#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l4s s MET 2 N 0.00 4.62 -0.17 1.09 0.00 -1.26 -3.97 119.30 119.60 1l4s s MET 2 Ca 0.00 1.68 0.01 0.00 0.00 0.00 0.00 55.69 57.38 1l4s s MET 2 Cb 0.00 -3.28 0.02 0.00 0.00 0.00 0.00 34.83 31.57 1l4s s MET 2 CO 0.00 0.11 -0.17 1.21 0.00 0.00 0.00 175.02 176.17 1l4s s ASN 3 N -0.16 3.06 -0.16 -1.18 3.84 -0.85 -5.03 114.94 114.46 1l4s s ASN 3 Ca 0.49 -0.65 0.01 0.00 0.21 0.00 0.00 52.86 52.92 1l4s s ASN 3 Cb -0.29 -1.36 0.01 0.00 -0.55 0.00 0.00 41.25 39.06 1l4s s ASN 3 CO 0.34 -0.04 -0.18 -0.63 -2.79 0.00 0.00 177.10 173.80 1l4s s ILE 4 N 1.36 2.34 0.12 -5.21 1.01 -1.26 0.11 121.20 119.67 1l4s s ILE 4 Ca 0.04 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 59.84 1l4s s ILE 4 Cb -0.14 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 1l4s s ILE 4 CO -0.11 0.53 -0.07 0.42 0.00 0.00 0.00 174.94 175.71 1l4s s THR 5 N 0.96 0.81 -0.23 2.92 -4.23 0.62 -4.90 115.64 111.59 1l4s s THR 5 Ca -0.03 -1.97 -0.26 0.00 -1.18 0.00 0.00 61.69 58.25 1l4s s THR 5 Cb -0.15 -1.77 0.10 0.00 1.34 0.00 0.00 72.50 72.02 1l4s s THR 5 CO -0.04 -0.80 0.86 -0.94 -0.54 0.00 0.00 174.62 173.16 1l4s s SER 6 N -3.09 -0.59 -0.41 3.99 1.04 -1.26 0.18 113.70 113.57 1l4s s SER 6 Ca 0.14 1.02 0.06 0.00 0.48 0.00 0.00 55.95 57.65 1l4s s SER 6 Cb 0.05 1.00 0.68 0.00 0.10 0.00 0.00 66.02 67.85 1l4s s SER 6 CO -0.03 -0.27 1.86 0.29 0.98 0.00 0.00 173.24 176.08 1l4s n LYS 7 N 2.06 2.61 0.00 4.02 5.02 -1.25 -4.38 118.16 126.25 1l4s n LYS 7 Ca -0.14 -3.04 0.00 0.00 -2.02 0.00 0.00 58.31 53.11 1l4s n LYS 7 Cb 0.56 -2.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 1l4s n LYS 7 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1l4s n GLN 8 N -0.89 0.00 -3.45 1.97 -0.06 -1.26 -5.09 117.38 108.60 1l4s n GLN 8 Ca 0.54 0.00 -0.20 0.00 -2.00 0.00 0.00 57.00 55.33 1l4s n GLN 8 Cb 1.57 -0.18 -0.02 0.00 -4.06 0.00 0.00 30.24 27.54 1l4s n GLN 8 CO 0.00 0.00 0.00 -1.33 -0.20 0.00 0.00 177.06 175.53 1l4s n MET 9 N -2.11 1.01 -4.61 3.69 2.81 -1.26 -5.16 117.12 111.49 1l4s n MET 9 Ca 0.00 -2.50 -0.27 0.00 -1.81 0.00 0.00 57.70 53.12 1l4s n MET 9 Cb 0.00 0.44 -0.11 0.00 -0.71 0.00 0.00 33.22 32.84 1l4s n MET 9 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1l4s s GLU 10 N -3.47 1.93 -0.62 0.03 2.12 -1.26 -4.57 118.70 112.87 1l4s s GLU 10 Ca 0.13 -2.09 -0.22 0.00 0.36 0.00 0.00 54.97 53.15 1l4s s GLU 10 Cb -0.01 -1.59 0.06 0.00 0.26 0.00 0.00 34.13 32.85 1l4s s GLU 10 CO 0.08 -0.05 0.92 0.42 -0.54 0.00 0.00 175.26 176.10 1l4s s ILE 11 N -2.74 4.40 0.16 -3.70 1.09 -1.26 -5.01 121.20 114.14 1l4s s ILE 11 Ca 0.35 -0.26 -0.04 0.00 -1.10 0.00 0.00 60.65 59.60 1l4s s ILE 11 Cb 0.10 -4.62 -0.05 0.00 -1.06 0.00 0.00 42.46 36.83 1l4s s ILE 11 CO 0.18 -1.32 0.39 0.42 -0.10 0.00 0.00 174.94 174.51 1l4s s THR 12 N 3.87 5.16 0.58 2.92 -4.23 -1.26 -4.94 115.64 117.74 1l4s s THR 12 Ca 0.23 -0.04 0.28 0.00 -1.18 0.00 0.00 61.69 60.98 1l4s s THR 12 Cb -0.16 -3.65 0.37 0.00 1.34 0.00 0.00 72.50 70.40 1l4s s THR 12 CO 0.12 -0.02 2.01 1.55 -0.54 0.00 0.00 174.62 177.73 1l4s h PRO 13 N 2.60 0.00 -0.05 3.99 0.13 -1.97 0.36 132.00 137.06 1l4s h PRO 13 Ca -0.46 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 1l4s h PRO 13 Cb 1.17 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.31 1l4s h PRO 13 CO 0.71 0.00 -0.49 0.00 -0.23 0.00 0.00 178.00 177.99 1l4s h ALA 14 N 1.65 0.13 0.00 -0.56 0.00 -1.97 0.31 119.26 118.82 1l4s h ALA 14 Ca 0.16 -0.52 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 1l4s h ALA 14 Cb 0.84 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1l4s h ALA 14 CO -0.00 0.32 -0.47 0.82 0.00 0.00 0.00 179.25 179.91 1l4s h ILE 15 N -0.06 1.12 0.02 0.00 2.04 -1.53 0.13 117.51 119.24 1l4s h ILE 15 Ca -0.05 -1.76 -0.14 