#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1flm n LEU 2 N 0.00 3.20 -4.88 3.17 4.77 -1.26 -4.95 117.00 117.05 1flm n LEU 2 Ca 0.00 1.03 -0.30 0.00 -0.03 0.00 0.00 56.01 56.71 1flm n LEU 2 Cb 0.00 -1.38 0.02 0.00 -2.33 0.00 0.00 43.42 39.73 1flm n LEU 2 CO 0.00 -0.20 0.68 -2.16 -1.33 0.00 0.00 177.39 174.38 1flm s PRO 3 N 2.61 3.38 0.27 3.23 0.04 -1.26 -4.95 135.00 138.31 1flm s PRO 3 Ca 0.87 0.56 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1flm s PRO 3 Cb -0.71 -2.12 0.57 0.00 0.04 0.00 0.00 34.50 32.28 1flm s PRO 3 CO 0.46 -0.63 1.75 0.78 0.04 0.00 0.00 177.00 179.40 1flm h GLY 4 N -0.31 1.42 1.76 0.56 0.00 -2.01 -1.15 103.07 103.35 1flm h GLY 4 Ca -0.45 -0.25 0.01 0.00 0.00 0.00 0.00 47.33 46.65 1flm h GLY 4 CO 0.62 -0.07 0.14 -0.84 0.00 0.00 0.00 176.54 176.40 1flm h THR 5 N 0.60 1.04 -0.55 4.70 2.02 -2.00 -1.23 112.91 117.48 1flm h THR 5 Ca 0.48 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.56 1flm h THR 5 Cb 0.72 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 1flm h THR 5 CO -0.39 0.05 0.28 0.15 0.37 0.00 0.00 175.52 175.98 1flm h PHE 6 N 0.26 0.77 -0.06 3.16 3.04 -1.57 -2.01 116.94 120.53 1flm h PHE 6 Ca 0.08 -0.03 -0.06 0.00 3.98 0.00 0.00 57.97 61.94 1flm h PHE 6 Cb 0.02 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 38.27 1flm h PHE 6 CO -0.00 0.58 -0.24 0.74 -2.02 0.00 0.00 178.31 177.37 1flm h PHE 7 N 0.74 0.11 -0.33 0.41 0.04 -1.24 -2.39 116.94 114.29 1flm h PHE 7 Ca 0.19 -0.02 -0.13 0.00 2.80 0.00 0.00 57.97 60.81 1flm h PHE 7 Cb 0.08 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 1flm h PHE 7 CO -0.01 0.34 -0.33 0.93 -0.60 0.00 0.00 178.31 178.65 1flm h GLU 8 N 0.10 0.72 -0.79 1.51 4.39 -0.90 -2.76 114.58 116.85 1flm h GLU 8 Ca 0.02 -0.34 0.06 0.00 0.34 0.00 0.00 59.36 59.44 1flm h GLU 8 Cb 0.48 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.07 1flm h GLU 8 CO 0.03 0.95 0.48 0.28 -1.16 0.00 0.00 179.01 179.59 1flm h VAL 9 N 0.61 1.02 0.00 3.13 2.07 -0.95 -2.69 116.25 119.44 1flm h VAL 9 Ca 0.07 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1flm h VAL 9 Cb 0.85 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1flm h VAL 9 CO 0.07 0.16 0.00 0.18 0.02 0.00 0.00 177.57 178.00 1flm n LEU 10 N -4.67 0.65 0.00 2.57 4.77 -0.94 -1.28 117.00 118.10 1flm n LEU 10 Ca 0.11 0.67 0.08 0.00 -0.03 0.00 0.00 56.01 56.83 1flm n LEU 10 Cb 0.17 -0.59 0.34 0.00 -2.33 0.00 0.00 43.42 41.01 1flm n LEU 10 CO 0.31 -0.58 0.75 0.29 -1.33 0.00 0.00 177.39 176.83 1flm n LYS 11 N -2.23 0.00 -4.34 3.23 5.02 -1.01 -4.68 118.16 114.15 1flm n LYS 11 Ca 0.02 0.23 -0.28 0.00 -2.02 0.00 0.00 58.31 56.26 1flm n LYS 11 Cb 0.22 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.62 1flm n LYS 11 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1flm s ASN 12 N -2.99 3.77 0.51 4.39 0.01 -0.40 -5.10 114.94 115.13 1flm s ASN 12 Ca 0.08 -0.67 -0.12 0.00 -0.71 0.00 0.00 52.86 51.43 1flm s ASN 12 Cb 0.10 -0.46 -0.06 0.00 0.41 0.00 0.00 41.25 41.24 1flm s ASN 12 CO 0.29 0.15 0.92 -0.70 -1.51 0.00 0.00 177.10 176.24 1flm s GLU 13 N -2.42 3.78 0.00 -0.60 2.56 -1.26 -4.61 118.70 116.14 1flm s GLU 13 Ca 0.20 0.70 0.00 0.00 0.00 0.00 0.00 54.97 55.87 1flm s GLU 13 Cb -0.09 -2.21 0.00 0.00 2.00 0.00 0.00 34.13 33.82 1flm s GLU 13 CO 0.11 -0.27 0.00 0.41 -0.56 0.00 0.00 175.26 174.94 1flm n GLY 14 N -1.85 -0.58 3.63 -1.50 0.00 -1.26 -4.92 105.19 98.71 1flm n GLY 14 Ca 0.05 -1.00 -0.37 0.00 0.00 0.00 0.00 46.02 44.70 1flm n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1flm s VAL 15 N -2.00 5.32 -0.03 1.61 1.01 -1.26 -0.51 120.40 124.54 1flm s VAL 15 Ca 0.00 0.25 -0.11 0.00 0.00 0.00 0.00 61.98 62.12 1flm s VAL 15 Cb 0.00 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.79 1flm s VAL 15 CO 0.00 0.29 0.31 -0.69 0.00 0.00 0.00 175.10 175.01 1flm s VAL 16 N 1.41 5.21 -0.02 2.92 1.01 0.22 -4.63 120.40 126.51 1flm s VAL 16 Ca 0.09 0.54 0.06 0.00 0.00 0.00 0.00 61.98 62.66 1flm s VAL 16 Cb -0.15 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 1flm s VAL 16 CO 0.08 0.54 -0.20 0.00 0.00 0.00 0.00 175.10 175.51 