#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 4.17 -0.08 -2.82 0.00 -1.26 -4.22 119.30 115.09 1l4s s MET 2 Ca 0.00 2.48 0.03 0.00 0.00 0.00 0.00 55.69 58.20 1l4s s MET 2 Cb 0.00 -3.08 0.01 0.00 0.00 0.00 0.00 34.83 31.75 1l4s s MET 2 CO 0.00 -0.61 -0.18 -0.80 0.00 0.00 0.00 175.02 173.43 1l4s s ASN 3 N 0.75 2.42 -0.05 -1.18 -0.87 -1.09 -5.04 114.94 109.88 1l4s s ASN 3 Ca 0.66 -0.42 -0.00 0.00 -1.57 0.00 0.00 52.86 51.53 1l4s s ASN 3 Cb -0.46 -1.07 0.03 0.00 -0.02 0.00 0.00 41.25 39.73 1l4s s ASN 3 CO 0.40 0.10 -0.00 -0.63 -2.57 0.00 0.00 177.10 174.40 1l4s s ILE 4 N 0.45 0.32 0.12 0.60 1.01 -1.26 0.01 121.20 122.47 1l4s s ILE 4 Ca -0.15 0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.60 1l4s s ILE 4 Cb -0.16 -0.44 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 1l4s s ILE 4 CO 0.06 0.22 -0.06 0.42 0.00 0.00 0.00 174.94 175.57 1l4s s THR 5 N 1.49 0.83 -0.16 2.92 -4.23 0.25 -4.90 115.64 111.83 1l4s s THR 5 Ca -0.03 -1.98 -0.28 0.00 -1.18 0.00 0.00 61.69 58.22 1l4s s THR 5 Cb -0.13 -1.80 0.09 0.00 1.34 0.00 0.00 72.50 71.99 1l4s s THR 5 CO -0.03 -0.77 0.80 -0.94 -0.54 0.00 0.00 174.62 173.14 1l4s s SER 6 N -3.10 -0.61 -0.42 3.99 1.04 -1.26 0.00 113.70 113.34 1l4s s SER 6 Ca 0.15 0.89 0.05 0.00 0.48 0.00 0.00 55.95 57.52 1l4s s SER 6 Cb 0.05 0.81 0.64 0.00 0.10 0.00 0.00 66.02 67.62 1l4s s SER 6 CO -0.02 -0.40 1.83 0.29 0.98 0.00 0.00 173.24 175.93 1l4s n LYS 7 N 1.57 2.17 0.06 4.02 4.01 -1.24 -4.51 118.16 124.23 1l4s n LYS 7 Ca -0.15 -3.05 0.00 0.00 -0.51 0.00 0.00 58.31 54.60 1l4s n LYS 7 Cb 0.56 -2.11 0.00 0.00 -0.51 0.00 0.00 35.03 32.97 1l4s n LYS 7 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23 1l4s n GLN 8 N -1.15 0.00 -3.06 1.97 7.27 -1.26 -5.10 117.38 116.06 1l4s n GLN 8 Ca 0.55 0.00 -0.18 0.00 0.07 0.00 0.00 57.00 57.44 1l4s n GLN 8 Cb 1.55 0.00 0.00 0.00 2.41 0.00 0.00 30.24 34.21 1l4s n GLN 8 CO 0.00 0.00 0.00 -1.33 0.07 0.00 0.00 177.06 175.80 1l4s n MET 9 N -2.89 0.92 -4.29 3.69 2.81 -1.26 -5.15 117.12 110.95 1l4s n MET 9 Ca 0.00 -2.35 -0.25 0.00 -1.81 0.00 0.00 57.70 53.28 1l4s n MET 9 Cb 0.00 0.23 -0.08 0.00 -0.71 0.00 0.00 33.22 32.65 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 -3.57 2.14 -0.37 0.03 1.03 -1.26 -4.60 118.70 112.10 1l4s s GLU 10 Ca 0.23 -1.88 -0.21 0.00 0.03 0.00 0.00 54.97 53.14 1l4s s GLU 10 Cb -0.02 -1.90 0.01 0.00 -0.80 0.00 0.00 34.13 31.42 1l4s s GLU 10 CO 0.14 -0.04 0.66 0.42 -1.33 0.00 0.00 175.26 175.11 1l4s s ILE 11 N -2.60 4.86 0.20 1.83 -1.09 -1.26 -5.05 121.20 118.09 1l4s s ILE 11 Ca 0.38 0.56 0.04 0.00 -2.23 0.00 0.00 60.65 59.40 1l4s s ILE 11 Cb 0.04 -4.11 -0.03 0.00 -1.58 0.00 0.00 42.46 36.78 1l4s s ILE 11 CO 0.21 -0.37 0.33 0.42 -1.23 0.00 0.00 174.94 174.30 1l4s s THR 12 N 2.78 5.28 -0.09 2.92 -4.23 -1.26 -4.98 115.64 116.06 1l4s s THR 12 Ca 0.25 -0.83 0.26 0.00 -1.18 0.00 0.00 61.69 60.18 1l4s s THR 12 Cb -0.14 -3.81 0.26 0.00 1.34 0.00 0.00 72.50 70.15 1l4s s THR 12 CO 0.16 -0.23 1.79 -0.65 -0.54 0.00 0.00 174.62 175.15 1l4s h PRO 13 N 1.59 0.00 0.20 3.99 0.11 -1.98 -0.12 132.00 135.79 1l4s h PRO 13 Ca -0.50 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.29 1l4s h PRO 13 Cb 1.21 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.34 1l4s h PRO 13 CO 0.64 0.00 -1.51 0.00 -0.21 0.00 0.00 178.00 176.92 1l4s h ALA 14 N 2.04 0.02 0.00 -0.75 0.00 -1.98 -1.54 119.26 117.05 1l4s h ALA 14 Ca 0.00 -0.99 -0.12 0.00 0.00 0.00 0.00 54.91 53.80 1l4s h ALA 14 Cb 0.07 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1l4s h ALA 14 CO 0.00 0.81 -0.58 0.82 0.00 0.00 0.00 179.25 180.30 1l4s h ILE 15 N 0.01 1.33 -0.04 0.00 2.04 -1.72 0.20 117.51 119.32 1l4s h ILE 15 Ca -0.29 -2.05 -0.06 0.00 1.00 0.00 0.00 64.86 63.46 1l4s h ILE 15 Cb 2.03 