#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lo5 s HIS 5 N 0.00 0.41 -0.10 4.31 3.76 -1.26 -5.07 115.29 117.33 1lo5 s HIS 5 Ca 0.00 -0.66 -0.04 0.00 -0.15 0.00 0.00 55.06 54.20 1lo5 s HIS 5 Cb 0.00 -0.28 0.05 0.00 1.11 0.00 0.00 32.58 33.46 1lo5 s HIS 5 CO 0.00 -0.21 0.22 0.08 -0.85 0.00 0.00 174.74 173.98 1lo5 s VAL 6 N -2.09 -0.20 0.03 -0.90 1.01 -1.26 -5.04 120.40 111.95 1lo5 s VAL 6 Ca -0.09 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1lo5 s VAL 6 Cb -0.05 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1lo5 s VAL 6 CO -0.03 0.10 0.10 -0.63 0.00 0.00 0.00 175.10 174.64 1lo5 s ILE 7 N 1.79 4.78 -0.12 2.22 1.01 -1.26 -1.65 121.20 127.98 1lo5 s ILE 7 Ca -0.04 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.08 1lo5 s ILE 7 Cb -0.11 -3.25 0.03 0.00 0.01 0.00 0.00 42.46 39.14 1lo5 s ILE 7 CO -0.08 0.24 -0.02 -0.63 0.00 0.00 0.00 174.94 174.46 1lo5 s ILE 8 N -1.31 0.64 -0.62 2.92 -1.09 0.59 -4.93 121.20 117.39 1lo5 s ILE 8 Ca 0.27 -0.19 -0.18 0.00 -2.23 0.00 0.00 60.65 58.32 1lo5 s ILE 8 Cb -0.12 -0.83 0.12 0.00 -1.58 0.00 0.00 42.46 40.04 1lo5 s ILE 8 CO 0.19 0.18 0.70 -1.58 -1.23 0.00 0.00 174.94 173.20 1lo5 s GLN 9 N 1.85 3.10 0.01 2.79 0.74 -1.26 -1.06 119.66 125.83 1lo5 s GLN 9 Ca 0.03 -1.47 0.06 0.00 0.05 0.00 0.00 55.36 54.03 1lo5 s GLN 9 Cb -0.14 -4.31 -0.03 0.00 1.10 0.00 0.00 33.01 29.63 1lo5 s GLN 9 CO -0.07 -1.51 -0.15 0.00 -0.55 0.00 0.00 175.29 173.01 1lo5 s ALA 10 N 2.38 2.68 0.20 1.58 0.00 -1.09 -5.05 121.76 122.45 1lo5 s ALA 10 Ca 0.12 -1.11 -0.20 0.00 0.00 0.00 0.00 51.96 50.77 1lo5 s ALA 10 Cb -0.23 -0.86 0.04 0.00 0.00 0.00 0.00 23.12 22.07 1lo5 s ALA 10 CO 0.04 0.58 0.58 -1.83 0.00 0.00 0.00 175.76 175.12 1lo5 s GLU 11 N -1.24 1.41 0.16 0.00 -1.05 -1.26 -2.39 118.70 114.33 1lo5 s GLU 11 Ca 0.14 -0.76 -0.21 0.00 -0.15 0.00 0.00 54.97 53.99 1lo5 s GLU 11 Cb -0.11 0.56 0.06 0.00 -0.44 0.00 0.00 34.13 34.20 1lo5 s GLU 11 CO 0.04 -0.61 0.56 -0.59 0.95 0.00 0.00 175.26 175.61 1lo5 s PHE 12 N -3.84 -0.45 -0.02 4.83 -0.12 -0.25 -4.96 117.98 113.17 1lo5 s PHE 12 Ca 0.07 0.20 0.01 0.00 -0.05 0.00 0.00 56.93 57.16 1lo5 s PHE 12 Cb -0.02 0.50 0.01 0.00 -0.63 0.00 0.00 43.02 42.89 1lo5 s PHE 12 CO -0.05 -0.84 -0.02 -0.47 -0.05 0.00 0.00 175.22 173.80 1lo5 s TYR 13 N -3.77 0.33 -0.05 3.49 5.04 -1.26 -0.17 117.35 120.96 1lo5 s TYR 13 Ca 0.02 -0.03 0.04 0.00 -2.44 0.00 0.00 57.07 54.66 1lo5 s TYR 13 Cb -0.01 -0.33 -0.00 0.00 0.35 0.00 0.00 41.96 41.97 1lo5 s TYR 13 CO -0.12 -0.08 -0.17 -1.17 -1.34 0.00 0.00 175.55 172.68 1lo5 s LEU 14 N 0.56 1.89 0.11 6.97 2.96 0.13 -4.97 118.68 126.33 1lo5 s LEU 14 Ca -0.06 -0.35 0.09 0.00 -0.22 0.00 0.00 54.13 53.60 1lo5 s LEU 14 Cb -0.09 -0.96 -0.04 0.00 0.50 0.00 0.00 46.19 45.60 1lo5 s LEU 14 CO -0.01 0.14 -0.21 0.20 -1.32 0.00 0.00 176.35 175.15 1lo5 s ASN 15 N 0.12 