#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2blx s VAL 2 N 0.00 4.84 0.43 3.15 1.01 -1.26 -0.62 120.40 127.95 2blx s VAL 2 Ca 0.00 -0.49 -0.22 0.00 0.00 0.00 0.00 61.98 61.26 2blx s VAL 2 Cb 0.00 -3.55 -0.09 0.00 0.00 0.00 0.00 36.38 32.74 2blx s VAL 2 CO 0.00 -0.06 1.02 -0.36 0.00 0.00 0.00 175.10 175.69 2blx s PHE 3 N 1.64 3.22 0.71 5.22 0.40 -0.27 -5.00 117.98 123.89 2blx s PHE 3 Ca 0.04 1.63 -0.11 0.00 -0.60 0.00 0.00 56.93 57.89 2blx s PHE 3 Cb -0.18 -3.04 0.02 0.00 0.51 0.00 0.00 43.02 40.34 2blx s PHE 3 CO 0.08 -0.53 1.07 0.20 0.70 0.00 0.00 175.22 176.74 2blx s GLY 4 N -1.83 1.72 0.09 4.36 0.00 -1.26 -4.84 107.32 105.56 2blx s GLY 4 Ca 0.61 0.18 -0.27 0.00 0.00 0.00 0.00 44.72 45.24 2blx s GLY 4 CO 0.22 0.50 1.67 -0.09 0.00 0.00 0.00 173.10 175.40 2blx h ARG 5 N -0.75 -0.44 -0.04 2.90 2.43 -1.97 0.58 114.38 117.10 2blx h ARG 5 Ca -0.44 0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.63 2blx h ARG 5 Cb 1.22 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.85 2blx h ARG 5 CO 0.55 -0.29 -0.57 0.00 -1.51 0.00 0.00 179.97 178.14 2blx h GLU 7 N 0.09 0.49 -0.47 0.00 4.81 -1.90 -0.50 114.58 117.09 2blx h GLU 7 Ca -0.00 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 2blx h GLU 7 Cb 1.03 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 2blx h GLU 7 CO 0.08 0.33 -0.10 1.25 -0.73 0.00 0.00 179.01 179.84 2blx h LEU 8 N 0.51 0.90 -0.53 1.64 5.85 -0.62 -1.94 115.31 121.12 2blx h LEU 8 Ca 0.14 -0.36 0.10 0.00 0.84 0.00 0.00 57.88 58.60 2blx h LEU 8 Cb -0.06 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 40.65 2blx h LEU 8 CO -0.03 1.05 0.07 0.00 -0.34 0.00 0.00 178.44 179.19 2blx h ALA 9 N 0.88 0.57 -0.58 1.25 0.00 -0.93 0.82 119.26 121.27 2blx h ALA 9 Ca 0.12 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 2blx h ALA 9 Cb 0.65 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2blx h ALA 9 CO 0.04 -0.34 0.10 0.00 0.00 0.00 0.00 179.25 179.06 2blx h ALA 10 N 1.43 0.77 -0.45 0.00 0.00 -0.92 -0.82 119.26 119.27 2blx h ALA 10 Ca 0.27 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2blx h ALA 10 Cb 0.39 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2blx h ALA 10 CO -0.38 0.51 0.07 0.00 0.00 0.00 0.00 179.25 179.45 2blx h ALA 11 N 1.01 0.60 -0.75 0.00 0.00 -0.88 -0.83 119.26 118.41 2blx h ALA 11 Ca 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2blx h ALA 11 Cb 0.41 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2blx h ALA 11 CO 0.01 0.33 0.43 0.52 0.00 0.00 0.00 179.25 180.54 2blx h MET 12 N 0.61 1.03 -0.40 0.00 2.86 -0.66 -2.31 114.93 116.07 2blx h MET 12 Ca 0.14 -0.11 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 2blx h MET 12 Cb 0.39 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 2blx h MET 12 CO 0.01 0.75 0.02 -0.22 1.06 0.00 0.00 176.91 178.52 2blx h LYS 13 N 1.03 0.69 -0.20 1.72 3.64 -0.98 -1.18 116.57 121.28 2blx h LYS 13 Ca 0.27 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2blx h LYS 13 Cb -0.00 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2blx h LYS 13 CO -0.05 0.77 0.09 -0.09 -2.27 0.00 0.00 179.45 177.90 2blx h ARG 14 N 0.52 0.28 -0.09 1.90 2.43 -0.98 -0.57 114.38 117.87 2blx h ARG 14 Ca 0.11 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2blx h ARG 14 Cb 0.45 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2blx h ARG 14 CO 0.02 0.23 0.00 0.72 -1.51 0.00 0.00 179.97 179.43 2blx n HIS 15 N -4.46 0.12 -1.68 2.20 8.25 -0.88 -4.92 115.22 113.84 2blx n HIS 15 Ca 0.00 -0.06 -0.04 0.00 -0.26 0.00 0.00 57.72 57.37 2blx n HIS 15 Cb 0.11 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.22 2blx n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2blx n GLY 16 N 0.96 0.40 0.11 -1.41 0.00 -0.22 -4.94 105.19 100.09 2blx n GLY 16 Ca 0.15 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2blx n GLY 16 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2blx h LEU 17 N 0.00 0.00 -9.41 0.99 5.85 -1.42 -3.41 115.31 107.91 2blx h LEU 17 Ca -0.08 0.00 -0.53 0.00 0.84 0.00 0.00 57.88 58.11 2blx h LEU 17 Cb 0.73 