#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l4s n MET 2 N 0.00 2.66 -4.05 -0.78 0.00 -1.26 -3.86 117.12 109.83 1l4s n MET 2 Ca 0.00 0.96 -0.32 0.00 0.00 0.00 0.00 57.70 58.34 1l4s n MET 2 Cb 0.00 -2.98 -0.15 0.00 0.00 0.00 0.00 33.22 30.09 1l4s n MET 2 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1l4s s ASN 3 N 4.87 4.20 -0.18 6.12 2.47 -0.92 -5.05 114.94 126.44 1l4s s ASN 3 Ca 0.91 -1.28 -0.03 0.00 0.42 0.00 0.00 52.86 52.88 1l4s s ASN 3 Cb -0.47 -1.48 -0.02 0.00 -1.45 0.00 0.00 41.25 37.84 1l4s s ASN 3 CO 0.43 -0.18 -0.05 -0.63 -3.72 0.00 0.00 177.10 172.96 1l4s s ILE 4 N 1.17 3.60 0.13 -5.21 1.01 -1.26 0.74 121.20 121.38 1l4s s ILE 4 Ca -0.07 -0.44 0.03 0.00 0.00 0.00 0.00 60.65 60.17 1l4s s ILE 4 Cb -0.19 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 1l4s s ILE 4 CO -0.06 0.46 -0.07 0.42 0.00 0.00 0.00 174.94 175.69 1l4s s THR 5 N 0.86 0.88 -0.27 2.92 -4.23 0.62 -4.90 115.64 111.52 1l4s s THR 5 Ca -0.01 -1.99 -0.25 0.00 -1.18 0.00 0.00 61.69 58.26 1l4s s THR 5 Cb -0.15 -1.80 0.09 0.00 1.34 0.00 0.00 72.50 71.98 1l4s s THR 5 CO 0.01 -0.77 0.85 -0.94 -0.54 0.00 0.00 174.62 173.23 1l4s s SER 6 N -3.11 -0.61 -0.51 3.99 1.04 -1.26 -0.39 113.70 112.84 1l4s s SER 6 Ca 0.15 1.16 0.02 0.00 0.48 0.00 0.00 55.95 57.77 1l4s s SER 6 Cb 0.04 1.17 0.58 0.00 0.10 0.00 0.00 66.02 67.92 1l4s s SER 6 CO -0.02 -0.22 1.92 0.29 0.98 0.00 0.00 173.24 176.19 1l4s n LYS 7 N 2.39 2.40 0.01 4.02 5.02 -1.25 -4.40 118.16 126.36 1l4s n LYS 7 Ca -0.13 -3.14 0.00 0.00 -2.02 0.00 0.00 58.31 53.02 1l4s n LYS 7 Cb 0.55 -2.20 0.00 0.00 -0.02 0.00 0.00 35.03 33.37 1l4s n LYS 7 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1l4s n GLN 8 N -1.06 0.00 -3.23 1.97 1.13 -1.26 -5.07 117.38 109.86 1l4s n GLN 8 Ca 0.59 0.00 -0.15 0.00 -1.94 0.00 0.00 57.00 55.50 1l4s n GLN 8 Cb 1.28 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 31.60 1l4s n GLN 8 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 1l4s n MET 9 N -2.54 1.39 -3.97 -1.09 2.81 -1.26 -5.17 117.12 107.30 1l4s n MET 9 Ca 0.00 -1.71 -0.24 0.00 -1.81 0.00 0.00 57.70 53.94 1l4s n MET 9 Cb 0.00 0.48 -0.05 0.00 -0.71 0.00 0.00 33.22 32.94 1l4s n MET 9 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 1l4s s GLU 10 N -2.84 2.31 -0.39 0.03 1.03 -1.26 -4.58 118.70 112.99 1l4s s GLU 10 Ca 0.01 -1.82 -0.21 0.00 0.03 0.00 0.00 54.97 52.98 1l4s s GLU 10 Cb 0.00 -2.09 0.01 0.00 -0.80 0.00 0.00 34.13 31.26 1l4s s GLU 10 CO 0.00 -0.24 0.65 0.42 -1.33 0.00 0.00 175.26 174.77 1l4s s ILE 11 N -2.61 4.84 0.14 1.83 -1.09 -1.26 -5.03 121.20 118.02 1l4s s ILE 11 Ca 0.40 0.41 0.00 0.00 -2.23 0.00 0.00 60.65 59.23 1l4s s ILE 11 Cb 0.01 -4.15 -0.04 0.00 -1.58 0.00 0.00 42.46 36.70 1l4s s ILE 11 CO 0.23 -0.45 0.30 0.42 -1.23 0.00 0.00 174.94 174.21 1l4s s THR 12 N 2.81 5.29 0.20 2.92 -4.23 -1.26 -4.98 115.64 116.40 1l4s s THR 12 Ca 0.24 -0.45 0.30 0.00 -1.18 0.00 0.00 61.69 60.60 1l4s s THR 12 Cb -0.14 -3.70 0.30 0.00 1.34 0.00 0.00 72.50 70.30 1l4s s THR 12 CO 0.17 -0.04 1.90 -0.65 -0.54 0.00 0.00 174.62 175.46 1l4s h PRO 13 N 2.41 0.00 0.18 3.99 0.11 -1.98 0.31 132.00 137.02 1l4s h PRO 13 Ca -0.47 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.37 1l4s h PRO 13 Cb 1.18 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.31 1l4s h PRO 13 CO 0.71 0.00 -1.21 0.00 -0.21 0.00 0.00 178.00 177.29 1l4s h ALA 14 N 1.86 -0.06 0.00 -0.75 0.00 -1.97 -0.90 119.26 117.44 1l4s h ALA 14 Ca 0.00 -0.85 -0.11 0.00 0.00 0.00 0.00 54.91 53.95 1l4s h ALA 14 Cb 0.12 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1l4s h ALA 14 CO 0.00 0.60 -0.53 0.82 0.00 0.00 0.00 179.25 180.14 1l4s h ILE 15 N -0.15 1.22 -0.02 0.00 2.04 -1.62 0.17 117.51 119.15 1l4s h ILE 15 Ca -0.22 -1.94 -0.10 0.00 1.00 0.00 0.00 64.86 63.60 1l4s h ILE 15 Cb 1.88 2.09 0.01 0.00 -0.74 0.00 0.00 36.82 