1flm s ALA 17 N -1.12 2.42 -0.13 5.51 0.00 -0.46 -2.09 121.76 125.89 1flm s ALA 17 Ca 0.22 -1.07 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 1flm s ALA 17 Cb -0.15 -0.74 0.03 0.00 0.00 0.00 0.00 23.12 22.26 1flm s ALA 17 CO 0.11 0.55 -0.08 0.42 0.00 0.00 0.00 175.76 176.76 1flm s ILE 18 N -0.70 1.13 -0.10 0.00 1.01 0.57 -1.27 121.20 121.84 1flm s ILE 18 Ca 0.11 -0.40 -0.02 0.00 0.00 0.00 0.00 60.65 60.34 1flm s ILE 18 Cb -0.10 -1.16 -0.03 0.00 0.01 0.00 0.00 42.46 41.18 1flm s ILE 18 CO 0.00 0.34 -0.02 0.00 0.00 0.00 0.00 174.94 175.26 1flm s ALA 19 N 1.66 3.15 0.25 9.38 0.00 0.17 -1.48 121.76 134.89 1flm s ALA 19 Ca 0.04 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.22 1flm s ALA 19 Cb -0.13 -1.46 -0.05 0.00 0.00 0.00 0.00 23.12 21.47 1flm s ALA 19 CO -0.09 0.47 -0.03 0.95 0.00 0.00 0.00 175.76 177.07 1flm s THR 20 N -0.50 1.27 -0.23 0.00 -4.23 -0.65 -2.09 115.64 109.21 1flm s THR 20 Ca 0.08 -2.07 -0.15 0.00 -1.18 0.00 0.00 61.69 58.38 1flm s THR 20 Cb -0.12 -2.37 -0.04 0.00 1.34 0.00 0.00 72.50 71.31 1flm s THR 20 CO 0.02 -0.33 0.34 -1.58 -0.54 0.00 0.00 174.62 172.54 1flm s GLN 21 N -3.81 4.11 0.48 3.99 2.00 -1.26 -1.24 119.66 123.94 1flm s GLN 21 Ca 0.28 0.07 0.07 0.00 -2.00 0.00 0.00 55.36 53.78 1flm s GLN 21 Cb 0.05 -3.57 0.01 0.00 0.80 0.00 0.00 33.01 30.31 1flm s GLN 21 CO 0.10 -0.08 0.43 0.20 -0.50 0.00 0.00 175.29 175.44 1flm s GLY 22 N 1.19 2.19 0.49 2.59 0.00 0.33 -4.74 107.32 109.37 1flm s GLY 22 Ca 0.16 -1.69 0.30 0.00 0.00 0.00 0.00 44.72 43.49 1flm s GLY 22 CO 0.08 -1.80 1.87 -2.09 0.00 0.00 0.00 173.10 171.16 1flm h GLU 23 N 0.84 0.00 0.00 2.90 4.81 -1.98 -3.12 114.58 118.03 1flm h GLU 23 Ca -0.38 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1flm h GLU 23 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1flm h GLU 23 CO 0.56 0.00 -1.18 -0.40 -0.73 0.00 0.00 179.01 177.26 1flm n ASP 24 N -2.98 0.71 0.00 1.04 5.75 -1.26 -5.07 116.55 114.73 1flm n ASP 24 Ca 0.02 -0.63 0.00 0.00 -0.01 0.00 0.00 54.79 54.17 1flm n ASP 24 Cb 0.35 1.12 0.00 0.00 -1.03 0.00 0.00 41.12 41.57 1flm n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1flm n GLY 25 N 1.43 0.49 3.72 6.12 0.00 -1.18 -5.13 105.19 110.64 1flm n GLY 25 Ca 0.02 -1.85 -0.30 0.00 0.00 0.00 0.00 46.02 43.90 1flm n GLY 25 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1flm s PRO 26 N -1.36 1.23 0.11 1.61 0.02 -1.26 -0.51 135.00 134.84 1flm s PRO 26 Ca 0.00 0.76 0.06 0.00 0.02 0.00 0.00 61.00 61.83 1flm s PRO 26 Cb 0.00 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.67 1flm s PRO 26 CO 0.00 -2.24 -0.14 -1.58 -0.33 0.00 0.00 177.00 172.71 1flm s HIS 27 N -2.97 1.36 -0.06 6.54 2.46 -0.37 -4.72 115.29 117.53 1flm s HIS 27 Ca 0.63 -0.55 -0.02 0.00 0.47 0.00 0.00 55.06 55.59 1flm s HIS 27 Cb -0.18 -0.72 0.04 0.00 -0.13 0.00 0.00 32.58 31.59 1flm s HIS 27 CO 0.57 0.12 0.10 -1.17 -2.47 0.00 0.00 174.74 171.89 1flm s LEU 28 N -2.35 0.29 0.35 8.88 2.96 -1.26 -1.64 118.68 125.91 1flm s LEU 28 Ca 0.07 0.19 0.03 0.00 -0.22 0.00 0.00 54.13 54.21 1flm s LEU 28 Cb -0.06 0.08 -0.04 0.00 0.50 0.00 0.00 46.19 46.68 1flm s LEU 28 CO 0.03 -0.22 0.12 0.68 -1.32 0.00 0.00 176.35 175.64 1flm s VAL 29 N 1.91 0.66 0.18 1.68 -7.23 -0.55 -4.96 120.40 112.09 1flm s VAL 29 Ca 0.00 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.22 1flm s VAL 29 Cb -0.12 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.24 1flm s VAL 29 CO -0.04 0.00 -0.07 0.20 -0.31 0.00 0.00 175.10 174.88 1flm s ASN 30 N -3.49 1.82 0.01 4.85 -0.87 -1.26 -0.31 114.94 115.69 1flm s ASN 30 Ca 0.31 -1.08 0.00 0.00 -1.57 0.00 0.00 52.86 50.52 1flm s ASN 30 Cb 0.05 -0.00 -0.00 0.00 -0.02 0.00 0.00 41.25 41.28 1flm s ASN 30 CO 0.16 -0.39 0.01 1.07 -2.57 0.00 0.00 177.10 175.38 1flm n THR 31 N -0.27 0.00 -4.33 1.60 5.66 -0.89 -4.99 114.28 111.07 1flm n THR 31 Ca -0.08 -0.06 -0.31 0.00 -3.05 0.00 0.00 64.05 60.54 1flm n THR 31 Cb 0.62 0.04 -0.10 0.00 -1.55 0.00 0.00 70.33 69.34 1flm n THR 31 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 175.07 172.28 1flm s TRP 32 N -3.98 2.93 0.36 1.09 0.52 -1.26 -0.61 118.94 117.98 1flm s TRP 32 Ca 0.01 -0.03 0.11 0.00 0.02 0.00 0.00 56.10 56.21 1flm s TRP 32 Cb -0.00 -1.58 0.88 0.00 -1.15 0.00 0.00 33.47 31.62 1flm s TRP 32 CO 0.01 0.42 1.83 -0.91 0.02 0.00 0.00 176.95 178.31 1flm h ASN 33 N 4.15 0.62 0.74 2.95 4.21 -1.09 -0.85 115.58 126.30 1flm h ASN 33 Ca -0.48 0.06 0.00 0.00 1.21 0.00 0.00 56.30 57.09 1flm h ASN 33 Cb 1.17 -0.05 0.00 0.00 -1.12 0.00 0.00 38.32 38.31 1flm h ASN 33 CO 0.55 0.26 0.00 -1.54 -1.29 0.00 0.00 177.43 175.41 1flm n SER 34 N -4.61 0.00 0.05 5.81 3.41 -1.26 -2.63 113.62 114.38 1flm n SER 34 Ca 0.20 0.31 0.11 0.00 -0.26 0.00 0.00 58.87 59.24 1flm n SER 34 Cb 0.59 -0.43 0.02 0.00 -0.26 0.00 0.00 64.21 64.13 1flm n SER 34 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1flm n TYR 35 N -1.43 0.48 -2.20 7.33 4.02 -0.33 -4.94 117.16 120.09 1flm n TYR 35 Ca 0.08 0.14 -0.41 0.00 -0.01 0.00 0.00 57.90 57.70 1flm n TYR 35 Cb 0.26 -0.62 -0.03 0.00 -0.02 0.00 0.00 39.34 38.93 1flm n TYR 35 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1flm s LEU 36 N -4.43 4.45 -0.17 7.72 1.43 -1.08 -4.59 118.68 122.00 1flm s LEU 36 Ca 0.02 2.56 0.01 0.00 -1.03 0.00 0.00 54.13 55.68 1flm s LEU 36 Cb 0.13 -3.64 0.01 0.00 0.03 0.00 0.00 46.19 42.72 1flm s LEU 36 CO 0.80 -0.45 -0.18 -0.75 0.23 0.00 0.00 176.35 175.99 1flm s LYS 37 N -1.42 3.07 -0.17 1.70 2.47 -0.53 -4.97 119.74 119.88 1flm s LYS 37 Ca 0.49 -0.80 -0.14 0.00 -1.56 0.00 0.00 55.97 53.96 1flm s LYS 37 Cb -0.38 -2.59 -0.05 0.00 -1.46 0.00 0.00 37.83 33.36 1flm s LYS 37 CO 0.48 -0.12 0.30 0.08 0.16 0.00 0.00 175.35 176.25 1flm s VAL 38 N 1.10 5.30 0.28 4.02 1.01 -1.26 -0.40 120.40 130.45 1flm s VAL 38 Ca 0.00 0.54 0.08 0.00 0.00 0.00 0.00 61.98 62.60 1flm s VAL 38 Cb -0.14 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1flm s VAL 38 CO -0.07 0.36 0.12 -0.76 0.00 0.00 0.00 175.10 174.76 1flm s LEU 39 N 0.64 3.46 0.65 3.92 1.43 0.77 -5.02 118.68 124.53 1flm s LEU 39 Ca 0.16 -0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 52.57 1flm s LEU 39 Cb -0.13 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.08 1flm s LEU 39 CO 0.04 -0.10 1.01 0.47 0.23 0.00 0.00 176.35 178.00 1flm n ASP 40 N -1.09 0.86 0.00 2.29 8.00 -1.26 -3.01 116.55 122.34 1flm n ASP 40 Ca -0.06 0.76 0.00 0.00 0.71 0.00 0.00 54.79 56.20 1flm n ASP 40 Cb 0.59 -1.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.27 1flm n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1flm n GLY 41 N 1.19 0.72 3.47 0.44 0.00 -1.26 -4.21 105.19 105.53 1flm n GLY 41 Ca 0.14 -0.70 -0.21 0.00 0.00 0.00 0.00 46.02 45.24 1flm n GLY 41 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1flm n ASN 42 N 1.46 -5.22 -4.43 1.61 3.02 -1.23 -4.82 115.26 105.64 1flm n ASN 42 Ca 0.00 -0.54 -0.33 0.00 -0.03 0.00 0.00 54.58 53.68 1flm n ASN 42 Cb 0.23 -4.87 -0.13 0.00 -0.61 0.00 0.00 39.78 34.40 1flm n ASN 42 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1flm s ARG 43 N -6.03 3.15 -0.12 3.52 0.52 -1.16 -0.87 118.95 117.95 1flm s ARG 43 Ca 0.43 -0.65 0.00 0.00 -0.52 0.00 0.00 55.73 54.99 1flm s ARG 43 Cb -0.19 -2.60 -0.01 0.00 0.52 0.00 0.00 34.95 32.66 1flm s ARG 43 CO 0.70 0.36 -0.14 0.42 0.02 0.00 0.00 175.30 176.65 1flm s ILE 44 N -0.02 2.92 -0.08 1.52 1.01 0.15 -0.17 121.20 126.54 1flm s ILE 44 Ca -0.03 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 59.94 1flm s ILE 44 Cb -0.14 -2.21 -0.02 0.00 0.01 0.00 0.00 42.46 40.09 1flm s ILE 44 CO 0.04 0.53 -0.13 -0.69 0.00 0.00 0.00 174.94 174.69 1flm s VAL 45 N 0.33 3.13 -0.06 2.92 1.01 0.47 -0.21 120.40 127.99 1flm s VAL 45 Ca -0.12 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.25 1flm s VAL 45 Cb -0.16 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 1flm s VAL 45 CO 0.06 0.57 -0.24 -0.69 0.00 0.00 0.00 175.10 174.80 1flm s VAL 46 N -0.42 1.99 -0.01 2.92 1.01 -0.08 -1.46 120.40 124.35 1flm s VAL 46 Ca 0.05 -1.03 -0.30 0.00 0.00 0.00 0.00 61.98 60.70 1flm s VAL 46 Cb -0.12 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 1flm s VAL 46 CO 0.02 0.55 1.06 -2.16 0.00 0.00 0.00 175.10 174.57 1flm s PRO 47 N -0.14 