#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lnm n GLY 6 N 0.00 1.93 3.98 0.27 0.00 -1.21 -4.76 105.19 105.40 1lnm n GLY 6 Ca 0.00 -2.10 -0.21 0.00 0.00 0.00 0.00 46.02 43.72 1lnm n GLY 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lnm s ALA 7 N -1.92 3.96 0.25 4.61 0.00 -1.26 -3.14 121.76 124.25 1lnm s ALA 7 Ca 0.00 -1.37 -0.30 0.00 0.00 0.00 0.00 51.96 50.29 1lnm s ALA 7 Cb 0.00 -2.03 -0.09 0.00 0.00 0.00 0.00 23.12 21.00 1lnm s ALA 7 CO 0.00 -0.71 1.13 0.00 0.00 0.00 0.00 175.76 176.18 1lnm s PRO 9 N -1.07 0.97 -0.58 0.00 0.04 -1.26 -4.89 135.00 128.22 1lnm s PRO 9 Ca 0.47 1.07 -0.27 0.00 0.04 0.00 0.00 61.00 62.31 1lnm s PRO 9 Cb -0.32 -1.76 -0.01 0.00 0.04 0.00 0.00 34.50 32.45 1lnm s PRO 9 CO 0.40 -2.51 1.70 -1.83 0.04 0.00 0.00 177.00 174.80 1lnm s GLU 10 N -4.77 2.92 0.03 4.56 1.03 -1.26 -4.96 118.70 116.24 1lnm s GLU 10 Ca 0.65 0.60 -0.21 0.00 0.03 0.00 0.00 54.97 56.04 1lnm s GLU 10 Cb -0.20 -4.28 -0.06 0.00 -0.80 0.00 0.00 34.13 28.79 1lnm s GLU 10 CO 0.58 -2.39 0.63 0.08 -1.33 0.00 0.00 175.26 172.84 1lnm s VAL 11 N 7.81 4.82 -0.42 1.83 1.01 -1.26 -5.04 120.40 129.14 1lnm s VAL 11 Ca 0.63 1.34 0.02 0.00 0.00 0.00 0.00 61.98 63.96 1lnm s VAL 11 Cb -0.13 -3.97 0.11 0.00 0.00 0.00 0.00 36.38 32.39 1lnm s VAL 11 CO 0.23 0.44 0.17 -1.59 0.00 0.00 0.00 175.10 174.34 1lnm s LYS 12 N -0.37 1.82 1.17 2.72 0.00 -1.26 -5.11 119.74 118.70 1lnm s LYS 12 Ca 0.32 -2.07 -0.16 0.00 0.00 0.00 0.00 55.97 54.06 1lnm s LYS 12 Cb -0.19 -3.38 0.27 0.00 0.00 0.00 0.00 37.83 34.53 1lnm s LYS 12 CO 0.19 -1.03 1.06 -1.25 0.00 0.00 0.00 175.35 174.32 1lnm s PRO 13 N 0.63 -0.93 0.95 1.78 0.04 -1.26 -4.88 135.00 131.33 1lnm s PRO 13 Ca 0.12 0.34 -0.12 0.00 0.04 0.00 0.00 61.00 61.39 1lnm s PRO 13 Cb -0.21 -1.59 0.16 0.00 0.04 0.00 0.00 34.50 32.89 1lnm s PRO 13 CO -0.05 -3.60 1.09 0.14 0.04 0.00 0.00 177.00 174.62 1lnm s VAL 14 N -2.76 2.44 -0.11 -0.36 -7.23 -0.68 -4.96 120.40 106.75 1lnm s VAL 14 Ca 0.68 0.14 0.15 0.00 -1.81 0.00 0.00 61.98 61.15 1lnm s VAL 14 Cb -0.17 -2.56 0.24 0.00 0.56 0.00 0.00 36.38 34.45 1lnm s VAL 14 CO 0.59 -0.19 1.12 -0.90 -0.31 0.00 0.00 175.10 175.41 1lnm n ASP 15 N -4.07 1.90 -1.12 4.85 3.85 -1.25 -3.95 116.55 116.76 1lnm n ASP 15 Ca 0.06 -2.89 0.02 0.00 -0.71 0.00 0.00 54.79 51.27 1lnm n ASP 15 Cb 0.55 -0.39 0.01 0.00 -1.35 0.00 0.00 41.12 39.94 1lnm n ASP 15 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 1lnm n ASN 16 N -1.16 0.55 -4.72 -1.12 6.94 -0.64 -4.76 115.26 110.36 1lnm n ASN 16 Ca 0.13 -1.97 -0.42 0.00 -0.02 0.00 0.00 54.58 52.30 1lnm n ASN 16 Cb 0.65 -0.23 -0.03 0.00 -2.36 0.00 0.00 39.78 37.81 1lnm n ASN 16 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 1lnm s PHE 17 N 0.00 3.58 -0.33 -2.53 5.36 0.51 -4.94 117.98 119.62 1lnm s PHE 17 Ca 0.20 1.54 -0.03 0.00 -0.96 0.00 0.00 56.93 57.69 1lnm s PHE 17 Cb 0.23 -3.26 0.06 0.00 -0.34 0.00 0.00 43.02 39.71 1lnm s PHE 17 CO -0.10 -0.61 0.07 0.34 -1.46 0.00 0.00 175.22 173.46 1lnm s ASP 18 N 0.59 5.06 0.53 6.13 2.15 -1.26 -4.29 116.67 125.58 1lnm s ASP 18 Ca 0.53 -1.44 0.32 0.00 0.43 0.00 0.00 52.55 52.38 1lnm s ASP 18 Cb -0.27 -1.77 1.29 0.00 -0.30 0.00 0.00 42.92 41.87 1lnm s ASP 18 CO 0.31 -0.34 1.96 -0.50 -0.17 0.00 0.00 175.17 176.42 1lnm h TRP 19 N 8.05 0.00 0.00 -5.34 4.06 -1.95 -3.03 115.95 117.75 1lnm h TRP 19 Ca -0.19 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.76 1lnm h TRP 19 Cb 1.06 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.22 1lnm h TRP 19 CO 0.59 0.05 0.00 -1.13 -3.56 0.00 0.00 178.44 174.39 1lnm n SER 20 N -3.17 0.00 0.17 -3.49 3.41 -1.26 -2.68 113.62 106.61 1lnm n SER 20 Ca 0.00 0.41 0.13 0.00 -0.26 0.00 0.00 58.87 59.15 1lnm n SER 20 Cb 0.33 -0.46 0.34 0.00 -0.26 0.00 0.00 64.21 64.16 1lnm n SER 20 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1lnm h GLN 21 N 0.00 0.00 -4.59 4.33 7.50 -1.90 -3.43 115.11 117.02 1lnm h GLN 21 Ca 0.00 0.00 -0.72 0.00 0.50 0.00 0.00 58.65 58.43 1lnm h GLN 21 Cb 0.28 0.00 -0.21 0.00 0.05 0.00 0.00 27.48 27.61 1lnm h GLN 21 CO 0.00 0.00 0.47 0.71 -1.50 0.00 0.00 178.83 178.51 1lnm s TYR 22 N -3.22 3.30 0.07 2.96 1.51 -1.09 -4.92 117.35 115.95 1lnm s TYR 22 Ca 0.08 -1.50 -0.22 0.00 -1.01 0.00 0.00 57.07 54.42 1lnm s TYR 22 Cb 0.09 -4.09 0.05 0.00 -0.11 0.00 0.00 41.96 37.90 1lnm s TYR 22 CO 0.61 -1.30 0.51 -3.38 -1.11 0.00 0.00 175.55 170.88 1lnm s HIS 23 N 1.89 -0.41 0.00 2.71 -3.43 -1.26 -4.54 115.29 110.25 1lnm s HIS 23 Ca 0.24 0.39 0.00 0.00 -0.80 0.00 0.00 55.06 54.89 1lnm s HIS 23 Cb -0.10 0.35 0.00 0.00 -1.43 0.00 0.00 32.58 31.41 1lnm s HIS 23 CO -0.06 -0.67 0.00 0.41 -2.00 0.00 0.00 174.74 172.42 1lnm n GLY 24 N 0.25 -1.82 3.76 -1.38 0.00 -0.85 -4.80 105.19 100.35 1lnm n GLY 24 Ca -0.18 -1.33 -0.39 0.00 0.00 0.00 0.00 46.02 44.12 1lnm n GLY 24 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lnm s LYS 25 N 0.00 4.38 -0.03 1.61 2.20 -1.26 -2.21 119.74 124.43 1lnm s LYS 25 Ca 0.00 0.86 0.05 0.00 -0.36 0.00 0.00 55.97 56.52 1lnm s LYS 25 Cb 0.00 -3.35 -0.01 0.00 -1.51 0.00 0.00 37.83 32.96 1lnm s LYS 25 CO 0.00 0.34 -0.19 -1.58 -0.36 0.00 0.00 175.35 173.57 1lnm s TRP 26 N -0.17 1.74 -0.13 4.03 0.52 -0.44 -4.67 118.94 119.82 1lnm s TRP 26 Ca 0.34 -0.39 -0.06 0.00 0.02 0.00 0.00 56.10 56.01 1lnm s TRP 26 