40.06 1l4s h ILE 15 CO 0.18 0.52 -0.36 0.03 0.00 0.00 0.00 178.15 178.52 1l4s h ARG 16 N 0.00 0.27 -0.44 2.37 2.47 -1.06 -2.57 114.38 115.42 1l4s h ARG 16 Ca -0.01 -0.27 -0.12 0.00 -1.26 0.00 0.00 59.98 58.32 1l4s h ARG 16 Cb 1.05 0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 29.43 1l4s h ARG 16 CO 0.07 0.97 -0.20 0.37 0.56 0.00 0.00 179.97 181.74 1l4s h GLN 17 N -0.31 0.88 0.87 0.04 5.75 -1.09 0.42 115.11 121.67 1l4s h GLN 17 Ca -0.04 -0.35 -0.04 0.00 -0.15 0.00 0.00 58.65 58.07 1l4s h GLN 17 Cb 1.08 -0.04 0.01 0.00 1.07 0.00 0.00 27.48 29.60 1l4s h GLN 17 CO 0.07 1.00 -0.42 1.25 -2.65 0.00 0.00 178.83 178.08 1l4s h HIS 18 N 0.77 -1.08 -0.29 3.99 2.76 -0.72 0.66 115.15 121.24 1l4s h HIS 18 Ca 0.11 -0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.25 1l4s h HIS 18 Cb 0.73 0.36 -0.01 0.00 1.55 0.00 0.00 27.41 30.04 1l4s h HIS 18 CO 0.04 -0.67 0.18 0.28 -1.30 0.00 0.00 177.93 176.46 1l4s h VAL 19 N -1.17 1.10 -0.78 5.26 2.07 -1.49 -2.57 116.25 118.67 1l4s h VAL 19 Ca -0.12 -0.23 0.05 0.00 0.82 0.00 0.00 66.70 67.22 1l4s h VAL 19 Cb 0.89 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 1l4s h VAL 19 CO 0.20 0.10 0.47 0.00 0.02 0.00 0.00 177.57 178.36 1l4s h ALA 20 N 1.07 1.05 -0.33 1.67 0.00 -0.09 -0.88 119.26 121.74 1l4s h ALA 20 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1l4s h ALA 20 Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1l4s h ALA 20 CO -0.02 0.22 0.22 0.38 0.00 0.00 0.00 179.25 180.05 1l4s h ASP 21 N 0.88 0.38 0.90 0.00 3.04 0.66 -0.86 116.42 121.43 1l4s h ASP 21 Ca 0.33 -0.01 -0.13 0.00 -3.24 0.00 0.00 57.03 53.99 1l4s h ASP 21 Cb 0.13 -0.09 -0.02 0.00 -1.04 0.00 0.00 39.33 38.30 1l4s h ASP 21 CO -0.16 0.27 -0.60 0.03 -2.04 0.00 0.00 179.24 176.75 1l4s h ARG 22 N 0.45 0.00 0.23 4.15 2.47 -0.82 -2.88 114.38 117.98 1l4s h ARG 22 Ca 0.12 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.83 1l4s h ARG 22 Cb -0.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.28 1l4s h ARG 22 CO -0.03 0.60 -0.11 -0.07 0.56 0.00 0.00 179.97 180.93 1l4s h LEU 23 N 0.00 -0.26 -2.54 3.04 3.38 -0.16 -1.84 115.31 116.94 1l4s h LEU 23 Ca -0.01 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1l4s h LEU 23 Cb 1.22 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 1l4s h LEU 23 CO 0.08 0.17 0.02 0.00 0.09 0.00 0.00 178.44 178.80 1l4s h ALA 24 N -0.16 1.46 0.02 1.53 0.00 -1.49 -0.09 119.26 120.53 1l4s h ALA 24 Ca -0.03 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 1l4s h ALA 24 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1l4s h ALA 24 CO 0.05 -0.03 -1.02 -0.22 0.00 0.00 0.00 179.25 178.04 1l4s h LYS 25 N 0.00 0.05 -2.85 0.00 3.11 -1.38 -3.35 116.57 112.15 1l4s h LYS 25 Ca 0.01 -0.08 -0.59 0.00 -2.81 0.00 0.00 60.65 57.18 1l4s h LYS 25 Cb 0.05 0.03 0.01 0.00 -1.00 0.00 0.00 32.23 31.33 1l4s h LYS 25 CO -0.00 1.02 3.18 1.28 -2.81 0.00 0.00 179.45 182.11 1l4s n LEU 26 N -3.41 8.14 0.00 5.20 4.77 -0.05 -4.73 117.00 126.92 1l4s n LEU 26 Ca -0.01 -4.15 0.00 0.00 -0.03 0.00 0.00 56.01 51.82 1l4s n LEU 26 Cb 0.93 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.50 1l4s n LEU 26 CO 0.48 1.98 0.37 -0.62 -1.33 0.00 0.00 177.39 178.27 1l4s n GLU 27 N 3.43 0.00 -0.03 3.23 1.02 -1.26 -2.62 120.64 124.41 1l4s n GLU 27 Ca 0.73 0.33 0.24 0.00 -0.02 0.00 0.00 57.16 58.43 1l4s n GLU 27 Cb 0.33 -1.23 0.72 0.00 -0.02 0.00 0.00 31.44 31.24 1l4s n GLU 27 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1l4s h LYS 28 N 0.00 0.00 -1.28 3.49 2.10 -1.96 0.84 116.57 119.76 1l4s h LYS 28 Ca 0.00 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.32 1l4s h LYS 28 Cb 0.00 0.00 -0.16 0.00 -0.90 0.00 0.00 32.23 31.17 1l4s h LYS 28 CO 0.00 0.00 0.43 0.91 -2.00 0.00 0.00 179.45 178.79 1l4s n TRP 29 N -3.89 1.70 -3.18 0.07 7.02 -1.08 -4.36 117.44 113.73 1l4s n TRP 29 Ca 