4.48 -0.27 2.72 0.04 -1.26 -1.15 135.00 139.43 1flm s PRO 47 Ca -0.04 1.53 -0.09 0.00 0.04 0.00 0.00 61.00 62.43 1flm s PRO 47 Cb -0.14 -3.46 -0.04 0.00 0.04 0.00 0.00 34.50 30.91 1flm s PRO 47 CO 0.04 -0.19 0.14 0.08 0.04 0.00 0.00 177.00 177.10 1flm s VAL 48 N 1.33 4.84 -0.18 -0.36 1.01 -0.48 -4.92 120.40 121.64 1flm s VAL 48 Ca 0.53 -0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.38 1flm s VAL 48 Cb -0.23 -3.30 -0.08 0.00 0.00 0.00 0.00 36.38 32.77 1flm s VAL 48 CO 0.26 0.27 -0.25 0.61 0.00 0.00 0.00 175.10 175.98 1flm n GLY 49 N 5.00 -0.33 0.00 4.51 0.00 -1.26 -0.48 105.19 112.63 1flm n GLY 49 Ca -0.15 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1flm n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1flm n GLY 50 N 1.82 0.25 4.00 -0.02 0.00 -1.26 -4.69 105.19 105.28 1flm n GLY 50 Ca -0.35 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 1flm n GLY 50 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1flm n MET 51 N 0.00 -4.55 0.03 1.61 2.00 -1.26 -4.90 117.12 110.05 1flm n MET 51 Ca 0.00 0.51 -0.19 0.00 0.00 0.00 0.00 57.70 58.02 1flm n MET 51 Cb 0.00 -5.26 -0.12 0.00 0.00 0.00 0.00 33.22 27.84 1flm n MET 51 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1flm h HIS 52 N -1.87 0.79 -0.32 2.03 3.86 -1.99 -0.66 115.15 117.00 1flm h HIS 52 Ca -0.59 -0.46 -0.15 0.00 -1.16 0.00 0.00 60.37 58.01 1flm h HIS 52 Cb 1.38 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 29.76 1flm h HIS 52 CO 0.58 1.29 -0.40 -0.22 0.86 0.00 0.00 177.93 180.04 1flm h LYS 53 N 0.07 0.78 -0.58 2.45 3.64 -2.00 -2.10 116.57 118.84 1flm h LYS 53 Ca -0.12 -0.41 0.03 0.00 -1.27 0.00 0.00 60.65 58.88 1flm h LYS 53 Cb 1.56 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 33.35 1flm h LYS 53 CO 0.17 1.04 0.35 1.15 -2.27 0.00 0.00 179.45 179.89 1flm h THR 54 N 0.64 1.07 -0.79 1.00 2.02 -1.95 -0.30 112.91 114.59 1flm h THR 54 Ca 0.05 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 1flm h THR 54 Cb 0.96 0.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.64 1flm h THR 54 CO 0.09 0.13 0.47 -0.08 0.37 0.00 0.00 175.52 176.50 1flm h GLU 55 N 0.70 1.07 -0.75 6.66 4.81 -0.90 -0.50 114.58 125.68 1flm h GLU 55 Ca 0.23 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1flm h GLU 55 Cb 0.02 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.14 1flm h GLU 55 CO -0.10 0.76 0.32 0.00 -0.73 0.00 0.00 179.01 179.26 1flm h ALA 56 N 1.25 1.14 -0.33 2.92 0.00 -0.93 -1.54 119.26 121.77 1flm h ALA 56 Ca 0.28 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1flm h ALA 56 Cb -0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1flm h ALA 56 CO -0.05 0.62 0.02 -0.91 0.00 0.00 0.00 179.25 178.93 1flm h ASN 57 N 1.09 0.56 0.16 0.00 2.35 -0.40 -3.02 115.58 116.32 1flm h ASN 57 Ca 0.26 -0.29 -0.06 0.00 -0.55 0.00 0.00 56.30 55.66 1flm h ASN 57 Cb 0.17 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1flm h ASN 57 CO -0.03 0.71 -0.22 0.58 -1.65 0.00 0.00 177.43 176.83 1flm h VAL 58 N 0.39 1.19 0.00 2.81 2.07 -0.83 -1.23 116.25 120.65 1flm h VAL 58 Ca 0.10 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 1flm h VAL 58 Cb 0.41 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1flm h VAL 58 CO 0.01 0.27 -0.09 0.00 0.02 0.00 0.00 177.57 177.78 1flm h ALA 59 N 1.68 1.74 0.00 1.67 0.00 -1.15 -2.99 119.26 120.20 1flm h ALA 59 Ca 0.02 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1flm h ALA 59 Cb 0.45 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1flm h ALA 59 CO 0.03 0.11 -2.02 0.54 0.00 0.00 0.00 179.25 177.92 1flm n ARG 60 N -4.27 0.66 -3.38 0.00 1.74 -0.77 -4.89 116.66 105.75 1flm n ARG 60 Ca -0.03 -0.15 -0.11 0.00 -0.77 0.00 0.00 57.85 56.79 1flm n ARG 60 Cb 0.17 -1.54 -0.09 0.00 -1.02 0.00 0.00 32.46 29.98 1flm n ARG 60 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1flm s ASP 61 N -4.73 0.57 0.00 0.55 -1.08 -0.54 -5.03 116.67 106.41 1flm s ASP 61 Ca -0.08 0.02 0.27 0.00 -0.52 0.00 0.00 52.55 52.24 1flm s ASP 61 Cb 0.12 0.93 1.46 0.00 -1.46 0.00 0.00 42.92 43.98 1flm s ASP 61 CO 0.89 -0.32 1.96 -1.84 0.52 0.00 0.00 