#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lid h ASP 2 N 0.00 0.33 0.53 0.00 5.19 -2.02 -1.15 116.42 119.30 1lid h ASP 2 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1lid h ASP 2 Cb 0.00 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.43 1lid h ASP 2 CO 0.00 0.23 0.00 0.00 -3.12 0.00 0.00 179.24 176.35 1lid n ALA 3 N -2.50 1.50 0.18 3.45 0.00 -1.26 -2.59 120.51 119.29 1lid n ALA 3 Ca 0.03 0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.69 1lid n ALA 3 Cb 0.15 -1.35 -0.10 0.00 0.00 0.00 0.00 19.45 18.15 1lid n ALA 3 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1lid n PHE 4 N -2.19 0.27 -1.99 0.00 3.72 -0.44 -4.98 117.46 111.86 1lid n PHE 4 Ca 0.01 0.08 -0.41 0.00 -0.05 0.00 0.00 57.45 57.08 1lid n PHE 4 Cb 0.18 -0.56 -0.02 0.00 -0.94 0.00 0.00 39.48 38.13 1lid n PHE 4 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1lid s VAL 5 N -3.39 2.59 -5.00 -4.37 1.01 -1.07 -4.59 120.40 105.57 1lid s VAL 5 Ca -0.03 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1lid s VAL 5 Cb 0.13 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1lid s VAL 5 CO 0.86 0.08 0.00 0.61 0.00 0.00 0.00 175.10 176.65 1lid n GLY 6 N 2.18 0.70 3.44 4.51 0.00 -0.70 -4.96 105.19 110.37 1lid n GLY 6 Ca 0.07 -1.87 -0.33 0.00 0.00 0.00 0.00 46.02 43.89 1lid n GLY 6 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lid s THR 7 N -1.56 3.41 0.04 2.61 2.01 -1.26 -1.18 115.64 119.70 1lid s THR 7 Ca 0.00 -0.54 0.07 0.00 0.31 0.00 0.00 61.69 61.52 1lid s THR 7 Cb 0.00 -2.44 -0.02 0.00 0.01 0.00 0.00 72.50 70.04 1lid s THR 7 CO 0.00 0.53 -0.19 0.26 -0.69 0.00 0.00 174.62 174.53 1lid s TRP 8 N 0.15 1.66 0.02 4.92 0.52 0.32 -1.21 118.94 125.33 1lid s TRP 8 Ca -0.05 -0.36 0.07 0.00 0.02 0.00 0.00 56.10 55.78 1lid s TRP 8 Cb -0.14 -0.99 -0.02 0.00 -1.15 0.00 0.00 33.47 31.16 1lid s TRP 8 CO 0.04 0.07 -0.21 -1.59 0.02 0.00 0.00 176.95 175.28 1lid s LYS 9 N -1.12 1.54 0.21 4.98 -2.85 0.24 -0.83 119.74 121.91 1lid s LYS 9 Ca 0.06 -0.86 -0.31 0.00 -1.00 0.00 0.00 55.97 53.86 1lid s LYS 9 Cb -0.08 -1.58 -0.10 0.00 -2.06 0.00 0.00 37.83 34.00 1lid s LYS 9 CO 0.02 0.42 1.48 -1.17 0.10 0.00 0.00 175.35 176.19 1lid s LEU 10 N -0.87 4.38 -0.10 2.77 2.96 -1.03 -1.46 118.68 125.33 1lid s LEU 10 Ca 0.08 2.63 -0.01 0.00 -0.22 0.00 0.00 54.13 56.61 1lid s LEU 10 Cb -0.08 -3.61 -0.06 0.00 0.50 0.00 0.00 46.19 42.94 1lid s LEU 10 CO 0.01 -0.74 -0.09 0.52 -1.32 0.00 0.00 176.35 174.72 1lid n VAL 11 N 2.96 0.55 -3.70 1.68 0.31 0.44 -4.90 118.33 115.67 1lid n VAL 11 Ca 0.09 -0.19 -0.12 0.00 -0.01 0.00 0.00 64.34 64.11 1lid n VAL 11 Cb 0.40 -1.02 -0.07 0.00 -0.91 0.00 0.00 33.84 32.24 1lid n VAL 11 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1lid s SER 12 N -5.15 -0.20 -0.01 4.52 1.04 -1.06 -4.99 113.70 107.86 1lid s SER 12 Ca -0.13 -0.13 0.01 0.00 0.48 0.00 0.00 55.95 56.17 1lid s SER 12 Cb 0.04 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1lid s SER 12 CO 0.21 -0.67 -0.01 -0.55 0.98 0.00 0.00 173.24 173.20 1lid s SER 13 N -2.13 0.23 -0.08 7.02 0.15 -1.26 -1.14 113.70 116.50 1lid s SER 13 Ca -0.04 -0.03 0.01 0.00 0.70 0.00 0.00 55.95 56.60 1lid s SER 13 Cb -0.00 -0.06 0.02 0.00 -1.71 0.00 0.00 66.02 64.27 1lid s SER 13 CO -0.04 -0.01 -0.10 -0.70 1.20 0.00 0.00 173.24 173.59 1lid s GLU 14 N 0.19 1.55 -2.07 5.44 2.12 -0.11 -4.86 118.70 120.96 1lid s GLU 14 Ca -0.02 -0.33 0.00 0.00 0.36 0.00 0.00 54.97 54.98 1lid s GLU 14 Cb -0.03 -1.39 0.00 0.00 0.26 0.00 0.00 34.13 32.96 1lid s GLU 14 CO -0.01 -0.07 0.00 0.09 -0.54 0.00 0.00 175.26 174.74 1lid n ASN 15 N 4.16 -5.58 0.07 -1.70 3.02 -1.26 -1.89 115.26 112.08 1lid n ASN 15 Ca -0.20 0.37 -0.05 0.00 -0.03 0.00 0.00 54.58 54.67 1lid n ASN 15 Cb 0.51 -4.81 0.14 0.00 -0.61 0.00 0.00 39.78 35.01 1lid n ASN 15 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1lid h PHE 16 N 0.00 0.36 -0.56 3.10 3.57 -1.90 -1.69 116.94 119.83 1lid h PHE 16 Ca -0.44 -0.13 -0.09 0.00 3.53 0.00 0.00 57.97 60.85 1lid h PHE 16 Cb 1.35 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.99 1lid h PHE 16 CO 0.57 0.77 -0.00 0.22 -2.23 0.00 0.00 178.31 177.63 1lid h ASP 17 N 0.23 0.94 -0.81 0.41 3.58 -1.96 -0.51 116.42 118.30 1lid h ASP 17 Ca 0.00 -0.26 -0.03 0.00 0.42 0.00 0.00 57.03 57.16 1lid h ASP 17 Cb 1.02 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 41.78 1lid h ASP 17 CO 0.09 1.00 0.37 0.44 -2.88 0.00 0.00 179.24 178.26 1lid h ASP 18 N 0.89 1.08 -0.28 2.28 3.32 -1.87 -0.03 116.42 121.80 1lid h ASP 18 Ca 0.16 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1lid h ASP 18 Cb 0.53 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1lid h ASP 18 CO 0.03 0.92 0.14 0.22 -1.72 0.00 0.00 179.24 178.83 1lid h TYR 19 N 1.17 0.40 -0.46 4.55 3.20 -0.86 -1.65 116.97 123.32 1lid h TYR 19 Ca 0.28 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.09 1lid h TYR 19 Cb 0.15 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 1lid h TYR 19 CO 0.02 0.36 0.13 0.52 -1.64 0.00 0.00 178.16 177.54 1lid h MET 20 N 0.32 0.68 -0.41 1.82 2.86 -0.73 -1.20 114.93 118.28 1lid h MET 20 Ca 0.10 -0.12 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1lid h MET 20 Cb 0.11 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 1lid h MET 20 CO -0.01 0.60 0.16 0.87 1.06 0.00 0.00 176.91 179.59 1lid h LYS 21 N 0.66 0.62 -0.65 1.72 1.57 -0.67 -1.10 116.57 118.71 1lid h LYS 21 Ca 0.15 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1lid h LYS 21 Cb 0.22 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1lid h LYS 21 CO -0.01 0.59 0.34 1.49 -0.57 0.00 0.00 179.45 181.29 1lid h GLU 22 N 0.52 0.91 0.00 3.15 4.57 -0.66 -1.02 114.58 122.04 1lid h GLU 22 Ca 0.14 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.19 1lid h GLU 22 Cb 0.21 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1lid h GLU 22 CO -0.01 0.69 -0.08 0.28 -1.18 0.00 0.00 179.01 178.71 1lid h VAL 23 N 0.92 0.20 0.00 0.32 2.07 -0.92 -3.47 116.25 115.37 1lid h VAL 23 Ca 0.23 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 67.01 1lid h VAL 23 Cb 0.06 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1lid h VAL 23 CO -0.03 0.08 0.00 0.61 0.02 0.00 0.00 177.57 178.24 1lid n GLY 24 N 0.11 1.02 3.73 2.17 0.00 -0.39 -5.07 105.19 106.77 1lid n GLY 24 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1lid n GLY 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lid s VAL 25 N -2.00 3.84 0.82 1.61 1.01 -0.50 -5.01 120.40 120.18 1lid s VAL 25 Ca 0.00 1.52 -0.10 0.00 0.00 0.00 0.00 61.98 63.40 1lid s VAL 25 Cb 0.00 -3.97 0.09 0.00 0.00 0.00 0.00 36.38 32.50 1lid s VAL 25 CO 0.00 0.23 1.11 -0.83 0.00 0.00 0.00 175.10 175.61 1lid s GLY 26 N 0.16 1.68 0.14 4.51 0.00 -1.26 -4.65 107.32 107.90 1lid s GLY 26 Ca 0.52 0.37 -0.26 0.00 0.00 0.00 0.00 44.72 45.34 1lid s GLY 26 CO 0.34 0.74 1.60 -2.75 0.00 0.00 0.00 173.10 173.03 1lid h PHE 27 N -1.39 -0.97 -0.64 1.90 3.57 -1.99 -0.14 116.94 117.28 1lid h PHE 27 Ca -0.44 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.10 1lid h PHE 27 Cb 1.24 0.45 -0.03 0.00 2.79 0.00 0.00 35.95 40.40 1lid h PHE 27 CO 0.55 -0.42 0.35 0.00 -2.23 0.00 0.00 178.31 176.56 1lid h ALA 28 N 0.36 0.82 -0.46 2.41 0.00 -1.99 -0.29 119.26 120.11 1lid h ALA 28 Ca 0.10 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1lid h ALA 28 Cb 0.57 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1lid h ALA 28 CO -0.38 0.33 -0.08 1.15 0.00 0.00 0.00 179.25 180.27 1lid h THR 29 N 0.87 1.26 -0.61 0.00 2.02 -1.85 -0.78 112.91 113.81 1lid h THR 29 Ca 0.23 -1.15 -0.04 0.00 0.77 0.00 0.00 66.41 66.22 1lid h THR 29 Cb 0.04 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 1lid h THR 29 CO -0.04 0.40 0.22 0.03 0.37 0.00 0.00 175.52 176.50 1lid h ARG 30 N 0.75 0.89 -0.40 6.66 3.08 -0.50 -0.43 114.38 124.43 1lid h ARG 30 Ca 0.13 -0.15 -0.15 0.00 0.07 0.00 0.00 59.98 59.88 1lid h ARG 30 Cb 0.57 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 1lid h ARG 30 CO 0.04 0.75 -0.32 0.87 -1.07 0.00 0.00 179.97 180.23 1lid h LYS 31 N 0.88 0.92 -0.23 0.04 1.79 -0.55 -1.12 116.57 118.29 1lid h LYS 31 Ca 0.20 -0.46 -0.01 0.00 -2.18 0.00 0.00 60.65 58.21 1lid h LYS 31 Cb 0.20 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 1lid h LYS 31 CO -0.01 1.11 0.12 0.28 -1.08 0.00 0.00 179.45 179.87 1lid h VAL 32 N 0.74 1.12 -0.92 0.50 2.07 -0.84 -2.85 116.25 116.07 1lid h VAL 32 Ca 0.07 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.28 1lid h VAL 32 Cb 0.91 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.55 1lid h VAL 32 CO 0.08 0.12 0.61 0.00 0.02 0.00 0.00 177.57 178.40 1lid h ALA 33 N 1.00 1.37 0.00 1.67 0.00 -0.96 -0.79 119.26 121.55 1lid h ALA 33 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1lid h ALA 33 Cb 0.08 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1lid