.00 0.00 23.12 19.74 2cds s ALA 42 CO 0.29 -0.81 -0.03 0.95 0.00 0.00 0.00 175.76 176.16 2cds s THR 43 N -0.26 0.18 -0.12 0.00 -4.23 -1.26 -1.55 115.64 108.41 2cds s THR 43 Ca 0.58 -0.42 -0.05 0.00 -1.18 0.00 0.00 61.69 60.62 2cds s THR 43 Cb -0.43 -0.22 0.05 0.00 1.34 0.00 0.00 72.50 73.24 2cds s THR 43 CO 0.47 -0.16 0.26 0.20 -0.54 0.00 0.00 174.62 174.86 2cds s ASN 44 N -0.60 -0.10 0.12 3.99 0.01 -0.90 -4.97 114.94 112.49 2cds s ASN 44 Ca -0.05 0.58 -0.19 0.00 -0.71 0.00 0.00 52.86 52.49 2cds s ASN 44 Cb -0.04 0.53 -0.07 0.00 0.41 0.00 0.00 41.25 42.07 2cds s ASN 44 CO -0.00 -0.19 0.60 -0.60 -1.51 0.00 0.00 177.10 175.40 2cds s ARG 45 N 1.62 4.18 0.22 -0.60 6.06 -1.26 -0.09 118.95 129.09 2cds s ARG 45 Ca -0.06 0.73 0.07 0.00 -2.50 0.00 0.00 55.73 53.96 2cds s ARG 45 Cb -0.11 -3.11 -0.04 0.00 0.06 0.00 0.00 34.95 31.76 2cds s ARG 45 CO -0.09 0.56 0.16 -0.80 -2.50 0.00 0.00 175.30 172.63 2cds s ASN 46 N -1.35 5.45 0.52 -2.12 0.01 0.27 -4.97 114.94 112.76 2cds s ASN 46 Ca 0.34 -0.24 0.22 0.00 -0.71 0.00 0.00 52.86 52.47 2cds s ASN 46 Cb -0.18 -1.38 1.35 0.00 0.41 0.00 0.00 41.25 41.45 2cds s ASN 46 CO 0.20 -0.00 2.05 0.71 -1.51 0.00 0.00 177.10 178.54 2cds h THR 47 N 1.70 0.82 0.00 1.60 1.35 -1.98 0.07 112.91 116.47 2cds h THR 47 Ca -0.48 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 2cds h THR 47 Cb 1.23 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 2cds h THR 47 CO 0.61 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.99 2cds n ASP 48 N -4.43 0.00 0.00 5.36 5.75 -1.26 -4.87 116.55 117.10 2cds n ASP 48 Ca 0.06 -0.93 0.00 0.00 -0.01 0.00 0.00 54.79 53.90 2cds n ASP 48 Cb 0.43 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.52 2cds n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2cds n GLY 49 N 0.74 1.75 3.87 6.12 0.00 0.01 -5.03 105.19 112.65 2cds n GLY 49 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2cds n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cds s SER 50 N -1.65 4.05 0.03 1.61 1.04 -1.26 -4.78 113.70 112.75 2cds s SER 50 Ca 0.00 0.78 0.02 0.00 0.48 0.00 0.00 55.95 57.23 2cds s SER 50 Cb 0.00 -1.26 -0.02 0.00 0.10 0.00 0.00 66.02 64.85 2cds s SER 50 CO 0.00 -2.19 -0.06 -0.89 0.98 0.00 0.00 173.24 171.07 2cds s THR 51 N -3.51 0.45 -0.14 2.02 2.01 -1.26 -0.57 115.64 114.64 2cds s THR 51 Ca 0.64 -0.79 -0.07 0.00 0.31 0.00 0.00 61.69 61.77 2cds s THR 51 Cb -0.11 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.87 2cds s THR 51 CO 0.51 -0.24 0.11 -1.81 -0.69 0.00 0.00 174.62 172.49 2cds s ASP 52 N -1.12 6.14 0.01 3.53 1.01 0.87 -1.39 116.67 125.71 2cds s ASP 52 Ca -0.07 0.34 0.05 0.00 0.71 0.00 0.00 52.55 53.59 2cds s ASP 52 Cb -0.07 -1.99 -0.02 0.00 1.01 0.00 0.00 42.92 41.85 