0.12 -1.75 -0.18 0.00 -1.02 0.00 0.00 57.50 54.67 1l4s n TRP 29 Cb 0.80 -0.86 -0.03 0.00 -2.42 0.00 0.00 31.31 28.80 1l4s n TRP 29 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1l4s n GLN 30 N -0.03 1.05 -2.47 -0.99 6.02 0.29 -4.93 117.38 116.31 1l4s n GLN 30 Ca 0.33 -3.43 -0.39 0.00 -0.01 0.00 0.00 57.00 53.50 1l4s n GLN 30 Cb 0.80 -1.73 -0.03 0.00 1.02 0.00 0.00 30.24 30.30 1l4s n GLN 30 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1l4s s THR 31 N -2.50 3.82 0.00 5.09 -4.23 -1.26 -4.75 115.64 111.80 1l4s s THR 31 Ca 0.40 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 60.32 1l4s s THR 31 Cb 0.35 -4.87 0.00 0.00 1.34 0.00 0.00 72.50 69.32 1l4s s THR 31 CO -0.08 -1.77 0.00 1.41 -0.54 0.00 0.00 174.62 173.64 1l4s n HIS 32 N 9.76 0.00 -1.47 3.99 8.25 -1.26 -4.58 115.22 129.92 1l4s n HIS 32 Ca 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.77 1l4s n HIS 32 Cb 0.50 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 1l4s n HIS 32 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1l4s n LEU 33 N 0.00 -1.92 -3.71 2.41 4.77 -1.26 -4.97 117.00 112.32 1l4s n LEU 33 Ca 0.00 2.77 -0.27 0.00 -0.03 0.00 0.00 56.01 58.47 1l4s n LEU 33 Cb 0.00 -2.76 -0.17 0.00 -2.33 0.00 0.00 43.42 38.17 1l4s n LEU 33 CO 0.00 -0.03 -0.36 -0.63 -1.33 0.00 0.00 177.39 175.04 1l4s s ILE 34 N -4.11 0.42 -0.52 -0.08 -1.09 0.17 -4.95 121.20 111.04 1l4s s ILE 34 Ca 0.00 -0.49 -0.19 0.00 -2.23 0.00 0.00 60.65 57.74 1l4s s ILE 34 Cb 0.00 -0.95 0.03 0.00 -1.58 0.00 0.00 42.46 39.95 1l4s s ILE 34 CO 0.00 -0.22 0.63 0.59 -1.23 0.00 0.00 174.94 174.71 1l4s n ASN 35 N 5.09 -6.98 -4.71 3.58 3.02 -1.26 -4.29 115.26 109.70 1l4s n ASN 35 Ca -0.09 0.12 -0.42 0.00 -0.03 0.00 0.00 54.58 54.17 1l4s n ASN 35 Cb 0.47 -4.01 -0.03 0.00 -0.61 0.00 0.00 39.78 35.60 1l4s n ASN 35 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1l4s s PRO 36 N -2.83 4.56 -0.13 3.52 0.04 -1.25 -4.70 135.00 134.20 1l4s s PRO 36 Ca 0.23 1.35 -0.02 0.00 0.04 0.00 0.00 61.00 62.60 1l4s s PRO 36 Cb -0.04 -3.45 -0.03 0.00 0.04 0.00 0.00 34.50 31.02 1l4s s PRO 36 CO 0.81 0.00 -0.05 -1.58 0.04 0.00 0.00 177.00 176.22 1l4s s HIS 37 N 0.84 2.99 -0.07 0.56 2.46 -0.37 -2.18 115.29 119.52 1l4s s HIS 37 Ca 0.49 -0.24 0.05 0.00 0.47 0.00 0.00 55.06 55.83 1l4s s HIS 37 Cb -0.21 -1.89 -0.00 0.00 -0.13 0.00 0.00 32.58 30.35 1l4s s HIS 37 CO 0.27 0.05 -0.23 0.42 -2.47 0.00 0.00 174.74 172.78 1l4s s ILE 38 N 0.06 1.90 -0.02 0.89 -1.09 0.23 -0.70 121.20 122.46 1l4s s ILE 38 Ca -0.01 -0.96 0.06 0.00 -2.23 0.00 0.00 60.65 57.52 1l4s s ILE 38 Cb -0.14 -1.63 -0.01 0.00 -1.58 0.00 0.00 42.46 39.10 1l4s s ILE 38 CO 0.03 0.53 -0.21 -0.63 -1.23 0.00 0.00 174.94 173.43 1l4s s ILE 39 N 0.08 1.66 -0.13 2.92 1.01 0.15 -0.27 121.20 126.61 1l4s s ILE 39 Ca -0.09 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.68 1l4s s ILE 39 Cb -0.15 -1.39 -0.00 0.00 0.01 0.00 0.00 42.46 40.93 1l4s s ILE 39 CO 0.05 0.47 -0.17 -0.76 0.00 0.00 0.00 174.94 174.53 1l4s s LEU 40 N -0.42 2.42 0.00 2.97 2.01 0.48 -0.02 118.68 126.12 1l4s s LEU 40 Ca 0.06 -0.46 0.01 0.00 0.01 0.00 0.00 54.13 53.75 1l4s s LEU 40 Cb -0.09 -1.53 -0.00 0.00 0.01 0.00 0.00 46.19 44.58 1l4s s LEU 40 CO -0.00 0.13 0.03 -1.20 1.01 0.00 0.00 176.35 176.32 1l4s n SER 41 N 3.74 2.10 -3.65 2.29 7.64 0.15 -3.78 113.62 122.12 1l4s n SER 41 Ca -0.19 -2.20 -0.14 0.00 1.01 0.00 0.00 58.87 57.35 1l4s n SER 41 Cb 0.52 0.34 -0.08 0.00 -1.01 0.00 0.00 64.21 63.99 1l4s n SER 41 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1l4s s LYS 42 N -2.94 0.78 0.12 1.43 2.20 -1.26 -2.12 119.74 117.94 1l4s s LYS 42 Ca 0.04 0.91 0.05 0.00 -0.36 0.00 0.00 55.97 56.61 1l4s s LYS 42 Cb 0.00 0.38 -0.04 0.00 -1.51 0.00 0.00 37.83 36.66 1l4s s LYS 42 CO 0.03 -0.10 -0.11 -1.21 -0.36 0.00 0.00 175.35 173.60 1l4s s GLU 43 N 0.33 0.95 0.61 4.03 