#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lgc s GLU 2 N 0.00 0.43 0.04 1.09 2.02 -1.26 -5.19 118.70 115.83 1lgc s GLU 2 Ca 0.00 0.55 -0.06 0.00 0.02 0.00 0.00 54.97 55.49 1lgc s GLU 2 Cb 0.00 0.19 -0.01 0.00 0.10 0.00 0.00 34.13 34.41 1lgc s GLU 2 CO 0.00 -0.06 0.10 0.99 0.02 0.00 0.00 175.26 176.31 1lgc s THR 3 N 0.43 0.13 -0.21 3.63 2.01 -1.26 -5.09 115.64 115.29 1lgc s THR 3 Ca 0.01 -1.08 -0.13 0.00 0.31 0.00 0.00 61.69 60.81 1lgc s THR 3 Cb -0.05 -0.88 0.06 0.00 0.01 0.00 0.00 72.50 71.65 1lgc s THR 3 CO -0.09 -0.59 0.51 -0.89 -0.69 0.00 0.00 174.62 172.87 1lgc s THR 4 N -2.57 -0.01 0.17 -0.82 2.01 -1.26 -5.03 115.64 108.12 1lgc s THR 4 Ca -0.05 0.05 -0.20 0.00 0.31 0.00 0.00 61.69 61.80 1lgc s THR 4 Cb -0.01 -0.74 0.05 0.00 0.01 0.00 0.00 72.50 71.80 1lgc s THR 4 CO -0.04 0.02 0.54 -0.44 -0.69 0.00 0.00 174.62 174.01 1lgc s SER 5 N 1.27 -0.40 -0.17 3.53 0.01 -1.26 -5.12 113.70 111.56 1lgc s SER 5 Ca -0.08 -0.23 -0.35 0.00 1.31 0.00 0.00 55.95 56.61 1lgc s SER 5 Cb -0.07 0.57 0.14 0.00 0.21 0.00 0.00 66.02 66.87 1lgc s SER 5 CO -0.12 -0.99 1.23 0.72 0.41 0.00 0.00 173.24 174.49 1lgc s PHE 6 N -3.80 -0.11 -0.15 2.43 -0.71 -1.26 -5.17 117.98 109.21 1lgc s PHE 6 Ca 0.04 0.05 -0.11 0.00 -1.04 0.00 0.00 56.93 55.87 1lgc s PHE 6 Cb -0.01 0.52 0.05 0.00 -1.21 0.00 0.00 43.02 42.37 1lgc s PHE 6 CO -0.09 -0.21 0.38 -1.54 -1.34 0.00 0.00 175.22 172.42 1lgc s SER 7 N -2.30 -0.43 -0.15 1.98 1.04 -1.26 -5.10 113.70 107.48 1lgc s SER 7 Ca 0.10 0.79 -0.02 0.00 0.48 0.00 0.00 55.95 57.31 1lgc s SER 7 Cb -0.00 0.74 0.05 0.00 0.10 0.00 0.00 66.02 66.91 1lgc s SER 7 CO -0.04 -0.16 0.01 -0.63 0.98 0.00 0.00 173.24 173.40 1lgc s ILE 8 N 0.75 0.58 -1.23 -1.02 1.01 -1.26 -5.01 121.20 115.01 1lgc s ILE 8 Ca -0.04 -0.33 0.14 0.00 0.00 0.00 0.00 60.65 60.41 1lgc s ILE 8 Cb -0.05 -0.90 -0.00 0.00 0.01 0.00 0.00 42.46 41.51 1lgc s ILE 8 CO -0.05 0.02 0.76 0.41 0.00 0.00 0.00 174.94 176.07 1lgc n THR 9 N 5.05 0.00 -3.32 2.92 -1.04 -1.26 -4.81 114.28 111.83 1lgc n THR 9 Ca -0.09 -0.36 -0.11 0.00 -2.04 0.00 0.00 64.05 61.45 1lgc n THR 9 Cb 0.48 1.16 -0.06 0.00 -1.82 0.00 0.00 70.33 70.09 1lgc n THR 9 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1lgc s LYS 10 N -1.67 0.53 -0.78 -2.82 -0.14 -1.26 -5.05 119.74 108.55 1lgc s LYS 10 Ca 0.11 -0.26 -0.25 0.00 -1.36 0.00 0.00 55.97 54.21 1lgc s LYS 10 Cb 0.11 -0.42 -0.08 0.00 -1.68 0.00 0.00 37.83 35.76 1lgc s LYS 10 CO 0.34 -1.11 2.14 -0.06 -0.76 0.00 0.00 175.35 175.91 1lgc s PHE 11 N 2.09 1.48 1.23 3.18 0.40 0.03 -4.94 117.98 121.45 1lgc s PHE 11 Ca 0.13 1.22 -0.16 0.00 -0.60 0.00 0.00 56.93 57.51 1lgc s PHE 11 Cb -0.12 -3.79 0.30 0.00 0.51 0.00 0.00 43.02 39.91 1lgc s PHE 11 CO -0.19 -1.85 1.01 0.20 0.70 0.00 0.00 175.22 175.09 1lgc s GLY 12 N 9.46 1.51 -0.03 4.36 0.00 -1.26 -3.62 107.32 117.73 1lgc s GLY 12 Ca 0.80 -0.42 -0.26 0.00 0.00 0.00 0.00 44.72 44.84 1lgc s GLY 12 CO 0.08 0.39 1.22 -2.55 0.00 0.00 0.00 173.10 172.24 1lgc h PRO 13 N -2.79 -0.00 -6.10 2.90 0.11 -1.93 -3.40 132.00 120.79 1lgc h PRO 13 Ca -0.56 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 64.96 1lgc h PRO 13 Cb 1.34 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.36 1lgc h PRO 13 CO 0.45 0.52 0.63 0.34 -0.21 0.00 0.00 178.00 179.73 1lgc s ASP 14 N -5.73 6.73 -0.46 -2.05 2.15 -1.26 -4.94 116.67 111.11 1lgc s ASP 14 Ca -0.16 0.68 0.06 0.00 0.43 0.00 0.00 52.55 53.56 1lgc s ASP 14 Cb 0.01 -2.47 0.21 0.00 -0.30 0.00 0.00 42.92 40.37 1lgc s ASP 14 CO 0.67 -0.84 0.61 1.67 -0.17 0.00 0.00 175.17 177.12 1lgc n GLN 15 N 6.74 0.53 0.00 4.34 -0.06 -1.26 -5.01 117.38 122.66 1lgc n GLN 15 Ca 0.08 -2.53 0.14 0.00 -2.00 0.00 0.00 57.00 52.69 1lgc n GLN 15 Cb 0.48 -1.47 0.73 0.00 -4.06 0.00 0.00 30.24 25.92 1lgc n GLN 15 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1lgc n PRO 16 N 2.31 0.43 -0.33 3.69 -0.04 -1.26 -3.45 135.00 136.35 1lgc n PRO 16 Ca 0.20 0.01 0.06 0.00 -0.04 0.00 0.00 63.50 63.73 1lgc n PRO 16 Cb 0.55 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.71 1lgc n PRO 16 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1lgc n ASN 17 N -1.28 2.83 -4.19 3.54 6.94 -1.26 -4.88 115.26 116.97 1lgc n ASN 17 Ca 0.14 -2.20 -0.15 0.00 -0.02 0.00 0.00 54.58 52.35 1lgc n ASN 17 Cb 0.23 -0.41 -0.11 0.00 -2.36 0.00 0.00 39.78 37.13 1lgc n ASN 17 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1lgc s LEU 18 N -1.22 2.41 -0.18 -4.53 1.02 -1.22 -2.00 118.68 112.95 1lgc s LEU 18 Ca 0.30 -0.82 0.01 0.00 0.02 0.00 0.00 54.13 53.64 1lgc s LEU 18 Cb 0.18 -0.34 0.02 0.00 0.02 0.00 0.00 46.19 46.08 1lgc s LEU 18 CO 0.15 -0.25 -0.19 -0.63 0.02 0.00 0.00 176.35 175.45 1lgc s ILE 19 N -2.44 2.08 -0.25 -0.59 1.01 0.37 -4.84 121.20 116.54 1lgc s ILE 19 Ca 0.06 -0.97 -0.11 0.00 0.00 0.00 0.00 60.65 59.63 1lgc s ILE 19 Cb -0.03 -1.89 -0.05 0.00 0.01 0.00 0.00 42.46 40.50 1lgc s ILE 19 CO 0.00 0.51 0.18 -0.36 0.00 0.00 0.00 174.94 175.27 1lgc s PHE 20 N 1.28 3.29 0.16 3.97 0.08 -1.26 -0.72 117.98 124.77 1lgc s PHE 20 Ca 0.04 0.21 0.11 0.00 0.12 0.00 0.00 56.93 57.41 1lgc s PHE 20 Cb -0.13 -2.32 -0.04 0.00 -0.57 0.00 0.00 43.02 39.96 1lgc s PHE 20 CO -0.13 -0.01 -0.25 -0.65 -0.10 0.00 0.00 175.22 174.08 1lgc s GLN 21 N 1.31 1.50 3.56 0.44 -0.21 -0.53 -4.94 119.66 120.78 1lgc s GLN 21 Ca 0.08 -1.40 0.00 0.00 0.02 0.00 0.00 55.36 54.06 1lgc s GLN 21 Cb -0.14 -1.90 0.00 0.00 1.00 0.00 0.00 33.01 31.96 1lgc s GLN 21 CO 0.07 0.43 0.00 0.41 -2.12 0.00 0.00 175.29 174.08 1lgc n GLY 22 N 0.62 0.49 0.39 3.09 0.00 -1.26 -1.66 105.19 106.87 1lgc n GLY 22 Ca -0.15 -0.80 0.02 0.00 0.00 0.00 0.00 46.02 45.08 1lgc n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lgc n ASP 23 N -1.65 1.03 -4.58 1.61 9.92 0.21 -4.85 116.55 118.24 1lgc n ASP 23 Ca 0.00 -2.05 -0.40 0.00 -0.53 0.00 0.00 54.79 51.81 1lgc n ASP 23 Cb 0.00 -0.24 -0.03 0.00 -0.64 0.00 0.00 41.12 40.22 1lgc n ASP 23 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1lgc s GLY 24 N -0.70 0.26 0.00 0.44 0.00 -1.09 -4.79 107.32 101.44 1lgc s GLY 24 Ca 0.08 0.20 0.00 0.00 0.00 0.00 0.00 44.72 45.01 1lgc s GLY 24 CO 0.04 3.70 0.00 1.58 0.00 0.00 0.00 173.10 