0.00 1.00 0.00 0.00 64.86 63.91 1l4s h ILE 15 Cb 1.17 2.01 0.01 0.00 -0.74 0.00 0.00 36.82 39.28 1l4s h ILE 15 CO 0.10 0.46 -0.56 0.03 0.00 0.00 0.00 178.15 178.18 1l4s h ARG 16 N 0.00 0.35 -0.50 2.37 2.47 -0.33 -2.58 114.38 116.16 1l4s h ARG 16 Ca -0.00 -0.40 -0.12 0.00 -1.26 0.00 0.00 59.98 58.20 1l4s h ARG 16 Cb 0.97 0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 29.40 1l4s h ARG 16 CO 0.06 1.09 -0.15 0.37 0.56 0.00 0.00 179.97 181.90 1l4s h GLN 17 N -0.22 0.98 0.79 0.04 4.15 -0.28 0.42 115.11 120.99 1l4s h GLN 17 Ca -0.08 -0.39 -0.04 0.00 0.77 0.00 0.00 58.65 58.91 1l4s h GLN 17 Cb 1.30 -0.05 0.01 0.00 0.21 0.00 0.00 27.48 28.95 1l4s h GLN 17 CO 0.11 1.07 -0.38 1.25 -1.93 0.00 0.00 178.83 178.94 1l4s h HIS 18 N 0.84 -0.99 -0.21 3.99 2.76 -0.82 0.90 115.15 121.64 1l4s h HIS 18 Ca 0.12 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.27 1l4s h HIS 18 Cb 0.72 0.33 -0.01 0.00 1.55 0.00 0.00 27.41 30.00 1l4s h HIS 18 CO 0.05 -0.61 0.13 0.28 -1.30 0.00 0.00 177.93 176.48 1l4s h VAL 19 N -1.10 1.08 -0.95 5.26 2.07 -1.48 -2.57 116.25 118.56 1l4s h VAL 19 Ca -0.11 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.26 1l4s h VAL 19 Cb 0.82 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 1l4s h VAL 19 CO 0.18 0.07 0.62 0.00 0.02 0.00 0.00 177.57 178.47 1l4s h ALA 20 N 1.04 1.25 -0.53 1.67 0.00 -0.07 -0.53 119.26 122.09 1l4s h ALA 20 Ca 0.07 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1l4s h ALA 20 Cb 0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 1l4s h ALA 20 CO -0.01 0.53 0.35 0.38 0.00 0.00 0.00 179.25 180.49 1l4s h ASP 21 N 1.23 0.59 1.04 0.00 3.04 0.12 -0.33 116.42 122.10 1l4s h ASP 21 Ca 0.37 -0.01 -0.13 0.00 -3.24 0.00 0.00 57.03 54.02 1l4s h ASP 21 Cb -0.04 -0.14 -0.02 0.00 -1.04 0.00 0.00 39.33 38.09 1l4s h ASP 21 CO -0.11 0.42 -0.61 0.03 -2.04 0.00 0.00 179.24 176.93 1l4s h ARG 22 N 0.69 0.00 0.48 4.15 2.47 -0.89 -2.77 114.38 118.51 1l4s h ARG 22 Ca 0.20 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.90 1l4s h ARG 22 Cb -0.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 1l4s h ARG 22 CO -0.05 0.61 -0.23 -0.07 0.56 0.00 0.00 179.97 180.79 1l4s h LEU 23 N 0.00 -0.55 -2.54 3.04 3.38 0.44 -1.53 115.31 117.55 1l4s h LEU 23 Ca -0.01 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1l4s h LEU 23 Cb 1.29 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.19 1l4s h LEU 23 CO 0.08 -0.14 -0.01 0.00 0.09 0.00 0.00 178.44 178.46 1l4s h ALA 24 N -0.89 1.35 0.00 1.53 0.00 -1.39 -0.58 119.26 119.28 1l4s h ALA 24 Ca -0.07 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.63 1l4s h ALA 24 Cb 0.57 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1l4s h ALA 24 CO 0.11 0.02 -0.95 -0.22 0.00 0.00 0.00 179.25 178.20 1l4s h LYS 25 N 0.00 0.00 -2.86 0.00 3.11 -1.42 -3.35 116.57 112.04 1l4s h LYS 25 Ca -0.00 0.00 -0.57 0.00 -2.81 0.00 0.00 60.65 57.27 1l4s h LYS 25 Cb 0.04 0.00 0.01 0.00 -1.00 0.00 0.00 32.23 31.28 1l4s h LYS 25 CO 0.00 0.95 3.07 1.28 -2.81 0.00 0.00 179.45 181.94 1l4s n LEU 26 N -3.38 7.91 0.00 5.20 4.77 -0.23 -4.71 117.00 126.57 1l4s n LEU 26 Ca -0.00 -4.06 0.00 0.00 -0.03 0.00 0.00 56.01 51.92 1l4s n LEU 26 Cb 0.91 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.50 1l4s n LEU 26 CO 0.46 1.91 0.41 -0.62 -1.33 0.00 0.00 177.39 178.23 1l4s n GLU 27 N 3.44 0.00 -0.11 3.23 -0.58 -1.26 -2.78 120.64 122.58 1l4s n GLU 27 Ca 0.70 0.34 0.27 0.00 -0.42 0.00 0.00 57.16 58.05 1l4s n GLU 27 Cb 0.34 -1.33 0.71 0.00 -0.57 0.00 0.00 31.44 30.59 1l4s n GLU 27 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1l4s h LYS 28 N 0.00 0.00 -1.81 3.49 5.09 -1.96 -0.91 116.57 120.47 1l4s h LYS 28 Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 60.65 60.40 1l4s h LYS 28 Cb 0.00 0.00 -0.13 0.00 0.10 0.00 0.00 32.23 32.20 1l4s h LYS 28 CO 0.00 0.00 0.26 0.91 -2.09 0.00 0.00 179.45 178.53 1l4s n TRP 29 N -3.91 1.22 -2.81 0.07 7.02 -1.12 -4.38 117.44 113.52 1l4s n TRP 29 Ca 0.16 -1.81 -0.10 0.00 -1.02 0.00 0.00 57.50 54.73 1l4s n TRP 29 Cb 0.95 -1.16 0.03 0.00 -2.42 0.00 0.00 31.31 28.71 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 0.94 0.76 0.00 -0.99 6.02 -0.35 -4.93 117.38 118.83 1l4s n GLN 30 Ca 0.36 -1.94 0.00 0.00 -0.01 0.00 0.00 57.00 55.42 1l4s n GLN 30 Cb 0.61 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 30.43 1l4s n GLN 30 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1l4s n THR 31 N 1.69 0.00 -3.19 5.09 -2.24 -1.26 -4.79 114.28 109.57 1l4s n THR 31 Ca 0.11 0.19 -0.23 0.00 -2.27 0.00 0.00 64.05 61.85 1l4s n THR 31 Cb 0.61 -0.44 -0.05 0.00 -2.10 0.00 0.00 70.33 68.35 1l4s n THR 31 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1l4s n HIS 32 N -0.72 1.24 -3.35 4.78 -0.00 -1.26 -5.10 115.22 110.82 1l4s n HIS 32 Ca 0.00 -3.82 -0.35 0.00 0.46 0.00 0.00 57.72 54.01 1l4s n HIS 32 Cb 0.00 -0.43 -0.06 0.00 -0.12 0.00 0.00 29.99 29.38 1l4s n HIS 32 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 1l4s s LEU 33 N -2.19 4.30 -0.22 0.27 1.43 -1.26 -3.73 118.68 117.27 1l4s s LEU 33 Ca 0.40 1.07 -0.03 0.00 -1.03 0.00 0.00 54.13 54.54 1l4s s LEU 33 Cb 0.24 -3.39 0.07 0.00 0.03 0.00 0.00 46.19 43.14 1l4s s LEU 33 CO -0.09 0.05 0.06 -0.63 0.23 0.00 0.00 176.35 175.98 1l4s s ILE 34 N -1.55 0.47 -0.63 -0.59 1.01 -0.16 -4.95 121.20 114.81 1l4s s ILE 34 Ca 0.40 -0.68 -0.11 0.00 0.00 0.00 0.00 60.65 60.26 1l4s s ILE 34 Cb -0.14 -1.09 0.02 0.00 0.01 0.00 0.00 42.46 41.25 1l4s s ILE 34 CO 0.20 -0.34 0.65 0.59 0.00 0.00 0.00 174.94 176.03 1l4s n ASN 35 N 5.06 -6.71 -4.72 3.58 4.13 -1.26 -4.28 115.26 111.06 1l4s n ASN 35 Ca -0.07 -0.15 -0.42 0.00 1.68 0.00 0.00 54.58 55.62 1l4s n ASN 35 Cb 0.46 -3.79 -0.03 0.00 -1.54 0.00 0.00 39.78 34.88 1l4s n ASN 35 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1l4s s PRO 36 N -3.27 4.56 -0.16 3.52 0.04 -1.25 -4.72 135.00 133.71 1l4s s PRO 36 Ca 0.13 1.51 -0.05 0.00 0.04 0.00 0.00 61.00 62.64 1l4s s PRO 36 Cb -0.03 -3.41 -0.03 0.00 0.04 0.00 0.00 34.50 31.07 1l4s s PRO 36 CO 0.81 -0.04 -0.01 -1.58 0.04 0.00 0.00 177.00 176.23 1l4s s HIS 37 N 0.78 3.09 -0.07 0.56 2.46 -0.45 -2.01 115.29 119.65 1l4s s HIS 37 Ca 0.52 -0.19 0.05 0.00 0.47 0.00 0.00 55.06 55.91 1l4s s HIS 37 Cb -0.24 -2.00 -0.00 0.00 -0.13 0.00 0.00 32.58 30.21 1l4s s HIS 37 CO 0.29 0.02 -0.23 0.42 -2.47 0.00 0.00 174.74 172.77 1l4s s ILE 38 N 0.38 1.94 0.11 0.89 1.09 0.29 -0.77 121.20 125.14 1l4s s ILE 38 Ca -0.02 -0.98 0.10 0.00 -1.10 0.00 0.00 60.65 58.65 1l4s s ILE 38 Cb -0.14 -1.66 -0.04 0.00 -1.06 0.00 0.00 42.46 39.56 1l4s s ILE 38 CO 0.02 0.54 -0.24 -0.63 -0.10 0.00 0.00 174.94 174.53 1l4s s ILE 39 N 0.08 2.42 -0.10 2.92 1.01 0.16 -0.27 121.20 127.41 1l4s s ILE 39 Ca -0.10 -1.63 0.02 0.00 0.00 0.00 0.00 60.65 58.94 1l4s s ILE 39 Cb -0.15 -2.07 0.01 0.00 0.01 0.00 0.00 42.46 40.26 1l4s s ILE 39 CO 0.05 0.13 -0.16 -0.76 0.00 0.00 0.00 174.94 174.20 1l4s s LEU 40 N -1.97 1.78 0.00 2.97 1.43 0.13 -0.72 118.68 122.29 1l4s s LEU 40 Ca 0.15 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 1l4s s LEU 40 Cb -0.10 -1.10 -0.00 0.00 0.03 0.00 0.00 46.19 45.01 1l4s s LEU 40 CO 0.07 0.04 0.02 -1.20 0.23 0.00 0.00 176.35 175.51 1l4s n SER 41 N 4.03 2.07 -3.63 2.29 7.64 0.16 -3.76 113.62 122.42 1l4s n SER 41 Ca -0.20 -1.88 -0.13 0.00 1.01 0.00 0.00 58.87 57.67 1l4s n SER 41 Cb 0.52 0.23 -0.07 0.00 -1.01 0.00 0.00 64.21 63.88 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 -2.70 0.81 0.13 1.43 2.20 -1.26 -2.28 119.74 118.07 1l4s s LYS 42 Ca 0.03 1.00 0.05 0.00 -0.36 0.00 0.00 55.97 56.69 