3.67 0.00 3.68 0.01 -1.26 0.14 114.94 121.30 1lo5 s ASN 15 Ca -0.06 -0.61 0.31 0.00 -0.71 0.00 0.00 52.86 51.80 1lo5 s ASN 15 Cb -0.12 -0.44 1.73 0.00 0.41 0.00 0.00 41.25 42.83 1lo5 s ASN 15 CO 0.03 0.19 2.14 -2.65 -1.51 0.00 0.00 177.10 175.29 1lo5 n PRO 16 N 0.94 0.91 0.32 -0.60 -0.02 -1.26 -4.85 135.00 130.45 1lo5 n PRO 16 Ca -0.16 -0.08 0.19 0.00 -2.02 0.00 0.00 63.50 61.43 1lo5 n PRO 16 Cb 0.53 -1.50 1.00 0.00 -0.02 0.00 0.00 33.50 33.50 1lo5 n PRO 16 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1lo5 h ASP 17 N 0.19 0.00 -4.55 2.55 5.19 -2.01 -3.44 116.42 114.34 1lo5 h ASP 17 Ca 0.00 0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 56.15 1lo5 h ASP 17 Cb 0.11 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.59 1lo5 h ASP 17 CO 0.00 0.00 -0.36 0.00 -3.12 0.00 0.00 179.24 175.76 1lo5 n GLN 18 N -3.08 -2.72 -4.16 3.56 6.02 0.12 -4.94 117.38 112.18 1lo5 n GLN 18 Ca -0.02 0.48 -0.30 0.00 -0.01 0.00 0.00 57.00 57.15 1lo5 n GLN 18 Cb 0.24 -5.10 -0.08 0.00 1.02 0.00 0.00 30.24 26.32 1lo5 n GLN 18 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1lo5 s SER 19 N -2.27 4.81 0.27 1.08 1.04 -1.01 -4.93 113.70 112.69 1lo5 s SER 19 Ca 0.14 -0.26 -0.11 0.00 0.48 0.00 0.00 55.95 56.19 1lo5 s SER 19 Cb -0.07 -1.07 0.00 0.00 0.10 0.00 0.00 66.02 64.98 1lo5 s SER 19 CO 0.17 0.17 0.50 -0.83 0.98 0.00 0.00 173.24 174.23 1lo5 s GLY 20 N -2.35 0.68 0.09 7.32 0.00 -1.26 0.21 107.32 112.00 1lo5 s GLY 20 Ca 0.25 -0.97 -0.18 0.00 0.00 0.00 0.00 44.72 43.81 1lo5 s GLY 20 CO 0.17 -0.66 0.44 1.85 0.00 0.00 0.00 173.10 174.90 1lo5 s GLU 21 N -3.73 1.03 -0.14 2.90 2.12 0.77 -4.95 118.70 116.69 1lo5 s GLU 21 Ca 0.23 -0.48 -0.04 0.00 0.36 0.00 0.00 54.97 55.04 1lo5 s GLU 21 Cb -0.01 0.46 0.07 0.00 0.26 0.00 0.00 34.13 34.91 1lo5 s GLU 21 CO 0.11 -0.39 0.22 0.12 -0.54 0.00 0.00 175.26 174.79 1lo5 s PHE 22 N -3.10 -0.31 0.13 5.30 2.19 -1.26 -1.09 117.98 119.83 1lo5 s PHE 22 Ca -0.01 0.62 -0.12 0.00 0.33 0.00 0.00 56.93 57.75 1lo5 s PHE 22 Cb 0.00 -0.21 0.01 0.00 -1.31 0.00 0.00 43.02 41.52 1lo5 s PHE 22 CO -0.07 -0.42 0.31 0.00 1.83 0.00 0.00 175.22 176.87 1lo5 s MET 23 N 2.36 1.04 0.10 10.12 0.23 -1.00 -0.95 119.30 131.19 1lo5 s MET 23 Ca 0.04 -0.94 0.03 0.00 -1.03 0.00 0.00 55.69 53.79 1lo5 s MET 23 Cb -0.13 0.41 -0.04 0.00 -1.53 0.00 0.00 34.83 33.53 1lo5 s MET 23 CO -0.09 -0.38 0.10 -0.06 -2.03 0.00 0.00 175.02 172.56 1lo5 s PHE 24 N -3.87 3.21 -0.02 3.16 0.40 0.12 -2.68 117.98 118.29 1lo5 s PHE 24 Ca 0.08 0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.49 1lo5 s PHE 24 Cb 0.03 -1.61 0.02 0.00 0.51 0.00 0.00 43.02 41.97 1lo5 s PHE 24 CO -0.08 0.53 -0.01 0.34 0.70 0.00 0.00 175.22 176.70 1lo5 s ASP 25 N -2.55 0.47 -0.38 1.36 -1.08 -0.23 -1.25 116.67 113.02 1lo5 s ASP 25 Ca 0.30 -0.05 -0.00 0.00 -0.52 0.00 0.00 52.55 52.28 1lo5 s ASP 