178.43 1lgc n TYR 25 N 12.72 0.00 -3.62 1.90 4.11 0.07 -4.54 117.16 127.81 1lgc n TYR 25 Ca 0.28 0.00 -0.15 0.00 -0.00 0.00 0.00 57.90 58.03 1lgc n TYR 25 Cb 0.49 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.76 1lgc n TYR 25 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.86 176.78 1lgc s THR 26 N 2.66 0.00 -0.22 -3.48 -1.32 -1.26 -2.21 115.64 109.81 1lgc s THR 26 Ca 0.00 -0.04 -0.29 0.00 -1.21 0.00 0.00 61.69 60.15 1lgc s THR 26 Cb 0.00 -0.91 0.15 0.00 -1.51 0.00 0.00 72.50 70.23 1lgc s THR 26 CO 0.00 -0.02 1.16 -0.89 -2.21 0.00 0.00 174.62 172.66 1lgc s THR 27 N -0.31 0.00 -1.65 5.08 2.01 -0.52 -4.89 115.64 115.36 1lgc s THR 27 Ca -0.05 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.95 1lgc s THR 27 Cb -0.03 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.48 1lgc s THR 27 CO 0.04 0.00 0.00 1.17 -0.69 0.00 0.00 174.62 175.14 1lgc n LYS 28 N 0.81 -1.52 -1.54 4.92 4.81 -1.26 -0.71 118.16 123.67 1lgc n LYS 28 Ca -0.07 0.94 -0.19 0.00 -0.87 0.00 0.00 58.31 58.12 1lgc n LYS 28 Cb 0.58 -5.49 -0.08 0.00 0.02 0.00 0.00 35.03 30.06 1lgc n LYS 28 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1lgc n GLU 29 N -2.82 -1.39 -5.15 1.64 1.02 -1.24 -4.95 120.64 107.75 1lgc n GLU 29 Ca -0.23 1.15 -0.32 0.00 -0.02 0.00 0.00 57.16 57.75 1lgc n GLU 29 Cb 0.67 -5.49 -0.16 0.00 -0.02 0.00 0.00 31.44 26.45 1lgc n GLU 29 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1lgc s ARG 30 N -3.57 2.68 -0.40 3.49 0.52 0.11 -0.79 118.95 120.99 1lgc s ARG 30 Ca 0.00 -0.85 -0.28 0.00 -0.52 0.00 0.00 55.73 54.08 1lgc s ARG 30 Cb 0.00 -2.26 0.02 0.00 0.52 0.00 0.00 34.95 33.23 1lgc s ARG 30 CO 0.00 0.38 1.05 -1.17 0.02 0.00 0.00 175.30 175.58 1lgc s LEU 31 N -0.14 3.84 -0.40 2.53 2.96 -1.26 -1.44 118.68 124.77 1lgc s LEU 31 Ca -0.03 0.64 -0.19 0.00 -0.22 0.00 0.00 54.13 54.32 1lgc s LEU 31 Cb -0.14 -3.45 0.01 0.00 0.50 0.00 0.00 46.19 43.11 1lgc s LEU 31 CO 0.04 -1.03 0.56 0.42 -1.32 0.00 0.00 176.35 175.01 1lgc s THR 32 N 3.93 4.95 -0.06 3.68 -4.23 -0.94 -4.89 115.64 118.08 1lgc s THR 32 Ca 0.44 0.15 0.14 0.00 -1.18 0.00 0.00 61.69 61.24 1lgc s THR 32 Cb -0.10 -4.08 -0.17 0.00 1.34 0.00 0.00 72.50 69.49 1lgc s THR 32 CO 0.23 -0.41 0.84 -0.07 -0.54 0.00 0.00 174.62 174.68 1lgc h LEU 33 N 9.34 0.00 -7.00 4.79 3.38 -1.89 0.24 115.31 124.17 1lgc h LEU 33 Ca -0.27 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.75 1lgc h LEU 33 Cb 1.11 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.62 1lgc h LEU 33 CO 0.83 0.82 0.30 -0.89 0.09 0.00 0.00 178.44 179.59 1lgc s THR 34 N -2.75 0.00 -0.10 0.22 2.01 -1.26 -2.45 115.64 111.30 1lgc s THR 34 Ca -0.03 0.00 -0.09 0.00 0.31 0.00 0.00 61.69 61.88 1lgc s THR 34 Cb 0.08 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 1lgc s THR 34 CO 0.81 0.00 0.20 -0.54 -0.69 0.00 0.00 174.62 174.40 1lgc s LYS 35 N 0.68 3.61 -0.31 4.92 -0.14 -1.26 -4.94 119.74 122.30 1lgc s LYS 35 Ca -0.02 -0.02 -0.07 0.00 -1.36 0.00 0.00 55.97 54.50 1lgc s LYS 35 Cb -0.05 -3.22 -0.07 0.00 -1.68 0.00 0.00 37.83 32.81 1lgc s LYS 35 CO -0.08 0.71 1.33 0.00 -0.76 0.00 0.00 175.35 176.55 1lgc n ALA 36 N 2.11 0.47 -2.42 5.17 0.00 -1.26 -4.76 120.51 119.81 1lgc n ALA 36 Ca -0.18 -1.26 -0.09 0.00 0.00 0.00 0.00 53.44 51.92 1lgc n ALA 36 Cb 0.54 -1.27 -0.08 0.00 0.00 0.00 0.00 19.45 18.64 1lgc n ALA 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1lgc s VAL 37 N 3.97 0.14 1.00 0.00 1.01 -1.26 -5.10 120.40 120.16 1lgc s VAL 37 Ca 0.27 -1.48 -0.12 0.00 0.00 0.00 0.00 61.98 60.65 1lgc s VAL 37 Cb -0.07 -1.60 0.19 0.00 0.00 0.00 0.00 36.38 34.91 1lgc s VAL 37 CO 0.08 -0.62 1.09 -0.13 0.00 0.00 0.00 175.10 175.51 1lgc s ARG 38 N -3.93 0.41 0.00 2.72 1.81 -1.26 -4.32 118.95 114.38 1lgc s ARG 38 Ca 0.11 0.58 0.00 0.00 -1.72 0.00 0.00 55.73 54.70 1lgc s ARG 38 Cb 0.06 -1.73 0.00 0.00 -0.45 0.00 0.00 34.95 32.83 1lgc s ARG 38 CO -0.06 -2.76 0.00 -1.71 -0.68 0.00 0.00 175.30 170.09 1lgc n ASN 39 N -4.21 0.00 -4.99 0.23 5.15 -1.26 -4.88 115.26 105.30 1lgc n ASN 39 Ca 0.05 0.00 -0.19 0.00 -0.60 0.00 0.00 54.58 53.84 1lgc n ASN 39 Cb 0.57 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.82 1lgc n ASN 39 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1lgc s THR 40 N -1.32 3.92 -0.10 -0.44 -4.23 -1.26 -5.03 115.64 107.19 1lgc s THR 40 Ca 0.00 -0.92 -0.04 0.00 -1.18 0.00 0.00 61.69 59.55 1lgc s THR 40 Cb 0.00 -3.37 0.05 0.00 1.34 0.00 0.00 72.50 70.52 1lgc s THR 40 CO 0.00 -0.16 0.21 -0.69 -0.54 0.00 0.00 174.62 173.43 1lgc s VAL 41 N -2.26 -0.16 -0.03 2.29 1.01 -1.26 -4.86 120.40 115.13 1lgc s VAL 41 Ca 0.47 0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.70 1lgc s VAL 41 Cb -0.10 -0.34 0.00 0.00 0.00 0.00 0.00 36.38 35.95 1lgc s VAL 41 CO 0.32 0.09 -0.09 -0.83 0.00 0.00 0.00 175.10 174.60 1lgc s GLY 42 N 1.68 0.54 0.05 4.51 0.00 -1.03 0.67 107.32 113.76 1lgc s GLY 42 Ca -0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 44.72 44.33 1lgc s GLY 42 CO -0.07 -0.06 -0.00 0.50 0.00 0.00 0.00 173.10 173.46 1lgc s ARG 43 N 0.23 0.63 -0.27 2.90 0.52 -0.66 -4.82 118.95 117.49 1lgc s ARG 43 Ca -0.04 -1.17 -0.15 0.00 -0.52 0.00 0.00 55.73 53.85 1lgc s ARG 43 Cb -0.09 0.23 0.08 0.00 0.52 0.00 0.00 34.95 35.69 1lgc s ARG 43 CO 0.01 -0.13 0.65 0.00 0.02 0.00 0.00 175.30 175.85 1lgc s ALA 44 N -3.86 -1.78 0.14 2.13 0.00 -1.25 -1.45 121.76 115.69 1lgc s ALA 44 Ca 0.06 2.30 0.09 0.00 0.00 0.00 0.00 51.96 54.42 1lgc s ALA 44 Cb 0.07 -1.39 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 1lgc s ALA 44 CO -0.10 -0.40 -0.22 -0.51 0.00 0.00 0.00 175.76 174.53 1lgc s LEU 45 N 1.69 2.37 0.30 0.00 1.43 0.10 -4.90 118.68 119.67 1lgc s LEU 45 Ca -0.10 -0.78 -0.29 0.00 -1.03 0.00 0.00 54.13 51.93 1lgc s LEU 45 Cb -0.06 -0.98 -0.10 0.00 0.03 0.00 0.00 46.19 45.08 1lgc s LEU 45 CO -0.19 0.06 1.29 -0.47 0.23 0.00 0.00 176.35 177.27 1lgc s TYR 46 N -1.50 3.15 0.06 0.29 5.04 -1.26 -0.48 117.35 122.65 1lgc s TYR 46 Ca 0.13 1.40 -0.25 0.00 -2.44 0.00 0.00 57.07 55.91 1lgc s TYR 46 Cb -0.08 -3.63 -0.12 0.00 0.35 0.00 0.00 41.96 38.48 1lgc s TYR 46 CO 0.06 -1.74 1.39 1.03 -1.34 0.00 0.00 175.55 174.96 1lgc h SER 47 