h ALA 33 CO -0.01 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.22 1lid n GLY 34 N -1.39 -1.34 0.06 0.00 0.00 -0.44 -2.28 105.19 99.79 1lid n GLY 34 Ca 0.11 0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.29 1lid n GLY 34 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1lid n MET 35 N -2.16 0.48 -2.74 1.61 2.81 -0.37 -4.95 117.12 111.80 1lid n MET 35 Ca 0.03 0.01 -0.39 0.00 -1.81 0.00 0.00 57.70 55.54 1lid n MET 35 Cb 0.27 -1.67 -0.06 0.00 -0.71 0.00 0.00 33.22 31.04 1lid n MET 35 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1lid s ALA 36 N -3.32 3.30 -0.71 3.04 0.00 -0.82 -5.00 121.76 118.25 1lid s ALA 36 Ca 0.00 0.61 0.05 0.00 0.00 0.00 0.00 51.96 52.61 1lid s ALA 36 Cb 0.12 -3.21 0.18 0.00 0.00 0.00 0.00 23.12 20.22 1lid s ALA 36 CO 0.81 0.18 0.55 1.17 0.00 0.00 0.00 175.76 178.47 1lid n LYS 37 N 1.19 1.99 -1.35 0.00 4.81 -1.26 -5.02 118.16 118.53 1lid n LYS 37 Ca -0.01 -4.52 -0.31 0.00 -0.87 0.00 0.00 58.31 52.60 1lid n LYS 37 Cb 0.48 -2.29 0.09 0.00 0.02 0.00 0.00 35.03 33.32 1lid n LYS 37 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1lid s PRO 38 N -1.61 2.32 -0.09 1.64 0.02 -1.26 -4.73 135.00 131.28 1lid s PRO 38 Ca 0.27 1.24 -0.02 0.00 0.02 0.00 0.00 61.00 62.51 1lid s PRO 38 Cb -0.02 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.57 1lid s PRO 38 CO -0.15 -1.61 0.00 -0.80 -0.33 0.00 0.00 177.00 174.12 1lid s ASN 39 N -3.16 5.23 -0.14 2.53 0.02 -0.79 -2.45 114.94 116.17 1lid s ASN 39 Ca 0.63 0.13 -0.01 0.00 -1.02 0.00 0.00 52.86 52.58 1lid s ASN 39 Cb -0.18 -1.51 -0.02 0.00 0.02 0.00 0.00 41.25 39.56 1lid s ASN 39 CO 0.53 0.36 -0.10 -0.32 0.02 0.00 0.00 177.10 177.59 1lid s MET 40 N -0.76 3.46 -0.17 -0.60 -2.45 -0.01 -1.05 119.30 117.73 1lid s MET 40 Ca 0.12 -0.64 0.00 0.00 -1.25 0.00 0.00 55.69 53.93 1lid s MET 40 Cb -0.12 -2.74 0.01 0.00 1.25 0.00 0.00 34.83 33.23 1lid s MET 40 CO 0.02 0.19 -0.17 0.42 1.05 0.00 0.00 175.02 176.53 1lid s ILE 41 N 0.45 2.40 -0.08 10.11 1.01 0.10 -0.52 121.20 134.67 1lid s ILE 41 Ca -0.08 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 59.77 1lid s ILE 41 Cb -0.15 -2.01 -0.01 0.00 0.01 0.00 0.00 42.46 40.29 1lid s ILE 41 CO 0.04 0.52 -0.20 -0.63 0.00 0.00 0.00 174.94 174.67 1lid s ILE 42 N 1.07 2.47 0.05 2.92 1.01 -0.33 -0.92 121.20 127.47 1lid s ILE 42 Ca -0.01 -0.90 -0.04 0.00 0.00 0.00 0.00 60.65 59.70 1lid s ILE 42 Cb -0.14 -1.96 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1lid s ILE 42 CO -0.06 0.56 0.06 -0.94 0.00 0.00 0.00 174.94 174.57 1lid s SER 43 N -0.01 0.29 -0.02 3.58 1.04 -0.75 -1.72 113.70 116.10 1lid s SER 43 Ca -0.06 -0.74 0.03 0.00 0.48 0.00 0.00 55.95 55.66 1lid s SER 43 Cb -0.15 0.24 -0.00 0.00 0.10 0.00 0.00 66.02 66.21 1lid s SER 43 CO 0.05 -0.59 -0.12 -0.69 0.98 0.00 0.00 173.24 172.88 1lid s VAL 44 N -3.35 0.97 -0.25 5.02 1.01 -1.26 -0.66 120.40 121.88 1lid s VAL 44 Ca 0.01 -0.48 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 1lid s VAL 44 Cb 0.03 -0.84 0.10 0.00 0.00 0.00 0.00 36.38 35.67 1lid s VAL 44 CO -0.08 0.29 0.17 0.21 0.00 0.00 0.00 175.10 175.68 1lid s ASN 45 N 0.03 2.56 1.64 3.32 3.04 0.07 -5.01 114.94 120.59 1lid s ASN 45 Ca -0.01 -0.85 0.00 0.00 0.04 0.00 0.00 52.86 52.03 1lid s ASN 45 Cb -0.08 -0.05 0.00 0.00 -1.54 0.00 0.00 41.25 39.58 1lid s ASN 45 CO 0.01 -0.39 0.00 0.61 -3.04 0.00 0.00 177.10 174.28 1lid n GLY 46 N 5.28 2.84 1.53 1.21 0.00 -1.26 -1.98 105.19 112.81 1lid n GLY 46 Ca -0.05 -0.23 0.08 0.00 0.00 0.00 0.00 46.02 45.81 1lid n GLY 46 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1lid n ASP 47 N 6.87 5.04 -4.54 1.61 5.68 -1.26 -4.88 116.55 125.07 1lid n ASP 47 Ca 0.00 -2.91 -0.35 0.00 -0.50 0.00 0.00 54.79 51.02 1lid n ASP 47 Cb 0.00 -0.63 -0.11 0.00 -1.14 0.00 0.00 41.12 39.24 1lid n ASP 47 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1lid s LEU 48 N -2.70 3.61 -0.12 -2.12 1.43 -0.83 -4.36 118.68 113.60 1lid s LEU 48 Ca 0.50 -0.06 -0.05 0.00 -1.03 0.00 0.00 54.13 53.48 1lid s LEU 48 Cb 0.38 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 1lid s LEU 48 CO 0.14 0.08 0.08 -0.69 0.23 0.00 0.00 176.35 176.19 1lid s VAL 49 N 0.94 4.97 -0.07 -1.59 1.01 -0.10 -0.75 120.40 124.81 1lid s VAL 49 Ca 0.04 0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.08 1lid s VAL 49 Cb -0.14 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 1lid s