#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3g n ASN 3 N 0.00 0.18 -3.09 6.43 4.05 -1.26 -3.39 115.26 118.18 1l3g n ASN 3 Ca 0.00 0.08 -0.15 0.00 0.45 0.00 0.00 54.58 54.96 1l3g n ASN 3 Cb 0.00 -0.25 0.10 0.00 1.23 0.00 0.00 39.78 40.86 1l3g n ASN 3 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1l3g n GLN 4 N -1.37 -0.49 -3.63 1.20 3.00 -1.26 -4.40 117.38 110.42 1l3g n GLN 4 Ca 0.09 -1.17 -0.38 0.00 -0.01 0.00 0.00 57.00 55.52 1l3g n GLN 4 Cb 0.31 -0.65 -0.08 0.00 0.00 0.00 0.00 30.24 29.83 1l3g n GLN 4 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1l3g s ILE 5 N -2.33 4.15 0.74 5.09 1.01 -1.26 -4.37 121.20 124.23 1l3g s ILE 5 Ca 0.39 -2.97 -0.15 0.00 0.00 0.00 0.00 60.65 57.91 1l3g s ILE 5 Cb -0.01 -3.66 0.01 0.00 0.01 0.00 0.00 42.46 38.81 1l3g s ILE 5 CO 0.27 -0.93 0.89 -1.22 0.00 0.00 0.00 174.94 173.95 1l3g n TYR 6 N 3.44 0.36 -4.09 3.97 4.01 0.68 -4.44 117.16 121.09 1l3g n TYR 6 Ca 0.11 0.38 -0.35 0.00 -0.16 0.00 0.00 57.90 57.87 1l3g n TYR 6 Cb 0.39 -2.04 -0.07 0.00 -0.31 0.00 0.00 39.34 37.31 1l3g n TYR 6 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1l3g s SER 7 N -1.68 5.86 0.08 7.72 0.15 0.51 0.89 113.70 127.22 1l3g s SER 7 Ca 0.71 0.29 -0.13 0.00 0.70 0.00 0.00 55.95 57.53 1l3g s SER 7 Cb -0.33 -1.78 0.02 0.00 -1.71 0.00 0.00 66.02 62.21 1l3g s SER 7 CO 0.53 0.37 0.29 0.00 1.20 0.00 0.00 173.24 175.62 1l3g s ALA 8 N -1.02 -0.59 -0.10 5.45 0.00 4.46 -2.00 121.76 127.95 1l3g s ALA 8 Ca 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 51.96 51.88 1l3g s ALA 8 Cb -0.12 0.46 0.05 0.00 0.00 0.00 0.00 23.12 23.52 1l3g s ALA 8 CO 0.06 -0.50 0.14 -0.98 0.00 0.00 0.00 175.76 174.48 1l3g s ARG 9 N -3.27 0.03 0.12 0.00 1.70 -1.26 0.68 118.95 116.96 1l3g s ARG 9 Ca 0.00 0.41 0.04 0.00 -0.47 0.00 0.00 55.73 55.71 1l3g s ARG 9 Cb 0.02 -0.62 -0.04 0.00 -0.57 0.00 0.00 34.95 33.74 1l3g s ARG 9 CO -0.08 -0.40 -0.11 0.71 -1.08 0.00 0.00 175.30 174.35 1l3g s TYR 10 N 2.26 1.21 -1.47 5.89 2.02 0.14 -4.79 117.35 122.61 1l3g s TYR 10 Ca 0.04 -0.69 -0.12 0.00 -0.37 0.00 0.00 57.07 55.93 1l3g s TYR 10 Cb -0.13 -0.63 0.08 0.00 -0.40 0.00 0.00 41.96 40.87 1l3g s TYR 10 CO -0.06 0.06 0.78 0.45 -1.57 0.00 0.00 175.55 175.21 1l3g n SER 11 N 0.20 -4.59 0.00 2.29 2.88 -1.26 0.89 113.62 114.03 1l3g n SER 11 Ca -0.13 -0.61 0.00 0.00 -1.33 0.00 0.00 58.87 56.80 1l3g n SER 11 Cb 0.59 -3.71 0.00 0.00 -0.75 0.00 0.00 64.21 60.34 1l3g n SER 11 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1l3g n GLY 12 N -1.50 1.94 3.87 0.46 0.00 -1.26 -4.96 105.19 103.74 1l3g n GLY 12 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1l3g n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l3g s VAL 13 N -2.16 4.83 -0.19 1.61 1.01 0.26 -5.07 120.40 120.69 1l3g s VAL 13 Ca 0.00 0.59 -0.04 0.00 0.00 0.00 0.00 61.98 62.53 1l3g s VAL 13 Cb 0.00 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 1l3g s VAL 13 CO 0.00 -0.25 -0.04 -0.62 0.00 0.00 0.00 175.10 174.20 1l3g s ASP 14 N -2.63 4.56 0.24 3.32 2.15 -1.26 0.28 116.67 123.33 1l3g s ASP 14 Ca 0.50 -0.26 0.02 0.00 0.43 0.00 0.00 52.55 53.24 1l3g s ASP 14 Cb -0.11 -1.76 -0.04 0.00 -0.30 0.00 0.00 42.92 40.71 1l3g s ASP 14 CO 0.24 0.07 0.18 0.68 -0.17 0.00 0.00 175.17 176.17 1l3g s VAL 15 N 0.93 0.00 0.12 1.11 -7.23 3.19 0.70 120.40 119.22 1l3g s VAL 15 Ca -0.00 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.24 1l3g s VAL 15 Cb -0.15 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 1l3g s VAL 15 CO 0.01 0.00 -0.06 -0.31 -0.31 0.00 0.00 175.10 174.43 1l3g s TYR 16 N -3.91 2.80 -0.21 2.82 2.02 -1.04 0.82 117.35 120.64 1l3g s TYR 16 Ca 0.40 -0.13 0.01 0.00 -0.37 0.00 0.00 57.07 56.98 1l3g s TYR 16 Cb 0.05 -1.43 0.03 0.00 -0.40 0.00 0.00 41.96 40.21 1l3g s TYR 16 CO 0.17 0.46 -0.15 -1.21 -1.57 0.00 0.00 175.55 173.25 1l3g s GLU 17 N -2.41 2.75 -0.00 -0.62 2.02 5.25 -1.34 118.70 124.35 1l3g s GLU 17 Ca 0.24 -1.00 0.02 0.00 0.02 0.00 0.00 54.97 54.24 1l3g s GLU 17 Cb -0.11 -2.72 -0.01 0.00 0.10 0.00 0.00 34.13 31.40 1l3g s GLU 17 CO 0.16 -0.34 -0.06 0.12 0.02 0.00 0.00 175.26 175.16 1l3g s PHE 18 N 1.24 0.51 0.07 1.61 2.19 -0.47 0.25 117.98 123.38 1l3g s PHE 18 Ca 0.00 -0.11 -0.30 0.00 0.33 0.00 0.00 56.93 56.85 1l3g s PHE 18 Cb -0.16 -0.33 -0.05 0.00 -1.31 0.00 0.00 43.02 41.18 1l3g s PHE 18 CO -0.09 -0.01 1.02 0.42 1.83 0.00 0.00 175.22 178.38 1l3g s ILE 19 N -0.19 4.49 0.00 3.12 -1.09 -1.04 0.38 121.20 126.87 1l3g s ILE 19 Ca 0.02 1.93 0.00 0.00 -2.23 0.00 0.00 60.65 60.37 1l3g s ILE 19 Cb -0.03 -4.24 0.00 0.00 -1.58 0.00 0.00 42.46 36.62 1l3g s ILE 19 CO -0.00 0.23 0.00 1.41 -1.23 0.00 0.00 174.94 175.35 1l3g n HIS 20 N 3.27 0.00 -0.29 3.97 8.25 3.53 -4.83 115.22 129.12 1l3g n HIS 20 Ca 0.04 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.45 1l3g n HIS 20 Cb 0.49 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.68 1l3g n HIS 20 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1l3g h SER 21 N 0.00 1.10 -0.59 0.41 0.02 -1.91 -1.60 113.55 110.99 1l3g h SER 21 Ca 0.00 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1l3g h SER 21 Cb 0.00 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.26 1l3g h SER 21 CO 0.00 0.96 0.00 1.07 -1.14 0.00 0.00 176.83 177.72 1l3g n THR 22 N -4.28 0.82 0.00 -2.27 5.66 -1.26 -4.96 114.28 108.00 1l3g n THR 22 Ca 0.07 -0.79 0.00 0.00 -3.05 0.00 0.00 64.05 60.28 1l3g n THR 22 Cb 0.18 0.37 0.00 0.00 -1.55 0.00 0.00 70.33 69.33 1l3g n THR 22 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1l3g n GLY 23 N 1.41 1.37 3.75 1.09 0.00 -0.60 -4.88 105.19 107.32 1l3g n GLY 23 Ca 0.20 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 1l3g n GLY 23 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1l3g s SER 24 N -4.00 7.53 -0.14 1.61 1.04 -1.21 0.72 113.70 119.25 1l3g s SER 24 Ca 0.00 1.81 0.01 0.00 0.48 0.00 0.00 55.95 58.25 1l3g s SER 24 Cb 0.00 -2.57 -0.00 0.00 0.10 0.00 0.00 66.02 63.55 1l3g s SER 24 CO 0.00 0.12 -0.16 -0.63 0.98 0.00 0.00 173.24 173.54 1l3g s ILE 25 N -0.85 2.66 -0.22 -1.02 1.01 1.23 -4.48 121.20 119.53 1l3g s ILE 25 Ca 0.41 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 60.20 1l3g s ILE 25 Cb -0.24 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 1l3g s ILE 25 CO 0.30 0.53 0.06 -0.32 0.00 0.00 0.00 174.94 175.50 1l3g s MET 26 N 0.62 3.77 0.04 2.79 1.75 -1.00 -1.37 119.30 125.89 1l3g s MET 26 Ca -0.09 -0.43 -0.03 0.00 -1.25 0.00 0.00 55.69 53.89 1l3g s MET 26 Cb -0.16 -3.25 -0.04 0.00 2.84 0.00 0.00 34.83 34.22 1l3g s MET 26 CO 0.03 0.02 0.23 0.21 -0.65 0.00 0.00 175.02 174.86 1l3g s LYS 27 N 1.06 3.49 -0.03 4.11 2.20 -0.45 -4.43 119.74 125.68 1l3g s LYS 27 Ca 0.04 -0.29 -0.25 0.00 -0.36 0.00 0.00 55.97 55.11 1l3g s LYS 27 Cb -0.14 -3.04 -0.04 0.00 -1.51 0.00 0.00 37.83 33.09 1l3g s LYS 27 CO 0.03 0.62 0.76 0.50 -0.36 0.00 0.00 175.35 176.91 1l3g s ARG 28 N -2.18 4.47 0.16 4.03 3.52 -1.09 -2.19 118.95 125.68 1l3g s ARG 28 Ca 0.32 1.01 -0.10 0.00 -0.13 0.00 0.00 55.73 56.83 1l3g s ARG 28 Cb -0.13 -3.43 0.01 0.00 -1.56 0.00 0.00 34.95 29.84 1l3g s ARG 28 CO 0.22 0.09 1.55 -0.22 -0.81 0.00 0.00 175.30 176.13 1l3g h LYS 29 N 6.53 1.01 -0.27 5.12 3.64 2.33 1.61 116.57 136.54 1l3g h LYS 29 Ca -0.42 -0.43 0.03 0.00 -1.27 0.00 0.00 60.65 58.56 1l3g h LYS 29 Cb 1.20 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.94 1l3g h LYS 29 CO 0.74 1.11 -0.27 0.87 -2.27 0.00 0.00 179.45 179.63 1l3g h LYS 30 N 0.87 -0.13 -0.10 1.90 1.79 -1.93 -3.10 116.57 115.86 1l3g h LYS 30 Ca 0.11 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 1l3g h LYS 30 Cb 0.79 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 1l3g h LYS 30 CO 0.07 -0.09 0.00 -3.47 -1.08 0.00 0.00 179.45 174.88 1l3g n ASP 31 N -4.00 2.73 -3.91 0.86 -0.08 -1.24 -5.00 116.55 105.91 1l3g n ASP 31 Ca -0.01 -2.78 -0.38 0.00 -1.51 0.00 0.00 54.79 50.11 1l3g n ASP 31 Cb 0.15 -0.37 0.02 0.00 2.34 0.00 0.00 41.12 43.27 1l3g n ASP 31 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1l3g n ASP 32 N -0.86 -4.22 -4.92 1.67 8.00 0.55 -4.35 116.55 112.42 1l3g n ASP 32 Ca 0.14 -1.16 -0.26 0.00 0.71 0.00 0.00 54.79 54.22 1l3g n ASP 32 Cb 0.62 -2.50 -0.01 0.00 -0.02 0.00 0.00 41.12 39.21 1l3g n ASP 32 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1l3g s TRP 33 N -3.56 3.54 0.09 1.24 0.52 -1.14 -2.81 118.94 116.82 1l3g s TRP 33 Ca 0.44 0.67 0.10 0.00 0.02 0.00 0.00 