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 0.02 -0.10 -0.12 -1.21 -0.36 0.00 0.00 175.35 173.58 1l4s s GLU 43 N 0.49 1.00 0.61 4.03 0.41 0.25 -4.93 118.70 120.56 1l4s s GLU 43 Ca -0.01 -1.29 0.28 0.00 -0.41 0.00 0.00 54.97 53.54 1l4s s GLU 43 Cb -0.05 -0.74 1.43 0.00 -1.78 0.00 0.00 34.13 32.99 1l4s s GLU 43 CO -0.01 0.12 1.84 -1.35 -0.49 0.00 0.00 175.26 175.37 1l4s h PRO 44 N 3.28 0.00 -0.01 0.39 0.11 -2.02 0.59 132.00 134.34 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 0.55 0.00 -0.28 0.94 -0.21 0.00 0.00 178.00 179.00 1l4s n GLN 45 N -3.49 0.61 -1.83 1.05 7.27 -1.26 -5.04 117.38 114.69 1l4s n GLN 45 Ca 0.07 -0.33 0.00 0.00 0.07 0.00 0.00 57.00 56.81 1l4s n GLN 45 Cb 0.68 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.84 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 1.37 0.24 3.68 1.69 0.00 0.21 -4.57 105.19 107.80 1l4s n GLY 46 Ca 0.11 -1.54 -0.27 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.92 2.87 -0.02 1.61 0.40 -0.88 0.87 117.98 119.92 1l4s s PHE 47 Ca 0.00 -0.12 0.05 0.00 -0.60 0.00 0.00 56.93 56.25 1l4s s PHE 47 Cb 0.00 -1.39 -0.01 0.00 0.51 0.00 0.00 43.02 42.13 1l4s s PHE 47 CO 0.00 0.52 -0.15 0.08 0.70 0.00 0.00 175.22 176.36 1l4s s VAL 48 N -1.73 1.22 -0.08 -0.44 1.01 -0.97 -2.75 120.40 116.67 1l4s s VAL 48 Ca 0.28 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1l4s s VAL 48 Cb -0.09 -1.02 0.02 0.00 0.00 0.00 0.00 36.38 35.29 1l4s s VAL 48 CO 0.19 0.35 -0.07 0.00 0.00 0.00 0.00 175.10 175.57 1l4s s ALA 49 N -0.30 1.08 0.10 5.51 0.00 0.55 0.37 121.76 129.07 1l4s s ALA 49 Ca 0.05 -0.35 0.10 0.00 0.00 0.00 0.00 51.96 51.76 1l4s s ALA 49 Cb -0.07 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1l4s s ALA 49 CO -0.00 -0.21 -0.24 -0.51 0.00 0.00 0.00 175.76 174.80 1l4s s ASP 50 N 1.32 3.43 -0.05 0.00 1.11 0.10 -0.36 116.67 122.22 1l4s s ASP 50 Ca -0.03 -0.64 -0.06 0.00 0.18 0.00 0.00 52.55 52.00 1l4s s ASP 50 Cb -0.14 -0.33 0.01 0.00 1.07 0.00 0.00 42.92 43.53 1l4s s ASP 50 CO -0.03 0.21 0.15 0.00 1.18 0.00 0.00 175.17 176.68 1l4s s ALA 51 N -0.99 -0.37 -0.04 5.23 0.00 -0.35 0.39 121.76 125.64 1l4s s ALA 51 Ca 0.14 0.35 0.01 0.00 0.00 0.00 0.00 51.96 52.46 1l4s s ALA 51 Cb -0.10 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 22.84 1l4s s ALA 51 CO 0.06 -0.09 -0.03 0.99 0.00 0.00 0.00 175.76 176.69 1l4s s THR 52 N -0.13 0.39 -0.04 0.00 2.01 0.05 -2.24 115.64 115.69 1l4s s THR 52 Ca -0.02 -0.05 0.03 0.00 0.31 0.00 0.00 61.69 61.96 1l4s s THR 52 Cb -0.02 -0.44 0.01 0.00 0.01 0.00 0.00 72.50 72.06 1l4s s THR 52 CO 0.00 0.19 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.38 1l4s s ILE 53 N 0.89 0.95 -0.15 1.82 1.01 -0.97 -1.35 121.20 123.41 1l4s s ILE 53 Ca -0.11 -0.43 -0.06 0.00 0.00 0.00 0.00 60.65 60.05 1l4s s ILE 53 Cb -0.14 -0.85 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 1l4s s ILE 53 CO -0.00 0.30 0.05 0.20 0.00 0.00 0.00 174.94 175.48 1l4s s ASN 54 N 0.30 5.59 -0.02 3.58 -0.87 -1.26 -2.01 114.94 120.25 1l4s s ASN 54 Ca -0.06 0.14 0.02 0.00 -1.57 0.00 0.00 52.86 51.38 1l4s s ASN 54 Cb -0.11 -1.86 0.01 0.00 -0.02 0.00 0.00 41.25 39.27 1l4s s ASN 54 CO 0.01 0.25 -0.06 0.42 -2.57 0.00 0.00 177.10 175.15 1l4s s THR 55 N -0.10 0.57 0.65 1.60 -4.23 0.16 -0.99 115.64 113.31 1l4s s THR 55 Ca 0.06 -0.23 0.15 0.00 -1.18 0.00 0.00 61.69 60.50 1l4s s THR 55 Cb -0.12 -0.53 0.17 0.00 1.34 0.00 0.00 72.50 73.36 1l4s s THR 55 CO 0.01 0.19 1.43 -0.65 -0.54 0.00 0.00 174.62 175.07 1l4s h PRO 56 N 6.52 0.00 -0.26 3.99 0.11 -1.97 0.91 132.00 141.30 1l4s h PRO 56 Ca -0.34 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 1l4s h PRO 56 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1l4s h PRO 56 CO 0.49 0.00 -0.00 0.09 -0.21 0.00 0.00 178.00 178.37 1l4s n ASN 