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 40.24 1l4s h ILE 15 CO 0.19 0.57 -0.21 0.03 0.00 0.00 0.00 178.15 178.73 1l4s h ARG 16 N 0.00 0.21 -0.47 2.37 3.08 -1.13 -2.54 114.38 115.91 1l4s h ARG 16 Ca -0.01 -0.18 -0.11 0.00 0.07 0.00 0.00 59.98 59.76 1l4s h ARG 16 Cb 1.09 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.16 1l4s h ARG 16 CO 0.08 0.83 -0.14 0.37 -1.07 0.00 0.00 179.97 180.03 1l4s h GLN 17 N -0.35 0.89 0.71 0.04 -0.00 -1.21 0.45 115.11 115.64 1l4s h GLN 17 Ca -0.01 -0.33 -0.03 0.00 -0.00 0.00 0.00 58.65 58.27 1l4s h GLN 17 Cb 0.87 -0.06 0.01 0.00 0.00 0.00 0.00 27.48 28.30 1l4s h GLN 17 CO 0.04 0.97 -0.36 1.25 0.00 0.00 0.00 178.83 180.74 1l4s h HIS 18 N 0.79 -0.94 -0.23 3.99 2.76 -0.65 0.63 115.15 121.50 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 0.67 0.32 -0.01 0.00 1.55 0.00 0.00 27.41 29.93 1l4s h HIS 18 CO 0.04 -0.57 0.14 0.28 -1.30 0.00 0.00 177.93 176.52 1l4s h VAL 19 N -0.98 1.09 -0.60 5.26 2.07 -1.48 -2.58 116.25 119.02 1l4s h VAL 19 Ca -0.10 -0.21 0.06 0.00 0.82 0.00 0.00 66.70 67.27 1l4s h VAL 19 Cb 0.76 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 1l4s h VAL 19 CO 0.15 0.09 0.31 0.00 0.02 0.00 0.00 177.57 178.14 1l4s h ALA 20 N 1.05 0.79 -0.35 1.67 0.00 -0.06 -0.76 119.26 121.59 1l4s h ALA 20 Ca 0.08 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1l4s h ALA 20 Cb 0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1l4s h ALA 20 CO -0.02 -0.03 0.23 0.38 0.00 0.00 0.00 179.25 179.82 1l4s h ASP 21 N 0.59 0.34 0.84 0.00 3.04 0.51 -0.48 116.42 121.25 1l4s h ASP 21 Ca 0.27 -0.01 -0.14 0.00 -3.24 0.00 0.00 57.03 53.91 1l4s h ASP 21 Cb 0.18 -0.08 -0.02 0.00 -1.04 0.00 0.00 39.33 38.37 1l4s h ASP 21 CO -0.18 0.24 -0.67 0.03 -2.04 0.00 0.00 179.24 176.61 1l4s h ARG 22 N 0.39 0.00 0.24 4.15 2.47 -0.80 -2.93 114.38 117.91 1l4s h ARG 22 Ca 0.14 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.84 1l4s h ARG 22 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 1l4s h ARG 22 CO -0.03 0.67 -0.12 -0.07 0.56 0.00 0.00 179.97 180.98 1l4s h LEU 23 N 0.00 -0.28 -2.32 3.04 3.38 0.16 -1.41 115.31 117.88 1l4s h LEU 23 Ca -0.01 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 57.74 1l4s h LEU 23 Cb 1.27 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 42.09 1l4s h LEU 23 CO 0.09 0.16 0.09 0.00 0.09 0.00 0.00 178.44 178.87 1l4s h ALA 24 N -0.23 1.71 0.05 1.53 0.00 -1.46 0.65 119.26 121.50 1l4s h ALA 24 Ca -0.03 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.64 1l4s h ALA 24 Cb 0.51 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1l4s h ALA 24 CO 0.06 -0.14 -1.07 -0.22 0.00 0.00 0.00 179.25 177.88 1l4s h LYS 25 N 0.00 0.13 -2.99 0.00 3.11 -1.42 -3.35 116.57 112.06 1l4s h LYS 25 Ca 0.04 -0.21 -0.68 0.00 -2.81 0.00 0.00 60.65 56.99 1l4s h LYS 25 Cb 0.23 0.08 0.01 0.00 -1.00 0.00 0.00 32.23 31.55 1l4s h LYS 25 CO -0.00 1.07 3.70 1.28 -2.81 0.00 0.00 179.45 182.69 1l4s n LEU 26 N -3.47 8.66 0.00 5.20 4.77 0.22 -4.75 117.00 127.63 1l4s n LEU 26 Ca -0.04 -4.42 0.00 0.00 -0.03 0.00 0.00 56.01 51.52 1l4s n LEU 26 Cb 0.95 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.50 1l4s n LEU 26 CO 0.50 2.05 0.34 -0.62 -1.33 0.00 0.00 177.39 178.33 1l4s n GLU 27 N 3.46 0.00 0.26 3.23 1.02 -1.26 0.13 120.64 127.48 1l4s n GLU 27 Ca 0.76 0.19 0.16 0.00 -0.02 0.00 0.00 57.16 58.26 1l4s n GLU 27 Cb 0.24 -1.18 0.76 0.00 -0.02 0.00 0.00 31.44 31.23 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 0.00 3.49 -0.00 -1.96 -0.58 116.57 117.53 1l4s h LYS 28 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 60.65 60.61 1l4s h LYS 28 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 32.22 1l4s h LYS 28 CO 0.00 0.00 -0.40 -1.49 -0.00 0.00 0.00 179.45 177.56 1l4s h TRP 29 N 0.00 0.00 -0.60 0.07 4.06 -1.90 -3.37 115.95 114.21 1l4s h TRP 29 Ca 0.06 0.00 -0.34 0.00 2.06 0.00 0.00 58.89 60.67 1l4s h TRP 29 Cb 0.86 0.00 -0.18 0.00 -1.00 0.00 0.00 29.16 28.84 1l4s h TRP 29 CO 0.00 0.38 0.44 0.94 -3.56 0.00 0.00 178.44 176.64 1l4s n GLN 30 N -4.64 1.84 -0.01 0.49 7.27 0.34 -4.33 117.38 118.34 1l4s n GLN 30 Ca -0.09 -1.86 -0.18 0.00 0.07 0.00 0.00 57.00 54.93 1l4s n GLN 30 Cb 0.28 -1.73 -0.14 0.00 2.41 0.00 0.00 30.24 31.06 1l4s n GLN 30 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1l4s h THR 31 N 0.74 1.47 0.00 1.69 1.03 -1.28 -3.36 112.91 113.19 1l4s h THR 31 Ca 0.38 -2.42 -0.17 0.00 -0.01 0.00 0.00 66.41 64.19 1l4s h THR 31 Cb 1.70 3.10 -0.03 0.00 -1.07 0.00 0.00 68.15 71.85 1l4s h THR 31 CO 0.76 0.64 -1.04 0.45 -0.01 0.00 0.00 175.52 176.32 1l4s h HIS 32 N -0.62 0.00 -2.89 0.00 3.86 -1.86 -3.47 115.15 110.16 1l4s h HIS 32 Ca -0.14 0.00 -0.59 0.00 -1.16 0.00 0.00 60.37 58.48 1l4s h HIS 32 Cb 1.42 0.00 0.15 0.00 1.06 0.00 0.00 27.41 30.04 1l4s h HIS 32 CO 0.20 0.69 -0.14 1.28 0.86 0.00 0.00 177.93 180.82 1l4s n LEU 33 N -3.12 1.54 -3.74 2.43 4.77 -1.26 -4.35 117.00 113.27 1l4s n LEU 33 Ca -0.04 0.89 -0.29 0.00 -0.03 0.00 0.00 56.01 56.54 1l4s n LEU 33 Cb 0.85 -1.24 -0.16 0.00 -2.33 0.00 0.00 43.42 40.54 1l4s n LEU 33 CO 0.43 -2.33 -0.35 -0.63 -1.33 0.00 0.00 177.39 173.17 1l4s s ILE 34 N -1.47 0.71 -0.48 -0.08 1.01 -0.40 -4.95 121.20 115.54 1l4s s ILE 34 Ca 0.66 -0.96 -0.23 0.00 0.00 0.00 0.00 60.65 60.13 1l4s s ILE 34 Cb -0.52 -1.34 0.03 0.00 0.01 0.00 0.00 42.46 40.63 1l4s s ILE 34 CO 0.55 -0.42 0.63 0.59 0.00 0.00 0.00 174.94 176.30 1l4s n ASN 35 N 4.95 -6.88 -4.88 3.58 4.13 -1.26 -4.41 115.26 110.49 1l4s n ASN 35 Ca -0.06 0.16 -0.30 0.00 1.68 0.00 0.00 54.58 56.06 1l4s n ASN 35 Cb 0.44 -3.82 0.02 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 -2.70 3.37 -0.04 3.52 0.04 -1.26 -4.74 135.00 133.20 1l4s s PRO 36 Ca 0.27 0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.84 1l4s s PRO 36 Cb -0.05 -2.14 0.03 0.00 0.04 0.00 0.00 34.50 32.38 1l4s s PRO 36 CO 0.82 -0.61 -0.01 -1.58 0.04 0.00 0.00 177.00 175.65 1l4s s HIS 37 N -3.12 0.46 -0.04 0.56 2.46 -1.09 -2.66 115.29 111.86 1l4s s HIS 37 Ca 0.54 -0.06 0.07 0.00 0.47 0.00 0.00 55.06 56.07 1l4s s HIS 37 Cb -0.11 -0.51 -0.01 0.00 -0.13 0.00 0.00 32.58 31.81 1l4s s HIS 37 CO 0.51 -0.16 -0.25 0.42 -2.47 0.00 0.00 174.74 172.79 1l4s s ILE 38 N 1.09 1.99 0.08 0.89 1.09 0.10 -1.87 121.20 124.58 1l4s s ILE 38 Ca -0.09 -1.05 0.07 0.00 -1.10 0.00 0.00 60.65 58.48 1l4s s ILE 38 Cb -0.14 -1.67 -0.04 0.00 -1.06 0.00 0.00 42.46 39.56 1l4s s ILE 38 CO -0.01 0.56 -0.14 -0.63 -0.10 0.00 0.00 174.94 174.61 1l4s s ILE 39 N -0.35 3.07 -0.10 2.92 1.09 0.17 -0.59 121.20 127.40 1l4s s ILE 39 Ca 0.03 -1.29 0.03 0.00 -1.10 0.00 0.00 60.65 58.32 1l4s s ILE 39 Cb -0.12 -2.38 0.01 0.00 -1.06 0.00 0.00 42.46 38.91 1l4s s ILE 39 CO 0.01 0.19 -0.19 -0.76 -0.10 0.00 0.00 174.94 174.10 1l4s s LEU 40 N -1.93 1.89 0.00 2.97 1.43 0.10 -1.35 118.68 121.79 1l4s s LEU 40 Ca 0.18 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 1l4s s LEU 40 Cb -0.11 -1.20 -0.00 0.00 0.03 0.00 0.00 46.19 44.91 1l4s s LEU 40 CO 0.10 0.07 0.01 -1.20 0.23 0.00 0.00 176.35 175.56 1l4s n SER 41 N 3.91 1.58 -3.62 2.29 7.64 0.20 -3.73 113.62 121.89 1l4s n SER 41 Ca -0.20 -1.22 -0.08 0.00 1.01 0.00 0.00 58.87 58.38 1l4s n SER 41 Cb 0.52 0.07 -0.06 0.00 -1.01 0.00 0.00 64.21 63.73 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 -2.17 0.41 0.25 1.43 2.20 -1.26 -2.37 119.74 118.23 1l4s s LYS 42 Ca 0.01 0.27 0.04 0.00 -0.36 0.00 0.00 55.97 55.93 1l4s s LYS 42 Cb 0.00 0.20 -0.05 0.00 -1.51 0.00 0.00 37.83 36.46 1l4s s LYS 42 CO 0.01 -0.09 0.00 -1.21 -0.36 0.00 0.00 175.35 173.69 1l4s s GLU 43 N -0.47 1.41 0.65 4.03 0.41 0.12 -4.94 118.70 119.91 1l4s s GLU 43 Ca 0.03 -1.73 0.19 0.00 -0.41 0.00 0.00 54.97 53.05 1l4s s GLU 43 Cb -0.03 -0.71 1.05 0.00 -1.78 0.00 0.00 34.13 32.66 1l4s s GLU 43 CO -0.05 -0.10 1.59 -1.35 -0.49 0.00 0.00 175.26 174.86 1l4s h PRO 44 N 2.39 0.00 0.00 0.39 0.11 -2.04 -2.79 132.00 130.06 1l4s h PRO 44 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1l4s h PRO 44 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1l4s h PRO 44 CO 0.65 0.00 0.00 0.94 -0.21 0.00 0.00 178.00 179.38 1l4s n GLN 45 N -2.73 0.00 0.00 1.05 7.27 -1.26 -5.10 117.38 116.62 1l4s n GLN 45 Ca -0.01 0.10 0.00 0.00 0.07 0.00 0.00 57.00 57.16 1l4s n GLN 45 Cb 0.59 -0.51 0.00 0.00 2.41 0.00 0.00 30.24 32.73 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 2.32 5.10 3.68 1.69 0.00 -1.06 -4.96 105.19 111.97 1l4s n GLY 46 Ca 0.00 -1.17 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 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 0.03 2.96 -0.01 1.61 0.40 -0.92 0.11 117.98 122.16 1l4s s PHE 47 Ca 0.00 -0.05 0.06 0.00 -0.60 0.00 0.00 56.93 56.34 1l4s s PHE 47 Cb 0.00 -1.51 -0.02 0.00 0.51 0.00 0.00 43.02 42.00 1l4s s PHE 47 CO 0.00 0.48 -0.20 0.08 0.70 0.00 0.00 175.22 176.28 1l4s s VAL 48 N -1.35 1.61 -0.08 -0.44 1.01 -1.00 -2.65 120.40 117.51 1l4s s VAL 48 Ca 0.26 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.35 1l4s s VAL 48 Cb -0.11 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 34.95 1l4s s VAL 48 CO 0.18 0.43 -0.07 0.00 0.00 0.00 0.00 175.10 175.65 1l4s s ALA 49 N -0.50 1.03 0.10 5.51 0.00 0.14 0.58 121.76 128.63 1l4s s ALA 49 Ca 0.08 -0.31 0.10 0.00 0.00 0.00 0.00 51.96 51.82 1l4s s ALA 49 Cb -0.08 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1l4s s ALA 49 CO -0.01 -0.19 -0.25 -0.51 0.00 0.00 0.00 175.76 174.81 1l4s s ASP 50 N 1.29 3.41 -0.06 0.00 1.11 -0.45 -0.15 116.67 121.81 1l4s s ASP 50 Ca -0.04 -0.66 -0.10 0.00 0.18 0.00 0.00 52.55 51.93 1l4s s ASP 50 Cb -0.14 -0.32 0.02 0.00 1.07 0.00 0.00 42.92 43.55 1l4s s ASP 50 CO -0.03 0.20 0.24 0.00 1.18 0.00 0.00 175.17 176.77 1l4s s ALA 51 N -1.00 -0.60 -0.04 5.23 0.00 -0.56 0.44 121.76 125.24 1l4s s ALA 51 Ca 0.14 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.55 1l4s s ALA 51 Cb -0.10 -0.19 0.03 0.00 0.00 0.00 0.00 23.12 22.85 1l4s s ALA 51 CO 0.06 -0.17 -0.01 0.99 0.00 0.00 0.00 175.76 176.62 1l4s s THR 52 N -0.52 0.28 -0.00 0.00 2.01 -0.78 -2.28 115.64 114.35 1l4s s THR 52 Ca -0.06 0.03 0.04 0.00 0.31 0.00 0.00 61.69 62.01 1l4s s THR 52 Cb -0.04 -0.36 -0.01 0.00 0.01 0.00 0.00 72.50 72.10 1l4s s THR 52 CO 0.01 0.17 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.37 1l4s s ILE 53 N 1.04 0.92 -0.10 1.82 1.01 -0.83 -2.67 121.20 122.39 1l4s s ILE 53 Ca -0.10 -0.57 -0.06 0.00 0.00 0.00 0.00 60.65 59.93 1l4s s ILE 53 Cb -0.14 -0.79 -0.04 0.00 0.01 0.00 0.00 42.46 41.51 1l4s s ILE 53 CO -0.01 0.21 0.13 0.21 0.00 0.00 0.00 174.94 175.48 1l4s s ASN 54 N -0.41 6.29 0.10 3.58 3.84 -1.26 -1.69 114.94 125.39 1l4s s ASN 54 Ca 0.04 0.42 0.03 0.00 0.21 0.00 0.00 52.86 53.56 1l4s s ASN 54 Cb -0.05 -2.01 -0.04 0.00 -0.55 0.00 0.00 41.25 38.60 1l4s s ASN 54 CO -0.00 0.39 -0.09 0.42 -2.79 0.00 0.00 177.10 175.02 1l4s s THR 55 N -1.06 0.87 -0.86 -5.21 -4.23 0.12 -1.27 115.64 104.00 1l4s s THR 55 Ca 0.17 -1.70 0.11 0.00 -1.18 0.00 0.00 61.69 59.08 1l4s s THR 55 Cb -0.12 -1.42 0.10 0.00 1.34 0.00 0.00 72.50 72.40 1l4s s THR 55 CO 0.06 -0.64 1.34 -2.65 -0.54 0.00 0.00 174.62 172.19 1l4s n PRO 56 N 0.42 0.04 -0.29 3.99 -0.02 -1.26 -2.17 135.00 135.71 1l4s n PRO 56 Ca -0.15 0.40 0.07 0.00 -2.02 0.00 0.00 63.50 61.80 1l4s n PRO 56 Cb 0.58 -1.59 0.11 0.00 -0.02 0.00 0.00 33.50 32.58 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 -1.66 1.63 0.00 2.55 3.02 -1.26 -5.11 115.26 114.43 