2cds s ASP 52 CO 0.00 0.34 -0.17 -0.31 0.21 0.00 0.00 175.17 175.24 2cds s TYR 53 N -0.60 1.49 0.00 4.23 1.51 0.57 -2.11 117.35 122.44 2cds s TYR 53 Ca 0.12 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 2cds s TYR 53 Cb -0.12 -0.93 0.00 0.00 -0.11 0.00 0.00 41.96 40.80 2cds s TYR 53 CO 0.02 0.01 0.00 0.41 -1.11 0.00 0.00 175.55 174.88 2cds n GLY 54 N 2.37 -2.27 0.28 0.71 0.00 -0.59 -0.94 105.19 104.75 2cds n GLY 54 Ca -0.16 -1.55 0.11 0.00 0.00 0.00 0.00 46.02 44.42 2cds n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2cds h ILE 55 N 0.00 0.87 -0.34 -0.61 2.10 -1.70 -1.43 117.51 116.40 2cds h ILE 55 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 2cds h ILE 55 Cb 0.00 0.96 0.00 0.00 -1.09 0.00 0.00 36.82 36.69 2cds h ILE 55 CO 0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.15 177.25 2cds n LEU 56 N -4.38 3.15 -3.88 2.19 4.77 -1.26 -3.89 117.00 113.70 2cds n LEU 56 Ca -0.01 -2.21 -0.36 0.00 -0.03 0.00 0.00 56.01 53.40 2cds n LEU 56 Cb 0.17 -0.30 0.02 0.00 -2.33 0.00 0.00 43.42 40.98 2cds n LEU 56 CO 0.33 0.72 -0.14 0.00 -1.33 0.00 0.00 177.39 176.97 2cds n GLN 57 N 0.32 -1.10 -2.59 3.23 1.13 -0.54 -4.91 117.38 112.93 2cds n GLN 57 Ca 0.14 0.30 -0.41 0.00 -1.94 0.00 0.00 57.00 55.08 2cds n GLN 57 Cb 0.53 -3.59 -0.04 0.00 0.11 0.00 0.00 30.24 27.25 2cds n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2cds s ILE 58 N -3.58 4.24 0.12 5.09 1.01 -0.12 -4.34 121.20 123.61 2cds s ILE 58 Ca 0.41 1.78 -0.27 0.00 0.00 0.00 0.00 60.65 62.57 2cds s ILE 58 Cb -0.18 -4.14 -0.07 0.00 0.01 0.00 0.00 42.46 38.08 2cds s ILE 58 CO 0.91 0.24 0.86 0.21 0.00 0.00 0.00 174.94 177.16 2cds s ASN 59 N 0.32 7.40 0.00 3.58 3.84 -1.26 -0.31 114.94 128.50 2cds s ASN 59 Ca 0.51 1.67 0.23 0.00 0.21 0.00 0.00 52.86 55.47 2cds s ASN 59 Cb -0.26 -2.53 0.98 0.00 -0.55 0.00 0.00 41.25 38.89 2cds s ASN 59 CO 0.31 0.04 1.73 -1.54 -2.79 0.00 0.00 177.10 174.86 2cds n SER 60 N 2.39 0.00 0.16 -4.21 3.41 -0.49 -2.05 113.62 112.84 2cds n SER 60 Ca -0.01 0.47 0.02 0.00 -0.26 0.00 0.00 58.87 59.08 2cds n SER 60 Cb 0.49 -0.49 0.26 0.00 -0.26 0.00 0.00 64.21 64.21 2cds n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2cds h ARG 61 N 0.00 0.00 0.00 4.33 2.43 -1.84 -3.40 114.38 115.90 2cds h ARG 61 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2cds h ARG 61 Cb 0.38 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 2cds h ARG 61 CO 0.00 0.49 -0.70 0.91 -1.51 0.00 0.00 179.97 179.16 2cds n TRP 62 N -3.69 0.00 -0.07 2.20 7.02 -1.22 -0.45 117.44 121.23 2cds n TRP 62 Ca -0.01 0.00 -0.07 0.00 -1.02 0.00 0.00 57.50 56.41 2cds n TRP 62 Cb 0.55 0.00 -0.15 0.00 -2.42 0.00 0.00 31.31 29.29 2cds n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2cds