57 N -2.79 3.73 0.00 -2.05 4.13 -1.26 -5.07 115.26 111.95 1l4s n ASN 57 Ca 0.02 -3.08 0.00 0.00 1.68 0.00 0.00 54.58 53.20 1l4s n ASN 57 Cb 0.79 -0.55 0.00 0.00 -1.54 0.00 0.00 39.78 38.48 1l4s n ASN 57 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1l4s n GLY 58 N -0.60 0.63 3.01 7.41 0.00 0.32 -5.13 105.19 110.83 1l4s n GLY 58 Ca 0.22 -1.85 -0.12 0.00 0.00 0.00 0.00 46.02 44.27 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 -1.65 -0.00 0.18 1.61 1.01 -1.26 0.37 120.40 120.66 1l4s s VAL 59 Ca 0.00 0.01 0.10 0.00 0.00 0.00 0.00 61.98 62.09 1l4s s VAL 59 Cb 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 1l4s s VAL 59 CO 0.00 0.00 -0.19 -0.76 0.00 0.00 0.00 175.10 174.15 1l4s s LEU 60 N 0.12 2.63 0.01 3.92 1.02 -0.85 -5.01 118.68 120.50 1l4s s LEU 60 Ca -0.00 -0.74 -0.01 0.00 0.02 0.00 0.00 54.13 53.40 1l4s s LEU 60 Cb -0.01 -1.36 -0.01 0.00 0.02 0.00 0.00 46.19 44.82 1l4s s LEU 60 CO -0.00 0.12 0.00 -0.69 0.02 0.00 0.00 176.35 175.80 1l4s s VAL 61 N -1.61 0.06 0.01 -1.59 1.01 -1.26 -2.28 120.40 114.74 1l4s s VAL 61 Ca 0.22 -0.50 -0.19 0.00 0.00 0.00 0.00 61.98 61.50 1l4s s VAL 61 Cb -0.08 -0.17 0.04 0.00 0.00 0.00 0.00 36.38 36.16 1l4s s VAL 61 CO 0.11 -0.28 0.42 0.00 0.00 0.00 0.00 175.10 175.36 1l4s s ALA 62 N -0.82 -1.06 0.06 5.51 0.00 -0.95 -4.84 121.76 119.67 1l4s s ALA 62 Ca -0.09 0.47 -0.07 0.00 0.00 0.00 0.00 51.96 52.28 1l4s s ALA 62 Cb -0.06 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.27 1l4s s ALA 62 CO -0.00 -0.38 0.13 0.45 0.00 0.00 0.00 175.76 175.95 1l4s s SER 63 N -1.67 0.19 -0.27 0.00 0.15 -1.26 -1.21 113.70 109.63 1l4s s SER 63 Ca -0.09 -0.65 -0.01 0.00 0.70 0.00 0.00 55.95 55.91 1l4s s SER 63 Cb -0.02 0.28 0.15 0.00 -1.71 0.00 0.00 66.02 64.72 1l4s s SER 63 CO 0.02 -0.63 0.39 -0.83 1.20 0.00 0.00 173.24 173.39 1l4s s GLY 64 N -2.59 -0.48 -0.62 9.45 0.00 0.51 -4.29 107.32 109.30 1l4s s GLY 64 Ca 0.02 0.57 0.01 0.00 0.00 0.00 0.00 44.72 45.31 1l4s s GLY 64 CO -0.08 2.84 1.74 0.28 0.00 0.00 0.00 173.10 177.87 1l4s n LYS 65 N 5.36 2.99 -1.95 2.90 5.02 -1.26 -0.33 118.16 130.89 1l4s n LYS 65 Ca -0.02 -3.71 -0.32 0.00 -2.02 0.00 0.00 58.31 52.24 1l4s n LYS 65 Cb 0.50 -2.28 0.02 0.00 -0.02 0.00 0.00 35.03 33.25 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 -3.82 3.11 0.54 2.13 2.46 -1.11 -4.67 115.29 113.92 1l4s s HIS 66 Ca 0.56 1.47 0.20 0.00 0.47 0.00 0.00 55.06 57.76 1l4s s HIS 66 Cb 0.45 -2.93 1.43 0.00 -0.13 0.00 0.00 32.58 31.40 1l4s s HIS 66 CO -0.16 -1.04 2.17 1.49 -2.47 0.00 0.00 174.74 174.73 1l4s h GLU 67 N 0.14 0.00 -5.01 2.88 4.81 -1.81 -2.34 114.58 113.25 1l4s h GLU 67 Ca -0.46 0.00 -0.64 0.00 -0.13 0.00 0.00 59.36 58.13 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 -0.38 0.34 -0.73 0.00 0.00 179.01 178.82 1l4s s ASP 68 N -6.74 6.13 0.24 1.04 -1.08 -1.26 -3.88 116.67 111.11 1l4s s ASP 68 Ca -0.05 0.09 -0.07 0.00 -0.52 0.00 0.00 52.55 52.01 1l4s s ASP 68 Cb 0.17 -2.16 0.43 0.00 -1.46 0.00 0.00 42.92 39.89 1l4s s ASP 68 CO 0.64 -0.13 1.66 -0.03 0.52 0.00 0.00 175.17 177.82 1l4s h MET 69 N 8.29 0.16 -0.46 4.34 1.85 -1.89 0.39 114.93 127.60 1l4s h MET 69 Ca -0.33 -0.01 -0.08 0.00 -0.61 0.00 0.00 59.70 58.67 1l4s h MET 69 Cb 1.17 -0.04 -0.02 0.00 0.43 0.00 0.00 31.60 33.15 1l4s h MET 69 CO 0.60 0.10 -0.02 1.88 -0.40 0.00 0.00 176.91 179.07 1l4s h TYR 70 N 0.16 0.91 -0.50 1.39 -1.99 -1.94 -2.31 116.97 112.69 1l4s h TYR 70 Ca 0.40 -0.17 -0.08 0.00 2.00 0.00 0.00 58.73 60.89 1l4s h TYR 70 Cb 0.70 -0.23 -0.02 0.00 2.00 0.00 0.00 36.73 39.17 1l4s h TYR 70 CO -0.35 0.88 0.00 1.15 -0.00 0.00 0.00 178.16 179.84 1l4s h THR 71 N 0.68 1.25 0.05 -2.88 2.02 -1.48 -1.04 112.91 111.52 1l4s h THR 71 Ca 0.13 -1.02 -0.00 0.00 0.77 0.00 0.00 66.41 66.28 1l4s h THR 71 Cb 0.53 