56.10 57.33 1l3g s TRP 33 Cb -0.20 -2.18 -0.03 0.00 -1.15 0.00 0.00 33.47 29.91 1l3g s TRP 33 CO 0.92 -0.15 -0.25 0.08 0.02 0.00 0.00 176.95 177.57 1l3g s VAL 34 N -2.60 2.30 -0.52 4.03 1.01 0.26 -2.66 120.40 122.22 1l3g s VAL 34 Ca 0.45 -1.54 -0.26 0.00 0.00 0.00 0.00 61.98 60.63 1l3g s VAL 34 Cb -0.10 -1.97 -0.07 0.00 0.00 0.00 0.00 36.38 34.24 1l3g s VAL 34 CO 0.42 0.23 2.38 0.21 0.00 0.00 0.00 175.10 178.33 1l3g s ASN 35 N -1.67 4.43 0.47 3.32 3.04 -1.25 0.15 114.94 123.43 1l3g s ASN 35 Ca 0.13 0.94 0.31 0.00 0.04 0.00 0.00 52.86 54.28 1l3g s ASN 35 Cb -0.10 -2.51 1.05 0.00 -1.54 0.00 0.00 41.25 38.15 1l3g s ASN 35 CO 0.05 -2.94 1.14 0.00 -3.04 0.00 0.00 177.10 172.31 1l3g n ALA 36 N 15.99 1.15 0.11 1.71 0.00 0.40 0.13 120.51 140.00 1l3g n ALA 36 Ca 0.37 0.40 -0.13 0.00 0.00 0.00 0.00 53.44 54.07 1l3g n ALA 36 Cb 0.54 -0.69 -0.08 0.00 0.00 0.00 0.00 19.45 19.22 1l3g n ALA 36 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1l3g h THR 37 N 0.00 0.90 -0.18 0.00 2.02 -1.78 5.42 112.91 119.29 1l3g h THR 37 Ca 0.57 -0.30 0.05 0.00 0.77 0.00 0.00 66.41 67.50 1l3g h THR 37 Cb 2.70 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 70.19 1l3g h THR 37 CO -0.01 0.07 0.14 -0.74 0.37 0.00 0.00 175.52 175.36 1l3g h HIS 38 N -0.37 0.00 0.03 3.16 6.17 0.69 5.14 115.15 129.97 1l3g h HIS 38 Ca -0.02 0.00 -0.27 0.00 0.71 0.00 0.00 60.37 60.79 1l3g h HIS 38 Cb 0.29 0.00 -0.03 0.00 2.52 0.00 0.00 27.41 30.19 1l3g h HIS 38 CO -0.02 0.00 -1.47 -0.89 0.71 0.00 0.00 177.93 176.26 1l3g n ILE 39 N -4.26 1.60 -0.09 6.26 -0.00 -0.71 -3.29 119.36 118.86 1l3g n ILE 39 Ca 0.01 -0.19 -0.23 0.00 -0.00 0.00 0.00 62.75 62.35 1l3g n ILE 39 Cb 0.27 -1.96 -0.12 0.00 -0.00 0.00 0.00 39.64 37.83 1l3g n ILE 39 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.55 176.44 1l3g n LEU 40 N -4.19 2.01 0.21 1.39 7.94 1.76 -4.07 117.00 122.04 1l3g n LEU 40 Ca -0.32 0.37 0.05 0.00 -1.11 0.00 0.00 56.01 54.99 1l3g n LEU 40 Cb 0.78 -0.98 0.45 0.00 0.53 0.00 0.00 43.42 44.20 1l3g n LEU 40 CO 0.25 0.41 0.82 0.50 -1.11 0.00 0.00 177.39 178.25 1l3g h LYS 41 N -0.82 0.00 -0.13 1.96 1.63 0.98 0.85 116.57 121.05 1l3g h LYS 41 Ca -0.40 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 59.44 1l3g h LYS 41 Cb 1.46 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.08 1l3g h LYS 41 CO -0.18 0.27 0.21 0.00 -3.45 0.00 0.00 179.45 176.29 1l3g h ALA 42 N 1.73 1.59 -0.02 5.00 0.00 0.13 -3.00 119.26 124.69 1l3g h ALA 42 Ca -0.00 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1l3g h ALA 42 Cb 0.49 0.01 -0.28 0.00 0.00 0.00 0.00 17.79 18.01 1l3g h ALA 42 CO 0.03 -0.27 -0.71 0.00 0.00 0.00 0.00 179.25 178.30 1l3g n ALA 43 N -2.20 2.96 -1.37 0.00 0.00 -0.70 -4.88 120.51 114.32 1l3g n ALA 43 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 53.44 51.80 1l3g n ALA 43 Cb 0.31 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.17 1l3g n ALA 43 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1l3g n ASN 44 N 0.15 0.00 -1.67 0.00 0.23 0.29 -5.00 115.26 109.25 1l3g n ASN 44 Ca -0.09 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.96 1l3g n ASN 44 Cb 0.94 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.64 1l3g n ASN 44 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1l3g n PHE 45 N 0.00 -2.59 -3.10 -2.53 3.72 -1.17 -4.69 117.46 107.10 1l3g n PHE 45 Ca 0.00 1.35 -0.45 0.00 -0.05 0.00 0.00 57.45 58.30 1l3g n PHE 45 Cb 0.41 -2.20 -0.03 0.00 -0.94 0.00 0.00 39.48 36.73 1l3g n PHE 45 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1l3g s ALA 46 N -1.85 3.62 0.00 4.37 0.00 -1.26 -4.33 121.76 122.31 1l3g s ALA 46 Ca 0.00 -2.82 0.00 0.00 0.00 0.00 0.00 51.96 49.14 1l3g s ALA 46 Cb 0.00 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1l3g s ALA 46 CO 0.00 -2.60 0.00 1.17 0.00 0.00 0.00 175.76 174.33 1l3g n LYS 47 N 5.65 1.15 0.15 0.00 4.81 -1.26 -4.87 118.16 123.79 1l3g n LYS 47 Ca 0.13 0.00 0.19 0.00 -0.87 0.00 0.00 58.31 57.75 1l3g n LYS 47 Cb 0.47 0.00 0.73 0.00 0.02 0.00 0.00 35.03 36.24 1l3g n LYS 47 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1l3g h ALA 48 N 1.00 1.94 0.08 3.14 0.00 -1.99 0.33 119.26 123.75 1l3g h ALA 48 