#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3g h ASN 3 N 0.00 0.00 -2.57 6.43 4.21 -1.99 -3.23 115.58 118.44 1l3g h ASN 3 Ca 0.00 -0.04 -0.21 0.00 1.21 0.00 0.00 56.30 57.26 1l3g h ASN 3 Cb 0.00 0.00 0.10 0.00 -1.12 0.00 0.00 38.32 37.30 1l3g h ASN 3 CO 0.00 0.02 0.10 0.00 -1.29 0.00 0.00 177.43 176.26 1l3g n GLN 4 N -2.64 -1.78 -3.87 0.81 6.02 -1.26 -4.25 117.38 110.40 1l3g n GLN 4 Ca 0.03 -0.94 -0.32 0.00 -0.01 0.00 0.00 57.00 55.76 1l3g n GLN 4 Cb 0.50 -0.81 -0.12 0.00 1.02 0.00 0.00 30.24 30.83 1l3g n GLN 4 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 1l3g s ILE 5 N -2.13 2.98 1.10 5.09 -1.16 -1.23 -3.38 121.20 122.48 1l3g s ILE 5 Ca 0.37 -3.28 -0.12 0.00 -0.51 0.00 0.00 60.65 57.11 1l3g s ILE 5 Cb -0.03 -3.01 0.25 0.00 0.61 0.00 0.00 42.46 40.28 1l3g s ILE 5 CO 0.28 -0.84 1.05 -0.31 -2.81 0.00 0.00 174.94 172.31 1l3g s TYR 6 N -0.31 1.52 0.10 3.50 1.51 0.64 -4.37 117.35 119.95 1l3g s TYR 6 Ca 0.18 1.24 0.08 0.00 -1.01 0.00 0.00 57.07 57.55 1l3g s TYR 6 Cb -0.23 -3.15 -0.04 0.00 -0.11 0.00 0.00 41.96 38.43 1l3g s TYR 6 CO -0.02 -3.56 -0.17 -1.12 -1.11 0.00 0.00 175.55 169.58 1l3g s SER 7 N -2.70 3.97 0.09 2.29 0.01 -1.26 0.31 113.70 116.41 1l3g s SER 7 Ca 0.68 -0.50 -0.13 0.00 1.31 0.00 0.00 55.95 57.31 1l3g s SER 7 Cb -0.24 -0.62 0.02 0.00 0.21 0.00 0.00 66.02 65.40 1l3g s SER 7 CO 0.63 0.20 0.30 0.00 0.41 0.00 0.00 173.24 174.77 1l3g s ALA 8 N -1.11 -0.62 -0.24 1.44 0.00 0.11 -2.16 121.76 119.18 1l3g s ALA 8 Ca 0.18 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 51.93 1l3g s ALA 8 Cb -0.11 0.51 0.06 0.00 0.00 0.00 0.00 23.12 23.58 1l3g s ALA 8 CO 0.10 -0.53 -0.08 0.50 0.00 0.00 0.00 175.76 175.75 1l3g s ARG 9 N -3.45 1.87 0.16 0.00 3.52 -1.26 0.24 118.95 120.03 1l3g s ARG 9 Ca 0.01 -1.07 -0.06 0.00 -0.13 0.00 0.00 55.73 54.49 1l3g s ARG 9 Cb 0.02 -2.65 -0.02 0.00 -1.56 0.00 0.00 34.95 30.74 1l3g s ARG 9 CO -0.09 -0.56 0.21 0.71 -0.81 0.00 0.00 175.30 174.76 1l3g s TYR 10 N 1.31 0.63 -1.48 5.12 2.02 -0.27 -4.87 117.35 119.81 1l3g s TYR 10 Ca -0.06 -0.98 -0.04 0.00 -0.37 0.00 0.00 57.07 55.62 1l3g s TYR 10 Cb -0.19 -0.23 0.02 0.00 -0.40 0.00 0.00 41.96 41.16 1l3g s TYR 10 CO -0.06 -0.67 0.36 -1.13 -1.57 0.00 0.00 175.55 172.48 1l3g n SER 11 N -0.19 -5.30 0.00 2.29 3.41 -1.26 -0.34 113.62 112.23 1l3g n SER 11 Ca -0.05 -0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 1l3g n SER 11 Cb 0.63 -4.35 0.00 0.00 -0.26 0.00 0.00 64.21 60.23 1l3g n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1l3g n GLY 12 N -1.24 1.60 3.06 5.00 0.00 -1.26 -4.93 105.19 107.42 1l3g n GLY 12 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.30 0.93 0.66 1.61 1.01 0.53 -5.11 120.40 117.74 1l3g s VAL 13 Ca 0.00 -0.49 -0.10 0.00 0.00 0.00 0.00 61.98 61.39 1l3g s VAL 13 Cb 0.00 -0.79 -0.00 0.00 0.00 0.00 0.00 36.38 35.59 1l3g s VAL 13 CO 0.00 0.27 1.04 1.51 0.00 0.00 0.00 175.10 177.92 1l3g s ASP 14 N -0.16 5.73 0.35 3.32 1.47 -1.26 -1.11 116.67 125.00 1l3g s ASP 14 Ca 0.02 1.16 -0.04 0.00 1.18 0.00 0.00 52.55 54.87 1l3g s ASP 14 Cb -0.06 -2.08 0.01 0.00 -0.34 0.00 0.00 42.92 40.45 1l3g s ASP 14 CO -0.00 -1.14 0.51 0.54 0.68 0.00 0.00 175.17 175.76 1l3g s VAL 15 N -3.24 0.00 0.10 2.11 0.11 0.68 0.42 120.40 120.58 1l3g s VAL 15 Ca 0.56 -1.52 0.08 0.00 -2.93 0.00 0.00 61.98 58.17 1l3g s VAL 15 Cb -0.11 -2.66 -0.04 0.00 -1.53 0.00 0.00 36.38 32.05 1l3g s VAL 15 CO 0.51 0.00 -0.17 -0.31 -3.33 0.00 0.00 175.10 171.81 1l3g s TYR 16 N -2.99 2.57 -0.12 1.54 2.02 0.42 0.04 117.35 120.83 1l3g s TYR 16 Ca 0.28 -0.24 0.03 0.00 -0.37 0.00 0.00 57.07 56.77 1l3g s TYR 16 Cb -0.01 -1.38 0.01 0.00 -0.40 0.00 0.00 41.96 40.17 1l3g s TYR 16 CO 0.19 0.37 -0.23 -1.83 -1.57 0.00 0.00 175.55 172.48 1l3g s GLU 17 N -2.02 3.02 -0.03 -0.62 1.03 0.93 0.23 118.70 121.24 1l3g s GLU 17 Ca 0.18 -0.86 0.03 0.00 0.03 0.00 0.00 54.97 54.34 1l3g s GLU 17 Cb -0.11 -2.36 0.00 0.00 -0.80 0.00 0.00 34.13 30.87 1l3g s GLU 17 CO 0.10 0.08 -0.09 0.12 -1.33 0.00 0.00 175.26 174.13 1l3g s PHE 18 N 0.59 0.97 -0.12 4.83 2.19 0.31 0.24 117.98 126.99 1l3g s PHE 18 Ca -0.13 -0.25 -0.19 0.00 0.33 0.00 0.00 56.93 56.69 1l3g s PHE 18 Cb -0.17 -0.69 -0.04 0.00 -1.31 0.00 0.00 43.02 40.81 1l3g s PHE 18 CO 0.03 -0.10 0.53 0.42 1.83 0.00 0.00 175.22 177.93 1l3g s ILE 19 N 0.20 5.15 0.00 3.12 -1.09 -1.16 0.82 121.20 128.24 1l3g s ILE 19 Ca -0.03 1.06 0.00 0.00 -2.23 0.00 0.00 60.65 59.45 1l3g s ILE 19 Cb -0.09 -3.87 0.00 0.00 -1.58 0.00 0.00 42.46 36.92 1l3g s ILE 19 CO 0.01 0.29 0.00 1.57 -1.23 0.00 0.00 174.94 175.58 1l3g n HIS 20 N 3.83 0.00 -0.02 3.97 -0.00 4.52 -4.76 115.22 122.76 1l3g n HIS 20 Ca -0.05 0.00 -0.04 0.00 0.46 0.00 0.00 57.72 58.09 1l3g n HIS 20 Cb 0.51 0.00 0.20 0.00 -0.12 0.00 0.00 29.99 30.58 1l3g n HIS 20 CO 0.00 0.00 0.00 0.77 0.46 0.00 0.00 176.34 177.57 1l3g h SER 21 N 0.00 0.56 -0.47 0.26 0.02 -1.86 -2.04 113.55 110.02 1l3g h SER 21 Ca 0.00 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1l3g h SER 21 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1l3g h SER 21 CO 0.00 0.75 0.00 1.07 -1.14 0.00 0.00 176.83 177.51 1l3g n THR 22 N -4.16 1.65 0.00 -2.27 5.66 -1.26 -4.98 114.28 108.93 1l3g n THR 22 Ca 0.00 -0.95 0.00 0.00 -3.05 0.00 0.00 64.05 60.06 1l3g n THR 22 Cb 0.37 -0.12 0.00 0.00 -1.55 0.00 0.00 70.33 69.03 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 0.75 1.22 3.70 1.09 0.00 -0.77 -4.88 105.19 106.29 1l3g n GLY 23 Ca 0.20 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 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 5.07 -0.17 1.61 0.15 -1.18 0.82 113.70 116.00 1l3g s SER 24 Ca 0.00 -0.18 -0.01 0.00 0.70 0.00 0.00 55.95 56.46 1l3g s SER 24 Cb 0.00 -1.22 -0.01 0.00 -1.71 0.00 0.00 66.02 63.09 1l3g s SER 24 CO 0.00 0.16 -0.11 -0.63 1.20 0.00 0.00 173.24 173.86 1l3g s ILE 25 N -1.38 3.00 -0.22 6.45 1.01 4.56 -4.39 121.20 130.23 1l3g s ILE 25 Ca 0.26 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 60.18 1l3g s ILE 25 Cb -0.11 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 1l3g s ILE 25 CO 0.19 0.49 0.11 -0.04 0.00 0.00 0.00 174.94 175.69 1l3g s MET 26 N 0.95 3.97 0.18 2.79 -1.94 -1.06 0.11 119.30 124.30 1l3g s MET 26 Ca -0.02 -0.33 0.08 0.00 -1.71 0.00 0.00 55.69 53.71 1l3g s MET 26 Cb -0.15 -3.39 -0.04 0.00 2.01 0.00 0.00 34.83 33.26 1l3g s MET 26 CO -0.01 0.10 -0.03 -1.59 -0.01 0.00 0.00 175.02 173.49 1l3g s LYS 27 N 0.88 2.30 0.03 2.03 0.00 0.62 -3.69 119.74 121.92 1l3g s LYS 27 Ca 0.06 -1.17 -0.17 0.00 0.00 0.00 0.00 55.97 54.69 1l3g s LYS 27 Cb -0.13 -2.29 -0.06 0.00 0.00 0.00 0.00 37.83 35.35 1l3g s LYS 27 CO 0.03 0.44 0.48 0.50 0.00 0.00 0.00 175.35 176.80 1l3g s ARG 28 N -2.95 4.05 0.30 1.78 3.52 -1.01 0.16 118.95 124.80 1l3g s ARG 28 Ca 0.27 0.55 0.07 0.00 -0.13 0.00 0.00 55.73 56.49 1l3g s ARG 28 Cb -0.09 -3.23 0.48 0.00 -1.56 0.00 0.00 34.95 30.55 1l3g s ARG 28 CO 0.18 0.65 1.71 0.87 -0.81 0.00 0.00 175.30 177.90 1l3g h LYS 29 N 4.70 0.22 -0.21 5.12 1.79 0.83 0.40 116.57 129.42 1l3g h LYS 29 Ca -0.50 -0.10 0.02 0.00 -2.18 0.00 0.00 60.65 57.89 1l3g h LYS 29 Cb 1.22 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.83 1l3g h LYS 29 CO 0.63 0.59 -0.17 0.87 -1.08 0.00 0.00 179.45 180.28 1l3g h LYS 30 N 0.18 -0.06 -0.20 3.15 1.79 -1.94 -2.94 116.57 116.55 1l3g h LYS 30 Ca 0.02 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.42 1l3g h LYS 30 Cb 0.80 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.42 1l3g h LYS 30 CO 0.06 -0.04 -0.10 -3.47 -1.08 0.00 0.00 179.45 174.82 1l3g n ASP 31 N -3.59 2.73 -3.96 0.86 -0.08 -1.24 -4.97 116.55 106.30 1l3g n ASP 31 Ca -0.00 -3.45 -0.35 0.00 -1.51 0.00 0.00 54.79 49.48 1l3g n ASP 31 Cb 0.09 -0.55 0.00 0.00 2.34 0.00 0.00 41.12 43.00 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 -1.02 -2.98 -4.93 1.67 9.92 0.09 -4.07 116.55 115.23 1l3g n ASP 32 Ca 0.24 -1.15 -0.25 0.00 -0.53 0.00 0.00 54.79 53.11 1l3g n ASP 32 Cb 0.87 -2.51 -0.01 0.00 -0.64 0.00 0.00 41.12 38.83 1l3g n ASP 32 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1l3g s TRP 33 N -3.72 3.52 0.10 1.24 0.52 -0.95 0.32 118.94 119.96 1l3g s TRP 33 Ca 0.31 0.50 0.06 0.00 0.02 0.00 0.00 56.10 57.00 1l3g s TRP 33 Cb -0.14 -2.03 -0.03 