n TRP 63 N -1.88 0.25 -4.07 -5.99 7.02 -0.87 -0.97 117.44 110.93 2cds n TRP 63 Ca 0.00 0.09 -0.10 0.00 -1.02 0.00 0.00 57.50 56.47 2cds n TRP 63 Cb 0.35 -0.99 -0.09 0.00 -2.42 0.00 0.00 31.31 28.17 2cds n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2cds s ASN 65 N -3.02 5.13 0.00 0.00 2.47 -0.61 -4.56 114.94 114.34 2cds s ASN 65 Ca 0.22 -0.13 0.01 0.00 0.42 0.00 0.00 52.86 53.38 2cds s ASN 65 Cb 0.06 -1.89 0.02 0.00 -1.45 0.00 0.00 41.25 37.99 2cds s ASN 65 CO 0.02 0.06 0.94 -0.90 -3.72 0.00 0.00 177.10 173.50 2cds n ASP 66 N 4.26 1.91 0.00 -4.21 5.68 -1.26 -0.97 116.55 121.96 2cds n ASP 66 Ca -0.17 -1.83 0.00 0.00 -0.50 0.00 0.00 54.79 52.29 2cds n ASP 66 Cb 0.52 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 2cds n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2cds n GLY 67 N -0.32 0.20 1.13 6.12 0.00 -1.26 -4.80 105.19 106.25 2cds n GLY 67 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.05 2cds n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2cds n ARG 68 N -0.56 0.00 -3.84 1.61 1.85 -1.26 -4.97 116.66 109.49 2cds n ARG 68 Ca 0.00 -1.53 -0.30 0.00 -1.00 0.00 0.00 57.85 55.03 2cds n ARG 68 Cb 0.30 -0.09 -0.14 0.00 -1.05 0.00 0.00 32.46 31.49 2cds n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2cds s THR 69 N 0.00 1.98 0.11 8.89 2.01 -1.26 -4.87 115.64 122.50 2cds s THR 69 Ca 0.20 -2.88 -0.36 0.00 0.31 0.00 0.00 61.69 58.96 2cds s THR 69 Cb 0.22 -2.39 -0.16 0.00 0.01 0.00 0.00 72.50 70.18 2cds s THR 69 CO -0.10 -0.83 1.35 -2.65 -0.69 0.00 0.00 174.62 171.70 2cds n PRO 70 N 3.40 1.30 -3.50 4.92 -0.02 -1.26 -2.61 135.00 137.23 2cds n PRO 70 Ca 0.06 0.47 -0.26 0.00 -2.02 0.00 0.00 63.50 61.75 2cds n PRO 70 Cb 0.34 -2.11 0.03 0.00 -0.02 0.00 0.00 33.50 31.75 2cds n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cds n GLY 71 N 2.55 -0.51 3.95 -1.23 0.00 -1.26 -4.99 105.19 103.69 2cds n GLY 71 Ca 0.18 0.17 -0.20 0.00 0.00 0.00 0.00 46.02 46.17 2cds n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cds s SER 72 N -3.03 5.72 0.34 1.61 1.04 -1.07 -5.07 113.70 113.23 2cds s SER 72 Ca 0.50 -0.31 0.07 0.00 0.48 0.00 0.00 55.95 56.69 2cds s SER 72 Cb -0.24 -1.09 -0.02 0.00 0.10 0.00 0.00 66.02 64.76 2cds s SER 72 CO 0.62 -0.44 0.33 -0.13 0.98 0.00 0.00 173.24 174.60 2cds s ARG 73 N -4.13 2.80 -0.48 4.02 0.52 0.40 -4.97 118.95 117.11 2cds s ARG 73 Ca 0.45 -1.24 0.08 0.00 -0.52 0.00 0.00 55.73 54.49 2cds s ARG 73 Cb -0.08 -2.54 0.31 0.00 0.52 0.00 0.00 34.95 33.16 2cds s ARG 73 CO 0.30 0.08 0.76 -1.71 0.02 0.00 0.00 175.30 174.75 2cds n ASN 74 N -1.43 2.25 0.14 0.23 5.15 -1.21 -3.67 115.26 116.73 2cds n ASN 74 Ca -0.01 -3.22 0.13 0.00 -0.60 0.00 0.00 54.58 50.87 2cds n ASN 74 Cb 0.59 -0.61 