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1l3g h ALA 48 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1l3g h ALA 48 CO 0.00 -0.64 -0.04 0.87 0.00 0.00 0.00 179.25 179.44 1l3g h LYS 49 N 0.00 -0.11 0.00 0.00 1.57 -1.93 -2.80 116.57 113.31 1l3g h LYS 49 Ca 0.15 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1l3g h LYS 49 Cb 1.10 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 1l3g h LYS 49 CO -0.00 0.29 -0.07 0.00 -0.57 0.00 0.00 179.45 179.10 1l3g h ARG 50 N -0.53 0.00 -0.23 3.15 2.47 -0.59 0.15 114.38 118.80 1l3g h ARG 50 Ca -0.01 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.62 1l3g h ARG 50 Cb 0.45 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.75 1l3g h ARG 50 CO 0.02 0.07 -0.24 0.00 0.56 0.00 0.00 179.97 180.37 1l3g h THR 51 N 0.00 1.26 0.00 2.04 1.03 -1.04 -0.67 112.91 115.53 1l3g h THR 51 Ca -0.00 -1.22 0.00 0.00 -0.01 0.00 0.00 66.41 65.18 1l3g h THR 51 Cb 0.14 1.35 0.00 0.00 -1.07 0.00 0.00 68.15 68.57 1l3g h THR 51 CO 0.01 0.38 -0.07 0.54 -0.01 0.00 0.00 175.52 176.37 1l3g n ARG 52 N -4.14 0.05 -0.31 0.00 1.74 -0.45 -2.85 116.66 110.71 1l3g n ARG 52 Ca -0.00 0.20 0.14 0.00 -0.77 0.00 0.00 57.85 57.42 1l3g n ARG 52 Cb 0.39 -0.78 0.32 0.00 -1.02 0.00 0.00 32.46 31.37 1l3g n ARG 52 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1l3g h ILE 53 N -0.11 0.47 0.50 0.55 2.04 -0.92 0.56 117.51 120.60 1l3g h ILE 53 Ca 0.00 -0.14 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 1l3g h ILE 53 Cb 0.07 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.18 1l3g h ILE 53 CO 0.00 0.08 -0.24 0.25 0.00 0.00 0.00 178.15 178.23 1l3g h LEU 54 N 0.41 -0.57 -1.10 1.44 6.46 -1.23 0.13 115.31 120.85 1l3g h LEU 54 Ca 0.57 -0.05 0.19 0.00 -0.12 0.00 0.00 57.88 58.46 1l3g h LEU 54 Cb 1.10 0.15 -0.10 0.00 -0.73 0.00 0.00 40.66 41.08 1l3g h LEU 54 CO -0.53 -0.17 0.61 -0.08 -0.62 0.00 0.00 178.44 177.65 1l3g h GLU 55 N -1.07 0.71 0.00 1.25 4.81 -1.14 2.10 114.58 121.24 1l3g h GLU 55 Ca -0.07 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.02 1l3g h GLU 55 Cb 0.59 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1l3g h GLU 55 CO 0.11 0.47 -0.47 -0.22 -0.73 0.00 0.00 179.01 178.17 1l3g h LYS 56 N 0.73 0.00 0.07 1.92 3.11 0.15 2.13 116.57 124.68 1l3g h LYS 56 Ca 0.55 0.00 -0.18 0.00 -2.81 0.00 0.00 60.65 58.21 1l3g h LYS 56 Cb 0.90 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.13 1l3g h LYS 56 CO -0.33 0.47 -0.92 1.49 -2.81 0.00 0.00 179.45 177.34 1l3g h GLU 57 N 0.00 0.15 0.05 1.90 4.57 0.29 -3.35 114.58 118.19 1l3g h GLU 57 Ca -0.00 -0.26 -0.30 0.00 -1.18 0.00 0.00 59.36 57.62 1l3g h GLU 57 Cb 1.11 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.76 1l3g h GLU 57 CO 0.06 1.12 -1.63 0.28 -1.18 0.00 0.00 179.01 177.67 1l3g n VAL 58 N -4.22 1.63 -0.31 0.32 0.31 0.66 -3.91 118.33 112.80 1l3g n VAL 58 Ca -0.20 -0.30 0.13 0.00 -0.01 0.00 0.00 64.34 63.96 1l3g n VAL 58 Cb 0.74 -1.91 0.25 0.00 -0.91 0.00 0.00 33.84 32.02 1l3g n VAL 58 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1l3g n LEU 59 N -4.04 -0.12 0.00 7.52 -0.00 0.72 0.80 117.00 121.88 1l3g n LEU 59 Ca -0.33 1.53 0.08 0.00 -0.00 0.00 0.00 56.01 57.29 1l3g n LEU 59 Cb 0.84 -0.55 0.39 0.00 -0.00 0.00 0.00 43.42 44.10 1l3g n LEU 59 CO 0.27 -1.54 0.77 0.29 -0.00 0.00 0.00 177.39 177.18 1l3g n LYS 60 N -5.33 0.07 -0.85 1.96 4.76 -1.23 -4.72 118.16 112.82 1l3g n LYS 60 Ca 0.21 0.18 0.00 0.00 -2.87 0.00 0.00 58.31 55.83 1l3g n LYS 60 Cb 0.67 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.36 1l3g n LYS 60 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1l3g n GLU 61 N -1.44 2.51 -1.43 1.97 -0.58 4.33 -5.00 120.64 121.00 1l3g n GLU 61 Ca 0.05 0.00 -0.25 0.00 -0.42 0.00 0.00 57.16 56.54 1l3g n GLU 61 Cb 0.18 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 30.98 1l3g n GLU 61 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 1l3g n THR 62 N -0.22 3.28 -1.81 2.62 5.66 -1.25 -4.93 114.28 117.63 1l3g n THR 62 Ca 0.00 -2.83 -0.42 0.00 -3.05 0.00 0.00 64.05 57.75 1l3g n THR 62 Cb 0.00 -1.63 -0.03 0.00 -1.55 0.00 0.00 70.33 67.12 1l3g n THR 62 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 1l3g s HIS 63 N -1.43 1.56 -0.15 1.09 -3.43 -1.24 -4.53 115.29 107.16 1l3g s HIS 63 Ca 0.60 -0.02 -0.01 0.00 -0.80 0.00 0.00 55.06 54.83 1l3g s HIS 63 Cb 0.38 -4.08 -0.01 0.00 -1.43 0.00 0.00 32.58 27.44 1l3g s HIS 63 CO -0.20 -4.56 -0.12 -1.21 -2.00 0.00 0.00 174.74 166.64 1l3g s GLU 64 N 4.62 3.34 -0.16 -0.38 0.41 -1.18 -4.78 118.70 120.57 1l3g s GLU 64 Ca 0.84 -0.69 -0.14 0.00 -0.41 0.00 0.00 54.97 54.57 1l3g s GLU 64 Cb -0.36 -2.69 -0.05 0.00 -1.78 0.00 0.00 34.13 29.25 1l3g s GLU 64 CO 0.36 0.09 0.29 -1.59 -0.49 0.00 0.00 175.26 173.92 1l3g s LYS 65 N 0.66 4.26 -0.08 1.61 -2.85 -0.35 -1.27 119.74 121.71 1l3g s LYS 65 Ca -0.07 0.09 -0.20 0.00 -1.00 0.00 0.00 55.97 54.79 1l3g s LYS 65 Cb -0.15 -3.43 -0.04 0.00 -2.06 0.00 0.00 37.83 32.15 1l3g s LYS 65 CO 0.02 0.24 0.58 0.14 0.10 0.00 0.00 175.35 176.43 1l3g s VAL 66 N 0.47 5.08 -0.03 1.79 -7.23 0.02 -4.94 120.40 115.57 1l3g s VAL 66 Ca 0.16 1.18 -0.04 0.00 -1.81 0.00 0.00 61.98 61.48 1l3g s VAL 66 Cb -0.13 -3.92 0.01 0.00 0.56 0.00 0.00 36.38 32.90 1l3g s VAL 66 CO 0.04 0.32 0.11 -1.58 -0.31 0.00 0.00 175.10 173.67 1l3g s GLN 67 N 0.51 0.21 0.00 4.82 2.00 -1.24 -4.49 119.66 121.46 1l3g s GLN 67 Ca 0.31 0.00 0.00 0.00 -2.00 0.00 0.00 55.36 53.67 1l3g s GLN 67 Cb -0.17 0.09 0.00 0.00 0.80 0.00 0.00 33.01 33.73 1l3g s GLN 67 CO 0.14 -0.04 0.00 0.41 -0.50 0.00 0.00 175.29 175.31 1l3g n GLY 68 N 2.64 0.85 0.90 2.59 0.00 -1.26 -3.93 105.19 106.99 1l3g n GLY 68 Ca -0.15 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1l3g n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l3g n GLY 69 N -2.29 0.68 3.28 -0.02 0.00 -1.26 -5.01 105.19 100.57 1l3g n GLY 69 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1l3g n GLY 69 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1l3g s PHE 70 N -2.54 3.65 0.00 1.61 -0.12 -1.25 -4.33 117.98 114.99 1l3g s PHE 70 Ca 0.00 -2.08 0.00 0.00 -0.05 0.00 0.00 56.93 54.80 1l3g s PHE 70 Cb 0.00 -3.69 0.00 0.00 -0.63 0.00 0.00 43.02 38.70 1l3g s PHE 70 CO 0.00 -0.96 0.00 0.41 -0.05 0.00 0.00 175.22 174.62 1l3g n GLY 71 N 3.99 0.87 0.10 1.99 0.00 -1.26 -3.69 105.19 107.19 1l3g n GLY 71 Ca 0.10 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1l3g n GLY 71 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1l3g n LYS 72 N -1.85 0.60 -0.02 1.61 0.00 -1.26 -1.66 118.16 115.58 1l3g n LYS 72 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.31 58.30 1l3g n LYS 72 Cb 0.12 -1.06 -0.05 0.00 0.00 0.00 0.00 35.03 34.04 1l3g n LYS 72 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1l3g n TYR 73 N -0.36 0.00 -0.07 5.64 4.01 -1.26 -4.70 117.16 120.42 1l3g n TYR 73 Ca 0.00 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.53 1l3g n TYR 73 Cb 0.03 -0.27 -0.13 0.00 -0.31 0.00 0.00 39.34 38.67 1l3g n TYR 73 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1l3g n GLN 74 N -2.06 0.69 0.00 -0.72 3.00 -0.76 -4.46 117.38 113.06 1l3g n GLN 74 Ca -0.07 0.26 0.00 0.00 -0.01 0.00 0.00 57.00 57.18 1l3g n GLN 74 Cb 0.52 -1.63 0.00 0.00 0.00 0.00 0.00 30.24 29.13 1l3g n GLN 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1l3g n GLY 75 N 1.95 1.80 3.22 1.08 0.00 -0.66 -4.38 105.19 108.19 1l3g n GLY 75 Ca -0.39 0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 1l3g n GLY 75 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1l3g s THR 76 N 0.00 3.74 0.28 2.61 -4.23 -0.40 -0.80 115.64 116.83 1l3g s THR 76 Ca 0.00 -1.53 -0.29 0.00 -1.18 0.00 0.00 61.69 58.69 1l3g s THR 76 Cb 0.00 -3.31 -0.09 0.00 1.34 0.00 0.00 72.50 70.43 1l3g s THR 76 CO 0.00 -0.45 1.04 0.26 -0.54 0.00 0.00 174.62 174.93 1l3g s TRP 77 N 1.32 3.68 0.11 3.99 0.51 -0.42 0.15 118.94 128.29 1l3g s TRP 77 Ca 0.02 1.77 0.08 0.00 -2.12 0.00 0.00 56.10 55.85 1l3g s TRP 77 Cb -0.22 -3.17 -0.04 0.00 -0.81 0.00 0.00 33.47 29.24 1l3g s TRP 77 CO 0.00 -0.22 -0.20 0.14 -0.51 0.00 0.00 176.95 176.16 1l3g s VAL 78 N -1.22 1.68 -0.23 4.03 -7.23 0.40 -3.10 120.40 114.73 1l3g s VAL 78 Ca 0.45 -1.60 -0.33 0.00 -1.81 0.00 0.00 61.98 58.69 1l3g s VAL 78 Cb -0.29 -1.57 -0.10 0.00 0.56 0.00 0.00 36.38 34.98 1l3g s VAL 78 CO 0.37 -0.12 2.10 -0.81 -0.31 0.00 0.00 175.10 176.32 1l3g n PRO 79 N 0.95 1.67 -0.30 4.82 -0.04 -1.26 0.93 