1l4s n ASN 57 Ca 0.02 -2.85 0.00 0.00 -0.03 0.00 0.00 54.58 51.72 1l4s n ASN 57 Cb 0.10 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 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 -0.96 0.58 2.91 7.41 0.00 -0.92 -5.13 105.19 109.09 1l4s n GLY 58 Ca 0.12 -1.76 -0.11 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 -2.46 0.04 0.16 1.61 1.01 -1.26 0.13 120.40 119.62 1l4s s VAL 59 Ca 0.00 -0.33 0.10 0.00 0.00 0.00 0.00 61.98 61.75 1l4s s VAL 59 Cb 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.23 1l4s s VAL 59 CO 0.00 -0.18 -0.21 -0.76 0.00 0.00 0.00 175.10 173.95 1l4s s LEU 60 N -0.53 2.57 0.01 3.92 1.02 -0.68 -5.00 118.68 119.99 1l4s s LEU 60 Ca -0.06 -0.71 -0.01 0.00 0.02 0.00 0.00 54.13 53.37 1l4s s LEU 60 Cb -0.04 -1.37 -0.01 0.00 0.02 0.00 0.00 46.19 44.79 1l4s s LEU 60 CO -0.00 0.15 0.01 -0.69 0.02 0.00 0.00 176.35 175.83 1l4s s VAL 61 N -1.40 0.08 0.08 -1.59 1.01 -1.26 -1.96 120.40 115.35 1l4s s VAL 61 Ca 0.19 -0.64 -0.18 0.00 0.00 0.00 0.00 61.98 61.35 1l4s s VAL 61 Cb -0.09 -0.23 0.04 0.00 0.00 0.00 0.00 36.38 36.10 1l4s s VAL 61 CO 0.10 -0.35 0.43 0.00 0.00 0.00 0.00 175.10 175.28 1l4s s ALA 62 N -1.06 -1.04 0.06 5.51 0.00 -0.96 -4.81 121.76 119.47 1l4s s ALA 62 Ca -0.12 0.22 -0.06 0.00 0.00 0.00 0.00 51.96 52.01 1l4s s ALA 62 Cb -0.07 0.49 -0.01 0.00 0.00 0.00 0.00 23.12 23.52 1l4s s ALA 62 CO -0.00 -0.54 0.11 -1.54 0.00 0.00 0.00 175.76 173.79 1l4s s SER 63 N -2.30 0.22 -0.27 0.00 1.04 -1.26 -1.50 113.70 109.63 1l4s s SER 63 Ca -0.02 -0.68 -0.00 0.00 0.48 0.00 0.00 55.95 55.72 1l4s s SER 63 Cb 0.00 0.27 0.15 0.00 0.10 0.00 0.00 66.02 66.55 1l4s s SER 63 CO -0.06 -0.63 0.42 -0.83 0.98 0.00 0.00 173.24 173.13 1l4s s GLY 64 N -2.62 -0.58 -0.62 7.32 0.00 0.78 -4.19 107.32 107.41 1l4s s GLY 64 Ca 0.02 0.71 0.01 0.00 0.00 0.00 0.00 44.72 45.46 1l4s s GLY 64 CO -0.09 2.95 1.72 0.28 0.00 0.00 0.00 173.10 177.96 1l4s n LYS 65 N 5.37 3.01 -1.99 2.90 4.01 -1.26 0.27 118.16 130.46 1l4s n LYS 65 Ca -0.01 -3.74 -0.32 0.00 -0.51 0.00 0.00 58.31 53.73 1l4s n LYS 65 Cb 0.50 -2.27 0.01 0.00 -0.51 0.00 0.00 35.03 32.76 1l4s n LYS 65 CO 0.00 0.00 0.00 -1.58 -1.11 0.00 0.00 177.40 174.71 1l4s s HIS 66 N -3.82 3.18 0.53 2.13 2.46 -1.08 -4.72 115.29 113.97 1l4s s HIS 66 Ca 0.55 1.46 0.25 0.00 0.47 0.00 0.00 55.06 57.80 1l4s s HIS 66 Cb 0.45 -2.90 1.57 0.00 -0.13 0.00 0.00 32.58 31.57 1l4s s HIS 66 CO -0.16 -0.94 2.17 0.93 -2.47 0.00 0.00 174.74 174.27 1l4s h GLU 67 N 0.18 0.00 -5.08 2.88 5.08 -1.93 -2.43 114.58 113.28 1l4s h GLU 67 Ca -0.46 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.28 1l4s h GLU 67 Cb 1.21 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.31 1l4s h GLU 67 CO 0.59 0.04 -0.41 0.34 -1.00 0.00 0.00 179.01 178.57 1l4s s ASP 68 N -6.40 6.15 0.21 1.42 -1.08 -1.26 -3.84 116.67 111.87 1l4s s ASP 68 Ca -0.04 0.16 -0.13 0.00 -0.52 0.00 0.00 52.55 52.01 1l4s s ASP 68 Cb 0.15 -2.15 0.24 0.00 -1.46 0.00 0.00 42.92 39.70 1l4s s ASP 68 CO 0.59 -0.05 1.63 -0.03 0.52 0.00 0.00 175.17 177.84 1l4s h MET 69 N 7.95 0.02 -0.44 4.34 1.85 -1.88 0.02 114.93 126.78 1l4s h MET 69 Ca -0.35 -0.00 -0.08 0.00 -0.61 0.00 0.00 59.70 58.65 1l4s h MET 69 Cb 1.17 -0.00 -0.02 0.00 0.43 0.00 0.00 31.60 33.18 1l4s h MET 69 CO 0.62 0.01 -0.07 1.88 -0.40 0.00 0.00 176.91 178.96 1l4s h TYR 70 N 0.02 0.84 -0.61 1.39 -1.99 -1.95 -2.56 116.97 112.11 1l4s h TYR 70 Ca 0.30 -0.14 -0.06 0.00 2.00 0.00 0.00 58.73 60.84 1l4s h TYR 70 Cb 0.47 -0.22 -0.02 0.00 2.00 0.00 0.00 36.73 38.96 1l4s h TYR 70 CO -0.48 0.81 0.15 1.15 -0.00 0.00 0.00 178.16 179.79 1l4s h THR 71 N 0.71 1.25 -0.21 -2.88 2.02 -1.48 -0.69 112.91 111.63 1l4s h THR 71 Ca 0.13 -0.91 -0.00 0.00 0.77 0.00 0.00 66.41 66.39 1l4s h THR 71 Cb 0.53 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1l4s