175.17 176.38 1flm n GLU 62 N 5.35 1.17 -2.71 4.34 0.00 -1.22 -3.95 120.64 123.62 1flm n GLU 62 Ca -0.04 -0.26 -0.41 0.00 0.00 0.00 0.00 57.16 56.46 1flm n GLU 62 Cb 0.50 -1.43 -0.04 0.00 0.00 0.00 0.00 31.44 30.46 1flm n GLU 62 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1flm s ARG 63 N -1.98 4.69 0.11 3.44 0.52 -1.26 -0.64 118.95 123.82 1flm s ARG 63 Ca 0.40 1.47 0.03 0.00 -0.52 0.00 0.00 55.73 57.11 1flm s ARG 63 Cb 0.19 -3.37 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 1flm s ARG 63 CO 0.32 0.20 -0.08 0.14 0.02 0.00 0.00 175.30 175.89 1flm s VAL 64 N 0.00 0.86 0.05 3.52 -7.23 -0.55 -4.52 120.40 112.53 1flm s VAL 64 Ca 0.47 -1.84 0.08 0.00 -1.81 0.00 0.00 61.98 58.89 1flm s VAL 64 Cb -0.24 -1.57 -0.03 0.00 0.56 0.00 0.00 36.38 35.10 1flm s VAL 64 CO 0.30 -0.73 -0.24 -0.76 -0.31 0.00 0.00 175.10 173.36 1flm s LEU 65 N -2.83 2.18 0.01 1.32 1.43 -0.89 -1.93 118.68 117.97 1flm s LEU 65 Ca 0.10 -0.57 0.01 0.00 -1.03 0.00 0.00 54.13 52.64 1flm s LEU 65 Cb 0.02 -1.13 -0.01 0.00 0.03 0.00 0.00 46.19 45.10 1flm s LEU 65 CO -0.02 0.20 -0.04 -0.32 0.23 0.00 0.00 176.35 176.40 1flm s MET 66 N -1.29 0.32 0.10 1.70 -2.45 0.11 -0.66 119.30 117.14 1flm s MET 66 Ca 0.10 -0.32 0.05 0.00 -1.25 0.00 0.00 55.69 54.27 1flm s MET 66 Cb -0.09 -0.21 -0.03 0.00 1.25 0.00 0.00 34.83 35.75 1flm s MET 66 CO 0.02 0.05 -0.14 0.95 1.05 0.00 0.00 175.02 176.95 1flm s THR 67 N -0.56 1.23 0.16 10.11 -4.23 -0.40 -0.59 115.64 121.37 1flm s THR 67 Ca -0.04 -1.56 -0.23 0.00 -1.18 0.00 0.00 61.69 58.68 1flm s THR 67 Cb -0.04 -1.35 0.07 0.00 1.34 0.00 0.00 72.50 72.51 1flm s THR 67 CO -0.00 -0.35 0.66 -1.48 -0.54 0.00 0.00 174.62 172.90 1flm s LEU 68 N -2.19 -0.49 0.00 4.79 2.34 -1.10 -1.36 118.68 120.68 1flm s LEU 68 Ca 0.05 -0.11 -0.13 0.00 0.06 0.00 0.00 54.13 54.00 1flm s LEU 68 Cb -0.07 2.55 0.04 0.00 -0.56 0.00 0.00 46.19 48.16 1flm s LEU 68 CO 0.02 -0.99 0.59 0.61 -1.06 0.00 0.00 176.35 175.52 1flm n GLY 69 N -0.38 0.69 3.63 -3.48 0.00 -1.26 -1.07 105.19 103.31 1flm n GLY 69 Ca -0.14 -0.99 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 1flm n GLY 69 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1flm s SER 70 N -2.34 -0.76 0.26 1.61 0.15 -0.40 -4.77 113.70 107.45 1flm s SER 70 Ca 0.13 1.42 0.24 0.00 0.70 0.00 0.00 55.95 58.44 1flm s SER 70 Cb -0.01 1.42 0.97 0.00 -1.71 0.00 0.00 66.02 66.69 1flm s SER 70 CO 0.01 -0.24 1.72 -1.14 1.20 0.00 0.00 173.24 174.79 1flm n ARG 71 N 2.92 0.21 -0.03 5.44 3.00 -1.26 -1.87 116.66 125.07 1flm n ARG 71 Ca -0.15 0.41 0.13 0.00 -0.00 0.00 0.00 57.85 58.24 1flm n ARG 71 Cb 0.56 -1.87 0.51 0.00 0.00 0.00 0.00 32.46 31.65 1flm n ARG 71 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1flm n LYS 72 N -2.26 1.63 -5.02 -0.14 5.02 -1.26 -2.91 118.16 113.21 1flm n LYS 72 Ca 0.02 -0.92 -0.32 0.00 -2.02 0.00 0.00 58.31 55.07 1flm n LYS 72 Cb 0.25 -1.45 -0.14 0.00 -0.02 0.00 0.00 35.03 33.67 1flm n LYS 72 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1flm s VAL 73 N -1.93 2.68 0.35 -0.18 1.01 -1.20 -4.94 120.40 116.18 1flm s VAL 73 Ca 0.37 -0.85 -0.27 0.00 0.00 0.00 0.00 61.98 61.23 1flm s VAL 73 Cb 0.20 -2.03 -0.09 0.00 0.00 0.00 0.00 36.38 34.45 1flm s VAL 73 CO 0.31 0.57 1.12 0.00 0.00 0.00 0.00 175.10 177.10 1flm s ALA 74 N -0.42 3.26 0.07 5.51 0.00 -1.26 -0.76 121.76 128.16 1flm s ALA 74 Ca 0.04 0.89 0.00 0.00 0.00 0.00 0.00 51.96 52.89 1flm s ALA 74 Cb -0.12 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1flm s ALA 74 CO 0.02 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.88 1flm n GLY 75 N 0.80 1.71 0.21 0.00 0.00 -0.12 -4.70 105.19 103.09 1flm n GLY 75 Ca 0.02 -2.05 0.08 0.00 0.00 0.00 0.00 46.02 44.07 1flm n GLY 75 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1flm h ARG 76 N 0.00 0.00 0.00 1.61 3.08 -1.84 -3.34 114.38 113.89 1flm h ARG 76 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1flm h ARG 76 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1flm h ARG 76 CO 0.00 0.28 -0.38 0.09 -1.07 0.00 0.00 179.97 178.90 1flm n ASN 77 N -3.39 0.54 0.00 7.04 4.13 -1.26 -5.11 115.26 117.21 