0.00 -1.15 0.00 0.00 33.47 30.12 1l3g s TRP 33 CO 0.92 0.02 -0.16 0.54 0.02 0.00 0.00 176.95 178.29 1l3g s VAL 34 N -2.41 1.38 -0.54 4.03 0.11 0.61 -2.40 120.40 121.18 1l3g s VAL 34 Ca 0.42 -1.53 -0.26 0.00 -2.93 0.00 0.00 61.98 57.68 1l3g s VAL 34 Cb -0.10 -1.39 -0.07 0.00 -1.53 0.00 0.00 36.38 33.29 1l3g s VAL 34 CO 0.38 -0.24 2.35 0.21 -3.33 0.00 0.00 175.10 174.47 1l3g s ASN 35 N -2.06 4.45 0.65 3.54 2.47 -1.14 0.67 114.94 123.52 1l3g s ASN 35 Ca 0.05 0.87 0.09 0.00 0.42 0.00 0.00 52.86 54.28 1l3g s ASN 35 Cb -0.08 -2.51 0.36 0.00 -1.45 0.00 0.00 41.25 37.57 1l3g s ASN 35 CO 0.03 -2.96 1.16 0.00 -3.72 0.00 0.00 177.10 171.62 1l3g h ALA 36 N 18.30 2.13 0.12 1.71 0.00 5.27 0.40 119.26 147.19 1l3g h ALA 36 Ca -0.21 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1l3g h ALA 36 Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1l3g h ALA 36 CO 1.15 -1.08 -0.06 1.15 0.00 0.00 0.00 179.25 180.41 1l3g h THR 37 N 0.00 0.97 -0.20 0.00 2.02 -1.82 5.29 112.91 119.18 1l3g h THR 37 Ca 0.10 -0.39 0.06 0.00 0.77 0.00 0.00 66.41 66.95 1l3g h THR 37 Cb 2.04 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 69.66 1l3g h THR 37 CO -0.00 0.09 0.16 1.12 0.37 0.00 0.00 175.52 177.27 1l3g h HIS 38 N -0.35 0.00 0.05 3.16 2.07 -0.53 5.13 115.15 124.68 1l3g h HIS 38 Ca -0.02 0.00 -0.29 0.00 -2.85 0.00 0.00 60.37 57.21 1l3g h HIS 38 Cb 0.28 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.23 1l3g h HIS 38 CO -0.01 0.00 -1.58 -0.89 -3.07 0.00 0.00 177.93 172.38 1l3g n ILE 39 N -4.20 1.63 -0.11 6.12 -0.00 -0.71 -3.21 119.36 118.89 1l3g n ILE 39 Ca 0.02 -0.28 -0.23 0.00 -0.00 0.00 0.00 62.75 62.26 1l3g n ILE 39 Cb 0.30 -1.92 -0.11 0.00 -0.00 0.00 0.00 39.64 37.91 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 -4.06 1.88 0.25 1.39 7.99 1.72 -4.01 117.00 122.16 1l3g n LEU 40 Ca -0.33 0.41 0.11 0.00 -0.01 0.00 0.00 56.01 56.19 1l3g n LEU 40 Cb 0.83 -0.96 0.63 0.00 -0.11 0.00 0.00 43.42 43.82 1l3g n LEU 40 CO 0.28 0.31 0.91 0.07 -1.51 0.00 0.00 177.39 177.45 1l3g h LYS 41 N -0.98 0.00 0.00 3.23 5.09 0.98 1.02 116.57 125.91 1l3g h LYS 41 Ca -0.38 0.00 -0.03 0.00 0.09 0.00 0.00 60.65 60.33 1l3g h LYS 41 Cb 1.35 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.67 1l3g h LYS 41 CO -0.23 0.17 -0.12 0.00 -2.09 0.00 0.00 179.45 177.18 1l3g h ALA 42 N 1.83 1.28 0.00 0.07 0.00 0.87 0.11 119.26 123.42 1l3g h ALA 42 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1l3g h ALA 42 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1l3g h ALA 42 CO 0.02 0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.42 1l3g n ALA 43 N -2.28 1.61 -1.43 0.00 0.00 -0.67 -4.74 120.51 112.99 1l3g n ALA 43 Ca -0.02 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1l3g n ALA 43 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.69 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 -0.10 0.12 -1.27 0.00 2.04 0.34 -5.08 115.26 111.32 1l3g n ASN 44 Ca 0.00 -1.54 0.00 0.00 -0.44 0.00 0.00 54.58 52.60 1l3g n ASN 44 Cb 0.17 -0.10 0.00 0.00 -2.53 0.00 0.00 39.78 37.32 1l3g n ASN 44 CO 0.00 0.00 0.00 0.49 -0.44 0.00 0.00 177.26 177.31 1l3g n PHE 45 N -0.05 -1.79 -2.83 -2.53 3.72 0.01 -4.51 117.46 109.49 1l3g n PHE 45 Ca 0.00 0.96 -0.43 0.00 -0.05 0.00 0.00 57.45 57.93 1l3g n PHE 45 Cb 0.59 -1.61 -0.03 0.00 -0.94 0.00 0.00 39.48 37.49 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 -3.80 3.16 0.00 4.37 0.00 -1.26 -4.17 121.76 120.05 1l3g s ALA 46 Ca 0.00 -2.42 0.00 0.00 0.00 0.00 0.00 51.96 49.54 1l3g s ALA 46 Cb 0.00 -4.11 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1l3g s ALA 46 CO 0.00 -3.08 0.00 1.63 0.00 0.00 0.00 175.76 174.31 1l3g n LYS 47 N 7.35 0.44 0.14 0.00 5.02 -1.26 -4.88 118.16 124.97 1l3g n LYS 47 Ca 0.19 0.00 0.19 0.00 -2.02 0.00 0.00 58.31 56.67 1l3g n LYS 47 Cb 0.49 0.00 0.72 0.00 -0.02 0.00 0.00 35.03 36.21 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 1.96 0.11 7.82 0.00 -1.97 0.30 119.26 128.48 1l3g h ALA 48 Ca 0.00 -0.01 -0.01 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 17.82 1l3g h ALA 48 CO 0.00 -0.66 -0.05 