#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fbi s VAL 2 N 0.00 3.71 -0.14 -0.18 1.01 -1.26 -1.66 120.40 121.87 1fbi s VAL 2 Ca 0.00 0.99 -0.26 0.00 0.00 0.00 0.00 61.98 62.71 1fbi s VAL 2 Cb 0.00 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 1fbi s VAL 2 CO 0.00 -0.04 0.85 -0.36 0.00 0.00 0.00 175.10 175.55 1fbi s PHE 3 N 3.12 3.46 0.31 5.22 0.40 0.12 -4.92 117.98 125.68 1fbi s PHE 3 Ca 0.66 1.32 -0.29 0.00 -0.60 0.00 0.00 56.93 58.03 1fbi s PHE 3 Cb -0.31 -3.03 -0.10 0.00 0.51 0.00 0.00 43.02 40.09 1fbi s PHE 3 CO 0.26 -0.20 1.31 0.20 0.70 0.00 0.00 175.22 177.49 1fbi s GLY 4 N 1.11 2.88 0.72 4.36 0.00 -1.26 -4.79 107.32 110.33 1fbi s GLY 4 Ca 0.40 1.24 -0.16 0.00 0.00 0.00 0.00 44.72 46.20 1fbi s GLY 4 CO 0.14 1.95 0.76 0.54 0.00 0.00 0.00 173.10 176.49 1fbi n ARG 5 N 1.15 0.42 0.00 2.90 1.74 -1.26 -2.13 116.66 119.48 1fbi n ARG 5 Ca 0.01 0.19 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1fbi n ARG 5 Cb 0.42 -2.03 0.00 0.00 -1.02 0.00 0.00 32.46 29.83 1fbi n ARG 5 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1fbi h GLU 7 N 0.00 -0.42 -0.86 0.00 4.81 -1.82 0.31 114.58 116.60 1fbi h GLU 7 Ca 0.00 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.37 1fbi h GLU 7 Cb 0.00 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.41 1fbi h GLU 7 CO 0.00 -0.15 0.55 1.25 -0.73 0.00 0.00 179.01 179.94 1fbi h LEU 8 N -0.65 0.70 -0.53 1.64 7.12 -1.67 -1.07 115.31 120.85 1fbi h LEU 8 Ca -0.04 0.03 -0.14 0.00 0.13 0.00 0.00 57.88 57.85 1fbi h LEU 8 Cb 0.46 -0.12 -0.01 0.00 -0.53 0.00 0.00 40.66 40.46 1fbi h LEU 8 CO 0.07 0.40 -0.30 0.00 -0.13 0.00 0.00 178.44 178.48 1fbi h ALA 9 N 1.59 0.72 -0.22 1.25 0.00 -1.70 -1.83 119.26 119.06 1fbi h ALA 9 Ca 0.41 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1fbi h ALA 9 Cb 0.53 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1fbi h ALA 9 CO -0.17 0.66 -0.19 0.00 0.00 0.00 0.00 179.25 179.56 1fbi h ALA 10 N 0.92 1.28 0.36 0.00 0.00 0.80 -1.77 119.26 120.83 1fbi h ALA 10 Ca 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1fbi h ALA 10 Cb 0.86 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1fbi h ALA 10 CO 0.08 0.48 -0.17 0.00 0.00 0.00 0.00 179.25 179.63 1fbi h ALA 11 N 1.46 -0.48 -0.33 0.00 0.00 -1.06 -1.00 119.26 117.85 1fbi h ALA 11 Ca 0.06 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 54.90 1fbi h ALA 11 Cb 0.53 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1fbi h ALA 11 CO 0.03 -0.50 0.27 0.52 0.00 0.00 0.00 179.25 179.58 1fbi h MET 12 N -1.02 0.00 -0.20 0.00 2.86 -1.35 0.37 114.93 115.58 1fbi h MET 12 Ca -0.05 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 1fbi h MET 12 Cb 0.49 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1fbi h MET 12 CO 0.08 0.00 -0.13 -0.22 1.06 0.00 0.00 176.91 177.70 1fbi h LYS 13 N 0.00 0.45 0.00 1.72 3.64 -1.26 -2.30 116.57 118.81 1fbi h LYS 13 Ca 0.16 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1fbi h LYS 13 Cb 0.69 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1fbi h LYS 13 CO -0.00 0.76 0.00 0.54 -2.27 0.00 0.00 179.45 178.48 1fbi n ARG 14 N -4.52 0.52 -0.37 1.90 1.74 0.12 -2.76 116.66 113.30 1fbi n ARG 14 Ca -0.05 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.10 1fbi n ARG 14 Cb 0.35 -1.06 0.11 0.00 -1.02 0.00 0.00 32.46 30.85 1fbi n ARG 14 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1fbi n HIS 15 N -0.56 0.00 -0.32 -1.55 8.25 -0.63 -4.98 115.22 115.42 1fbi n HIS 15 Ca 0.01 -0.83 0.00 0.00 -0.26 0.00 0.00 57.72 56.64 1fbi n HIS 15 Cb 0.01 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 30.97 1fbi n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fbi n GLY 16 N -0.92 0.45 0.31 -1.41 0.00 -1.11 -4.76 105.19 97.74 1fbi n GLY 16 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.24 1fbi n GLY 16 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1fbi h LEU 17 N 0.00 0.19 0.00 0.99 5.85 -1.78 -3.37 115.31 117.18 1fbi h LEU 17 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1fbi h LEU 17 Cb 0.00 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1fbi h LEU 17 