1flm n ASN 77 Ca 0.00 -2.23 0.00 0.00 1.68 0.00 0.00 54.58 54.04 1flm n ASN 77 Cb 0.48 -0.25 0.00 0.00 -1.54 0.00 0.00 39.78 38.48 1flm n ASN 77 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1flm n GLY 78 N -0.33 -0.94 3.74 7.41 0.00 -1.26 -5.12 105.19 108.70 1flm n GLY 78 Ca 0.04 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 1flm n GLY 78 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1flm s PRO 79 N -2.00 4.37 0.00 1.61 0.02 -1.26 -0.94 135.00 136.79 1flm s PRO 79 Ca 0.00 2.10 0.00 0.00 0.02 0.00 0.00 61.00 63.12 1flm s PRO 79 Cb 0.00 -3.18 0.00 0.00 0.02 0.00 0.00 34.50 31.34 1flm s PRO 79 CO 0.00 -0.28 0.00 0.41 -0.33 0.00 0.00 177.00 176.80 1flm n GLY 80 N 2.30 2.68 3.66 0.52 0.00 0.06 -4.72 105.19 109.68 1flm n GLY 80 Ca 0.06 -1.44 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 1flm n GLY 80 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1flm s THR 81 N -0.41 0.00 0.05 2.61 -1.32 -0.78 -2.75 115.64 113.05 1flm s THR 81 Ca 0.00 -1.30 -0.23 0.00 -1.21 0.00 0.00 61.69 58.95 1flm s THR 81 Cb 0.00 -2.51 0.08 0.00 -1.51 0.00 0.00 72.50 68.56 1flm s THR 81 CO 0.00 0.00 1.06 0.61 -2.21 0.00 0.00 174.62 174.08 1flm n GLY 82 N -0.49 0.42 3.05 6.08 0.00 -1.26 -1.28 105.19 111.71 1flm n GLY 82 Ca -0.03 -1.06 -0.15 0.00 0.00 0.00 0.00 46.02 44.78 1flm n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1flm s PHE 83 N -2.28 0.73 -0.24 1.61 0.40 -0.24 -1.51 117.98 116.46 1flm s PHE 83 Ca 0.24 -0.38 -0.07 0.00 -0.60 0.00 0.00 56.93 56.12 1flm s PHE 83 Cb -0.01 -0.44 -0.03 0.00 0.51 0.00 0.00 43.02 43.05 1flm s PHE 83 CO 0.02 -0.04 0.06 -1.17 0.70 0.00 0.00 175.22 174.78 1flm s LEU 84 N -1.19 3.43 -0.14 -0.37 2.96 0.08 -2.72 118.68 120.73 1flm s LEU 84 Ca -0.05 -0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 53.64 1flm s LEU 84 Cb -0.08 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.68 1flm s LEU 84 CO 0.00 -0.01 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.33 1flm s ILE 85 N 1.44 3.63 -0.04 6.68 1.01 0.24 -1.10 121.20 133.07 1flm s ILE 85 Ca 0.05 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.27 1flm s ILE 85 Cb -0.15 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.72 1flm s ILE 85 CO 0.03 0.51 -0.09 -0.13 0.00 0.00 0.00 174.94 175.26 1flm s ARG 86 N 0.29 2.60 0.14 2.79 0.52 -0.50 -0.71 118.95 124.08 1flm s ARG 86 Ca -0.05 -0.65 -0.09 0.00 -0.52 0.00 0.00 55.73 54.41 1flm s ARG 86 Cb -0.15 -2.49 0.03 0.00 0.52 0.00 0.00 34.95 32.87 1flm s ARG 86 CO 0.04 0.63 0.45 0.41 0.02 0.00 0.00 175.30 176.84 1flm n GLY 87 N 2.04 1.22 3.44 -3.53 0.00 -0.81 -0.50 105.19 107.05 1flm n GLY 87 Ca -0.17 -1.08 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 1flm n GLY 87 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1flm s SER 88 N -2.10 3.66 0.18 1.61 1.04 -0.62 -1.48 113.70 115.99 1flm s SER 88 Ca 0.09 -0.56 0.11 0.00 0.48 0.00 0.00 55.95 56.07 1flm s SER 88 Cb -0.02 -0.47 -0.04 0.00 0.10 0.00 0.00 66.02 65.59 1flm s SER 88 CO 0.04 0.21 -0.21 0.00 0.98 0.00 0.00 173.24 174.26 1flm s ALA 89 N -1.02 2.61 -0.01 5.32 0.00 0.19 -0.63 121.76 128.22 1flm s ALA 89 Ca 0.15 -1.59 -0.12 0.00 0.00 0.00 0.00 51.96 50.41 1flm s ALA 89 Cb -0.10 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.61 1flm s ALA 89 CO 0.07 0.45 0.24 0.00 0.00 0.00 0.00 175.76 176.52 1flm s ALA 90 N -1.61 -0.60 -0.15 0.00 0.00 -0.54 -4.82 121.76 114.04 1flm s ALA 90 Ca 0.21 0.14 -0.07 0.00 0.00 0.00 0.00 51.96 52.24 1flm s ALA 90 Cb -0.08 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 1flm s ALA 90 CO 0.11 -0.24 0.09 -0.06 0.00 0.00 0.00 175.76 175.66 1flm s PHE 91 N -1.35 3.39 0.01 0.00 0.40 -1.26 -0.36 117.98 118.81 1flm s PHE 91 Ca -0.14 0.30 0.06 0.00 -0.60 0.00 0.00 56.93 56.55 1flm s PHE 91 Cb -0.06 -2.01 -0.02 0.00 0.51 0.00 0.00 43.02 41.44 1flm s PHE 91 CO 0.03 0.42 -0.20 1.03 0.70 0.00 0.00 175.22 177.20 1flm s ARG 92 N -0.27 1.52 0.00 0.44 1.81 0.06 -4.97 118.95 117.55 1flm s ARG 92 Ca 0.09 -0.79 0.06 0.00 -1.72 0.00 0.00 55.73 53.38 1flm s ARG 92 Cb -0.12 -1.52 0.08 0.00 -0.45 0.00 0.00 34.95 32.94 1flm