N 3.83 -0.99 -3.09 4.32 0.87 -1.73 -3.44 113.55 113.32 1lgc h SER 47 Ca -0.48 0.08 -0.53 0.00 -1.23 0.00 0.00 61.79 59.63 1lgc h SER 47 Cb 1.22 0.33 0.04 0.00 -0.44 0.00 0.00 62.40 63.54 1lgc h SER 47 CO 0.68 -0.48 0.76 -0.44 -0.53 0.00 0.00 176.83 176.82 1lgc s SER 48 N -3.73 6.74 0.06 6.23 0.01 -1.26 -4.98 113.70 116.77 1lgc s SER 48 Ca -0.13 2.48 -0.31 0.00 1.31 0.00 0.00 55.95 59.31 1lgc s SER 48 Cb 0.03 -2.60 -0.06 0.00 0.21 0.00 0.00 66.02 63.60 1lgc s SER 48 CO 0.42 -0.69 1.23 -2.16 0.41 0.00 0.00 173.24 172.46 1lgc s PRO 49 N 0.62 4.41 0.21 12.44 0.04 -1.26 -5.00 135.00 146.45 1lgc s PRO 49 Ca 0.64 1.81 -0.14 0.00 0.04 0.00 0.00 61.00 63.35 1lgc s PRO 49 Cb -0.40 -3.36 -0.08 0.00 0.04 0.00 0.00 34.50 30.71 1lgc s PRO 49 CO 0.34 -0.30 0.61 0.96 0.04 0.00 0.00 177.00 178.65 1lgc s ILE 50 N 1.19 4.81 -0.79 0.56 -4.36 -1.26 -5.02 121.20 116.33 1lgc s ILE 50 Ca 0.59 0.82 -0.21 0.00 -0.26 0.00 0.00 60.65 61.59 1lgc s ILE 50 Cb -0.30 -3.70 0.09 0.00 1.25 0.00 0.00 42.46 39.80 1lgc s ILE 50 CO 0.29 0.08 1.06 -2.28 0.24 0.00 0.00 174.94 174.32 1lgc s HIS 51 N -1.66 2.84 0.11 1.37 5.65 -1.26 -4.89 115.29 117.45 1lgc s HIS 51 Ca 0.44 -0.90 -0.05 0.00 0.25 0.00 0.00 55.06 54.80 1lgc s HIS 51 Cb -0.13 -4.31 -0.15 0.00 -1.18 0.00 0.00 32.58 26.80 1lgc s HIS 51 CO 0.20 -1.60 1.25 0.97 -0.65 0.00 0.00 174.74 174.90 1lgc h ILE 52 N 5.97 1.42 -2.95 0.89 6.09 -1.97 -3.46 117.51 123.49 1lgc h ILE 52 Ca -0.09 -2.60 -0.12 0.00 -1.37 0.00 0.00 64.86 60.68 1lgc h ILE 52 Cb 1.05 2.57 -0.21 0.00 0.47 0.00 0.00 36.82 40.70 1lgc h ILE 52 CO 1.17 0.77 -0.27 -1.66 -3.07 0.00 0.00 178.15 175.09 1lgc s TRP 53 N -3.09 -0.26 -0.31 2.19 1.48 -1.26 -0.41 118.94 117.28 1lgc s TRP 53 Ca -0.06 0.50 -0.11 0.00 -1.06 0.00 0.00 56.10 55.37 1lgc s TRP 53 Cb 0.08 0.12 -0.03 0.00 -1.16 0.00 0.00 33.47 32.48 1lgc s TRP 53 CO 0.88 -0.34 0.19 0.34 -4.06 0.00 0.00 176.95 173.96 1lgc s ASP 54 N -0.87 5.87 0.01 -2.66 -1.08 -1.13 -5.00 116.67 111.81 1lgc s ASP 54 Ca -0.09 -0.30 -0.25 0.00 -0.52 0.00 0.00 52.55 51.38 1lgc s ASP 54 Cb -0.04 -2.09 -0.14 0.00 -1.46 0.00 0.00 42.92 39.19 1lgc s ASP 54 CO 0.03 -0.16 1.09 0.77 0.52 0.00 0.00 175.17 177.43 1lgc h SER 55 N 8.41 -0.75 -1.62 -0.34 4.64 -1.93 -0.58 113.55 121.37 1lgc h SER 55 Ca -0.33 0.03 0.48 0.00 -0.47 0.00 0.00 61.79 61.50 1lgc h SER 55 Cb 1.17 0.20 -0.08 0.00 -0.31 0.00 0.00 62.40 63.37 1lgc h SER 55 CO 0.60 -0.41 1.14 0.11 -0.87 0.00 0.00 176.83 177.39 1lgc h LYS 56 N -1.14 0.03 -0.08 4.77 1.79 -1.97 0.42 116.57 120.38 1lgc h LYS 56 Ca -0.09 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1lgc h LYS 56 Cb 0.68 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1lgc h LYS 56 CO 0.15 0.02 0.00 2.41 -1.08 0.00 0.00 179.45 180.95 1lgc n THR 57 N -4.20 1.17 -0.41 -0.16 -1.04 -1.22 -5.00 114.28 103.43 1lgc n THR 57 Ca 0.38 -1.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.19 1lgc n THR 57 Cb 1.68 0.37 0.00 0.00 -1.82 0.00 0.00 70.33 70.56 1lgc n THR 57 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1lgc n GLY 58 N -0.43 0.00 3.61 3.41 0.00 0.15 -4.92 105.19 107.01 1lgc n GLY 58 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1lgc n GLY 58 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lgc s ASN 59 N -1.12 1.00 0.04 1.61 -0.87 -1.10 -4.89 114.94 109.60 1lgc s ASN 59 Ca 0.00 0.58 -0.02 0.00 -1.57 0.00 0.00 52.86 51.85 1lgc s ASN 59 Cb 0.00 -0.79 -0.02 0.00 -0.02 0.00 0.00 41.25 40.42 1lgc s ASN 59 CO 0.00 -4.07 0.01 -0.69 -2.57 0.00 0.00 177.10 169.78 1lgc s VAL 60 N -3.07 0.16 -0.07 1.60 1.01 -1.26 -2.84 120.40 115.93 1lgc s VAL 60 Ca 0.71 -1.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.22 1lgc s VAL 60 Cb -0.09 -0.98 -0.05 0.00 0.00 0.00 0.00 36.38 35.26 1lgc s VAL 60 CO 0.56 -0.74 0.34 0.00 0.00 0.00 0.00 175.10 175.26 1lgc s ALA 61 N -2.85 3.69 0.58 5.51 0.00 0.46 -4.69 121.76 124.45 1lgc s ALA 61 Ca -0.03 -0.34 -0.09 0.00 0.00 0.00 0.00 51.96 51.50 1lgc s ALA 61 Cb 0.00 -2.34 -0.03 0.00 0.00 0.00 0.00 23.12 20.75 1lgc s ALA 61 CO -0.06 0.37 0.95 -0.80 0.00 0.00 0.00 175.76 176.23 1lgc s ASN 62 N -0.57 6.13 -0.01 0.00 0.01 -1.26 -4.31 114.94 114.92 1lgc s ASN 62 Ca 0.21 1.20 -0.28 0.00 -0.71 0.00 0.00 52.86 53.27 1lgc s ASN 62 Cb -0.15 -2.30 0.10 0.00 0.41 0.00 0.00 41.25 39.31 1lgc s ASN 62 CO 0.09 -0.84 0.86 0.72 -1.51 0.00 0.00 177.10 176.43 1lgc s PHE 63 N -3.05 -0.39 -0.13 2.20 -0.12 -0.99 -4.96 117.98 110.54 1lgc s PHE 63 Ca 0.53 0.34 -0.14 0.00 -0.05 0.00 0.00 56.93 57.60 1lgc s PHE 63 Cb -0.11 0.52 0.04 0.00 -0.63 0.00 0.00 43.02 42.84 1lgc s PHE 63 CO 0.50 -0.55 0.39 0.54 -0.05 0.00 0.00 175.22 176.05 1lgc s VAL 64 N -2.80 0.01 0.09 -2.49 0.11 -1.26 -0.10 120.40 113.96 1lgc s VAL 64 Ca 0.03 -0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 59.02 1lgc s VAL 64 Cb -0.01 -0.57 -0.04 0.00 -1.53 0.00 0.00 36.38 34.23 1lgc s VAL 64 CO -0.07 -0.02 0.02 0.28 -3.33 0.00 0.00 175.10 171.97 1lgc s THR 65 N 0.05 0.16 -0.06 5.04 -1.32 -1.00 -5.02 115.64 113.50 1lgc s THR 65 Ca -0.01 -1.87 -0.28 0.00 -1.21 0.00 0.00 61.69 58.32 1lgc s THR 65 Cb -0.03 -1.81 0.06 0.00 -1.51 0.00 0.00 72.50 69.21 1lgc s THR 65 CO 0.01 -0.71 0.63 -0.94 -2.21 0.00 0.00 174.62 171.40 1lgc s SER 66 N -2.99 -0.60 -0.03 8.08 1.04 -1.26 -1.79 113.70 116.15 1lgc s SER 66 Ca 0.16 0.67 -0.29 0.00 0.48 0.00 0.00 55.95 56.98 1lgc s SER 66 Cb 0.08 0.56 0.10 0.00 0.10 0.00 0.00 66.02 66.85 1lgc s SER 66 CO -0.03 -0.57 0.84 0.72 0.98 0.00 0.00 173.24 175.18 1lgc s PHE 67 N -1.12 -0.43 -0.11 5.02 -0.71 -0.74 -4.99 117.98 114.90 1lgc s PHE 67 Ca -0.11 0.49 0.02 0.00 -1.04 0.00 0.00 56.93 56.30 1lgc s PHE 67 Cb -0.01 0.50 -0.01 0.00 -1.21 0.00 0.00 43.02 42.28 1lgc s PHE 67 CO 0.09 -0.54 -0.17 -0.08 -1.34 0.00 0.00 175.22 173.17 1lgc s THR 68 N -2.35 2.70 0.24 -4.49 -1.32 -1.26 -0.20 115.64 108.96 1lgc s THR 68 Ca -0.00 -0.80 0.01 0.00 -1.21 0.00 0.00 61.69 59.69 1lgc s THR 68 Cb -0.01 -2.09 -0.05 0.00 -1.51 0.00 0.00 72.50 68.84 1lgc s THR 68 CO -0.04 0.55 0.08 0.72 -2.21 0.00 0.00 174.62 173.72 1lgc s PHE 69 N 0.17 1.46 -0.04 9.09 -0.71 -1.03 -4.90 117.98 122.02 1lgc s PHE 69 Ca -0.10 -1.16 -0.01 0.00 -1.04 0.00 0.00 56.93 54.62 1lgc s PHE 69 Cb -0.16 -0.85 0.03 0.00 -1.21 0.00 0.00 43.02 40.84 1lgc s PHE 69 CO 0.06 -0.33 0.07 0.08 -1.34 0.00 0.00 175.22 173.76 1lgc s VAL 70 N -3.76 -0.05 -0.61 -2.49 1.01 -1.26 -0.72 120.40 112.51 1lgc s VAL 70 Ca 0.36 0.19 -0.00 0.00 0.00 0.00 0.00 61.98 62.52 1lgc s VAL 70 Cb 0.07 -0.14 0.15 0.00 0.00 0.00 0.00 36.38 36.47 1lgc s VAL 70 CO 0.12 0.08 0.40 -0.63 0.00 0.00 0.00 175.10 175.07 1lgc s ILE 71 N 1.04 3.35 -0.84 2.22 1.01 -1.26 -5.01 121.20 121.71 1lgc s ILE 71 Ca -0.08 -3.18 -0.23 0.00 0.00 0.00 0.00 60.65 57.15 1lgc s ILE 71 Cb -0.12 -3.21 0.06 0.00 0.01 0.00 0.00 42.46 39.20 1lgc s ILE 71 CO -0.04 -0.87 1.23 -0.62 0.00 0.00 0.00 174.94 174.64 1lgc s ASP 72 N 0.23 6.35 -0.14 3.58 -1.08 -1.26 -2.49 116.67 121.87 1lgc s ASP 72 Ca 0.18 -1.17 -0.12 0.00 -0.52 0.00 0.00 52.55 50.92 1lgc s ASP 72 Cb -0.21 -2.50 -0.05 0.00 -1.46 0.00 0.00 42.92 38.70 1lgc s ASP 72 CO -0.03 -1.50 0.24 0.00 0.52 0.00 0.00 175.17 174.40 1lgc s ALA 73 N 4.55 3.69 -0.84 3.66 0.00 -1.26 -4.81 121.76 126.74 1lgc s ALA 73 Ca 0.35 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.79 1lgc s ALA 73 Cb -0.07 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.80 1lgc s ALA 73 CO 0.02 0.28 0.25 -0.35 0.00 0.00 0.00 175.76 175.96 1lgc n PRO 74 N 2.97 0.44 0.00 0.00 -0.04 -1.26 -4.48 135.00 132.63 1lgc n PRO 74 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 1lgc n PRO 74 Cb 0.53 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 1lgc n PRO 74 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1lgc n ASN 75 N 0.36 0.00 0.28 3.54 0.23 -1.26 -5.02 115.26 113.39 1lgc n ASN 75 Ca 0.00 0.00 0.19 0.00 -0.53 0.00 0.00 54.58 54.24 1lgc n ASN 75 Cb 0.13 0.00 0.88 0.00 -2.08 0.00 0.00 39.78 38.70 1lgc n ASN 75 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1lgc h SER 76 N 0.00 0.00 0.00 0.53 0.02 -1.99 -3.36 113.55 108.75 1lgc h SER 76 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1lgc h SER 76 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1lgc h SER 76 CO 0.00 0.00 0.00 -1.22 -1.14 0.00 0.00 176.83 174.47 1lgc n TYR 77 N -2.96 0.00 0.46 3.45 4.01 -1.26 -4.43 117.16 116.43 1lgc n TYR 77 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1lgc n TYR 77 Cb 0.19 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 1lgc n TYR 77 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1lgc n ASN 78 N -1.01 2.25 -4.77 7.72 4.13 -1.26 -4.94 115.26 117.39 1lgc n ASN 78 Ca 0.00 -1.42 -0.40 0.00 1.68 0.00 0.00 54.58 54.44 1lgc n ASN 78 Cb 0.00 -0.41 0.01 0.00 -1.54 0.00 0.00 39.78 37.84 1lgc n ASN 78 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1lgc s VAL 79 N 0.42 2.29 -0.15 2.41 1.01 -1.26 -5.02 120.40 120.09 1lgc s VAL 79 Ca 0.00 0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 1lgc s VAL 79 Cb 0.00 -3.16 0.11 0.00 0.00 0.00 0.00 36.38 33.33 1lgc s VAL 79 CO 0.00 0.04 0.92 0.00 0.00 0.00 0.00 175.10 176.06 1lgc s ALA 80 N -1.21 -1.89 0.00 5.51 0.00 -1.26 -4.37 121.76 118.53 1lgc s ALA 80 Ca 0.58 1.58 0.00 0.00 0.00 0.00 0.00 51.96 54.12 1lgc s ALA 80 Cb -0.42 -0.65 0.00 0.00 0.00 0.00 0.00 23.12 22.05 1lgc s ALA 80 CO 0.54 -0.31 0.00 -3.47 0.00 0.00 0.00 175.76 172.52 1lgc n ASP 81 N 1.03 3.69 0.00 0.00 -0.08 -1.26 -5.05 116.55 114.88 1lgc n ASP 81 Ca -0.13 -0.06 0.00 0.00 -1.51 0.00 0.00 54.79 53.09 1lgc n ASP 81 Cb 0.57 0.86 0.00 0.00 2.34 0.00 0.00 41.12 44.89 1lgc n ASP 81 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1lgc n GLY 82 N 1.97 3.87 3.56 0.27 0.00 -1.26 -2.15 105.19 111.45 1lgc n GLY 82 Ca 0.00 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 1lgc n GLY 82 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1lgc s PHE 83 N -2.00 2.68 0.03 1.61 5.36 -1.04 -4.92 117.98 119.70 1lgc s PHE 83 Ca 0.00 -0.19 -0.03 0.00 -0.96 0.00 0.00 56.93 55.75 1lgc s PHE 83 Cb 0.00 -1.39 -0.02 0.00 -0.34 0.00 0.00 43.02 41.27 1lgc s PHE 83 CO 0.00 0.43 0.04 0.99 -1.46 0.00 0.00 175.22 175.22 1lgc s THR 84 N -1.27 0.14 -0.10 0.12 2.01 -1.26 -0.85 115.64 114.44 1lgc s THR 84 Ca 0.21 -1.18 0.01 0.00 0.31 0.00 0.00 61.69 61.04 1lgc s THR 84 Cb -0.11 -0.84 0.02 0.00 0.01 0.00 0.00 72.50 71.58 1lgc s THR 84 CO 0.13 -0.65 -0.13 0.12 -0.69 0.00 0.00 174.62 173.40 1lgc s PHE 85 N -2.54 1.75 0.23 4.92 5.36 -0.89 -4.99 117.98 121.82 1lgc s PHE 85 Ca -0.06 -0.80 0.01 0.00 -0.96 0.00 0.00 56.93 55.13 1lgc s PHE 85 Cb -0.02 -1.30 -0.05 0.00 -0.34 0.00 0.00 43.02 41.31 1lgc s PHE 85 CO -0.05 -0.44 0.08 -0.59 -1.46 0.00 0.00 175.22 172.77 1lgc s PHE 86 N 1.05 1.42 -0.01 10.12 -0.71 -1.26 -0.45 117.98 128.13 1lgc s PHE 86 Ca -0.06 -1.16 0.06 0.00 -1.04 0.00 0.00 56.93 54.72 1lgc s PHE 86 Cb -0.15 -0.82 -0.02 0.00 -1.21 0.00 0.00 43.02 40.83 1lgc s PHE 86 CO -0.02 -0.34 -0.19 0.42 -1.34 0.00 0.00 175.22 173.76 1lgc s ILE 87 N -3.77 1.52 0.18 -4.49 1.01 0.05 -5.00 121.20 110.70 1lgc s ILE 87 Ca 0.35 -0.84 -0.24 0.00 0.00 0.00 0.00 60.65 59.92 1lgc s ILE 87 Cb 0.07 -1.27 0.06 0.00 0.01 0.00 0.00 42.46 41.34 1lgc s ILE 87 CO 0.11 0.42 0.95 0.00 0.00 0.00 0.00 174.94 176.42 1lgc s ALA 88 N -0.47 -1.57 0.77 9.38 0.00 -1.26 -2.74 121.76 125.87 1lgc s ALA 88 Ca 0.07 -0.01 -0.11 0.00 0.00 0.00 0.00 51.96 51.91 1lgc s ALA 88 Cb -0.07 0.67 0.06 0.00 0.00 0.00 0.00 23.12 23.78 1lgc s ALA 88 CO -0.01 -1.05 1.10 -1.25 0.00 0.00 0.00 175.76 174.56 1lgc s PRO 89 N -3.14 2.21 0.34 0.00 0.04 -1.26 -4.91 135.00 128.29 1lgc s PRO 89 Ca 0.14 1.25 0.11 0.00 0.04 0.00 0.00 61.00 62.54 1lgc s PRO 89 Cb -0.02 -1.89 0.90 0.00 0.04 0.00 0.00 34.50 33.54 1lgc s PRO 89 CO 0.03 -1.69 1.77 0.28 0.04 0.00 0.00 177.00 177.43 1lgc h VAL 90 N -1.02 0.61 -0.07 -0.36 2.07 -2.00 -0.89 116.25 114.58 1lgc h VAL 90 Ca -0.44 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1lgc h VAL 90 Cb 1.24 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1lgc h VAL 90 CO 0.51 0.11 0.02 -0.90 0.02 0.00 0.00 177.57 177.32 1lgc n ASP 91 N -4.74 1.90 -4.59 0.57 5.68 -1.26 -4.88 116.55 109.21 1lgc n ASP 91 Ca 0.25 -2.11 -0.42 0.00 -0.50 0.00 0.00 54.79 52.00 1lgc n ASP 91 Cb 0.71 -0.52 -0.03 0.00 -1.14 0.00 0.00 41.12 