VAL 49 CO 0.03 0.58 -0.25 -0.89 0.00 0.00 0.00 175.10 174.58 1lid s THR 50 N -0.72 2.04 -0.18 3.92 2.01 0.17 -1.45 115.64 121.43 1lid s THR 50 Ca 0.12 -1.05 0.01 0.00 0.31 0.00 0.00 61.69 61.09 1lid s THR 50 Cb -0.12 -1.74 0.03 0.00 0.01 0.00 0.00 72.50 70.68 1lid s THR 50 CO 0.03 0.56 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.74 1lid s ILE 51 N -0.00 1.80 -0.07 1.82 1.01 -0.16 -1.82 121.20 123.78 1lid s ILE 51 Ca -0.08 -0.89 0.03 0.00 0.00 0.00 0.00 60.65 59.71 1lid s ILE 51 Cb -0.15 -1.72 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 1lid s ILE 51 CO 0.05 0.39 -0.15 -0.60 0.00 0.00 0.00 174.94 174.63 1lid s ARG 52 N 1.37 2.69 -0.10 2.79 3.52 -0.10 -1.74 118.95 127.38 1lid s ARG 52 Ca 0.03 -0.72 0.04 0.00 -0.13 0.00 0.00 55.73 54.95 1lid s ARG 52 Cb -0.14 -2.40 0.00 0.00 -1.56 0.00 0.00 34.95 30.85 1lid s ARG 52 CO -0.11 0.51 -0.24 0.45 -0.81 0.00 0.00 175.30 175.11 1lid s SER 53 N -0.44 3.08 -0.10 -2.12 0.15 -0.15 -0.72 113.70 113.40 1lid s SER 53 Ca 0.05 -0.56 0.04 0.00 0.70 0.00 0.00 55.95 56.18 1lid s SER 53 Cb -0.12 -1.41 0.00 0.00 -1.71 0.00 0.00 66.02 62.78 1lid s SER 53 CO 0.02 0.16 -0.22 -1.61 1.20 0.00 0.00 173.24 172.78 1lid s GLU 54 N 0.36 2.90 0.20 5.44 2.02 -0.21 -0.58 118.70 128.83 1lid s GLU 54 Ca -0.18 -0.83 -0.08 0.00 0.02 0.00 0.00 54.97 53.90 1lid s GLU 54 Cb -0.18 -2.22 -0.02 0.00 0.10 0.00 0.00 34.13 31.81 1lid s GLU 54 CO 0.08 0.14 0.31 -1.54 0.02 0.00 0.00 175.26 174.27 1lid s SER 55 N 0.44 0.03 0.30 -0.19 1.04 -0.99 -1.88 113.70 112.44 1lid s SER 55 Ca -0.17 -1.05 0.01 0.00 0.48 0.00 0.00 55.95 55.22 1lid s SER 55 Cb -0.17 0.47 0.52 0.00 0.10 0.00 0.00 66.02 66.94 1lid s SER 55 CO 0.07 -0.96 1.91 0.71 0.98 0.00 0.00 173.24 175.95 1lid h THR 56 N 2.47 1.07 0.04 2.02 1.35 -2.00 -3.02 112.91 114.84 1lid h THR 56 Ca -0.31 -0.35 -0.16 0.00 -0.55 0.00 0.00 66.41 65.04 1lid h THR 56 Cb 1.24 -0.06 0.01 0.00 -1.73 0.00 0.00 68.15 67.62 1lid h THR 56 CO 0.45 0.19 -0.65 -0.26 -0.25 0.00 0.00 175.52 175.00 1lid h PHE 57 N 1.03 0.58 -2.03 4.73 0.04 -1.98 -3.48 116.94 115.84 1lid h PHE 57 Ca 0.39 -0.34 -0.03 0.00 2.80 0.00 0.00 57.97 60.79 1lid h PHE 57 Cb 0.20 -0.05 -0.21 0.00 2.20 0.00 0.00 35.95 38.08 1lid h PHE 57 CO -0.00 1.19 0.10 0.21 -0.60 0.00 0.00 178.31 179.21 1lid s LYS 58 N -2.98 0.81 -0.01 1.51 2.20 -1.14 -5.16 119.74 114.97 1lid s LYS 58 Ca -0.13 1.02 0.03 0.00 -0.36 0.00 0.00 55.97 56.53 1lid s LYS 58 Cb 0.03 0.36 -0.03 0.00 -1.51 0.00 0.00 37.83 36.67 1lid s LYS 58 CO 0.82 -0.11 -0.06 -0.80 -0.36 0.00 0.00 175.35 174.85 1lid s ASN 59 N 0.59 4.70 0.13 1.43 0.01 -1.26 -2.36 114.94 118.17 1lid s ASN 59 Ca -0.02 -0.10 0.06 0.00 -0.71 0.00 0.00 52.86 52.09 1lid s ASN 59 Cb -0.05 -1.13 -0.04 0.00 0.41 0.00 0.00 41.25 40.44 1lid s ASN 59 CO -0.03 0.30 -0.15 0.42 -1.51 0.00 0.00 177.10 176.13 1lid s THR 60 N -0.97 1.42 -0.17 1.60 -4.23 0.25 -4.97 115.64 108.57 1lid s THR 60 Ca 0.16 -1.73 -0.09 0.00 -1.18 0.00 0.00 61.69 58.85 1lid s THR 60 Cb -0.11 -1.57 0.06 0.00 1.34 0.00 0.00 72.50 72.21 1lid s THR 60 CO 0.07 -0.38 0.41 -0.70 -0.54 0.00 0.00 174.62 173.48 1lid s GLU 61 N -2.63 0.38 -0.00 3.99 2.12 -1.26 -0.97 118.70 120.32 1lid s GLU 61 Ca 0.10 0.79 0.05 0.00 0.36 0.00 0.00 54.97 56.27 1lid s GLU 61 Cb -0.05 -0.01 -0.01 0.00 0.26 0.00 0.00 34.13 34.31 1lid s GLU 61 CO 0.04 -0.16 -0.16 0.96 -0.54 0.00 0.00 175.26 175.39 1lid s ILE 62 N 1.45 1.30 -0.04 -3.70 -4.36 -0.71 -5.02 121.20 110.13 1lid s ILE 62 Ca -0.09 -0.76 0.03 0.00 -0.26 0.00 0.00 60.65 59.57 1lid s ILE 62 Cb -0.09 -1.09 0.00 0.00 1.25 0.00 0.00 42.46 42.53 1lid s ILE 62 CO -0.13 0.32 -0.13 -0.44 0.24 0.00 0.00 174.94 174.81 1lid s SER 63 N -0.51 1.72 0.14 4.36 0.01 -1.26 -0.99 113.70 117.18 1lid s SER 63 Ca 0.06 -0.28 -0.18 0.00 1.31 0.00 0.00 55.95 56.86 1lid s SER 63 Cb -0.07 -0.56 0.05 0.00 0.21 0.00 0.00 66.02 65.65 1lid s SER 63 CO -0.00 0.09 0.47 0.72 0.41 0.00 0.00 173.24 174.93 1lid s PHE 64 N 0.26 -0.31 -0.14 2.43 -0.71 -0.53 -4.96 117.98 114.01 1lid s PHE 64 Ca -0.06 0.03 -0.08 0.00 -1.04 0.00 0.00 56.93 55.78 1lid s PHE 64 Cb -0.12 0.37 -0.04 0.00 -1.21 0.00 0.00 43.02 42.02 1lid s PHE 64 CO 0.02 -0.77 0.12 0.21 -1.34 0.00 0.00 175.22 173.47 1lid s LYS 65 N -3.79 3.65 -0.03 1.99 2.20 -1.26 -0.93 119.74 121.57 1lid s LYS 65 Ca 0.03 -0.18 -0.30 0.00 -0.36 0.00 0.00 55.97 55.16 1lid s LYS 65 Cb 0.01 -3.23 -0.07 0.00 -1.51 0.00 0.00 37.83 33.03 1lid s LYS 65 CO -0.12 0.62 1.82 -0.51 -0.36 0.00 0.00 175.35 176.80 1lid s LEU 66 N -0.57 4.31 0.00 5.43 2.01 -1.26 -2.32 118.68 126.29 1lid s LEU 66 Ca 0.12 2.39 0.00 0.00 0.01 0.00 0.00 54.13 56.65 1lid s LEU 66 Cb -0.12 -3.53 0.00 0.00 0.01 0.00 0.00 46.19 42.55 1lid s LEU 66 CO 0.02 -1.05 0.00 0.61 1.01 0.00 0.00 176.35 176.94 1lid n GLY 67 N 4.42 0.37 3.37 -3.19 0.00 -0.04 -4.98 105.19 105.14 1lid n GLY 67 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 1lid n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lid s VAL 68 N -2.00 3.59 0.34 1.61 1.01 -0.98 -4.97 120.40 118.99 1lid s VAL 68 Ca 0.00 -0.43 -0.28 0.00 0.00 0.00 0.00 61.98 61.26 1lid s VAL 68 Cb 0.00 -2.62 -0.10 0.00 0.00 0.00 0.00 36.38 33.66 1lid s VAL 68 CO 0.00 0.43 1.31 -0.70 0.00 0.00 0.00 175.10 176.15 1lid s GLU 69 N 1.17 4.31 0.14 2.72 2.12 -1.26 -4.69 118.70 123.21 1lid s GLU 69 Ca 0.02 2.22 -0.06 0.00 0.36 0.00 0.00 54.97 57.51 1lid s GLU 69 Cb -0.14 -3.04 -0.02 0.00 0.26 0.00 0.00 34.13 31.19 1lid s GLU 69 CO -0.00 -0.23 0.19 -0.59 -0.54 0.00 0.00 175.26 174.09 1lid s PHE 70 N -1.15 0.50 0.10 5.30 -0.71 -0.03 -4.95 117.98 117.04 1lid s PHE 70 Ca 0.50 -0.89 -0.25 0.00 -1.04 0.00 0.00 56.93 55.25 1lid s PHE 70 Cb -0.40 -0.20 -0.07 0.00 -1.21 0.00 0.00 43.02 41.15 1lid s PHE 70 CO 0.53 -0.62 0.77 -0.51 -1.34 0.00 0.00 175.22 174.05 1lid s ASP 71 N -2.97 7.30 -0.00 1.98 1.01 -1.26 -0.53 116.67 122.19 1lid s ASP 71 Ca 0.17 1.55 0.01 0.00 0.71 0.00 0.00 52.55 54.98 1lid s ASP 71 Cb 0.05 -2.48 -0.00 0.00 1.01 0.00 0.00 42.92 41.49 1lid s ASP 71 CO -0.02 0.11 -0.03 -0.70 0.21 0.00 0.00 175.17 174.74 1lid s GLU 72 N -0.57 0.26 -0.26 8.23 2.12 -0.57 -4.93 118.70 122.99 1lid s GLU 72 Ca 0.37 -0.10 -0.05 0.00 0.36 0.00 0.00 54.97 55.55 1lid s GLU 72 Cb -0.22 -0.26 -0.00 0.00 0.26 0.00 0.00 34.13 33.91 1lid s GLU 72 CO 0.25 0.06 0.02 0.42 -0.54 0.00 0.00 175.26 175.47 1lid s ILE 73 N -0.02 3.74 0.81 -3.70 1.01 -1.26 -0.70 121.20 121.08 1lid s ILE 73 Ca 0.01 -0.55 -0.12 0.00 0.00 0.00 0.00 60.65 59.99 1lid s ILE 73 Cb -0.02 -2.81 0.08 0.00 0.01 0.00 0.00 42.46 39.71 1lid s ILE 73 CO -0.00 0.26 1.14 0.42 0.00 0.00 0.00 174.94 176.76 1lid s THR 74 N 1.50 2.46 0.57 2.92 -4.23 0.05 -4.89 115.64 114.01 1lid s THR 74 Ca 0.04 0.15 0.25 0.00 -1.18 0.00 0.00 61.69 60.96 1lid s THR 74 Cb -0.16 -3.07 0.34 0.00 1.34 0.00 0.00 72.50 70.96 1lid s THR 74 CO 0.00 -0.19 2.15 0.00 -0.54 0.00 0.00 174.62 176.04 1lid h ALA 75 N -1.06 1.84 -0.56 3.99 0.00 -1.97 0.12 119.26 121.62 1lid h ALA 75 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1lid h ALA 75 Cb 1.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1lid h ALA 75 CO 0.64 -0.16 0.00 -0.40 0.00 0.00 0.00 179.25 179.33 1lid n ASP 76 N -4.06 4.09 -2.85 0.00 5.75 -1.26 -4.95 116.55 113.26 1lid n ASP 76 Ca -0.00 -2.35 -0.20 0.00 -0.01 0.00 0.00 54.79 52.23 1lid n ASP 76 Cb 0.22 -0.53 0.05 0.00 -1.03 0.00 0.00 41.12 39.83 1lid n ASP 76 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1lid n ASP 77 N 0.97 -5.61 -4.85 -1.12 8.00 0.43 -5.03 116.55 109.34 1lid n ASP 77 Ca 0.22 -0.35 -0.35 0.00 0.71 0.00 0.00 54.79 55.03 1lid n ASP 77 Cb 0.76 -4.33 -0.06 0.00 -0.02 0.00 0.00 41.12 37.47 1lid n ASP 77 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1lid s ARG 78 N -5.80 3.96 -0.36 -1.24 0.52 -1.26 -4.83 118.95 109.93 1lid s ARG 78 Ca 0.37 0.48 -0.13 0.00 -0.52 0.00 0.00 55.73 55.93 1lid s ARG 78 Cb -0.16 -2.86 0.00 0.00 0.52 0.00 0.00 34.95 32.45 1lid s ARG 78 CO 0.46 0.44 0.24 0.15 0.02 0.00 0.00 175.30 176.61 1lid s LYS 79 N -2.14 3.20 0.26 3.54 1.02 -1.26 -0.77 119.74 123.59 1lid s LYS 79 Ca 0.40 -0.84 0.06 0.00 0.02 0.00 0.00 55.97 55.61 1lid s LYS 79 Cb -0.14 -3.82 -0.06 0.00 -0.52 0.00 0.00 37.83 33.29 1lid s LYS 79 CO 0.19 -0.58 -0.06 0.14 -0.92 0.00 0.00 175.35 174.13 1lid s VAL 80 N 1.67 1.57 -0.22 3.17 -7.23 0.13 -4.83 120.40 114.66 1lid s VAL 80 Ca 0.05 -2.12 -0.09 0.00 -1.81 0.00 0.00 61.98 58.01 1lid s VAL 80 Cb -0.18 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.32 1lid s VAL 80 CO 0.09 -0.34 0.11 -0.54 -0.31 0.00 0.00 175.10 174.12 1lid s LYS 81 N -3.74 3.99 0.12 4.82 -0.14 -0.53 -1.51 119.74 122.75 1lid s LYS 81 Ca 0.29 -0.32 0.11 0.00 -1.36 0.00 0.00 55.97 54.68 1lid s LYS 81 Cb 0.04 -3.40 -0.04 0.00 -1.68 0.00 0.00 37.83 32.75 1lid s LYS 81 CO 0.11 0.11 -0.26 -1.12 -0.76 0.00 0.00 175.35 173.42 1lid s SER 82 N 0.87 3.23 -0.03 2.83 0.01 0.31 -1.32 113.70 119.59 1lid s SER 82 Ca 0.06 -0.72 -0.01 0.00 1.31 0.00 0.00 55.95 56.58 1lid s SER 82 Cb -0.13 -0.22 0.02 0.00 0.21 0.00 0.00 66.02 65.90 1lid s SER 82 CO 0.03 0.18 0.07 -0.51 0.41 0.00 0.00 173.24 173.42 1lid s ILE 83 N -1.03 -0.04 -0.08 1.44 2.07 -0.79 -0.85 121.20 121.92 1lid s ILE 83 Ca 0.13 0.14 0.03 0.00 -1.41 0.00 0.00 60.65 59.54 1lid s ILE 83 Cb -0.10 -0.13 0.00 0.00 0.13 0.00 0.00 42.46 42.37 1lid s ILE 83 CO 0.05 0.06 -0.19 -0.63 -1.91 0.00 0.00 174.94 172.32 1lid s ILE 84 N 0.76 1.66 0.32 2.00 1.01 -1.26 -1.14 121.20 124.54 1lid s ILE 84 Ca -0.06 -0.79 0.08 0.00 0.00 0.00 0.00 60.65 59.88 1lid s ILE 84 Cb -0.08 -1.46 -0.06 0.00 0.01 0.00 0.00 42.46 40.87 1lid s ILE 84 CO -0.03 0.47 -0.08 0.42 0.00 0.00 0.00 174.94 175.72 1lid s THR 85 N 0.44 2.00 -0.31 2.92 -4.23 -0.60 -0.86 115.64 115.01 1lid s THR 85 Ca -0.16 -2.18 -0.05 0.00 -1.18 0.00 0.00 61.69 58.12 1lid s THR 85 Cb -0.17 -2.56 0.03 0.00 1.34 0.00 0.00 72.50 71.14 1lid s THR 85 CO 0.06 -0.24 0.07 -0.22 -0.54 0.00 0.00 174.62 173.75 1lid s LEU 86 N -3.54 4.00 -0.09 4.79 2.96 -1.26 -1.01 118.68 124.53 1lid s LEU 86 Ca 0.31 -0.99 -0.02 0.00 -0.22 0.00 0.00 54.13 53.21 1lid s LEU 86 Cb 0.03 -1.83 0.03 0.00 0.50 0.00 0.00 46.19 44.92 1lid s LEU 86 CO 0.15 -0.26 0.01 -1.81 -1.32 0.00 0.00 176.35 173.12 1lid s ASP 87 N 1.41 1.79 -1.46 3.68 1.01 -0.35 -4.83 116.67 117.92 1lid s ASP 87 Ca -0.01 -0.20 -0.03 0.00 0.71 0.00 0.00 52.55 53.03 1lid s ASP 87 Cb -0.18 -0.46 0.00 0.00 1.01 0.00 0.00 42.92 43.29 1lid s ASP 87 CO 0.01 -0.21 0.37 0.61 0.21 0.00 0.00 175.17 176.16 1lid n GLY 88 N 5.14 -0.39 2.49 0.21 0.00 -1.26 -1.44 105.19 109.94 1lid n GLY 88 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1lid n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lid n GLY 89 N -1.31 0.53 3.46 -0.02 0.00 -1.26 -5.03 105.19 101.55 1lid n GLY 89 Ca -0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 1lid n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lid s ALA 90 N -2.29 2.60 -0.29 4.61 0.00 -0.52 -4.65 121.76 121.22 1lid s ALA 90 Ca 0.00 -1.44 -0.20 0.00 0.00 0.00 0.00 51.96 50.32 1lid s ALA 90 Cb 0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.57 1lid s ALA 90 CO 0.00 0.54 0.61 -0.51 0.00 0.00 0.00 175.76 176.40 1lid s LEU 91 N -2.26 4.12 -0.25 0.00 1.43 -0.28 -1.21 118.68 120.24 1lid s LEU 91 Ca 0.18 0.50 -0.04 0.00 -1.03 0.00 0.00 54.13 53.73 1lid s LEU 91 Cb -0.10 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.33 1lid s LEU 91 CO 0.09 -0.42 -0.02 -0.69 0.23 0.00 0.00 176.35 175.54 1lid s VAL 92 N 2.53 3.39 -0.15 -1.59 1.01 -0.18 -1.04 120.40 124.37 1lid s VAL 92 Ca 0.25 -0.67 -0.03 0.00 0.00 0.00 0.00 61.98 61.52 1lid s VAL 92 Cb -0.15 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 1lid s VAL 92 CO 0.11 0.28 -0.05 -1.58 0.00 0.00 0.00 175.10 173.86 1lid s GLN 93 N 1.44 3.64 -0.12 2.72 0.74 0.15 -1.55 119.66 126.68 1lid s GLN 93 Ca 0.04 -0.54 0.02 0.00 0.05 0.00 0.00 55.36 54.93 1lid s GLN 93 Cb -0.16 -2.89 -0.00 0.00 1.10 0.00 0.00 33.01 31.06 1lid s GLN 93 CO -0.02 0.23 -0.20 0.08 -0.55 0.00 0.00 175.29 174.83 1lid s VAL 94 N 0.38 2.41 -0.12 1.34 1.01 -0.30 -1.04 120.40 124.08 1lid s VAL 94 Ca -0.05 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 1lid s VAL 94 Cb -0.14 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.25 1lid s VAL 94 CO 0.03 0.54 -0.11 -1.10 0.00 0.00 0.00 175.10 174.47 1lid s GLN 95 N 0.43 3.28 -0.04 2.72 -0.21 -0.39 -1.89 119.66 123.56 1lid s GLN 95 Ca -0.14 -0.64 0.06 0.00 0.02 0.00 0.00 55.36 54.65 1lid s GLN 95 Cb -0.17 -2.65 -0.01 0.00 1.00 0.00 0.00 33.01 31.18 1lid s GLN 95 CO 0.06 0.31 -0.21 0.15 -2.12 0.00 0.00 175.29 173.49 1lid s LYS 96 N 0.11 1.96 -0.22 2.91 1.02 -0.44 -1.75 119.74 123.34 1lid s LYS 96 Ca -0.05 -0.74 -0.26 0.00 0.02 0.00 0.00 55.97 54.93 1lid s LYS 96 Cb -0.14 -1.75 0.08 0.00 -0.52 0.00 0.00 37.83 35.49 1lid s LYS 96 CO 0.04 0.36 0.77 1.67 -0.92 0.00 0.00 175.35 177.27 1lid s TRP 97 N -0.22 -0.70 -1.64 3.18 -2.14 -0.58 -1.45 118.94 115.39 1lid s TRP 97 Ca 0.01 1.60 -0.18 0.00 2.66 0.00 0.00 56.10 60.19 1lid s TRP 97 Cb -0.11 0.32 0.15 0.00 -3.10 0.00 0.00 33.47 30.73 1lid s TRP 97 CO 0.01 -0.40 0.76 -0.25 -2.66 0.00 0.00 176.95 174.41 1lid n ASP 98 N 2.17 -3.38 0.00 -2.66 8.00 -1.26 0.04 116.55 