#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 4.27 0.03 -2.82 2.02 -1.26 -5.00 118.70 115.94 1lgc s GLU 2 Ca 0.00 2.32 -0.08 0.00 0.02 0.00 0.00 54.97 57.23 1lgc s GLU 2 Cb 0.00 -3.09 -0.00 0.00 0.10 0.00 0.00 34.13 31.14 1lgc s GLU 2 CO 0.00 -0.39 0.16 0.99 0.02 0.00 0.00 175.26 176.04 1lgc s THR 3 N -0.31 0.11 -0.13 3.63 2.01 -1.26 -5.06 115.64 114.62 1lgc s THR 3 Ca 0.57 -0.88 -0.07 0.00 0.31 0.00 0.00 61.69 61.62 1lgc s THR 3 Cb -0.42 -0.77 0.05 0.00 0.01 0.00 0.00 72.50 71.37 1lgc s THR 3 CO 0.47 -0.48 0.31 -0.89 -0.69 0.00 0.00 174.62 173.34 1lgc s THR 4 N -2.22 -0.07 0.09 -0.82 2.01 -1.26 -5.05 115.64 108.33 1lgc s THR 4 Ca -0.08 0.13 -0.12 0.00 0.31 0.00 0.00 61.69 61.93 1lgc s THR 4 Cb -0.03 -0.48 0.01 0.00 0.01 0.00 0.00 72.50 72.01 1lgc s THR 4 CO -0.02 0.05 0.28 -0.44 -0.69 0.00 0.00 174.62 173.80 1lgc s SER 5 N 1.40 -0.04 -0.17 3.53 0.01 -1.26 -5.10 113.70 112.08 1lgc s SER 5 Ca -0.09 -0.47 -0.30 0.00 1.31 0.00 0.00 55.95 56.40 1lgc s SER 5 Cb -0.10 0.39 0.13 0.00 0.21 0.00 0.00 66.02 66.66 1lgc s SER 5 CO -0.10 -0.76 1.04 0.72 0.41 0.00 0.00 173.24 174.55 1lgc s PHE 6 N -3.65 -0.32 0.00 2.43 -0.71 -1.26 -5.16 117.98 109.32 1lgc s PHE 6 Ca 0.03 0.51 0.03 0.00 -1.04 0.00 0.00 56.93 56.46 1lgc s PHE 6 Cb 0.03 0.46 -0.01 0.00 -1.21 0.00 0.00 43.02 42.29 1lgc s PHE 6 CO -0.10 -0.31 -0.09 -1.12 -1.34 0.00 0.00 175.22 172.25 1lgc s SER 7 N -1.24 1.11 -0.02 1.98 0.01 -1.26 -5.10 113.70 109.19 1lgc s SER 7 Ca 0.00 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.04 1lgc s SER 7 Cb -0.01 -0.10 0.02 0.00 0.21 0.00 0.00 66.02 66.14 1lgc s SER 7 CO -0.01 0.07 -0.00 -0.63 0.41 0.00 0.00 173.24 173.09 1lgc s ILE 8 N -0.39 0.11 0.00 1.44 1.01 -1.26 -5.02 121.20 117.09 1lgc s ILE 8 Ca 0.02 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.72 1lgc s ILE 8 Cb -0.05 -0.17 0.00 0.00 0.01 0.00 0.00 42.46 42.25 1lgc s ILE 8 CO -0.00 0.09 0.75 0.41 0.00 0.00 0.00 174.94 176.19 1lgc n THR 9 N 3.69 0.00 -3.12 2.92 -1.04 -1.26 -4.99 114.28 110.48 1lgc n THR 9 Ca -0.21 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 61.84 1lgc n THR 9 Cb 0.54 0.55 -0.00 0.00 -1.82 0.00 0.00 70.33 69.60 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 0.00 0.38 0.30 -2.82 3.01 -1.26 -5.09 119.74 114.26 1lgc s LYS 10 Ca 0.00 0.26 -0.17 0.00 -1.01 0.00 0.00 55.97 55.05 1lgc s LYS 10 Cb 0.00 0.14 -0.09 0.00 -1.01 0.00 0.00 37.83 36.87 1lgc s LYS 10 CO 0.00 -0.68 0.75 -0.06 0.51 0.00 0.00 175.35 175.87 1lgc s PHE 11 N 2.72 3.46 0.24 3.18 0.40 -0.07 -5.04 117.98 122.86 1lgc s PHE 11 Ca 0.18 1.30 0.01 0.00 -0.60 0.00 0.00 56.93 57.82 1lgc s PHE 11 Cb -0.05 -2.58 -0.05 0.00 0.51 0.00 0.00 43.02 40.85 1lgc s PHE 11 CO -0.22 0.16 0.10 0.20 0.70 0.00 0.00 175.22 176.16 1lgc s GLY 12 N -2.07 1.62 0.22 4.36 0.00 -1.26 -4.02 107.32 106.17 1lgc s GLY 12 Ca 0.51 -1.81 -0.09 0.00 0.00 0.00 0.00 44.72 43.33 1lgc s GLY 12 CO 0.18 -1.54 1.69 -0.56 0.00 0.00 0.00 173.10 172.87 1lgc h PRO 13 N 2.47 0.22 -4.19 2.90 0.13 -1.99 -2.87 132.00 128.66 1lgc h PRO 13 Ca -0.38 -0.01 -0.72 0.00 -0.87 0.00 0.00 66.00 64.02 1lgc h PRO 13 Cb 1.24 -0.05 -0.31 0.00 0.13 0.00 0.00 31.00 32.02 1lgc h PRO 13 CO 0.59 0.14 -0.38 -0.51 -0.23 0.00 0.00 178.00 177.61 1lgc s ASP 14 N -5.27 5.64 -0.43 1.44 1.01 -1.26 -4.90 116.67 112.90 1lgc s ASP 14 Ca -0.13 -2.13 0.02 0.00 0.71 0.00 0.00 52.55 51.02 1lgc s ASP 14 Cb 0.19 -1.97 0.14 0.00 1.01 0.00 0.00 42.92 42.29 1lgc s ASP 14 CO 0.74 -0.61 0.27 -1.58 0.21 0.00 0.00 175.17 174.19 1lgc s GLN 15 N 1.03 1.14 0.23 8.23 2.00 -1.09 -5.03 119.66 126.18 1lgc s GLN 15 Ca 0.09 -1.96 0.22 0.00 -2.00 0.00 0.00 55.36 51.71 1lgc s GLN 15 Cb -0.24 -2.04 0.94 0.00 0.80 0.00 0.00 33.01 32.48 1lgc s GLN 15 CO -0.02 -1.21 1.68 -2.30 -0.50 0.00 0.00 175.29 172.93 1lgc n PRO 16 N 3.45 0.17 -0.36 1.67 -0.02 -1.26 -3.73 135.00 134.92 1lgc n PRO 16 Ca 0.13 0.41 -0.03 0.00 -2.02 0.00 0.00 63.50 61.99 1lgc n PRO 16 Cb 0.37 -1.83 0.10 0.00 -0.02 0.00 0.00 33.50 32.12 1lgc n PRO 16 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1lgc h ASN 17 N 0.00 1.14 -3.33 2.55 4.21 -1.96 -3.45 115.58 114.74 1lgc h ASN 17 Ca 0.00 -0.07 -0.46 0.00 1.21 0.00 0.00 56.30 56.99 1lgc h ASN 17 Cb 0.34 -0.29 0.06 0.00 -1.12 0.00 0.00 38.32 37.31 1lgc h ASN 17 CO 0.00 0.87 0.12 -0.76 -1.29 0.00 0.00 177.43 176.37 1lgc s LEU 18 N -10.02 3.13 -0.11 1.61 2.01 -1.24 -0.07 118.68 113.98 1lgc s LEU 18 Ca -0.13 0.40 0.02 0.00 0.01 0.00 0.00 54.13 54.43 1lgc s LEU 18 Cb 0.17 -3.18 0.01 0.00 0.01 0.00 0.00 46.19 43.21 1lgc s LEU 18 CO 0.82 -1.25 -0.17 -0.63 1.01 0.00 0.00 176.35 176.14 1lgc s ILE 19 N -2.99 1.60 -0.16 -0.59 1.01 0.27 -4.70 121.20 115.65 1lgc s ILE 19 Ca 0.56 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 60.43 1lgc s ILE 19 Cb -0.10 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.87 1lgc s ILE 19 CO 0.43 0.46 0.08 -0.36 0.00 0.00 0.00 174.94 175.55 1lgc s PHE 20 N 0.89 3.34 0.09 3.97 0.08 -1.26 -0.03 117.98 125.06 1lgc s PHE 20 Ca -0.08 0.23 0.06 0.00 0.12 0.00 0.00 56.93 57.25 1lgc s PHE 20 Cb -0.15 -2.02 -0.03 0.00 -0.57 0.00 0.00 43.02 40.24 1lgc s PHE 20 CO -0.01 0.34 -0.15 -0.65 -0.10 0.00 0.00 175.22 174.66 1lgc s GLN 21 N -0.11 0.93 4.91 0.44 -0.21 0.79 -4.98 119.66 121.44 1lgc s GLN 21 Ca 0.08 -1.09 0.00 0.00 0.02 0.00 0.00 55.36 54.37 1lgc s GLN 21 Cb -0.12 -0.91 0.00 0.00 1.00 0.00 0.00 33.01 32.98 1lgc s GLN 21 CO 0.01 0.19 0.00 0.41 -2.12 0.00 0.00 175.29 173.78 1lgc n GLY 22 N 0.96 1.85 1.42 3.09 0.00 -1.26 -1.54 105.19 109.72 1lgc n GLY 22 Ca -0.19 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.17 3.23 -4.76 1.61 8.00 0.14 -4.87 116.55 119.74 1lgc n ASP 23 Ca 0.00 -2.59 -0.39 0.00 0.71 0.00 0.00 54.79 52.51 1lgc n ASP 23 Cb 0.00 -0.62 -0.06 0.00 -0.02 0.00 0.00 41.12 40.42 1lgc n ASP 23 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1lgc s GLY 24 N 0.05 3.06 0.15 0.44 0.00 -1.04 -4.67 107.32 105.30 1lgc s GLY 24 Ca 0.22 0.62 -0.24 0.00 0.00 0.00 0.00 44.72 45.33 1lgc s GLY 24 CO 0.05 1.17 0.66 -2.52 0.00 