40.14 1lgc n ASP 91 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1lgc s THR 92 N -0.96 3.45 0.42 2.12 -1.32 -0.34 -4.99 115.64 114.01 1lgc s THR 92 Ca 0.06 0.44 0.08 0.00 -1.21 0.00 0.00 61.69 61.06 1lgc s THR 92 Cb 0.04 -3.64 -0.01 0.00 -1.51 0.00 0.00 72.50 67.39 1lgc s THR 92 CO 0.02 -0.43 0.47 -1.59 -2.21 0.00 0.00 174.62 170.87 1lgc s LYS 93 N 5.81 2.68 0.97 7.08 -2.85 -1.26 -5.07 119.74 127.10 1lgc s LYS 93 Ca 0.80 -1.39 -0.11 0.00 -1.00 0.00 0.00 55.97 54.27 1lgc s LYS 93 Cb -0.22 -2.56 0.16 0.00 -2.06 0.00 0.00 37.83 33.15 1lgc s LYS 93 CO 0.33 -0.22 1.04 -2.30 0.10 0.00 0.00 175.35 174.29 1lgc n PRO 94 N -1.69 -0.79 0.00 1.78 -0.02 -1.26 -5.04 135.00 127.98 1lgc n PRO 94 Ca 0.06 -0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1lgc n PRO 94 Cb 0.60 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1lgc n PRO 94 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1lgc n GLN 95 N -4.10 2.83 -1.88 -0.52 1.13 -0.46 -5.05 117.38 109.34 1lgc n GLN 95 Ca 0.10 0.00 -0.39 0.00 -1.94 0.00 0.00 57.00 54.77 1lgc n GLN 95 Cb 0.53 0.00 0.02 0.00 0.11 0.00 0.00 30.24 30.90 1lgc n GLN 95 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1lgc s THR 96 N 0.84 2.26 0.00 5.09 2.01 -1.20 -4.68 115.64 119.95 1lgc s THR 96 Ca 0.00 0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.21 1lgc s THR 96 Cb 0.00 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.40 1lgc s THR 96 CO 0.00 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.55 1lgc n GLY 97 N 0.64 1.34 7.00 4.40 0.00 -1.26 -1.03 105.19 116.28 1lgc n GLY 97 Ca 0.07 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1lgc n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lgc n GLY 98 N 5.00 2.68 0.23 -0.02 0.00 -1.26 -0.71 105.19 111.11 1lgc n GLY 98 Ca 0.00 -0.17 0.16 0.00 0.00 0.00 0.00 46.02 46.01 1lgc n GLY 98 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1lgc h GLY 99 N 0.00 0.00 1.09 -0.02 0.00 -1.92 -2.41 103.07 99.81 1lgc h GLY 99 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1lgc h GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 1lgc n TYR 100 N -2.64 0.00 -3.08 5.60 4.02 0.11 -4.88 117.16 116.30 1lgc n TYR 100 Ca -0.01 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.69 1lgc n TYR 100 Cb 0.12 -0.05 -0.00 0.00 -0.02 0.00 0.00 39.34 39.39 1lgc n TYR 100 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1lgc n LEU 101 N -1.05 -1.40 0.00 7.72 4.77 -0.91 -1.28 117.00 124.86 1lgc n LEU 101 Ca 0.17 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1lgc n LEU 101 Cb 0.10 -2.09 0.00 0.00 -2.33 0.00 0.00 43.42 39.10 1lgc n LEU 101 CO 0.15 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 1lgc n GLY 102 N -1.06 0.00 0.08 -0.72 0.00 -0.19 -4.71 105.19 98.59 1lgc n GLY 102 Ca -0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.90 1lgc n GLY 102 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1lgc n VAL 103 N -1.83 1.08 -4.58 1.61 0.31 -0.40 -1.36 118.33 113.15 1lgc n VAL 103 Ca 0.00 -0.68 -0.27 0.00 -0.01 0.00 0.00 64.34 63.38 1lgc n VAL 103 Cb 0.04 -0.53 -0.11 0.00 -0.91 0.00 0.00 33.84 32.33 1lgc n VAL 103 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1lgc s PHE 104 N -2.44 2.42 -0.06 3.52 0.08 -0.96 -4.82 117.98 115.71 1lgc s PHE 104 Ca -0.08 -0.69 0.06 0.00 0.12 0.00 0.00 56.93 56.34 1lgc s PHE 104 Cb 0.05 -1.65 -0.09 0.00 -0.57 0.00 0.00 43.02 40.77 1lgc s PHE 104 CO 0.68 0.40 0.03 0.09 -0.10 0.00 0.00 175.22 176.32 1lgc n ASN 105 N -0.90 3.34 -3.45 1.36 3.02 -1.26 -3.25 115.26 114.12 1lgc n ASN 105 Ca -0.05 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.39 1lgc n ASN 105 Cb 0.66 0.72 -0.03 0.00 -0.61 0.00 0.00 39.78 40.53 1lgc n ASN 105 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1lgc s SER 106 N -3.74 0.31 0.00 6.41 1.04 -1.26 -5.00 113.70 111.45 1lgc s SER 106 Ca -0.03 -1.18 0.26 0.00 0.48 0.00 0.00 55.95 55.48 1lgc s SER 106 Cb 0.02 0.69 0.64 0.00 0.10 0.00 0.00 66.02 67.46 1lgc s SER 106 CO 0.28 -1.34 1.49 2.29 0.98 0.00 0.00 173.24 176.94 1lgc n LYS 107 N -0.49 0.52 -3.05 4.02 2.85 -1.26 -2.82 118.16 117.93 1lgc n LYS 107 Ca -0.02 -0.31 -0.41 0.00 -1.05 0.00 0.00 58.31 56.52 1lgc n LYS 107 Cb 0.61 -1.49 -0.06 0.00 -0.65 0.00 0.00 35.03 33.44 1lgc n LYS 107 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1lgc s ASP 108 N -2.69 6.70 -0.17 -5.58 1.01 -1.26 -4.64 116.67 110.03 1lgc s ASP 108 Ca 0.19 0.86 -0.35 0.00 0.71 0.00 0.00 52.55 53.97 1lgc s ASP 108 Cb 0.19 -2.37 -0.12 0.00 1.01 0.00 0.00 42.92 41.63 1lgc s ASP 108 CO 0.59 -0.37 1.95 0.00 0.21 0.00 0.00 175.17 177.56 1lgc n TYR 109 N 5.50 2.15 -4.64 4.23 4.19 -1.26 -4.76 117.16 122.57 1lgc n TYR 109 Ca 0.01 0.09 -0.33 0.00 3.31 0.00 0.00 57.90 60.98 1lgc n TYR 109 Cb 0.49 -2.63 -0.15 0.00 0.49 0.00 0.00 39.34 37.54 1lgc n TYR 109 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1lgc s ASP 110 N 4.97 3.77 0.35 2.98 2.15 -0.30 -5.01 116.67 125.57 1lgc s ASP 110 Ca 0.97 -0.42 0.05 0.00 0.43 0.00 0.00 52.55 53.58 1lgc s ASP 110 Cb -0.73 -1.58 0.70 0.00 -0.30 0.00 0.00 42.92 41.01 1lgc s ASP 110 CO 0.52 0.11 1.95 0.50 -0.17 0.00 0.00 175.17 178.08 1lgc h LYS 111 N 7.09 0.79 -0.71 4.34 3.11 -1.92 -3.06 116.57 126.20 1lgc h LYS 111 Ca -0.29 -0.05 0.10 0.00 -2.81 0.00 0.00 60.65 57.60 1lgc h LYS 111 Cb 1.20 -0.18 -0.07 0.00 -1.00 0.00 0.00 32.23 32.18 1lgc h LYS 111 CO 0.56 0.52 0.34 1.15 -2.81 0.00 0.00 179.45 179.21 1lgc h THR 112 N 0.81 0.82 -0.29 1.00 2.02 -1.96 -3.22 112.91 112.09 1lgc h THR 112 Ca 0.33 -0.19 0.07 0.00 0.77 0.00 0.00 66.41 67.38 1lgc h THR 112 Cb 0.24 0.20 -0.07 0.00 -1.74 0.00 0.00 68.15 66.78 1lgc h THR 112 CO -0.11 0.10 -0.20 0.28 0.37 0.00 0.00 175.52 175.96 1lgc h SER 113 N 0.57 -0.66 -6.29 4.18 0.02 -1.89 -3.46 113.55 106.01 1lgc h SER 113 Ca 0.35 0.13 -0.46 0.00 -0.84 0.00 0.00 61.79 60.98 1lgc h SER 113 Cb 0.40 0.33 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 1lgc h SER 113 CO -0.29 -0.24 -0.84 0.00 -1.14 0.00 0.00 176.83 174.33 1lgc n GLN 114 N -5.36 -4.37 -3.71 3.45 6.02 -1.22 -4.64 117.38 107.55 1lgc n GLN 114 Ca 0.00 0.53 -0.29 0.00 -0.01 0.00 0.00 57.00 57.23 