0.64 0.00 -0.53 0.00 0.00 39.78 39.87 2cds n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2cds h LEU 75 N 3.36 0.03 -0.63 1.20 3.38 -1.11 -0.16 115.31 121.38 2cds h LEU 75 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2cds h LEU 75 Cb 0.77 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2cds h LEU 75 CO 0.64 0.02 -0.11 0.00 0.09 0.00 0.00 178.44 179.08 2cds n ASN 77 N -0.35 -4.73 -3.57 0.00 3.02 -0.07 -5.00 115.26 104.56 2cds n ASN 77 Ca 0.16 -0.98 -0.14 0.00 -0.03 0.00 0.00 54.58 53.58 2cds n ASN 77 Cb 0.33 -3.52 -0.05 0.00 -0.61 0.00 0.00 39.78 35.93 2cds n ASN 77 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2cds s ILE 78 N -3.51 0.03 0.29 2.41 -4.36 -1.26 -5.08 121.20 109.71 2cds s ILE 78 Ca 0.41 -0.22 -0.29 0.00 -0.26 0.00 0.00 60.65 60.29 2cds s ILE 78 Cb -0.14 -0.96 -0.09 0.00 1.25 0.00 0.00 42.46 42.51 2cds s ILE 78 CO 0.85 -0.12 1.05 -2.16 0.24 0.00 0.00 174.94 174.80 2cds s PRO 79 N -2.30 4.61 0.54 0.37 0.04 -1.26 -1.58 135.00 135.42 2cds s PRO 79 Ca -0.06 1.67 0.25 0.00 0.04 0.00 0.00 61.00 62.90 2cds s PRO 79 Cb -0.01 -3.09 1.42 0.00 0.04 0.00 0.00 34.50 32.86 2cds s PRO 79 CO -0.01 0.23 2.02 0.00 0.04 0.00 0.00 177.00 179.28 2cds h SER 81 N 0.00 0.00 0.48 0.00 4.64 -1.91 -0.74 113.55 116.02 2cds h SER 81 Ca 0.20 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.51 2cds h SER 81 Cb 0.84 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2cds h SER 81 CO -0.00 0.05 -0.06 0.00 -0.87 0.00 0.00 176.83 175.95 2cds h ALA 82 N 1.95 1.12 -0.00 5.18 0.00 -1.59 -2.08 119.26 123.83 2cds h ALA 82 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2cds h ALA 82 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2cds h ALA 82 CO 0.01 0.07 -0.01 1.28 0.00 0.00 0.00 179.25 180.60 2cds n LEU 83 N -3.33 0.05 -0.72 0.00 4.77 -0.28 -3.29 117.00 114.20 2cds n LEU 83 Ca -0.01 0.15 0.10 0.00 -0.03 0.00 0.00 56.01 56.22 2cds n LEU 83 Cb 0.22 -0.17 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 2cds n LEU 83 CO 0.27 0.01 0.50 0.18 -1.33 0.00 0.00 177.39 177.02 2cds n LEU 84 N -1.14 2.48 -4.71 2.23 4.77 -0.78 -3.94 117.00 115.91 2cds n LEU 84 Ca 0.18 -0.94 -0.32 0.00 -0.03 0.00 0.00 56.01 54.89 2cds n LEU 84 Cb 0.20 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.41 2cds n LEU 84 CO 0.21 0.43 0.73 -0.55 -1.33 0.00 0.00 177.39 176.89 2cds s SER 85 N -1.82 3.73 0.29 -1.43 0.15 -1.21 -4.18 113.70 109.23 2cds s SER 85 Ca 0.22 2.21 0.26 0.00 0.70 0.00 0.00 55.95 59.33 2cds s SER 85 Cb 0.17 -2.57 0.90 0.00 -1.71 0.00 0.00 66.02 62.80 2cds s SER 85 CO 0.31 -2.57 1.76 0.77 1.20 0.00 0.00 173.24 174.71 2cds h SER 86 N -1.06 0.00 -3.57 5.45 4.64 -1.93 -3.40 113.55 113.68 2cds h SER 86 Ca -0.45 