0.00 0.00 173.10 172.46 1lgc s TYR 25 N -1.26 -0.46 -0.40 1.90 1.13 -0.54 -4.70 117.35 113.03 1lgc s TYR 25 Ca 0.43 0.22 -0.06 0.00 -1.41 0.00 0.00 57.07 56.25 1lgc s TYR 25 Cb -0.25 0.58 0.09 0.00 -1.10 0.00 0.00 41.96 41.27 1lgc s TYR 25 CO 0.31 -0.86 0.20 -0.08 -2.51 0.00 0.00 175.55 172.61 1lgc s THR 26 N -3.67 3.71 0.11 -3.49 -1.32 -1.26 -0.40 115.64 109.32 1lgc s THR 26 Ca 0.03 -1.62 0.05 0.00 -1.21 0.00 0.00 61.69 58.94 1lgc s THR 26 Cb -0.02 -3.34 -0.04 0.00 -1.51 0.00 0.00 72.50 67.60 1lgc s THR 26 CO -0.09 -0.51 -0.12 0.42 -2.21 0.00 0.00 174.62 172.10 1lgc s THR 27 N 1.30 1.15 -1.64 5.08 -4.23 -0.56 -4.13 115.64 112.61 1lgc s THR 27 Ca 0.03 -1.67 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 1lgc s THR 27 Cb -0.22 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.18 1lgc s THR 27 CO -0.01 -0.48 0.00 1.17 -0.54 0.00 0.00 174.62 174.77 1lgc n LYS 28 N 0.56 -1.76 -0.90 3.99 0.00 -1.26 -0.76 118.16 118.03 1lgc n LYS 28 Ca -0.16 0.92 0.00 0.00 0.00 0.00 0.00 58.31 59.08 1lgc n LYS 28 Cb 0.57 -5.50 0.00 0.00 0.00 0.00 0.00 35.03 30.10 1lgc n LYS 28 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1lgc n GLU 29 N -2.79 -0.38 -4.35 1.64 4.07 -1.26 -4.99 120.64 112.57 1lgc n GLU 29 Ca -0.21 0.10 -0.29 0.00 -0.06 0.00 0.00 57.16 56.70 1lgc n GLU 29 Cb 0.65 -3.54 -0.12 0.00 -0.06 0.00 0.00 31.44 28.37 1lgc n GLU 29 CO 0.00 0.00 0.00 -0.98 -0.06 0.00 0.00 177.13 176.09 1lgc s ARG 30 N -0.59 1.63 -0.29 5.31 1.70 0.06 -0.89 118.95 125.87 1lgc s ARG 30 Ca 0.00 -1.31 -0.29 0.00 -0.47 0.00 0.00 55.73 53.66 1lgc s ARG 30 Cb 0.00 -2.00 -0.00 0.00 -0.57 0.00 0.00 34.95 32.38 1lgc s ARG 30 CO 0.00 0.45 1.36 -1.17 -1.08 0.00 0.00 175.30 174.86 1lgc s LEU 31 N -2.26 3.87 -0.41 -1.89 2.96 -1.26 -1.50 118.68 118.19 1lgc s LEU 31 Ca 0.18 1.27 -0.15 0.00 -0.22 0.00 0.00 54.13 55.20 1lgc s LEU 31 Cb -0.10 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.07 1lgc s LEU 31 CO 0.09 -1.12 0.31 -0.89 -1.32 0.00 0.00 176.35 173.42 1lgc s THR 32 N 4.55 5.24 -0.13 3.68 2.01 0.47 -4.96 115.64 126.50 1lgc s THR 32 Ca 0.59 -0.61 -0.19 0.00 0.31 0.00 0.00 61.69 61.79 1lgc s THR 32 Cb -0.18 -3.94 -0.26 0.00 0.01 0.00 0.00 72.50 68.14 1lgc s THR 32 CO 0.24 -0.31 0.54 -0.07 -0.69 0.00 0.00 174.62 174.33 1lgc h LEU 33 N 8.68 0.25 -8.29 4.42 3.38 -1.85 -1.43 115.31 120.46 1lgc h LEU 33 Ca -0.27 -0.81 -0.12 0.00 0.09 0.00 0.00 57.88 56.77 1lgc h LEU 33 Cb 1.12 -0.08 -0.12 0.00 0.09 0.00 0.00 40.66 41.67 1lgc h LEU 33 CO 0.73 1.48 -0.30 0.42 0.09 0.00 0.00 178.44 180.86 1lgc s THR 34 N -2.41 0.02 0.19 0.22 -4.23 -1.26 -2.77 115.64 105.40 1lgc s THR 34 Ca -0.21 -1.56 0.01 0.00 -1.18 0.00 0.00 61.69 58.75 1lgc s THR 34 Cb 0.03 -2.18 -0.00 0.00 1.34 0.00 0.00 72.50 71.69 1lgc s THR 34 CO 0.72 -0.08 0.04 0.29 -0.54 0.00 0.00 174.62 175.04 1lgc n LYS 35 N -0.31 1.09 -1.24 3.99 4.76 -1.26 -5.01 118.16 120.18 1lgc n LYS 35 Ca -0.02 -1.53 -0.36 0.00 -2.87 0.00 0.00 58.31 53.52 1lgc n LYS 35 Cb 0.63 0.64 -0.02 0.00 -1.84 0.00 0.00 35.03 34.44 1lgc n LYS 35 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1lgc n ALA 36 N -2.23 5.59 -2.46 7.82 0.00 -1.26 -4.83 120.51 123.15 1lgc n ALA 36 Ca -0.08 -3.18 -0.16 0.00 0.00 0.00 0.00 53.44 50.03 1lgc n ALA 36 Cb 0.27 -3.36 -0.11 0.00 0.00 0.00 0.00 19.45 16.25 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 3.24 1.15 0.54 0.00 1.01 -1.26 -5.10 120.40 119.98 1lgc s VAL 37 Ca 0.54 -1.73 -0.09 0.00 0.00 0.00 0.00 61.98 60.69 1lgc s VAL 37 Cb 0.14 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 1lgc s VAL 37 CO -0.03 -0.52 0.92 0.00 0.00 0.00 0.00 175.10 175.47 1lgc s ARG 38 N -2.87 3.63 -1.65 2.72 1.70 -1.26 -4.48 118.95 116.74 1lgc s ARG 38 Ca 0.09 0.55 -0.08 0.00 -0.47 0.00 0.00 55.73 55.82 1lgc s ARG 38 Cb -0.03 -2.22 0.07 0.00 -0.57 0.00 0.00 34.95 32.21 1lgc s ARG 38 CO 0.02 -0.36 0.21 -1.71 -1.08 0.00 0.00 175.30 172.37 1lgc n ASN 39 N -2.32 -0.01 -4.62 -2.89 4.05 -1.26 -4.97 115.26 103.24 1lgc n ASN 39 Ca 0.04 -1.25 -0.24 0.00 0.45 0.00 0.00 54.58 53.58 1lgc n ASN 39 Cb 0.54 -1.67 -0.08 0.00 1.23 0.00 0.00 39.78 39.80 1lgc n ASN 39 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 1lgc s THR 40 N -4.01 2.92 -0.08 -0.44 -4.23 -1.26 -4.97 115.64 103.56 1lgc s THR 40 Ca 0.27 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 58.74 1lgc s THR 40 Cb -0.15 -2.74 0.05 0.00 1.34 0.00 0.00 72.50 70.99 1lgc s THR 40 CO 1.00 -0.29 0.13 0.54 -0.54 0.00 0.00 174.62 175.46 1lgc s VAL 41 N -2.44 -0.21 -0.15 2.29 0.11 -1.26 -4.58 120.40 114.15 1lgc s VAL 41 Ca 0.33 0.32 0.00 0.00 -2.93 0.00 0.00 61.98 59.71 1lgc s VAL 41 Cb -0.03 -0.29 0.02 0.00 -1.53 0.00 0.00 36.38 34.55 1lgc s VAL 41 CO 0.19 0.12 -0.12 -0.83 -3.33 0.00 0.00 175.10 171.12 1lgc s GLY 42 N 2.25 1.08 0.11 6.54 0.00 -1.11 0.29 107.32 116.47 1lgc s GLY 42 Ca 0.04 -0.86 0.08 0.00 0.00 0.00 0.00 44.72 43.98 1lgc s GLY 42 CO -0.05 0.61 -0.20 0.50 0.00 0.00 0.00 173.10 173.95 1lgc s ARG 43 N 1.53 1.11 -0.02 2.90 0.52 -0.59 -4.70 118.95 119.70 1lgc s ARG 43 Ca 0.04 -1.17 0.00 0.00 -0.52 0.00 0.00 55.73 54.08 1lgc s ARG 43 Cb -0.13 -1.33 0.02 0.00 0.52 0.00 0.00 34.95 34.03 1lgc s ARG 43 CO -0.10 0.30 0.02 0.00 0.02 0.00 0.00 175.30 175.54 1lgc s ALA 44 N -1.28 0.10 0.11 2.13 0.00 -1.26 -0.15 121.76 121.41 1lgc s ALA 44 Ca 0.07 0.20 0.09 0.00 0.00 0.00 0.00 51.96 52.32 1lgc s ALA 44 Cb -0.09 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 1lgc s ALA 44 CO 0.04 -0.07 -0.23 -0.51 0.00 0.00 0.00 175.76 174.99 1lgc s LEU 45 N 0.78 2.30 0.02 0.00 1.43 0.95 -4.90 118.68 119.27 1lgc s LEU 45 Ca -0.07 -0.70 -0.30 0.00 -1.03 0.00 0.00 54.13 52.03 1lgc s LEU 45 Cb -0.10 -1.01 -0.05 0.00 0.03 0.00 0.00 46.19 45.06 1lgc s LEU 45 CO -0.02 0.11 1.20 -0.47 0.23 0.00 0.00 176.35 177.40 1lgc s TYR 46 N -1.10 3.35 0.16 0.29 5.04 -1.26 0.97 117.35 124.79 1lgc s TYR 46 Ca 0.09 1.27 -0.20 0.00 -2.44 0.00 0.00 57.07 55.80 1lgc s TYR 46 Cb -0.10 -3.42 0.06 0.00 0.35 0.00 0.00 41.96 38.85 1lgc s TYR 46 CO 0.05 -1.28 1.65 0.66 -1.34 0.00 0.00 