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.78 2blx h LEU 17 CO 0.10 0.60 1.12 1.51 -0.34 0.00 0.00 178.44 181.43 2blx s ASP 18 N -6.26 6.52 0.00 1.25 -4.77 -1.26 -1.69 116.67 110.45 2blx s ASP 18 Ca 0.01 2.58 0.00 0.00 -3.30 0.00 0.00 52.55 51.84 2blx s ASP 18 Cb 0.08 -2.55 0.00 0.00 -1.09 0.00 0.00 42.92 39.36 2blx s ASP 18 CO 0.78 -0.98 0.00 0.59 0.70 0.00 0.00 175.17 176.26 2blx n ASN 19 N 6.46 -4.14 -4.69 2.11 3.02 0.18 -4.87 115.26 113.32 2blx n ASN 19 Ca 0.18 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.31 2blx n ASN 19 Cb 0.40 -1.93 -0.03 0.00 -0.61 0.00 0.00 39.78 37.61 2blx n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2blx s TYR 20 N -1.58 2.46 -1.87 3.10 5.04 -0.68 -1.19 117.35 122.63 2blx s TYR 20 Ca 0.00 0.40 0.00 0.00 -2.44 0.00 0.00 57.07 55.03 2blx s TYR 20 Cb 0.00 -3.91 0.00 0.00 0.35 0.00 0.00 41.96 38.40 2blx s TYR 20 CO 0.00 -3.61 0.00 0.54 -1.34 0.00 0.00 175.55 171.14 2blx n ARG 21 N 5.67 -1.64 -0.81 4.97 5.12 -1.26 -1.81 116.66 126.90 2blx n ARG 21 Ca 0.15 1.05 0.00 0.00 -1.93 0.00 0.00 57.85 57.13 2blx n ARG 21 Cb 0.41 -5.64 0.00 0.00 -1.16 0.00 0.00 32.46 26.07 2blx n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2blx n GLY 22 N -0.84 0.74 3.48 -0.13 0.00 -0.33 -5.02 105.19 103.08 2blx n GLY 22 Ca -0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.36 2blx n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2blx s TYR 23 N -2.74 3.22 0.90 1.61 2.02 -0.75 -4.90 117.35 116.72 2blx s TYR 23 Ca 0.00 -0.47 -0.10 0.00 -0.37 0.00 0.00 57.07 56.13 2blx s TYR 23 Cb 0.00 -2.65 0.14 0.00 -0.40 0.00 0.00 41.96 39.04 2blx s TYR 23 CO 0.00 -0.58 1.14 -1.54 -1.57 0.00 0.00 175.55 173.00 2blx s SER 24 N 1.72 3.06 0.25 2.29 1.04 -1.26 -0.65 113.70 120.15 2blx s SER 24 Ca 0.07 2.17 -0.03 0.00 0.48 0.00 0.00 55.95 58.64 2blx s SER 24 Cb -0.18 -2.56 0.49 0.00 0.10 0.00 0.00 66.02 63.87 2blx s SER 24 CO 0.11 -3.01 1.75 0.25 0.98 0.00 0.00 173.24 173.32 2blx h LEU 25 N -1.79 0.43 -1.75 2.42 5.85 -1.89 -0.37 115.31 118.21 2blx h LEU 25 Ca -0.43 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.41 2blx h LEU 25 Cb 1.27 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.32 2blx h LEU 25 CO 0.42 0.18 0.21 1.23 -0.34 0.00 0.00 178.44 180.14 2blx h GLY 26 N 0.55 0.37 0.80 3.75 0.00 -1.91 -1.56 103.07 105.09 2blx h GLY 26 Ca 0.44 -0.13 0.04 0.00 0.00 0.00 0.00 47.33 47.68 2blx h GLY 26 CO -0.37 0.12 0.48 3.43 0.00 0.00 0.00 176.54 180.20 2blx h ASN 27 N 0.34 0.77 -0.25 0.19 2.35 -1.28 -0.03 115.58 117.68 2blx h ASN 27 Ca 0.12 0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.73 2blx h ASN 27 Cb 0.08 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.30 2blx h ASN 27 CO -0.03 0.52 -0.44 -0.50 -1.65 0.00 0.00 177.43 175.34 2blx h TRP 28 N 0.91 0.91 -0.42 1.19 4.06 -1.33 -0.78 115.95 120.51 2blx h TRP 28 Ca 0.32 -0.32 -0.04 0.00 2.06 0.00 0.00 58.89 60.92 2blx h TRP 28 Cb 0.08 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 28.05 2blx h TRP 28 CO -0.04 1.11 0.12 0.28 -3.56 0.00 0.00 178.44 176.35 2blx h VAL 29 N 0.46 1.22 -0.59 1.49 2.07 -1.27 -1.20 116.25 118.44 2blx h VAL 29 Ca 0.02 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 2blx h VAL 29 Cb 1.04 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 2blx h VAL 29 CO 0.10 0.26 0.27 0.00 0.02 0.00 0.00 177.57 178.22 2blx h ALA 31 N 1.11 0.32 -0.74 0.00 0.00 -0.99 -2.07 119.26 116.89 2blx h ALA 31 Ca 0.20 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2blx h ALA 31 Cb 0.14 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2blx h ALA 31 CO -0.02 -0.35 0.38 0.00 0.00 0.00 0.00 179.25 179.26 2blx h ALA 32 N 1.22 1.28 -0.01 0.00 0.00 -0.87 0.30 119.26 121.17 2blx h ALA 32 Ca 0.14 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2blx h ALA 32 Cb 0.15 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2blx h ALA 32 CO -0.18 0.57 -0.11 -0.22 0.00 0.00 0.00 179.25 179.31 2blx h LYS 33 N 1.04 -0.18 0.00 0.00 1.63 -0.56 -0.94 116.57 117.56 2blx h LYS 33 Ca 0.26 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.07 