#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 2.35 -4.55 6.43 5.15 -1.26 -3.33 115.26 120.05 1l3g n ASN 3 Ca 0.00 -2.10 -0.29 0.00 -0.60 0.00 0.00 54.58 51.59 1l3g n ASN 3 Cb 0.00 -0.33 -0.04 0.00 -0.53 0.00 0.00 39.78 38.88 1l3g n ASN 3 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1l3g s GLN 4 N -1.57 2.08 -0.57 1.20 -0.21 -1.26 -4.68 119.66 114.65 1l3g s GLN 4 Ca 0.26 0.87 -0.05 0.00 0.02 0.00 0.00 55.36 56.46 1l3g s GLN 4 Cb 0.15 -4.65 0.15 0.00 1.00 0.00 0.00 33.01 29.66 1l3g s GLN 4 CO 0.16 -3.53 0.40 0.42 -2.12 0.00 0.00 175.29 170.62 1l3g s ILE 5 N 12.25 3.87 0.44 1.08 1.09 -1.26 -4.45 121.20 134.22 1l3g s ILE 5 Ca 0.89 -2.53 -0.03 0.00 -1.10 0.00 0.00 60.65 57.89 1l3g s ILE 5 Cb -0.14 -3.54 -0.03 0.00 -1.06 0.00 0.00 42.46 37.69 1l3g s ILE 5 CO 0.18 -0.83 0.69 -0.31 -0.10 0.00 0.00 174.94 174.57 1l3g s TYR 6 N 0.45 3.48 -0.12 3.97 1.51 -1.16 -4.77 117.35 120.72 1l3g s TYR 6 Ca 0.13 0.57 -0.04 0.00 -1.01 0.00 0.00 57.07 56.72 1l3g s TYR 6 Cb -0.21 -2.18 -0.04 0.00 -0.11 0.00 0.00 41.96 39.43 1l3g s TYR 6 CO -0.04 -0.17 0.04 0.45 -1.11 0.00 0.00 175.55 174.72 1l3g s SER 7 N -4.11 5.55 0.03 2.29 0.15 -1.26 -2.59 113.70 113.77 1l3g s SER 7 Ca 0.45 0.19 -0.09 0.00 0.70 0.00 0.00 55.95 57.20 1l3g s SER 7 Cb -0.10 -1.73 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 1l3g s SER 7 CO 0.41 0.33 0.17 0.00 1.20 0.00 0.00 173.24 175.35 1l3g s ALA 8 N -0.57 -0.32 -0.15 5.45 0.00 0.16 -4.73 121.76 121.60 1l3g s ALA 8 Ca 0.10 -0.30 -0.07 0.00 0.00 0.00 0.00 51.96 51.69 1l3g s ALA 8 Cb -0.12 0.25 0.06 0.00 0.00 0.00 0.00 23.12 23.31 1l3g s ALA 8 CO 0.02 -0.34 0.35 0.50 0.00 0.00 0.00 175.76 176.29 1l3g s ARG 9 N -2.42 0.31 0.25 0.00 3.00 -1.26 0.78 118.95 119.60 1l3g s ARG 9 Ca -0.06 0.73 -0.04 0.00 -1.00 0.00 0.00 55.73 55.35 1l3g s ARG 9 Cb -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 34.95 34.89 1l3g s ARG 9 CO -0.03 -0.18 0.30 0.71 0.00 0.00 0.00 175.30 176.10 1l3g s TYR 10 N 1.55 0.95 -1.43 5.12 1.51 0.27 -4.75 117.35 120.55 1l3g s TYR 10 Ca -0.08 -1.19 -0.11 0.00 -1.01 0.00 0.00 57.07 54.69 1l3g s TYR 10 Cb -0.10 -0.27 0.04 0.00 -0.11 0.00 0.00 41.96 41.53 1l3g s TYR 10 CO -0.11 -0.84 1.09 0.45 -1.11 0.00 0.00 175.55 175.03 1l3g n SER 11 N -0.57 -5.56 0.00 2.29 2.88 -1.26 -0.70 113.62 110.70 1l3g n SER 11 Ca 0.01 -0.65 0.00 0.00 -1.33 0.00 0.00 58.87 56.90 1l3g n SER 11 Cb 0.64 -4.52 0.00 0.00 -0.75 0.00 0.00 64.21 59.58 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 -1.85 1.59 3.09 0.46 0.00 -1.26 -4.94 105.19 102.27 1l3g n GLY 12 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.29 1.12 0.66 1.61 1.01 0.13 -5.02 120.40 117.61 1l3g s VAL 13 Ca 0.00 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 61.30 1l3g s VAL 13 Cb 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 36.38 35.41 1l3g s VAL 13 CO 0.00 0.33 1.05 1.51 0.00 0.00 0.00 175.10 177.99 1l3g s ASP 14 N -0.07 5.79 0.35 3.32 1.47 -1.26 0.95 116.67 127.21 1l3g s ASP 14 Ca 0.00 1.22 -0.04 0.00 1.18 0.00 0.00 52.55 54.91 1l3g s ASP 14 Cb -0.08 -2.14 0.01 0.00 -0.34 0.00 0.00 42.92 40.37 1l3g s ASP 14 CO 0.01 -1.12 0.52 0.68 0.68 0.00 0.00 175.17 175.94 1l3g s VAL 15 N -3.26 0.00 -0.01 2.11 -7.23 4.09 0.38 120.40 116.48 1l3g s VAL 15 Ca 0.56 -1.51 0.06 0.00 -1.81 0.00 0.00 61.98 59.28 1l3g s VAL 15 Cb -0.11 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.12 1l3g s VAL 15 CO 0.52 0.00 -0.18 -0.31 -0.31 0.00 0.00 175.10 174.82 1l3g s TYR 16 N -2.93 2.57 -0.16 2.82 1.51 -0.88 0.37 117.35 120.65 1l3g s TYR 16 Ca 0.28 -0.25 0.02 0.00 -1.01 0.00 0.00 57.07 56.10 1l3g s TYR 16 Cb -0.01 -1.54 0.02 0.00 -0.11 0.00 0.00 41.96 40.32 1l3g s TYR 16 CO 0.19 0.17 -0.21 -1.83 -1.11 0.00 0.00 175.55 172.76 1l3g s GLU 17 N -0.99 3.01 -0.00 -0.62 -1.05 -0.83 0.11 118.70 118.33 1l3g s GLU 17 Ca 0.12 -0.84 0.02 0.00 -0.15 0.00 0.00 54.97 54.12 1l3g s GLU 17 Cb -0.10 -2.51 -0.00 0.00 -0.44 0.00 0.00 34.13 31.07 1l3g s GLU 17 CO 0.02 -0.12 -0.05 -0.06 0.95 0.00 0.00 175.26 176.00 1l3g s PHE 18 N 1.07 0.49 0.00 4.83 0.08 0.64 -2.97 117.98 122.12 1l3g s PHE 18 Ca -0.01 -0.09 -0.29 0.00 0.12 0.00 0.00 56.93 56.66 1l3g s PHE 18 Cb -0.14 -0.32 -0.03 0.00 -0.57 0.00 0.00 43.02 41.96 1l3g s PHE 18 CO -0.08 -0.01 0.93 0.42 -0.10 0.00 0.00 175.22 176.38 1l3g s ILE 19 N -0.13 4.86 0.00 0.64 -1.09 -1.10 0.54 121.20 124.93 1l3g s ILE 19 Ca 0.02 1.95 0.00 0.00 -2.23 0.00 0.00 60.65 60.39 1l3g s ILE 19 Cb -0.02 -4.27 0.00 0.00 -1.58 0.00 0.00 42.46 36.59 1l3g s ILE 19 CO -0.00 0.20 0.00 1.57 -1.23 0.00 0.00 174.94 175.47 1l3g n HIS 20 N 3.74 0.00 -0.16 3.97 -0.00 4.57 -4.79 115.22 122.55 1l3g n HIS 20 Ca 0.04 0.00 -0.03 0.00 0.46 0.00 0.00 57.72 58.19 1l3g n HIS 20 Cb 0.51 0.00 0.17 0.00 -0.12 0.00 0.00 29.99 30.55 1l3g n HIS 20 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1l3g h SER 21 N 0.00 0.83 -0.52 0.26 4.64 -1.89 -1.59 113.55 115.28 1l3g h SER 21 Ca 0.00 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1l3g h SER 21 Cb 0.00 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 61.87 1l3g h SER 21 CO 0.00 0.80 0.00 1.07 -0.87 0.00 0.00 176.83 177.83 1l3g n THR 22 N -4.27 1.30 0.00 2.95 5.66 -1.26 -4.97 114.28 113.69 1l3g n THR 22 Ca 0.04 -0.89 0.00 0.00 -3.05 0.00 0.00 64.05 60.16 1l3g n THR 22 Cb 0.22 0.11 0.00 0.00 -1.55 0.00 0.00 70.33 69.11 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 1.05 1.37 3.85 1.09 0.00 -0.60 -4.89 105.19 107.06 1l3g n GLY 23 Ca 0.20 -0.88 -0.35 0.00 0.00 0.00 0.00 46.02 44.99 1l3g n GLY 23 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3g s SER 24 N -4.00 6.78 -0.17 1.61 0.15 -1.20 0.83 113.70 117.70 1l3g s SER 24 Ca 0.00 1.05 -0.01 0.00 0.70 0.00 0.00 55.95 57.69 1l3g s SER 24 Cb 0.00 -2.28 -0.00 0.00 -1.71 0.00 0.00 66.02 62.03 1l3g s SER 24 CO 0.00 0.06 -0.12 -0.63 1.20 0.00 0.00 173.24 173.75 1l3g s ILE 25 N -1.55 2.89 -0.22 6.45 1.01 2.15 -4.49 121.20 127.43 1l3g s ILE 25 Ca 0.40 -0.69 -0.09 0.00 0.00 0.00 0.00 60.65 60.28 1l3g s ILE 25 Cb -0.14 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 1l3g s ILE 25 CO 0.19 0.49 0.11 -0.04 0.00 0.00 0.00 174.94 175.70 1l3g s MET 26 N 0.95 3.95 -0.03 2.79 -1.94 -0.80 -0.26 119.30 123.96 1l3g s MET 26 Ca -0.02 -0.34 -0.14 0.00 -1.71 0.00 0.00 55.69 53.48 1l3g s MET 26 Cb -0.15 -3.38 -0.05 0.00 2.01 0.00 0.00 34.83 33.26 1l3g s MET 26 CO -0.01 0.09 0.37 0.15 -0.01 0.00 0.00 175.02 175.61 1l3g s LYS 27 N 0.92 3.91 -0.47 2.03 1.02 0.31 -4.43 119.74 123.04 1l3g s LYS 27 Ca 0.05 0.33 -0.29 0.00 0.02 0.00 0.00 55.97 56.08 1l3g s LYS 27 Cb -0.13 -3.24 0.03 0.00 -0.52 0.00 0.00 37.83 33.96 1l3g s LYS 27 CO 0.03 0.64 1.20 0.50 -0.92 0.00 0.00 175.35 176.80 1l3g s ARG 28 N -0.86 3.68 0.52 1.68 3.52 -1.10 -2.08 118.95 124.32 1l3g s ARG 28 Ca 0.22 0.64 0.17 0.00 -0.13 0.00 0.00 55.73 56.63 1l3g s ARG 28 Cb -0.16 -3.94 1.28 0.00 -1.56 0.00 0.00 34.95 30.57 1l3g s ARG 28 CO 0.11 -1.44 2.14 -0.22 -0.81 0.00 0.00 175.30 175.09 1l3g h LYS 29 N 9.59 0.00 -0.66 5.12 3.11 0.66 0.19 116.57 134.58 1l3g h LYS 29 Ca -0.24 0.00 0.08 0.00 -2.81 0.00 0.00 60.65 57.68 1l3g h LYS 29 Cb 1.07 0.00 -0.10 0.00 -1.00 0.00 0.00 32.23 32.20 1l3g h LYS 29 CO 1.12 0.00 -0.52 0.87 -2.81 0.00 0.00 179.45 178.11 1l3g h LYS 30 N 0.00 -0.21 0.00 1.90 1.79 -1.90 -3.37 116.57 114.78 1l3g h LYS 30 Ca 0.02 0.01 -0.07 0.00 -2.18 0.00 0.00 60.65 58.43 1l3g h LYS 30 Cb 0.06 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 1l3g h LYS 30 CO -0.00 -0.14 -1.02 -0.25 -1.08 0.00 0.00 179.45 176.96 1l3g n ASP 31 N -5.36 0.61 0.00 0.86 8.00 -1.11 -5.07 116.55 114.48 1l3g n ASP 31 Ca 0.00 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.60 1l3g n ASP 31 Cb 0.33 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.20 1l3g n ASP 31 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1l3g n ASP 32 N -3.35 0.00 -4.95 -2.24 2.03 0.66 -4.96 116.55 103.74 1l3g n ASP 32 Ca -0.09 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 54.99 1l3g n ASP 32 Cb 0.45 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.84 1l3g n ASP 32 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 1l3g s TRP 33 N -0.19 3.49 0.23 -0.67 0.52 -1.19 0.14 118.94 121.26 1l3g s TRP 33 Ca 0.00 0.26 0.11 