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.24 2cds h SER 86 Cb 1.27 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.23 2cds h SER 86 CO 0.47 0.00 0.15 -0.62 -0.87 0.00 0.00 176.83 175.95 2cds s ASP 87 N -4.69 6.42 0.00 4.97 -1.08 -1.26 -4.95 116.67 116.08 2cds s ASP 87 Ca 0.07 0.11 0.30 0.00 -0.52 0.00 0.00 52.55 52.51 2cds s ASP 87 Cb 0.10 -2.33 1.75 0.00 -1.46 0.00 0.00 42.92 40.98 2cds s ASP 87 CO 0.52 -0.61 2.09 2.30 0.52 0.00 0.00 175.17 179.99 2cds n ILE 88 N 5.61 0.01 -0.21 4.11 -5.35 -1.26 -4.33 119.36 117.94 2cds n ILE 88 Ca -0.01 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.45 2cds n ILE 88 Cb 0.48 -0.54 0.04 0.00 -1.74 0.00 0.00 39.64 37.89 2cds n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2cds h THR 89 N 0.00 0.27 -0.59 7.28 2.02 -1.94 0.20 112.91 120.15 2cds h THR 89 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2cds h THR 89 Cb 0.02 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 66.67 2cds h THR 89 CO 0.00 0.00 0.34 0.00 0.37 0.00 0.00 175.52 176.23 2cds h ALA 90 N 1.36 0.75 -0.49 6.16 0.00 -1.86 -0.08 119.26 125.09 2cds h ALA 90 Ca 0.28 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2cds h ALA 90 Cb 0.51 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2cds h ALA 90 CO -0.67 0.24 0.30 0.77 0.00 0.00 0.00 179.25 179.89 2cds h SER 91 N 0.79 0.59 -0.17 0.00 0.02 -1.60 -1.70 113.55 111.47 2cds h SER 91 Ca 0.21 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 2cds h SER 91 Cb 0.00 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 2cds h SER 91 CO -0.04 0.47 0.07 0.58 -1.14 0.00 0.00 176.83 176.78 2cds h VAL 92 N 0.66 1.15 -1.01 2.27 2.07 -0.57 0.06 116.25 120.88 2cds h VAL 92 Ca 0.18 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 67.27 2cds h VAL 92 Cb -0.01 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 2cds h VAL 92 CO -0.03 0.14 0.67 0.78 0.02 0.00 0.00 177.57 179.15 2cds h ASN 93 N 0.13 1.13 -0.28 0.57 -0.26 -0.88 -1.23 115.58 114.76 2cds h ASN 93 Ca 0.06 -0.02 -0.19 0.00 -0.56 0.00 0.00 56.30 55.59 2cds h ASN 93 Cb 0.16 -0.27 0.00 0.00 -1.06 0.00 0.00 38.32 37.15 2cds h ASN 93 CO -0.01 0.80 -0.55 0.00 -1.06 0.00 0.00 177.43 176.61 2cds h ALA 95 N 0.69 1.44 -0.55 0.00 0.00 -0.46 -1.07 119.26 119.30 2cds h ALA 95 Ca 0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2cds h ALA 95 Cb 1.16 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 2cds h ALA 95 CO 0.12 0.49 0.26 0.87 0.00 0.00 0.00 179.25 180.99 2cds h LYS 96 N 1.11 0.77 -0.19 0.00 1.57 -1.14 0.33 116.57 119.02 2cds h LYS 96 Ca 0.34 -0.09 -0.21 0.00 -1.87 0.00 0.00 60.65 58.82 2cds h LYS 96 Cb -0.01 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 32.16 2cds h LYS 96 CO -0.10 0.60 -0.70 