2blx h LYS 33 Cb 0.06 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 2blx h LYS 33 CO -0.04 -0.12 -0.31 0.74 -3.45 0.00 0.00 179.45 176.28 2blx h PHE 34 N -0.19 0.00 0.24 1.91 0.04 -1.16 0.78 116.94 118.56 2blx h PHE 34 Ca 0.04 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.47 2blx h PHE 34 Cb 0.25 0.00 0.03 0.00 2.20 0.00 0.00 35.95 38.43 2blx h PHE 34 CO -0.18 0.00 -1.55 0.93 -0.60 0.00 0.00 178.31 176.92 2blx h GLU 35 N 0.00 0.51 0.00 1.51 4.39 -0.85 -3.43 114.58 116.71 2blx h GLU 35 Ca 0.00 -0.88 0.00 0.00 0.34 0.00 0.00 59.36 58.82 2blx h GLU 35 Cb 0.89 0.33 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 2blx h GLU 35 CO 0.00 1.42 0.00 -1.13 -1.16 0.00 0.00 179.01 178.14 2blx n SER 36 N -3.70 0.09 -3.00 1.42 3.41 -0.38 -4.84 113.62 106.62 2blx n SER 36 Ca -0.19 -0.50 -0.21 0.00 -0.26 0.00 0.00 58.87 57.71 2blx n SER 36 Cb 1.10 0.12 0.01 0.00 -0.26 0.00 0.00 64.21 65.18 2blx n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2blx n ASN 37 N -0.12 -5.02 -0.61 4.04 5.15 0.27 -2.00 115.26 116.97 2blx n ASN 37 Ca 0.00 -0.23 -0.08 0.00 -0.60 0.00 0.00 54.58 53.67 2blx n ASN 37 Cb 0.09 -4.11 -0.03 0.00 -0.53 0.00 0.00 39.78 35.19 2blx n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2blx n PHE 38 N -4.13 0.00 -3.54 1.20 3.72 -1.19 -4.84 117.46 108.68 2blx n PHE 38 Ca -0.10 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.90 2blx n PHE 38 Cb 0.60 -1.71 -0.11 0.00 -0.94 0.00 0.00 39.48 37.32 2blx n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2blx s ASN 39 N -2.75 6.00 0.55 4.37 2.47 -0.85 -1.12 114.94 123.62 2blx s ASN 39 Ca 0.00 -0.50 0.31 0.00 0.42 0.00 0.00 52.86 53.09 2blx s ASN 39 Cb 0.00 -2.12 1.61 0.00 -1.45 0.00 0.00 41.25 39.29 2blx s ASN 39 CO 0.00 -0.26 2.12 0.71 -3.72 0.00 0.00 177.10 175.95 2blx h THR 40 N 5.53 0.39 -0.12 -5.21 1.35 -1.17 -2.74 112.91 110.95 2blx h THR 40 Ca -0.31 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 2blx h THR 40 Cb 1.15 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 2blx h THR 40 CO 0.64 0.08 0.00 0.00 -0.25 0.00 0.00 175.52 175.99 2blx n GLN 41 N -3.48 1.59 -1.75 4.72 6.02 -1.26 -3.96 117.38 119.26 2blx n GLN 41 Ca -0.02 -0.88 -0.42 0.00 -0.01 0.00 0.00 57.00 55.67 2blx n GLN 41 Cb 0.21 -1.39 -0.02 0.00 1.02 0.00 0.00 30.24 30.07 2blx n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2blx n ALA 42 N 0.10 2.61 -2.87 -1.58 0.00 -1.03 -4.80 120.51 112.93 2blx n ALA 42 Ca 0.16 0.37 -0.12 0.00 0.00 0.00 0.00 53.44 53.86 2blx n ALA 42 Cb 0.29 -2.47 -0.13 0.00 0.00 0.00 0.00 19.45 17.13 2blx n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2blx s THR 43 N 0.08 0.13 -0.11 0.00 -4.23 -1.26 -0.69 115.64 109.56 2blx s THR 43 Ca 0.65 -0.31 -0.07 0.00 -1.18 0.00 0.00 61.69 60.77 2blx s THR 43 Cb -0.49 -0.16 0.04 0.00 1.34 0.00 0.00 72.50 73.23 2blx s THR 43 CO 0.47 -0.12 0.28 0.20 -0.54 0.00 0.00 174.62 174.92 2blx s ASN 44 N -0.45 -0.31 0.18 3.99 -0.87 -0.65 -4.97 114.94 111.86 2blx s ASN 44 Ca -0.04 0.59 -0.30 0.00 -1.57 0.00 0.00 52.86 51.54 2blx s ASN 44 Cb -0.03 0.52 -0.07 0.00 -0.02 0.00 0.00 41.25 41.64 2blx s ASN 44 CO -0.00 -0.14 0.95 -0.60 -2.57 0.00 0.00 177.10 174.74 2blx s ARG 45 N 0.84 4.78 0.41 -0.60 6.06 -1.26 -0.57 118.95 128.62 2blx s ARG 45 Ca -0.06 1.48 0.01 0.00 -2.50 0.00 0.00 55.73 54.66 2blx s ARG 45 Cb -0.07 -3.32 -0.01 0.00 0.06 0.00 0.00 34.95 31.61 2blx s ARG 45 CO -0.06 0.37 0.62 -0.80 -2.50 0.00 0.00 175.30 172.93 2blx s ASN 46 N -0.61 5.95 0.26 -2.12 0.02 0.32 -4.95 114.94 113.81 2blx s ASN 46 Ca 0.44 0.26 -0.02 0.00 -1.02 0.00 0.00 52.86 52.52 2blx s ASN 46 Cb -0.25 -1.60 0.50 0.00 0.02 0.00 0.00 41.25 39.92 2blx s ASN 46 CO 0.31 -0.58 1.77 0.71 0.02 0.00 0.00 177.10 179.33 2blx h THR 47 N 0.54 0.76 0.00 1.60 1.35 -1.97 -1.29 112.91 113.89 2blx h THR 47 Ca -0.47 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 2blx h THR 47 Cb 1.25 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.73 2blx h THR 47 CO 0.58 0.12 0.00 -0.90 -0.25 0.00 0.00 175.52 175.06 2blx n ASP 48 N -4.86 0.00 0.00 5.36 5.75 -1.26 -4.89 116.55 116.66 2blx n ASP 48 Ca 0.16 -0.94 0.00 0.00 -0.01 0.00 0.00 54.79 54.01 2blx n ASP 48 Cb 0.40 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.49 2blx n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2blx n GLY 49 N 0.68 1.15 3.74 6.12 0.00 -0.49 -5.04 105.19 111.34 2blx n GLY 49 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 2blx n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2blx s SER 50 N -2.89 3.08 0.03 1.61 1.04 -1.26 -4.75 113.70 110.55 2blx s SER 50 Ca 0.00 1.05 0.02 0.00 0.48 0.00 0.00 55.95 57.49 2blx s SER 50 Cb 0.00 -1.66 -0.02 0.00 0.10 0.00 0.00 66.02 64.44 2blx s SER 50 CO 0.00 -2.83 -0.06 -0.89 0.98 0.00 0.00 173.24 170.44 2blx s THR 51 N -3.14 0.42 -0.09 2.02 2.01 -1.26 -0.52 115.64 115.08 2blx s THR 51 Ca 0.65 -0.82 -0.03 0.00 0.31 0.00 0.00 61.69 61.79 2blx s THR 51 Cb -0.16 -0.47 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 2blx s THR 51 CO 0.55 -0.28 0.06 -1.81 -0.69 0.00 0.00 174.62 172.45 2blx s ASP 52 N -1.19 5.67 -0.03 3.53 1.01 0.27 -1.01 116.67 124.93 2blx s ASP 52 Ca -0.08 0.26 0.04 0.00 0.71 0.00 0.00 52.55 53.48 2blx s ASP 52 Cb -0.08 -1.69 -0.00 0.00 1.01 0.00 0.00 42.92 42.16 2blx s ASP 52 CO 0.00 0.38 -0.15 -0.31 0.21 0.00 0.00 175.17 175.30 2blx s TYR 53 N -0.96 1.51 0.00 4.23 1.51 -0.08 -1.64 117.35 121.91 2blx s TYR 53 Ca 0.15 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.81 2blx s TYR 53 Cb -0.12 -1.02 0.00 0.00 -0.11 0.00 0.00 41.96 40.72 2blx s TYR 53 CO 0.04 -0.13 0.00 0.41 -1.11 0.00 0.00 175.55 174.76 2blx n GLY 54 N 3.09 -2.04 0.29 0.71 0.00 0.14 -1.62 105.19 105.75 2blx n GLY 54 Ca -0.17 -1.62 0.15 0.00 0.00 0.00 0.00 46.02 44.38 2blx n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2blx h ILE 55 N 0.00 0.49 -0.06 -0.61 2.10 -1.72 -1.71 117.51 116.00 2blx h ILE 55 Ca 0.00 -0.20 0.00 0.00 1.08 0.00 0.00 64.86 65.74 2blx h ILE 55 Cb 0.00 1.13 0.00 0.00 -1.09 0.00 0.00 36.82 36.86 2blx h ILE 55 CO 0.00 0.04 0.00 0.18 -1.08 0.00 0.00 178.15 177.29 2blx n LEU 56 N -3.69 2.51 -3.87 2.19 4.77 -1.26 -4.09 117.00 113.55 2blx n LEU 56 Ca -0.03 -2.73 -0.32 0.00 -0.03 0.00 0.00 56.01 52.91 2blx n LEU 56 Cb 0.14 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 40.92 2blx n LEU 56 CO 0.28 0.65 -0.16 0.00 -1.33 0.00 0.00 177.39 176.83 2blx n GLN 57 N -0.94 -1.76 -2.59 3.23 1.13 -0.64 -4.89 117.38 110.91 2blx n GLN 57 Ca 0.12 0.36 -0.42 0.00 -1.94 0.00 0.00 57.00 55.13 2blx n GLN 57 Cb 0.56 -3.97 -0.04 0.00 0.11 0.00 0.00 30.24 26.90 2blx n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2blx s ILE 58 N -3.69 4.32 -0.08 5.09 1.01 -0.64 -4.33 121.20 122.89 2blx s ILE 58 Ca 0.30 1.79 -0.19 0.00 0.00 0.00 0.00 60.65 62.55 2blx s ILE 58 Cb -0.12 -4.15 -0.05 0.00 0.01 0.00 0.00 42.46 38.16 2blx s ILE 58 CO 0.90 0.21 0.52 0.21 0.00 0.00 0.00 174.94 176.77 2blx s ASN 59 N 0.54 6.79 0.00 3.58 3.84 -1.26 -0.90 114.94 127.52 2blx s ASN 59 Ca 0.52 0.94 0.15 0.00 0.21 0.00 0.00 52.86 54.68 2blx s ASN 59 Cb -0.26 -2.31 0.65 0.00 -0.55 0.00 0.00 41.25 38.78 2blx s ASN 59 CO 0.30 0.05 1.48 -1.54 -2.79 0.00 0.00 177.10 174.60 2blx n SER 60 N 3.28 0.00 -0.17 -4.21 3.41 -0.18 -1.47 113.62 114.28 2blx n SER 60 Ca -0.07 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2blx n SER 60 Cb 0.51 -0.49 0.25 0.00 -0.26 0.00 0.00 64.21 64.22 2blx n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2blx h ARG 61 N 0.00 0.90 0.00 4.33 9.65 -1.83 -3.38 114.38 124.05 2blx h ARG 61 Ca 0.00 -0.09 0.00 0.00 -1.10 0.00 0.00 59.98 58.79 2blx h ARG 61 Cb 0.25 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 28.65 2blx h ARG 61 CO 0.00 0.65 -0.87 0.91 2.80 0.00 0.00 179.97 183.46 2blx n TRP 62 N -4.39 0.00 -0.01 2.20 7.02 -1.07 -1.39 117.44 119.80 2blx n TRP 62 Ca 0.07 0.00 0.04 0.00 -1.02 0.00 0.00 57.50 56.58 2blx n TRP 62 Cb 0.08 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 28.90 2blx n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2blx n TRP 63 N -2.05 0.00 -3.84 -5.99 7.02 -0.54 -0.82 117.44 111.21 2blx n TRP 63 Ca 