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1l4s h THR 71 CO 0.03 0.36 -0.03 0.00 0.37 0.00 0.00 175.52 176.26 1l4s h ALA 72 N 1.22 -0.07 -0.77 6.16 0.00 -0.15 0.47 119.26 126.12 1l4s h ALA 72 Ca 0.15 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1l4s h ALA 72 Cb 0.47 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1l4s h ALA 72 CO 0.02 -0.48 0.40 0.82 0.00 0.00 0.00 179.25 180.01 1l4s h ILE 73 N -0.19 1.24 -0.62 0.00 2.04 -1.31 0.21 117.51 118.87 1l4s h ILE 73 Ca -0.01 -0.63 -0.06 0.00 1.00 0.00 0.00 64.86 65.16 1l4s h ILE 73 Cb 0.17 0.24 -0.03 0.00 -0.74 0.00 0.00 36.82 36.46 1l4s h ILE 73 CO 0.01 0.27 0.16 0.78 0.00 0.00 0.00 178.15 179.38 1l4s h ASN 74 N 1.07 0.94 -0.56 1.72 4.21 -0.97 -2.54 115.58 119.45 1l4s h ASN 74 Ca 0.27 -0.23 -0.10 0.00 1.21 0.00 0.00 56.30 57.45 1l4s h ASN 74 Cb 0.07 -0.25 -0.02 0.00 -1.12 0.00 0.00 38.32 37.01 1l4s h ASN 74 CO -0.04 0.92 -0.03 -0.33 -1.29 0.00 0.00 177.43 176.66 1l4s h GLU 75 N 0.91 1.02 0.32 0.81 4.39 0.47 -1.83 114.58 120.68 1l4s h GLU 75 Ca 0.20 -0.33 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 1l4s h GLU 75 Cb 0.34 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 1l4s h GLU 75 CO -0.00 1.02 -0.32 1.25 -1.16 0.00 0.00 179.01 179.79 1l4s h LEU 76 N 0.93 -0.89 -2.06 1.33 6.46 -0.30 -0.78 115.31 120.00 1l4s h LEU 76 Ca 0.16 0.07 0.11 0.00 -0.12 0.00 0.00 57.88 58.10 1l4s h LEU 76 Cb 0.58 0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 40.78 1l4s h LEU 76 CO 0.03 -0.43 0.35 0.40 -0.62 0.00 0.00 178.44 178.18 1l4s h ILE 77 N -0.64 0.50 -0.99 4.05 2.04 -1.48 0.37 117.51 121.37 1l4s h ILE 77 Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.84 1l4s h ILE 77 Cb 0.56 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 37.32 1l4s h ILE 77 CO -0.04 0.00 0.65 -1.13 0.00 0.00 0.00 178.15 177.63 1l4s h ASN 78 N 0.00 1.10 0.58 1.72 -1.24 -0.27 0.85 115.58 118.32 1l4s h ASN 78 Ca 0.18 -0.02 -0.16 0.00 0.71 0.00 0.00 56.30 57.01 1l4s h ASN 78 Cb 0.87 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 39.64 1l4s h ASN 78 CO -0.00 0.77 -0.72 0.11 -1.29 0.00 0.00 177.43 176.31 1l4s h LYS 79 N 1.29 0.11 -0.22 6.67 1.79 0.51 -0.02 116.57 126.71 1l4s h LYS 79 Ca 0.38 -0.09 -0.01 0.00 -2.18 0.00 0.00 60.65 58.75 1l4s h LYS 79 Cb -0.07 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.60 1l4s h LYS 79 CO -0.10 0.78 0.09 -0.07 -1.08 0.00 0.00 179.45 179.07 1l4s h LEU 80 N 0.07 0.29 -0.36 2.94 3.38 -0.47 0.44 115.31 121.60 1l4s h LEU 80 Ca -0.02 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1l4s h LEU 80 Cb 1.27 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1l4s h LEU 80 CO 0.10 0.36 0.22 -0.08 0.09 0.00 0.00 178.44 179.13 1l4s h GLU 81 N 0.21 0.49 -0.10 1.13 4.81 -0.78 0.46 114.58 120.80 1l4s h GLU 81 Ca 0.07 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1l4s h GLU 81 Cb 0.15 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1l4s h GLU 81 CO -0.01 0.36 -0.11 -0.09 -0.73 0.00 0.00 179.01 178.43 1l4s h ARG 82 N 0.47 0.15 -0.03 1.92 9.65 -0.62 -0.68 114.38 125.24 1l4s h ARG 82 Ca 0.13 -0.03 -0.12 0.00 -1.10 0.00 0.00 59.98 58.87 1l4s h ARG 82 Cb -0.01 -0.02 0.01 0.00 -1.39 0.00 0.00 29.97 28.56 1l4s h ARG 82 CO -0.03 0.27 -0.44 1.96 2.80 0.00 0.00 179.97 184.54 1l4s h GLN 83 N 0.14 0.35 0.00 0.20 4.20 0.54 -3.18 115.11 117.36 1l4s h GLN 83 Ca 0.03 -0.34 -0.03 0.00 0.06 0.00 0.00 58.65 58.37 1l4s h GLN 83 Cb 0.30 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 1l4s h GLN 83 CO 0.02 1.00 -0.16 -0.07 -0.67 0.00 0.00 178.83 178.95 1l4s h LEU 84 N -0.17 0.00 -1.56 1.46 3.38 -0.65 -2.12 115.31 115.65 1l4s h LEU 84 Ca -0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1l4s h LEU 84 Cb 1.