0.00 0.02 0.00 0.00 56.10 56.49 1l3g s TRP 33 Cb 0.00 -1.82 -0.05 0.00 -1.15 0.00 0.00 33.47 30.46 1l3g s TRP 33 CO 0.00 0.20 -0.21 0.54 0.02 0.00 0.00 176.95 177.50 1l3g s VAL 34 N -2.22 2.30 -0.60 4.03 0.11 2.26 -2.71 120.40 123.56 1l3g s VAL 34 Ca 0.39 -2.19 -0.26 0.00 -2.93 0.00 0.00 61.98 56.98 1l3g s VAL 34 Cb -0.09 -2.16 -0.04 0.00 -1.53 0.00 0.00 36.38 32.56 1l3g s VAL 34 CO 0.34 -0.29 2.02 0.54 -3.33 0.00 0.00 175.10 174.38 1l3g s ASN 35 N -3.06 5.00 0.63 3.54 2.20 -1.26 0.44 114.94 122.43 1l3g s ASN 35 Ca 0.24 0.47 0.21 0.00 -0.94 0.00 0.00 52.86 52.84 1l3g s ASN 35 Cb -0.06 -2.52 0.95 0.00 -2.00 0.00 0.00 41.25 37.62 1l3g s ASN 35 CO 0.11 -2.57 1.48 0.00 -2.94 0.00 0.00 177.10 173.18 1l3g h ALA 36 N 15.93 2.24 -0.68 3.54 0.00 -0.32 0.38 119.26 140.35 1l3g h ALA 36 Ca -0.23 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.67 1l3g h ALA 36 Cb 1.18 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1l3g h ALA 36 CO 1.20 -1.06 0.45 1.15 0.00 0.00 0.00 179.25 180.98 1l3g h THR 37 N 0.00 1.18 0.00 0.00 2.02 -1.82 3.80 112.91 118.09 1l3g h THR 37 Ca 0.21 -0.34 -0.05 0.00 0.77 0.00 0.00 66.41 67.00 1l3g h THR 37 Cb 1.87 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.45 1l3g h THR 37 CO -0.00 0.18 -0.25 -0.74 0.37 0.00 0.00 175.52 175.07 1l3g h HIS 38 N 0.93 0.00 0.00 3.16 6.17 -0.57 4.48 115.15 129.32 1l3g h HIS 38 Ca 0.25 0.00 -0.19 0.00 0.71 0.00 0.00 60.37 61.14 1l3g h HIS 38 Cb -0.10 0.00 -0.03 0.00 2.52 0.00 0.00 27.41 29.81 1l3g h HIS 38 CO -0.02 0.25 -1.14 -0.89 0.71 0.00 0.00 177.93 176.84 1l3g n ILE 39 N -3.84 1.51 -0.10 6.26 -0.00 -0.24 -3.39 119.36 119.56 1l3g n ILE 39 Ca -0.02 0.02 -0.23 0.00 -0.00 0.00 0.00 62.75 62.52 1l3g n ILE 39 Cb 0.34 -2.11 -0.11 0.00 -0.00 0.00 0.00 39.64 37.76 1l3g n ILE 39 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 1l3g n LEU 40 N -4.46 1.90 0.25 1.39 7.99 1.24 -3.60 117.00 121.70 1l3g n LEU 40 Ca -0.28 0.40 0.11 0.00 -0.01 0.00 0.00 56.01 56.24 1l3g n LEU 40 Cb 0.61 -0.96 0.64 0.00 -0.11 0.00 0.00 43.42 43.59 1l3g n LEU 40 CO 0.17 0.33 0.92 0.50 -1.51 0.00 0.00 177.39 177.79 1l3g h LYS 41 N -0.95 0.00 0.00 3.23 3.11 0.25 0.25 116.57 122.47 1l3g h LYS 41 Ca -0.38 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.43 1l3g h LYS 41 Cb 1.37 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.59 1l3g h LYS 41 CO -0.22 0.16 -0.11 0.00 -2.81 0.00 0.00 179.45 176.47 1l3g h ALA 42 N 1.84 1.10 -0.02 5.00 0.00 0.79 0.26 119.26 128.24 1l3g h ALA 42 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1l3g h ALA 42 Cb 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1l3g h ALA 42 CO 0.02 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.41 1l3g n ALA 43 N -2.20 2.27 -1.86 0.00 0.00 -0.70 -4.69 120.51 113.34 1l3g n ALA 43 Ca -0.01 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.69 1l3g n ALA 43 Cb 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.71 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 -0.16 0.00 -0.94 0.00 0.23 -0.01 -5.09 115.26 109.30 1l3g n ASN 44 Ca 0.01 -1.45 0.04 0.00 -0.53 0.00 0.00 54.58 52.65 1l3g n ASN 44 Cb 0.14 -0.09 -0.02 0.00 -2.08 0.00 0.00 39.78 37.72 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 -1.37 -3.08 -2.53 3.72 0.91 -4.46 117.46 110.65 1l3g n PHE 45 Ca 0.00 0.75 -0.45 0.00 -0.05 0.00 0.00 57.45 57.70 1l3g n PHE 45 Cb 0.59 -1.21 -0.03 0.00 -0.94 0.00 0.00 39.48 37.89 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 -4.70 3.59 0.00 4.37 0.00 -1.26 -4.20 121.76 119.56 1l3g s ALA 46 Ca 0.00 -2.80 0.00 0.00 0.00 0.00 0.00 51.96 49.16 1l3g s ALA 46 Cb 0.00 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1l3g s ALA 46 CO 0.00 -2.64 0.00 1.63 0.00 0.00 0.00 175.76 174.75 1l3g n LYS 47 N 5.76 0.81 0.02 0.00 5.02 -1.26 -4.87 118.16 123.63 1l3g n LYS 47 Ca 0.13 0.00 0.22 0.00 -2.02 0.00 0.00 58.31 56.65 1l3g n LYS 47 Cb 0.47 0.00 0.72 0.00 -0.02 0.00 0.00 35.03 36.20 1l3g n LYS 47 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l3g h ALA 48 N 1.00 2.31 0.05 7.82 0.00 -1.97 0.34 119.26 128.80 1l3g h ALA 48 