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.39 2blx n TRP 63 Cb 0.44 -0.24 -0.07 0.00 -2.42 0.00 0.00 31.31 29.03 2blx n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2blx s ASN 65 N -2.88 5.89 0.00 0.00 2.47 -0.29 -4.55 114.94 115.58 2blx s ASN 65 Ca 0.08 -0.01 0.06 0.00 0.42 0.00 0.00 52.86 53.41 2blx s ASN 65 Cb 0.04 -2.08 0.09 0.00 -1.45 0.00 0.00 41.25 37.84 2blx s ASN 65 CO -0.08 -0.02 0.84 -0.90 -3.72 0.00 0.00 177.10 173.22 2blx n ASP 66 N 4.84 1.84 0.00 -4.21 5.68 -1.26 -0.71 116.55 122.73 2blx n ASP 66 Ca -0.15 -1.49 0.00 0.00 -0.50 0.00 0.00 54.79 52.65 2blx n ASP 66 Cb 0.52 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 2blx n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2blx n GLY 67 N 0.28 0.97 0.96 6.12 0.00 -1.26 -4.80 105.19 107.47 2blx n GLY 67 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.08 2blx n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2blx n ARG 68 N -2.00 0.00 -3.80 1.61 1.85 -1.26 -4.92 116.66 108.14 2blx n ARG 68 Ca 0.00 -1.39 -0.28 0.00 -1.00 0.00 0.00 57.85 55.19 2blx n ARG 68 Cb 0.00 -0.21 -0.11 0.00 -1.05 0.00 0.00 32.46 31.09 2blx n ARG 68 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2blx n THR 69 N 0.22 1.69 -1.69 8.89 -1.04 -1.26 -4.85 114.28 116.24 2blx n THR 69 Ca 0.01 -4.89 -0.44 0.00 -2.04 0.00 0.00 64.05 56.69 2blx n THR 69 Cb 0.89 -2.16 -0.03 0.00 -1.82 0.00 0.00 70.33 67.21 2blx n THR 69 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2blx n PRO 70 N 1.78 2.19 -0.96 -2.82 -0.02 -1.26 -1.82 135.00 132.09 2blx n PRO 70 Ca 0.22 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 2blx n PRO 70 Cb 0.36 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 2blx n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2blx n GLY 71 N 2.28 0.71 3.93 -1.23 0.00 -1.26 -5.03 105.19 104.59 2blx n GLY 71 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 2blx n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2blx s SER 72 N -2.42 4.47 0.50 1.61 1.04 -0.75 -5.09 113.70 113.06 2blx s SER 72 Ca 0.00 0.44 0.08 0.00 0.48 0.00 0.00 55.95 56.95 2blx s SER 72 Cb 0.00 -0.95 0.03 0.00 0.10 0.00 0.00 66.02 65.21 2blx s SER 72 CO 0.00 -1.85 0.54 -0.13 0.98 0.00 0.00 173.24 172.78 2blx s ARG 73 N -5.40 2.42 -0.38 4.02 1.81 -0.49 -4.99 118.95 115.94 2blx s ARG 73 Ca 0.63 -1.67 0.10 0.00 -1.72 0.00 0.00 55.73 53.08 2blx s ARG 73 Cb -0.09 -2.43 0.31 0.00 -0.45 0.00 0.00 34.95 32.29 2blx s ARG 73 CO 0.47 -0.53 0.66 -1.71 -0.68 0.00 0.00 175.30 173.51 2blx n ASN 74 N -1.86 0.68 0.23 0.23 5.15 -1.15 -3.56 115.26 114.99 2blx n ASN 74 Ca 0.06 -2.91 0.12 0.00 -0.60 0.00 0.00 54.58 51.25 2blx n ASN 74 Cb 0.62 -0.63 0.47 0.00 -0.53 0.00 0.00 39.78 39.71 2blx n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2blx h LEU 75 N 3.38 0.00 -0.62 1.20 3.38 -0.99 -0.83 115.31 120.83 2blx h LEU 75 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2blx h LEU 75 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2blx h LEU 75 CO 0.49 0.15 -0.07 0.00 0.09 0.00 0.00 178.44 179.10 2blx n ASN 77 N -0.33 -2.75 -3.79 0.00 5.15 -0.32 -5.01 115.26 108.22 2blx n ASN 77 Ca 0.17 -0.78 -0.12 0.00 -0.60 0.00 0.00 54.58 53.26 2blx n ASN 77 Cb 0.31 -4.44 -0.09 0.00 -0.53 0.00 0.00 39.78 35.04 2blx n ASN 77 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2blx s ILE 78 N -3.53 0.07 0.37 -1.44 -4.36 -1.26 -5.07 121.20 105.99 2blx s ILE 78 Ca 0.13 -0.59 -0.27 0.00 -0.26 0.00 0.00 60.65 59.66 2blx s ILE 78 Cb -0.03 -0.68 -0.09 0.00 1.25 0.00 0.00 42.46 42.91 2blx s ILE 78 CO 0.79 -0.32 1.29 -2.16 0.24 0.00 0.00 174.94 174.77 2blx s PRO 79 N -1.69 4.15 0.51 0.37 0.04 -1.26 -1.14 135.00 135.98 2blx s PRO 79 Ca -0.11 2.15 0.19 0.00 0.04 0.00 0.00 61.00 63.27 2blx s PRO 79 Cb -0.04 -2.89 1.28 0.00 0.04 0.00 0.00 34.50 32.88 2blx s PRO 79 CO 0.02 -0.34 2.06 0.00 0.04 0.00 0.00 177.00 178.78 2blx h SER 81 N 0.07 0.00 0.12 0.00 4.64 -1.91 -0.54 113.55 115.93 2blx h SER 81 Ca 0.15 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2blx h SER 81 Cb 0.51 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2blx