0.87 0.00 0.00 0.00 179.25 179.40 1l3g h LYS 49 N 0.00 -0.14 0.00 0.00 1.79 -1.91 -2.77 116.57 113.54 1l3g h LYS 49 Ca 0.16 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.63 1l3g h LYS 49 Cb 1.14 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.82 1l3g h LYS 49 CO -0.00 0.25 -0.05 -0.09 -1.08 0.00 0.00 179.45 178.48 1l3g h ARG 50 N -0.56 0.00 -0.32 3.15 2.43 -0.61 0.14 114.38 118.61 1l3g h ARG 50 Ca -0.01 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1l3g h ARG 50 Cb 0.45 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1l3g h ARG 50 CO 0.02 0.05 -0.20 1.15 -1.51 0.00 0.00 179.97 179.48 1l3g h THR 51 N 0.00 1.26 0.00 0.20 2.02 -1.04 -0.98 112.91 114.36 1l3g h THR 51 Ca -0.00 -1.22 0.00 0.00 0.77 0.00 0.00 66.41 65.96 1l3g h THR 51 Cb 0.10 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1l3g h THR 51 CO 0.01 0.40 -0.19 -1.14 0.37 0.00 0.00 175.52 174.96 1l3g n ARG 52 N -4.14 0.15 -0.28 6.66 0.63 -0.46 -2.58 116.66 116.64 1l3g n ARG 52 Ca 0.00 0.30 0.09 0.00 -0.92 0.00 0.00 57.85 57.32 1l3g n ARG 52 Cb 0.39 -1.02 0.23 0.00 0.45 0.00 0.00 32.46 32.51 1l3g n ARG 52 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 1l3g h ILE 53 N -0.32 0.35 0.48 5.15 5.03 -0.93 1.39 117.51 128.66 1l3g h ILE 53 Ca 0.00 -0.06 -0.02 0.00 -0.12 0.00 0.00 64.86 64.65 1l3g h ILE 53 Cb 0.19 0.15 0.00 0.00 -3.03 0.00 0.00 36.82 34.13 1l3g h ILE 53 CO 0.00 0.03 -0.23 0.25 -0.68 0.00 0.00 178.15 177.52 1l3g h LEU 54 N 0.18 -0.55 -0.66 1.44 5.85 -1.31 0.30 115.31 120.57 1l3g h LEU 54 Ca 0.49 -0.06 0.11 0.00 0.84 0.00 0.00 57.88 59.25 1l3g h LEU 54 Cb 0.92 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 42.01 1l3g h LEU 54 CO -0.64 -0.15 0.23 -0.08 -0.34 0.00 0.00 178.44 177.46 1l3g h GLU 55 N -1.05 0.38 0.00 1.25 4.57 -1.01 3.00 114.58 121.72 1l3g h GLU 55 Ca -0.07 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.05 1l3g h GLU 55 Cb 0.58 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 1l3g h GLU 55 CO 0.11 0.25 -0.19 -0.22 -1.18 0.00 0.00 179.01 177.79 1l3g h LYS 56 N 0.39 0.00 0.02 1.92 3.11 0.18 0.64 116.57 122.84 1l3g h LYS 56 Ca 0.35 0.00 -0.27 0.00 -2.81 0.00 0.00 60.65 57.91 1l3g h LYS 56 Cb 0.48 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.67 1l3g h LYS 56 CO -0.36 0.19 -1.48 -1.91 -2.81 0.00 0.00 179.45 173.07 1l3g n GLU 57 N -3.31 0.60 -0.06 1.90 4.07 0.11 -4.20 120.64 119.75 1l3g n GLU 57 Ca 0.01 0.50 -0.19 0.00 -0.06 0.00 0.00 57.16 57.42 1l3g n GLU 57 Cb 0.43 -1.72 -0.13 0.00 -0.06 0.00 0.00 31.44 29.96 1l3g n GLU 57 CO 0.00 0.00 0.00 -0.24 -0.06 0.00 0.00 177.13 176.83 1l3g h VAL 58 N -0.81 1.29 -0.90 6.31 3.04 0.52 -2.43 116.25 123.26 1l3g h VAL 58 Ca -0.39 -2.31 0.26 0.00 -1.01 0.00 0.00 66.70 63.26 1l3g h VAL 58 Cb 1.46 2.80 -0.17 0.00 -2.01 0.00 0.00 31.29 33.37 1l3g h VAL 58 CO -0.17 0.52 0.06 -0.11 -1.01 0.00 0.00 177.57 176.87 1l3g n LEU 59 N -4.37 -0.06 0.12 3.16 -0.00 0.22 0.29 117.00 116.37 1l3g n LEU 59 Ca -0.22 1.52 0.08 0.00 -0.00 0.00 0.00 56.01 57.39 1l3g n LEU 59 Cb 0.66 -0.57 0.02 0.00 -0.00 0.00 0.00 43.42 43.53 1l3g n LEU 59 CO 0.31 -1.56 0.20 0.11 -0.00 0.00 0.00 177.39 176.44 1l3g h LYS 60 N 0.00 0.00 -5.28 1.96 1.57 -1.69 -3.43 116.57 109.70 1l3g h LYS 60 Ca 0.57 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.72 1l3g h LYS 60 Cb 1.21 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.35 1l3g h LYS 60 CO -0.83 0.13 -0.59 -2.00 -0.57 0.00 0.00 179.45 175.59 1l3g s GLU 61 N -3.18 3.89 0.00 3.15 2.56 0.86 -4.86 118.70 121.11 1l3g s GLU 61 Ca 0.01 -0.39 0.00 0.00 0.00 0.00 0.00 54.97 54.59 1l3g s GLU 61 Cb 0.08 -3.14 0.00 0.00 2.00 0.00 0.00 34.13 33.07 1l3g s GLU 61 CO 0.76 0.26 0.00 2.41 -0.56 0.00 0.00 175.26 178.13 1l3g n THR 62 N 3.56 0.00 -1.54 -1.70 -1.04 -1.25 -4.46 114.28 107.85 1l3g n THR 62 Ca -0.17 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.55 1l3g n THR 62 Cb 0.52 0.00 0.13 0.00 -1.82 0.00 0.00 70.33 69.16 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 0.00 2.58 -0.06 -1.42 5.65 -1.03 -3.81 115.29 117.20 1l3g s HIS 63 Ca 0.00 0.91 -0.02 0.00 0.25 