135.00 141.76 1l3g n PRO 79 Ca -0.18 0.52 0.27 0.00 -0.04 0.00 0.00 63.50 64.07 1l3g n PRO 79 Cb 0.54 -2.73 0.60 0.00 -0.04 0.00 0.00 33.50 31.87 1l3g n PRO 79 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 1l3g h LEU 80 N 12.08 0.27 -1.42 1.53 -0.00 -1.72 4.22 115.31 130.27 1l3g h LEU 80 Ca -0.38 0.05 -0.02 0.00 -0.00 0.00 0.00 57.88 57.52 1l3g h LEU 80 Cb 1.28 0.01 -0.02 0.00 -0.00 0.00 0.00 40.66 41.93 1l3g h LEU 80 CO 0.98 0.05 0.12 -0.55 -0.00 0.00 0.00 178.44 179.04 1l3g h ASN 81 N 0.23 0.46 0.00 0.17 -1.07 -1.87 -1.87 115.58 111.63 1l3g h ASN 81 Ca 0.56 -0.05 -0.26 0.00 0.07 0.00 0.00 56.30 56.63 1l3g h ASN 81 Cb 1.74 -0.12 -0.05 0.00 -2.07 0.00 0.00 38.32 37.83 1l3g h ASN 81 CO -0.18 0.44 -1.97 2.30 0.07 0.00 0.00 177.43 178.10 1l3g n ILE 82 N -4.37 0.97 0.41 6.14 -6.64 0.28 -4.06 119.36 112.08 1l3g n ILE 82 Ca 0.02 -0.58 -0.17 0.00 -1.77 0.00 0.00 62.75 60.24 1l3g n ILE 82 Cb 0.16 -0.66 -0.09 0.00 -1.44 0.00 0.00 39.64 37.61 1l3g n ILE 82 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1l3g h ALA 83 N 0.64 -1.04 -0.05 -1.28 0.00 0.77 -1.51 119.26 116.80 1l3g h ALA 83 Ca -0.38 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.30 1l3g h ALA 83 Cb 1.85 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 20.04 1l3g h ALA 83 CO 0.01 -1.02 0.03 0.87 0.00 0.00 0.00 179.25 179.15 1l3g h LYS 84 N -1.18 0.02 0.00 0.00 1.57 -1.51 0.05 116.57 115.53 1l3g h LYS 84 Ca -0.11 -0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 1l3g h LYS 84 Cb 0.81 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 1l3g h LYS 84 CO 0.17 0.01 -0.35 0.37 -0.57 0.00 0.00 179.45 179.09 1l3g h GLN 85 N 0.02 0.00 0.15 3.15 4.15 -1.63 1.16 115.11 122.12 1l3g h GLN 85 Ca 0.02 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.11 1l3g h GLN 85 Cb 0.05 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.74 1l3g h GLN 85 CO -0.00 0.35 -1.64 1.25 -1.93 0.00 0.00 178.83 176.86 1l3g h LEU 86 N 0.00 0.49 0.00 -2.39 6.46 0.00 -3.37 115.31 116.51 1l3g h LEU 86 Ca -0.00 -0.72 0.00 0.00 -0.12 0.00 0.00 57.88 57.04 1l3g h LEU 86 Cb 0.63 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.40 1l3g h LEU 86 CO 0.05 1.60 -0.47 0.00 -0.62 0.00 0.00 178.44 179.00 1l3g n ALA 87 N -2.76 0.42 -0.06 1.25 0.00 -0.36 -4.05 120.51 114.95 1l3g n ALA 87 Ca -0.20 -0.40 0.13 0.00 0.00 0.00 0.00 53.44 52.97 1l3g n ALA 87 Cb 1.06 0.01 0.20 0.00 0.00 0.00 0.00 19.45 20.72 1l3g n ALA 87 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1l3g n GLU 88 N -4.44 0.01 0.00 0.00 0.28 0.40 -0.96 120.64 115.93 1l3g n GLU 88 Ca -0.07 0.59 0.00 0.00 -0.16 0.00 0.00 57.16 57.52 1l3g n GLU 88 Cb 0.25 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.62 1l3g n GLU 88 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1l3g n LYS 89 N -2.27 0.00 -0.16 3.44 4.81 -1.25 -3.43 118.16 119.30 1l3g n LYS 89 Ca 0.11 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.60 1l3g n LYS 89 Cb 0.84 0.00 0.14 0.00 0.02 0.00 0.00 35.03 36.03 1l3g n LYS 89 CO 0.00 0.00 0.00 1.97 1.17 0.00 0.00 177.40 180.54 1l3g n PHE 90 N 0.00 0.43 -0.02 5.64 -1.74 -1.05 -4.26 117.46 116.45 1l3g n PHE 90 Ca 0.00 -0.49 -0.02 0.00 -0.56 0.00 0.00 57.45 56.38 1l3g n PHE 90 Cb 0.00 -0.03 -0.01 0.00 1.52 0.00 0.00 39.48 40.97 1l3g n PHE 90 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 1l3g n SER 91 N 0.46 0.56 -0.00 5.98 2.88 -0.14 -4.84 113.62 118.52 1l3g n SER 91 Ca 0.11 0.21 0.01 0.00 -1.33 0.00 0.00 58.87 57.86 1l3g n SER 91 Cb 0.41 -0.59 -0.01 0.00 -0.75 0.00 0.00 64.21 63.28 1l3g n SER 91 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1l3g n VAL 92 N -3.03 0.00 -0.26 2.46 0.31 -0.67 -4.29 118.33 112.85 1l3g n VAL 92 Ca -0.03 -0.41 0.21 0.00 -0.01 0.00 0.00 64.34 64.09 1l3g n VAL 92 Cb 0.12 0.93 0.32 0.00 -0.91 0.00 0.00 33.84 34.31 1l3g n VAL 92 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1l3g n TYR 93 N -1.10 0.00 -0.07 3.52 9.36 -0.65 0.41 117.16 128.63 1l3g n TYR 93 Ca 0.00 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 61.16 1l3g n TYR 93 Cb 0.02 -0.19 -0.02 0.00 -0.63 0.00 0.00 39.34 38.52 1l3g n TYR 93 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1l3g n ASP 