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1l3g h ALA 48 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1l3g h ALA 48 CO 0.00 -0.81 -0.02 0.87 0.00 0.00 0.00 179.25 179.29 1l3g h LYS 49 N 0.00 -0.06 0.00 0.00 1.57 -1.91 -2.78 116.57 113.38 1l3g h LYS 49 Ca 0.26 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1l3g h LYS 49 Cb 1.32 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.64 1l3g h LYS 49 CO -0.00 0.34 -0.05 -0.09 -0.57 0.00 0.00 179.45 179.08 1l3g h ARG 50 N -0.48 0.00 -0.24 3.15 1.12 -0.57 0.41 114.38 117.77 1l3g h ARG 50 Ca -0.01 0.00 -0.11 0.00 -1.11 0.00 0.00 59.98 58.76 1l3g h ARG 50 Cb 0.43 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.38 1l3g h ARG 50 CO 0.01 0.05 -0.31 1.15 -3.11 0.00 0.00 179.97 177.76 1l3g h THR 51 N 0.00 1.28 0.00 0.20 2.02 -0.94 -0.66 112.91 114.81 1l3g h THR 51 Ca -0.00 -1.38 0.00 0.00 0.77 0.00 0.00 66.41 65.80 1l3g h THR 51 Cb 0.12 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 1l3g h THR 51 CO 0.01 0.44 0.00 0.54 0.37 0.00 0.00 175.52 176.87 1l3g n ARG 52 N -4.08 0.00 -0.29 6.66 3.00 -0.45 -2.19 116.66 119.32 1l3g n ARG 52 Ca -0.01 0.22 0.11 0.00 -0.01 0.00 0.00 57.85 58.16 1l3g n ARG 52 Cb 0.45 -0.69 0.25 0.00 0.00 0.00 0.00 32.46 32.47 1l3g n ARG 52 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 1l3g h ILE 53 N 0.00 0.36 0.46 0.55 2.04 -1.14 1.19 117.51 120.98 1l3g h ILE 53 Ca 0.00 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 1l3g h ILE 53 Cb 0.00 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 1l3g h ILE 53 CO 0.00 0.04 -0.22 0.25 0.00 0.00 0.00 178.15 178.22 1l3g h LEU 54 N 0.22 -0.52 -0.64 1.44 5.85 -1.23 0.81 115.31 121.23 1l3g h LEU 54 Ca 0.51 -0.08 0.12 0.00 0.84 0.00 0.00 57.88 59.27 1l3g h LEU 54 Cb 0.99 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 42.07 1l3g h LEU 54 CO -0.63 -0.13 0.20 -0.33 -0.34 0.00 0.00 178.44 177.22 1l3g h GLU 55 N -1.02 0.34 0.13 1.25 4.39 -0.72 2.16 114.58 121.11 1l3g h GLU 55 Ca -0.06 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 1l3g h GLU 55 Cb 0.57 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1l3g h GLU 55 CO 0.10 0.22 -0.06 -0.22 -1.16 0.00 0.00 179.01 177.89 1l3g h LYS 56 N 0.35 -0.17 -0.44 2.33 3.11 0.14 7.99 116.57 129.89 1l3g h LYS 56 Ca 0.34 0.01 0.06 0.00 -2.81 0.00 0.00 60.65 58.25 1l3g h LYS 56 Cb 0.49 0.04 -0.05 0.00 -1.00 0.00 0.00 32.23 31.71 1l3g h LYS 56 CO -0.38 0.30 0.14 1.49 -2.81 0.00 0.00 179.45 178.18 1l3g h GLU 57 N -0.77 0.29 0.09 1.90 4.57 0.11 -2.63 114.58 118.15 1l3g h GLU 57 Ca -0.02 -0.02 -0.25 0.00 -1.18 0.00 0.00 59.36 57.89 1l3g h GLU 57 Cb 0.54 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 1l3g h GLU 57 CO 0.03 0.19 -1.30 -0.24 -1.18 0.00 0.00 179.01 176.51 1l3g h VAL 58 N 0.30 1.07 -0.83 0.32 3.04 0.35 -3.35 116.25 117.15 1l3g h VAL 58 Ca 0.21 -2.37 0.24 0.00 -1.01 0.00 0.00 66.70 63.76 1l3g h VAL 58 Cb 0.21 2.71 -0.15 0.00 -2.01 0.00 0.00 31.29 32.05 1l3g h VAL 58 CO -0.22 0.66 0.05 -0.11 -1.01 0.00 0.00 177.57 176.93 1l3g n LEU 59 N -4.02 -0.07 0.00 3.16 -0.00 2.56 0.72 117.00 119.35 1l3g n LEU 59 Ca -0.25 1.41 0.08 0.00 -0.00 0.00 0.00 56.01 57.25 1l3g n LEU 59 Cb 0.85 -0.53 0.35 0.00 -0.00 0.00 0.00 43.42 44.09 1l3g n LEU 59 CO 0.38 -1.44 0.76 2.29 -0.00 0.00 0.00 177.39 179.38 1l3g n LYS 60 N -5.17 0.00 0.00 1.96 2.85 -1.00 -4.72 118.16 112.08 1l3g n LYS 60 Ca 0.20 0.22 0.00 0.00 -1.05 0.00 0.00 58.31 57.69 1l3g n LYS 60 Cb 0.67 -1.51 0.00 0.00 -0.65 0.00 0.00 35.03 33.54 1l3g n LYS 60 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1l3g n GLU 61 N -1.52 3.88 -2.41 -1.58 4.71 3.53 -5.01 120.64 122.26 1l3g n GLU 61 Ca 0.04 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.78 1l3g n GLU 61 Cb 0.19 0.00 0.02 0.00 -1.01 0.00 0.00 31.44 30.65 1l3g n GLU 61 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1l3g n THR 62 N 0.00 5.36 -2.30 2.62 -1.04 -1.24 -4.99 114.28 112.69 1l3g n THR 62 Ca 0.00 -5.43 -0.42 0.00 -2.04 0.00 0.00 64.05 56.15 1l3g n THR 62 Cb 0.00 -1.48 -0.03 0.00 -1.82 0.00 0.00 70.33 67.00 1l3g n THR 62 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1l3g