175.55 175.29 1lgc h SER 47 N 7.05 -0.54 -3.41 4.32 4.64 -0.76 -3.42 113.55 121.43 1lgc h SER 47 Ca -0.39 0.13 -0.52 0.00 -0.47 0.00 0.00 61.79 60.53 1lgc h SER 47 Cb 1.20 0.29 0.01 0.00 -0.31 0.00 0.00 62.40 63.59 1lgc h SER 47 CO 0.83 -0.20 0.56 -0.55 -0.87 0.00 0.00 176.83 176.61 1lgc s SER 48 N -5.13 7.08 0.48 4.97 0.15 -1.26 -5.02 113.70 114.97 1lgc s SER 48 Ca -0.14 2.18 -0.21 0.00 0.70 0.00 0.00 55.95 58.48 1lgc s SER 48 Cb 0.13 -2.60 -0.08 0.00 -1.71 0.00 0.00 66.02 61.76 1lgc s SER 48 CO 0.69 -0.39 1.05 -2.84 1.20 0.00 0.00 173.24 172.95 1lgc s PRO 49 N 0.08 3.81 0.00 5.44 0.02 -1.26 -5.06 135.00 138.03 1lgc s PRO 49 Ca 0.54 1.42 0.06 0.00 0.02 0.00 0.00 61.00 63.05 1lgc s PRO 49 Cb -0.32 -2.16 -0.03 0.00 0.02 0.00 0.00 34.50 32.01 1lgc s PRO 49 CO 0.35 -0.43 -0.19 -1.50 -0.33 0.00 0.00 177.00 174.90 1lgc s ILE 50 N -1.90 2.68 -0.58 2.83 2.07 -1.26 -5.08 121.20 119.97 1lgc s ILE 50 Ca 0.66 -1.04 -0.24 0.00 -1.41 0.00 0.00 60.65 58.62 1lgc s ILE 50 Cb -0.18 -2.06 0.05 0.00 0.13 0.00 0.00 42.46 40.39 1lgc s ILE 50 CO 0.22 0.46 0.96 -2.28 -1.91 0.00 0.00 174.94 172.39 1lgc s HIS 51 N -0.80 2.76 -0.24 3.50 5.65 -1.26 -4.90 115.29 119.99 1lgc s HIS 51 Ca 0.13 -0.11 0.20 0.00 0.25 0.00 0.00 55.06 55.52 1lgc s HIS 51 Cb -0.10 -4.13 0.07 0.00 -1.18 0.00 0.00 32.58 27.24 1lgc s HIS 51 CO 0.02 -1.43 1.24 0.82 -0.65 0.00 0.00 174.74 174.75 1lgc h ILE 52 N 6.01 0.32 -2.23 0.89 1.08 -1.98 -3.44 117.51 118.16 1lgc h ILE 52 Ca -0.27 -1.51 0.15 0.00 -0.39 0.00 0.00 64.86 62.84 1lgc h ILE 52 Cb 1.07 1.97 -0.13 0.00 -3.07 0.00 0.00 36.82 36.66 1lgc h ILE 52 CO 1.11 0.18 0.52 -1.66 -0.69 0.00 0.00 178.15 177.61 1lgc s TRP 53 N -3.13 -0.26 -0.06 1.37 1.48 -1.26 0.46 118.94 117.54 1lgc s TRP 53 Ca 0.02 0.08 0.05 0.00 -1.06 0.00 0.00 56.10 55.19 1lgc s TRP 53 Cb 0.08 0.57 -0.01 0.00 -1.16 0.00 0.00 33.47 32.95 1lgc s TRP 53 CO 0.75 -0.60 -0.22 0.34 -4.06 0.00 0.00 176.95 173.16 1lgc s ASP 54 N -2.63 2.72 -0.00 -2.66 2.15 0.87 -4.98 116.67 112.14 1lgc s ASP 54 Ca 0.08 -0.45 -0.24 0.00 0.43 0.00 0.00 52.55 52.36 1lgc s ASP 54 Cb -0.01 -0.79 -0.16 0.00 -0.30 0.00 0.00 42.92 41.65 1lgc s ASP 54 CO -0.05 0.20 1.17 0.28 -0.17 0.00 0.00 175.17 176.60 1lgc h SER 55 N 6.19 -0.30 0.00 -0.34 0.02 -1.94 0.50 113.55 117.68 1lgc h SER 55 Ca -0.31 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 1lgc h SER 55 Cb 1.18 0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1lgc h SER 55 CO 0.47 0.10 0.00 0.29 -1.14 0.00 0.00 176.83 176.55 1lgc n LYS 56 N -5.08 0.56 0.00 3.45 4.01 -1.26 -2.63 118.16 117.21 1lgc n LYS 56 Ca -0.09 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.71 1lgc n LYS 56 Cb 0.26 -1.28 0.00 0.00 -0.51 0.00 0.00 35.03 33.50 1lgc n LYS 56 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1lgc n THR 57 N 0.24 0.00 -0.67 -0.18 -2.24 -1.24 -5.01 114.28 105.18 1lgc n THR 57 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1lgc n THR 57 Cb 0.15 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 1lgc n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lgc n GLY 58 N 0.09 0.72 3.77 3.38 0.00 0.18 -5.02 105.19 108.30 1lgc n GLY 58 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.33 6.69 0.05 1.61 0.02 -1.15 -4.78 114.94 115.05 1lgc s ASN 59 Ca 0.00 2.61 0.06 0.00 -1.02 0.00 0.00 52.86 54.51 1lgc s ASN 59 Cb 0.00 -2.64 -0.04 0.00 0.02 0.00 0.00 41.25 38.59 1lgc s ASN 59 CO 0.00 -0.59 -0.13 -0.69 0.02 0.00 0.00 177.10 175.71 1lgc s VAL 60 N -1.20 3.16 1.14 1.60 1.01 -1.26 -0.09 120.40 124.76 1lgc s VAL 60 Ca 0.51 -1.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 1lgc s VAL 60 Cb -0.38 -2.39 0.26 0.00 0.00 0.00 0.00 36.38 33.87 1lgc s VAL 60 CO 0.49 0.28 1.08 0.00 0.00 0.00 0.00 175.10 176.95 1lgc s ALA 61 N -1.03 0.48 -0.09 5.51 0.00 0.17 -4.63 121.76 122.17 1lgc s ALA 61 Ca 0.17 -0.63 -0.01 0.00 0.00 0.00 0.00 51.96 51.49 1lgc s ALA 61 Cb -0.11 -3.02 0.03 0.00 0.00 0.00 0.00 23.12 20.02 1lgc s ALA 61 CO 0.08 -3.43 -0.03 1.21 0.00 0.00 0.00 175.76 173.59 1lgc s ASN 62 N -3.51 1.78 0.27 0.00 3.84 -1.26 -2.89 114.94 113.17 1lgc s ASN 62 Ca 0.68 -0.17 0.02 0.00 0.21 0.00 0.00 52.86 53.61 1lgc s ASN 62 Cb -0.15 -0.59 -0.03 0.00 -0.55 0.00 0.00 41.25 39.93 1lgc s ASN 62 CO 0.58 -0.16 0.25 0.72 -2.79 0.00 0.00 177.10 175.69 1lgc s PHE 63 N 1.84 1.37 -0.22 0.43 -0.12 -0.59 -4.98 117.98 115.71 1lgc s PHE 63 Ca 0.04 -1.46 -0.20 0.00 -0.05 0.00 0.00 56.93 55.26 1lgc s PHE 63 Cb -0.12 -0.54 0.06 0.00 -0.63 0.00 0.00 43.02 41.78 1lgc s PHE 63 CO -0.06 -0.81 0.58 0.54 -0.05 0.00 0.00 175.22 175.42 1lgc s VAL 64 N -3.74 0.00 0.00 -2.49 0.11 -1.26 -0.41 120.40 112.62 1lgc s VAL 64 Ca 0.38 -0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.45 1lgc s VAL 64 Cb 0.04 -0.81 -0.01 0.00 -1.53 0.00 0.00 36.38 34.07 1lgc s VAL 64 CO 0.19 -0.00 -0.07 0.28 -3.33 0.00 0.00 175.10 172.18 1lgc s THR 65 N 0.29 0.52 -0.04 5.04 -1.32 -0.13 -5.01 115.64 114.99 1lgc s THR 65 Ca -0.00 -0.40 0.01 0.00 -1.21 0.00 0.00 61.69 60.09 1lgc s THR 65 Cb -0.04 -0.46 0.02 0.00 -1.51 0.00 0.00 72.50 70.50 1lgc s THR 65 CO 0.01 0.07 -0.05 -0.55 -2.21 0.00 0.00 174.62 171.88 1lgc s SER 66 N -0.37 0.97 0.00 8.08 0.15 -1.26 -1.57 113.70 119.70 1lgc s SER 66 Ca 0.01 -0.14 -0.18 0.00 0.70 0.00 0.00 55.95 56.33 1lgc s SER 66 Cb -0.04 -0.43 0.03 0.00 -1.71 0.00 0.00 66.02 63.87 1lgc s SER 66 CO -0.00 -0.03 0.40 0.72 1.20 0.00 0.00 173.24 175.53 1lgc s PHE 67 N 0.75 -0.27 -0.15 3.44 -0.71 -0.86 -5.01 117.98 115.16 1lgc s PHE 67 Ca -0.10 0.36 -0.03 0.00 -1.04 0.00 0.00 56.93 56.12 1lgc s PHE 67 Cb -0.13 0.18 -0.03 0.00 -1.21 0.00 0.00 43.02 41.83 1lgc s PHE 67 CO 0.01 -0.49 -0.05 0.99 -1.34 0.00 0.00 175.22 174.34 1lgc s THR 68 N -1.74 3.79 0.16 -4.49 2.01 -1.26 -0.53 115.64 113.57 1lgc s THR 68 Ca -0.10 -0.40 0.04 0.00 0.31 0.00 0.00 61.69 61.54 1lgc s THR 68 Cb -0.03 -2.65 -0.05 0.00 0.01 0.00 0.00 72.50 69.79 1lgc s THR 68 CO 0.03 0.50 -0.07 0.72 -0.69 0.00 0.00 174.62 175.10 1lgc s PHE 69 N 0.34 1.26 -0.05 4.92 -0.71 -0.74 -4.98 117.98 118.02 1lgc s