h THR 71 CO 0.03 0.34 0.12 0.00 0.37 0.00 0.00 175.52 176.38 1l4s h ALA 72 N 1.04 0.27 -0.35 6.16 0.00 -0.89 0.42 119.26 125.92 1l4s h ALA 72 Ca 0.19 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1l4s h ALA 72 Cb 0.35 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1l4s h ALA 72 CO 0.00 -0.20 0.21 0.82 0.00 0.00 0.00 179.25 180.09 1l4s h ILE 73 N 0.24 1.12 -0.68 0.00 2.04 -1.30 0.23 117.51 119.16 1l4s h ILE 73 Ca 0.08 -0.28 -0.06 0.00 1.00 0.00 0.00 64.86 65.59 1l4s h ILE 73 Cb 0.06 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 1l4s h ILE 73 CO -0.01 0.12 0.18 0.78 0.00 0.00 0.00 178.15 179.21 1l4s h ASN 74 N 0.45 1.01 -0.35 1.72 2.35 -0.91 -2.54 115.58 117.31 1l4s h ASN 74 Ca 0.12 -0.23 -0.05 0.00 -0.55 0.00 0.00 56.30 55.60 1l4s h ASN 74 Cb 0.01 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 1l4s h ASN 74 CO -0.02 0.98 0.03 -0.33 -1.65 0.00 0.00 177.43 176.43 1l4s h GLU 75 N 1.00 0.60 0.29 0.81 5.08 0.20 -1.83 114.58 120.74 1l4s h GLU 75 Ca 0.21 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1l4s h GLU 75 Cb 0.35 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 1l4s h GLU 75 CO -0.00 0.70 -0.50 1.25 -1.00 0.00 0.00 179.01 179.46 1l4s h LEU 76 N 0.43 -1.43 -2.00 1.33 6.46 -0.38 0.07 115.31 119.79 1l4s h LEU 76 Ca 0.10 0.14 0.11 0.00 -0.12 0.00 0.00 57.88 58.11 1l4s h LEU 76 Cb 0.41 0.50 -0.02 0.00 -0.73 0.00 0.00 40.66 40.83 1l4s h LEU 76 CO 0.01 -0.60 0.28 0.40 -0.62 0.00 0.00 178.44 177.92 1l4s h ILE 77 N -0.85 0.80 -0.85 4.05 2.04 -1.46 0.23 117.51 121.46 1l4s h ILE 77 Ca -0.03 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.87 1l4s h ILE 77 Cb 0.80 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.63 1l4s h ILE 77 CO -0.18 0.00 0.56 -1.13 0.00 0.00 0.00 178.15 177.40 1l4s h ASN 78 N 0.00 0.91 0.75 1.72 -1.24 -0.11 0.09 115.58 117.69 1l4s h ASN 78 Ca 0.18 -0.01 -0.13 0.00 0.71 0.00 0.00 56.30 57.05 1l4s h ASN 78 Cb 0.74 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.56 1l4s h ASN 78 CO -0.00 0.62 -0.63 0.11 -1.29 0.00 0.00 177.43 176.24 1l4s h LYS 79 N 1.05 0.00 -0.10 6.67 6.56 0.28 0.38 116.57 131.40 1l4s h LYS 79 Ca 0.34 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.93 1l4s h LYS 79 Cb 0.04 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.69 1l4s h LYS 79 CO -0.10 0.63 0.05 -0.07 -2.06 0.00 0.00 179.45 177.90 1l4s h LEU 80 N 0.00 0.13 -0.48 2.94 3.38 -0.38 0.30 115.31 121.20 1l4s h LEU 80 Ca -0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1l4s h LEU 80 Cb 1.17 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1l4s h LEU 80 CO 0.08 0.20 0.22 -0.08 0.09 0.00 0.00 178.44 178.95 1l4s h GLU 81 N 0.06 0.69 -0.18 1.13 4.81 -1.09 -1.33 114.58 118.67 1l4s h GLU 81 Ca 0.04 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 1l4s h GLU 81 Cb 0.10 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1l4s h GLU 81 CO -0.01 0.60 -0.02 -0.09 -0.73 0.00 0.00 179.01 178.76 1l4s h ARG 82 N 0.63 0.26 -0.05 1.92 9.65 -0.54 -0.60 114.38 125.64 1l4s h ARG 82 Ca 0.16 -0.04 -0.21 0.00 -1.10 0.00 0.00 59.98 58.79 1l4s h ARG 82 Cb 0.14 -0.05 0.01 0.00 -1.39 0.00 0.00 29.97 28.69 1l4s h ARG 82 CO -0.02 0.31 -0.78 1.96 2.80 0.00 0.00 179.97 184.25 1l4s h GLN 83 N 0.26 0.62 -0.15 0.20 4.20 0.00 -3.19 115.11 117.05 1l4s h GLN 83 Ca 0.06 -0.59 -0.06 0.00 0.06 0.00 0.00 58.65 58.12 1l4s h GLN 83 Cb 0.22 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 1l4s h GLN 83 CO 0.01 1.21 -0.17 -0.07 -0.67 0.00 0.00 178.83 179.13 1l4s h LEU 84 N 0.25 0.23 -1.53 1.46 3.38 -0.86 -2.50 115.31 115.74 1l4s h LEU 84 Ca -0.08 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1l4s h LEU 84 Cb 1.44 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 42.11 1l4s h LEU 84 CO 