0.00 0.00 55.06 56.19 1l3g s HIS 63 Cb 0.00 -3.34 0.04 0.00 -1.18 0.00 0.00 32.58 28.10 1l3g s HIS 63 CO 0.00 -2.25 0.13 -1.21 -0.65 0.00 0.00 174.74 170.76 1l3g s GLU 64 N -5.26 0.07 -0.51 2.88 0.41 -0.69 -4.82 118.70 110.78 1l3g s GLU 64 Ca 0.63 0.36 -0.02 0.00 -0.41 0.00 0.00 54.97 55.54 1l3g s GLU 64 Cb -0.15 -0.20 0.13 0.00 -1.78 0.00 0.00 34.13 32.13 1l3g s GLU 64 CO 0.53 -0.18 0.31 -1.59 -0.49 0.00 0.00 175.26 173.84 1l3g s LYS 65 N 1.27 2.23 -0.24 1.61 -2.85 -1.17 -2.53 119.74 118.06 1l3g s LYS 65 Ca -0.08 -2.19 -0.17 0.00 -1.00 0.00 0.00 55.97 52.53 1l3g s LYS 65 Cb -0.12 -3.62 -0.03 0.00 -2.06 0.00 0.00 37.83 32.00 1l3g s LYS 65 CO -0.06 -1.12 0.46 0.54 0.10 0.00 0.00 175.35 175.28 1l3g s VAL 66 N 0.51 5.13 0.05 1.79 0.11 0.44 -5.00 120.40 123.42 1l3g s VAL 66 Ca 0.13 0.79 -0.04 0.00 -2.93 0.00 0.00 61.98 59.93 1l3g s VAL 66 Cb -0.22 -3.78 -0.02 0.00 -1.53 0.00 0.00 36.38 30.83 1l3g s VAL 66 CO -0.04 0.16 0.07 0.00 -3.33 0.00 0.00 175.10 171.96 1l3g s GLN 67 N 1.90 0.64 0.00 1.54 -2.07 -1.26 -4.32 119.66 116.09 1l3g s GLN 67 Ca 0.20 -0.95 0.00 0.00 -1.82 0.00 0.00 55.36 52.79 1l3g s GLN 67 Cb -0.15 0.24 0.00 0.00 -1.09 0.00 0.00 33.01 32.01 1l3g s GLN 67 CO 0.09 -0.16 0.00 0.41 -1.32 0.00 0.00 175.29 174.31 1l3g n GLY 68 N 0.40 0.83 1.70 2.60 0.00 -1.26 -3.90 105.19 105.56 1l3g n GLY 68 Ca -0.17 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.31 1.72 3.43 -0.02 0.00 -1.26 -4.98 105.19 101.77 1l3g n GLY 69 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1l3g n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1l3g s PHE 70 N -2.54 3.21 0.00 1.61 0.40 -1.25 -4.03 117.98 115.38 1l3g s PHE 70 Ca 0.00 -1.44 0.00 0.00 -0.60 0.00 0.00 56.93 54.89 1l3g s PHE 70 Cb 0.00 -4.19 0.00 0.00 0.51 0.00 0.00 43.02 39.34 1l3g s PHE 70 CO 0.00 -1.40 0.00 0.41 0.70 0.00 0.00 175.22 174.93 1l3g n GLY 71 N 5.22 0.43 0.14 4.36 0.00 -1.26 -4.06 105.19 110.02 1l3g n GLY 71 Ca 0.20 -0.95 0.12 0.00 0.00 0.00 0.00 46.02 45.39 1l3g n GLY 71 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1l3g h LYS 72 N 0.00 0.00 0.00 1.61 5.09 -1.75 -1.86 116.57 119.65 1l3g h LYS 72 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 60.65 60.66 1l3g h LYS 72 Cb 0.40 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.72 1l3g h LYS 72 CO 0.00 0.00 -0.37 1.88 -2.09 0.00 0.00 179.45 178.87 1l3g h TYR 73 N 0.00 0.00 0.02 0.07 -1.99 -1.89 -3.25 116.97 109.93 1l3g h TYR 73 Ca 0.00 0.00 -0.35 0.00 2.00 0.00 0.00 58.73 60.38 1l3g h TYR 73 Cb 0.45 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.13 1l3g h TYR 73 CO 0.00 0.37 -1.93 0.00 -0.00 0.00 0.00 178.16 176.60 1l3g n GLN 74 N -3.85 0.62 0.00 4.88 0.00 -0.80 -3.71 117.38 114.51 1l3g n GLN 74 Ca -0.01 0.37 0.00 0.00 0.00 0.00 0.00 57.00 57.36 1l3g n GLN 74 Cb 0.44 -1.64 0.00 0.00 0.00 0.00 0.00 30.24 29.04 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 1.58 0.96 2.78 2.61 0.00 -0.77 -4.49 105.19 107.87 1l3g n GLY 75 Ca -0.41 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 1l3g n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l3g s THR 76 N 0.00 1.81 0.32 2.61 2.01 -1.05 -0.42 115.64 120.92 1l3g s THR 76 Ca 0.00 -2.89 -0.20 0.00 0.31 0.00 0.00 61.69 58.90 1l3g s THR 76 Cb 0.00 -2.26 -0.09 0.00 0.01 0.00 0.00 72.50 70.16 1l3g s THR 76 CO 0.00 -0.88 0.83 0.26 -0.69 0.00 0.00 174.62 174.14 1l3g s TRP 77 N 0.04 3.51 0.03 4.92 0.51 -1.10 1.01 118.94 127.86 1l3g s TRP 77 Ca 0.18 1.49 0.05 0.00 -2.12 0.00 0.00 56.10 55.70 1l3g s TRP 77 Cb -0.23 -2.72 -0.02 0.00 -0.81 0.00 0.00 33.47 29.69 1l3g s TRP 77 CO -0.02 0.14 -0.14 0.14 -0.51 0.00 0.00 176.95 176.57 1l3g s VAL 78 N -1.81 1.14 -0.27 4.03 -7.23 3.11 -1.70 120.40 117.67 1l3g s VAL 78 Ca 0.52 -0.95 -0.39 0.00 -1.81 0.00 0.00 61.98 59.35 1l3g s VAL 78 Cb -0.14 -1.02 -0.15 0.00 0.56 0.00 0.00 36.38 35.64 1l3g s VAL 78 CO 0.19 0.06 1.84 -2.65 -0.31 0.00 0.00 175.10 174.23 1l3g n PRO 79 N 2.03 1.28 -0.27 4.82 -0.02 -1.25 0.22 135.00 141.81 1l3g n PRO 79 Ca -0.17 0.45 0.31 0.00 -2.02 0.00 0.00 63.50 62.08 1l3g n PRO 79 Cb 0.55 -2.22 0.71 0.00 -0.02 