94 N -2.68 1.81 0.30 2.98 8.00 -1.26 -4.24 116.55 121.46 1l3g n ASP 94 Ca 0.17 0.62 0.16 0.00 0.71 0.00 0.00 54.79 56.45 1l3g n ASP 94 Cb 0.82 -0.88 0.93 0.00 -0.02 0.00 0.00 41.12 41.98 1l3g n ASP 94 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 1l3g h GLN 95 N -1.00 0.00 -0.93 -1.24 5.75 -0.36 -1.24 115.11 116.09 1l3g h GLN 95 Ca -0.03 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.43 1l3g h GLN 95 Cb 0.58 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.11 1l3g h GLN 95 CO -0.02 0.01 0.04 1.28 -2.65 0.00 0.00 178.83 177.49 1l3g n LEU 96 N -3.76 2.65 0.20 -2.39 4.77 0.85 -4.38 117.00 114.93 1l3g n LEU 96 Ca -0.03 -1.35 -0.17 0.00 -0.03 0.00 0.00 56.01 54.43 1l3g n LEU 96 Cb 0.09 -0.56 -0.09 0.00 -2.33 0.00 0.00 43.42 40.53 1l3g n LEU 96 CO 0.27 0.42 0.54 0.11 -1.33 0.00 0.00 177.39 177.40 1l3g h LYS 97 N 0.78 -0.81 0.43 3.23 1.57 -1.40 0.81 116.57 121.17 1l3g h LYS 97 Ca 0.04 0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1l3g h LYS 97 Cb 1.03 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1l3g h LYS 97 CO 0.16 -0.54 -0.21 -1.35 -0.57 0.00 0.00 179.45 176.95 1l3g h PRO 98 N -0.84 -0.55 -0.86 3.15 0.11 -1.77 -1.59 132.00 129.64 1l3g h PRO 98 Ca -0.02 0.04 0.13 0.00 0.11 0.00 0.00 66.00 66.25 1l3g h PRO 98 Cb 0.79 0.13 -0.09 0.00 0.11 0.00 0.00 31.00 31.94 1l3g h PRO 98 CO -0.17 -0.37 0.46 1.25 -0.21 0.00 0.00 178.00 178.96 1l3g h LEU 99 N -0.58 0.60 -1.22 2.35 5.85 -1.74 0.86 115.31 121.44 1l3g h LEU 99 Ca -0.06 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1l3g h LEU 99 Cb 0.44 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 1l3g h LEU 99 CO 0.10 0.28 0.22 -0.26 -0.34 0.00 0.00 178.44 178.44 1l3g h PHE 100 N 0.70 0.76 0.00 1.25 -1.00 0.10 -1.64 116.94 117.11 1l3g h PHE 100 Ca 0.45 -0.03 -0.08 0.00 2.81 0.00 0.00 57.97 61.11 1l3g h PHE 100 Cb 0.57 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.88 1l3g h PHE 100 CO -0.07 0.59 -0.40 -0.44 -1.61 0.00 0.00 178.31 176.37 1l3g h ASP 101 N 0.75 0.00 0.00 2.17 3.32 0.12 -3.45 116.42 119.34 1l3g h ASP 101 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1l3g h ASP 101 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1l3g h ASP 101 CO -0.02 0.40 0.00 2.22 -1.72 0.00 0.00 179.24 180.12 1l3g n PHE 102 N -3.68 0.00 -1.36 4.55 -1.74 -0.59 -5.06 117.46 109.59 1l3g n PHE 102 Ca -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.88 1l3g n PHE 102 Cb 0.49 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.49 1l3g n PHE 102 CO 0.00 0.00 0.00 -2.37 -0.56 0.00 0.00 176.76 173.83 1l3g n THR 103 N 0.00 0.00 -4.11 1.97 5.66 -1.10 -4.47 114.28 112.22 1l3g n THR 103 Ca 0.00 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.78 1l3g n THR 103 Cb 0.00 0.80 -0.05 0.00 -1.55 0.00 0.00 70.33 69.53 1l3g n THR 103 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1l3g s GLN 104 N 0.00 2.61 0.23 1.09 0.00 -1.26 -4.83 119.66 117.49 1l3g s GLN 104 Ca 0.00 -1.30 0.06 0.00 -0.00 0.00 0.00 55.36 54.12 1l3g s GLN 104 Cb 0.00 -2.36 -0.04 0.00 0.00 0.00 0.00 33.01 30.62 1l3g s GLN 104 CO 0.00 0.28 0.22 -0.08 0.00 0.00 0.00 175.29 175.71 1l3g s THR 105 N -2.27 4.64 -2.25 3.63 -1.32 -1.26 -5.00 115.64 111.81 1l3g s THR 105 Ca 0.35 -1.23 0.20 0.00 -1.21 0.00 0.00 61.69 59.81 1l3g s THR 105 Cb -0.06 -3.48 0.46 0.00 -1.51 0.00 0.00 72.50 67.91 1l3g s THR 105 CO 0.23 -0.28 1.55 0.47 -2.21 0.00 0.00 174.62 174.38 1l3g n ASP 106 N -1.01 1.54 0.00 8.08 9.92 -1.26 -4.87 116.55 128.96 1l3g n ASP 106 Ca -0.08 -1.69 0.00 0.00 -0.53 0.00 0.00 54.79 52.48 1l3g n ASP 106 Cb 0.57 -0.10 0.00 0.00 -0.64 0.00 0.00 41.12 40.95 1l3g n ASP 106 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1l3g n GLY 107 N 1.10 1.21 3.81 0.44 0.00 -1.26 -5.04 105.19 105.45 1l3g n GLY 107 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1l3g n GLY 107 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3g s SER 108 N -3.02 3.95 0.46 1.61 0.15 -1.26 -4.96 113.70 110.63 1l3g s SER 108 Ca 0.00 1.01 -0.12 0.00 0.70 0.00 0.00 55.95 57.53 1l3g s SER 108 Cb 0.00 -1.61 -0.09 0.00 -1.71 0.00 0.00 66.02 62.61 1l3g s SER 108 CO 0.00 -2.28 -0.69 0.00 1.20 0.00 0.00 173.24 171.48 1l3g n