s ARG 92 CO 0.01 0.41 0.83 0.25 -0.68 0.00 0.00 175.30 176.12 1flm n THR 93 N 2.33 0.29 -3.91 0.02 -2.24 -1.26 -0.38 114.28 109.13 1flm n THR 93 Ca -0.16 -0.65 -0.11 0.00 -2.27 0.00 0.00 64.05 60.87 1flm n THR 93 Cb 0.53 0.94 -0.00 0.00 -2.10 0.00 0.00 70.33 69.70 1flm n THR 93 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1flm s ASP 94 N -0.66 0.28 0.00 3.42 -4.77 -1.26 -4.97 116.67 108.72 1flm s ASP 94 Ca 0.09 -1.22 0.00 0.00 -3.30 0.00 0.00 52.55 48.12 1flm s ASP 94 Cb 0.06 0.78 0.00 0.00 -1.09 0.00 0.00 42.92 42.66 1flm s ASP 94 CO 0.08 -1.53 0.00 0.61 0.70 0.00 0.00 175.17 175.03 1flm n GLY 95 N -0.53 0.30 0.25 2.12 0.00 -1.26 -4.15 105.19 101.91 1flm n GLY 95 Ca -0.05 -1.89 0.12 0.00 0.00 0.00 0.00 46.02 44.20 1flm n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1flm h PRO 96 N 0.00 0.00 -0.07 1.61 0.13 -2.01 -0.59 132.00 131.06 1flm h PRO 96 Ca 0.00 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.97 1flm h PRO 96 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1flm h PRO 96 CO 0.00 0.14 -0.66 0.93 -0.23 0.00 0.00 178.00 178.18 1flm h GLU 97 N 0.00 0.30 -0.27 0.86 5.08 -2.00 -1.31 114.58 117.24 1flm h GLU 97 Ca -0.00 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.08 1flm h GLU 97 Cb 0.39 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1flm h GLU 97 CO 0.02 0.85 -0.04 0.35 -1.00 0.00 0.00 179.01 179.19 1flm h PHE 98 N 0.21 0.55 0.00 4.33 3.57 -1.49 -3.06 116.94 121.05 1flm h PHE 98 Ca -0.01 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.36 1flm h PHE 98 Cb 1.20 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.80 1flm h PHE 98 CO 0.03 0.69 -0.08 0.93 -2.23 0.00 0.00 178.31 177.65 1flm h GLU 99 N 0.26 0.00 -0.06 1.11 4.39 -1.04 -0.92 114.58 118.33 1flm h GLU 99 Ca 0.07 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.79 1flm h GLU 99 Cb 0.50 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1flm h GLU 99 CO 0.02 0.08 0.06 0.00 -1.16 0.00 0.00 179.01 178.02 1flm h ALA 100 N 1.92 1.64 0.00 3.43 0.00 -1.13 -2.90 119.26 122.21 1flm h ALA 100 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1flm h ALA 100 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1flm h ALA 100 CO 0.01 -0.09 -0.00 0.44 0.00 0.00 0.00 179.25 179.61 1flm n ILE 101 N -3.87 1.02 0.31 0.00 -6.64 -0.42 -4.73 119.36 105.04 1flm n ILE 101 Ca -0.02 -1.04 0.07 0.00 -1.77 0.00 0.00 62.75 59.99 1flm n ILE 101 Cb 0.16 0.48 0.29 0.00 -1.44 0.00 0.00 39.64 39.13 1flm n ILE 101 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1flm n ALA 102 N -0.53 1.42 0.30 -1.28 0.00 -0.79 -1.25 120.51 118.38 1flm n ALA 102 Ca 0.01 0.02 0.18 0.00 0.00 0.00 0.00 53.44 53.64 1flm n ALA 102 Cb 0.26 -1.21 0.94 0.00 0.00 0.00 0.00 19.45 19.44 1flm n ALA 102 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1flm h ARG 103 N 0.00 0.00 -6.40 0.00 0.11 -1.85 -3.36 114.38 102.88 1flm h ARG 103 Ca 0.00 0.00 -0.58 0.00 0.10 0.00 0.00 59.98 59.50 1flm h ARG 103 Cb 0.18 0.00 -0.09 0.00 1.11 0.00 0.00 29.97 31.17 1flm h ARG 103 CO 0.00 0.04 0.77 -0.06 0.10 0.00 0.00 179.97 180.81 1flm s PHE 104 N -4.16 2.82 -0.40 4.08 0.08 -0.38 -4.89 117.98 115.13 1flm s PHE 104 Ca -0.03 0.47 0.27 0.00 0.12 0.00 0.00 56.93 57.75 1flm s PHE 104 Cb 0.13 -4.24 0.93 0.00 -0.57 0.00 0.00 43.02 39.27 1flm s PHE 104 CO 0.51 -1.26 1.78 0.87 -0.10 0.00 0.00 175.22 177.01 1flm h LYS 105 N 9.23 0.00 -0.00 0.44 1.79 -1.87 -1.68 116.57 124.48 1flm h LYS 105 Ca -0.24 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.23 1flm h LYS 105 Cb 1.07 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.72 1flm h LYS 105 CO 1.09 0.00 -0.05 -2.67 -1.08 0.00 0.00 179.45 176.75 1flm n TRP 106 N -2.58 0.00 -2.69 -1.35 4.27 -1.26 -4.86 117.44 108.97 1flm n TRP 106 Ca 0.03 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.22 1flm n TRP 106 Cb 0.34 -0.24 -0.03 0.00 -1.36 0.00 0.00 31.31 30.02 1flm n TRP 106 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1flm s ALA 107 N -2.54 3.34 -0.52 -1.67 0.00 -0.63 -4.54 121.76 115.21 1flm s ALA 107 Ca 0.29 0.41 0.23 0.00 0.00 0.00 0.00 51.96 52.89 