s HIS 63 N -4.14 2.95 0.02 -1.42 5.04 -1.24 -4.46 115.29 112.03 1l3g s HIS 63 Ca 0.43 0.94 0.01 0.00 -1.54 0.00 0.00 55.06 54.90 1l3g s HIS 63 Cb 0.26 -3.58 -0.02 0.00 0.04 0.00 0.00 32.58 29.28 1l3g s HIS 63 CO -0.21 -2.08 -0.04 -1.21 -2.34 0.00 0.00 174.74 168.86 1l3g s GLU 64 N 2.41 0.35 -0.24 2.88 8.01 -1.26 -4.94 118.70 125.91 1l3g s GLU 64 Ca 0.61 -0.61 -0.12 0.00 0.01 0.00 0.00 54.97 54.86 1l3g s GLU 64 Cb -0.29 0.00 -0.05 0.00 -4.31 0.00 0.00 34.13 29.49 1l3g s GLU 64 CO 0.25 -0.02 0.23 0.15 0.01 0.00 0.00 175.26 175.87 1l3g s LYS 65 N -1.40 4.06 -0.07 1.61 3.01 -1.19 -1.82 119.74 123.94 1l3g s LYS 65 Ca -0.14 -0.17 -0.20 0.00 -1.01 0.00 0.00 55.97 54.45 1l3g s LYS 65 Cb -0.09 -3.57 -0.04 0.00 -1.01 0.00 0.00 37.83 33.11 1l3g s LYS 65 CO -0.01 -0.03 0.57 0.14 0.51 0.00 0.00 175.35 176.54 1l3g s VAL 66 N 1.31 5.06 0.03 3.17 -7.23 -1.15 -4.98 120.40 116.61 1l3g s VAL 66 Ca 0.10 1.18 -0.04 0.00 -1.81 0.00 0.00 61.98 61.41 1l3g s VAL 66 Cb -0.14 -3.91 -0.01 0.00 0.56 0.00 0.00 36.38 32.87 1l3g s VAL 66 CO 0.07 0.34 0.06 -1.10 -0.31 0.00 0.00 175.10 174.16 1l3g s GLN 67 N 0.40 0.52 0.00 4.82 -1.52 -1.26 -4.43 119.66 118.19 1l3g s GLN 67 Ca 0.31 -0.71 0.00 0.00 -1.95 0.00 0.00 55.36 53.00 1l3g s GLN 67 Cb -0.17 0.20 0.00 0.00 -0.22 0.00 0.00 33.01 32.82 1l3g s GLN 67 CO 0.15 -0.12 0.00 0.41 -0.25 0.00 0.00 175.29 175.48 1l3g n GLY 68 N 0.99 0.93 0.00 3.09 0.00 -1.26 -3.76 105.19 105.18 1l3g n GLY 68 Ca -0.20 0.00 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 -2.00 0.61 3.37 -0.02 0.00 -1.26 -5.02 105.19 100.87 1l3g n GLY 69 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.00 3.74 0.00 1.61 -0.12 -1.25 -4.28 117.98 115.68 1l3g s PHE 70 Ca 0.00 -2.06 0.00 0.00 -0.05 0.00 0.00 56.93 54.82 1l3g s PHE 70 Cb 0.00 -3.96 0.00 0.00 -0.63 0.00 0.00 43.02 38.43 1l3g s PHE 70 CO 0.00 -1.12 0.00 0.41 -0.05 0.00 0.00 175.22 174.46 1l3g n GLY 71 N 3.98 0.44 0.01 1.99 0.00 -1.26 -4.32 105.19 106.03 1l3g n GLY 71 Ca 0.20 -0.96 0.09 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.26 0.02 0.12 1.61 0.00 -1.26 -1.62 118.16 114.76 1l3g n LYS 72 Ca 0.00 0.21 -0.00 0.00 0.00 0.00 0.00 58.31 58.51 1l3g n LYS 72 Cb 0.16 -1.54 -0.00 0.00 0.00 0.00 0.00 35.03 33.65 1l3g n LYS 72 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.40 179.28 1l3g h TYR 73 N 0.00 0.00 0.03 5.64 0.05 -1.90 -3.34 116.97 117.45 1l3g h TYR 73 Ca 0.00 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 58.43 1l3g h TYR 73 Cb 0.33 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.03 1l3g h TYR 73 CO 0.00 0.65 -1.99 1.04 -1.05 0.00 0.00 178.16 176.82 1l3g n GLN 74 N -3.29 0.64 0.00 4.88 6.02 -0.83 -4.50 117.38 120.30 1l3g n GLN 74 Ca 0.01 0.34 0.00 0.00 -0.01 0.00 0.00 57.00 57.34 1l3g n GLN 74 Cb 0.79 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 30.41 1l3g n GLN 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1l3g n GLY 75 N 1.69 1.49 3.04 1.08 0.00 -0.64 -4.19 105.19 107.66 1l3g n GLY 75 Ca -0.40 0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 1l3g n GLY 75 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1l3g n THR 76 N 0.00 5.19 -1.64 2.61 -2.24 -0.75 -2.96 114.28 114.49 1l3g n THR 76 Ca 0.00 -5.85 -0.30 0.00 -2.27 0.00 0.00 64.05 55.62 1l3g n THR 76 Cb 0.00 -2.15 0.06 0.00 -2.10 0.00 0.00 70.33 66.14 1l3g n THR 76 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1l3g s TRP 77 N -2.59 3.09 0.14 4.78 -2.14 -1.22 0.39 118.94 121.39 1l3g s TRP 77 Ca 0.31 1.26 -0.01 0.00 2.66 0.00 0.00 56.10 60.31 1l3g s TRP 77 Cb 0.03 -2.98 -0.04 0.00 -3.10 0.00 0.00 33.47 27.38 1l3g s TRP 77 CO 0.08 -1.37 0.08 0.14 -2.66 0.00 0.00 176.95 173.22 1l3g s VAL 78 N -3.14 0.09 -0.21 -0.66 -7.23 1.51 -4.12 120.40 106.64 1l3g s VAL 78 Ca 0.59 -1.89 -0.32 0.00 -1.81 0.00 0.00 61.98 58.55 1l3g s VAL 78 Cb -0.13 -2.07 -0.09 0.00 0.56 0.00 0.00 36.38 34.65 1l3g s VAL 78 CO 0.54 -0.41 2.12 -0.81 -0.31 0.00 0.00 175.10 176.22 1l3g n PRO 79 N -0.12 1.80 -0.20 4.82 -0.04 -1.26 0.56 135.00 140.56 1l3g n PRO 79 Ca -0.05 0.55 0.30 0.00 -0.04 0.00 0.00 63.50 64.27 1l3g n PRO 79 