2.02 0.26 -4.93 118.70 121.96 1l4s s GLU 43 Ca -0.00 -1.25 0.28 0.00 0.02 0.00 0.00 54.97 54.02 1l4s s GLU 43 Cb -0.05 -0.67 1.44 0.00 0.10 0.00 0.00 34.13 34.95 1l4s s GLU 43 CO 0.01 0.11 1.85 -1.35 0.02 0.00 0.00 175.26 175.90 1l4s h PRO 44 N 3.38 0.00 -0.00 0.39 0.11 -2.02 0.54 132.00 134.39 1l4s h PRO 44 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1l4s h PRO 44 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1l4s h PRO 44 CO 0.54 0.00 -0.32 0.94 -0.21 0.00 0.00 178.00 178.95 1l4s n GLN 45 N -3.51 0.54 -2.07 1.05 7.27 -1.26 -5.04 117.38 114.36 1l4s n GLN 45 Ca 0.07 -0.31 0.00 0.00 0.07 0.00 0.00 57.00 56.84 1l4s n GLN 45 Cb 0.68 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.83 1l4s n GLN 45 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1l4s n GLY 46 N 1.39 0.04 3.71 1.69 0.00 0.19 -4.57 105.19 107.64 1l4s n GLY 46 Ca 0.10 -1.51 -0.27 0.00 0.00 0.00 0.00 46.02 44.34 1l4s n GLY 46 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1l4s s PHE 47 N -2.81 2.95 -0.01 1.61 0.40 -0.87 0.92 117.98 120.16 1l4s s PHE 47 Ca 0.00 -0.09 0.05 0.00 -0.60 0.00 0.00 56.93 56.29 1l4s s PHE 47 Cb 0.00 -1.43 -0.01 0.00 0.51 0.00 0.00 43.02 42.09 1l4s s PHE 47 CO 0.00 0.52 -0.16 0.08 0.70 0.00 0.00 175.22 176.36 1l4s s VAL 48 N -1.71 1.24 -0.08 -0.44 1.01 -0.90 -2.74 120.40 116.77 1l4s s VAL 48 Ca 0.28 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1l4s s VAL 48 Cb -0.10 -1.03 0.02 0.00 0.00 0.00 0.00 36.38 35.27 1l4s s VAL 48 CO 0.20 0.35 -0.07 0.00 0.00 0.00 0.00 175.10 175.58 1l4s s ALA 49 N -0.33 1.10 0.09 5.51 0.00 0.63 0.34 121.76 129.09 1l4s s ALA 49 Ca 0.05 -0.36 0.10 0.00 0.00 0.00 0.00 51.96 51.75 1l4s s ALA 49 Cb -0.06 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.30 1l4s s ALA 49 CO -0.00 -0.23 -0.27 -0.51 0.00 0.00 0.00 175.76 174.75 1l4s s ASP 50 N 1.36 3.23 -0.05 0.00 1.11 0.97 -0.65 116.67 122.64 1l4s s ASP 50 Ca -0.02 -0.67 -0.06 0.00 0.18 0.00 0.00 52.55 51.98 1l4s s ASP 50 Cb -0.14 -0.25 0.01 0.00 1.07 0.00 0.00 42.92 43.61 1l4s s ASP 50 CO -0.03 0.22 0.15 0.00 1.18 0.00 0.00 175.17 176.69 1l4s s ALA 51 N -0.93 -0.38 -0.03 5.23 0.00 -0.54 0.29 121.76 125.41 1l4s s ALA 51 Ca 0.13 0.38 0.01 0.00 0.00 0.00 0.00 51.96 52.48 1l4s s ALA 51 Cb -0.10 -0.22 0.02 0.00 0.00 0.00 0.00 23.12 22.82 1l4s s ALA 51 CO 0.04 -0.09 -0.02 0.99 0.00 0.00 0.00 175.76 176.68 1l4s s THR 52 N -0.05 0.33 -0.03 0.00 2.01 0.12 -2.31 115.64 115.71 1l4s s THR 52 Ca -0.01 -0.03 0.02 0.00 0.31 0.00 0.00 61.69 61.98 1l4s s THR 52 Cb -0.02 -0.38 0.00 0.00 0.01 0.00 0.00 72.50 72.11 1l4s s THR 52 CO 0.00 0.17 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.38 1l4s s ILE 53 N 0.81 0.76 -0.25 1.82 1.01 -0.75 -1.24 121.20 123.36 1l4s s ILE 53 Ca -0.09 -0.34 -0.08 0.00 0.00 0.00 0.00 60.65 60.13 1l4s s ILE 53 Cb -0.12 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 1l4s s ILE 53 CO -0.01 0.24 0.10 0.20 0.00 0.00 0.00 174.94 175.48 1l4s s ASN 54 N 0.22 5.44 0.20 3.58 -0.87 -1.26 -1.72 114.94 120.53 1l4s s ASN 54 Ca -0.04 -0.12 0.10 0.00 -1.57 0.00 0.00 52.86 51.24 1l4s s ASN 54 Cb -0.09 -1.98 -0.04 0.00 -0.02 0.00 0.00 41.25 39.12 1l4s s ASN 54 CO 0.00 -0.01 -0.14 0.42 -2.57 0.00 0.00 177.10 174.80 1l4s s THR 55 N 1.51 2.92 -0.74 1.60 -4.23 1.00 0.42 115.64 118.13 1l4s s THR 55 Ca 0.06 -1.83 0.14 0.00 -1.18 0.00 0.00 61.69 58.88 1l4s s THR 55 Cb -0.15 -2.45 0.13 0.00 1.34 0.00 0.00 72.50 71.37 1l4s s THR 55 CO 0.05 -0.15 1.43 -2.65 -0.54 0.00 0.00 174.62 172.76 1l4s n PRO 56 N 0.01 0.07 0.00 3.99 -0.02 -1.26 -1.86 135.00 135.93 1l4s n PRO 56 Ca -0.11 0.43 0.04 0.00 -2.02 0.00 0.00 63.50 61.85 1l4s n PRO 56 Cb 0.56 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 1l4s n PRO 56 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1l4s n ASN 57 N -1.80 1.17 0.00 2.55 3.02 -1.26 -5.10 115.26 113.84 1l4s n ASN 57 Ca 0.01 -1.08 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 1l4s n ASN 57 Cb 0.11 0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 1l4s n ASN 57 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l4s n GLY 58 N 0.81 -1.11 3.09 7.41 0.00 -0.78 -5.15 105.19 109.47 1l4s n GLY 58 Ca 0.04 -1.14 -0.21 0.00 0.00 0.00 0.00 46.02 44.70 1l4s n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l4s s VAL 59 N -3.00 1.03 0.01 1.61 1.01 -1.26 -0.00 120.40 119.80 1l4s s VAL 59 Ca 0.00 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.47 1l4s s VAL 59 Cb 0.00 -0.87 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1l4s s VAL 59 CO 0.00 0.27 -0.23 -0.76 0.00 0.00 0.00 175.10 174.39 1l4s s LEU 60 N -0.36 2.31 0.01 3.92 2.01 -0.70 -5.00 118.68 120.86 1l4s s LEU 60 Ca 0.05 -0.46 -0.01 0.00 0.01 0.00 0.00 54.13 53.72 1l4s s LEU 60 Cb -0.05 -1.39 -0.01 0.00 0.01 0.00 0.00 46.19 44.75 1l4s s LEU 60 CO -0.00 0.29 0.00 0.54 1.01 0.00 0.00 176.35 178.19 1l4s s VAL 61 N -0.76 0.07 0.01 -1.59 0.11 -1.26 -1.81 120.40 115.17 1l4s s VAL 61 Ca 0.12 -0.58 -0.23 0.00 -2.93 0.00 0.00 61.98 58.36 1l4s s VAL 61 Cb -0.10 -0.20 0.05 0.00 -1.53 0.00 0.00 36.38 34.60 1l4s s VAL 61 CO 0.02 -0.32 0.52 0.00 -3.33 0.00 0.00 175.10 171.98 1l4s s ALA 62 N -0.95 -1.32 0.07 1.54 0.00 -0.98 -4.73 121.76 115.40 1l4s s ALA 62 Ca -0.10 0.71 -0.05 0.00 0.00 0.00 0.00 51.96 52.52 1l4s s ALA 62 Cb -0.06 0.23 -0.02 0.00 0.00 0.00 0.00 23.12 23.26 1l4s s ALA 62 CO -0.00 -0.42 0.08 -1.12 0.00 0.00 0.00 175.76 174.29 1l4s s SER 63 N -1.66 0.31 -0.28 0.00 0.01 -1.26 -1.47 113.70 109.36 1l4s s SER 63 Ca -0.08 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.32 1l4s s SER 63 Cb -0.01 0.27 0.17 0.00 0.21 0.00 0.00 66.02 66.66 1l4s s SER 63 CO 0.02 -0.67 0.48 -0.83 0.41 0.00 0.00 173.24 172.65 1l4s s GLY 64 N -2.90 -0.75 -0.60 3.44 0.00 0.18 -4.07 107.32 102.62 1l4s s GLY 64 Ca 0.07 1.00 0.01 0.00 0.00 0.00 0.00 44.72 45.80 1l4s s GLY 64 CO -0.09 3.12 1.69 0.28 0.00 0.00 0.00 173.10 178.10 1l4s n LYS 65 N 5.39 3.03 -1.97 2.90 5.02 -1.26 -0.27 118.16 131.00 1l4s n LYS 65 Ca -0.00 -3.75 -0.32 0.00 -2.02 0.00 0.00 58.31 52.21 1l4s n LYS 65 Cb 0.51 -2.28 0.01 0.00 -0.02 0.00 0.00 35.03 33.26 1l4s n LYS 65 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1l4s s HIS 66 N -3.80 3.14 0.56 2.13 2.46 -1.11 -4.68 115.29 113.99 1l4s s HIS 66 Ca 0.56 1.47 0.24 0.00 0.47 0.00 0.00 55.06 57.79 1l4s s HIS 66 Cb 0.45 -2.92 1.59 0.00 -0.13 0.00 0.00 32.58 31.56 1l4s s HIS 66 CO -0.14 -1.00 2.21 1.49 -2.47 0.00 0.00 174.74 174.83 1l4s h GLU 67 N 0.17 0.00 -5.02 2.88 4.81 -1.81 -2.32 114.58 113.30 1l4s h GLU 67 Ca -0.46 0.00 -0.63 0.00 -0.13 0.00 0.00 59.36 58.14 1l4s h GLU 67 Cb 1.21 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.43 1l4s h GLU 67 CO 0.58 0.00 -0.41 0.34 -0.73 0.00 0.00 179.01 178.79 1l4s s ASP 68 N -6.55 6.12 0.24 1.04 2.15 -1.26 -3.89 116.67 114.52 1l4s s ASP 68 Ca -0.05 0.12 -0.06 0.00 0.43 0.00 0.00 52.55 52.98 1l4s s ASP 68 Cb 0.16 -2.15 0.44 0.00 -0.30 0.00 0.00 42.92 41.06 1l4s s ASP 68 CO 0.60 -0.09 1.66 -0.03 -0.17 0.00 0.00 175.17 177.14 1l4s h MET 69 N 8.22 0.18 -0.54 4.34 1.85 -1.89 0.21 114.93 127.30 1l4s h MET 69 Ca -0.34 -0.01 -0.09 0.00 -0.61 0.00 0.00 59.70 58.65 1l4s h MET 69 Cb 1.18 -0.04 -0.02 0.00 0.43 0.00 0.00 31.60 33.15 1l4s h MET 69 CO 0.59 0.12 -0.03 1.88 -0.40 0.00 0.00 176.91 179.08 1l4s h TYR 70 N 0.18 1.07 -0.59 1.39 0.05 -1.94 -2.41 116.97 114.72 1l4s h TYR 70 Ca 0.40 -0.20 -0.08 0.00 0.05 0.00 0.00 58.73 58.91 1l4s h TYR 70 Cb 0.70 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 38.15 1l4s h TYR 70 CO -0.33 0.98 0.05 1.15 -1.05 0.00 0.00 178.16 178.96 1l4s h THR 71 N 0.85 1.26 0.06 -2.88 2.02 -1.47 -0.93 112.91 111.82 1l4s h THR 71 Ca 0.15 