0.16 0.43 0.14 -1.13 0.09 0.00 0.00 178.44 178.13 1l4s h ASN 85 N 0.23 0.41 1.07 -0.43 -1.24 -1.10 -1.70 115.58 112.82 1l4s h ASN 85 Ca 0.04 -0.03 -0.13 0.00 0.71 0.00 0.00 56.30 56.89 1l4s h ASN 85 Cb 0.45 -0.10 -0.02 0.00 0.73 0.00 0.00 38.32 39.38 1l4s h ASN 85 CO 0.03 0.37 -0.64 0.11 -1.29 0.00 0.00 177.43 176.01 1l4s h LYS 86 N 0.46 0.00 0.00 6.67 1.57 -1.48 -3.24 116.57 120.56 1l4s h LYS 86 Ca 0.12 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 1l4s h LYS 86 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1l4s h LYS 86 CO -0.01 0.64 -0.19 -0.07 -0.57 0.00 0.00 179.45 179.24 1l4s h LEU 87 N 0.00 0.00 0.00 2.94 3.38 -1.19 -3.41 115.31 117.03 1l4s h LEU 87 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1l4s h LEU 87 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1l4s h LEU 87 CO 0.08 0.19 0.00 0.00 0.09 0.00 0.00 178.44 178.80 1l4s n GLN 88 N -3.32 0.00 0.00 1.13 10.64 -1.12 -4.75 117.38 119.96 1l4s n GLN 88 Ca 0.01 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.18 1l4s n GLN 88 Cb 0.43 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.81 1l4s n GLN 88 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 1l4s n HIS 89 N 0.00 0.00 0.04 2.61 8.25 -1.26 -3.65 115.22 121.22 1l4s n HIS 89 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.44 1l4s n HIS 89 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 1l4s n HIS 89 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 1l4s h LYS 90 N 0.00 -0.11 0.00 -0.41 1.57 -1.93 -3.51 116.57 112.18 1l4s h LYS 90 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1l4s h LYS 90 Cb 0.00 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1l4s h LYS 90 CO 0.00 -0.07 0.00 0.41 -0.57 0.00 0.00 179.45 179.22 1l4s n GLY 91 N 0.41 0.66 3.49 3.86 0.00 -1.24 -5.11 105.19 107.26 1l4s n GLY 91 Ca -0.01 -1.75 0.01 0.00 0.00 0.00 0.00 46.02 44.26 1l4s n GLY 91 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1l4s s GLU 92 N -2.00 0.47 -0.57 1.61 2.56 -1.26 -4.99 118.70 114.51 1l4s s GLU 92 Ca 0.00 1.12 -0.01 0.00 0.00 0.00 0.00 54.97 56.09 1l4s s GLU 92 Cb 0.00 0.67 0.45 0.00 2.00 0.00 0.00 34.13 37.25 1l4s s GLU 92 CO 0.00 -0.22 2.00 0.00 -0.56 0.00 0.00 175.26 176.48 1l4s n ALA 93 N 5.30 6.00 -2.54 6.30 0.00 -1.26 -4.92 120.51 129.39 1l4s n ALA 93 Ca -0.09 -3.08 -0.43 0.00 0.00 0.00 0.00 53.44 49.83 1l4s n ALA 93 Cb 0.51 -1.66 -0.07 0.00 0.00 0.00 0.00 19.45 18.23 1l4s n ALA 93 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1l4s s ARG 94 N -3.41 3.23 0.40 0.00 3.52 -1.26 -5.05 118.95 116.39 1l4s s ARG 94 Ca 0.58 -0.50 0.08 0.00 -0.13 0.00 0.00 55.73 55.76 1l4s s ARG 94 Cb 0.46 -3.97 -0.04 0.00 -1.56 0.00 0.00 34.95 29.83 1l4s s ARG 94 CO 0.01 -1.02 0.22 0.50 -0.81 0.00 0.00 175.30 174.20 1l4s s ARG 95 N 2.71 2.31 -0.53 5.12 6.06 -1.26 -5.03 118.95 128.33 1l4s s ARG 95 Ca 0.20 -1.74 0.01 0.00 -2.50 0.00 0.00 55.73 51.70 1l4s s ARG 95 Cb -0.15 -2.09 0.54 0.00 0.06 0.00 0.00 34.95 33.31 1l4s s ARG 95 CO 0.17 -0.10 1.95 0.00 -2.50 0.00 0.00 175.30 174.82 1l4s n ALA 96 N -1.29 5.82 -2.69 6.12 0.00 -1.26 -4.90 120.51 122.30 1l4s n ALA 96 Ca -0.00 -3.02 -0.42 0.00 0.00 0.00 0.00 53.44 50.00 1l4s n ALA 96 Cb 0.64 -1.57 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 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 -3.37 2.93 0.11 0.00 0.00 -1.26 -4.96 121.76 115.20 1l4s s ALA 97 Ca 0.58 -1.83 -0.10 0.00 0.00 0.00 0.00 51.96 50.61 1l4s s ALA 97 Cb 0.47 -4.15 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1l4s s ALA 97 CO 0.05 -3.14 0.25 0.95 0.00 0.00 0.00 175.76 173.86 1l4s s THR 98 N 4.73 0.12 -0.28 0.00 -4.23 -1.26 -5.14 115.64 109.57 1l4s s THR 98 Ca 0.32 -1.10 -0.04 0.00 -1.18 0.00 0.00 61.69 59.70 1l4s s THR 98 Cb -0.09 -1.38 0.10 0.00 1.34 