CO 0.00 0.13 0.00 0.47 -0.34 0.00 0.00 178.44 178.70 1fbi n ASP 18 N -4.48 0.00 -2.20 1.25 9.92 -1.25 -0.90 116.55 118.90 1fbi n ASP 18 Ca 0.03 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 54.06 1fbi n ASP 18 Cb 0.23 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.73 1fbi n ASP 18 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1fbi n ASN 19 N -0.08 4.60 -4.68 -2.24 5.15 -1.20 -1.38 115.26 115.43 1fbi n ASN 19 Ca 0.00 -3.62 -0.48 0.00 -0.60 0.00 0.00 54.58 49.89 1fbi n ASN 19 Cb 0.00 -0.38 -0.05 0.00 -0.53 0.00 0.00 39.78 38.82 1fbi n ASN 19 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1fbi n TYR 20 N -0.63 2.32 -1.13 1.20 4.19 -0.07 -0.48 117.16 122.56 1fbi n TYR 20 Ca 0.40 0.05 -0.04 0.00 3.31 0.00 0.00 57.90 61.61 1fbi n TYR 20 Cb 0.88 -2.64 -0.02 0.00 0.49 0.00 0.00 39.34 38.05 1fbi n TYR 20 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 1fbi n ARG 21 N 5.89 -1.87 -0.63 2.98 5.12 -1.26 -3.16 116.66 123.72 1fbi n ARG 21 Ca 0.21 0.65 0.00 0.00 -1.93 0.00 0.00 57.85 56.78 1fbi n ARG 21 Cb 0.30 -5.12 0.00 0.00 -1.16 0.00 0.00 32.46 26.48 1fbi n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1fbi n GLY 22 N 0.68 0.90 3.13 -0.13 0.00 0.37 -5.11 105.19 105.03 1fbi n GLY 22 Ca -0.04 -0.59 -0.05 0.00 0.00 0.00 0.00 46.02 45.34 1fbi n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fbi s TYR 23 N -2.40 -1.07 0.59 1.61 2.02 -1.19 -5.09 117.35 111.82 1fbi s TYR 23 Ca 0.00 1.37 -0.16 0.00 -0.37 0.00 0.00 57.07 57.90 1fbi s TYR 23 Cb 0.00 0.30 -0.04 0.00 -0.40 0.00 0.00 41.96 41.82 1fbi s TYR 23 CO 0.00 -0.70 1.06 -1.12 -1.57 0.00 0.00 175.55 173.22 1fbi s SER 24 N 2.68 5.78 0.32 2.29 0.01 -1.24 -3.27 113.70 120.26 1fbi s SER 24 Ca 0.10 1.86 0.23 0.00 1.31 0.00 0.00 55.95 59.44 1fbi s SER 24 Cb -0.14 -2.54 1.11 0.00 0.21 0.00 0.00 66.02 64.66 1fbi s SER 24 CO -0.17 -1.17 1.19 -0.11 0.41 0.00 0.00 173.24 173.39 1fbi n LEU 25 N -1.94 0.18 -0.19 2.44 -0.00 -0.48 0.15 117.00 117.16 1fbi n LEU 25 Ca 0.09 1.10 -0.08 0.00 -0.00 0.00 0.00 56.01 57.11 1fbi n LEU 25 Cb 0.53 -0.54 0.05 0.00 -0.00 0.00 0.00 43.42 43.46 1fbi n LEU 25 CO 0.46 -1.20 0.81 1.23 -0.00 0.00 0.00 177.39 178.70 1fbi h GLY 26 N 0.00 1.10 1.24 -3.96 0.00 -1.88 -0.48 103.07 99.09 1fbi h GLY 26 Ca 0.66 -0.81 -0.06 0.00 0.00 0.00 0.00 47.33 47.12 1fbi h GLY 26 CO -0.40 0.75 0.13 3.43 0.00 0.00 0.00 176.54 180.45 1fbi h ASN 27 N 0.92 0.89 0.12 0.19 4.21 0.10 0.29 115.58 122.31 1fbi h ASN 27 Ca 0.16 -0.18 -0.01 0.00 1.21 0.00 0.00 56.30 57.49 1fbi h ASN 27 Cb 0.57 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 37.54 1fbi h ASN 27 CO 0.03 0.87 -0.06 -0.50 -1.29 0.00 0.00 177.43 176.49 1fbi h TRP 28 N 0.90 -0.15 -0.62 1.19 -0.00 -1.29 -1.38 115.95 114.61 1fbi h TRP 28 Ca 0.19 -0.00 -0.07 0.00 -0.00 0.00 0.00 58.89 59.01 1fbi h TRP 28 Cb 0.34 0.05 -0.02 0.00 -0.00 0.00 0.00 29.16 29.53 1fbi h TRP 28 CO 0.02 0.03 0.11 0.28 -0.00 0.00 0.00 178.44 178.88 1fbi h VAL 29 N -0.31 1.26 0.59 1.49 2.07 -0.85 -1.80 116.25 118.69 1fbi h VAL 29 Ca -0.02 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 1fbi h VAL 29 Cb 0.25 0.70 0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1fbi h VAL 29 CO 0.03 0.37 -0.28 0.00 0.02 0.00 0.00 177.57 177.70 1fbi h ALA 31 N -0.47 1.46 0.54 0.00 0.00 -1.23 -0.81 119.26 118.76 1fbi h ALA 31 Ca -0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1fbi h ALA 31 Cb 0.63 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1fbi h ALA 31 CO 0.13 0.35 -0.26 0.00 0.00 0.00 0.00 179.25 179.47 1fbi h ALA 32 N 1.50 -0.73 -0.04 0.00 0.00 -1.26 -2.57 119.26 116.16 1fbi h ALA 32 Ca 0.46 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1fbi h ALA 32 Cb 0.31 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 18.32 1fbi h ALA 32 CO -0.21 -0.84 -0.41 -0.22 0.00 0.00 0.00 179.25 177.57 1fbi h LYS 33 N -0.87 -0.52 0.00 0.00 3.11 -0.97 0.32 116.57 117.64 1fbi h LYS 33 Ca -0.07 0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.80 1fbi h LYS 33 Cb 0.61 0.12 0.00 0.00 -1.00 0.00 0.00 32.23 31.96 1fbi h LYS 33 CO 0.12 -0.35 0.00 1.19 -2.81 