Cb -0.19 -1.14 -0.04 0.00 -1.15 0.00 0.00 33.47 30.95 1lnm s TRP 26 CO 0.19 -0.08 0.07 -1.58 0.02 0.00 0.00 176.95 175.57 1lnm s TRP 27 N -0.27 3.34 -0.91 -1.98 0.52 0.35 -0.69 118.94 119.29 1lnm s TRP 27 Ca 0.03 0.27 -0.24 0.00 0.02 0.00 0.00 56.10 56.18 1lnm s TRP 27 Cb -0.09 -1.95 0.05 0.00 -1.15 0.00 0.00 33.47 30.34 1lnm s TRP 27 CO 0.00 0.44 1.34 -1.14 0.02 0.00 0.00 176.95 177.62 1lnm s GLN 28 N -0.46 3.46 0.20 4.98 0.74 -0.51 -0.65 119.66 127.41 1lnm s GLN 28 Ca 0.10 -0.94 0.24 0.00 0.05 0.00 0.00 55.36 54.81 1lnm s GLN 28 Cb -0.12 -4.93 0.42 0.00 1.10 0.00 0.00 33.01 29.48 1lnm s GLN 28 CO 0.02 -2.12 1.45 -0.39 -0.55 0.00 0.00 175.29 173.70 1lnm h VAL 29 N 6.44 0.00 -2.44 1.34 -1.51 -1.63 -3.42 116.25 115.03 1lnm h VAL 29 Ca 0.04 -0.64 -0.07 0.00 -1.23 0.00 0.00 66.70 64.80 1lnm h VAL 29 Cb 1.03 1.38 -0.18 0.00 -2.13 0.00 0.00 31.29 31.39 1lnm h VAL 29 CO 1.34 0.00 0.05 0.00 -1.23 0.00 0.00 177.57 177.73 1lnm s ALA 30 N -3.18 -1.44 0.27 5.19 0.00 -1.20 -0.60 121.76 120.80 1lnm s ALA 30 Ca 0.07 0.90 -0.21 0.00 0.00 0.00 0.00 51.96 52.72 1lnm s ALA 30 Cb 0.11 0.13 0.04 0.00 0.00 0.00 0.00 23.12 23.41 1lnm s ALA 30 CO 0.69 -0.39 0.81 0.00 0.00 0.00 0.00 175.76 176.87 1lnm s ALA 31 N -1.59 -1.25 0.48 0.00 0.00 -0.92 0.58 121.76 119.06 1lnm s ALA 31 Ca -0.10 -0.30 -0.24 0.00 0.00 0.00 0.00 51.96 51.32 1lnm s ALA 31 Cb -0.01 0.76 -0.07 0.00 0.00 0.00 0.00 23.12 23.80 1lnm s ALA 31 CO 0.05 -1.03 1.33 0.71 0.00 0.00 0.00 175.76 176.82 1lnm s TYR 32 N -3.33 2.53 0.36 0.00 2.02 -0.39 -1.17 117.35 117.37 1lnm s TYR 32 Ca 0.13 1.38 0.04 0.00 -0.37 0.00 0.00 57.07 58.24 1lnm s TYR 32 Cb -0.05 -3.74 0.69 0.00 -0.40 0.00 0.00 41.96 38.47 1lnm s TYR 32 CO 0.07 -2.53 2.02 -1.00 -1.57 0.00 0.00 175.55 172.53 1lnm h PRO 33 N 2.01 0.77 -0.86 -1.71 0.13 -1.93 -1.55 132.00 128.86 1lnm h PRO 33 Ca -0.50 -0.05 0.08 0.00 -0.87 0.00 0.00 66.00 64.66 1lnm h PRO 33 Cb 1.27 -0.17 -0.07 0.00 0.13 0.00 0.00 31.00 32.16 1lnm h PRO 33 CO 0.60 0.51 0.52 -0.44 -0.23 0.00 0.00 178.00 178.96 1lnm h ASP 34 N 0.79 0.80 -0.51 1.44 3.45 -1.95 -0.23 116.42 120.21 1lnm h ASP 34 Ca 0.23 0.03 -0.04 0.00 0.43 0.00 0.00 57.03 57.67 1lnm h ASP 34 Cb -0.05 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 38.56 1lnm h ASP 34 CO -0.05 0.49 0.16 -0.74 -1.57 0.00 0.00 179.24 177.52 1lnm h HIS 35 N 0.92 0.83 -0.21 4.55 2.76 -1.65 -1.96 115.15 120.39 1lnm h HIS 35 Ca 0.39 -0.08 -0.06 0.00 -2.20 0.00 0.00 60.37 58.42 1lnm h HIS 35 Cb 0.26 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 1lnm h HIS 35 CO -0.04 0.72 -0.14 0.82 -1.30 0.00 0.00 177.93 177.99 1lnm h ILE 36 N 0.70 1.21 0.07 6.26 2.04 -0.55 -0.27 117.51 126.97 1lnm h ILE 36 Ca 0.17 -0.94 -0.25 0.00 1.00 0.00 0.00 64.86 64.83 1lnm h ILE 36 Cb 0.28 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1lnm h ILE 36 CO -0.00 0.30 -1.21 0.71 0.00 0.00 0.00 178.15 177.94 1lnm h THR 37 N 0.33 1.50 0.21 -0.27 1.35 -1.02 0.66 112.91 115.67 1lnm h THR 37 Ca 0.06 -3.15 -0.30 0.00 -0.55 0.00 0.00 66.41 62.46 1lnm h THR 37 Cb 0.45 2.85 0.03 0.00 -1.73 0.00 0.00 68.15 69.75 1lnm h THR 37 CO 0.03 0.89 -1.38 0.11 -0.25 0.00 0.00 175.52 174.92 1lnm h LYS 38 N 0.04 0.45 -0.01 4.72 1.57 -1.22 -3.40 116.57 118.72 1lnm h LYS 38 Ca -0.11 -0.76 0.00 0.00 -1.87 0.00 0.00 60.65 57.91 1lnm h LYS 38 Cb 1.90 0.28 0.00 0.00 0.08 0.00 0.00 32.23 34.49 1lnm h LYS 38 CO 0.16 1.36 -0.07 0.66 -0.57 0.00 0.00 179.45 180.99 1lnm n TYR 39 N -3.80 0.00 0.00 -1.35 4.02 -0.12 -5.04 117.16 110.86 1lnm n TYR 39 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 1lnm n TYR 39 Cb 1.03 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.35 1lnm n TYR 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1lnm n GLY 40 N 0.77 2.62 3.95 2.72 0.00 0.22 -4.77 105.19 110.70 1lnm n GLY 40 Ca 0.06 -1.83 -0.24 0.00 0.00 0.00 0.00 46.02 44.02 1lnm n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lnm s LYS 41 N -3.56 2.19 -1.41 1.61 -2.85 -0.47 -4.54 119.74 110.72 1lnm s LYS 41 Ca 0.00 -0.51 -0.09 0.00 -1.00 0.00 0.00 55.97 54.37 1lnm s LYS 41 Cb 0.00 -2.27 0.02 0.00 -2.06 0.00 0.00 37.83 33.52 1lnm s LYS 41 CO 0.00 -1.15 1.07 0.00 0.10 0.00 0.00 175.35 175.38 1lnm s GLY 43 N -3.22 2.54 0.05 0.00 0.00 -1.26 -4.56 107.32 100.88 1lnm s GLY 43 Ca 0.55 0.02 -0.03 0.00 0.00 0.00 0.00 44.72 45.27 1lnm s GLY 43 CO 0.68 1.04 0.02 0.66 0.00 0.00 0.00 173.10 175.50 1lnm s TRP 44 N 0.74 0.43 0.01 1.90 1.48 -0.84 -1.43 118.94 121.23 1lnm s TRP 44 Ca 0.34 -0.93 0.01 0.00 -1.06 0.00 0.00 56.10 54.45 1lnm s TRP 44 Cb -0.17 -0.31 -0.01 0.00 -1.16 0.00 0.00 33.47 31.83 1lnm s TRP 44 CO 0.15 -0.40 -0.02 0.00 -4.06 0.00 0.00 176.95 172.62 1lnm s ALA 45 N -3.73 0.16 -0.20 2.67 0.00 0.13 -1.36 121.76 119.43 1lnm s ALA 45 Ca 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 51.96 51.75 1lnm s ALA 45 Cb 0.06 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 1lnm s ALA 45 CO -0.09 -0.01 -0.05 -2.00 0.00 0.00 0.00 175.76 173.61 1lnm s GLU 46 N -0.43 3.46 -0.10 0.00 2.12 -0.02 -1.33 118.70 122.40 1lnm s GLU 46 Ca -0.03 -0.60 -0.05 0.00 0.36 0.00 0.00 54.97 54.65 1lnm s GLU 46 Cb -0.03 -2.95 -0.04 0.00 0.26 0.00 0.00 34.13 31.37 1lnm s GLU 46 CO -0.00 -0.04 0.08 0.71 -0.54 0.00 0.00 175.26 175.46 1lnm s TYR 47 N 1.09 3.40 -0.17 5.30 1.51 -0.94 -1.67 117.35 125.86 1lnm s TYR 47 Ca 0.01 0.37 -0.04 0.00 -1.01 0.00 0.00 57.07 56.41 1lnm s TYR 47 Cb -0.15 -1.87 0.06 0.00 -0.11 0.00 0.00 41.96 39.90 1lnm s TYR 47 CO -0.00 0.62 0.06 0.99 -1.11 0.00 0.00 175.55 176.11 1lnm s THR 48 N -0.98 0.20 0.45 -0.71 2.01 -0.41 -2.01 115.64 114.19 1lnm s THR 48 Ca 0.15 -0.31 -0.24 0.00 0.31 0.00 0.00 61.69 61.59 1lnm s THR 48 Cb -0.12 -0.76 -0.08 0.00 0.01 0.00 0.00 72.50 71.55 1lnm s THR 48 CO 0.04 -0.22 1.27 -2.84 -0.69 0.00 0.00 174.62 172.18 1lnm s PRO 49 N 2.01 3.76 -0.46 4.92 0.02 -1.26 -0.96 135.00 143.03 1lnm s PRO 49 Ca 0.01 2.05 0.06 0.00 0.02 0.00 0.00 61.00 63.13 1lnm s PRO 49 Cb -0.16 -2.57 0.19 0.00 0.02 0.00 0.00 34.50 31.98 1lnm s PRO 49 CO -0.08 -0.63 0.53 -1.91 -0.33 0.00 0.00 177.00 174.58 1lnm n GLU 50 N -0.26 0.38 0.00 5.54 2.13 0.52 -4.86 120.64 124.09 1lnm n GLU 50 Ca 0.06 -2.66 0.00 0.00 0.66 0.00 0.00 57.16 55.22 1lnm n GLU 50 Cb 0.45 -1.56 0.00 0.00 0.27 0.00 0.00 31.44 30.61 1lnm n GLU 50 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1lnm n GLY 51 N 2.75 2.52 0.14 8.31 0.00 -1.26 -2.10 105.19 115.56 1lnm n GLY 51 Ca 0.24 -0.30 0.13 0.00 0.00 0.00 0.00 46.02 46.08 1lnm n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lnm h LYS 52 N 0.00 0.00 -6.29 1.61 1.57 -1.97 -3.46 116.57 108.03 1lnm h LYS 52 Ca 0.00 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.32 1lnm h LYS 52 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1lnm h LYS 52 CO 0.00 0.00 -0.32 -1.54 -0.57 0.00 0.00 179.45 177.02 1lnm s SER 53 N -4.63 5.30 -0.10 0.86 1.04 -0.89 -4.61 113.70 110.66 1lnm s SER 53 Ca 0.06 -0.62 0.01 0.00 0.48 0.00 0.00 55.95 55.88 1lnm s SER 53 Cb 0.10 -0.57 0.02 0.00 0.10 0.00 0.00 66.02 65.67 1lnm s SER 53 CO 0.50 -0.72 -0.11 -0.69 0.98 0.00 0.00 173.24 173.20 1lnm s VAL 54 N -2.43 1.18 -0.02 5.02 1.01 -0.94 -0.36 120.40 123.86 1lnm s VAL 54 Ca 0.51 -0.43 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 1lnm s VAL 54 Cb -0.06 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 1lnm s VAL 54 CO 0.30 0.38 0.60 -0.75 0.00 0.00 0.00 175.10 175.63 1lnm s LYS 55 N 1.26 4.33 -0.10 2.72 2.47 -0.13 -0.38 119.74 129.90 1lnm s LYS 55 Ca -0.03 0.73 0.02 0.00 -1.56 0.00 0.00 55.97 55.14 1lnm s LYS 55 Cb -0.14 -3.36 -0.01 0.00 -1.46 0.00 0.00 37.83 32.86 1lnm s LYS 55 CO -0.04 0.33 -0.17 0.08 0.16 0.00 0.00 175.35 175.71 1lnm s VAL 56 N -0.06 2.72 -0.13 4.02 1.01 0.24 -1.28 120.40 126.93 1lnm s VAL 56 Ca 0.31 -0.80 -0.00 0.00 0.00 0.00 0.00 61.98 61.49 1lnm s VAL 56 Cb -0.18 -2.09 0.03 0.00 0.00 0.00 0.00 36.38 34.13 1lnm s VAL 56 CO 0.17 0.55 -0.07 -0.44 0.00 0.00 0.00 175.10 175.30 1lnm s SER 57 N 0.10 2.39 -0.01 3.32 0.01 -0.67 -1.13 113.70 117.71 1lnm s SER 57 Ca -0.08 -0.41 0.04 0.00 1.31 0.00 0.00 55.95 56.81 1lnm s SER 57 Cb -0.15 -0.88 -0.01 0.00 0.21 0.00 0.00 66.02 65.18 1lnm s SER 57 CO 0.05 -0.13 -0.14 -0.60 0.41 0.00 0.00 173.24 172.83 1lnm s ARG 58 N 1.67 1.18 -0.12 12.44 3.52 -0.56 -0.84 118.95 136.23 1lnm s ARG 58 Ca 0.04 -0.52 -0.03 0.00 -0.13 0.00 0.00 55.73 55.09 1lnm s ARG 58 Cb -0.13 -1.14 -0.03 0.00 -1.56 0.00 0.00 34.95 32.09 1lnm s ARG 58 CO -0.08 0.31 -0.03 -0.47 -0.81 0.00 0.00 175.30 174.22 1lnm s TYR 59 N -0.33 3.05 0.23 5.12 5.04 -0.47 -0.42 117.35 129.57 1lnm s TYR 59 Ca 0.05 -0.11 -0.19 0.00 -2.44 0.00 0.00 57.07 54.38 1lnm s TYR 59 Cb -0.06 -1.88 0.03 0.00 0.35 0.00 0.00 41.96 40.40 1lnm s TYR 59 CO -0.01 0.16 0.61 -1.54 -1.34 0.00 0.00 175.55 173.44 1lnm s SER 60 N -0.14 -0.29 -0.29 4.32 1.04 -0.89 -1.99 113.70 115.46 1lnm s SER 60 Ca 0.03 -0.51 -0.06 0.00 0.48 0.00 0.00 55.95 55.90 1lnm s SER 60 Cb -0.13 0.65 0.01 0.00 0.10 0.00 0.00 66.02 66.65 1lnm s SER 60 CO 0.02 -1.18 0.06 -0.69 0.98 0.00 0.00 173.24 172.43 1lnm s VAL 61 N -3.89 3.74 -0.20 5.02 1.01 -0.17 -1.55 120.40 124.37 1lnm s VAL 61 Ca 0.10 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.30 1lnm s VAL 61 Cb -0.03 -2.94 0.03 0.00 0.00 0.00 0.00 36.38 33.43 1lnm s VAL 61 CO 0.01 0.08 -0.18 -0.63 0.00 0.00 0.00 175.10 174.38 1lnm s ILE 62 N 1.46 2.12 -1.35 2.22 1.01 -0.25 -1.37 121.20 125.04 1lnm s ILE 62 Ca 0.02 -1.08 -0.01 0.00 0.00 0.00 0.00 60.65 59.58 1lnm s ILE 62 Cb -0.17 -1.97 0.01 0.00 0.01 0.00 0.00 42.46 40.33 1lnm s ILE 62 CO 0.01 0.42 0.63 1.41 0.00 0.00 0.00 174.94 177.41 1lnm n HIS 63 N 4.59 -1.85 -0.45 3.97 8.25 -1.26 -1.46 115.22 127.00 1lnm n HIS 63 Ca -0.19 0.82 0.00 0.00 -0.26 0.00 0.00 57.72 58.08 1lnm n HIS 63 Cb 0.48 -4.18 0.00 0.00 1.12 0.00 0.00 29.99 27.41 1lnm n HIS 63 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lnm n GLY 64 N -1.69 0.84 3.58 -1.41 0.00 -1.26 -5.01 105.19 100.23 1lnm n GLY 64 Ca -0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1lnm n GLY 64 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lnm s LYS 65 N -0.32 3.33 0.26 1.61 2.47 -0.54 -5.07 119.74 121.47 1lnm s LYS 65 Ca 0.00 -0.48 -0.30 0.00 -1.56 0.00 0.00 55.97 53.64 1lnm s LYS 65 Cb 0.00 -2.85 -0.09 0.00 -1.46 0.00 0.00 37.83 33.43 1lnm s LYS 65 CO 0.00 0.46 1.13 -1.83 0.16 0.00 0.00 175.35 175.27 1lnm s GLU 66 N -0.22 4.59 0.01 4.03 -1.05 -1.26 -1.09 118.70 123.70 1lnm s GLU 66 Ca 0.05 1.84 0.01 0.00 -0.15 0.00 0.00 54.97 56.72 1lnm s GLU 66 Cb -0.13 -3.20 -0.01 0.00 -0.44 0.00 0.00 