PHE 69 Ca -0.05 -0.83 -0.01 0.00 -1.04 0.00 0.00 56.93 55.01 1lgc s PHE 69 Cb -0.14 -0.67 0.03 0.00 -1.21 0.00 0.00 43.02 41.02 1lgc s PHE 69 CO 0.03 0.01 0.02 0.08 -1.34 0.00 0.00 175.22 174.02 1lgc s VAL 70 N -3.41 0.17 -0.32 -2.49 1.01 -1.26 -2.23 120.40 111.88 1lgc s VAL 70 Ca 0.19 0.18 -0.07 0.00 0.00 0.00 0.00 61.98 62.28 1lgc s VAL 70 Cb 0.04 -0.32 0.02 0.00 0.00 0.00 0.00 36.38 36.12 1lgc s VAL 70 CO 0.02 0.19 0.09 -0.63 0.00 0.00 0.00 175.10 174.77 1lgc s ILE 71 N 1.62 3.87 -0.36 2.22 1.01 -1.26 -5.02 121.20 123.27 1lgc s ILE 71 Ca -0.01 -0.91 -0.04 0.00 0.00 0.00 0.00 60.65 59.69 1lgc s ILE 71 Cb -0.13 -3.09 0.07 0.00 0.01 0.00 0.00 42.46 39.32 1lgc s ILE 71 CO -0.03 -0.05 0.12 -0.62 0.00 0.00 0.00 174.94 174.37 1lgc s ASP 72 N 1.45 5.19 -0.13 3.58 -1.08 -1.26 -1.35 116.67 123.07 1lgc s ASP 72 Ca 0.01 -1.54 -0.07 0.00 -0.52 0.00 0.00 52.55 50.43 1lgc s ASP 72 Cb -0.18 -1.82 -0.04 0.00 -1.46 0.00 0.00 42.92 39.42 1lgc s ASP 72 CO 0.03 -0.41 0.12 0.00 0.52 0.00 0.00 175.17 175.43 1lgc s ALA 73 N 1.26 3.77 0.22 3.66 0.00 -1.26 -4.86 121.76 124.56 1lgc s ALA 73 Ca 0.01 -0.67 -0.09 0.00 0.00 0.00 0.00 51.96 51.22 1lgc s ALA 73 Cb -0.21 -1.94 0.20 0.00 0.00 0.00 0.00 23.12 21.17 1lgc s ALA 73 CO -0.01 0.54 1.89 -1.35 0.00 0.00 0.00 175.76 176.83 1lgc h PRO 74 N 5.28 1.08 -4.85 0.00 0.11 -1.99 -3.40 132.00 128.24 1lgc h PRO 74 Ca -0.52 -0.07 -0.61 0.00 0.11 0.00 0.00 66.00 64.91 1lgc h PRO 74 Cb 1.21 -0.24 -0.35 0.00 0.11 0.00 0.00 31.00 31.73 1lgc h PRO 74 CO 0.60 0.72 -0.84 1.21 -0.21 0.00 0.00 178.00 179.48 1lgc s ASN 75 N -5.94 2.67 0.00 -2.05 2.47 -1.26 -5.03 114.94 105.80 1lgc s ASN 75 Ca -0.13 -0.49 0.18 0.00 0.42 0.00 0.00 52.86 52.84 1lgc s ASN 75 Cb 0.16 -1.21 0.86 0.00 -1.45 0.00 0.00 41.25 39.61 1lgc s ASN 75 CO 0.79 0.02 1.54 -1.20 -3.72 0.00 0.00 177.10 174.53 1lgc n SER 76 N 4.29 0.00 -0.09 -4.21 7.64 -1.26 -3.30 113.62 116.69 1lgc n SER 76 Ca -0.19 0.16 -0.19 0.00 1.01 0.00 0.00 58.87 59.66 1lgc n SER 76 Cb 0.51 -0.34 -0.11 0.00 -1.01 0.00 0.00 64.21 63.26 1lgc n SER 76 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 1lgc h TYR 77 N 0.00 0.00 -3.54 1.43 0.05 -1.97 -3.42 116.97 109.52 1lgc h TYR 77 Ca 0.00 0.00 -0.77 0.00 0.05 0.00 0.00 58.73 58.01 1lgc h TYR 77 Cb 0.20 0.00 -0.24 0.00 1.01 0.00 0.00 36.73 37.70 1lgc h TYR 77 CO 0.00 1.26 0.24 -0.80 -1.05 0.00 0.00 178.16 177.81 1lgc s ASN 78 N -6.61 6.73 0.01 3.88 -0.87 -1.21 -5.03 114.94 111.84 1lgc s ASN 78 Ca -0.25 -2.55 0.07 0.00 -1.57 0.00 0.00 52.86 48.56 1lgc s ASN 78 Cb 0.03 -2.25 -0.03 0.00 -0.02 0.00 0.00 41.25 38.99 1lgc s ASN 78 CO 0.59 -0.67 -0.21 -0.69 -2.57 0.00 0.00 177.10 173.55 1lgc s VAL 79 N 0.68 2.55 -0.20 1.60 1.01 -1.26 -4.69 120.40 120.09 1lgc s VAL 79 Ca 0.21 -1.10 -0.30 0.00 0.00 0.00 0.00 61.98 60.78 1lgc s VAL 79 Cb -0.09 -2.00 0.15 0.00 0.00 0.00 0.00 36.38 34.43 1lgc s VAL 79 CO -0.09 0.46 1.12 0.00 0.00 0.00 0.00 175.10 176.59 1lgc s ALA 80 N -0.78 -1.99 -0.08 5.51 0.00 -1.26 -4.32 121.76 118.83 1lgc s ALA 80 Ca 0.12 1.67 -0.01 0.00 0.00 0.00 0.00 51.96 53.74 1lgc s ALA 80 Cb -0.10 -0.91 -0.05 0.00 0.00 0.00 0.00 23.12 22.06 1lgc s ALA 80 CO 0.02 -0.31 -0.08 -3.47 0.00 0.00 0.00 175.76 171.92 1lgc n ASP 81 N 0.60 2.53 0.00 0.00 -0.08 -1.26 -5.06 116.55 113.28 1lgc n ASP 81 Ca -0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.22 1lgc n ASP 81 Cb 0.58 -0.16 0.00 0.00 2.34 0.00 0.00 41.12 43.88 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 2.92 1.10 3.88 0.27 0.00 -1.26 -0.28 105.19 111.83 1lgc n GLY 82 Ca -0.15 -0.71 -0.21 0.00 0.00 0.00 0.00 46.02 44.96 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 2.98 -0.28 1.61 5.36 -0.21 -4.96 117.98 120.48 1lgc s PHE 83 Ca 0.00 -0.26 -0.23 0.00 -0.96 0.00 0.00 56.93 55.48 1lgc s PHE 83 Cb 0.00 -1.80 0.11 0.00 -0.34 0.00 0.00 43.02 41.00 1lgc s PHE 83 CO 0.00 0.18 0.94 0.99 -1.46 0.00 0.00 175.22 175.87 1lgc s THR 84 N -2.25 0.00 -0.17 0.12 2.01 -1.26 -1.52 115.64 112.57 1lgc s THR 84 Ca 0.41 0.00 -0.06 0.00 0.31 0.00 0.00 61.69 62.35 1lgc s THR 84 Cb -0.07 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.40 1lgc s THR 84 CO 0.27 0.00 0.04 0.12 -0.69 0.00 0.00 174.62 174.36 1lgc s PHE 85 N 0.53 3.21 0.08 4.92 5.36 -0.44 -4.99 117.98 126.64 1lgc s PHE 85 Ca -0.00 0.01 0.03 0.00 -0.96 0.00 0.00 56.93 56.00 1lgc s PHE 85 Cb -0.05 -2.03 -0.03 0.00 -0.34 0.00 0.00 43.02 40.57 1lgc s PHE 85 CO -0.07 0.15 -0.08 -0.59 -1.46 0.00 0.00 175.22 173.16 1lgc s PHE 86 N 0.26 0.89 -0.20 10.12 -0.71 -1.26 -1.29 117.98 125.78 1lgc s PHE 86 Ca 0.02 -0.68 0.01 0.00 -1.04 0.00 0.00 56.93 55.25 1lgc s PHE 86 Cb -0.13 -0.51 0.03 0.00 -1.21 0.00 0.00 43.02 41.21 1lgc s PHE 86 CO 0.01 -0.07 -0.18 0.42 -1.34 0.00 0.00 175.22 174.06 1lgc s ILE 87 N -2.42 2.08 0.20 -4.49 1.01 -0.19 -5.02 121.20 112.37 1lgc s ILE 87 Ca 0.02 -1.11 -0.03 0.00 0.00 0.00 0.00 60.65 59.53 1lgc s ILE 87 Cb -0.03 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 1lgc s ILE 87 CO -0.01 0.39 0.17 0.00 0.00 0.00 0.00 174.94 175.49 1lgc s ALA 88 N 1.25 0.98 0.77 9.38 0.00 -1.26 -1.48 121.76 131.39 1lgc s ALA 88 Ca 0.01 -1.58 -0.15 0.00 0.00 0.00 0.00 51.96 50.24 1lgc s ALA 88 Cb -0.15 1.33 0.04 0.00 0.00 0.00 0.00 23.12 24.34 1lgc s ALA 88 CO -0.11 -0.62 1.05 -0.35 0.00 0.00 0.00 175.76 175.73 1lgc n PRO 89 N -0.28 0.34 -0.21 0.00 -0.04 -1.25 -4.85 135.00 128.70 1lgc n PRO 89 Ca 0.01 0.18 0.31 0.00 -0.04 0.00 0.00 63.50 63.96 1lgc n PRO 89 Cb 0.65 -2.30 0.66 0.00 -0.04 0.00 0.00 33.50 32.46 1lgc n PRO 89 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1lgc h VAL 90 N -0.59 0.21 -0.68 0.52 2.07 -1.99 -2.37 116.25 113.42 1lgc h VAL 90 Ca -0.47 0.00 -0.46 0.00 0.82 0.00 0.00 66.70 66.59 1lgc h VAL 90 Cb 1.32 0.29 -0.29 0.00 -1.52 0.00 0.00 31.29 31.09 1lgc h VAL 90 CO 0.46 0.00 -0.19 -0.90 0.02 0.00 0.00 177.57 176.96 1lgc n ASP 91 N -3.70 4.79 -4.76 0.57 5.68 -1.26 -5.06 116.55 112.81 1lgc n ASP 91 Ca 0.22 -3.78 -0.41 0.00 -0.50 0.00 0.00 54.79 50.32 1lgc n ASP 91 Cb 1.25 -0.59 -0.01 0.00 -1.14 