0.00 0.00 179.45 177.61 1fbi n PHE 34 N -5.44 0.00 -0.00 1.91 3.72 -0.34 -0.56 117.46 116.74 1fbi n PHE 34 Ca -0.05 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.33 1fbi n PHE 34 Cb 0.36 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.90 1fbi n PHE 34 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1fbi n GLU 35 N -0.65 0.08 0.00 -1.08 -0.58 0.79 -4.83 120.64 114.38 1fbi n GLU 35 Ca 0.03 0.03 0.09 0.00 -0.42 0.00 0.00 57.16 56.90 1fbi n GLU 35 Cb 0.01 -0.46 0.07 0.00 -0.57 0.00 0.00 31.44 30.49 1fbi n GLU 35 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1fbi n SER 36 N -3.03 2.51 -2.26 1.62 3.41 0.67 -4.94 113.62 111.59 1fbi n SER 36 Ca -0.02 -1.75 -0.19 0.00 -0.26 0.00 0.00 58.87 56.64 1fbi n SER 36 Cb 0.08 0.04 -0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1fbi n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1fbi n ASN 37 N 0.97 -5.50 0.00 4.04 4.05 0.27 -0.62 115.26 118.47 1fbi n ASN 37 Ca 0.11 -0.06 0.00 0.00 0.45 0.00 0.00 54.58 55.08 1fbi n ASN 37 Cb 0.46 -4.51 0.00 0.00 1.23 0.00 0.00 39.78 36.96 1fbi n ASN 37 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 1fbi n PHE 38 N -4.09 0.00 -2.49 1.20 3.01 -1.26 -4.84 117.46 109.00 1fbi n PHE 38 Ca -0.20 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.84 1fbi n PHE 38 Cb 0.66 -0.44 -0.03 0.00 -0.01 0.00 0.00 39.48 39.66 1fbi n PHE 38 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1fbi s ASN 39 N -3.03 6.24 -1.51 4.37 2.47 0.21 0.14 114.94 123.83 1fbi s ASN 39 Ca 0.00 0.09 -0.12 0.00 0.42 0.00 0.00 52.86 53.25 1fbi s ASN 39 Cb 0.00 -2.55 -0.00 0.00 -1.45 0.00 0.00 41.25 37.25 1fbi s ASN 39 CO 0.00 -1.66 2.51 -0.24 -3.72 0.00 0.00 177.10 173.99 1fbi n SER 40 N 9.16 6.05 0.00 -4.21 2.88 -0.67 -2.16 113.62 124.68 1fbi n SER 40 Ca 0.09 -2.76 0.00 0.00 -1.33 0.00 0.00 58.87 54.87 1fbi n SER 40 Cb 0.49 -1.60 0.00 0.00 -0.75 0.00 0.00 64.21 62.35 1fbi n SER 40 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1fbi n GLN 41 N 4.79 0.00 -2.00 -1.46 -0.06 -1.26 -1.90 117.38 115.49 1fbi n GLN 41 Ca 0.62 0.00 -0.42 0.00 -2.00 0.00 0.00 57.00 55.21 1fbi n GLN 41 Cb 0.32 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.47 1fbi n GLN 41 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1fbi s ALA 42 N 0.00 3.66 -0.35 1.69 0.00 -0.92 -4.90 121.76 120.94 1fbi s ALA 42 Ca 0.00 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.29 1fbi s ALA 42 Cb 0.00 -3.57 0.14 0.00 0.00 0.00 0.00 23.12 19.69 1fbi s ALA 42 CO 0.00 -0.74 0.22 0.99 0.00 0.00 0.00 175.76 176.23 1fbi s THR 43 N 0.35 0.11 -0.41 0.00 2.01 -1.26 -3.48 115.64 112.96 1fbi s THR 43 Ca 0.62 -1.67 -0.25 0.00 0.31 0.00 0.00 61.69 60.70 1fbi s THR 43 Cb -0.42 -1.09 0.02 0.00 0.01 0.00 0.00 72.50 71.02 1fbi s THR 43 CO 0.39 -0.97 0.89 0.21 -0.69 0.00 0.00 174.62 174.45 1fbi s ASN 44 N 1.09 6.56 -0.49 3.53 2.47 -1.24 -4.90 114.94 121.95 1fbi s ASN 44 Ca 0.18 0.29 -0.28 0.00 0.42 0.00 0.00 52.86 53.47 1fbi s ASN 44 Cb -0.22 -2.44 0.01 0.00 -1.45 0.00 0.00 41.25 37.15 1fbi s ASN 44 CO 0.01 -0.92 1.47 -0.13 -3.72 0.00 0.00 177.10 173.81 1fbi s ARG 45 N 3.50 3.36 0.70 0.43 3.00 -1.26 -2.56 118.95 126.12 1fbi s ARG 45 Ca 0.36 0.71 -0.15 0.00 0.00 0.00 0.00 55.73 56.65 1fbi s ARG 45 Cb -0.11 -4.11 0.03 0.00 0.00 0.00 0.00 34.95 30.75 1fbi s ARG 45 CO 0.22 -1.85 1.15 1.21 0.00 0.00 0.00 175.30 176.03 1fbi s ASN 46 N 4.62 4.61 0.17 0.23 3.84 -0.46 -4.95 114.94 123.00 1fbi s ASN 46 Ca 0.59 2.15 -0.15 0.00 0.21 0.00 0.00 52.86 55.66 1fbi s ASN 46 Cb -0.13 -2.57 0.05 0.00 -0.55 0.00 0.00 41.25 38.06 1fbi s ASN 46 CO 0.28 -1.98 1.82 0.74 -2.79 0.00 0.00 177.10 175.18 1fbi h THR 47 N -0.24 1.10 0.00 -5.21 2.02 -1.93 -3.14 112.91 105.51 1fbi h THR 47 Ca -0.47 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.50 1fbi h THR 47 Cb 1.27 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 1fbi h THR 47 CO 0.52 0.11 0.00 -0.90 0.37 0.00 0.00 175.52 175.62 1fbi n ASP 48 N -4.77 0.00 0.00 4.18 5.68 -1.26 -4.75 116.55 115.63 1fbi n ASP 48 Ca 0.02 -0.09 0.00 0.00 -0.50 0.00 0.00 54.79 54.22 1fbi n ASP 48 Cb 0.04 