h SER 81 CO -0.01 0.02 -0.02 0.00 -0.87 0.00 0.00 176.83 175.94 2blx h ALA 82 N 1.98 1.27 -0.01 5.18 0.00 -1.51 -1.60 119.26 124.57 2blx h ALA 82 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2blx h ALA 82 Cb 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2blx h ALA 82 CO 0.00 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.56 2blx n LEU 83 N -3.50 0.25 -0.47 0.00 4.77 -0.21 -3.42 117.00 114.41 2blx n LEU 83 Ca -0.03 -0.09 0.08 0.00 -0.03 0.00 0.00 56.01 55.95 2blx n LEU 83 Cb 0.12 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.22 2blx n LEU 83 CO 0.25 0.04 0.34 0.18 -1.33 0.00 0.00 177.39 176.88 2blx n LEU 84 N -0.77 1.88 -4.71 2.23 4.77 -0.60 -3.80 117.00 116.00 2blx n LEU 84 Ca 0.21 -0.83 -0.33 0.00 -0.03 0.00 0.00 56.01 55.03 2blx n LEU 84 Cb 0.14 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.35 2blx n LEU 84 CO 0.16 0.35 0.75 -0.55 -1.33 0.00 0.00 177.39 176.77 2blx s SER 85 N -1.79 3.81 0.53 -1.43 0.15 -1.22 -4.15 113.70 109.60 2blx s SER 85 Ca 0.16 2.23 0.28 0.00 0.70 0.00 0.00 55.95 59.32 2blx s SER 85 Cb 0.14 -2.57 1.48 0.00 -1.71 0.00 0.00 66.02 63.35 2blx s SER 85 CO 0.36 -2.51 2.08 0.77 1.20 0.00 0.00 173.24 175.13 2blx h SER 86 N -0.92 0.00 -3.41 5.45 4.64 -1.94 -3.40 113.55 113.97 2blx h SER 86 Ca -0.46 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.26 2blx h SER 86 Cb 1.28 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.27 2blx h SER 86 CO 0.47 0.11 0.24 -0.62 -0.87 0.00 0.00 176.83 176.16 2blx s ASP 87 N -6.09 6.69 0.00 4.97 -1.08 -1.26 -4.95 116.67 114.95 2blx s ASP 87 Ca -0.03 0.84 0.15 0.00 -0.52 0.00 0.00 52.55 52.99 2blx s ASP 87 Cb 0.13 -2.37 0.55 0.00 -1.46 0.00 0.00 42.92 39.77 2blx s ASP 87 CO 0.58 -0.38 1.40 2.30 0.52 0.00 0.00 175.17 179.58 2blx n ILE 88 N 5.06 0.26 -0.11 4.11 -5.35 -1.26 -4.41 119.36 117.65 2blx n ILE 88 Ca 0.01 -0.31 -0.06 0.00 -0.27 0.00 0.00 62.75 62.12 2blx n ILE 88 Cb 0.49 0.20 0.01 0.00 -1.74 0.00 0.00 39.64 38.59 2blx n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2blx h THR 89 N 1.63 0.47 -0.73 7.28 2.02 -1.94 -0.30 112.91 121.34 2blx h THR 89 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 2blx h THR 89 Cb 0.36 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 2blx h THR 89 CO 0.00 0.00 0.19 0.00 0.37 0.00 0.00 175.52 176.08 2blx h ALA 90 N 1.18 0.96 -0.53 6.16 0.00 -1.85 -0.42 119.26 124.76 2blx h ALA 90 Ca 0.19 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2blx h ALA 90 Cb 0.39 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2blx h ALA 90 CO -0.44 0.67 0.22 0.77 0.00 0.00 0.00 179.25 180.47 2blx h SER 91 N 1.10 0.72 -0.19 0.00 0.02 -1.66 -0.91 113.55 112.63 2blx h SER 91 Ca 0.23 -0.16 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2blx h SER 91 Cb 0.35 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 2blx h SER 91 CO -0.00 0.68 0.02 0.58 -1.14 0.00 0.00 176.83 176.96 2blx h VAL 92 N 0.71 1.24 -0.69 2.27 2.07 -0.72 0.48 116.25 121.61 2blx h VAL 92 Ca 0.18 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2blx h VAL 92 Cb 0.17 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 2blx h VAL 92 CO -0.02 0.24 0.45 0.78 0.02 0.00 0.00 177.57 179.05 2blx h ASN 93 N 0.10 0.80 -0.49 0.57 2.35 -0.97 -1.05 115.58 116.90 2blx h ASN 93 Ca 0.06 -0.03 -0.12 0.00 -0.55 0.00 0.00 56.30 55.66 2blx h ASN 93 Cb 0.35 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 2blx h ASN 93 CO 0.01 0.59 -0.16 0.00 -1.65 0.00 0.00 177.43 176.22 2blx h ALA 95 N 0.88 1.56 -0.88 0.00 0.00 -0.48 -0.82 119.26 119.52 2blx h ALA 95 Ca 0.12 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2blx h ALA 95 Cb 0.72 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 2blx h ALA 95 CO 0.06 0.37 0.57 0.87 0.00 0.00 0.00 179.25 181.11 2blx h LYS 96 N 0.91 1.07 0.03 0.00 1.57 -1.08 -0.55 116.57 118.51 2blx h LYS 96 Ca 0.29 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2blx h LYS 96 Cb 0.03 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.10 2blx h LYS 96 CO -0.08 0.71 -0.01 -0.22 -0.57 0.00 