34.13 30.36 1lnm s GLU 66 CO 0.02 0.12 -0.04 0.71 0.95 0.00 0.00 175.26 177.02 1lnm s TYR 67 N -0.91 0.35 -0.13 4.83 1.51 -0.59 -4.98 117.35 117.43 1lnm s TYR 67 Ca 0.47 -0.24 -0.10 0.00 -1.01 0.00 0.00 57.07 56.18 1lnm s TYR 67 Cb -0.32 -0.22 -0.05 0.00 -0.11 0.00 0.00 41.96 41.25 1lnm s TYR 67 CO 0.41 -0.06 0.21 -0.06 -1.11 0.00 0.00 175.55 174.94 1lnm s PHE 68 N -0.62 3.54 0.41 2.71 0.40 -1.26 -2.10 117.98 121.06 1lnm s PHE 68 Ca -0.05 0.56 0.07 0.00 -0.60 0.00 0.00 56.93 56.91 1lnm s PHE 68 Cb -0.05 -2.14 -0.07 0.00 0.51 0.00 0.00 43.02 41.28 1lnm s PHE 68 CO -0.00 0.49 0.07 -1.54 0.70 0.00 0.00 175.22 174.95 1lnm s SER 69 N -0.33 4.10 0.06 1.36 1.04 0.44 -4.78 113.70 115.59 1lnm s SER 69 Ca 0.15 -1.24 0.03 0.00 0.48 0.00 0.00 55.95 55.36 1lnm s SER 69 Cb -0.13 -0.43 -0.03 0.00 0.10 0.00 0.00 66.02 65.53 1lnm s SER 69 CO 0.04 -0.47 -0.09 -1.83 0.98 0.00 0.00 173.24 171.87 1lnm s GLU 70 N -3.78 0.64 0.18 4.02 -1.05 -0.80 -1.50 118.70 116.42 1lnm s GLU 70 Ca 0.37 -0.92 -0.18 0.00 -0.15 0.00 0.00 54.97 54.10 1lnm s GLU 70 Cb 0.07 -0.36 0.03 0.00 -0.44 0.00 0.00 34.13 33.43 1lnm s GLU 70 CO 0.20 0.06 0.52 0.20 0.95 0.00 0.00 175.26 177.18 1lnm s GLY 71 N -1.93 -0.16 0.03 -3.83 0.00 -0.28 -0.98 107.32 100.18 1lnm s GLY 71 Ca -0.04 -0.14 0.08 0.00 0.00 0.00 0.00 44.72 44.62 1lnm s GLY 71 CO -0.00 -0.23 -0.24 -1.59 0.00 0.00 0.00 173.10 171.04 1lnm s THR 72 N -3.86 2.33 -0.05 0.90 2.01 -1.23 -0.59 115.64 115.16 1lnm s THR 72 Ca 0.08 -1.28 0.06 0.00 0.31 0.00 0.00 61.69 60.85 1lnm s THR 72 Cb -0.01 -1.92 -0.01 0.00 0.01 0.00 0.00 72.50 70.57 1lnm s THR 72 CO -0.05 0.39 -0.24 0.00 -0.69 0.00 0.00 174.62 174.04 1lnm s ALA 73 N -0.81 2.23 0.08 7.40 0.00 0.49 -0.94 121.76 130.22 1lnm s ALA 73 Ca 0.12 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 51.07 1lnm s ALA 73 Cb -0.10 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.28 1lnm s ALA 73 CO 0.02 0.44 -0.10 0.71 0.00 0.00 0.00 175.76 176.83 1lnm s TYR 74 N -0.26 1.01 0.44 0.00 1.51 -0.08 -2.21 117.35 117.76 1lnm s TYR 74 Ca -0.00 -0.58 -0.21 0.00 -1.01 0.00 0.00 57.07 55.26 1lnm s TYR 74 Cb -0.13 -0.56 -0.10 0.00 -0.11 0.00 0.00 41.96 41.06 1lnm s TYR 74 CO 0.03 -0.01 0.99 -1.25 -1.11 0.00 0.00 175.55 174.20 1lnm s PRO 75 N -2.32 4.08 -0.22 -1.71 0.04 -1.26 0.31 135.00 133.91 1lnm s PRO 75 Ca 0.01 1.27 -0.06 0.00 0.04 0.00 0.00 61.00 62.26 1lnm s PRO 75 Cb -0.06 -2.22 -0.02 0.00 0.04 0.00 0.00 34.50 32.24 1lnm s PRO 75 CO 0.00 -0.18 0.02 0.08 0.04 0.00 0.00 177.00 176.97 1lnm s VAL 76 N -2.01 4.04 0.00 -0.36 1.01 -0.92 -4.77 120.40 117.38 1lnm s VAL 76 Ca 0.63 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.34 1lnm s VAL 76 Cb -0.14 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.39 1lnm s VAL 76 CO 0.18 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.28 1lnm n GLY 77 N 4.55 0.18 3.62 4.51 0.00 -1.26 -4.60 105.19 112.19 1lnm n GLY 77 Ca -0.17 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 1lnm n GLY 77 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1lnm s ASP 78 N -4.00 5.80 0.64 1.61 2.15 -1.26 -4.84 116.67 116.77 1lnm s ASP 78 Ca 0.00 1.97 0.24 0.00 0.43 0.00 0.00 52.55 55.19 1lnm s ASP 78 Cb 0.00 -2.52 1.22 0.00 -0.30 0.00 0.00 42.92 41.33 1lnm s ASP 78 CO 0.00 -1.67 1.69 0.77 -0.17 0.00 0.00 175.17 175.78 1lnm h SER 79 N 13.45 0.00 0.66 -0.34 4.64 -1.94 -1.74 113.55 128.28 1lnm h SER 79 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1lnm h SER 79 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1lnm h SER 79 CO 0.97 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 177.04 1lnm h LYS 80 N 0.00 0.00 0.00 4.77 1.57 -1.89 -3.26 116.57 117.76 1lnm h LYS 80 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1lnm h LYS 80 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 1lnm h LYS 80 CO -0.00 0.00 -0.70 0.97 -0.57 0.00 0.00 179.45 179.15 1lnm h ILE 81 N 0.00 0.00 -0.09 1.86 2.10 -1.47 0.17 117.51 120.08 1lnm h ILE 81 Ca 0.00 -0.59 0.00 0.00 1.08 0.00 0.00 64.86 65.35 1lnm h ILE 81 Cb 0.33 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 37.21 1lnm h ILE 81 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 177.68 1lnm n GLY 82 N 1.31 0.58 3.48 8.18 0.00 -1.23 -2.81 105.19 114.69 1lnm n GLY 82 Ca 0.03 -0.78 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 1lnm n GLY 82 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lnm s LYS 83 N -3.77 3.68 -0.06 1.61 2.20 -1.26 -0.73 119.74 121.41 1lnm s LYS 83 Ca 0.00 -0.49 0.02 0.00 -0.36 0.00 0.00 55.97 55.14 1lnm s LYS 83 Cb 0.00 -3.11 0.01 0.00 -1.51 0.00 0.00 37.83 33.22 1lnm s LYS 83 CO 0.00 0.05 -0.12 0.42 -0.36 0.00 0.00 175.35 175.34 1lnm s ILE 84 N 0.93 1.08 0.20 5.43 1.01 -0.07 -2.17 121.20 127.62 1lnm s ILE 84 Ca 0.02 -0.47 -0.09 0.00 0.00 0.00 0.00 60.65 60.11 1lnm s ILE 84 Cb -0.14 -0.98 -0.07 0.00 0.01 0.00 0.00 42.46 41.28 1lnm s ILE 84 CO 0.02 0.34 0.51 -0.47 0.00 0.00 0.00 174.94 175.34 1lnm s TYR 85 N 0.54 3.45 -0.19 3.97 6.14 0.15 -1.54 117.35 129.87 1lnm s TYR 85 Ca -0.12 0.81 -0.12 0.00 0.64 0.00 0.00 57.07 58.29 1lnm s TYR 85 Cb -0.14 -2.21 0.06 0.00 0.42 0.00 0.00 41.96 40.09 1lnm s TYR 85 CO 0.03 0.32 0.47 -1.58 0.64 0.00 0.00 175.55 175.43 1lnm s HIS 86 N -1.76 -0.66 0.29 4.97 2.46 0.33 -0.90 115.29 