ALA 109 N -3.59 -2.29 -3.44 5.45 0.00 -1.26 -4.76 120.51 110.62 1l3g n ALA 109 Ca 0.07 -0.61 -0.44 0.00 0.00 0.00 0.00 53.44 52.46 1l3g n ALA 109 Cb 0.59 -0.35 -0.05 0.00 0.00 0.00 0.00 19.45 19.64 1l3g n ALA 109 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1l3g s SER 110 N -0.49 6.13 1.05 0.00 1.04 -1.26 -5.00 113.70 115.17 1l3g s SER 110 Ca 0.16 -2.33 -0.12 0.00 0.48 0.00 0.00 55.95 54.14 1l3g s SER 110 Cb 0.05 -2.10 0.22 0.00 0.10 0.00 0.00 66.02 64.28 1l3g s SER 110 CO 0.29 -0.63 1.07 -2.16 0.98 0.00 0.00 173.24 172.78 1l3g s PRO 111 N 0.74 0.03 0.98 4.02 0.04 -1.26 -4.97 135.00 134.58 1l3g s PRO 111 Ca 0.11 0.82 -0.12 0.00 0.04 0.00 0.00 61.00 61.85 1l3g s PRO 111 Cb -0.20 -1.67 0.12 0.00 0.04 0.00 0.00 34.50 32.79 1l3g s PRO 111 CO -0.03 -3.08 0.75 -2.30 0.04 0.00 0.00 177.00 172.37 1l3g n PRO 112 N -4.46 -0.76 0.00 0.56 -0.02 -1.26 -4.59 135.00 124.46 1l3g n PRO 112 Ca 0.05 -0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1l3g n PRO 112 Cb 0.55 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 1l3g n PRO 112 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1l3g n PRO 113 N -3.19 0.00 -2.62 0.52 -0.02 -0.85 -3.74 135.00 125.10 1l3g n PRO 113 Ca 0.08 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.14 1l3g n PRO 113 Cb 0.54 -0.09 -0.03 0.00 -0.02 0.00 0.00 33.50 33.90 1l3g n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l3g s ALA 114 N -2.61 2.83 -0.24 3.55 0.00 -1.26 -0.37 121.76 123.67 1l3g s ALA 114 Ca 0.00 -1.57 -0.29 0.00 0.00 0.00 0.00 51.96 50.10 1l3g s ALA 114 Cb 0.00 -4.20 0.00 0.00 0.00 0.00 0.00 23.12 18.93 1l3g s ALA 114 CO 0.00 -3.21 1.14 -1.25 0.00 0.00 0.00 175.76 172.44 1l3g s PRO 115 N 5.27 4.16 -1.21 0.00 0.04 -1.26 -4.96 135.00 137.04 1l3g s PRO 115 Ca 0.33 1.35 -0.13 0.00 0.04 0.00 0.00 61.00 62.59 1l3g s PRO 115 Cb -0.09 -3.72 0.18 0.00 0.04 0.00 0.00 34.50 30.90 1l3g s PRO 115 CO 0.11 -0.78 1.46 1.17 0.04 0.00 0.00 177.00 179.00 1l3g n LYS 116 N 6.65 3.41 -4.26 4.56 4.81 -1.26 -4.97 118.16 127.10 1l3g n LYS 116 Ca 0.13 -3.87 -0.20 0.00 -0.87 0.00 0.00 58.31 53.50 1l3g n LYS 116 Cb 0.46 -3.00 -0.12 0.00 0.02 0.00 0.00 35.03 32.40 1l3g n LYS 116 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 1l3g s HIS 117 N 1.25 1.57 0.03 5.64 2.46 -1.26 -5.12 115.29 119.86 1l3g s HIS 117 Ca 0.42 -0.49 -0.30 0.00 0.47 0.00 0.00 55.06 55.16 1l3g s HIS 117 Cb -0.02 -0.83 -0.04 0.00 -0.13 0.00 0.00 32.58 31.56 1l3g s HIS 117 CO -0.00 0.19 1.01 -1.01 -2.47 0.00 0.00 174.74 172.46 1l3g s HIS 118 N -1.75 3.65 0.54 3.88 0.09 -1.26 -5.01 115.29 115.44 1l3g s HIS 118 Ca 0.08 1.67 -0.21 0.00 -0.00 0.00 0.00 55.06 56.60 1l3g s HIS 118 Cb -0.07 -3.15 -0.05 0.00 -0.00 0.00 0.00 32.58 29.31 1l3g s HIS 118 CO 0.04 -0.14 1.23 -1.58 -0.00 0.00 0.00 174.74 174.29 1l3g s HIS 119 N 0.83 2.51 0.52 1.40 2.46 -1.26 -4.92 115.29 116.82 1l3g s HIS 119 Ca 0.52 1.49 -0.14 0.00 0.47 0.00 0.00 55.06 57.40 1l3g s HIS 119 Cb -0.23 -3.53 -0.10 0.00 -0.13 0.00 0.00 32.58 28.60 1l3g s HIS 119 CO 0.29 -2.17 -0.77 0.00 -2.47 0.00 0.00 174.74 169.62 1l3g n ALA 120 N -1.13 -3.13 -2.52 1.58 0.00 -1.26 -4.78 120.51 109.27 1l3g n ALA 120 Ca 0.11 -0.68 -0.42 0.00 0.00 0.00 0.00 53.44 52.45 1l3g n ALA 120 Cb 0.48 -0.43 -0.08 0.00 0.00 0.00 0.00 19.45 19.42 1l3g n ALA 120 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1l3g s SER 121 N -0.52 6.23 -0.61 0.00 1.04 -1.26 -5.01 113.70 113.57 1l3g s SER 121 Ca 0.19 -0.38 -0.02 0.00 0.48 0.00 0.00 55.95 56.22 1l3g s SER 121 Cb 0.04 -2.24 0.16 0.00 0.10 0.00 0.00 66.02 64.08 1l3g s SER 121 CO 0.35 -0.52 0.41 -1.59 0.98 0.00 0.00 173.24 172.87 1l3g s LYS 122 N 2.25 2.49 0.00 4.02 0.00 -1.26 -5.07 119.74 122.16 1l3g s LYS 122 Ca 0.15 -2.53 0.04 0.00 0.00 0.00 0.00 55.97 53.62 1l3g s LYS 122 Cb -0.16 -3.68 -0.03 0.00 0.00 0.00 0.00 37.83 33.96 1l3g s LYS 122 CO 0.14 -1.16 -0.09 0.54 0.00 0.00 0.00 175.35 174.78 1l3g s VAL 123 N -0.07 3.49 -2.61 1.79 0.11 -1.26 -5.28 120.40 116.56 1l3g s VAL 123 Ca 0.17 -0.81 0.27 0.00 -2.93 0.00 0.00 61.98 58.67 1l3g s VAL 123 Cb -0.21 -2.50 0.47 0.00 -1.53 0.00 0.00 36.38 32.61 1l3g s VAL 123 CO -0.03 0.41 1.64 0.47 -3.33 0.00 0.00 175.10 174.25