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1l4s h LEU 84 CO 0.09 0.16 -0.04 -1.13 0.09 0.00 0.00 178.44 177.61 1l4s h ASN 85 N 0.00 0.22 1.33 -0.43 -1.24 -1.11 -1.08 115.58 113.27 1l4s h ASN 85 Ca -0.00 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 56.98 1l4s h ASN 85 Cb 0.39 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 39.38 1l4s h ASN 85 CO 0.02 0.30 0.00 0.11 -1.29 0.00 0.00 177.43 176.57 1l4s h LYS 86 N 0.23 0.00 0.00 6.67 1.57 -1.44 -2.92 116.57 120.69 1l4s h LYS 86 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1l4s h LYS 86 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1l4s h LYS 86 CO 0.01 0.00 0.00 -0.07 -0.57 0.00 0.00 179.45 178.82 1l4s h LEU 87 N 0.00 0.00 0.00 2.94 3.38 -1.24 -2.40 115.31 117.99 1l4s h LEU 87 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1l4s h LEU 87 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1l4s h LEU 87 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 1l4s n GLN 88 N -2.64 0.37 -3.69 1.13 3.00 -1.10 -4.75 117.38 109.70 1l4s n GLN 88 Ca 0.01 0.05 -0.13 0.00 -0.01 0.00 0.00 57.00 56.93 1l4s n GLN 88 Cb 0.25 -1.50 -0.09 0.00 0.00 0.00 0.00 30.24 28.90 1l4s n GLN 88 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.06 173.68 1l4s s HIS 89 N -2.55 -0.63 0.04 1.08 -3.43 -0.91 -5.06 115.29 103.84 1l4s s HIS 89 Ca 0.24 1.47 0.00 0.00 -0.80 0.00 0.00 55.06 55.97 1l4s s HIS 89 Cb 0.17 0.25 0.00 0.00 -1.43 0.00 0.00 32.58 31.56 1l4s s HIS 89 CO 0.37 -0.31 0.00 1.17 -2.00 0.00 0.00 174.74 173.97 1l4s n LYS 90 N 3.12 0.00 0.00 -0.38 3.00 -1.26 -4.89 118.16 117.75 1l4s n LYS 90 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 1l4s n LYS 90 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.59 1l4s n LYS 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1l4s n GLY 91 N -1.46 1.87 3.10 3.14 0.00 -1.26 -5.13 105.19 105.45 1l4s n GLY 91 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1l4s n GLY 91 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1l4s n GLU 92 N -0.76 -0.65 -3.74 1.61 -0.58 -1.26 -5.11 120.64 110.15 1l4s n GLU 92 Ca 0.00 -1.84 -0.14 0.00 -0.42 0.00 0.00 57.16 54.76 1l4s n GLU 92 Cb 0.00 -0.89 -0.14 0.00 -0.57 0.00 0.00 31.44 29.84 1l4s n GLU 92 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1l4s s ALA 93 N -3.66 -0.30 -0.12 0.62 0.00 -1.26 -5.03 121.76 112.01 1l4s s ALA 93 Ca 0.58 0.72 0.07 0.00 0.00 0.00 0.00 51.96 53.33 1l4s s ALA 93 Cb -0.02 -0.52 -0.24 0.00 0.00 0.00 0.00 23.12 22.35 1l4s s ALA 93 CO 0.40 -0.20 0.36 -2.13 0.00 0.00 0.00 175.76 174.18 1l4s n ARG 94 N 4.32 0.68 -3.91 0.00 0.63 -1.26 -4.79 116.66 112.34 1l4s n ARG 94 Ca -0.24 0.21 -0.29 0.00 -0.92 0.00 0.00 57.85 56.61 1l4s n ARG 94 Cb 0.52 -1.68 -0.16 0.00 0.45 0.00 0.00 32.46 31.58 1l4s n ARG 94 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 1l4s s ARG 95 N -2.56 1.55 -0.27 -0.14 3.00 -1.26 -4.94 118.95 114.33 1l4s s ARG 95 Ca -0.14 -0.56 -0.01 0.00 -1.00 0.00 0.00 55.73 54.02 1l4s s ARG 95 Cb 0.07 -2.06 0.00 0.00 0.00 0.00 0.00 34.95 32.97 1l4s s ARG 95 CO 0.78 -0.42 0.01 0.00 0.00 0.00 0.00 175.30 175.68 1l4s n ALA 96 N 4.84 -3.47 0.21 6.12 0.00 -1.26 -4.90 120.51 122.05 1l4s n ALA 96 Ca -0.12 0.57 0.09 0.00 0.00 0.00 0.00 53.44 53.97 1l4s n ALA 96 Cb 0.48 -1.12 0.38 0.00 0.00 0.00 0.00 19.45 19.19 1l4s n ALA 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l4s h ALA 97 N 2.83 0.97 0.00 0.00 0.00 -1.92 -3.47 119.26 117.68 1l4s h ALA 97 Ca -0.03 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1l4s h ALA 97 Cb 0.