1flm s ALA 107 Cb 0.20 -3.41 0.16 0.00 0.00 0.00 0.00 23.12 20.08 1flm s ALA 107 CO 0.47 -0.51 1.15 2.89 0.00 0.00 0.00 175.76 179.76 1flm n ARG 108 N 4.73 0.38 -3.72 0.00 1.85 0.37 -4.98 116.66 115.28 1flm n ARG 108 Ca 0.08 0.07 -0.05 0.00 -1.00 0.00 0.00 57.85 56.94 1flm n ARG 108 Cb 0.49 -1.69 -0.02 0.00 -1.05 0.00 0.00 32.46 30.19 1flm n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1flm s ALA 109 N -3.23 -1.59 -0.10 2.89 0.00 -1.19 -4.79 121.76 113.74 1flm s ALA 109 Ca 0.04 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.17 1flm s ALA 109 Cb 0.13 0.66 -0.02 0.00 0.00 0.00 0.00 23.12 23.89 1flm s ALA 109 CO 0.76 -0.98 -0.10 0.00 0.00 0.00 0.00 175.76 175.44 1flm s ALA 110 N -3.41 2.80 -0.32 0.00 0.00 0.49 -1.38 121.76 119.95 1flm s ALA 110 Ca 0.10 -0.89 -0.16 0.00 0.00 0.00 0.00 51.96 51.02 1flm s ALA 110 Cb -0.02 -1.23 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 1flm s ALA 110 CO 0.01 0.40 0.39 -1.17 0.00 0.00 0.00 175.76 175.39 1flm s LEU 111 N -0.19 4.28 -0.25 0.00 2.96 -0.30 -0.76 118.68 124.42 1flm s LEU 111 Ca 0.01 -0.01 -0.07 0.00 -0.22 0.00 0.00 54.13 53.85 1flm s LEU 111 Cb -0.13 -2.41 -0.02 0.00 0.50 0.00 0.00 46.19 44.12 1flm s LEU 111 CO 0.03 -0.31 0.05 -0.69 -1.32 0.00 0.00 176.35 174.12 1flm s VAL 112 N 2.10 4.15 -0.22 1.68 1.01 0.52 -0.90 120.40 128.73 1flm s VAL 112 Ca 0.14 -0.25 -0.05 0.00 0.00 0.00 0.00 61.98 61.82 1flm s VAL 112 Cb -0.16 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.25 1flm s VAL 112 CO 0.11 0.34 0.01 -0.63 0.00 0.00 0.00 175.10 174.93 1flm s ILE 113 N 1.59 3.95 -0.26 2.22 1.01 0.70 -1.46 121.20 128.95 1flm s ILE 113 Ca 0.06 -0.30 -0.18 0.00 0.00 0.00 0.00 60.65 60.23 1flm s ILE 113 Cb -0.15 -2.81 -0.03 0.00 0.01 0.00 0.00 42.46 39.48 1flm s ILE 113 CO 0.02 0.40 0.50 -0.89 0.00 0.00 0.00 174.94 174.98 1flm s THR 114 N 1.26 5.08 0.14 2.92 2.01 0.19 -0.68 115.64 126.57 1flm s THR 114 Ca 0.04 0.84 -0.30 0.00 0.31 0.00 0.00 61.69 62.58 1flm s THR 114 Cb -0.15 -3.82 -0.07 0.00 0.01 0.00 0.00 72.50 68.48 1flm s THR 114 CO 0.01 0.09 1.06 -0.69 -0.69 0.00 0.00 174.62 174.40 1flm s VAL 115 N 2.29 4.14 -0.04 3.82 1.01 -0.05 -1.59 120.40 129.97 1flm s VAL 115 Ca 0.20 1.78 0.09 0.00 0.00 0.00 0.00 61.98 64.06 1flm s VAL 115 Cb -0.16 -4.14 -0.14 0.00 0.00 0.00 0.00 36.38 31.95 1flm s VAL 115 CO 0.09 0.28 0.16 1.33 0.00 0.00 0.00 175.10 176.96 1flm n VAL 116 N 2.69 0.20 -3.56 2.92 0.24 0.35 -4.96 118.33 116.21 1flm n VAL 116 Ca 0.03 -0.28 -0.15 0.00 -2.04 0.00 0.00 64.34 61.90 1flm n VAL 116 Cb 0.47 -0.04 -0.06 0.00 -1.47 0.00 0.00 33.84 32.74 1flm n VAL 116 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1flm s SER 117 N -3.46 -0.50 -0.03 -1.34 1.04 -1.04 -4.99 113.70 103.38 1flm s SER 117 Ca -0.04 0.34 -0.00 0.00 0.48 0.00 0.00 55.95 56.73 1flm s SER 117 Cb 0.05 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.70 1flm s SER 117 CO 0.40 -0.67 0.02 0.00 0.98 0.00 0.00 173.24 173.97 1flm s ALA 118 N -2.01 0.25 -0.08 5.32 0.00 -1.26 -1.41 121.76 122.57 1flm s ALA 118 Ca -0.08 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.11 1flm s ALA 118 Cb -0.01 -0.35 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1flm s ALA 118 CO 0.02 -0.15 -0.14 -1.21 0.00 0.00 0.00 175.76 174.28 1flm s GLU 119 N 1.21 2.01 -0.37 0.00 2.02 -0.26 -4.99 118.70 118.32 1flm s GLU 119 Ca -0.07 -0.51 -0.27 0.00 0.02 0.00 0.00 54.97 54.15 1flm s GLU 119 Cb -0.13 -1.66 0.02 0.00 0.10 0.00 0.00 34.13 32.46 1flm s GLU 119 CO -0.02 0.01 0.97 -1.14 0.02 0.00 0.00 175.26 175.10 1flm s GLN 120 N 0.75 3.88 -0.01 1.61 0.74 -1.26 -0.74 119.66 124.63 1flm s GLN 120 Ca -0.12 0.68 0.21 0.00 0.05 0.00 0.00 55.36 56.18 1flm s GLN 120 Cb -0.16 -3.80 0.63 0.00 1.10 0.00 0.00 33.01 30.79 1flm s GLN 120 CO 0.03 -0.97 1.53 0.25 -0.55 0.00 0.00 175.29 175.57 1flm n THR 121 N 6.02 1.08 -1.39 -0.34 -2.24 -0.57 -4.99 114.28 111.87 1flm n THR 121 Ca 0.08 -1.02 0.00 0.00 -2.27 0.00 0.00 64.05 60.84 1flm n THR 121 Cb 0.48 0.46 0.00 0.00 -2.10 0.00 0.00 70.33 69.17 1flm n THR 121 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39