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.29 1l4s h THR 71 Cb 0.57 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1l4s h THR 71 CO 0.03 0.38 -0.03 0.00 0.37 0.00 0.00 175.52 176.27 1l4s h ALA 72 N 1.14 -0.09 -0.57 6.16 0.00 -0.51 0.43 119.26 125.83 1l4s h ALA 72 Ca 0.18 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1l4s h ALA 72 Cb 0.46 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1l4s h ALA 72 CO 0.02 -0.50 0.31 0.82 0.00 0.00 0.00 179.25 179.91 1l4s h ILE 73 N -0.19 1.19 -0.77 0.00 2.04 -1.34 0.17 117.51 118.60 1l4s h ILE 73 Ca -0.01 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.33 1l4s h ILE 73 Cb 0.17 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 1l4s h ILE 73 CO 0.01 0.20 0.28 0.78 0.00 0.00 0.00 178.15 179.43 1l4s h ASN 74 N 0.77 1.08 -0.45 1.72 2.35 -1.00 -2.57 115.58 117.48 1l4s h ASN 74 Ca 0.20 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.69 1l4s h ASN 74 Cb 0.04 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.11 1l4s h ASN 74 CO -0.03 0.97 0.01 -0.33 -1.65 0.00 0.00 177.43 176.40 1l4s h GLU 75 N 1.12 0.80 0.18 0.81 4.39 0.37 -1.49 114.58 120.76 1l4s h GLU 75 Ca 0.25 -0.25 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1l4s h GLU 75 Cb 0.25 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.79 1l4s h GLU 75 CO -0.02 0.85 -0.42 1.25 -1.16 0.00 0.00 179.01 179.51 1l4s h LEU 76 N 0.65 -1.24 -1.97 1.33 6.46 -0.38 1.00 115.31 121.15 1l4s h LEU 76 Ca 0.13 0.12 0.14 0.00 -0.12 0.00 0.00 57.88 58.15 1l4s h LEU 76 Cb 0.49 0.45 -0.02 0.00 -0.73 0.00 0.00 40.66 40.84 1l4s h LEU 76 CO 0.02 -0.48 0.36 0.40 -0.62 0.00 0.00 178.44 178.13 1l4s h ILE 77 N -0.67 0.76 -0.04 4.05 2.04 -1.47 0.63 117.51 122.81 1l4s h ILE 77 Ca -0.02 -0.01 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1l4s h ILE 77 Cb 0.64 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1l4s h ILE 77 CO -0.18 0.01 0.03 -1.13 0.00 0.00 0.00 178.15 176.88 1l4s h ASN 78 N 0.03 0.00 0.76 1.72 -0.73 0.26 -0.66 115.58 116.95 1l4s h ASN 78 Ca 0.24 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 58.19 1l4s h ASN 78 Cb 0.93 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 39.48 1l4s h ASN 78 CO -0.01 0.00 -1.35 0.11 -0.37 0.00 0.00 177.43 175.81 1l4s h LYS 79 N 0.00 0.00 0.03 6.67 6.56 0.14 -2.60 116.57 127.37 1l4s h LYS 79 Ca 0.02 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1l4s h LYS 79 Cb 0.08 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.74 1l4s h LYS 79 CO -0.00 0.54 -0.01 -0.07 -2.06 0.00 0.00 179.45 177.85 1l4s h LEU 80 N 0.00 -0.03 0.07 2.94 3.38 -0.30 0.41 115.31 121.78 1l4s h LEU 80 Ca -0.17 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1l4s h LEU 80 Cb 1.78 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.54 1l4s h LEU 80 CO 0.08 0.16 -0.03 -0.08 0.09 0.00 0.00 178.44 178.66 1l4s h GLU 81 N -0.22 -0.09 -0.22 1.13 4.81 -1.31 0.14 114.58 118.81 1l4s h GLU 81 Ca -0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1l4s h GLU 81 Cb 0.21 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 1l4s h GLU 81 CO 0.01 -0.06 0.01 0.07 -0.73 0.00 0.00 179.01 178.31 1l4s h ARG 82 N -0.09 0.32 -0.08 1.92 0.11 -1.36 -0.77 114.38 114.43 1l4s h ARG 82 Ca -0.01 -0.05 -0.18 0.00 0.10 0.00 0.00 59.98 59.84 1l4s h ARG 82 Cb 0.07 -0.06 0.01 0.00 1.11 0.00 0.00 29.97 31.10 1l4s h ARG 82 CO 0.02 0.34 -0.64 1.96 0.10 0.00 0.00 179.97 181.74 1l4s h GLN 83 N 0.32 0.58 0.00 0.08 4.20 0.26 -3.14 115.11 117.40 1l4s h GLN 83 Ca 0.08 -0.52 -0.05 0.00 0.06 0.00 0.00 58.65 58.22 1l4s h GLN 83 Cb 0.20 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1l4s h GLN 83 CO 0.00 1.14 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.98 1l4s h LEU 84 N 0.19 0.00 -1.82 1.46 3.38 -0.37 -2.06 115.31 116.09 1l4s h LEU 84 Ca -0.06 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1l4s h LEU 84 Cb 1.