0.00 0.00 72.50 72.46 1l4s s THR 98 CO 0.06 -0.53 0.12 -0.44 -0.54 0.00 0.00 174.62 173.30 1l4s s SER 99 N -2.87 3.49 0.13 3.99 0.01 -1.26 -5.12 113.70 112.06 1l4s s SER 99 Ca 0.06 -1.26 -0.24 0.00 1.31 0.00 0.00 55.95 55.82 1l4s s SER 99 Cb 0.04 -0.38 0.07 0.00 0.21 0.00 0.00 66.02 65.96 1l4s s SER 99 CO -0.09 -0.43 0.62 0.54 0.41 0.00 0.00 173.24 174.28 1l4s s VAL 100 N 2.07 0.00 0.00 3.43 0.11 -1.26 -5.05 120.40 119.70 1l4s s VAL 100 Ca 0.09 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.14 1l4s s VAL 100 Cb -0.16 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.69 1l4s s VAL 100 CO -0.34 0.00 0.00 2.29 -3.33 0.00 0.00 175.10 173.72 1l4s n LYS 101 N -0.20 0.00 -2.81 1.54 0.00 -1.26 -5.09 118.16 110.34 1l4s n LYS 101 Ca -0.17 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.09 1l4s n LYS 101 Cb 0.64 0.00 0.01 0.00 -0.00 0.00 0.00 35.03 35.68 1l4s n LYS 101 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1l4s n ASP 102 N -0.58 -7.52 -3.89 -5.58 9.92 -1.26 -4.99 116.55 102.64 1l4s n ASP 102 Ca 0.00 0.34 -0.28 0.00 -0.53 0.00 0.00 54.79 54.32 1l4s n ASP 102 Cb 0.00 -5.09 -0.12 0.00 -0.64 0.00 0.00 41.12 35.27 1l4s n ASP 102 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1l4s s ALA 103 N -2.64 3.65 -0.53 2.24 0.00 -1.26 -4.92 121.76 118.29 1l4s s ALA 103 Ca 0.17 -3.69 0.03 0.00 0.00 0.00 0.00 51.96 48.46 1l4s s ALA 103 Cb -0.05 -2.15 0.42 0.00 0.00 0.00 0.00 23.12 21.35 1l4s s ALA 103 CO 0.71 -2.08 1.53 0.09 0.00 0.00 0.00 175.76 176.01 1l4s n ASN 104 N 2.22 6.02 -1.45 0.00 3.02 -1.26 -5.04 115.26 118.77 1l4s n ASN 104 Ca 0.17 -3.77 0.00 0.00 -0.03 0.00 0.00 54.58 50.95 1l4s n ASN 104 Cb 0.35 -0.67 0.00 0.00 -0.61 0.00 0.00 39.78 38.85 1l4s n ASN 104 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1l4s n PHE 105 N -0.65 -4.01 -1.07 3.10 7.35 -1.26 -4.98 117.46 115.94 1l4s n PHE 105 Ca 0.49 2.14 0.11 0.00 -0.76 0.00 0.00 57.45 59.42 1l4s n PHE 105 Cb 0.66 -3.30 -0.05 0.00 0.35 0.00 0.00 39.48 37.13 1l4s n PHE 105 CO 0.00 0.00 0.00 1.55 -0.76 0.00 0.00 176.76 177.55 1l4s n VAL 106 N -0.89 -0.36 -1.21 -2.13 3.14 -1.26 -5.01 118.33 110.61 1l4s n VAL 106 Ca 0.00 0.47 0.00 0.00 -2.96 0.00 0.00 64.34 61.85 1l4s n VAL 106 Cb 0.00 -0.76 0.00 0.00 -1.06 0.00 0.00 33.84 32.02 1l4s n VAL 106 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1l4s n GLU 107 N -3.65 -3.35 0.14 1.45 2.13 -1.26 -5.05 120.64 111.05 1l4s n GLU 107 Ca -0.04 2.42 0.00 0.00 0.66 0.00 0.00 57.16 60.20 1l4s n GLU 107 Cb 0.48 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.53 1l4s n GLU 107 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1l4s n GLU 108 N 0.20 0.00 -3.92 5.31 1.02 -1.26 -4.92 120.64 117.07 1l4s n GLU 108 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 1l4s n GLU 108 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.31 1l4s n GLU 108 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1l4s s VAL 109 N -1.57 0.09 0.07 2.62 -7.23 -1.26 -5.12 120.40 108.01 1l4s s VAL 109 Ca 0.00 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.44 1l4s s VAL 109 Cb 0.00 -0.33 0.00 0.00 0.56 0.00 0.00 36.38 36.61 1l4s s VAL 109 CO 0.00 -0.40 0.00 -0.62 -0.31 0.00 0.00 175.10 173.77 1l4s n GLU 110 N 1.65 -0.63 0.05 4.82 1.02 -1.26 -4.93 120.64 121.35 1l4s n GLU 110 Ca -0.22 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1l4s n GLU 110 Cb 0.56 -0.77 0.00 0.00 -0.02 0.00 0.00 31.44 31.21 1l4s n GLU 110 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1l4s n GLU 111 N -2.42 0.00 0.00 3.49 2.13 -1.26 -5.08 120.64 117.50 1l4s n GLU 111 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1l4s n GLU 111 Cb 0.14 -0.11 0.00 0.00 0.27 0.00 0.00 31.44 31.74 1l4s n GLU 111 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81