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.02 1fbi n ASP 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fbi n GLY 49 N -0.81 0.27 3.76 6.12 0.00 -1.19 -4.95 105.19 108.40 1fbi n GLY 49 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1fbi n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fbi s SER 50 N -2.53 6.49 -0.11 1.61 1.04 -1.26 -4.45 113.70 114.50 1fbi s SER 50 Ca 0.00 0.58 -0.05 0.00 0.48 0.00 0.00 55.95 56.96 1fbi s SER 50 Cb 0.00 -2.18 -0.04 0.00 0.10 0.00 0.00 66.02 63.90 1fbi s SER 50 CO 0.00 0.18 0.10 0.42 0.98 0.00 0.00 173.24 174.91 1fbi s THR 51 N 0.02 5.12 -0.05 2.02 -4.23 -1.26 -1.36 115.64 115.89 1fbi s THR 51 Ca 0.17 0.05 -0.13 0.00 -1.18 0.00 0.00 61.69 60.61 1fbi s THR 51 Cb -0.13 -3.21 -0.05 0.00 1.34 0.00 0.00 72.50 70.44 1fbi s THR 51 CO 0.05 0.61 0.33 -1.81 -0.54 0.00 0.00 174.62 173.26 1fbi s ASP 52 N -1.01 6.66 0.24 3.99 1.11 -1.06 -2.06 116.67 124.53 1fbi s ASP 52 Ca 0.15 0.78 0.10 0.00 0.18 0.00 0.00 52.55 53.75 1fbi s ASP 52 Cb -0.12 -2.20 -0.05 0.00 1.07 0.00 0.00 42.92 41.62 1fbi s ASP 52 CO 0.04 0.30 -0.17 -0.31 1.18 0.00 0.00 175.17 176.21 1fbi s TYR 53 N -0.79 1.96 0.26 4.23 1.51 0.22 -3.59 117.35 121.15 1fbi s TYR 53 Ca 0.21 -0.47 0.00 0.00 -1.01 0.00 0.00 57.07 55.80 1fbi s TYR 53 Cb -0.15 -0.88 0.00 0.00 -0.11 0.00 0.00 41.96 40.82 1fbi s TYR 53 CO 0.10 0.51 0.00 0.41 -1.11 0.00 0.00 175.55 175.46 1fbi n GLY 54 N -0.46 -1.97 0.00 0.71 0.00 -1.23 -0.26 105.19 101.98 1fbi n GLY 54 Ca -0.07 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1fbi n GLY 54 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1fbi n VAL 55 N -3.57 0.70 -0.20 1.61 3.14 -1.26 -0.67 118.33 118.07 1fbi n VAL 55 Ca 0.01 0.18 0.00 0.00 -2.96 0.00 0.00 64.34 61.56 1fbi n VAL 55 Cb 0.52 -1.18 0.00 0.00 -1.06 0.00 0.00 33.84 32.12 1fbi n VAL 55 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1fbi n LEU 56 N -1.17 0.52 -3.47 6.55 4.77 -1.26 -4.33 117.00 118.62 1fbi n LEU 56 Ca 0.00 -0.62 -0.17 0.00 -0.03 0.00 0.00 56.01 55.19 1fbi n LEU 56 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1fbi n LEU 56 CO 0.00 0.13 0.03 0.00 -1.33 0.00 0.00 177.39 176.22 1fbi n GLN 57 N -0.20 -1.39 -3.01 3.23 1.13 0.15 -4.96 117.38 112.33 1fbi n GLN 57 Ca 0.00 0.95 -0.40 0.00 -1.94 0.00 0.00 57.00 55.61 1fbi n GLN 57 Cb 0.05 -4.24 -0.05 0.00 0.11 0.00 0.00 30.24 26.11 1fbi n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1fbi s ILE 58 N -3.15 4.99 0.41 5.09 1.01 0.64 -4.55 121.20 125.64 1fbi s ILE 58 Ca 0.16 1.44 -0.25 0.00 0.00 0.00 0.00 60.65 62.00 1fbi s ILE 58 Cb -0.05 -4.05 -0.08 0.00 0.01 0.00 0.00 42.46 38.29 1fbi s ILE 58 CO 0.83 0.15 1.16 0.21 0.00 0.00 0.00 174.94 177.28 1fbi s ASN 59 N 1.01 6.49 -0.98 3.58 2.47 -1.26 -0.61 114.94 125.64 1fbi s ASN 59 Ca 0.36 2.31 -0.06 0.00 0.42 0.00 0.00 52.86 55.89 1fbi s ASN 59 Cb -0.17 -2.61 0.24 0.00 -1.45 0.00 0.00 41.25 37.27 1fbi s ASN 59 CO 0.14 -0.69 0.92 -0.44 -3.72 0.00 0.00 177.10 173.31 1fbi s SER 60 N -1.21 6.63 0.00 -4.21 0.01 -0.87 -2.16 113.70 111.89 1fbi s SER 60 Ca 0.58 -3.56 0.00 0.00 1.31 0.00 0.00 55.95 54.28 1fbi s SER 60 Cb -0.29 -2.07 0.00 0.00 0.21 0.00 0.00 66.02 63.87 1fbi s SER 60 CO 0.37 -0.26 0.00 -1.14 0.41 0.00 0.00 173.24 172.61 1fbi n ARG 61 N 2.66 0.00 0.03 12.44 0.00 -1.23 -4.46 116.66 126.10 1fbi n ARG 61 Ca 0.21 0.00 -0.01 0.00 -0.00 0.00 0.00 57.85 58.06 1fbi n ARG 61 Cb 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 32.84 1fbi n ARG 61 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.63 179.50 1fbi n TRP 62 N -0.08 0.00 -0.12 -0.14 -0.00 -1.26 -0.67 117.44 115.18 1fbi n TRP 62 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.50 57.34 1fbi n TRP 62 Cb 0.00 -0.04 -0.12 0.00 -0.00 0.00 0.00 31.31 31.16 1fbi n TRP 62 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 177.69 178.60 1fbi n TRP 63 N -3.46 0.00 -3.69 5.87 7.02 -1.23 0.42 117.44 122.37 1fbi n TRP 63 Ca -0.01 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.14 1fbi n TRP 63 Cb 0.13 -0.95 -0.05 0.00 -2.42 0.00 0.00 31.31 28.02 1fbi n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1fbi