0.00 0.00 33.50 32.52 1l3g n PRO 79 CO 0.00 0.00 0.00 1.37 1.98 0.00 0.00 175.50 178.85 1l3g h LEU 80 N 8.28 0.05 -0.66 2.45 -0.00 -0.28 4.09 115.31 129.24 1l3g h LEU 80 Ca -0.43 0.01 -0.11 0.00 -0.00 0.00 0.00 57.88 57.34 1l3g h LEU 80 Cb 1.31 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.96 1l3g h LEU 80 CO 0.97 0.01 -0.19 -1.13 -0.00 0.00 0.00 178.44 178.10 1l3g h ASN 81 N 0.05 0.85 0.03 0.17 -0.73 -1.86 -1.78 115.58 112.30 1l3g h ASN 81 Ca 0.52 -0.30 -0.37 0.00 1.87 0.00 0.00 56.30 58.01 1l3g h ASN 81 Cb 1.98 -0.23 -0.07 0.00 0.27 0.00 0.00 38.32 40.27 1l3g h ASN 81 CO -0.04 1.02 -2.38 0.00 -0.37 0.00 0.00 177.43 175.66 1l3g n ILE 82 N -4.12 1.45 0.36 2.57 0.00 0.18 -3.94 119.36 115.86 1l3g n ILE 82 Ca 0.01 -0.74 -0.16 0.00 0.00 0.00 0.00 62.75 61.85 1l3g n ILE 82 Cb 0.42 -0.89 -0.08 0.00 0.00 0.00 0.00 39.64 39.09 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 0.59 -0.92 -0.54 1.51 0.00 0.75 -1.45 119.26 119.20 1l3g h ALA 83 Ca -0.55 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 54.26 1l3g h ALA 83 Cb 2.10 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 20.22 1l3g h ALA 83 CO -0.01 -0.93 0.37 0.87 0.00 0.00 0.00 179.25 179.55 1l3g h LYS 84 N -1.09 0.22 -0.01 0.00 1.57 -1.46 0.41 116.57 116.22 1l3g h LYS 84 Ca -0.09 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 1l3g h LYS 84 Cb 0.74 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 1l3g h LYS 84 CO 0.16 0.15 -0.53 0.37 -0.57 0.00 0.00 179.45 179.02 1l3g h GLN 85 N 0.23 0.02 0.14 3.15 -0.00 -1.62 0.58 115.11 117.61 1l3g h GLN 85 Ca 0.25 -0.01 -0.34 0.00 -0.00 0.00 0.00 58.65 58.55 1l3g h GLN 85 Cb 0.70 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.17 1l3g h GLN 85 CO -0.05 0.55 -1.78 1.25 0.00 0.00 0.00 178.83 178.80 1l3g h LEU 86 N 0.02 0.46 0.00 -2.39 6.46 0.29 -3.38 115.31 116.77 1l3g h LEU 86 Ca -0.00 -0.78 -0.00 0.00 -0.12 0.00 0.00 57.88 56.97 1l3g h LEU 86 Cb 0.95 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.73 1l3g h LEU 86 CO 0.07 1.67 -0.40 0.00 -0.62 0.00 0.00 178.44 179.17 1l3g h ALA 87 N 0.26 0.00 -0.51 1.25 0.00 -0.29 -3.35 119.26 116.62 1l3g h ALA 87 Ca -0.34 -0.40 0.15 0.00 0.00 0.00 0.00 54.91 54.32 1l3g h ALA 87 Cb 2.06 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 20.22 1l3g h ALA 87 CO 0.14 0.40 0.79 -0.85 0.00 0.00 0.00 179.25 179.72 1l3g n GLU 88 N -4.65 0.01 0.00 0.00 0.28 0.20 -0.71 120.64 115.77 1l3g n GLU 88 Ca -0.06 0.68 0.00 0.00 -0.16 0.00 0.00 57.16 57.62 1l3g n GLU 88 Cb 0.21 -1.73 0.00 0.00 1.43 0.00 0.00 31.44 31.35 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 -2.40 0.00 -0.11 3.44 4.81 -1.25 -4.10 118.16 118.55 1l3g n LYS 89 Ca 0.11 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 57.61 1l3g n LYS 89 Cb 0.94 -0.04 0.11 0.00 0.02 0.00 0.00 35.03 36.07 1l3g n LYS 89 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1l3g n PHE 90 N 0.00 0.28 0.00 5.64 -0.00 -1.07 -4.35 117.46 117.96 1l3g n PHE 90 Ca 0.00 -0.29 0.00 0.00 -0.00 0.00 0.00 57.45 57.16 1l3g n PHE 90 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 39.48 39.47 1l3g n PHE 90 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1l3g n SER 91 N 0.61 0.00 0.00 -2.13 7.64 0.11 -4.71 113.62 115.14 1l3g n SER 91 Ca 0.10 0.11 0.00 0.00 1.01 0.00 0.00 58.87 60.09 1l3g n SER 91 Cb 0.38 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1l3g n SER 91 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1l3g n VAL 92 N -0.34 0.84 -0.36 0.44 0.24 -1.19 -4.27 118.33 113.69 1l3g n VAL 92 Ca 0.00 -0.92 0.30 0.00 -2.04 0.00 0.00 64.34 61.68 1l3g n VAL 92 Cb 0.00 0.58 0.46 0.00 -1.47 0.00 0.00 33.84 33.41 1l3g n VAL 92 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1l3g n TYR 93 N -0.42 0.00 -0.07 6.34 4.19 -1.22 0.20 117.16 126.19 1l3g n TYR 93 Ca 0.00 0.00 -0.05 0.00 3.31 0.00 0.00 57.90 61.16 1l3g n TYR 93 Cb 0.22 -0.28 -0.02 0.00 0.49 0.00 0.00 39.34 39.76 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 -3.04 1.64 0.16 2.98 8.00 -1.26 -4.17 116.55 120.86 1l3g n ASP 94 Ca 0.25 0.56 0.03 0.00 0.71 0.00 0.00 54.79 