120.01 1lnm s HIS 86 Ca 0.45 1.43 0.01 0.00 0.47 0.00 0.00 55.06 57.42 1lnm s HIS 86 Cb -0.12 0.31 -0.03 0.00 -0.13 0.00 0.00 32.58 32.61 1lnm s HIS 86 CO 0.22 -0.35 0.46 -1.54 -2.47 0.00 0.00 174.74 171.06 1lnm s SER 87 N 1.19 6.33 -0.21 9.88 1.04 -0.11 -1.82 113.70 130.00 1lnm s SER 87 Ca -0.08 0.35 -0.04 0.00 0.48 0.00 0.00 55.95 56.66 1lnm s SER 87 Cb -0.07 -1.98 0.11 0.00 0.10 0.00 0.00 66.02 64.17 1lnm s SER 87 CO -0.11 -0.18 0.29 -0.47 0.98 0.00 0.00 173.24 173.75 1lnm s TYR 88 N -2.12 -0.50 -0.17 5.02 5.04 0.13 -3.50 117.35 121.24 1lnm s TYR 88 Ca 0.38 0.54 0.01 0.00 -2.44 0.00 0.00 57.07 55.56 1lnm s TYR 88 Cb -0.10 -0.18 0.01 0.00 0.35 0.00 0.00 41.96 42.04 1lnm s TYR 88 CO 0.32 -0.62 -0.18 0.99 -1.34 0.00 0.00 175.55 174.72 1lnm s THR 89 N 2.42 2.25 -0.05 4.34 2.01 -0.15 -0.43 115.64 126.03 1lnm s THR 89 Ca 0.08 -0.89 -0.05 0.00 0.31 0.00 0.00 61.69 61.15 1lnm s THR 89 Cb -0.15 -1.95 0.01 0.00 0.01 0.00 0.00 72.50 70.42 1lnm s THR 89 CO -0.13 0.53 0.14 -0.51 -0.69 0.00 0.00 174.62 173.96 1lnm s ILE 90 N 1.16 0.00 -1.63 1.82 2.07 -0.93 -1.90 121.20 121.79 1lnm s ILE 90 Ca 0.02 -0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.17 1lnm s ILE 90 Cb -0.14 -0.21 0.08 0.00 0.13 0.00 0.00 42.46 42.32 1lnm s ILE 90 CO -0.08 -0.00 0.33 0.61 -1.91 0.00 0.00 174.94 173.89 1lnm n GLY 91 N 2.99 -0.25 2.48 1.50 0.00 -1.26 -2.42 105.19 108.23 1lnm n GLY 91 Ca -0.12 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1lnm n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lnm n GLY 92 N -1.94 0.74 3.30 -0.02 0.00 -1.26 -5.00 105.19 101.01 1lnm n GLY 92 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 1lnm n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lnm s VAL 93 N -2.96 2.43 -0.07 1.61 1.01 -1.02 -5.13 120.40 116.27 1lnm s VAL 93 Ca 0.00 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.08 1lnm s VAL 93 Cb 0.00 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 1lnm s VAL 93 CO 0.00 0.56 -0.07 -0.89 0.00 0.00 0.00 175.10 174.69 1lnm s THR 94 N 0.11 3.67 0.15 3.92 2.01 -1.26 -2.19 115.64 122.05 1lnm s THR 94 Ca -0.10 -0.49 0.05 0.00 0.31 0.00 0.00 61.69 61.47 1lnm s THR 94 Cb -0.16 -2.50 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 1lnm s THR 94 CO 0.06 0.59 -0.12 -1.10 -0.69 0.00 0.00 174.62 173.37 1lnm s GLN 95 N -0.73 1.08 0.05 4.92 -0.21 0.42 -4.97 119.66 120.22 1lnm s GLN 95 Ca 0.11 -1.40 -0.12 0.00 0.02 0.00 0.00 55.36 53.97 1lnm s GLN 95 Cb -0.11 -0.75 0.01 0.00 1.00 0.00 0.00 33.01 33.16 1lnm s GLN 95 CO 0.02 0.11 0.26 -1.83 -2.12 0.00 0.00 175.29 171.73 1lnm s GLU 96 N -3.43 0.79 -0.06 2.91 -1.05 -1.26 0.19 118.70 116.79 1lnm s GLU 96 Ca 0.15 -0.60 -0.31 0.00 -0.15 0.00 0.00 54.97 54.06 1lnm s GLU 96 Cb 0.00 0.34 0.12 0.00 -0.44 0.00 0.00 34.13 34.14 1lnm s GLU 96 CO 0.02 -0.25 1.36 0.20 0.95 0.00 0.00 175.26 177.54 1lnm s GLY 97 N -2.19 -0.31 -0.04 -3.83 0.00 -0.76 -5.01 107.32 95.18 1lnm s GLY 97 Ca -0.04 0.45 0.07 0.00 0.00 0.00 0.00 44.72 45.20 1lnm s GLY 97 CO -0.05 3.61 -0.23 0.14 0.00 0.00 0.00 173.10 176.57 1lnm s VAL 98 N -2.07 2.24 0.29 1.40 1.01 -1.26 -0.51 120.40 121.49 1lnm s VAL 98 Ca 0.24 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 61.22 1lnm s VAL 98 Cb 0.03 -1.81 -0.06 0.00 0.00 0.00 0.00 36.38 34.55 1lnm s VAL 98 CO -0.04 0.58 0.08 0.72 0.00 0.00 0.00 175.10 176.44 1lnm s PHE 99 N -0.47 1.71 -0.02 5.22 -0.12 -0.59 -4.93 117.98 118.78 1lnm s PHE 99 Ca 0.06 -1.10 0.06 0.00 -0.05 0.00 0.00 56.93 55.90 1lnm s PHE 99 Cb -0.11 -1.05 -0.02 0.00 -0.63 0.00 0.00 43.02 41.21 1lnm s PHE 99 CO 0.01 -0.21 -0.21 -0.80 -0.05 0.00 0.00 175.22 173.96 1lnm s ASN 100 N -3.38 2.53 -0.34 1.98 0.01 -0.73 -0.89 114.94 114.11 1lnm s ASN 100 Ca 0.37 -0.39 -0.23 0.00 -0.71 0.00 0.00 52.86 51.90 1lnm s ASN 100 Cb 0.08 -0.35 0.00 0.00 0.41 0.00 0.00 41.25 41.40 1lnm s ASN 100 CO 0.14 0.25 0.75 -0.69 -1.51 0.00 0.00 177.10 176.05 1lnm s VAL 101 N -0.44 4.79 0.11 1.60 1.01 0.09 -1.42 120.40 126.14 1lnm s VAL 101 Ca 0.06 0.91 -0.02 0.00 0.00 0.00 0.00 61.98 62.93 1lnm s VAL 101 Cb -0.09 -4.16 -0.23 0.00 0.00 0.00 0.00 36.38 31.91 1lnm s VAL 101 CO -0.00 -0.35 1.24 -0.07 0.00 0.00 0.00 175.10 175.92 1lnm h LEU 102 N 9.57 0.40 -7.00 3.92 3.38 -1.68 -1.81 115.31 122.08 1lnm h LEU 102 Ca -0.25 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.38 1lnm h LEU 102 Cb 1.10 -0.13 -0.24 0.00 0.09 0.00 0.00 40.66 41.48 1lnm h LEU 102 CO 0.88 1.23 0.39 -0.55 0.09 0.00 0.00 178.44 180.48 1lnm s SER 103 N -7.06 -0.51 -0.02 -0.43 0.15 -1.25 -4.68 113.70 99.89 1lnm s SER 103 Ca -0.04 0.90 -0.28 0.00 0.70 0.00 0.00 55.95 57.23 1lnm s SER 103 Cb 0.08 0.88 0.10 0.00 -1.71 0.00 0.00 66.02 65.37 1lnm s SER 103 CO 0.86 -0.23 0.82 0.28 1.20 0.00 0.00 173.24 176.17 1lnm s THR 104 N -0.05 0.00 -1.45 6.45 -1.32 -1.26 -0.83 115.64 117.17 1lnm s THR 104 Ca 0.01 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.64 1lnm s THR 104 Cb -0.04 -1.00 0.40 0.00 -1.51 0.00 0.00 72.50 70.35 1lnm s THR 104 CO -0.02 0.00 1.31 -0.90 -2.21 0.00 0.00 174.62 172.80 1lnm n ASP 105 N 0.18 3.19 -2.77 8.08 5.75 -1.24 -4.97 116.55 124.77 1lnm n ASP 105 Ca -0.13 -1.95 -0.19 0.00 -0.01 0.00 0.00 54.79 52.52 1lnm n ASP 105 Cb 0.61 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1lnm n