0.00 0.00 41.12 40.64 1lgc n ASP 91 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1lgc s THR 92 N -4.23 2.19 0.21 2.12 2.01 -0.90 -5.03 115.64 112.02 1lgc s THR 92 Ca 0.52 0.17 0.09 0.00 0.31 0.00 0.00 61.69 62.79 1lgc s THR 92 Cb 0.43 -3.11 -0.05 0.00 0.01 0.00 0.00 72.50 69.79 1lgc s THR 92 CO 0.01 0.03 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.27 1lgc s LYS 93 N -1.18 1.40 0.32 4.92 3.01 -1.26 -5.09 119.74 121.85 1lgc s LYS 93 Ca 0.58 -1.57 -0.29 0.00 -1.01 0.00 0.00 55.97 53.67 1lgc s LYS 93 Cb -0.46 -1.35 -0.11 0.00 -1.01 0.00 0.00 37.83 34.90 1lgc s LYS 93 CO 0.53 0.25 1.58 -2.14 0.51 0.00 0.00 175.35 176.08 1lgc s PRO 94 N -3.33 4.11 0.00 -1.68 0.02 -1.26 -4.98 135.00 127.88 1lgc s PRO 94 Ca 0.22 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.83 1lgc s PRO 94 Cb -0.03 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.48 1lgc s PRO 94 CO 0.09 -0.62 0.00 1.04 -0.33 0.00 0.00 177.00 177.18 1lgc n GLN 95 N 1.75 3.60 -1.73 5.54 1.13 0.91 -5.03 117.38 123.55 1lgc n GLN 95 Ca 0.06 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.70 1lgc n GLN 95 Cb 0.38 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.70 1lgc n GLN 95 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1lgc n THR 96 N 0.00 0.51 -0.10 5.09 -1.04 -1.15 -4.64 114.28 112.95 1lgc n THR 96 Ca 0.00 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1lgc n THR 96 Cb 0.00 -1.95 0.00 0.00 -1.82 0.00 0.00 70.33 66.56 1lgc n THR 96 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1lgc n GLY 97 N 3.04 1.04 7.00 3.41 0.00 -1.26 -0.31 105.19 118.11 1lgc n GLY 97 Ca 0.12 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.64 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 2.87 0.18 -0.02 0.00 -1.26 -1.78 105.19 110.18 1lgc n GLY 98 Ca 0.00 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.04 -0.02 0.00 -1.97 -2.30 103.07 97.73 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 -2.41 0.36 -0.37 5.60 4.01 -0.73 -4.91 117.16 118.70 1lgc n TYR 100 Ca -0.01 -0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 1lgc n TYR 100 Cb 0.11 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 1lgc n TYR 100 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1lgc n LEU 101 N 0.10 0.40 0.00 7.72 4.77 -0.87 -2.47 117.00 126.65 1lgc n LEU 101 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1lgc n LEU 101 Cb 0.28 -1.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.19 1lgc n LEU 101 CO 0.06 -0.37 0.00 0.61 -1.33 0.00 0.00 177.39 176.36 1lgc n GLY 102 N 0.30 1.71 0.00 -0.72 0.00 0.57 -4.85 105.19 102.20 1lgc n GLY 102 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1lgc n GLY 102 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1lgc n VAL 103 N -2.00 0.00 -4.33 1.61 0.24 -1.03 -0.07 118.33 112.75 1lgc n VAL 103 Ca 0.00 -0.25 -0.17 0.00 -2.04 0.00 0.00 64.34 61.87 1lgc n VAL 103 Cb 0.00 0.68 -0.10 0.00 -1.47 0.00 0.00 33.84 32.95 1lgc n VAL 103 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1lgc s PHE 104 N -2.30 1.60 -0.14 6.34 0.08 -1.15 -4.81 117.98 117.60 1lgc s PHE 104 Ca 0.01 -0.72 0.03 0.00 0.12 0.00 0.00 56.93 56.37 1lgc s PHE 104 Cb 0.07 -0.83 -0.04 0.00 -0.57 0.00 0.00 43.02 41.65 1lgc s PHE 104 CO 0.43 0.18 0.14 0.09 -0.10 0.00 0.00 175.22 175.96 1lgc n ASN 105 N -0.38 0.55 -3.56 1.36 3.02 -1.26 -2.96 115.26 112.03 1lgc n ASN 105 Ca -0.07 -0.52 -0.05 0.00 -0.03 0.00 0.00 54.58 53.90 1lgc n ASN 105 Cb 0.62 1.02 -0.00 0.00 -0.61 0.00 0.00 39.78 40.80 1lgc n ASN 105 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1lgc s SER 106 N -1.42 -0.13 0.22 6.41 0.15 -1.26 -4.97 113.70 112.69 1lgc s SER 106 Ca 0.01 -0.64 0.16 0.00 0.70 0.00 0.00 55.95 56.18 1lgc s SER 106 Cb 0.03 0.61 0.01 0.00 -1.71 0.00 0.00 66.02 64.96 1lgc s SER 106 CO 0.14 -1.17 1.25 0.50 1.20 0.00 0.00 173.24 175.16 1lgc h LYS 107 N 2.00 0.00 -7.33 5.44 3.64 -1.97 -3.06 116.57 115.29 1lgc h LYS 107 Ca -0.25 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.62 1lgc h LYS 107 Cb 1.24 0.00 0.11 0.00 -0.41 0.00 0.00 32.23 33.17 1lgc h LYS 107 CO 0.29 0.41 0.35 -0.51 -2.27 0.00 0.00 179.45 177.72 1lgc s ASP 108 N -6.21 4.97 -0.50 4.20 1.01 -1.26 -4.57 116.67 114.32 1lgc s ASP 108 Ca 0.02 1.69 -0.28 0.00 0.71 0.00 0.00 52.55 54.68 1lgc s ASP 108 Cb 0.08 -2.48 0.02 0.00 1.01 0.00 0.00 42.92 41.54 1lgc s ASP 108 CO 0.76 -1.71 1.33 -0.47 0.21 0.00 0.00 175.17 175.29 1lgc s TYR 109 N -2.99 2.48 -0.94 4.23 5.04 -1.26 -4.60 117.35 119.30 1lgc s TYR 109 Ca 0.59 0.58 -0.13 0.00 -2.44 0.00 0.00 57.07 55.68 1lgc s TYR 109 Cb -0.15 -4.40 0.23 0.00 0.35 0.00 0.00 41.96 37.99 1lgc s TYR 109 CO 0.55 -1.78 0.92 0.34 -1.34 0.00 0.00 175.55 174.25 1lgc s ASP 110 N 3.66 6.95 0.42 4.32 2.15 -0.34 -4.92 116.67 128.91 1lgc s ASP 110 Ca 0.53 -2.96 0.27 0.00 0.43 0.00 0.00 52.55 50.82 1lgc s ASP 110 Cb -0.10 -2.23 1.37 0.00 -0.30 0.00 0.00 42.92 41.66 1lgc s ASP 110 CO 0.29 -0.51 1.63 0.50 -0.17 0.00 0.00 175.17 176.91 1lgc h LYS 111 N 7.46 0.11 -0.00 4.34 3.64 -1.93 0.49 116.57 130.68 1lgc h LYS 111 Ca 0.14 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1lgc h LYS 111 Cb 0.98 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1lgc h LYS 111 CO 0.87 0.08 -0.00 0.25 -2.27 0.00 0.00 179.45 178.37 1lgc n THR 112 N -4.78 0.00 -0.07 1.00 -2.24 -1.26 -3.71 114.28 103.21 1lgc n THR 112 Ca 0.36 -0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 62.04 1lgc n THR 112 Cb 1.34 -0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 69.06 1lgc n THR 112 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1lgc h SER 113 N 0.03 0.33 -4.11 3.42 0.87 -0.34 -3.46 113.55 110.29 1lgc h SER 113 Ca 0.00 -0.14 -0.38 0.00 -1.23 0.00 0.00 61.79 60.04 1lgc h SER 113 Cb 0.21 -0.09 0.01 0.00 -0.44 0.00 0.00 62.40 62.09 1lgc h SER 113 CO 0.00 0.38 -0.53 0.00 -0.53 0.00 0.00 176.83 176.14 1lgc n GLN 114 N -4.81 -3.35 -4.39 2.24 6.02 -1.24 -4.68 117.38 107.17 1lgc n GLN 114 Ca -0.03 0.82 -0.27 0.00 -0.01 0.00 0.00 57.00 57.51 1lgc n GLN 114 Cb 0.11 -5.57 -0.17 