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1l4s h ALA 97 CO 0.09 0.33 0.00 2.41 0.00 0.00 0.00 179.25 182.08 1l4s n THR 98 N -3.37 0.00 -0.75 0.00 -1.04 -1.26 -4.88 114.28 102.98 1l4s n THR 98 Ca 0.00 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.69 1l4s n THR 98 Cb 0.48 0.00 0.14 0.00 -1.82 0.00 0.00 70.33 69.13 1l4s n THR 98 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1l4s n SER 99 N 2.13 -1.31 -4.30 8.00 7.64 -1.26 -5.03 113.62 119.48 1l4s n SER 99 Ca 0.00 0.35 -0.20 0.00 1.01 0.00 0.00 58.87 60.03 1l4s n SER 99 Cb 0.00 -1.29 -0.11 0.00 -1.01 0.00 0.00 64.21 61.80 1l4s n SER 99 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1l4s s VAL 100 N -2.47 1.66 -0.09 0.44 -7.23 -1.26 -5.05 120.40 106.40 1l4s s VAL 100 Ca 0.60 -1.87 0.05 0.00 -1.81 0.00 0.00 61.98 58.96 1l4s s VAL 100 Cb -0.22 -1.76 -0.09 0.00 0.56 0.00 0.00 36.38 34.87 1l4s s VAL 100 CO 0.64 -0.36 -0.01 0.29 -0.31 0.00 0.00 175.10 175.36 1l4s n LYS 101 N 0.34 1.82 -2.77 4.82 5.02 -1.26 -5.08 118.16 121.05 1l4s n LYS 101 Ca -0.14 0.02 -0.05 0.00 -2.02 0.00 0.00 58.31 56.12 1l4s n LYS 101 Cb 0.57 -1.22 0.01 0.00 -0.02 0.00 0.00 35.03 34.37 1l4s n LYS 101 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1l4s n ASP 102 N -2.49 -7.37 0.00 4.39 9.92 -1.26 -4.94 116.55 114.80 1l4s n ASP 102 Ca -0.16 0.34 0.00 0.00 -0.53 0.00 0.00 54.79 54.45 1l4s n ASP 102 Cb 0.75 -4.98 0.00 0.00 -0.64 0.00 0.00 41.12 36.26 1l4s n ASP 102 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1l4s n ALA 103 N -0.68 0.00 -1.07 2.24 0.00 -1.26 -5.17 120.51 114.57 1l4s n ALA 103 Ca 0.08 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.57 1l4s n ALA 103 Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.88 1l4s n ALA 103 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1l4s n ASN 104 N -0.88 -6.38 -3.99 0.00 3.02 -1.26 -5.00 115.26 100.77 1l4s n ASN 104 Ca 0.00 0.37 -0.09 0.00 -0.03 0.00 0.00 54.58 54.83 1l4s n ASN 104 Cb 0.00 -1.05 -0.05 0.00 -0.61 0.00 0.00 39.78 38.07 1l4s n ASN 104 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1l4s s PHE 105 N -0.54 0.35 -1.32 3.10 0.08 -1.26 -5.06 117.98 113.34 1l4s s PHE 105 Ca 0.00 -0.71 -0.07 0.00 0.12 0.00 0.00 56.93 56.28 1l4s s PHE 105 Cb 0.00 0.18 0.05 0.00 -0.57 0.00 0.00 43.02 42.67 1l4s s PHE 105 CO 0.00 -0.97 2.61 1.55 -0.10 0.00 0.00 175.22 178.31 1l4s n VAL 106 N -0.37 4.81 -3.73 -0.44 3.14 -1.26 -4.92 118.33 115.55 1l4s n VAL 106 Ca -0.02 -3.67 -0.36 0.00 -2.96 0.00 0.00 64.34 57.33 1l4s n VAL 106 Cb 0.62 -2.20 -0.10 0.00 -1.06 0.00 0.00 33.84 31.10 1l4s n VAL 106 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 1l4s s GLU 107 N -0.19 3.97 -0.32 1.45 0.41 -1.26 -5.05 118.70 117.71 1l4s s GLU 107 Ca 0.59 -0.33 -0.02 0.00 -0.41 0.00 0.00 54.97 54.81 1l4s s GLU 107 Cb 0.20 -3.46 0.12 0.00 -1.78 0.00 0.00 34.13 29.21 1l4s s GLU 107 CO -0.09 0.02 0.18 -2.00 -0.49 0.00 0.00 175.26 172.88 1l4s s GLU 108 N 1.13 0.35 0.00 1.61 -6.30 -1.26 -4.94 118.70 109.28 1l4s s GLU 108 Ca 0.06 -0.83 0.00 0.00 -2.50 0.00 0.00 54.97 51.70 1l4s s GLU 108 Cb -0.14 -1.18 0.00 0.00 0.00 0.00 0.00 34.13 32.82 1l4s s GLU 108 CO 0.05 -1.10 0.00 1.33 0.02 0.00 0.00 175.26 175.56 1l4s n VAL 109 N 4.75 0.00 -4.61 3.70 0.24 -1.26 -5.12 118.33 116.04 1l4s n VAL 109 Ca 0.02 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.07 1l4s n VAL 109 Cb 0.40 -0.33 -0.14 0.00 -1.47 0.00 0.00 33.84 32.31 1l4s n VAL 109 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1l4s s GLU 110 N -1.72 1.36 -0.34 7.34 2.02 -1.26 -5.08 118.70 121.02 1l4s s GLU 110 Ca 0.00 -0.94 -0.06 0.00 0.02 0.00 0.00 54.97 53.99 1l4s s GLU 110 Cb 0.00 -1.47 0.23 0.00 0.10 0.00 0.00 34.13 32.98 1l4s s GLU 110 CO 0.00 0.37 1.12 -1.91 0.02 0.00 0.00 175.26 174.87 1l4s n GLU 111 N 1.81 0.11 0.00 1.61 4.07 -1.26 -5.19 120.64 121.79 1l4s n GLU 111 Ca -0.17 -0.78 0.05 0.00 -0.06 0.00 0.00 57.16 56.19 1l4s n GLU 111 Cb 0.53 0.04 0.04 0.00 -0.06 0.00 0.00 31.44 32.00 1l4s n GLU 111 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22