0.87 -0.57 0.00 0.00 179.45 179.55 2cds h LYS 97 N 0.77 0.82 0.10 3.15 1.57 -1.19 -2.77 116.57 119.02 2cds h LYS 97 Ca 0.19 -0.62 -0.01 0.00 -1.87 0.00 0.00 60.65 58.35 2cds h LYS 97 Cb 0.08 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2cds h LYS 97 CO -0.03 1.23 -0.05 0.82 -0.57 0.00 0.00 179.45 180.86 2cds h ILE 98 N 0.57 0.96 0.00 1.86 2.04 -0.65 -2.86 117.51 119.43 2cds h ILE 98 Ca -0.03 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.59 2cds h ILE 98 Cb 1.33 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 2cds h ILE 98 CO 0.15 0.06 0.00 1.62 0.00 0.00 0.00 178.15 179.98 2cds h VAL 99 N -0.25 0.00 0.00 1.67 3.04 -1.02 -1.64 116.25 118.06 2cds h VAL 99 Ca -0.01 -0.31 0.00 0.00 -1.01 0.00 0.00 66.70 65.36 2cds h VAL 99 Cb 0.20 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 30.66 2cds h VAL 99 CO 0.02 0.00 0.00 -1.20 -1.01 0.00 0.00 177.57 175.38 2cds n SER 100 N -2.72 0.11 -4.80 3.17 7.64 -1.05 -3.87 113.62 112.10 2cds n SER 100 Ca 0.01 0.51 -0.34 0.00 1.01 0.00 0.00 58.87 60.06 2cds n SER 100 Cb 0.23 -0.54 -0.04 0.00 -1.01 0.00 0.00 64.21 62.84 2cds n SER 100 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2cds s ASP 101 N -3.21 6.57 0.42 6.43 -1.08 -0.62 -4.90 116.67 120.28 2cds s ASP 101 Ca 0.13 1.89 0.34 0.00 -0.52 0.00 0.00 52.55 54.38 2cds s ASP 101 Cb 0.17 -2.56 1.16 0.00 -1.46 0.00 0.00 42.92 40.23 2cds s ASP 101 CO 0.51 -0.62 1.12 0.61 0.52 0.00 0.00 175.17 177.31 2cds n GLY 102 N -0.24 -0.70 0.63 2.66 0.00 -1.26 -1.18 105.19 105.10 2cds n GLY 102 Ca 0.08 0.46 0.13 0.00 0.00 0.00 0.00 46.02 46.69 2cds n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2cds n ASN 103 N -3.28 1.99 0.00 1.61 3.02 -1.26 -5.05 115.26 112.29 2cds n ASN 103 Ca 0.30 -1.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.22 2cds n ASN 103 Cb 1.43 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 40.62 2cds n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cds n GLY 104 N 1.25 1.87 0.00 7.41 0.00 -0.32 -2.27 105.19 113.12 2cds n GLY 104 Ca 0.17 -0.46 0.09 0.00 0.00 0.00 0.00 46.02 45.82 2cds n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2cds n MET 105 N 7.75 0.33 0.00 1.61 2.81 -1.26 -2.50 117.12 125.87 2cds n MET 105 Ca 0.00 0.09 0.06 0.00 -1.81 0.00 0.00 57.70 56.03 2cds n MET 105 Cb 0.00 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.26 2cds n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2cds n ASN 106 N -1.21 0.00 0.27 7.83 4.13 -0.96 -1.70 115.26 123.62 2cds n ASN 106 Ca 0.10 0.47 0.14 0.00 1.68 0.00 0.00 54.58 56.97 2cds n ASN 106 Cb 0.12 -0.49 0.75 0.00 -1.54 0.00 0.00 39.78 38.62 2cds n ASN 106 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2cds h ALA 107 N 2.40 1.22 -2.55 5.41 0.00 -1.65 -3.39 119.26 120.70 2cds h ALA 107 Ca 0.00 -0.09 -0.71 0.00 0.00 0.00 0.00 54.91 54.11 2cds h ALA 107 Cb 0.19 -0.02 -0.20 0.00 0.00 0.00 0.00 17.79 17.76 2cds h ALA 107 CO 0.00 0.13 -0.44 -1.58 0.00 0.00 0.00 179.25 177.36 2cds s TRP 108 N -4.11 3.24 0.31 0.00 0.51 -0.69 -4.96 118.94 113.23 2cds s TRP 108 Ca -0.02 -0.49 0.02 0.00 -2.12 0.00 0.00 56.10 53.49 2cds s TRP 108 Cb 0.13 -2.57 0.57 0.00 -0.81 0.00 0.00 33.47 30.79 2cds s TRP 108 CO 0.57 -0.53 1.90 -0.39 -0.51 0.00 0.00 176.95 177.98 2cds h VAL 109 N 5.60 1.02 -0.58 4.03 -1.51 -1.86 -1.66 116.25 121.29 2cds h VAL 109 Ca -0.28 -0.34 -0.07 0.00 -1.23 0.00 0.00 66.70 64.78 2cds h VAL 109 Cb 1.13 -0.05 -0.02 0.00 -2.13 0.00 0.00 31.29 30.22 2cds h VAL 109 CO 0.71 0.18 0.08 0.00 -1.23 0.00 0.00 177.57 177.31 2cds h ALA 110 N 1.53 1.04 -0.20 5.19 0.00 -1.93 -1.08 119.26 123.82 2cds h ALA 110 Ca 0.41 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 2cds h ALA 110 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2cds h ALA 110 CO -0.17 0.61 0.00 2.35 0.00 0.00 0.00 179.25 182.05 2cds h TRP 111 N 0.89 0.37 -0.61 0.00 7.01 -1.64 0.19 115.95 122.17 2cds h TRP 111 Ca 0.18 -0.06 -0.01 0.00 2.11 0.00 0.00 58.89 61.10 2cds h TRP 111 Cb 0.41 -0.10 -0.03 0.00 -2.10 0.00 0.00 29.16 27.35 2cds h TRP 111 CO 0.03 0.54 0.33 -0.09 -2.79 0.00 0.00 178.44 176.46 2cds h ARG 112 N 0.10 0.85 0.00 2.65 2.43 -1.18 0.40 114.38 119.64 2cds h ARG 112 Ca 0.06 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2cds h ARG 112 Cb 0.38 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 2cds h ARG 112 CO 0.01 0.65 -0.86 -0.91 -1.51 0.00 0.00 179.97 177.35 2cds h ASN 113 N 0.83 0.00 0.00 -3.80 2.35 -1.16 -3.38 115.58 110.42 2cds h ASN 113 Ca 0.21 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2cds h ASN 113 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 2cds h ASN 113 CO -0.03 0.04 0.00 0.54 -1.65 0.00 0.00 177.43 176.32 2cds n ARG 114 N -2.52 3.85 -0.01 0.81 1.74 0.66 -4.91 116.66 116.29 2cds n ARG 114 Ca 0.01 -0.04 -0.02 0.00 -0.77 0.00 0.00 57.85 57.03 2cds n ARG 114 Cb 0.51 -0.38 -0.01 0.00 -1.02 0.00 0.00 32.46 31.56 2cds n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cds n LYS 116 N -2.92 1.29 -1.04 0.00 4.81 0.12 -1.19 118.16 119.23 2cds n LYS 116 Ca -0.03 0.47 -0.01 0.00 -0.87 0.00 0.00 58.31 57.86 2cds n LYS 116 Cb 0.52 -2.14 -0.01 0.00 0.02 0.00 0.00 35.03 33.43 2cds n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2cds n GLY 117 N 2.95 0.50 3.81 3.14 0.00 -1.26 -4.95 105.19 109.39 2cds n GLY 117 Ca 0.20 -0.28 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 2cds n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cds s THR 118 N -1.91 