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 1l4s h LEU 84 CO 0.13 0.26 -0.13 -1.13 0.09 0.00 0.00 178.44 177.65 1l4s h ASN 85 N 0.00 0.00 1.08 -0.43 -0.73 -1.10 -1.13 115.58 113.27 1l4s h ASN 85 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1l4s h ASN 85 Cb 0.47 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.06 1l4s h ASN 85 CO 0.03 0.13 0.00 0.11 -0.37 0.00 0.00 177.43 177.34 1l4s h LYS 86 N 0.00 0.00 0.00 6.67 1.79 -1.39 -2.85 116.57 120.79 1l4s h LYS 86 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1l4s h LYS 86 Cb 0.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 1l4s h LYS 86 CO 0.02 0.00 0.00 -0.07 -1.08 0.00 0.00 179.45 178.32 1l4s h LEU 87 N 0.00 0.00 -0.51 2.94 3.38 -1.28 -2.55 115.31 117.28 1l4s h LEU 87 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1l4s h LEU 87 Cb 0.54 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1l4s h LEU 87 CO 0.00 0.00 -0.24 1.56 0.09 0.00 0.00 178.44 179.85 1l4s h GLN 88 N 0.00 0.00 0.16 1.13 4.20 -1.65 -2.84 115.11 116.11 1l4s h GLN 88 Ca 0.00 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.37 1l4s h GLN 88 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1l4s h GLN 88 CO 0.00 0.24 -1.73 0.45 -0.67 0.00 0.00 178.83 177.12 1l4s h HIS 89 N 0.00 0.62 0.00 2.96 3.86 -1.65 -3.32 115.15 117.62 1l4s h HIS 89 Ca -0.00 -0.45 -0.01 0.00 -1.16 0.00 0.00 60.37 58.75 1l4s h HIS 89 Cb 0.99 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.44 1l4s h HIS 89 CO 0.00 1.60 -0.05 0.87 0.86 0.00 0.00 177.93 181.21 1l4s h LYS 90 N 0.09 0.00 -3.03 2.45 1.79 -1.57 -3.33 116.57 112.97 1l4s h LYS 90 Ca -0.33 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.58 1l4s h LYS 90 Cb 2.07 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 32.74 1l4s h LYS 90 CO 0.16 0.05 3.25 0.41 -1.08 0.00 0.00 179.45 182.24 1l4s n GLY 91 N -0.01 3.87 0.00 3.86 0.00 -1.07 -3.84 105.19 108.00 1l4s n GLY 91 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1l4s n GLY 91 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1l4s n GLU 92 N 3.65 0.42 0.10 1.61 0.28 -1.25 -4.99 120.64 120.45 1l4s n GLU 92 Ca 0.68 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.68 1l4s n GLU 92 Cb 0.25 -0.95 0.00 0.00 1.43 0.00 0.00 31.44 32.18 1l4s n GLU 92 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1l4s n ALA 93 N -2.33 3.00 -1.81 -1.84 0.00 -1.25 -5.15 120.51 111.13 1l4s n ALA 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1l4s n ALA 93 Cb 0.45 0.11 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1l4s n ALA 93 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1l4s n ARG 94 N -3.45 -4.90 0.00 0.00 0.63 -1.26 -5.05 116.66 102.63 1l4s n ARG 94 Ca 0.00 3.52 0.00 0.00 -0.92 0.00 0.00 57.85 60.45 1l4s n ARG 94 Cb 0.01 -3.80 0.00 0.00 0.45 0.00 0.00 32.46 29.13 1l4s n ARG 94 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1l4s n ARG 95 N 1.13 0.00 -2.91 -0.14 1.74 -1.26 -5.10 116.66 110.11 1l4s n ARG 95 Ca 0.00 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.01 1l4s n ARG 95 Cb 0.00 -0.01 0.01 0.00 -1.02 0.00 0.00 32.46 31.44 1l4s n ARG 95 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1l4s n ALA 96 N -2.13 -2.89 -3.37 7.54 0.00 -1.26 -4.99 120.51 113.41 1l4s n ALA 96 Ca 0.00 0.90 -0.37 0.00 0.00 0.00 0.00 53.44 53.97 1l4s n ALA 96 Cb 0.00 -3.26 -0.12 0.00 0.00 0.00 0.00 19.45 16.07 1l4s n ALA 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l4s s ALA 97 N -2.68 3.05 0.32 0.00 0.00 -1.26 -5.09 121.76 116.10 1l4s s ALA 97 Ca 0.20 -1.89 0.08 0.00 0.00 0.00 0.00 51.96 50.34 1l4s s ALA 97 Cb -0.05 -2.28 -0.04 0.00 0.00 0.00 0.00 23.12 20.75 1l4s s ALA 97 CO 0.77 -1.42 0.18 0.95 0.00 0.00 0.00 175.76 176.24 1l4s s THR 98 N 1.35 3.38 1.41 0.00 -4.23 -1.26 -5.12 115.64 111.16 1l4s s THR 98 