1lgc n GLN 114 Cb 0.27 -5.01 -0.16 0.00 1.02 0.00 0.00 30.24 26.37 1lgc n GLN 114 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1lgc s THR 115 N -3.69 0.61 0.02 5.09 2.01 -1.26 -4.08 115.64 114.35 1lgc s THR 115 Ca 0.15 -0.93 -0.19 0.00 0.31 0.00 0.00 61.69 61.03 1lgc s THR 115 Cb -0.08 -1.30 -0.06 0.00 0.01 0.00 0.00 72.50 71.08 1lgc s THR 115 CO 0.85 -0.46 0.53 -0.69 -0.69 0.00 0.00 174.62 174.16 1lgc s VAL 116 N 1.78 4.87 -0.17 3.82 1.01 -1.11 -2.39 120.40 128.22 1lgc s VAL 116 Ca 0.04 1.12 -0.13 0.00 0.00 0.00 0.00 61.98 63.01 1lgc s VAL 116 Cb -0.17 -3.86 0.05 0.00 0.00 0.00 0.00 36.38 32.40 1lgc s VAL 116 CO -0.18 0.51 0.44 0.00 0.00 0.00 0.00 175.10 175.86 1lgc s ALA 117 N -0.75 -1.09 -0.47 5.51 0.00 0.02 -0.77 121.76 124.22 1lgc s ALA 117 Ca 0.28 1.36 -0.19 0.00 0.00 0.00 0.00 51.96 53.41 1lgc s ALA 117 Cb -0.18 -0.80 0.04 0.00 0.00 0.00 0.00 23.12 22.17 1lgc s ALA 117 CO 0.17 -0.23 0.59 0.08 0.00 0.00 0.00 175.76 176.37 1lgc s VAL 118 N 0.64 4.90 -0.09 0.00 1.01 0.40 -0.37 120.40 126.90 1lgc s VAL 118 Ca -0.03 -0.26 -0.04 0.00 0.00 0.00 0.00 61.98 61.65 1lgc s VAL 118 Cb -0.05 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 1lgc s VAL 118 CO -0.04 -0.66 0.10 -1.83 0.00 0.00 0.00 175.10 172.68 1lgc s GLU 119 N 2.59 3.28 -0.70 2.72 -1.05 0.49 -2.10 118.70 123.93 1lgc s GLU 119 Ca 0.17 -0.26 0.05 0.00 -0.15 0.00 0.00 54.97 54.77 1lgc s GLU 119 Cb -0.17 -3.04 0.26 0.00 -0.44 0.00 0.00 34.13 30.74 1lgc s GLU 119 CO 0.15 0.73 0.84 1.19 0.95 0.00 0.00 175.26 179.12 1lgc n PHE 120 N 1.81 3.48 -2.23 4.83 3.01 -0.02 -0.74 117.46 127.59 1lgc n PHE 120 Ca -0.18 -3.95 -0.41 0.00 1.01 0.00 0.00 57.45 53.92 1lgc n PHE 120 Cb 0.54 -0.65 -0.03 0.00 -0.01 0.00 0.00 39.48 39.33 1lgc n PHE 120 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1lgc s ASP 121 N -2.37 6.92 -0.12 4.37 -1.08 -0.70 -2.50 116.67 121.20 1lgc s ASP 121 Ca 0.39 2.47 0.16 0.00 -0.52 0.00 0.00 52.55 55.04 1lgc s ASP 121 Cb 0.13 -2.63 0.26 0.00 -1.46 0.00 0.00 42.92 39.23 1lgc s ASP 121 CO 0.00 -0.46 1.13 0.35 0.52 0.00 0.00 175.17 176.71 1lgc n THR 122 N 1.80 1.62 -3.72 1.71 -2.24 -0.91 -1.31 114.28 111.23 1lgc n THR 122 Ca 0.03 -2.00 -0.12 0.00 -2.27 0.00 0.00 64.05 59.68 1lgc n THR 122 Cb 0.43 -0.12 -0.13 0.00 -2.10 0.00 0.00 70.33 68.41 1lgc n THR 122 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1lgc s PHE 123 N -2.46 -0.36 -0.34 4.78 5.36 -1.23 -4.17 117.98 119.56 1lgc s PHE 123 Ca 0.28 0.85 -0.24 0.00 -0.96 0.00 0.00 56.93 56.85 1lgc s PHE 123 Cb 0.25 0.06 0.01 0.00 -0.34 0.00 0.00 43.02 43.00 1lgc s PHE 123 CO 0.02 -0.25 0.85 -0.47 -1.46 0.00 0.00 175.22 173.90 1lgc s TYR 124 N 1.37 3.14 -0.46 10.12 5.04 -1.26 -5.00 117.35 130.30 1lgc s TYR 124 Ca -0.08 0.76 -0.11 0.00 -2.44 0.00 0.00 57.07 55.20 1lgc s TYR 124 Cb -0.10 -3.42 0.10 0.00 0.35 0.00 0.00 41.96 38.89 1lgc s TYR 124 CO -0.09 -0.70 0.34 -0.80 -1.34 0.00 0.00 175.55 172.96 1lgc s ASN 125 N 1.75 5.78 0.34 4.32 -0.87 -1.26 -4.98 114.94 120.02 1lgc s ASN 125 Ca 0.35 -1.71 0.15 0.00 -1.57 0.00 0.00 52.86 50.08 1lgc s ASN 125 Cb -0.13 -2.04 1.12 0.00 -0.02 0.00 0.00 41.25 40.17 1lgc s ASN 125 CO 0.16 -0.66 1.65 0.71 -2.57 0.00 0.00 177.10 176.38 1lgc h THR 126 N 6.05 0.25 0.00 1.60 1.35 -1.94 0.28 112.91 120.49 1lgc h THR 126 Ca -0.23 -0.09 -0.01 0.00 -0.55 0.00 0.00 66.41 65.53 1lgc h THR 126 Cb 1.08 -0.04 -0.00 0.00 -1.73 0.00 0.00 68.15 67.46 1lgc h THR 126 CO 0.85 0.05 -0.04 0.00 -0.25 0.00 0.00 175.52 176.13 1lgc h ALA 127 N 1.87 1.19 0.00 6.62 0.00 -2.02 -3.35 119.26 123.58 1lgc h ALA 127 Ca 0.75 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.62 1lgc h ALA 127 Cb 1.75 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1lgc h ALA 127 CO -0.64 0.05 0.00 -2.67 0.00 0.00 0.00 179.25 175.99 1lgc n TRP 128 N -3.41 0.00 -3.51 0.00 2.14 -0.55 -5.06 117.44 107.06 1lgc n TRP 128 Ca -0.02 0.00 -0.21 0.00 2.07 0.00 0.00 57.50 59.33 1lgc n TRP 128 Cb 0.16 0.04 -0.01 0.00 -0.81 0.00 0.00 31.31 30.69 1lgc n TRP 128 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1lgc s ASP 129 N 0.00 6.13 0.25 -0.67 1.01 0.86 -4.54 116.67 119.71 1lgc s ASP 129 Ca 0.00 0.14 -0.30 0.00 0.71 0.00 0.00 52.55 53.09 1lgc s ASP 129 Cb 0.00 -1.67 -0.14 0.00 1.01 0.00 0.00 42.92 42.12 1lgc s ASP 129 CO 0.00 -0.34 1.29 -2.65 0.21 0.00 0.00 175.17 173.68 1lgc n PRO 130 N -1.69 1.80 -0.16 8.23 -0.02 -1.26 -4.87 135.00 137.03 1lgc n PRO 130 Ca -0.04 0.64 0.17 0.00 -2.02 0.00 0.00 63.50 62.25 1lgc n PRO 130 Cb 0.57 -2.21 0.53 0.00 -0.02 0.00 0.00 33.50 32.37 1lgc n PRO 130 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1lgc h SER 131 N 3.47 0.34 0.49 2.55 0.02 -1.96 0.07 113.55 118.54 1lgc h SER 131 Ca -0.44 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1lgc h SER 131 Cb 1.30 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1lgc h SER 131 CO 0.70 0.17 0.00 -0.46 -1.14 0.00 0.00 176.83 176.10 1lgc n ASN 132 N -4.47 0.43 -1.50 3.07 0.23 -1.26 -4.85 115.26 106.91 1lgc n ASN 132 Ca 0.15 0.63 -0.16 0.00 -0.53 0.00 0.00 54.58 54.66 1lgc n ASN 132 Cb 0.58 -0.71 -0.05 0.00 -2.08 0.00 0.00 39.78 37.52 1lgc n ASN 132 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1lgc n GLY 133 N -0.35 0.89 3.81 4.83 0.00 0.01 -4.98 105.19 109.41 1lgc n GLY 133 Ca 0.02 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 1lgc n GLY 133 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1lgc s ASP 134 N -2.61 7.04 0.62 1.61 1.01 -1.26 -4.72 116.67 118.36 1lgc s ASP 134 Ca 0.00 1.23 -0.18 0.00 0.71 0.00 0.00 52.55 54.31 1lgc s ASP 134 Cb 0.00 -2.35 -0.04 0.00 1.01 0.00 0.00 42.92 41.54 1lgc s ASP 134 CO 0.00 0.28 1.04 0.54 0.21 0.00 0.00 175.17 177.23 1lgc n ARG 135 N 1.71 0.93 -3.53 8.23 1.74 -1.26 -4.85 116.66 119.64 1lgc n ARG 135 Ca -0.11 0.36 -0.09 0.00 -0.77 0.00 0.00 57.85 57.24 1lgc n ARG 135 Cb 0.51 -2.25 -0.03 0.00 -1.02 0.00 0.00 32.46 29.67 1lgc n ARG 135 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1lgc s HIS 136 N -1.49 -0.36 0.57 -1.55 -3.43 -0.43 -1.39 115.29 107.22 1lgc s HIS 136 Ca 0.78 0.38 -0.07 0.00 -0.80 0.00 0.00 55.06 55.35 1lgc s HIS 136 Cb -0.41 0.50 -0.01 0.00 -1.43 0.00 0.00 32.58 31.24 1lgc s HIS 136 CO 0.45 -0.47 0.90 0.42 -2.00 0.00 0.00 174.74 174.04 1lgc s ILE 137 N -2.37 4.06 -0.29 -5.38 1.01 -0.39 -1.72 121.20 116.11 1lgc s ILE 137 Ca 0.02 0.16 -0.28 0.00 0.00 0.00 0.00 60.65 60.56 1lgc s ILE 137 Cb -0.01 -3.60 0.19 0.00 0.01 0.00 0.00 42.46 39.06 1lgc s ILE 137 CO -0.05 -0.64 1.40 -0.83 0.00 0.00 0.00 174.94 174.83 1lgc s GLY 138 N -4.25 0.20 0.15 6.18 0.00 0.08 -2.40 107.32 107.28 1lgc s GLY 138 Ca 0.53 3.11 -0.11 0.00 0.00 0.00 0.00 44.72 48.25 1lgc s GLY 138 CO 0.46 1.41 0.49 -0.42 0.00 0.00 0.00 173.10 175.04 1lgc s ILE 139 N -0.65 4.98 0.02 0.90 1.01 -0.78 -0.38 121.20 126.30 1lgc s ILE 139 Ca 0.09 0.54 0.04 0.00 0.00 0.00 0.00 60.65 61.32 1lgc s ILE 139 Cb -0.02 -3.67 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 1lgc s ILE 139 CO -0.11 0.15 -0.12 -1.81 0.00 0.00 0.00 174.94 173.05 1lgc s ASP 140 N -1.97 1.43 -0.37 3.58 1.11 0.50 -2.24 116.67 118.71 1lgc s ASP 140 Ca 0.39 -0.38 0.05 0.00 0.18 0.00 0.00 52.55 52.79 1lgc s ASP 140 Cb -0.13 -0.10 0.17 0.00 1.07 0.00 0.00 42.92 43.92 1lgc s ASP 140 CO 0.20 0.04 0.49 0.54 1.18 0.00 0.00 175.17 177.61 1lgc s VAL 141 N -0.70 -0.65 -0.36 -1.27 0.11 -1.26 -0.80 120.40 115.47 1lgc s VAL 141 Ca 0.01 -0.49 0.00 0.00 -2.93 0.00 0.00 61.98 58.57 1lgc s VAL 141 Cb -0.07 -0.47 0.00 0.00 -1.53 0.00 0.00 36.38 34.31 1lgc s VAL 141 CO 0.01 -0.30 0.00 0.59 -3.33 0.00 0.00 175.10 172.06 1lgc n ASN 142 N 4.49 -3.11 -3.58 3.54 3.02 -1.00 -4.85 115.26 113.78 1lgc n ASN 142 Ca 0.10 0.07 -0.07 0.00 -0.03 0.00 0.00 54.58 54.65 1lgc n ASN 142 Cb 0.51 -1.24 -0.03 0.00 -0.61 0.00 0.00 39.78 38.40 1lgc n ASN 142 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1lgc s SER 143 N -2.94 -0.24 0.00 6.41 1.04 -1.26 -1.15 113.70 115.56 1lgc s SER 143 Ca 0.00 0.14 0.29 0.00 0.48 0.00 0.00 55.95 56.86 1lgc s SER 143 Cb 0.00 0.23 1.31 0.00 0.10 0.00 0.00 66.02 67.66 1lgc s SER 143 CO 0.00 -0.31 1.91 0.00 0.98 0.00 0.00 173.24 175.82 1lgc n ILE 144 N 0.25 0.00 -3.26 -1.02 0.13 -1.13 -4.58 119.36 109.75 1lgc n ILE 144 Ca -0.05 -0.05 -0.44 0.00 -1.10 0.00 0.00 62.75 61.11 1lgc n ILE 144 Cb 0.59 -0.19 -0.07 0.00 -0.84 0.00 0.00 39.64 39.14 1lgc n ILE 144 CO 0.00 0.00 0.00 -0.75 2.80 0.00 0.00 176.55 178.60 1lgc s LYS 145 N -2.46 3.05 1.02 9.51 2.20 -1.26 -4.93 119.74 126.86 1lgc s LYS 145 Ca 0.30 -1.17 -0.14 0.00 -0.36 0.00 0.00 55.97 54.60 1lgc s LYS 145 Cb 0.20 -4.14 0.09 0.00 -1.51 0.00 0.00 37.83 32.47 1lgc s LYS 145 CO 0.47 -1.17 0.43 0.43 -0.36 0.00 0.00 175.35 175.14 1lgc n SER 146 N 5.73 -1.86 -0.40 1.43 7.64 -1.26 -4.79 113.62 120.12 1lgc n SER 146 Ca -0.10 0.17 0.09 0.00 1.01 0.00 0.00 58.87 60.04 1lgc n SER 146 Cb 0.44 -1.17 0.18 0.00 -1.01 0.00 0.00 64.21 62.65 1lgc n SER 146 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1lgc n ILE 147 N -4.04 2.06 0.00 0.44 -5.35 -0.95 -4.97 119.36 106.56 1lgc n ILE 147 Ca 0.05 -2.23 0.00 0.00 -0.27 0.00 0.00 62.75 60.30 1lgc n ILE 147 Cb 0.56 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.21 1lgc n ILE 147 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1lgc n ASN 148 N -1.12 0.00 -1.61 7.28 2.85 -1.26 -4.96 115.26 116.44 1lgc n ASN 148 Ca 0.19 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.66 1lgc n ASN 148 Cb 0.74 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.76 1lgc n ASN 148 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1lgc n THR 149 N 0.00 0.00 -3.37 -0.44 -2.24 -1.26 -1.86 114.28 105.10 1lgc n THR 149 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 1lgc n THR 149 Cb 0.00 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.19 1lgc n THR 149 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1lgc s LYS 150 N -1.93 0.22 0.59 -0.78 2.47 -1.01 -4.92 119.74 114.39 1lgc s LYS 150 Ca 0.00 0.54 -0.19 0.00 -1.56 0.00 0.00 55.97 54.75 1lgc s LYS 150 Cb 0.00 0.30 -0.04 0.00 -1.46 0.00 0.00 37.83 36.63 1lgc s LYS 150 CO 0.00 -0.07 1.16 0.43 0.16 0.00 0.00 175.35 177.02 1lgc n SER 151 N 4.69 1.63 -3.72 1.43 7.64 -1.26 -1.27 113.62 122.76 1lgc n SER 151 Ca -0.09 0.86 -0.14 0.00 1.01 0.00 0.00 58.87 60.51 1lgc n SER 151 Cb 0.54 -1.48 -0.14 0.00 -1.01 0.00 0.00 64.21 62.12 1lgc n SER 151 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 1lgc s TRP 152 N -1.41 -0.25 -1.34 1.43 -0.00 -0.48 -4.76 118.94 112.14 1lgc s TRP 152 Ca 0.76 0.65 -0.16 0.00 -0.00 0.00 0.00 56.10 57.35 1lgc s TRP 152 Cb -0.41 -0.06 0.08 0.00 -0.00 0.00 0.00 33.47 33.07 1lgc s TRP 152 CO 0.46 -0.22 1.87 1.17 -0.00 0.00 0.00 176.95 180.23 1lgc n LYS 153 N 4.48 3.14 -1.58 5.86 3.00 -1.26 -4.51 118.16 127.29 1lgc n LYS 153 Ca -0.21 -3.15 -0.50 0.00 -0.00 0.00 0.00 58.31 54.45 1lgc n LYS 153 Cb 0.52 -3.34 -0.05 0.00 0.00 0.00 0.00 35.03 32.16 1lgc n LYS 153 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1lgc n LEU 154 N 7.03 1.49 -3.97 3.14 7.94 -1.26 -4.91 117.00 126.46 1lgc n LEU 154 Ca 0.48 1.14 -0.31 0.00 -1.11 0.00 0.00 56.01 56.21 1lgc n LEU 154 Cb 0.43 -1.20 -0.13 0.00 0.53 0.00 0.00 43.42 43.05 1lgc n LEU 154 CO 0.80 -1.27 -0.11 -1.10 -1.11 0.00 0.00 177.39 174.60 1lgc s GLN 155 N -0.17 2.19 -0.67 1.96 -0.21 -1.26 -5.06 119.66 116.44 1lgc s GLN 155 Ca 0.76 -2.76 -0.32 0.00 0.02 0.00 0.00 55.36 53.06 1lgc s GLN 155 Cb -0.89 -3.42 -0.18 0.00 1.00 0.00 0.00 33.01 29.53 1lgc s GLN 155 CO 0.51 -1.15 2.12 -1.71 -2.12 0.00 0.00 175.29 172.93 1lgc n ASN 156 N 2.93 0.43 0.00 5.90 5.15 -1.26 -0.39 115.26 128.02 1lgc n ASN 156 Ca 0.08 0.35 0.00 0.00 -0.60 0.00 0.00 54.58 54.41 1lgc n ASN 156 Cb 0.33 -0.79 0.00 0.00 -0.53 0.00 0.00 39.78 38.80 1lgc n ASN 156 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1lgc n GLY 157 N 6.00 0.60 3.79 8.20 0.00 -1.04 -4.89 105.19 117.85 1lgc n GLY 157 Ca 0.53 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.18 1lgc n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lgc s LYS 158 N -0.81 4.49 0.43 1.61 -0.14 0.48 -4.90 119.74 120.90 1lgc s LYS 158 Ca 0.00 1.18 -0.24 0.00 -1.36 0.00 0.00 55.97 55.55 1lgc s LYS 158 Cb 0.00 -2.86 -0.08 0.00 -1.68 0.00 0.00 37.83 33.21 1lgc s LYS 158 CO 0.00 0.34 1.17 -1.21 -0.76 0.00 0.00 175.35 