ASP 105 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1lnm n ASN 106 N 0.97 -4.74 0.13 -1.12 3.02 -1.26 -4.73 115.26 107.52 1lnm n ASN 106 Ca 0.16 -0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 1lnm n ASN 106 Cb 0.49 -3.93 0.00 0.00 -0.61 0.00 0.00 39.78 35.73 1lnm n ASN 106 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1lnm n LYS 107 N -3.33 0.00 -0.02 3.52 2.85 -1.26 -4.96 118.16 114.96 1lnm n LYS 107 Ca -0.13 0.00 -0.01 0.00 -1.05 0.00 0.00 58.31 57.12 1lnm n LYS 107 Cb 0.61 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.95 1lnm n LYS 107 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1lnm n ASN 108 N -3.17 3.82 -3.78 -5.58 3.02 -1.26 -4.84 115.26 103.47 1lnm n ASN 108 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.45 1lnm n ASN 108 Cb 0.00 0.73 -0.06 0.00 -0.61 0.00 0.00 39.78 39.84 1lnm n ASN 108 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1lnm s TYR 109 N -2.16 0.04 -0.15 3.10 -0.85 -1.26 -1.58 117.35 114.49 1lnm s TYR 109 Ca -0.02 -0.40 -0.09 0.00 -0.52 0.00 0.00 57.07 56.04 1lnm s TYR 109 Cb 0.02 0.14 0.05 0.00 0.38 0.00 0.00 41.96 42.54 1lnm s TYR 109 CO 0.20 -0.71 0.36 0.42 -1.52 0.00 0.00 175.55 174.30 1lnm s ILE 110 N -3.87 -0.02 -0.26 -3.49 1.01 -0.73 -3.59 121.20 110.25 1lnm s ILE 110 Ca 0.08 0.08 -0.08 0.00 0.00 0.00 0.00 60.65 60.74 1lnm s ILE 110 Cb 0.02 -0.53 -0.02 0.00 0.01 0.00 0.00 42.46 41.94 1lnm s ILE 110 CO -0.07 0.03 0.08 -0.63 0.00 0.00 0.00 174.94 174.35 1lnm s ILE 111 N 1.08 4.34 0.20 2.92 1.01 -0.01 -1.74 121.20 129.00 1lnm s ILE 111 Ca -0.07 -0.23 0.05 0.00 0.00 0.00 0.00 60.65 60.40 1lnm s ILE 111 Cb -0.07 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 1lnm s ILE 111 CO -0.09 0.29 0.25 -0.83 0.00 0.00 0.00 174.94 174.57 1lnm s GLY 112 N 1.61 1.49 -0.13 6.18 0.00 -0.05 -1.80 107.32 114.63 1lnm s GLY 112 Ca 0.06 -1.23 -0.08 0.00 0.00 0.00 0.00 44.72 43.47 1lnm s GLY 112 CO 0.04 -1.24 0.32 -0.47 0.00 0.00 0.00 173.10 171.74 1lnm s TYR 113 N -1.91 -0.41 0.01 1.90 5.04 -0.51 -2.23 117.35 119.25 1lnm s TYR 113 Ca 0.33 0.94 0.02 0.00 -2.44 0.00 0.00 57.07 55.93 1lnm s TYR 113 Cb -0.09 0.13 -0.01 0.00 0.35 0.00 0.00 41.96 42.34 1lnm s TYR 113 CO 0.27 -0.24 -0.07 0.12 -1.34 0.00 0.00 175.55 174.29 1lnm s PHE 114 N 0.91 0.60 -0.04 4.97 2.19 -0.79 -1.77 117.98 124.05 1lnm s PHE 114 Ca -0.06 -0.24 -0.03 0.00 0.33 0.00 0.00 56.93 56.93 1lnm s PHE 114 Cb -0.07 -0.38 0.02 0.00 -1.31 0.00 0.00 43.02 41.29 1lnm s PHE 114 CO -0.07 -0.03 0.11 0.00 1.83 0.00 0.00 175.22 177.06 1lnm s SER 116 N 0.53 3.11 0.33 0.00 1.04 -0.70 -5.01 113.70 113.01 1lnm s SER 116 Ca -0.04 -0.48 0.09 0.00 0.48 0.00 0.00 55.95 56.01 1lnm s SER 116 Cb -0.06 -0.61 -0.06 0.00 0.10 0.00 0.00 66.02 65.40 1lnm s SER 116 CO -0.02 0.28 -0.03 -0.47 0.98 0.00 0.00 173.24 173.98 1lnm s TYR 117 N -0.40 2.50 0.00 5.02 5.04 -1.26 -2.15 117.35 126.11 1lnm s TYR 117 Ca 0.04 -0.43 0.00 0.00 -2.44 0.00 0.00 57.07 54.23 1lnm s TYR 117 Cb -0.12 -1.41 0.00 0.00 0.35 0.00 0.00 41.96 40.78 1lnm s TYR 117 CO 0.01 0.53 0.00 1.17 -1.34 0.00 0.00 175.55 175.92 1lnm n LYS 122 N -0.89 0.00 -4.47 4.97 3.00 -1.26 -4.65 118.16 114.86 1lnm n LYS 122 Ca -0.05 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.02 1lnm n LYS 122 Cb 0.62 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.57 1lnm n LYS 122 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1lnm s GLY 123 N -0.38 2.62 -0.04 3.14 0.00 -1.26 -3.29 107.32 108.12 1lnm s GLY 123 Ca 0.00 -1.35 -0.10 0.00 0.00 0.00 0.00 44.72 43.28 1lnm s GLY 123 CO 0.00 -1.76 0.23 -2.38 0.00 0.00 0.00 173.10 169.19 1lnm s HIS 124 N -3.24 -0.14 -0.03 1.90 -3.43 -1.19 -4.72 115.29 104.44 1lnm s HIS 124 Ca 0.26 0.29 0.05 0.00 -0.80 0.00 0.00 55.06 54.86 1lnm s HIS 124 Cb 0.02 0.05 -0.03 0.00 -1.43 0.00 0.00 32.58 31.19 1lnm s HIS 124 CO 0.18 -0.25 -0.17 1.41 -2.00 0.00 0.00 174.74 173.90 1lnm s MET 125 N -0.78 2.37 0.02 -0.38 1.75 -0.91 -4.49 119.30 116.88 1lnm s MET 125 Ca -0.09 -0.78 0.05 0.00 -1.25 0.00 0.00 55.69 53.62 1lnm s MET 125 Cb -0.05 -2.28 -0.02 0.00 2.84 0.00 0.00 34.83 35.32 1lnm s MET 125 CO 0.02 0.60 -0.15 -0.51 -0.65 0.00 0.00 175.02 174.33 1lnm s ASP 126 N -0.79 1.72 -0.02 1.11 1.11 -1.26 -1.72 116.67 116.82 1lnm s ASP 126 Ca 0.12 -0.38 0.00 0.00 0.18 0.00 0.00 52.55 52.47 1lnm s ASP 126 Cb -0.10 -0.15 0.02 0.00 1.07 0.00 0.00 42.92 43.75 1lnm s ASP 126 CO 0.01 0.10 -0.00 -0.76 1.18 0.00 0.00 175.17 175.70 1lnm s LEU 127 N -0.79 1.50 -0.02 1.23 1.43 0.19 -4.95 118.68 117.27 1lnm s LEU 127 Ca 0.04 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1lnm s LEU 127 Cb -0.07 -0.15 0.01 0.00 0.03 0.00 0.00 46.19 46.01 1lnm s LEU 127 CO 0.01 -0.05 -0.03 -0.69 0.23 0.00 0.00 176.35 175.81 1lnm s VAL 128 N 0.58 0.30 0.03 -1.59 1.01 -1.26 -1.88 120.40 117.59 1lnm s VAL 128 Ca -0.05 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1lnm s VAL 128 Cb -0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 1lnm s VAL 128 CO -0.01 0.12 -0.05 -1.66 0.00 0.00 0.00 175.10 173.50 1lnm s TRP 129 N 0.34 0.41 -0.16 5.22 -2.14 -0.95 -1.26 118.94 120.40 1lnm s TRP 129 Ca -0.03 -0.56 0.01 0.00 2.66 0.00 0.00 56.10 58.17 1lnm s TRP 129 Cb -0.07 -0.27 0.02 0.00 -3.10 0.00 0.00 33.47 30.05 1lnm s TRP 129 CO -0.01 -0.17 -0.18 0.08 -2.66 0.00 0.00 176.95 174.02 1lnm s VAL 130 N -1.64 1.84 -0.05 -0.66 1.01 0.20 -0.87 120.40 120.23 1lnm s VAL 130 Ca -0.12 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.04 1lnm s VAL 130 Cb -0.09 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 1lnm s VAL 130 CO -0.01 0.50 0.04 -0.76 0.00 0.00 0.00 175.10 174.87 1lnm s LEU 131 N 1.32 3.73 0.04 3.92 1.43 -0.71 -1.69 118.68 126.72 1lnm s LEU 131 Ca 0.04 0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 1lnm s LEU 131 Cb -0.13 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.04 1lnm s LEU 131 CO -0.11 0.33 -0.05 -0.55 0.23 0.00 0.00 176.35 176.19 1lnm s SER 132 N -1.30 0.61 0.54 2.29 0.15 0.17 -1.77 113.70 114.40 1lnm s SER 132 Ca 0.18 -0.61 0.28 0.00 0.70 0.00 0.00 55.95 56.50 1lnm s SER 132 Cb -0.12 0.08 1.56 0.00 -1.71 0.00 0.00 66.02 65.83 1lnm s SER 132 CO 0.08 -0.30 2.13 0.03 1.20 0.00 0.00 173.24 176.38 1lnm h ARG 133 N 4.32 0.00 -6.27 5.44 3.08 -1.56 0.10 114.38 119.49 1lnm h ARG 133 Ca -0.34 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.13 1lnm h ARG 133 Cb 1.20 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.15 1lnm h ARG 133 CO 0.45 0.08 -0.62 -1.54 -1.07 0.00 0.00 179.97 177.27 1lnm s SER 134 N -6.16 4.93 0.55 7.04 1.04 -1.26 -4.76 113.70 115.07 1lnm s SER 134 Ca -0.03 -0.40 0.33 0.00 0.48 0.00 0.00 55.95 56.33 1lnm s SER 134 Cb 0.14 -1.09 1.37 0.00 0.10 0.00 0.00 66.02 66.54 1lnm s SER 134 CO 0.57 0.05 1.99 0.24 0.98 0.00 0.00 173.24 177.07 1lnm h MET 135 N 2.30 0.00 -4.76 4.02 2.86 -1.95 -3.41 114.93 113.99 1lnm h MET 135 Ca -0.47 0.00 -0.45 0.00 -2.06 0.00 0.00 59.70 56.72 1lnm h MET 135 Cb 1.22 0.00 -0.31 0.00 0.06 0.00 0.00 31.60 32.57 1lnm h MET 135 CO 0.60 0.02 -0.80 0.08 1.06 0.00 0.00 176.91 177.87 1lnm s VAL 136 N -3.69 0.91 -0.21 -2.22 1.01 -1.26 -4.87 120.40 110.07 1lnm s VAL 136 Ca 0.01 -0.44 -0.29 0.00 0.00 0.00 0.00 61.98 61.26 1lnm s VAL 136 Cb 0.09 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 1lnm s VAL 136 CO 0.55 0.28 1.55 -0.76 0.00 0.00 0.00 175.10 176.72 1lnm s LEU 137 N 0.12 3.95 0.36 3.92 1.43 -1.26 -5.01 118.68 122.18 1lnm s LEU 137 Ca -0.03 1.62 0.09 0.00 -1.03 0.00 0.00 54.13 54.78 1lnm s LEU 137 Cb -0.09 -3.53 -0.07 0.00 0.03 0.00 0.00 46.19 42.53 1lnm s LEU 137 CO 0.01 -1.17 -0.07 0.42 0.23 0.00 0.00 176.35 175.76 1lnm s THR 138 N 4.88 2.18 0.00 5.49 -4.23 -1.26 -4.71 115.64 117.99 1lnm s THR 138 Ca 0.68 -2.16 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 1lnm s THR 138 Cb -0.24 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 70.87 1lnm s THR 138 CO 0.27 -0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.81 1lnm n GLY 139 N -0.83 1.77 0.31 3.99 0.00 -1.26 -2.40 105.19 106.78 1lnm n GLY 139 Ca -0.05 0.46 -0.12 0.00 0.00 0.00 0.00 46.02 46.31 1lnm n GLY 139 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1lnm h GLU 140 N 0.00 -0.46 -0.58 1.61 4.81 -2.00 -2.40 114.58 115.57 1lnm h GLU 140 Ca 0.00 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1lnm h GLU 140 Cb 0.00 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1lnm h GLU 140 CO 0.00 -0.31 0.26 0.00 -0.73 0.00 0.00 179.01 178.24 1lnm h ALA 141 N 0.25 0.75 -0.51 2.92 0.00 -1.88 -2.28 119.26 118.51 1lnm h ALA 141 Ca 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1lnm h ALA 141 Cb 0.53 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1lnm h ALA 141 CO -0.20 0.32 0.29 -0.22 0.00 0.00 0.00 179.25 179.44 1lnm h LYS 142 N 0.79 0.70 -0.02 0.00 3.64 -1.41 0.27 116.57 120.54 1lnm h LYS 142 Ca 0.20 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.40 1lnm h LYS 142 Cb 0.14 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1lnm h LYS 142 CO -0.02 0.53 -0.44 1.15 -2.27 0.00 0.00 179.45 178.40 1lnm h THR 143 N 0.68 1.32 0.04 1.00 2.02 -1.32 -0.26 112.91 116.38 1lnm h THR 143 Ca 0.18 -1.54 -0.00 0.00 0.77 0.00 0.00 66.41 65.82 1lnm h THR 143 Cb 0.03 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 1lnm h THR 143 CO -0.03 0.44 -0.02 0.00 0.37 0.00 0.00 175.52 176.29 1lnm h ALA 144 N 1.51 -0.05 -0.77 6.16 0.00 -1.13 -2.51 119.26 122.47 1lnm h ALA 144 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1lnm h ALA 144 Cb 0.80 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 1lnm h ALA 144 CO 0.06 -0.24 0.50 0.28 0.00 0.00 0.00 179.25 179.85 1lnm h VAL 145 N -0.63 1.21 -0.54 0.00 2.07 -0.70 -2.27 116.25 115.38 1lnm h VAL 145 Ca -0.00 -0.40 -0.12 0.00 0.82 0.00 0.00 66.70 67.00 1lnm h VAL 145 Cb 0.57 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1lnm h VAL 145 CO 0.01 0.20 -0.13 -0.33 0.02 0.00 0.00 177.57 177.34 1lnm h GLU 146 N 1.05 1.04 -0.29 1.57 5.08 -1.09 -2.30 114.58 119.65 1lnm h GLU 146 Ca 0.28 -0.39 -0.07 0.00 -1.00 0.00 0.00 59.36 58.17 1lnm h GLU 146 Cb -0.10 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1lnm h GLU 146 CO -0.06 1.09 -0.14 -0.91 -1.00 0.00 0.00 179.01 177.99 1lnm h ASN 147 N 0.91 0.48 -0.58 1.42 2.35 -1.25 -1.63 115.58 117.27 1lnm h ASN 147 Ca 0.14 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1lnm h ASN 147 Cb 0.70 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.92 1lnm h ASN 147 CO 0.05 0.65 0.30 0.22 -1.65 0.00 0.00 177.43 177.00 1lnm h TYR 148 N 0.45 0.82 -0.15 1.19 3.20 -1.23 -2.82 116.97 118.43 1lnm