0.00 1.02 0.00 0.00 30.24 25.64 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 -3.01 1.32 -0.02 5.09 2.01 -1.26 -3.85 115.64 115.92 1lgc s THR 115 Ca 0.18 -0.54 0.05 0.00 0.31 0.00 0.00 61.69 61.69 1lgc s THR 115 Cb -0.09 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.17 1lgc s THR 115 CO 0.23 0.41 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.73 1lgc s VAL 116 N 1.03 3.06 -0.21 3.82 1.01 -0.55 -0.35 120.40 128.20 1lgc s VAL 116 Ca -0.07 -0.85 -0.18 0.00 0.00 0.00 0.00 61.98 60.88 1lgc s VAL 116 Cb -0.15 -2.24 0.06 0.00 0.00 0.00 0.00 36.38 34.05 1lgc s VAL 116 CO -0.01 0.50 0.54 0.00 0.00 0.00 0.00 175.10 176.13 1lgc s ALA 117 N -0.81 -1.36 -0.44 5.51 0.00 -0.19 -1.02 121.76 123.46 1lgc s ALA 117 Ca 0.13 1.60 -0.15 0.00 0.00 0.00 0.00 51.96 53.54 1lgc s ALA 117 Cb -0.11 -0.94 0.04 0.00 0.00 0.00 0.00 23.12 22.12 1lgc s ALA 117 CO 0.03 -0.27 0.36 0.54 0.00 0.00 0.00 175.76 176.42 1lgc s VAL 118 N 0.49 5.22 0.05 0.00 0.11 -0.41 0.30 120.40 126.17 1lgc s VAL 118 Ca -0.02 -0.78 -0.00 0.00 -2.93 0.00 0.00 61.98 58.25 1lgc s VAL 118 Cb -0.04 -4.02 -0.04 0.00 -1.53 0.00 0.00 36.38 30.74 1lgc s VAL 118 CO -0.02 -0.44 0.20 -1.83 -3.33 0.00 0.00 175.10 169.69 1lgc s GLU 119 N 1.73 3.43 -0.39 1.54 -1.05 0.82 -1.33 118.70 123.46 1lgc s GLU 119 Ca 0.06 -0.43 0.02 0.00 -0.15 0.00 0.00 54.97 54.47 1lgc s GLU 119 Cb -0.21 -3.04 0.11 0.00 -0.44 0.00 0.00 34.13 30.55 1lgc s GLU 119 CO 0.09 0.62 0.14 -0.06 0.95 0.00 0.00 175.26 177.00 1lgc s PHE 120 N -1.48 2.68 -0.35 4.83 0.40 -0.57 0.27 117.98 123.75 1lgc s PHE 120 Ca 0.34 -2.55 -0.15 0.00 -0.60 0.00 0.00 56.93 53.97 1lgc s PHE 120 Cb -0.13 -2.33 -0.01 0.00 0.51 0.00 0.00 43.02 41.06 1lgc s PHE 120 CO 0.27 -0.85 0.33 0.34 0.70 0.00 0.00 175.22 176.00 1lgc s ASP 121 N 0.75 6.14 -0.21 1.36 -1.08 -0.12 -1.04 116.67 122.47 1lgc s ASP 121 Ca 0.13 -0.33 0.15 0.00 -0.52 0.00 0.00 52.55 51.97 1lgc s ASP 121 Cb -0.21 -2.18 0.80 0.00 -1.46 0.00 0.00 42.92 39.87 1lgc s ASP 121 CO -0.09 -0.33 1.72 0.35 0.52 0.00 0.00 175.17 177.35 1lgc n THR 122 N 5.21 2.59 -3.71 1.71 -2.24 0.62 -1.96 114.28 116.50 1lgc n THR 122 Ca -0.10 -1.35 -0.13 0.00 -2.27 0.00 0.00 64.05 60.20 1lgc n THR 122 Cb 0.49 -0.21 -0.13 0.00 -2.10 0.00 0.00 70.33 68.38 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 -2.60 -0.36 -0.20 4.78 2.19 -1.16 -4.32 117.98 116.31 1lgc s PHE 123 Ca 0.54 0.85 -0.29 0.00 0.33 0.00 0.00 56.93 58.35 1lgc s PHE 123 Cb 0.40 0.02 -0.01 0.00 -1.31 0.00 0.00 43.02 42.12 1lgc s PHE 123 CO 0.17 -0.27 1.30 -0.47 1.83 0.00 0.00 175.22 177.79 1lgc s TYR 124 N 1.60 2.73 -0.42 10.12 5.04 -1.26 -4.99 117.35 130.18 1lgc s TYR 124 Ca -0.06 0.92 -0.06 0.00 -2.44 0.00 0.00 57.07 55.43 1lgc s TYR 124 Cb -0.11 -3.66 0.10 0.00 0.35 0.00 0.00 41.96 38.65 1lgc s TYR 124 CO -0.09 -1.84 0.24 -0.80 -1.34 0.00 0.00 175.55 171.72 1lgc s ASN 125 N 2.37 5.42 0.57 4.32 -0.87 -1.26 -4.96 114.94 120.52 1lgc s ASN 125 Ca 0.57 -1.85 0.33 0.00 -1.57 0.00 0.00 52.86 50.33 1lgc s ASN 125 Cb -0.21 -1.90 1.45 0.00 -0.02 0.00 0.00 41.25 40.57 1lgc s ASN 125 CO 0.18 -0.56 1.77 0.71 -2.57 0.00 0.00 177.10 176.63 1lgc h THR 126 N 6.26 0.34 0.00 1.60 1.35 -1.94 -0.01 112.91 120.51 1lgc h THR 126 Ca -0.17 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.65 1lgc h THR 126 Cb 1.06 0.42 -0.01 0.00 -1.73 0.00 0.00 68.15 67.90 1lgc h THR 126 CO 0.74 0.00 -0.17 0.00 -0.25 0.00 0.00 175.52 175.84 1lgc h ALA 127 N 1.31 1.22 0.00 6.62 0.00 -2.03 -3.40 119.26 122.98 1lgc h ALA 127 Ca 0.44 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1lgc h ALA 127 Cb 2.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1lgc h ALA 127 CO -0.00 0.21 0.00 -2.67 0.00 0.00 0.00 179.25 176.79 1lgc n TRP 128 N -3.61 0.00 -2.44 0.00 2.14 -0.35 -5.10 117.44 108.09 1lgc n TRP 128 Ca -0.01 0.00 -0.31 0.00 2.07 0.00 0.00 57.50 59.25 1lgc n TRP 128 Cb 0.30 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.78 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 6.47 0.12 -0.67 1.01 -0.17 -4.72 116.67 118.71 1lgc s ASP 129 Ca 0.00 1.34 -0.35 0.00 0.71 0.00 0.00 52.55 54.25 1lgc s ASP 129 Cb 0.00 -2.42 -0.16 0.00 1.01 0.00 0.00 42.92 41.35 1lgc s ASP 129 CO 0.00 -0.60 1.33 -2.65 0.21 0.00 0.00 175.17 173.46 1lgc n PRO 130 N -1.84 1.29 -0.29 8.23 -0.02 -1.26 -4.83 135.00 136.27 1lgc n PRO 130 Ca 0.05 0.46 0.33 0.00 -2.02 0.00 0.00 63.50 62.32 1lgc n PRO 130 Cb 0.54 -2.09 0.73 0.00 -0.02 0.00 0.00 33.50 32.67 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 4.42 0.03 0.12 2.55 0.02 -1.96 -0.47 113.55 118.25 1lgc h SER 131 Ca -0.46 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.48 1lgc h SER 131 Cb 1.33 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.87 1lgc h SER 131 CO 0.77 0.00 -0.03 -0.55 -1.14 0.00 0.00 176.83 175.88 1lgc h ASN 132 N 0.02 0.00 -0.64 3.07 7.08 -2.05 -3.46 115.58 119.60 1lgc h ASN 132 Ca 0.54 0.00 -0.17 0.00 -3.08 0.00 0.00 56.30 53.58 1lgc h ASN 132 Cb 2.11 0.00 -0.05 0.00 -2.08 0.00 0.00 38.32 38.30 1lgc h ASN 132 CO -0.02 0.03 -0.18 0.61 -2.08 0.00 0.00 177.43 175.80 1lgc n GLY 133 N -1.09 0.74 3.89 9.14 0.00 -0.19 -5.03 105.19 112.64 1lgc n GLY 133 Ca -0.03 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.82 6.50 0.51 1.61 1.01 -1.26 -4.72 116.67 117.49 1lgc s ASP 134 Ca 0.00 0.91 -0.22 0.00 0.71 0.00 0.00 52.55 53.96 1lgc s ASP 134 Cb 0.00 -2.23 -0.06 0.00 1.01 0.00 0.00 42.92 41.64 1lgc s ASP 134 CO 0.00 -0.27 1.21 -0.13 0.21 0.00 0.00 175.17 176.19 1lgc s ARG 135 N -3.59 3.45 0.08 8.23 1.81 -1.26 -4.87 118.95 122.80 1lgc s ARG 135 Ca 0.47 1.86 -0.22 0.00 -1.72 0.00 0.00 55.73 56.13 1lgc s ARG 135 Cb -0.11 -2.25 0.05 0.00 -0.45 0.00 0.00 34.95 32.20 1lgc s ARG 135 CO 0.29 -0.83 0.53 -3.38 -0.68 0.00 0.00 175.30 171.23 1lgc s HIS 136 N -1.53 -0.43 -0.12 -0.53 -3.43 -0.83 -0.54 115.29 107.90 1lgc s HIS 136 Ca 0.69 0.38 -0.14 0.00 -0.80 0.00 0.00 55.06 55.19 1lgc s HIS 136 Cb -0.31 0.38 -0.05 0.00 -1.43 0.00 0.00 32.58 31.18 1lgc s HIS 136 CO 0.36 -0.70 0.32 0.42 -2.00 0.00 0.00 174.74 173.15 1lgc s ILE 137 N -2.90 5.25 0.02 -5.38 1.01 -0.76 -0.94 121.20 117.51 1lgc s ILE 137 Ca -0.03 0.62 -0.03 0.00 0.00 0.00 0.00 60.65 61.21 1lgc s ILE 137 Cb -0.00 -3.65 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 1lgc s ILE 137 CO -0.05 0.45 0.04 -0.83 0.00 0.00 0.00 174.94 174.54 1lgc s GLY 138 N -0.01 0.20 -0.35 6.18 0.00 0.14 -1.63 107.32 111.86 1lgc s GLY 138 Ca 0.19 -0.54 -0.09 0.00 0.00 0.00 0.00 44.72 44.28 1lgc s GLY 138 CO 0.07 -0.65 0.16 -0.42 0.00 0.00 0.00 173.10 172.26 1lgc s ILE 139 N -1.98 4.28 0.17 0.90 1.01 -0.94 -0.13 121.20 124.51 1lgc s ILE 139 Ca -0.11 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 59.66 1lgc s ILE 139 Cb -0.05 -3.