56.34 1l3g n ASP 94 Cb 1.24 -0.82 0.41 0.00 -0.02 0.00 0.00 41.12 41.92 1l3g n ASP 94 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1l3g h GLN 95 N -0.90 0.13 -0.70 -1.24 7.50 -1.03 -1.84 115.11 117.03 1l3g h GLN 95 Ca 0.00 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.12 1l3g h GLN 95 Cb 0.51 -0.02 0.00 0.00 0.05 0.00 0.00 27.48 28.02 1l3g h GLN 95 CO 0.00 0.33 0.00 1.28 -1.50 0.00 0.00 178.83 178.94 1l3g n LEU 96 N -4.25 0.70 -0.27 1.46 4.77 0.53 -4.00 117.00 115.94 1l3g n LEU 96 Ca -0.01 -0.35 0.05 0.00 -0.03 0.00 0.00 56.01 55.67 1l3g n LEU 96 Cb 0.30 -0.35 0.19 0.00 -2.33 0.00 0.00 43.42 41.22 1l3g n LEU 96 CO 0.38 0.17 1.05 0.50 -1.33 0.00 0.00 177.39 178.17 1l3g h LYS 97 N 0.09 0.52 -0.02 3.23 3.11 -1.49 -0.28 116.57 121.72 1l3g h LYS 97 Ca 0.00 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.80 1l3g h LYS 97 Cb 0.35 -0.12 -0.00 0.00 -1.00 0.00 0.00 32.23 31.46 1l3g h LYS 97 CO 0.00 0.34 -0.03 -1.35 -2.81 0.00 0.00 179.45 175.60 1l3g h PRO 98 N 0.53 0.06 -0.92 1.90 0.11 -1.85 -1.60 132.00 130.24 1l3g h PRO 98 Ca 0.42 -0.03 0.19 0.00 0.11 0.00 0.00 66.00 66.68 1l3g h PRO 98 Cb 0.58 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 31.58 1l3g h PRO 98 CO -0.36 0.55 0.48 1.25 -0.21 0.00 0.00 178.00 179.71 1l3g h LEU 99 N -0.42 0.55 -0.37 2.35 6.46 -1.59 4.53 115.31 126.82 1l3g h LEU 99 Ca 0.00 0.12 -0.18 0.00 -0.12 0.00 0.00 57.88 57.70 1l3g h LEU 99 Cb 0.54 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.49 1l3g h LEU 99 CO 0.01 0.15 -0.82 -0.26 -0.62 0.00 0.00 178.44 176.89 1l3g h PHE 100 N 0.58 0.16 0.01 1.25 -1.00 -1.05 -3.34 116.94 113.55 1l3g h PHE 100 Ca 0.54 -0.08 -0.25 0.00 2.81 0.00 0.00 57.97 60.99 1l3g h PHE 100 Cb 0.91 -0.02 -0.03 0.00 3.61 0.00 0.00 35.95 40.42 1l3g h PHE 100 CO -0.07 0.88 -1.37 -0.25 -1.61 0.00 0.00 178.31 175.88 1l3g n ASP 101 N -3.64 1.89 0.00 2.17 9.92 0.62 -4.98 116.55 122.52 1l3g n ASP 101 Ca -0.02 0.40 0.00 0.00 -0.53 0.00 0.00 54.79 54.64 1l3g n ASP 101 Cb 0.78 -0.95 0.00 0.00 -0.64 0.00 0.00 41.12 40.30 1l3g n ASP 101 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1l3g n PHE 102 N -4.34 0.00 -2.09 1.24 7.35 1.46 -4.31 117.46 116.77 1l3g n PHE 102 Ca -0.33 0.00 -0.39 0.00 -0.76 0.00 0.00 57.45 55.97 1l3g n PHE 102 Cb 0.72 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.53 1l3g n PHE 102 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1l3g n THR 103 N 0.00 3.10 -4.40 -2.13 -2.24 -1.26 -4.92 114.28 102.43 1l3g n THR 103 Ca 0.00 -3.06 -0.34 0.00 -2.27 0.00 0.00 64.05 58.39 1l3g n THR 103 Cb 0.00 -2.36 -0.12 0.00 -2.10 0.00 0.00 70.33 65.75 1l3g n THR 103 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1l3g s GLN 104 N 4.61 3.61 0.23 -0.78 -2.07 -1.26 -5.11 119.66 118.89 1l3g s GLN 104 Ca 0.56 -0.51 0.08 0.00 -1.82 0.00 0.00 55.36 53.67 1l3g s GLN 104 Cb 0.07 -2.90 -0.04 0.00 -1.09 0.00 0.00 33.01 29.04 1l3g s GLN 104 CO 0.06 0.29 0.06 0.95 -1.32 0.00 0.00 175.29 175.33 1l3g s THR 105 N 0.24 3.87 0.00 3.63 -4.23 -1.26 -4.88 115.64 113.01 1l3g s THR 105 Ca -0.02 -1.60 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 1l3g s THR 105 Cb -0.14 -3.04 0.00 0.00 1.34 0.00 0.00 72.50 70.66 1l3g s THR 105 CO 0.03 -0.29 0.18 0.47 -0.54 0.00 0.00 174.62 174.47 1l3g n ASP 106 N -0.76 0.00 0.00 3.99 9.92 -1.26 -4.18 116.55 124.26 1l3g n ASP 106 Ca -0.08 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.18 1l3g n ASP 106 Cb 0.57 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.05 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 -0.39 0.53 3.31 0.44 0.00 -1.26 -5.06 105.19 102.77 1l3g n GLY 107 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1l3g n GLY 107 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1l3g n SER 108 N 0.00 -2.27 -1.95 1.61 3.41 -1.26 -4.47 113.62 108.69 1l3g n SER 108 Ca 0.00 -0.15 -0.28 0.00 -0.26 0.00 0.00 58.87 58.18 1l3g n SER 108 Cb 0.00 -1.02 -0.05 0.00 -0.26 0.00 0.00 64.21 62.88 1l3g n SER 108 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1l3g n ALA 109 N -4.59 -0.22 -2.39 7.33 0.00 -1.26 -4.86 120.51 