0.00 179.45 179.27 2blx h LYS 97 N 1.10 -0.03 -0.49 3.15 3.64 -1.08 -3.04 116.57 119.82 2blx h LYS 97 Ca 0.35 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.80 2blx h LYS 97 Cb 0.01 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.78 2blx h LYS 97 CO -0.12 0.25 0.18 0.82 -2.27 0.00 0.00 179.45 178.31 2blx h ILE 98 N -0.32 0.84 0.00 2.00 2.04 -0.87 -2.08 117.51 119.12 2blx h ILE 98 Ca -0.00 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2blx h ILE 98 Cb 0.30 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2blx h ILE 98 CO 0.01 0.06 0.00 1.62 0.00 0.00 0.00 178.15 179.84 2blx h VAL 99 N 0.35 0.00 -0.08 1.67 3.04 -1.17 -2.10 116.25 117.96 2blx h VAL 99 Ca 0.23 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 2blx h VAL 99 Cb 0.24 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 2blx h VAL 99 CO -0.24 0.00 0.00 -1.20 -1.01 0.00 0.00 177.57 175.12 2blx n SER 100 N -2.36 1.82 0.08 3.17 7.64 -0.79 -3.76 113.62 119.42 2blx n SER 100 Ca 0.02 -1.64 0.13 0.00 1.01 0.00 0.00 58.87 58.39 2blx n SER 100 Cb 0.24 -0.04 0.46 0.00 -1.01 0.00 0.00 64.21 63.86 2blx n SER 100 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2blx n ASP 101 N 0.42 0.58 0.00 6.43 2.03 -0.79 -4.92 116.55 120.30 2blx n ASP 101 Ca 0.18 0.57 0.00 0.00 0.52 0.00 0.00 54.79 56.05 2blx n ASP 101 Cb 0.39 -0.72 0.00 0.00 -0.72 0.00 0.00 41.12 40.07 2blx n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2blx n GLY 102 N 1.17 2.21 1.18 0.27 0.00 -1.26 -4.96 105.19 103.80 2blx n GLY 102 Ca 0.05 -0.32 0.12 0.00 0.00 0.00 0.00 46.02 45.88 2blx n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2blx n ASN 103 N 0.00 3.55 0.00 1.61 3.02 -1.26 -5.06 115.26 117.12 2blx n ASN 103 Ca 0.00 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 2blx n ASN 103 Cb 0.00 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 2blx n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2blx n GLY 104 N 1.51 2.32 0.00 7.41 0.00 -1.25 -1.96 105.19 113.23 2blx n GLY 104 Ca 0.20 -0.43 0.13 0.00 0.00 0.00 0.00 46.02 45.93 2blx n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2blx n MET 105 N 9.86 0.62 0.20 1.61 2.81 -1.26 -2.74 117.12 128.22 2blx n MET 105 Ca 0.00 0.02 0.14 0.00 -1.81 0.00 0.00 57.70 56.05 2blx n MET 105 Cb 0.00 -1.50 0.70 0.00 -0.71 0.00 0.00 33.22 31.71 2blx n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2blx h ASN 106 N 0.00 0.00 -0.58 7.83 2.35 -1.81 -1.07 115.58 122.29 2blx h ASN 106 Ca 0.00 0.00 0.14 0.00 -0.55 0.00 0.00 56.30 55.89 2blx h ASN 106 Cb 0.13 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 2blx h ASN 106 CO 0.00 0.00 0.40 0.00 -1.65 0.00 0.00 177.43 176.18 2blx h ALA 107 N 2.05 2.29 -1.94 -0.83 0.00 -1.65 -3.34 119.26 115.84 2blx h ALA 107 Ca 0.00 -0.01 -0.70 0.00 0.00 0.00 0.00 54.91 54.20 2blx h ALA 107 Cb 0.10 -0.01 -0.19 0.00 0.00 0.00 0.00 17.79 17.69 2blx h ALA 107 CO 0.00 -0.44 0.10 -1.58 0.00 0.00 0.00 179.25 177.32 2blx s TRP 108 N -5.19 3.01 0.38 0.00 0.51 -0.41 -4.94 118.94 112.30 2blx s TRP 108 Ca -0.06 -0.88 0.07 0.00 -2.12 0.00 0.00 56.10 53.11 2blx s TRP 108 Cb 0.20 -3.91 0.79 0.00 -0.81 0.00 0.00 33.47 29.74 2blx s TRP 108 CO 0.74 -1.24 1.98 -0.24 -0.51 0.00 0.00 176.95 177.68 2blx h VAL 109 N 5.91 1.02 -0.16 4.03 3.04 -1.83 -0.61 116.25 127.65 2blx h VAL 109 Ca -0.29 -0.23 -0.08 0.00 -1.01 0.00 0.00 66.70 65.09 2blx h VAL 109 Cb 1.09 0.28 -0.01 0.00 -2.01 0.00 0.00 31.29 30.64 2blx h VAL 109 CO 1.07 0.12 -0.24 0.00 -1.01 0.00 0.00 177.57 177.51 2blx h ALA 110 N 1.64 1.29 -0.24 3.17 0.00 -1.93 -0.44 119.26 122.76 2blx h ALA 110 Ca 0.28 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2blx h ALA 110 Cb 0.23 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2blx h ALA 110 CO -0.09 0.48 0.06 2.35 0.00 0.00 0.00 179.25 182.06 2blx h TRP 111 N 0.26 0.39 -0.47 0.00 7.01 -1.44 -0.70 115.95 121.01 2blx h TRP 111 Ca 0.04 -0.04 0.02 0.00 2.11 0.00 0.00 58.89 61.02 2blx h TRP 111 Cb 0.58 -0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 27.50 2blx h TRP 111 CO 0.01 0.46 0.28 -0.09 -2.79 0.00 0.00 178.44 176.31 2blx h ARG 112 N 0.21 0.55 0.00 2.65 2.43 -0.92 0.73 114.38 120.03 2blx h ARG 112 Ca 0.08 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2blx h ARG 112 Cb 0.26 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2blx h ARG 112 CO -0.00 0.36 -0.35 -0.91 -1.51 0.00 0.00 179.97 177.56 2blx h ASN 113 N 0.56 0.00 0.00 -3.80 2.35 -0.99 -3.35 115.58 110.35 2blx h ASN 113 Ca 0.19 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2blx h ASN 113 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 2blx h ASN 113 CO -0.08 0.01 -0.17 0.54 -1.65 0.00 0.00 177.43 176.08 2blx n ARG 114 N -2.73 3.80 0.00 0.81 1.74 -0.28 -4.91 116.66 115.09 2blx n ARG 114 Ca 0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 2blx n ARG 114 Cb 0.51 -0.45 0.00 0.00 -1.02 0.00 0.00 32.46 31.50 2blx n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2blx n LYS 116 N -2.57 2.59 -0.91 0.00 4.81 0.06 -1.47 118.16 120.66 2blx n LYS 116 Ca 0.00 0.94 0.00 0.00 -0.87 0.00 0.00 58.31 58.38 2blx n LYS 116 Cb 0.41 -2.77 0.00 0.00 0.02 0.00 0.00 35.03 32.69 2blx n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2blx n GLY 117 N 3.87 0.85 3.95 3.14 0.00 -1.26 -4.93 105.19 110.81 2blx n GLY 117 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 2blx n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2blx s THR 118 N -3.36 2.31 -1.29 2.61 -4.23 -0.54 -5.01 115.64 106.12 2blx s THR 118 Ca 0.00 -1.24 -0.18 0.00 -1.18 0.00 0.00 61.69 59.09 2blx s THR 118 Cb 0.00 -2.55 0.04 0.00 1.34 0.00 0.00 72.50 71.33 2blx s THR 118 CO 0.00 0.00 1.82 -0.67 -0.54 0.00 0.00 174.62 175.23 2blx n ASP 119 N -1.83 4.54 0.28 3.99 2.03 -1.26 -4.77 116.55 119.53 2blx n ASP 119 Ca 0.06 -2.88 0.17 0.00 0.52 0.00 0.00 54.79 52.66 2blx n ASP 119 Cb 0.62 -1.73 0.72 0.00 -0.72 0.00 0.00 41.12 40.01 2blx n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2blx h VAL 120 N 5.47 0.10 0.00 5.18 -1.51 -1.91 -2.37 116.25 121.22 2blx h VAL 120 Ca 0.43 -0.53 -0.01 0.00 -1.23 0.00 0.00 66.70 65.36 2blx h VAL 120 Cb 0.85 1.48 -0.00 0.00 -2.13 0.00 0.00 31.29 31.49 2blx h VAL 120 CO 1.48 0.03 -0.05 -0.61 -1.23 0.00 0.00 177.57 177.19 2blx h GLN 121 N 0.00 0.00 -0.81 5.19 -0.00 -1.87 -1.16 115.11 116.47 2blx h GLN 121 Ca -0.00 0.00 0.20 0.00 -0.00 0.00 0.00 58.65 58.85 2blx h GLN 121 Cb 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 27.48 27.91 2blx h GLN 121 CO 0.00 0.05 0.55 0.00 0.00 0.00 0.00 178.83 179.44 2blx h ALA 122 N 1.95 2.41 0.00 3.38 0.00 -1.82 -0.70 119.26 124.48 2blx h ALA 122 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2blx h ALA 122 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2blx h ALA 122 CO 0.01 -0.65 0.00 -1.49 0.00 0.00 0.00 179.25 177.11 2blx h TRP 123 N 0.23 0.00 -0.12 0.00 4.06 -1.41 -2.76 115.95 115.94 2blx h TRP 123 Ca 0.40 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.35 2blx h TRP 123 Cb 1.23 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.39 2blx h TRP 123 CO -0.00 0.00 0.00 0.44 -3.56 0.00 0.00 178.44 175.32 2blx n ILE 124 N -2.84 0.51 -2.17 1.49 -5.35 -0.31 -4.81 119.36 105.87 2blx n ILE 124 Ca 0.00 -0.76 -0.40 0.00 -0.27 0.00 0.00 62.75 61.33 2blx n ILE 124 Cb 0.23 0.82 -0.02 0.00 -1.74 0.00 0.00 39.64 38.92 2blx n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2blx s ARG 125 N -0.80 4.19 0.00 6.28 3.52 -0.95 -2.05 118.95 129.15 2blx s ARG 125 Ca 0.11 2.07 0.00 0.00 -0.13 0.00 0.00 55.73 57.78 2blx s ARG 125 Cb 0.07 -2.89 0.00 0.00 -1.56 0.00 0.00 34.95 30.57 2blx s ARG 125 CO 0.09 -0.27 0.00 0.41 -0.81 0.00 0.00 175.30 174.72 2blx n GLY 126 N 0.76 3.18 3.80 8.12 0.00 -1.26 -5.03 105.19 114.76 2blx n GLY 126 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2blx n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2blx s ARG 128 N -2.62 2.80 0.00 0.00 3.52 -1.26 -5.12 118.95 116.28 2blx s ARG 128 Ca 0.56 -1.74 0.00 0.00 -0.13 0.00 0.00 55.73 54.42 2blx s ARG 128 Cb -0.14 -4.16 0.00 0.00 -1.56 0.00 0.00 34.95 29.09 2blx s ARG 128 CO 0.18 -1.28 0.25 1.28 -0.81 0.00 0.00 175.30 174.92