s ASN 65 N -2.05 4.73 -0.06 0.00 2.47 -0.99 -3.58 114.94 115.46 1fbi s ASN 65 Ca 0.35 -1.50 0.12 0.00 0.42 0.00 0.00 52.86 52.25 1fbi s ASN 65 Cb -0.13 -1.65 0.35 0.00 -1.45 0.00 0.00 41.25 38.37 1fbi s ASN 65 CO 0.21 -0.27 1.28 -0.90 -3.72 0.00 0.00 177.10 173.70 1fbi n ASP 66 N 4.50 3.12 0.00 -4.21 5.75 -1.26 -1.00 116.55 123.45 1fbi n ASP 66 Ca -0.10 -2.36 0.00 0.00 -0.01 0.00 0.00 54.79 52.32 1fbi n ASP 66 Cb 0.42 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 1fbi n ASP 66 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fbi n GLY 67 N 0.03 0.00 0.00 6.12 0.00 -1.26 -4.48 105.19 105.60 1fbi n GLY 67 Ca 0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.17 1fbi n GLY 67 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1fbi n ARG 68 N -1.59 1.09 -3.04 1.61 0.00 -1.26 -4.97 116.66 108.50 1fbi n ARG 68 Ca 0.00 -0.02 -0.41 0.00 -0.00 0.00 0.00 57.85 57.42 1fbi n ARG 68 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 32.46 31.41 1fbi n ARG 68 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1fbi s THR 69 N -2.06 4.97 0.10 5.15 2.01 -1.26 -5.03 115.64 119.51 1fbi s THR 69 Ca -0.01 1.32 -0.30 0.00 0.31 0.00 0.00 61.69 63.01 1fbi s THR 69 Cb 0.02 -4.00 -0.06 0.00 0.01 0.00 0.00 72.50 68.46 1fbi s THR 69 CO 0.13 0.07 1.15 -2.16 -0.69 0.00 0.00 174.62 173.12 1fbi s PRO 70 N 2.10 4.49 0.00 4.92 0.04 -1.26 -3.98 135.00 141.32 1fbi s PRO 70 Ca 0.31 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.09 1fbi s PRO 70 Cb -0.16 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.05 1fbi s PRO 70 CO 0.10 -0.14 0.00 0.41 0.04 0.00 0.00 177.00 177.42 1fbi n GLY 71 N 2.79 0.97 3.58 0.56 0.00 -1.26 -5.01 105.19 106.82 1fbi n GLY 71 Ca 0.07 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 1fbi n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fbi s SER 72 N -2.66 6.47 0.55 1.61 0.01 -1.26 -4.69 113.70 113.74 1fbi s SER 72 Ca 0.00 0.14 0.33 0.00 1.31 0.00 0.00 55.95 57.73 1fbi s SER 72 Cb 0.00 -2.55 1.47 0.00 0.21 0.00 0.00 66.02 65.15 1fbi s SER 72 CO 0.00 -1.45 2.03 0.03 0.41 0.00 0.00 173.24 174.26 1fbi h ARG 73 N 9.50 0.00 -7.02 12.44 3.08 -1.03 -3.47 114.38 127.88 1fbi h ARG 73 Ca -0.25 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.20 1fbi h ARG 73 Cb 1.06 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.98 1fbi h ARG 73 CO 1.18 0.05 -0.97 -1.71 -1.07 0.00 0.00 179.97 177.44 1fbi n ASN 74 N -3.20 -1.24 0.10 7.04 2.85 0.14 -4.82 115.26 116.13 1fbi n ASN 74 Ca -0.00 -1.27 0.11 0.00 -0.11 0.00 0.00 54.58 53.30 1fbi n ASN 74 Cb 0.28 -1.56 0.45 0.00 1.24 0.00 0.00 39.78 40.20 1fbi n ASN 74 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1fbi n LEU 75 N -4.75 0.54 0.00 1.20 4.77 0.17 -1.94 117.00 116.98 1fbi n LEU 75 Ca -0.23 0.63 0.11 0.00 -0.03 0.00 0.00 56.01 56.49 1fbi n LEU 75 Cb 0.63 -0.54 0.10 0.00 -2.33 0.00 0.00 43.42 41.28 1fbi n LEU 75 CO 0.79 -0.47 0.25 0.00 -1.33 0.00 0.00 177.39 176.63 1fbi n ASN 77 N -1.54 -6.21 -3.64 0.00 5.15 -0.82 -4.93 115.26 103.27 1fbi n ASN 77 Ca 0.05 -0.16 -0.04 0.00 -0.60 0.00 0.00 54.58 53.83 1fbi n ASN 77 Cb 0.34 -2.97 -0.07 0.00 -0.53 0.00 0.00 39.78 36.56 1fbi n ASN 77 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 1fbi s ILE 78 N -2.25 0.00 0.26 -1.44 1.10 -1.26 -5.12 121.20 112.49 1fbi s ILE 78 Ca 0.22 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.08 1fbi s ILE 78 Cb -0.03 -1.00 -0.09 0.00 0.15 0.00 0.00 42.46 41.48 1fbi s ILE 78 CO 0.84 0.00 0.93 -2.16 -2.11 0.00 0.00 174.94 172.44 1fbi s PRO 79 N -0.12 4.77 0.28 3.50 0.04 -1.26 -2.35 135.00 139.85 1fbi s PRO 79 Ca 0.07 1.43 0.01 0.00 0.04 0.00 0.00 61.00 62.55 1fbi s PRO 79 Cb -0.04 -3.16 0.67 0.00 0.04 0.00 0.00 34.50 32.02 1fbi s PRO 79 CO -0.13 0.46 1.67 0.00 0.04 0.00 0.00 177.00 179.04 1fbi h SER 81 N 0.27 0.45 -0.03 0.00 0.02 -1.93 0.87 113.55 113.21 1fbi h SER 81 Ca 0.53 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.56 1fbi h SER 81 Cb 1.03 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 1fbi h SER 81 CO -0.60 0.06 -0.01 0.00 -1.14 0.00 0.00 176.83 175.13 