h TYR 148 Ca 0.08 -0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.79 1lnm h TYR 148 Cb 0.52 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 1lnm h TYR 148 CO 0.02 0.61 -0.49 -0.07 -1.64 0.00 0.00 178.16 176.59 1lnm h LEU 149 N 0.79 0.43 -0.62 2.82 3.38 -1.01 -1.10 115.31 119.99 1lnm h LEU 149 Ca 0.20 -0.21 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1lnm h LEU 149 Cb 0.08 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1lnm h LEU 149 CO -0.03 0.85 0.00 0.40 0.09 0.00 0.00 178.44 179.75 1lnm h ILE 150 N 0.31 1.27 -0.04 1.22 2.04 -1.18 -2.83 117.51 118.31 1lnm h ILE 150 Ca 0.02 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.72 1lnm h ILE 150 Cb 0.98 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1lnm h ILE 150 CO 0.08 0.42 0.00 0.61 0.00 0.00 0.00 178.15 179.27 1lnm n GLY 151 N -0.42 0.22 3.73 5.37 0.00 -1.08 -4.95 105.19 108.05 1lnm n GLY 151 Ca 0.03 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 1lnm n GLY 151 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1lnm s SER 152 N -1.95 7.35 0.34 1.61 0.15 -0.44 -4.94 113.70 115.83 1lnm s SER 152 Ca 0.36 1.93 0.18 0.00 0.70 0.00 0.00 55.95 59.12 1lnm s SER 152 Cb 0.21 -2.59 0.34 0.00 -1.71 0.00 0.00 66.02 62.27 1lnm s SER 152 CO 0.32 -0.19 1.57 1.55 1.20 0.00 0.00 173.24 177.70 1lnm h PRO 153 N 5.61 0.00 0.00 5.44 0.13 -1.90 -3.39 132.00 137.89 1lnm h PRO 153 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1lnm h PRO 153 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1lnm h PRO 153 CO 0.73 0.37 -0.68 1.33 -0.23 0.00 0.00 178.00 179.52 1lnm n VAL 154 N -3.27 0.00 -4.22 1.56 0.24 -1.26 -5.01 118.33 106.38 1lnm n VAL 154 Ca 0.02 -0.28 -0.35 0.00 -2.04 0.00 0.00 64.34 61.70 1lnm n VAL 154 Cb 0.62 0.77 -0.10 0.00 -1.47 0.00 0.00 33.84 33.66 1lnm n VAL 154 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1lnm s VAL 155 N -1.97 4.47 -0.56 3.34 1.01 -1.26 -5.07 120.40 120.37 1lnm s VAL 155 Ca 0.01 -0.17 -0.13 0.00 0.00 0.00 0.00 61.98 61.69 1lnm s VAL 155 Cb 0.05 -2.95 0.14 0.00 0.00 0.00 0.00 36.38 33.62 1lnm s VAL 155 CO 0.30 0.53 0.48 -0.62 0.00 0.00 0.00 175.10 175.79 1lnm s ASP 156 N -0.16 6.06 0.33 3.32 3.68 -1.26 -4.85 116.67 123.79 1lnm s ASP 156 Ca 0.06 -1.98 0.06 0.00 2.13 0.00 0.00 52.55 52.82 1lnm s ASP 156 Cb -0.12 -2.13 0.73 0.00 -1.45 0.00 0.00 42.92 39.94 1lnm s ASP 156 CO 0.02 -0.75 1.86 0.77 0.13 0.00 0.00 175.17 177.20 1lnm h SER 157 N 8.54 0.75 -0.85 -0.34 4.64 -1.97 0.24 113.55 124.55 1lnm h SER 157 Ca -0.21 0.04 0.17 0.00 -0.47 0.00 0.00 61.79 61.32 1lnm h SER 157 Cb 1.08 -0.11 -0.06 0.00 -0.31 0.00 0.00 62.40 63.00 1lnm h SER 157 CO 0.93 0.39 0.56 1.56 -0.87 0.00 0.00 176.83 179.41 1lnm h GLN 158 N 0.80 0.46 0.00 4.77 4.20 -2.00 -2.25 115.11 121.08 1lnm h GLN 158 Ca 0.46 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.14 1lnm h GLN 158 Cb 0.62 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1lnm h GLN 158 CO -0.22 0.31 0.00 0.87 -0.67 0.00 0.00 178.83 179.12 1lnm h LYS 159 N 0.48 0.00 -6.41 1.46 1.57 -0.93 -3.45 116.57 109.28 1lnm h LYS 159 Ca 0.44 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.68 1lnm h LYS 159 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.28 1lnm h LYS 159 CO -0.17 0.00 0.83 -0.51 -0.57 0.00 0.00 179.45 179.03 1lnm s LEU 160 N -4.85 4.33 -0.22 2.94 1.43 -0.85 -4.35 118.68 117.10 1lnm s LEU 160 Ca 0.10 2.18 -0.10 0.00 -1.03 0.00 0.00 54.13 55.28 1lnm s LEU 160 Cb 0.11 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.72 1lnm s LEU 160 CO 0.61 -0.72 0.14 -0.69 0.23 0.00 0.00 176.35 175.91 1lnm s VAL 161 N 2.20 5.26 -0.06 -1.59 1.01 -0.31 -4.94 120.40 121.97 1lnm s VAL 161 Ca 0.65 0.14 -0.15 0.00 0.00 0.00 0.00 61.98 62.62 1lnm s VAL 161 Cb -0.33 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 1lnm s VAL 161 CO 0.28 0.39 0.39 -0.31 0.00 0.00 0.00 175.10 175.84 1lnm s TYR 162 N 0.80 3.62 0.43 5.22 1.51 -1.26 -2.16 117.35 125.52 1lnm s TYR 162 Ca 0.07 0.87 -0.23 0.00 -1.01 0.00 0.00 57.07 56.76 1lnm s TYR 162 Cb -0.13 -2.34 -0.08 0.00 -0.11 0.00 0.00 41.96 39.30 1lnm s TYR 162 CO 0.02 0.46 1.13 -1.12 -1.11 0.00 0.00 175.55 174.94 1lnm s SER 163 N -0.40 6.38 -0.40 2.29 0.01 0.23 -4.98 113.70 116.84 1lnm s SER 163 Ca 0.22 2.23 0.02 0.00 1.31 0.00 0.00 55.95 59.74 1lnm s SER 163 Cb -0.15 -2.60 0.12 0.00 0.21 0.00 0.00 66.02 63.59 1lnm s SER 163 CO 0.10 -0.77 0.16 -0.62 0.41 0.00 0.00 173.24 172.52 1lnm s ASP 164 N -1.39 4.20 0.00 2.44 3.68 -1.26 -4.98 116.67 119.36 1lnm s ASP 164 Ca 0.61 -2.34 0.00 0.00 2.13 0.00 0.00 52.55 52.95 1lnm s ASP 164 Cb -0.27 -1.29 0.00 0.00 -1.45 0.00 0.00 42.92 39.91 1lnm s ASP 164 CO 0.33 -0.33 0.35 0.49 0.13 0.00 0.00 175.17 176.14 1lnm n PHE 165 N 3.96 0.00 -0.28 -5.34 3.72 -1.26 -4.82 117.46 113.44 1lnm n PHE 165 Ca 0.04 -0.03 -0.05 0.00 -0.05 0.00 0.00 57.45 57.36 1lnm n PHE 165 Cb 0.38 -0.07 0.06 0.00 -0.94 0.00 0.00 39.48 38.91 1lnm n PHE 165 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1lnm h SER 166 N 0.38 0.97 0.00 4.37 0.02 -2.02 -3.50 113.55 113.77 1lnm h SER 166 Ca 0.00 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1lnm h SER 166 Cb 0.35 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1lnm h SER 166 CO 0.00 0.80 0.00 0.00 -1.14 0.00 0.00 176.83 176.49