174.89 1lgc s GLU 159 N -1.95 3.91 -0.29 1.68 2.02 -1.26 -4.55 118.70 118.25 1lgc s GLU 159 Ca 0.47 1.80 -0.01 0.00 0.02 0.00 0.00 54.97 57.25 1lgc s GLU 159 Cb -0.18 -2.54 0.09 0.00 0.10 0.00 0.00 34.13 31.60 1lgc s GLU 159 CO 0.23 -0.44 0.09 0.00 0.02 0.00 0.00 175.26 175.17 1lgc s ALA 160 N -1.49 1.38 0.59 5.21 0.00 0.10 -4.24 121.76 123.31 1lgc s ALA 160 Ca 0.60 -1.47 -0.19 0.00 0.00 0.00 0.00 51.96 50.90 1lgc s ALA 160 Cb -0.29 -1.53 -0.03 0.00 0.00 0.00 0.00 23.12 21.26 1lgc s ALA 160 CO 0.36 -1.58 1.26 -0.80 0.00 0.00 0.00 175.76 175.00 1lgc s ASN 161 N 1.70 5.08 0.04 0.00 -0.87 -1.14 -2.47 114.94 117.28 1lgc s ASN 161 Ca 0.08 2.52 -0.09 0.00 -1.57 0.00 0.00 52.86 53.80 1lgc s ASN 161 Cb -0.17 -2.61 0.00 0.00 -0.02 0.00 0.00 41.25 38.45 1lgc s ASN 161 CO -0.24 -1.67 0.17 -0.69 -2.57 0.00 0.00 177.10 172.10 1lgc s VAL 162 N -1.48 0.11 -0.06 1.60 1.01 0.71 -0.74 120.40 121.55 1lgc s VAL 162 Ca 0.77 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 1lgc s VAL 162 Cb -0.34 -0.89 0.02 0.00 0.00 0.00 0.00 36.38 35.18 1lgc s VAL 162 CO 0.37 -0.51 0.27 -0.69 0.00 0.00 0.00 175.10 174.55 1lgc s VAL 163 N -2.52 0.03 -0.18 2.92 1.01 -1.23 -1.78 120.40 118.64 1lgc s VAL 163 Ca -0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 61.98 61.64 1lgc s VAL 163 Cb -0.01 -0.47 0.08 0.00 0.00 0.00 0.00 36.38 35.97 1lgc s VAL 163 CO -0.04 -0.14 0.16 -0.63 0.00 0.00 0.00 175.10 174.46 1lgc s ILE 164 N -0.53 -0.22 0.05 2.22 1.01 -0.74 -1.21 121.20 121.78 1lgc s ILE 164 Ca -0.06 -0.11 0.06 0.00 0.00 0.00 0.00 60.65 60.54 1lgc s ILE 164 Cb -0.04 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 41.79 1lgc s ILE 164 CO 0.02 -0.22 -0.12 0.00 0.00 0.00 0.00 174.94 174.62 1lgc s ALA 165 N 2.24 2.84 0.17 9.38 0.00 0.94 -2.36 121.76 134.97 1lgc s ALA 165 Ca 0.05 -1.16 0.04 0.00 0.00 0.00 0.00 51.96 50.88 1lgc s ALA 165 Cb -0.16 -0.90 -0.05 0.00 0.00 0.00 0.00 23.12 22.01 1lgc s ALA 165 CO -0.10 0.61 -0.06 0.12 0.00 0.00 0.00 175.76 176.32 1lgc s PHE 166 N -1.04 1.33 -0.11 0.00 5.36 0.85 -0.43 117.98 123.94 1lgc s PHE 166 Ca 0.18 -0.84 -0.05 0.00 -0.96 0.00 0.00 56.93 55.25 1lgc s PHE 166 Cb -0.11 -0.72 0.05 0.00 -0.34 0.00 0.00 43.02 41.90 1lgc s PHE 166 CO 0.09 0.00 0.24 1.21 -1.46 0.00 0.00 175.22 175.31 1lgc s ASN 167 N -3.20 -0.19 0.37 6.13 3.84 -1.26 -2.34 114.94 118.28 1lgc s ASN 167 Ca 0.21 0.52 0.05 0.00 0.21 0.00 0.00 52.86 53.85 1lgc s ASN 167 Cb 0.04 0.43 0.72 0.00 -0.55 0.00 0.00 41.25 41.88 1lgc s ASN 167 CO 0.03 -0.17 2.00 1.23 -2.79 0.00 0.00 177.10 177.39 1lgc h GLY 168 N 7.31 0.68 0.17 1.21 0.00 -1.84 0.74 103.07 111.35 1lgc h GLY 168 Ca -0.38 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 46.65 1lgc h GLY 168 CO 0.35 0.28 -0.08 0.00 0.00 0.00 0.00 176.54 177.09 1lgc h ALA 169 N 1.63 -0.36 -0.01 3.60 0.00 -1.96 -3.37 119.26 118.79 1lgc h ALA 169 Ca 0.17 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 1lgc h ALA 169 Cb 0.03 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1lgc h ALA 169 CO -0.03 -0.34 -0.63 1.79 0.00 0.00 0.00 179.25 180.04 1lgc h THR 170 N -0.63 1.44 -1.93 0.00 1.35 -1.99 -3.46 112.91 107.69 1lgc h THR 170 Ca -0.02 -2.14 -0.36 0.00 -0.55 0.00 0.00 66.41 63.33 1lgc h THR 170 Cb 0.18 2.15 -0.06 0.00 -1.73 0.00 0.00 68.15 68.68 1lgc h THR 170 CO 0.04 0.62 -0.41 0.59 -0.25 0.00 0.00 175.52 176.10 1lgc n ASN 171 N -3.80 -5.19 -4.42 5.36 3.02 0.26 -4.93 115.26 105.55 1lgc n ASN 171 Ca -0.01 0.15 -0.44 0.00 -0.03 0.00 0.00 54.58 54.25 1lgc n ASN 171 Cb 0.63 -4.26 -0.04 0.00 -0.61 0.00 0.00 39.78 35.49 1lgc n ASN 171 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1lgc s VAL 172 N -2.81 4.56 0.18 2.41 0.11 -1.26 -4.85 120.40 118.74 1lgc s VAL 172 Ca 0.00 -0.59 -0.31 0.00 -2.93 0.00 0.00 61.98 58.15 1lgc s VAL 172 Cb 0.00 -4.57 -0.09 0.00 -1.53 0.00 0.00 36.38 30.19 1lgc s VAL 172 CO 0.00 -1.26 1.40 -0.22 -3.33 0.00 0.00 175.10 171.69 1lgc s LEU 173 N 3.40 4.39 -0.18 2.54 2.96 -1.26 -4.30 118.68 126.23 1lgc s LEU 173 Ca 0.18 2.47 -0.04 0.00 -0.22 0.00 0.00 54.13 56.52 1lgc s LEU 173 Cb -0.20 -3.60 0.06 0.00 0.50 0.00 0.00 46.19 42.95 1lgc s LEU 173 CO 0.09 -0.65 0.05 -0.89 -1.32 0.00 0.00 176.35 173.64 1lgc s THR 174 N 0.55 0.28 0.16 3.68 2.01 0.42 -4.98 115.64 117.76 1lgc s THR 174 Ca 0.62 -0.36 0.08 0.00 0.31 0.00 0.00 61.69 62.33 1lgc s THR 174 Cb -0.39 -0.82 -0.04 0.00 0.01 0.00 0.00 72.50 71.26 1lgc s THR 174 CO 0.36 -0.21 -0.05 0.68 -0.69 0.00 0.00 174.62 174.71 1lgc s VAL 175 N 1.97 3.50 -0.38 3.82 -7.23 -1.26 -0.04 120.40 120.78 1lgc s VAL 175 Ca 0.01 -1.45 0.05 0.00 -1.81 0.00 0.00 61.98 58.78 1lgc s VAL 175 Cb -0.16 -2.72 0.17 0.00 0.56 0.00 0.00 36.38 34.22 1lgc s VAL 175 CO -0.08 -0.06 0.51 -0.94 -0.31 0.00 0.00 175.10 174.22 1lgc s SER 176 N -2.74 -0.31 0.47 4.85 1.04 -0.35 -4.98 113.70 111.68 1lgc s SER 176 Ca 0.25 -1.01 -0.24 0.00 0.48 0.00 0.00 55.95 55.44 1lgc s SER 176 Cb -0.10 1.34 -0.07 0.00 0.10 0.00 0.00 66.02 67.30 1lgc s SER 176 CO 0.17 -0.23 1.37 -0.22 0.98 0.00 0.00 173.24 175.30 1lgc s LEU 177 N 1.80 4.04 -0.43 2.42 1.98 -1.26 -3.55 118.68 123.68 1lgc s LEU 177 Ca 0.15 2.79 0.05 0.00 -2.89 0.00 0.00 54.13 54.23 1lgc s LEU 177 Cb -0.10 -4.06 0.17 0.00 0.66 0.00 0.00 46.19 42.87 1lgc s LEU 177 CO -0.09 -1.23 0.50 -0.89 -1.89 0.00 0.00 176.35 172.75 1lgc s THR 178 N -1.27 -0.46 0.31 3.68 2.01 0.08 -4.97 115.64 115.02 1lgc s THR 178 Ca 0.64 -1.25 -0.29 0.00 0.31 0.00 0.00 61.69 61.10 1lgc s THR 178 Cb -0.41 -0.52 -0.11 0.00 0.01 0.00 0.00 72.50 71.48 1lgc s THR 178 CO 0.51 -0.49 1.45 -0.31 -0.69 0.00 0.00 174.62 175.09 1lgc s TYR 179 N 1.00 2.85 -0.49 4.92 1.51 -1.26 -2.89 117.35 122.98 1lgc s TYR 179 Ca 0.24 1.11 -0.30 0.00 -1.01 0.00 0.00 57.07 57.11 1lgc s TYR 179 Cb -0.05 -3.90 -0.11 0.00 -0.11 0.00 0.00 41.96 37.80 1lgc s TYR 179 CO -0.08 -2.76 2.36 -2.30 -1.11 0.00 0.00 175.55 171.67 1lgc n PRO 180 N 1.41 1.00 0.00 -1.71 -0.02 -1.26 -4.98 135.00 129.45 1lgc n PRO 180 Ca 0.04 0.17 0.14 0.00 -2.02 0.00 0.00 63.50 61.83 1lgc n PRO 180 Cb 0.40 -2.76 0.58 0.00 -0.02 0.00 0.00 33.50 31.69 1lgc n PRO 180 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77