1fbi h ALA 82 N 1.64 1.80 0.00 3.77 0.00 -1.12 0.80 119.26 126.15 1fbi h ALA 82 Ca 0.63 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1fbi h ALA 82 Cb 1.58 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1fbi h ALA 82 CO -0.34 0.16 0.00 -0.07 0.00 0.00 0.00 179.25 179.00 1fbi h LEU 83 N 0.14 0.00 -6.83 0.00 3.38 0.69 -3.36 115.31 109.32 1fbi h LEU 83 Ca 0.03 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.32 1fbi h LEU 83 Cb 0.12 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 40.51 1fbi h LEU 83 CO 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 178.44 178.45 1fbi n GLN 84 N -2.60 2.98 -3.82 1.13 10.64 0.27 -3.88 117.38 122.11 1fbi n GLN 84 Ca 0.03 -4.57 -0.08 0.00 -1.83 0.00 0.00 57.00 50.55 1fbi n GLN 84 Cb 0.36 -2.38 0.02 0.00 -0.86 0.00 0.00 30.24 27.38 1fbi n GLN 84 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 1fbi s SER 85 N -1.39 -0.03 0.00 2.61 1.04 -1.26 -4.90 113.70 109.77 1fbi s SER 85 Ca 0.32 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.70 1fbi s SER 85 Cb 0.03 0.82 0.00 0.00 0.10 0.00 0.00 66.02 66.97 1fbi s SER 85 CO -0.04 -1.62 0.45 -1.20 0.98 0.00 0.00 173.24 171.82 1fbi n SER 86 N -1.28 0.00 -4.35 7.02 7.64 -1.26 -4.67 113.62 116.73 1fbi n SER 86 Ca -0.08 0.45 -0.53 0.00 1.01 0.00 0.00 58.87 59.72 1fbi n SER 86 Cb 0.60 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.68 1fbi n SER 86 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1fbi n ASP 87 N -0.58 0.90 0.02 6.43 2.03 -1.26 -4.81 116.55 119.27 1fbi n ASP 87 Ca 0.00 0.49 0.01 0.00 0.52 0.00 0.00 54.79 55.80 1fbi n ASP 87 Cb 0.00 -0.98 0.04 0.00 -0.72 0.00 0.00 41.12 39.46 1fbi n ASP 87 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fbi n ILE 88 N 6.89 1.38 -0.04 5.18 0.13 -1.26 -3.96 119.36 127.68 1fbi n ILE 88 Ca 0.55 0.52 -0.11 0.00 -1.10 0.00 0.00 62.75 62.62 1fbi n ILE 88 Cb 0.04 -1.52 -0.07 0.00 -0.84 0.00 0.00 39.64 37.24 1fbi n ILE 88 CO 0.00 0.00 0.00 0.74 2.80 0.00 0.00 176.55 180.09 1fbi h THR 89 N 0.00 0.00 0.05 9.51 2.02 -1.95 0.60 112.91 123.14 1fbi h THR 89 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1fbi h THR 89 Cb 0.29 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.65 1fbi h THR 89 CO 0.00 0.00 -0.30 0.00 0.37 0.00 0.00 175.52 175.59 1fbi h ALA 90 N -0.55 -0.46 -0.68 6.16 0.00 -1.83 -2.53 119.26 119.37 1fbi h ALA 90 Ca 0.03 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1fbi h ALA 90 Cb 0.47 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1fbi h ALA 90 CO -0.35 -0.82 0.17 1.15 0.00 0.00 0.00 179.25 179.40 1fbi h THR 91 N -0.47 1.26 0.54 0.00 2.02 -1.79 -2.68 112.91 111.78 1fbi h THR 91 Ca 0.05 -0.95 -0.02 0.00 0.77 0.00 0.00 66.41 66.26 1fbi h THR 91 Cb 0.54 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 1fbi h THR 91 CO -0.22 0.36 -0.48 0.00 0.37 0.00 0.00 175.52 175.55 1fbi h ALA 92 N 1.07 -1.11 0.07 6.16 0.00 -0.72 -2.08 119.26 122.66 1fbi h ALA 92 Ca 0.21 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1fbi h ALA 92 Cb 0.36 0.67 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1fbi h ALA 92 CO 0.00 -1.16 -0.04 -0.91 0.00 0.00 0.00 179.25 177.15 1fbi h ASN 93 N -1.01 -0.08 0.00 0.00 2.35 -1.51 -2.08 115.58 113.25 1fbi h ASN 93 Ca -0.06 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 1fbi h ASN 93 Cb 0.86 0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.26 1fbi h ASN 93 CO -0.03 0.07 0.15 0.00 -1.65 0.00 0.00 177.43 175.97 1fbi h ALA 95 N 1.67 0.30 -0.76 0.00 0.00 -0.63 -3.20 119.26 116.64 1fbi h ALA 95 Ca 0.00 -0.40 0.17 0.00 0.00 0.00 0.00 54.91 54.68 1fbi h ALA 95 Cb 0.30 -0.06 -0.12 0.00 0.00 0.00 0.00 17.79 17.91 1fbi h ALA 95 CO 0.00 0.31 0.15 0.87 0.00 0.00 0.00 179.25 180.58 1fbi h LYS 96 N 0.21 0.22 0.00 0.00 1.57 -0.60 0.29 116.57 118.27 1fbi h LYS 96 Ca 0.02 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1fbi h LYS 96 Cb 0.86 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.12 1fbi h LYS 96 CO 0.07 0.15 -0.07 0.87 -0.57 0.00 0.00 179.45 179.89 1fbi h LYS 97 N 0.23 0.00 0.11 3.15 1.57 -1.60 0.18 116.57 120.20 1fbi h LYS 97 Ca 0.44 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.93 1fbi h LYS 97 Cb 0.77 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.11 1fbi h LYS 97 CO -0.56 0.07 -1.21 0.82 -0.57 0.00 0.00 179.45 177.99 1fbi h ILE 98 N 0.00 1.31 -0.02 1.86 2.04 -0.54 -3.08 117.51 119.09 1fbi h ILE 98 Ca -0.00 -2.51 0.00 0.00 1.00 0.00 0.00 64.86 63.35 1fbi h ILE 98 Cb 0.17 2.