119.46 1lid n ASP 98 Ca -0.15 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.43 1lid n ASP 98 Cb 0.56 -2.77 0.00 0.00 -0.02 0.00 0.00 41.12 38.89 1lid n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lid n GLY 99 N -1.35 0.45 3.70 0.44 0.00 -1.26 -5.01 105.19 102.16 1lid n GLY 99 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1lid n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lid s LYS 100 N -0.42 2.38 0.07 1.61 1.02 0.11 -5.15 119.74 119.36 1lid s LYS 100 Ca 0.00 -1.47 -0.15 0.00 0.02 0.00 0.00 55.97 54.38 1lid s LYS 100 Cb 0.00 -2.19 0.03 0.00 -0.52 0.00 0.00 37.83 35.14 1lid s LYS 100 CO 0.00 0.23 0.34 -1.54 -0.92 0.00 0.00 175.35 173.47 1lid s SER 101 N -3.78 -0.16 0.01 2.83 1.04 -1.26 -1.52 113.70 110.86 1lid s SER 101 Ca 0.35 -0.24 -0.06 0.00 0.48 0.00 0.00 55.95 56.47 1lid s SER 101 Cb -0.04 0.41 -0.00 0.00 0.10 0.00 0.00 66.02 66.48 1lid s SER 101 CO 0.22 -0.71 0.10 0.28 0.98 0.00 0.00 173.24 174.11 1lid s THR 102 N -3.09 0.10 -0.08 2.02 -1.32 -0.71 -4.72 115.64 107.83 1lid s THR 102 Ca -0.01 -0.81 0.03 0.00 -1.21 0.00 0.00 61.69 59.69 1lid s THR 102 Cb 0.01 -0.50 -0.01 0.00 -1.51 0.00 0.00 72.50 70.48 1lid s THR 102 CO -0.07 -0.44 -0.19 -0.89 -2.21 0.00 0.00 174.62 170.82 1lid s THR 103 N -1.65 2.61 -0.18 5.08 2.01 -0.99 -1.26 115.64 121.25 1lid s THR 103 Ca -0.13 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.03 1lid s THR 103 Cb -0.07 -2.02 0.04 0.00 0.01 0.00 0.00 72.50 70.46 1lid s THR 103 CO -0.00 0.56 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.74 1lid s ILE 104 N -0.07 1.66 -0.15 1.82 1.01 -0.21 -0.91 121.20 124.36 1lid s ILE 104 Ca -0.04 -0.91 -0.03 0.00 0.00 0.00 0.00 60.65 59.66 1lid s ILE 104 Cb -0.14 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.63 1lid s ILE 104 CO 0.04 0.27 -0.05 -0.75 0.00 0.00 0.00 174.94 174.45 1lid s LYS 105 N 1.41 3.59 -0.18 2.79 2.20 0.23 -0.67 119.74 129.11 1lid s LYS 105 Ca 0.01 -0.54 -0.01 0.00 -0.36 0.00 0.00 55.97 55.07 1lid s LYS 105 Cb -0.15 -2.86 0.00 0.00 -1.51 0.00 0.00 37.83 33.31 1lid s LYS 105 CO -0.09 0.26 -0.14 1.03 -0.36 0.00 0.00 175.35 176.05 1lid s ARG 106 N 0.29 3.20 0.05 4.03 0.52 -0.21 -0.75 118.95 126.07 1lid s ARG 106 Ca -0.04 -0.74 -0.02 0.00 -0.52 0.00 0.00 55.73 54.40 1lid s ARG 106 Cb -0.14 -2.70 -0.03 0.00 0.52 0.00 0.00 34.95 32.60 1lid s ARG 106 CO 0.03 -0.09 0.01 -1.59 0.02 0.00 0.00 175.30 173.68 1lid s LYS 107 N 1.09 0.60 0.09 3.54 -2.85 -0.33 -1.13 119.74 120.75 1lid s LYS 107 Ca 0.00 -1.05 -0.13 0.00 -1.00 0.00 0.00 55.97 53.79 1lid s LYS 107 Cb -0.14 0.21 -0.06 0.00 -2.06 0.00 0.00 37.83 35.78 1lid s LYS 107 CO -0.04 -0.12 0.46 1.03 0.10 0.00 0.00 175.35 176.77 1lid s ARG 108 N -3.44 3.88 -0.24 1.78 1.81 -1.26 -0.58 118.95 120.90 1lid s ARG 108 Ca 0.02 0.34 -0.03 0.00 -1.72 0.00 0.00 55.73 54.34 1lid s ARG 108 Cb 0.04 -3.03 0.10 0.00 -0.45 0.00 0.00 34.95 31.61 1lid s ARG 108 CO -0.08 0.56 0.18 0.34 -0.68 0.00 0.00 175.30 175.62 1lid s ASP 109 N -1.59 2.34 1.78 0.23 -1.08 -0.39 -4.90 116.67 113.05 1lid s ASP 109 Ca 0.33 -0.75 0.00 0.00 -0.52 0.00 0.00 52.55 51.60 1lid s ASP 109 Cb -0.15 0.04 0.00 0.00 -1.46 0.00 0.00 42.92 41.35 1lid s ASP 109 CO 0.18 -0.38 0.00 0.61 0.52 0.00 0.00 175.17 176.10 1lid n GLY 110 N 5.29 3.13 0.99 2.66 0.00 -1.26 -1.25 105.19 114.74 1lid n GLY 110 Ca -0.05 -0.17 0.10 0.00 0.00 0.00 0.00 46.02 45.90 1lid n GLY 110 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1lid n ASP 111 N 6.27 2.90 -4.81 1.61 5.68 -1.26 -4.96 116.55 121.99 1lid n ASP 111 Ca 0.00 -1.94 -0.22 0.00 -0.50 0.00 0.00 54.79 52.13 1lid n ASP 111 Cb 0.00 -0.29 -0.05 0.00 -1.14 0.00 0.00 41.12 39.64 1lid n ASP 111 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1lid s LYS 112 N -1.42 2.72 -0.14 0.11 1.02 -0.38 -4.56 119.74 117.09 1lid s LYS 112 Ca 0.37 -1.25 -0.01 0.00 0.02 0.00 0.00 55.97 55.11 1lid s LYS 112 Cb 0.20 -2.44 -0.02 0.00 -0.52 0.00 0.00 37.83 35.05 1lid s LYS 112 CO 0.28 0.24 -0.11 -1.17 -0.92 0.00 0.00 175.35 173.66 1lid s LEU 113 N -3.89 2.82 -0.11 3.17 0.20 -0.57 -1.27 118.68 119.02 1lid s LEU 113 Ca 0.37 -0.30 0.01 0.00 0.69 0.00 0.00 54.13 54.90 1lid s LEU 113 Cb -0.06 -1.65 -0.01 0.00 -0.43 0.00 0.00 46.19 44.04 1lid s LEU 113 CO 0.25 0.16 -0.15 -0.69 -0.29 0.00 0.00 176.35 175.63 1lid s VAL 114 N 0.40 2.91 -0.20 1.68 1.01 0.25 -0.49 120.40 125.96 1lid s VAL 114 Ca -0.09 