114.52 1l3g n ALA 109 Ca 0.01 0.14 -0.32 0.00 0.00 0.00 0.00 53.44 53.28 1l3g n ALA 109 Cb 0.61 -0.87 -0.14 0.00 0.00 0.00 0.00 19.45 19.04 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 2.01 3.53 1.34 0.00 1.04 -1.26 -5.12 113.70 115.23 1l3g s SER 110 Ca 0.49 -0.36 -0.21 0.00 0.48 0.00 0.00 55.95 56.35 1l3g s SER 110 Cb -0.65 -0.57 0.34 0.00 0.10 0.00 0.00 66.02 65.23 1l3g s SER 110 CO 0.32 0.32 1.00 -2.16 0.98 0.00 0.00 173.24 173.70 1l3g s PRO 111 N -0.77 -2.27 0.11 4.02 0.04 -1.26 -4.84 135.00 130.03 1l3g s PRO 111 Ca 0.11 0.09 -0.35 0.00 0.04 0.00 0.00 61.00 60.89 1l3g s PRO 111 Cb -0.10 -1.46 -0.17 0.00 0.04 0.00 0.00 34.50 32.80 1l3g s PRO 111 CO 0.00 -4.43 1.09 -2.30 0.04 0.00 0.00 177.00 171.40 1l3g n PRO 112 N -5.30 0.67 0.00 0.56 -0.02 -1.26 -4.94 135.00 124.70 1l3g n PRO 112 Ca 0.12 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1l3g n PRO 112 Cb 0.60 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 1l3g n PRO 112 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1l3g n PRO 113 N 1.74 0.00 -1.17 0.52 -0.04 -1.26 -4.79 135.00 129.99 1l3g n PRO 113 Ca 0.18 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.26 1l3g n PRO 113 Cb 0.19 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 33.67 1l3g n PRO 113 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1l3g n ALA 114 N -3.00 -3.65 -1.60 0.55 0.00 -0.92 -4.59 120.51 107.31 1l3g n ALA 114 Ca 0.00 -0.28 -0.47 0.00 0.00 0.00 0.00 53.44 52.69 1l3g n ALA 114 Cb 0.00 -1.38 -0.05 0.00 0.00 0.00 0.00 19.45 18.02 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 1.51 1.87 -2.00 0.00 -0.02 -1.26 -4.94 135.00 130.15 1l3g n PRO 115 Ca 0.05 0.61 -0.32 0.00 -2.02 0.00 0.00 63.50 61.82 1l3g n PRO 115 Cb 0.50 -2.77 0.01 0.00 -0.02 0.00 0.00 33.50 31.22 1l3g n PRO 115 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1l3g s LYS 116 N 5.26 3.40 0.03 -0.52 -2.85 -1.26 -5.06 119.74 118.74 1l3g s LYS 116 Ca 0.99 1.06 0.05 0.00 -1.00 0.00 0.00 55.97 57.07 1l3g s LYS 116 Cb -0.63 -2.05 -0.03 0.00 -2.06 0.00 0.00 37.83 33.06 1l3g s LYS 116 CO 0.46 -0.74 -0.11 -1.01 0.10 0.00 0.00 175.35 174.06 1l3g s HIS 117 N -2.68 2.76 0.38 1.78 3.76 -1.26 -5.11 115.29 114.92 1l3g s HIS 117 Ca 0.61 -0.12 -0.24 0.00 -0.15 0.00 0.00 55.06 55.15 1l3g s HIS 117 Cb -0.14 -1.54 -0.10 0.00 1.11 0.00 0.00 32.58 31.91 1l3g s HIS 117 CO 0.41 0.34 0.99 -3.38 -0.85 0.00 0.00 174.74 172.25 1l3g s HIS 118 N -1.00 3.42 -0.72 1.40 -3.43 -1.26 -4.98 115.29 108.72 1l3g s HIS 118 Ca 0.17 1.68 -0.22 0.00 -0.80 0.00 0.00 55.06 55.89 1l3g s HIS 118 Cb -0.11 -3.01 0.08 0.00 -1.43 0.00 0.00 32.58 28.12 1l3g s HIS 118 CO 0.08 -0.25 1.00 -1.58 -2.00 0.00 0.00 174.74 171.99 1l3g s HIS 119 N -1.74 2.76 0.59 0.38 2.46 -1.26 -5.02 115.29 113.45 1l3g s HIS 119 Ca 0.56 -0.72 -0.03 0.00 0.47 0.00 0.00 55.06 55.34 1l3g s HIS 119 Cb -0.18 -4.30 0.03 0.00 -0.13 0.00 0.00 32.58 28.00 1l3g s HIS 119 CO 0.23 -1.62 0.86 0.00 -2.47 0.00 0.00 174.74 171.74 1l3g s ALA 120 N 3.80 3.52 -0.86 1.58 0.00 -1.26 -5.02 121.76 123.52 1l3g s ALA 120 Ca 0.24 -1.03 -0.15 0.00 0.00 0.00 0.00 51.96 51.03 1l3g s ALA 120 Cb -0.14 -2.36 0.20 0.00 0.00 0.00 0.00 23.12 20.82 1l3g s ALA 120 CO 0.06 -0.88 0.86 -1.12 0.00 0.00 0.00 175.76 174.69 1l3g s SER 121 N -4.40 6.76 -0.39 0.00 0.01 -1.26 -5.00 113.70 109.43 1l3g s SER 121 Ca 0.56 -2.60 -0.10 0.00 1.31 0.00 0.00 55.95 55.12 1l3g s SER 121 Cb -0.10 -2.25 0.05 0.00 0.21 0.00 0.00 66.02 63.92 1l3g s SER 121 CO 0.42 -0.66 0.21 -0.75 0.41 0.00 0.00 173.24 172.87 1l3g s LYS 122 N 0.63 2.73 -0.43 12.44 2.36 -1.26 -5.05 119.74 131.16 1l3g s LYS 122 Ca 0.22 -1.22 -0.14 0.00 -2.55 0.00 0.00 55.97 52.27 1l3g s LYS 122 Cb -0.09 -3.72 0.05 0.00 -1.05 0.00 0.00 37.83 33.02 1l3g s LYS 122 CO -0.09 -0.79 0.33 0.54 1.55 0.00 0.00 175.35 176.89 1l3g s VAL 123 N 1.50 5.09 -2.00 4.02 0.11 -1.26 -5.32 120.40 122.54 1l3g s VAL 123 Ca 0.02 -0.91 0.13 0.00 -2.93 0.00 0.00 61.98 58.28 1l3g s VAL 123 Cb -0.21 -3.94 0.36 0.00 -1.53 0.00 0.00 36.38 31.06 1l3g s VAL 123 CO 0.05 -0.43 1.18 -0.90 -3.33 0.00 0.00 175.10 171.67