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.93 1fbi h ILE 98 CO 0.01 0.76 0.00 0.55 0.00 0.00 0.00 178.15 179.47 1fbi n VAL 99 N -3.76 0.02 -0.43 1.67 3.14 -0.38 -2.20 118.33 116.38 1fbi n VAL 99 Ca -0.12 -0.05 0.05 0.00 -2.96 0.00 0.00 64.34 61.26 1fbi n VAL 99 Cb 0.97 -0.25 0.14 0.00 -1.06 0.00 0.00 33.84 33.64 1fbi n VAL 99 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1fbi n SER 100 N -0.70 2.83 -1.48 6.55 7.64 -0.09 -4.82 113.62 123.55 1fbi n SER 100 Ca 0.19 -2.37 0.00 0.00 1.01 0.00 0.00 58.87 57.70 1fbi n SER 100 Cb 0.13 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1fbi n SER 100 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1fbi n ASP 101 N -0.23 0.00 -0.01 6.43 2.03 -0.93 -5.02 116.55 118.82 1fbi n ASP 101 Ca 0.11 -0.11 -0.01 0.00 0.52 0.00 0.00 54.79 55.31 1fbi n ASP 101 Cb 0.51 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.91 1fbi n ASP 101 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1fbi h GLY 102 N 0.00 -0.05 0.28 0.27 0.00 -1.94 -3.38 103.07 98.26 1fbi h GLY 102 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1fbi h GLY 102 CO 0.00 -0.02 0.00 0.70 0.00 0.00 0.00 176.54 177.22 1fbi n ASN 103 N -3.83 0.00 -0.32 0.19 4.13 -1.26 -4.95 115.26 109.23 1fbi n ASN 103 Ca -0.01 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.25 1fbi n ASN 103 Cb 0.02 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.26 1fbi n ASN 103 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1fbi n GLY 104 N -0.60 -0.69 0.00 7.41 0.00 -1.26 -3.32 105.19 106.74 1fbi n GLY 104 Ca 0.00 -1.09 0.06 0.00 0.00 0.00 0.00 46.02 44.99 1fbi n GLY 104 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1fbi n MET 105 N -0.63 0.18 -0.17 1.61 0.00 -1.26 -2.84 117.12 114.00 1fbi n MET 105 Ca 0.00 0.16 0.02 0.00 -0.00 0.00 0.00 57.70 57.88 1fbi n MET 105 Cb 0.00 -1.50 0.29 0.00 0.00 0.00 0.00 33.22 32.01 1fbi n MET 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 175.97 175.06 1fbi h ASN 106 N 0.00 0.76 0.00 6.12 4.21 -1.96 -1.62 115.58 123.08 1fbi h ASN 106 Ca 0.00 -0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.49 1fbi h ASN 106 Cb 0.09 -0.19 0.00 0.00 -1.12 0.00 0.00 38.32 37.11 1fbi h ASN 106 CO 0.00 0.54 0.03 0.00 -1.29 0.00 0.00 177.43 176.71 1fbi n ALA 107 N -2.43 1.08 0.38 -0.83 0.00 -1.13 -2.06 120.51 115.51 1fbi n ALA 107 Ca 0.08 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.53 1fbi n ALA 107 Cb 0.06 -0.90 0.12 0.00 0.00 0.00 0.00 19.45 18.74 1fbi n ALA 107 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1fbi n TRP 108 N -1.24 0.71 0.00 0.00 8.01 -0.61 -4.96 117.44 119.35 1fbi n TRP 108 Ca 0.00 -0.31 0.00 0.00 -1.31 0.00 0.00 57.50 55.88 1fbi n TRP 108 Cb 0.03 -0.26 0.00 0.00 -2.01 0.00 0.00 31.31 29.07 1fbi n TRP 108 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.69 178.23 1fbi n VAL 109 N 0.18 0.00 -1.76 -0.99 3.14 -0.87 -3.99 118.33 114.03 1fbi n VAL 109 Ca 0.10 0.00 -0.41 0.00 -2.96 0.00 0.00 64.34 61.07 1fbi n VAL 109 Cb 0.59 0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 33.35 1fbi n VAL 109 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1fbi n ALA 110 N 1.35 4.24 0.02 1.55 0.00 -1.26 -2.46 120.51 123.95 1fbi n ALA 110 Ca 0.00 -3.64 0.00 0.00 0.00 0.00 0.00 53.44 49.80 1fbi n ALA 110 Cb 0.00 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 15.88 1fbi n ALA 110 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1fbi n TRP 111 N 7.66 -1.41 -0.37 0.00 -0.00 -1.26 -4.71 117.44 117.35 1fbi n TRP 111 Ca 0.50 0.12 0.29 0.00 -0.00 0.00 0.00 57.50 58.41 1fbi n TRP 111 Cb 0.41 0.50 0.58 0.00 -0.00 0.00 0.00 31.31 32.80 1fbi n TRP 111 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 177.69 177.60 1fbi