Cb 0.64 -2.84 0.73 0.00 -0.04 0.00 0.00 33.50 31.98 1l3g n PRO 79 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1l3g h LEU 80 N 12.57 0.00 -0.82 1.53 6.46 0.10 2.27 115.31 137.42 1l3g h LEU 80 Ca -0.39 0.00 -0.11 0.00 -0.12 0.00 0.00 57.88 57.26 1l3g h LEU 80 Cb 1.27 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.19 1l3g h LEU 80 CO 0.97 0.00 -0.24 0.78 -0.62 0.00 0.00 178.44 179.33 1l3g h ASN 81 N 0.00 0.62 0.01 1.25 4.21 -1.87 -1.81 115.58 117.98 1l3g h ASN 81 Ca 0.46 -0.22 -0.38 0.00 1.21 0.00 0.00 56.30 57.37 1l3g h ASN 81 Cb 1.93 -0.17 -0.07 0.00 -1.12 0.00 0.00 38.32 38.89 1l3g h ASN 81 CO -0.00 0.85 -2.42 -0.38 -1.29 0.00 0.00 177.43 174.18 1l3g n ILE 82 N -4.11 1.44 0.38 2.81 5.41 0.19 -3.95 119.36 121.52 1l3g n ILE 82 Ca -0.00 -0.72 -0.17 0.00 1.00 0.00 0.00 62.75 62.86 1l3g n ILE 82 Cb 0.42 -0.93 -0.09 0.00 -0.71 0.00 0.00 39.64 38.34 1l3g n ILE 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1l3g h ALA 83 N 0.53 -0.95 -0.36 -1.39 0.00 0.34 -1.47 119.26 115.96 1l3g h ALA 83 Ca -0.56 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 54.23 1l3g h ALA 83 Cb 2.08 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 20.23 1l3g h ALA 83 CO -0.02 -0.97 0.26 -0.22 0.00 0.00 0.00 179.25 178.29 1l3g h LYS 84 N -1.08 0.00 0.00 0.00 3.64 -1.49 0.25 116.57 117.88 1l3g h LYS 84 Ca -0.10 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.17 1l3g h LYS 84 Cb 0.76 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1l3g h LYS 84 CO 0.16 0.00 -0.55 0.37 -2.27 0.00 0.00 179.45 177.16 1l3g h GLN 85 N 0.00 0.00 0.16 1.90 4.15 -1.59 0.27 115.11 119.99 1l3g h GLN 85 Ca 0.17 0.00 -0.36 0.00 0.77 0.00 0.00 58.65 59.23 1l3g h GLN 85 Cb 0.69 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.37 1l3g h GLN 85 CO -0.00 0.55 -1.87 1.25 -1.93 0.00 0.00 178.83 176.84 1l3g h LEU 86 N 0.00 0.53 0.00 -2.39 5.85 0.28 -3.37 115.31 116.21 1l3g h LEU 86 Ca -0.01 -0.94 -0.02 0.00 0.84 0.00 0.00 57.88 57.75 1l3g h LEU 86 Cb 1.03 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.89 1l3g h LEU 86 CO 0.07 1.82 -0.32 0.00 -0.34 0.00 0.00 178.44 179.67 1l3g h ALA 87 N 0.10 0.03 -0.56 1.25 0.00 -0.67 -3.33 119.26 116.08 1l3g h ALA 87 Ca -0.38 -0.37 0.16 0.00 0.00 0.00 0.00 54.91 54.33 1l3g h ALA 87 Cb 2.07 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 20.11 1l3g h ALA 87 CO 0.14 0.27 0.94 -0.85 0.00 0.00 0.00 179.25 179.75 1l3g n GLU 88 N -4.67 0.02 0.00 0.00 0.00 0.93 -0.90 120.64 116.02 1l3g n GLU 88 Ca -0.07 0.81 0.00 0.00 0.00 0.00 0.00 57.16 57.90 1l3g n GLU 88 Cb 0.22 -2.08 0.00 0.00 0.00 0.00 0.00 31.44 29.58 1l3g n GLU 88 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1l3g n LYS 89 N -2.62 0.00 -0.08 3.44 4.81 -1.25 -4.14 118.16 118.32 1l3g n LYS 89 Ca 0.13 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 57.63 1l3g n LYS 89 Cb 1.10 -0.00 0.10 0.00 0.02 0.00 0.00 35.03 36.25 1l3g n LYS 89 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1l3g n PHE 90 N 0.00 0.21 0.00 5.64 3.72 -1.12 -4.34 117.46 121.57 1l3g n PHE 90 Ca 0.00 -0.22 0.00 0.00 -0.05 0.00 0.00 57.45 57.18 1l3g n PHE 90 Cb 0.00 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 1l3g n PHE 90 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1l3g n SER 91 N 0.64 0.00 -0.02 4.37 7.64 -0.08 -4.69 113.62 121.48 1l3g n SER 91 Ca 0.09 0.12 0.02 0.00 1.01 0.00 0.00 58.87 60.11 1l3g n SER 91 Cb 0.36 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.58 1l3g n SER 91 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1l3g n VAL 92 N -0.29 1.15 -0.48 0.44 0.31 -1.16 -4.50 118.33 113.80 1l3g n VAL 92 Ca 0.00 -1.21 0.41 0.00 -0.01 0.00 0.00 64.34 63.53 1l3g n VAL 92 Cb 0.00 0.38 0.63 0.00 -0.91 0.00 0.00 33.84 33.94 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 -0.65 0.00 -0.08 3.52 4.19 -1.20 -0.18 117.16 122.77 1l3g n TYR 93 Ca 0.03 0.00 -0.07 0.00 3.31 0.00 0.00 57.90 61.17 1l3g n TYR 93 Cb 0.32 -0.38 -0.03 0.00 0.49 0.00 0.00 39.34 39.74 1l3g n TYR 93 CO 0.00 0.00 0.00 -0.25 0.91 0.00 0.00 176.86 177.52 1l3g n ASP 94 N -3.57 1.82 0.16 2.98 9.92 -1.26 -3.98 