1.78 -1.35 2.61 -4.23 -0.33 -5.01 115.64 107.20 2cds s THR 118 Ca 0.00 -1.68 -0.16 0.00 -1.18 0.00 0.00 61.69 58.68 2cds s THR 118 Cb 0.00 -2.46 0.07 0.00 1.34 0.00 0.00 72.50 71.45 2cds s THR 118 CO 0.00 0.00 1.89 -0.67 -0.54 0.00 0.00 174.62 175.30 2cds n ASP 119 N -1.46 4.61 0.29 3.99 2.03 -1.26 -4.78 116.55 119.97 2cds n ASP 119 Ca -0.05 -2.91 0.17 0.00 0.52 0.00 0.00 54.79 52.51 2cds n ASP 119 Cb 0.65 -1.69 0.96 0.00 -0.72 0.00 0.00 41.12 40.31 2cds n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2cds h VAL 120 N 4.87 0.43 0.00 5.18 -1.51 -1.90 -1.98 116.25 121.34 2cds h VAL 120 Ca 0.48 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.93 2cds h VAL 120 Cb 0.78 0.98 -0.00 0.00 -2.13 0.00 0.00 31.29 30.92 2cds h VAL 120 CO 1.60 0.00 -0.07 1.56 -1.23 0.00 0.00 177.57 179.43 2cds h GLN 121 N 0.00 0.00 -0.21 5.19 4.20 -1.86 -1.06 115.11 121.36 2cds h GLN 121 Ca 0.01 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.78 2cds h GLN 121 Cb 0.06 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2cds h GLN 121 CO -0.00 0.07 0.30 0.00 -0.67 0.00 0.00 178.83 178.53 2cds h ALA 122 N 1.93 1.77 0.00 3.87 0.00 -1.75 -0.68 119.26 124.40 2cds h ALA 122 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2cds h ALA 122 Cb 0.15 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2cds h ALA 122 CO 0.01 -0.41 0.00 -1.49 0.00 0.00 0.00 179.25 177.36 2cds h TRP 123 N 0.00 0.00 -0.00 0.00 4.06 -1.40 -3.21 115.95 115.40 2cds h TRP 123 Ca 0.10 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.05 2cds h TRP 123 Cb 0.69 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.85 2cds h TRP 123 CO 0.00 0.00 0.00 0.44 -3.56 0.00 0.00 178.44 175.32 2cds n ILE 124 N -2.56 0.17 -2.10 1.49 -5.35 -0.28 -4.82 119.36 105.90 2cds n ILE 124 Ca 0.02 -0.59 -0.39 0.00 -0.27 0.00 0.00 62.75 61.52 2cds n ILE 124 Cb 0.30 0.92 -0.01 0.00 -1.74 0.00 0.00 39.64 39.11 2cds n ILE 124 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2cds s ARG 125 N -0.20 4.05 0.00 6.28 0.52 -1.08 -2.40 118.95 126.12 2cds s ARG 125 Ca 0.01 2.11 0.00 0.00 -0.52 0.00 0.00 55.73 57.33 2cds s ARG 125 Cb 0.00 -2.80 0.00 0.00 0.52 0.00 0.00 34.95 32.68 2cds s ARG 125 CO 0.01 -0.41 0.00 0.41 0.02 0.00 0.00 175.30 175.32 2cds n GLY 126 N 0.69 1.75 3.86 -3.53 0.00 -1.26 -5.03 105.19 101.67 2cds n GLY 126 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 2cds n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cds s ARG 128 N -2.51 3.11 0.00 0.00 3.52 -1.26 -5.13 118.95 116.68 2cds s ARG 128 Ca 0.45 -0.97 0.00 0.00 -0.13 0.00 0.00 55.73 55.08 2cds s ARG 128 Cb -0.13 -4.15 0.00 0.00 -1.56 0.00 0.00 34.95 29.11 2cds s ARG 128 CO 0.20 -1.38 0.25 1.28 -0.81 0.00 0.00 175.30 174.85