h ARG 112 N 0.00 0.25 -4.53 5.87 9.65 -1.69 0.42 114.38 124.35 1fbi h ARG 112 Ca 0.00 -0.01 -0.26 0.00 -1.10 0.00 0.00 59.98 58.61 1fbi h ARG 112 Cb 0.00 -0.06 -0.20 0.00 -1.39 0.00 0.00 29.97 28.32 1fbi h ARG 112 CO 0.00 0.16 -0.73 -1.59 2.80 0.00 0.00 179.97 180.62 1fbi s LYS 113 N -5.38 0.55 0.00 0.20 -2.85 -1.25 -4.51 119.74 106.49 1fbi s LYS 113 Ca -0.08 -0.82 0.00 0.00 -1.00 0.00 0.00 55.97 54.07 1fbi s LYS 113 Cb 0.27 -0.25 0.00 0.00 -2.06 0.00 0.00 37.83 35.79 1fbi s LYS 113 CO 0.81 0.03 0.00 1.58 0.10 0.00 0.00 175.35 177.87 1fbi n HIS 114 N 1.29 0.00 -0.10 1.78 -0.00 -1.26 -4.60 115.22 112.34 1fbi n HIS 114 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.50 1fbi n HIS 114 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.54 1fbi n HIS 114 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1fbi s LYS 116 N 0.00 4.28 0.00 0.00 0.00 0.13 -3.37 119.74 120.78 1fbi s LYS 116 Ca 0.00 2.31 0.00 0.00 0.00 0.00 0.00 55.97 58.28 1fbi s LYS 116 Cb 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 37.83 34.77 1fbi s LYS 116 CO 0.00 -0.32 0.00 0.41 0.00 0.00 0.00 175.35 175.44 1fbi n GLY 117 N 1.09 1.45 3.68 0.59 0.00 -1.26 -4.99 105.19 105.75 1fbi n GLY 117 Ca 0.02 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1fbi n GLY 117 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fbi n THR 118 N 0.00 3.59 -2.12 2.61 -2.24 -1.22 -4.78 114.28 110.12 1fbi n THR 118 Ca 0.00 -0.50 -0.32 0.00 -2.27 0.00 0.00 64.05 60.96 1fbi n THR 118 Cb 0.00 -1.41 -0.05 0.00 -2.10 0.00 0.00 70.33 66.77 1fbi n THR 118 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1fbi n ASP 119 N -0.70 3.44 0.14 3.42 2.03 -1.26 -4.70 116.55 118.92 1fbi n ASP 119 Ca 0.11 -2.74 0.08 0.00 0.52 0.00 0.00 54.79 52.76 1fbi n ASP 119 Cb 0.45 -1.72 0.40 0.00 -0.72 0.00 0.00 41.12 39.53 1fbi n ASP 119 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1fbi n VAL 120 N 7.42 0.91 -0.27 5.18 0.24 -1.26 -2.13 118.33 128.41 1fbi n VAL 120 Ca 0.46 0.71 0.33 0.00 -2.04 0.00 0.00 64.34 63.79 1fbi n VAL 120 Cb 0.46 -1.71 0.74 0.00 -1.47 0.00 0.00 33.84 31.86 1fbi n VAL 120 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1fbi h ARG 121 N 0.00 0.01 -0.56 7.34 3.08 -1.90 -0.27 114.38 122.07 1fbi h ARG 121 Ca 0.00 -0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.16 1fbi h ARG 121 Cb 0.31 -0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.27 1fbi h ARG 121 CO 0.00 0.01 0.03 -0.39 -1.07 0.00 0.00 179.97 178.55 1fbi h VAL 122 N 0.01 0.58 -0.06 2.04 -1.51 -1.83 -0.31 116.25 115.16 1fbi h VAL 122 Ca 0.51 -0.05 0.02 0.00 -1.23 0.00 0.00 66.70 65.95 1fbi h VAL 122 Cb 2.04 0.41 -0.00 0.00 -2.13 0.00 0.00 31.29 31.61 1fbi h VAL 122 CO -0.01 0.03 0.15 -0.50 -1.23 0.00 0.00 177.57 176.01 1fbi h TRP 123 N 0.15 0.00 0.00 5.19 4.06 -1.31 0.93 115.95 124.97 1fbi h TRP 123 Ca 0.29 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 61.03 1fbi h TRP 123 Cb 0.45 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.58 1fbi h TRP 123 CO -0.31 0.00 -1.10 0.82 -3.56 0.00 0.00 178.44 174.28 1fbi h ILE 124 N 0.00 1.35 -3.04 1.49 2.04 -1.18 -3.46 117.51 114.70 1fbi h ILE 124 Ca 0.03 -3.03 -0.54 0.00 1.00 0.00 0.00 64.86 62.32 1fbi h ILE 124 Cb 0.33 2.65 0.08 0.00 -0.74 0.00 0.00 36.82 39.15 1fbi h ILE 124 CO -0.00 0.77 0.84 0.29 0.00 0.00 0.00 178.15 180.05 1fbi n LYS 125 N -3.24 2.55 0.00 2.37 4.76 0.32 -2.41 118.16 122.52 1fbi n LYS 125 Ca -0.04 0.91 0.00 0.00 -2.87 0.00 0.00 58.31 56.31 1fbi n LYS 125 Cb 0.93 -2.68 0.00 0.00 -1.84 0.00 0.00 35.03 31.44 1fbi n LYS 125 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1fbi n GLY 126 N 2.43 3.35 0.07 0.72 0.00 -1.26 -4.86 105.19 105.64 1fbi n GLY 126 Ca 0.10 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.05 1fbi n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fbi n ARG 128 N -3.27 -1.00 0.00 0.00 3.00 -1.26 -5.05 116.66 109.08 1fbi n ARG 128 Ca -0.04 1.21 0.00 0.00 -0.00 0.00 0.00 57.85 59.02 1fbi n ARG 128 Cb 0.96 -3.69 0.00 0.00 0.00 0.00 0.00 32.46 29.73 1fbi n ARG 128 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91