116.55 122.62 1l3g n ASP 94 Ca 0.34 0.61 -0.14 0.00 -0.53 0.00 0.00 54.79 55.07 1l3g n ASP 94 Cb 1.76 -0.88 -0.07 0.00 -0.64 0.00 0.00 41.12 41.29 1l3g n ASP 94 CO 0.00 0.00 0.00 -0.61 0.13 0.00 0.00 177.20 176.72 1l3g h GLN 95 N -1.00 -0.58 -1.37 -1.24 5.75 -1.32 -1.18 115.11 114.17 1l3g h GLN 95 Ca -0.05 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 1l3g h GLN 95 Cb 0.62 0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.30 1l3g h GLN 95 CO -0.03 -0.39 0.00 1.47 -2.65 0.00 0.00 178.83 177.24 1l3g n LEU 96 N -5.42 2.32 0.29 -2.39 -0.00 0.74 -4.27 117.00 108.28 1l3g n LEU 96 Ca -0.08 -1.14 -0.18 0.00 -0.00 0.00 0.00 56.01 54.61 1l3g n LEU 96 Cb 0.33 -0.41 -0.09 0.00 -0.00 0.00 0.00 43.42 43.25 1l3g n LEU 96 CO 0.26 0.40 0.55 0.11 -0.00 0.00 0.00 177.39 178.71 1l3g h LYS 97 N 0.73 -0.94 0.51 1.47 1.79 -1.34 0.17 116.57 118.97 1l3g h LYS 97 Ca 0.00 0.06 -0.03 0.00 -2.18 0.00 0.00 60.65 58.51 1l3g h LYS 97 Cb 0.71 0.21 0.01 0.00 -1.58 0.00 0.00 32.23 31.58 1l3g h LYS 97 CO 0.00 -0.63 -0.25 -1.35 -1.08 0.00 0.00 179.45 176.15 1l3g h PRO 98 N -0.97 -0.66 -1.06 3.15 0.11 -1.74 -1.60 132.00 129.23 1l3g h PRO 98 Ca -0.06 0.05 0.28 0.00 0.11 0.00 0.00 66.00 66.38 1l3g h PRO 98 Cb 0.84 0.15 -0.08 0.00 0.11 0.00 0.00 31.00 32.02 1l3g h PRO 98 CO -0.05 -0.43 0.70 1.25 -0.21 0.00 0.00 178.00 179.26 1l3g h LEU 99 N -0.71 0.35 -0.27 2.35 7.12 -1.53 2.24 115.31 124.86 1l3g h LEU 99 Ca -0.07 0.07 -0.15 0.00 0.13 0.00 0.00 57.88 57.86 1l3g h LEU 99 Cb 0.54 0.01 -0.00 0.00 -0.53 0.00 0.00 40.66 40.68 1l3g h LEU 99 CO 0.12 0.06 -0.40 -0.26 -0.13 0.00 0.00 178.44 177.83 1l3g h PHE 100 N 0.31 0.93 0.22 1.25 -1.00 -0.00 -3.28 116.94 115.36 1l3g h PHE 100 Ca 0.58 -0.31 -0.33 0.00 2.81 0.00 0.00 57.97 60.72 1l3g h PHE 100 Cb 1.65 -0.18 0.03 0.00 3.61 0.00 0.00 35.95 41.06 1l3g h PHE 100 CO -0.00 1.09 -1.55 -0.44 -1.61 0.00 0.00 178.31 175.80 1l3g h ASP 101 N 0.50 0.73 0.00 2.17 3.32 0.51 -3.49 116.42 120.16 1l3g h ASP 101 Ca 0.03 -0.93 0.00 0.00 0.02 0.00 0.00 57.03 56.15 1l3g h ASP 101 Cb 0.99 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1l3g h ASP 101 CO 0.09 1.72 0.00 2.22 -1.72 0.00 0.00 179.24 181.56 1l3g n PHE 102 N -3.71 0.00 -2.37 4.55 -1.74 0.72 -4.36 117.46 110.56 1l3g n PHE 102 Ca -0.20 0.00 -0.39 0.00 -0.56 0.00 0.00 57.45 56.30 1l3g n PHE 102 Cb 1.07 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 42.04 1l3g n PHE 102 CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 1l3g s THR 103 N 0.00 3.64 0.08 1.97 -4.23 -1.26 -4.98 115.64 110.86 1l3g s THR 103 Ca 0.00 0.03 -0.20 0.00 -1.18 0.00 0.00 61.69 60.33 1l3g s THR 103 Cb 0.00 -4.60 -0.07 0.00 1.34 0.00 0.00 72.50 69.18 1l3g s THR 103 CO 0.00 -1.53 0.60 -1.58 -0.54 0.00 0.00 174.62 171.57 1l3g s GLN 104 N 6.06 4.27 -0.09 3.99 2.00 -1.26 -4.99 119.66 129.64 1l3g s GLN 104 Ca 0.49 0.81 -0.29 0.00 -2.00 0.00 0.00 55.36 54.37 1l3g s GLN 104 Cb -0.07 -3.25 -0.07 0.00 0.80 0.00 0.00 33.01 30.42 1l3g s GLN 104 CO 0.09 0.61 2.06 -0.08 -0.50 0.00 0.00 175.29 177.47 1l3g s THR 105 N -1.04 3.05 -0.72 -0.34 -1.32 -1.26 -4.80 115.64 109.21 1l3g s THR 105 Ca 0.30 0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.84 1l3g s THR 105 Cb -0.20 -3.05 0.00 0.00 -1.51 0.00 0.00 72.50 67.74 1l3g s THR 105 CO 0.20 -0.02 0.45 0.47 -2.21 0.00 0.00 174.62 173.51 1l3g n ASP 106 N 9.45 1.09 0.00 8.08 8.00 -1.26 -4.66 116.55 137.25 1l3g n ASP 106 Ca 0.24 -1.39 0.00 0.00 0.71 0.00 0.00 54.79 54.35 1l3g n ASP 106 Cb 0.43 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 1l3g n ASP 106 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l3g n GLY 107 N 0.29 1.77 3.56 0.44 0.00 -1.26 -5.05 105.19 104.94 1l3g n GLY 107 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.93 1.59 0.34 1.61 0.15 -1.26 -4.85 113.70 109.35 1l3g s SER 108 Ca 0.00 1.47 -0.09 0.00 0.70 0.00 0.00 55.95 58.03 1l3g s SER 108 Cb 0.00 -2.20 -0.07 0.00 -1.71 0.00 0.00 66.02 62.04 1l3g s SER 108 CO 0.00 -3.81 -0.19 0.00 1.20 0.00 0.00 173.24 170.43 1l3g n ALA 109 N -4.65 -2.95 -2.30 5.45 0.00 -1.26 -4.58 120.51 110.20 1l3g n ALA 109 Ca 0.04 -0.15 -0.38 0.00 0.00 0.00 0.00 53.44 52.95 1l3g n ALA 109 Cb 0.55 -0.64 -0.03 0.00 0.00 0.00 0.00 19.45 19.33 1l3g n ALA 109 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1l3g s SER 110 N -0.49 5.76 0.66 0.00 0.15 -1.26 -4.97 113.70 113.56 1l3g s SER 110 Ca 0.25 -0.39 -0.16 0.00 0.70 0.00 0.00 55.95 56.35 1l3g s SER 110 Cb -0.18 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 1l3g s SER 110 CO 0.36 -2.11 1.14 -2.16 1.20 0.00 0.00 173.24 171.67 1l3g s PRO 111 N 6.25 2.69 0.22 5.44 0.04 -1.26 -4.95 135.00 143.44 1l3g s PRO 111 Ca 0.53 1.53 -0.30 0.00 0.04 0.00 0.00 61.00 62.79 1l3g s PRO 111 Cb -0.08 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 1l3g s PRO 111 CO 0.10 -1.36 1.47 -1.25 0.04 0.00 0.00 177.00 176.00 1l3g s PRO 112 N -3.93 4.25 0.00 0.56 0.04 -1.26 -5.00 135.00 129.66 1l3g s PRO 112 Ca 0.70 2.31 0.00 0.00 0.04 0.00 0.00 61.00 64.05 1l3g s PRO 112 Cb -0.23 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.18 1l3g s PRO 112 CO 0.40 -0.47 0.00 -2.30 0.04 0.00 0.00 177.00 174.68 1l3g n PRO 113 N 2.78 0.00 -0.76 0.56 -0.02 -1.26 -4.81 135.00 131.49 1l3g n PRO 113 Ca 0.09 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.25 1l3g n PRO 113 Cb 0.40 0.00 0.12 0.00 -0.02 0.00 0.00 33.50 34.00 1l3g n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l3g n ALA 114 N -3.00 -3.92 -1.68 3.55 0.00 -1.26 -4.71 120.51 109.49 1l3g n ALA 114 Ca 0.00 -1.26 -0.46 0.00 0.00 0.00 0.00 53.44 51.72 1l3g n ALA 114 Cb 0.00 -1.14 -0.04 0.00 0.00 0.00 0.00 19.45 18.27 1l3g n ALA 114 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1l3g n PRO 115 N -0.44 2.41 -3.28 0.00 -0.02 -1.26 -4.95 135.00 127.45 1l3g n PRO 115 Ca 0.00 0.88 -0.39 0.00 -2.02 0.00 0.00 63.50 61.98 1l3g n PRO 115 Cb 0.61 -2.76 -0.06 0.00 -0.02 0.00 0.00 33.50 31.27 1l3g n PRO 115 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1l3g s LYS 116 N 4.01 4.19 0.28 -0.52 2.20 -1.26 -5.07 119.74 123.57 1l3g s LYS 116 Ca 0.91 0.73 -0.11 0.00 -0.36 0.00 0.00 55.97 57.14 1l3g s LYS 116 Cb -0.61 -3.23 -0.07 0.00 -1.51 0.00 0.00 37.83 32.40 1l3g s LYS 116 CO 0.48 0.64 0.62 -1.01 -0.36 0.00 0.00 175.35 175.72 1l3g s HIS 117 N -1.12 3.42 -0.14 4.03 3.76 -1.26 -4.97 115.29 119.00 1l3g s HIS 117 Ca 0.29 0.96 -0.38 0.00 -0.15 0.00 0.00 55.06 55.78 1l3g s HIS 117 Cb -0.19 -2.34 -0.15 0.00 1.11 0.00 0.00 32.58 31.01 1l3g s HIS 117 CO 0.19 0.18 1.67 0.72 -0.85 0.00 0.00 174.74 176.65 1l3g n HIS 118 N -0.37 2.00 -3.34 1.40 -0.00 -1.26 -4.89 115.22 108.75 1l3g n HIS 118 Ca 0.01 0.45 -0.46 0.00 -0.00 0.00 0.00 57.72 57.73 1l3g n HIS 118 Cb 0.53 -2.47 -0.05 0.00 -0.00 0.00 0.00 29.99 28.00 1l3g n HIS 118 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 1l3g s HIS 119 N 2.84 3.37 1.04 4.41 5.04 -1.26 -5.06 115.29 125.67 1l3g s HIS 119 Ca 0.93 -1.50 -0.23 0.00 -1.54 0.00 0.00 55.06 52.73 1l3g s HIS 119 Cb -0.96 -3.77 -0.06 0.00 0.04 0.00 0.00 32.58 27.83 1l3g s HIS 119 CO 0.58 -1.01 -0.79 0.00 -2.34 0.00 0.00 174.74 171.18 1l3g n ALA 120 N 4.94 -4.99 -2.62 1.58 0.00 -1.26 -4.97 120.51 113.20 1l3g n ALA 120 Ca -0.08 -1.26 -0.31 0.00 0.00 0.00 0.00 53.44 51.80 1l3g n ALA 120 Cb 0.41 -1.16 -0.10 0.00 0.00 0.00 0.00 19.45 18.61 1l3g n ALA 120 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1l3g s SER 121 N -1.38 4.68 0.54 0.00 0.15 -1.26 -5.12 113.70 111.31 1l3g s SER 121 Ca 0.45 -0.21 -0.10 0.00 0.70 0.00 0.00 55.95 56.79 1l3g s SER 121 Cb -0.02 -1.05 -0.05 0.00 -1.71 0.00 0.00 66.02 63.19 1l3g s SER 121 CO 0.68 0.23 0.92 -0.75 1.20 0.00 0.00 173.24 175.52 1l3g s LYS 122 N -1.86 3.65 -0.00 5.44 2.20 -1.26 -4.98 119.74 122.93 1l3g s LYS 122 Ca 0.20 0.58 -0.30 0.00 -0.36 0.00 0.00 55.97 56.10 1l3g s LYS 122 Cb -0.11 -2.21 -0.07 0.00 -1.51 0.00 0.00 37.83 33.93 1l3g s LYS 122 CO 0.12 -0.37 1.71 0.54 -0.36 0.00 0.00 175.35 176.99 1l3g s VAL 123 N -2.89 3.32 -2.43 4.02 0.11 -1.26 -5.35 120.40 115.93 1l3g s VAL 123 Ca 0.53 0.52 0.29 0.00 -2.93 0.00 0.00 61.98 60.38 1l3g s VAL 123 Cb -0.11 -3.33 0.60 0.00 -1.53 0.00 0.00 36.38 32.01 1l3g s VAL 123 CO 0.46 -0.03 1.82 0.47 -3.33 0.00 0.00 175.10 174.48