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.13 1lid s VAL 114 Cb -0.16 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 1lid s VAL 114 CO 0.05 0.54 -0.04 -0.69 0.00 0.00 0.00 175.10 174.96 1lid s VAL 115 N 0.19 3.55 -0.17 2.92 1.01 0.29 -1.18 120.40 127.00 1lid s VAL 115 Ca -0.09 -0.45 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 1lid s VAL 115 Cb -0.15 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.61 1lid s VAL 115 CO 0.05 0.43 -0.08 -0.70 0.00 0.00 0.00 175.10 174.81 1lid s GLU 116 N 1.19 3.42 -0.12 2.72 2.12 0.07 -0.76 118.70 127.33 1lid s GLU 116 Ca 0.02 -0.64 0.01 0.00 0.36 0.00 0.00 54.97 54.73 1lid s GLU 116 Cb -0.14 -2.84 -0.01 0.00 0.26 0.00 0.00 34.13 31.40 1lid s GLU 116 CO -0.00 0.03 -0.17 0.00 -0.54 0.00 0.00 175.26 174.58 1lid s VAL 118 N 0.40 1.21 -0.12 0.00 1.01 -0.08 -1.03 120.40 121.79 1lid s VAL 118 Ca -0.13 -0.50 -0.03 0.00 0.00 0.00 0.00 61.98 61.32 1lid s VAL 118 Cb -0.16 -1.12 0.05 0.00 0.00 0.00 0.00 36.38 35.15 1lid s VAL 118 CO 0.06 0.38 0.06 -0.32 0.00 0.00 0.00 175.10 175.28 1lid s MET 119 N 0.82 0.15 -1.36 2.72 1.75 -0.49 -2.36 119.30 120.53 1lid s MET 119 Ca -0.11 0.04 -0.15 0.00 -1.25 0.00 0.00 55.69 54.22 1lid s MET 119 Cb -0.15 -1.38 0.02 0.00 2.84 0.00 0.00 34.83 36.15 1lid s MET 119 CO 0.02 -0.53 0.40 1.63 -0.65 0.00 0.00 175.02 175.89 1lid n LYS 120 N 5.24 -1.14 0.00 4.11 5.02 -1.26 -1.14 118.16 128.99 1lid n LYS 120 Ca -0.06 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1lid n LYS 120 Cb 0.49 -3.44 0.00 0.00 -0.02 0.00 0.00 35.03 32.07 1lid n LYS 120 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lid n GLY 121 N -2.21 3.05 3.70 0.72 0.00 -1.26 -4.99 105.19 104.19 1lid n GLY 121 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1lid n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lid s VAL 122 N -1.44 4.85 -0.06 1.61 1.01 -0.29 -5.05 120.40 121.03 1lid s VAL 122 Ca 0.00 1.96 0.06 0.00 0.00 0.00 0.00 61.98 63.99 1lid s VAL 122 Cb 0.00 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 32.10 1lid s VAL 122 CO 0.00 0.10 -0.23 0.42 0.00 0.00 0.00 175.10 175.38 1lid s THR 123 N 1.48 1.93 0.04 3.92 -4.23 -1.26 -1.39 115.64 116.13 1lid s THR 123 Ca 0.48 -1.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.08 1lid s THR 123 Cb -0.19 -1.64 -0.03 0.00 1.34 0.00 0.00 72.50 71.98 1lid s THR 123 CO 0.22 0.54 -0.24 -0.55 -0.54 0.00 0.00 174.62 174.04 1lid s SER 124 N -0.10 2.92 -0.11 3.99 0.15 -0.19 -4.75 113.70 115.61 1lid s SER 124 Ca -0.04 -0.56 0.02 0.00 0.70 0.00 0.00 55.95 56.06 1lid s SER 124 Cb -0.14 -0.26 0.01 0.00 -1.71 0.00 0.00 66.02 63.93 1lid s SER 124 CO 0.04 0.23 -0.15 -0.89 1.20 0.00 0.00 173.24 173.66 1lid s THR 125 N -0.80 1.50 -0.09 6.45 2.01 -0.79 -1.12 115.64 122.80 1lid s THR 125 Ca 0.10 -0.65 0.03 0.00 0.31 0.00 0.00 61.69 61.49 1lid s THR 125 Cb -0.10 -1.37 0.01 0.00 0.01 0.00 0.00 72.50 71.05 1lid s THR 125 CO 0.02 0.44 -0.20 -0.13 -0.69 0.00 0.00 174.62 174.06 1lid s ARG 126 N 0.96 2.63 -0.11 4.92 0.52 0.06 -0.93 118.95 127.00 1lid s ARG 126 Ca -0.07 -0.73 -0.01 0.00 -0.52 0.00 0.00 55.73 54.40 1lid s ARG 126 Cb -0.15 -2.04 -0.02 0.00 0.52 0.00 0.00 34.95 33.26 1lid s ARG 126 CO -0.01 0.11 -0.09 0.08 0.02 0.00 0.00 175.30 175.41 1lid s VAL 127 N 0.50 3.49 0.07 3.52 1.01 -0.29 -0.55 120.40 128.15 1lid s VAL 127 Ca -0.16 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 61.39 1lid s VAL 127 Cb -0.17 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 1lid s VAL 127 CO 0.06 0.54 -0.26 -0.31 0.00 0.00 0.00 175.10 175.13 1lid s TYR 128 N -0.09 2.30 0.26 5.22 1.51 0.36 -0.42 117.35 126.49 1lid s TYR 128 Ca 0.00 -0.40 0.09 0.00 -1.01 0.00 0.00 57.07 55.75 1lid s TYR 128 Cb -0.13 -1.34 -0.05 0.00 -0.11 0.00 0.00 41.96 40.32 1lid s TYR 128 CO 0.03 0.19 -0.15 -1.83 -1.11 0.00 0.00 175.55 172.68 1lid s GLU 129 N -1.48 1.54 0.30 -0.62 -1.05 -0.53 -1.51 118.70 115.35 1lid s GLU 129 Ca 0.12 -1.72 -0.29 0.00 -0.15 0.00 0.00 54.97 52.93 1lid s GLU 129 Cb -0.10 -1.43 -0.10 0.00 -0.44 0.00 0.00 34.13 32.06 1lid s GLU 129 CO 0.03 0.21 1.44 1.03 0.95 0.00 0.00 175.26 178.92 1lid s ARG 130 N -3.60 4.24 0.00 -4.83 0.52 -1.26 -0.59 118.95 113.42 1lid s ARG 130 Ca 0.27 2.38 0.30 0.00 -0.52 0.00 0.00 55.73 58.16 1lid s ARG 130 Cb -0.01 -3.06 1.79 0.00 0.52 0.00 0.00 34.95 34.19 1lid s ARG 130 CO 0.12 -0.42 2.12 0.00 0.02 0.00 0.00 175.30 177.14