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.00 1lgc s ILE 139 CO -0.02 -0.18 0.29 -1.81 0.00 0.00 0.00 174.94 173.21 1lgc s ASP 140 N 1.50 6.24 -0.29 3.58 1.01 0.15 -1.27 116.67 127.60 1lgc s ASP 140 Ca 0.01 0.11 0.04 0.00 0.71 0.00 0.00 52.55 53.42 1lgc s ASP 140 Cb -0.19 -1.85 0.18 0.00 1.01 0.00 0.00 42.92 42.07 1lgc s ASP 140 CO 0.05 0.02 0.50 0.54 0.21 0.00 0.00 175.17 176.49 1lgc s VAL 141 N -1.80 -0.82 -0.87 -1.27 0.11 -1.26 -1.02 120.40 113.47 1lgc s VAL 141 Ca 0.34 -0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.25 1lgc s VAL 141 Cb -0.10 -0.99 0.00 0.00 -1.53 0.00 0.00 36.38 33.76 1lgc s VAL 141 CO 0.28 -0.14 0.00 0.59 -3.33 0.00 0.00 175.10 172.50 1lgc n ASN 142 N 5.39 -3.91 -3.62 3.54 3.02 0.52 -4.93 115.26 115.26 1lgc n ASN 142 Ca 0.02 0.19 -0.03 0.00 -0.03 0.00 0.00 54.58 54.73 1lgc n ASN 142 Cb 0.52 -2.25 -0.03 0.00 -0.61 0.00 0.00 39.78 37.41 1lgc n ASN 142 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1lgc s SER 143 N -2.88 -0.08 0.00 6.41 0.15 -1.26 -1.19 113.70 114.84 1lgc s SER 143 Ca 0.00 0.03 0.25 0.00 0.70 0.00 0.00 55.95 56.93 1lgc s SER 143 Cb 0.00 0.08 1.10 0.00 -1.71 0.00 0.00 66.02 65.49 1lgc s SER 143 CO 0.00 -0.12 1.80 0.00 1.20 0.00 0.00 173.24 176.12 1lgc n ILE 144 N 0.13 0.28 -3.11 6.45 0.00 -1.16 -4.69 119.36 117.26 1lgc n ILE 144 Ca 0.01 0.07 -0.40 0.00 0.00 0.00 0.00 62.75 62.43 1lgc n ILE 144 Cb 0.58 -0.65 -0.06 0.00 0.00 0.00 0.00 39.64 39.51 1lgc n ILE 144 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1lgc s LYS 145 N -2.91 4.18 0.36 9.51 2.20 -1.26 -4.96 119.74 126.86 1lgc s LYS 145 Ca 0.14 0.61 -0.27 0.00 -0.36 0.00 0.00 55.97 56.09 1lgc s LYS 145 Cb 0.16 -3.60 -0.09 0.00 -1.51 0.00 0.00 37.83 32.79 1lgc s LYS 145 CO 0.44 -0.29 1.24 -1.12 -0.36 0.00 0.00 175.35 175.25 1lgc s SER 146 N 1.28 6.68 0.00 1.43 0.01 -1.26 -4.62 113.70 117.21 1lgc s SER 146 Ca 0.28 2.53 0.29 0.00 1.31 0.00 0.00 55.95 60.36 1lgc s SER 146 Cb -0.16 -2.63 1.27 0.00 0.21 0.00 0.00 66.02 64.71 1lgc s SER 146 CO 0.10 -0.58 1.90 2.30 0.41 0.00 0.00 173.24 177.37 1lgc n ILE 147 N 0.52 0.00 -3.63 1.44 -5.35 -0.40 -4.84 119.36 107.10 1lgc n ILE 147 Ca 0.02 -0.02 -0.06 0.00 -0.27 0.00 0.00 62.75 62.41 1lgc n ILE 147 Cb 0.44 -0.27 -0.06 0.00 -1.74 0.00 0.00 39.64 38.01 1lgc n ILE 147 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1lgc s ASN 148 N -2.64 -0.21 0.21 7.28 3.04 -1.26 -5.02 114.94 116.34 1lgc s ASN 148 Ca 0.25 0.32 -0.02 0.00 0.04 0.00 0.00 52.86 53.45 1lgc s ASN 148 Cb 0.20 0.29 -0.04 0.00 -1.54 0.00 0.00 41.25 40.17 1lgc s ASN 148 CO 0.50 -0.14 0.18 0.42 -3.04 0.00 0.00 177.10 175.02 1lgc s THR 149 N -0.52 0.00 -0.12 -5.21 -4.23 -1.26 -2.21 115.64 102.08 1lgc s THR 149 Ca 0.04 -1.94 -0.05 0.00 -1.18 0.00 0.00 61.69 58.57 1lgc s THR 149 Cb -0.03 -2.47 0.06 0.00 1.34 0.00 0.00 72.50 71.40 1lgc s THR 149 CO -0.07 0.00 0.27 -0.75 -0.54 0.00 0.00 174.62 173.53 1lgc s LYS 150 N -4.10 0.19 0.37 3.99 2.47 -0.64 -4.98 119.74 117.04 1lgc s LYS 150 Ca 0.37 0.67 -0.28 0.00 -1.56 0.00 0.00 55.97 55.18 1lgc s LYS 150 Cb 0.06 -0.06 -0.10 0.00 -1.46 0.00 0.00 37.83 36.27 1lgc s LYS 150 CO 0.13 -0.23 1.38 -1.12 0.16 0.00 0.00 175.35 175.67 1lgc s SER 151 N 1.91 6.47 -0.07 1.43 0.01 -1.26 -1.82 113.70 120.37 1lgc s SER 151 Ca -0.04 2.84 -0.03 0.00 1.31 0.00 0.00 55.95 60.04 1lgc s SER 151 Cb -0.11 -2.66 0.04 0.00 0.21 0.00 0.00 66.02 63.50 1lgc s SER 151 CO -0.09 -0.76 0.15 0.86 0.41 0.00 0.00 173.24 173.81 1lgc s TRP 152 N -1.16 -0.16 -0.69 2.43 -0.00 0.30 -4.88 118.94 114.78 1lgc s TRP 152 Ca 0.52 0.48 -0.22 0.00 -0.00 0.00 0.00 56.10 56.88 1lgc s TRP 152 Cb -0.42 -0.08 0.07 0.00 -0.00 0.00 0.00 33.47 33.04 1lgc s TRP 152 CO 0.57 -0.16 1.00 0.15 -0.00 0.00 0.00 176.95 178.50 1lgc s LYS 153 N 1.13 3.16 0.25 5.86 1.02 -1.26 -4.14 119.74 125.75 1lgc s LYS 153 Ca -0.09 -0.89 -0.31 0.00 0.02 0.00 0.00 55.97 54.70 1lgc s LYS 153 Cb -0.11 -4.30 -0.12 0.00 -0.52 0.00 0.00 37.83 32.78 1lgc s LYS 153 CO -0.06 -1.84 1.68 -1.17 -0.92 0.00 0.00 175.35 173.04 1lgc s LEU 154 N 4.04 4.36 -0.63 3.17 1.98 -1.26 -4.94 118.68 125.40 1lgc s LEU 154 Ca 0.24 2.92 -0.08 0.00 -2.89 0.00 0.00 54.13 54.31 1lgc s LEU 154 Cb -0.15 -3.62 0.16 0.00 0.66 0.00 0.00 46.19 43.25 1lgc s LEU 154 CO 0.08 -0.96 0.50 -1.10 -1.89 0.00 0.00 176.35 172.99 1lgc s GLN 155 N 0.46 2.84 -0.38 1.98 -0.21 -1.26 -5.05 119.66 118.05 1lgc s GLN 155 Ca 0.70 -2.25 -0.43 0.00 0.02 0.00 0.00 55.36 53.40 1lgc s GLN 155 Cb -0.49 -4.00 -0.18 0.00 1.00 0.00 0.00 33.01 29.34 1lgc s GLN 155 CO 0.39 -1.22 1.68 -1.71 -2.12 0.00 0.00 175.29 172.31 1lgc n ASN 156 N 4.12 1.85 0.00 5.90 5.15 -1.26 -0.96 115.26 130.07 1lgc n ASN 156 Ca 0.04 1.13 0.00 0.00 -0.60 0.00 0.00 54.58 55.15 1lgc n ASN 156 Cb 0.41 -1.02 0.00 0.00 -0.53 0.00 0.00 39.78 38.64 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 4.10 1.94 3.91 8.20 0.00 -0.46 -4.96 105.19 117.93 1lgc n GLY 157 Ca 0.29 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.02 3.59 -0.27 1.61 3.01 -0.13 -4.92 119.74 122.60 1lgc s LYS 158 Ca 0.00 -0.16 -0.12 0.00 -1.01 0.00 0.00 55.97 54.68 1lgc s LYS 158 Cb 0.00 -2.80 -0.05 0.00 -1.01 0.00 0.00 37.83 33.97 1lgc s LYS 158 CO 0.00 0.39 0.21 -1.83 0.51 0.00 0.00 175.35 174.63 1lgc s GLU 159 N -3.10 3.98 -0.09 1.68 -1.05 -1.26 -4.37 118.70 114.49 1lgc s GLU 159 Ca 0.41 -0.25 -0.06 0.00 -0.15 0.00 0.00 54.97 54.92 1lgc s GLU 159 Cb -0.11 -3.64 -0.04 0.00 -0.44 0.00 0.00 34.13 29.90 1lgc s GLU 159 CO 0.27 -0.15 0.15 0.00 0.95 0.00 0.00 175.26 176.48 1lgc s ALA 160 N 1.68 3.89 -0.24 -0.84 0.00 -0.95 -4.30 121.76 121.01 1lgc s ALA 160 Ca 0.08 -0.68 -0.11 0.00 0.00 0.00 0.00 51.96 51.25 1lgc s ALA 160 Cb -0.16 -1.94 -0.05 0.00 0.00 0.00 0.00 23.12 20.98 1lgc s ALA 160 CO 0.10 0.66 0.20 -0.80 0.00 0.00 0.00 175.76 175.91 1lgc s ASN 161 N -1.28 6.16 0.03 0.00 0.01 0.14 -1.80 114.94 118.20 1lgc s ASN 161 Ca 0.18 0.17 0.03 0.00 -0.71 0.00 0.00 52.86 52.54 1lgc s ASN 161 Cb -0.12 -2.13 -0.04 0.00 0.41 0.00 0.00 41.25 39.38 1lgc s ASN 161 CO 0.08 0.03 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.99 1lgc s VAL 162 N 1.14 3.89 -0.10 1.60 1.01 0.31 -0.88 120.40 127.38 1lgc s VAL 162 Ca 0.09 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1lgc s VAL 162 Cb -0.14 -2.76 0.04 0.00 0.00 0.00 0.00 36.38 33.52 1lgc s VAL 162 CO 0.05 0.30 0.05 -0.69 0.00 0.00 0.00 175.10 174.81 1lgc s VAL 163 N -1.12 0.09 -0.07 2.92 1.01 0.17 -2.03 120.40 121.37 1lgc s VAL 163 Ca 0.20 0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.34 1lgc s VAL 163 Cb -0.11 -0.44 -0.01 0.00 0.00 0.00 0.00 36.38 35.81 1lgc s VAL 163 CO 0.12 0.05 -0.22 -0.63 0.00 0.00 0.00 175.10 174.41 1lgc s ILE 164 N 2.08 2.29 0.08 2.22 1.01 -0.61 -0.94 121.20 127.33 1lgc s ILE 164 Ca 0.04 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.72 1lgc s ILE 164 Cb -0.14 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 1lgc s ILE 164 CO -0.06 0.57 -0.06 0.00 0.00 0.00 0.00 174.94 175.39 1lgc s ALA 165 N -0.14 0.78 -0.02 9.38 0.00 -0.22 -0.96 121.76 130.59 1lgc s ALA 165 Ca -0.04 -1.20 -0.00 0.00 0.00 0.00 0.00 51.96 50.73 1lgc s ALA 165 Cb -0.14 0.16 0.03 0.00 0.00 0.00 0.00 23.12 23.17 1lgc s ALA 165 CO 0.04 -0.22 0.03 0.12 0.00 0.00 0.00 175.76 175.73 1lgc s PHE 166 N -3.23 0.02 -0.43 0.00 5.36 0.46 -1.36 117.98 118.80 1lgc s PHE 166 Ca 0.06 0.14 -0.09 0.00 -0.96 0.00 0.00 56.93 56.08 1lgc s PHE 166 Cb 0.03 -0.21 0.08 0.00 -0.34 0.00 0.00 43.02 42.58 1lgc s PHE 166 CO -0.05 -0.09 0.27 1.21 -1.46 0.00 0.00 175.22 175.10 1lgc s ASN 167 N 1.00 5.64 0.40 6.13 3.84 -1.21 -1.54 114.94 129.20 1lgc s ASN 167 Ca -0.08 -1.57 0.17 0.00 0.21 0.00 0.00 52.86 51.58 1lgc s ASN 167 Cb -0.12 -1.99 1.06 0.00 -0.55 0.00 0.00 41.25 39.65 1lgc s ASN 167 CO -0.03 -0.56 1.82 1.23 -2.79 0.00 0.00 177.10 176.77 1lgc h GLY 168 N 8.40 1.05 0.36 1.21 0.00 -1.79 1.23 103.07 113.54 1lgc h GLY 168 Ca -0.22 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 1lgc h GLY 168 CO 0.77 -0.05 -0.17 0.00 0.00 0.00 0.00 176.54 177.09 1lgc h ALA 169 N 1.61 -0.66 -0.00 3.60 0.00 -1.87 -3.31 119.26 118.63 1lgc h ALA 169 Ca 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1lgc h ALA 169 Cb 1.26 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1lgc h ALA 169 CO -0.23 -0.63 -0.05 0.25 0.00 0.00 0.00 179.25 178.60 1lgc n THR 170 N -4.16 0.00 -1.73 0.00 -2.24 -1.15 -4.92 114.28 100.08 1lgc n THR 170 Ca -0.06 -0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.54 1lgc n THR 170 Cb 0.19 -0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 67.93 1lgc n THR 170 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1lgc n ASN 171 N -1.48 -4.78 -4.60 3.42 3.02 0.42 -4.95 115.26 106.31 1lgc n ASN 171 Ca 0.07 0.35 -0.40 0.00 -0.03 0.00 0.00 54.58 54.57 1lgc n ASN 171 Cb 0.33 -4.22 -0.08 0.00 -0.61 0.00 0.00 39.78 35.21 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 -2.59 5.04 0.25 2.41 0.11 -1.24 -4.85 120.40 119.53 1lgc s VAL 172 Ca 0.00 0.72 -0.30 0.00 -2.93 0.00 0.00 61.98 59.47 1lgc s VAL 172 Cb 0.00 -3.88 -0.09 0.00 -1.53 0.00 0.00 36.38 30.88 1lgc s VAL 172 CO 0.00 -0.03 0.95 -0.22 -3.33 0.00 0.00 175.10 172.48 1lgc s LEU 173 N 2.37 4.62 -0.04 2.54 0.20 -1.26 -3.35 118.68 123.75 1lgc s LEU 173 Ca 0.21 1.97 0.02 0.00 0.69 0.00 0.00 54.13 57.02 1lgc s LEU 173 Cb -0.15 -3.64 0.01 0.00 -0.43 0.00 0.00 46.19 41.98 1lgc s LEU 173 CO 0.11 0.12 -0.09 -0.89 -0.29 0.00 0.00 176.35 175.30 1lgc s THR 174 N -1.21 0.88 -0.04 3.68 2.01 -0.46 -4.98 115.64 115.51 1lgc s THR 174 Ca 0.42 -0.36 0.02 0.00 0.31 0.00 0.00 61.69 62.08 1lgc s THR 174 Cb -0.26 -0.81 0.01 0.00 0.01 0.00 0.00 72.50 71.45 1lgc s THR 174 CO 0.32 0.29 -0.10 0.54 -0.69 0.00 0.00 174.62 174.98 1lgc s VAL 175 N 0.51 0.89 -0.02 3.82 0.11 -1.26 -1.06 120.40 123.38 1lgc s VAL 175 Ca -0.09 -0.37 0.00 0.00 -2.93 0.00 0.00 61.98 58.59 1lgc s VAL 175 Cb -0.13 -0.82 0.03 0.00 -1.53 0.00 0.00 36.38 33.93 1lgc s VAL 175 CO 0.02 0.29 0.01 -0.44 -3.33 0.00 0.00 175.10 171.65 1lgc s SER 176 N 0.51 0.25 0.05 3.54 0.01 -0.12 -4.97 113.70 112.97 1lgc s SER 176 Ca -0.09 0.00 0.09 0.00 1.31 0.00 0.00 55.95 57.26 1lgc s SER 176 Cb -0.13 -0.15 -0.03 0.00 0.21 0.00 0.00 66.02 65.93 1lgc s SER 176 CO 0.02 -0.11 -0.24 -0.22 0.41 0.00 0.00 173.24 173.10 1lgc s LEU 177 N 1.01 2.32 -0.13 2.44 0.20 -1.26 0.42 118.68 123.68 1lgc s LEU 177 Ca -0.09 -0.54 -0.07 0.00 0.69 0.00 0.00 54.13 54.11 1lgc s LEU 177 Cb -0.13 -1.36 0.05 0.00 -0.43 0.00 0.00 46.19 44.32 1lgc s LEU 177 CO -0.02 0.25 0.31 -0.89 -0.29 0.00 0.00 176.35 175.71 1lgc s THR 178 N -0.86 -0.04 -0.57 3.68 2.01 -0.06 -4.94 115.64 114.87 1lgc s THR 178 Ca 0.13 0.13 -0.14 0.00 0.31 0.00 0.00 61.69 62.12 1lgc s THR 178 Cb -0.10 -0.47 0.14 0.00 0.01 0.00 0.00 72.50 72.08 1lgc s THR 178 CO 0.03 0.05 0.50 -0.31 -0.69 0.00 0.00 174.62 174.21 1lgc s TYR 179 N 1.33 3.36 -0.00 4.92 2.02 -1.26 -0.69 117.35 127.04 1lgc s TYR 179 Ca -0.09 -1.55 -0.30 0.00 -0.37 0.00 0.00 57.07 54.76 1lgc s TYR 179 Cb -0.10 -3.73 -0.06 0.00 -0.40 0.00 0.00 41.96 37.68 1lgc s TYR 179 CO -0.10 -1.01 1.48 -2.14 -1.57 0.00 0.00 175.55 172.21 1lgc s PRO 180 N 1.31 4.25 0.00 -1.71 0.02 -1.26 -5.08 135.00 132.53 1lgc s PRO 180 Ca 0.06 2.05 0.00 0.00 0.02 0.00 0.00 61.00 63.13 1lgc s PRO 180 Cb -0.26 -3.64 0.00 0.00 0.02 0.00 0.00 34.50 30.61 1lgc s PRO 180 CO 0.00 -0.65 0.00 0.09 -0.33 0.00 0.00 177.00 176.11