Ca -0.01 -1.58 -0.23 0.00 -1.18 0.00 0.00 61.69 58.70 1l4s s THR 98 Cb -0.20 -3.08 0.36 0.00 1.34 0.00 0.00 72.50 70.92 1l4s s THR 98 CO 0.01 -0.22 0.95 -0.44 -0.54 0.00 0.00 174.62 174.39 1l4s s SER 99 N -3.88 -0.90 0.04 3.99 0.01 -1.26 -5.04 113.70 106.66 1l4s s SER 99 Ca 0.38 0.81 0.07 0.00 1.31 0.00 0.00 55.95 58.51 1l4s s SER 99 Cb -0.05 -1.13 -0.03 0.00 0.21 0.00 0.00 66.02 65.02 1l4s s SER 99 CO 0.24 -5.26 -0.18 0.68 0.41 0.00 0.00 173.24 169.12 1l4s s VAL 100 N -2.36 2.77 -0.19 3.43 -7.23 -1.26 -5.12 120.40 110.44 1l4s s VAL 100 Ca 0.69 -1.19 -0.03 0.00 -1.81 0.00 0.00 61.98 59.64 1l4s s VAL 100 Cb -0.12 -2.17 -0.01 0.00 0.56 0.00 0.00 36.38 34.64 1l4s s VAL 100 CO 0.57 0.34 -0.07 -0.54 -0.31 0.00 0.00 175.10 175.09 1l4s s LYS 101 N -1.44 3.39 -0.32 4.82 3.01 -1.26 -5.00 119.74 122.95 1l4s s LYS 101 Ca 0.15 -0.64 -0.06 0.00 -1.01 0.00 0.00 55.97 54.41 1l4s s LYS 101 Cb -0.10 -2.87 0.24 0.00 -1.01 0.00 0.00 37.83 34.09 1l4s s LYS 101 CO 0.05 -0.03 1.19 -3.47 0.51 0.00 0.00 175.35 173.60 1l4s n ASP 102 N 4.29 -1.23 -3.63 2.83 2.03 -1.26 -5.07 116.55 114.50 1l4s n ASP 102 Ca -0.18 -1.18 -0.12 0.00 0.52 0.00 0.00 54.79 53.83 1l4s n ASP 102 Cb 0.51 0.64 -0.07 0.00 -0.72 0.00 0.00 41.12 41.48 1l4s n ASP 102 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1l4s s ALA 103 N 0.58 -1.82 -1.39 -1.67 0.00 -1.26 -4.91 121.76 111.29 1l4s s ALA 103 Ca 0.24 2.10 0.00 0.00 0.00 0.00 0.00 51.96 54.31 1l4s s ALA 103 Cb 0.17 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 22.03 1l4s s ALA 103 CO -0.09 -0.34 0.00 0.09 0.00 0.00 0.00 175.76 175.41 1l4s n ASN 104 N 3.01 -5.30 -2.95 0.00 4.13 -1.26 -4.07 115.26 108.82 1l4s n ASN 104 Ca -0.15 0.32 -0.01 0.00 1.68 0.00 0.00 54.58 56.42 1l4s n ASN 104 Cb 0.56 -3.95 -0.01 0.00 -1.54 0.00 0.00 39.78 34.84 1l4s n ASN 104 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1l4s n PHE 105 N -2.38 -1.73 -2.19 3.10 7.35 -1.26 -4.77 117.46 115.58 1l4s n PHE 105 Ca -0.13 0.88 -0.42 0.00 -0.76 0.00 0.00 57.45 57.02 1l4s n PHE 105 Cb 0.55 -2.21 -0.03 0.00 0.35 0.00 0.00 39.48 38.14 1l4s n PHE 105 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1l4s s VAL 106 N -0.81 3.64 -0.00 -2.13 1.01 -1.26 -4.97 120.40 115.88 1l4s s VAL 106 Ca -0.05 0.59 0.00 0.00 0.00 0.00 0.00 61.98 62.52 1l4s s VAL 106 Cb 0.00 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.37 1l4s s VAL 106 CO 0.32 -0.75 0.00 -1.61 0.00 0.00 0.00 175.10 173.06 1l4s s GLU 107 N 5.67 0.02 -0.28 2.72 0.41 -1.26 -5.00 118.70 120.99 1l4s s GLU 107 Ca 0.67 0.01 -0.02 0.00 -0.41 0.00 0.00 54.97 55.22 1l4s s GLU 107 Cb -0.16 -0.06 0.01 0.00 -1.78 0.00 0.00 34.13 32.14 1l4s s GLU 107 CO 0.29 -0.02 0.04 0.39 -0.49 0.00 0.00 175.26 175.48 1l4s n GLU 108 N 3.22 -3.59 -3.73 1.61 -0.58 -1.26 -5.06 120.64 111.25 1l4s n GLU 108 Ca -0.14 2.85 -0.14 0.00 -0.42 0.00 0.00 57.16 59.30 1l4s n GLU 108 Cb 0.59 -5.20 -0.15 0.00 -0.57 0.00 0.00 31.44 26.11 1l4s n GLU 108 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1l4s s VAL 109 N -1.46 -0.09 -1.10 2.62 -7.23 -1.26 -5.08 120.40 106.80 1l4s s VAL 109 Ca -0.04 0.21 -0.06 0.00 -1.81 0.00 0.00 61.98 60.28 1l4s s VAL 109 Cb 0.00 -0.26 0.29 0.00 0.56 0.00 0.00 36.38 36.98 1l4s s VAL 109 CO 0.76 0.09 1.41 1.21 -0.31 0.00 0.00 175.10 178.26 1l4s n GLU 110 N 4.42 4.20 -3.29 4.82 4.07 -1.26 -4.89 120.64 128.71 1l4s n GLU 110 Ca -0.22 -4.48 0.03 0.00 -0.06 0.00 0.00 57.16 52.42 1l4s n GLU 110 Cb 0.51 -2.55 -0.02 0.00 -0.06 0.00 0.00 31.44 29.33 1l4s n GLU 110 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 1l4s s GLU 111 N -2.23 0.46 0.00 5.31 2.12 -1.26 -5.34 118.70 117.77 1l4s s GLU 111 Ca 0.32 0.94 0.22 0.00 0.36 0.00 0.00 54.97 56.80 1l4s s GLU 111 Cb 0.01 0.54 0.17 0.00 0.26 0.00 0.00 34.13 35.11 1l4s s GLU 111 CO 0.05 -0.39 1.19 -0.85 -0.54 0.00 0.00 175.26 174.72