25 Cb -0.12 -0.21 0.10 0.00 -1.46 0.00 0.00 42.92 41.24 1lo5 s ASP 25 CO 0.23 -0.06 0.13 0.12 0.52 0.00 0.00 175.17 176.11 1lo5 s PHE 26 N 0.75 3.64 -1.53 -5.34 5.36 -0.57 -0.30 117.98 119.99 1lo5 s PHE 26 Ca -0.08 -2.62 -0.05 0.00 -0.96 0.00 0.00 56.93 53.22 1lo5 s PHE 26 Cb -0.11 -3.05 0.01 0.00 -0.34 0.00 0.00 43.02 39.53 1lo5 s PHE 26 CO -0.01 -0.96 0.54 -0.25 -1.46 0.00 0.00 175.22 173.08 1lo5 n ASP 27 N 4.46 -5.74 0.00 6.13 8.00 -0.66 -2.27 116.55 126.48 1lo5 n ASP 27 Ca -0.00 -0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.22 1lo5 n ASP 27 Cb 0.42 -4.66 0.00 0.00 -0.02 0.00 0.00 41.12 36.86 1lo5 n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lo5 n GLY 28 N -1.43 0.12 3.43 0.44 0.00 -1.26 -5.06 105.19 101.44 1lo5 n GLY 28 Ca -0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 1lo5 n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1lo5 s ASP 29 N -2.11 5.01 0.17 1.61 1.01 -0.96 -5.00 116.67 116.41 1lo5 s ASP 29 Ca 0.00 -0.22 -0.33 0.00 0.71 0.00 0.00 52.55 52.71 1lo5 s ASP 29 Cb 0.00 -1.89 -0.14 0.00 1.01 0.00 0.00 42.92 41.90 1lo5 s ASP 29 CO 0.00 -0.01 1.44 1.21 0.21 0.00 0.00 175.17 178.01 1lo5 n GLU 30 N 4.79 1.83 -0.12 8.23 2.13 -1.26 -1.52 120.64 134.72 1lo5 n GLU 30 Ca -0.17 0.66 -0.25 0.00 0.66 0.00 0.00 57.16 58.06 1lo5 n GLU 30 Cb 0.51 -2.34 -0.11 0.00 0.27 0.00 0.00 31.44 29.78 1lo5 n GLU 30 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1lo5 n ILE 31 N 2.59 1.53 -3.51 6.31 5.41 -0.38 -4.70 119.36 126.61 1lo5 n ILE 31 Ca 0.15 -0.16 -0.10 0.00 1.00 0.00 0.00 62.75 63.65 1lo5 n ILE 31 Cb 0.27 -1.99 -0.03 0.00 -0.71 0.00 0.00 39.64 37.19 1lo5 n ILE 31 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 1lo5 s PHE 32 N -2.42 -0.39 0.07 1.39 -0.12 -1.23 -1.92 117.98 113.35 1lo5 s PHE 32 Ca -0.33 0.37 -0.01 0.00 -0.05 0.00 0.00 56.93 56.92 1lo5 s PHE 32 Cb 0.09 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.96 1lo5 s PHE 32 CO 0.55 -0.54 -0.01 -3.38 -0.05 0.00 0.00 175.22 171.78 1lo5 s HIS 33 N -2.66 0.59 -0.12 3.49 -3.43 -0.95 0.15 115.29 112.35 1lo5 s HIS 33 Ca 0.02 -1.10 -0.14 0.00 -0.80 0.00 0.00 55.06 53.05 1lo5 s HIS 33 Cb -0.01 -0.40 -0.05 0.00 -1.43 0.00 0.00 32.58 30.69 1lo5 s HIS 33 CO -0.06 -0.41 0.31 0.08 -2.00 0.00 0.00 174.74 172.66 1lo5 s VAL 34 N -3.95 5.26 -0.97 -5.38 1.01 -0.12 0.66 120.40 116.91 1lo5 s VAL 34 Ca 0.11 0.60 -0.20 0.00 0.00 0.00 0.00 61.98 62.49 1lo5 s VAL 34 Cb 0.08 -3.64 0.10 0.00 0.00 0.00 0.00 36.38 32.92 1lo5 s VAL 34 CO -0.07 0.45 1.27 -0.62 0.00 0.00 0.00 175.10 176.13 1lo5 s ASP 35 N -0.01 6.58 0.20 3.32 -1.08 0.22 -4.61 116.67 121.30 1lo5 s ASP 35 Ca 0.19 -1.81 -0.09 0.00 -0.52 0.00 0.00 52.55 50.31 1lo5 s ASP 35 Cb -0.14 -2.47 0.28 0.00 -1.46 0.00 0.00 42.92 39.13 1lo5 s ASP 35 CO 0.06 -1.25 1.21 0.23 0.52 0.00 0.00 175.17 175.94 1lo5 n MET 36 N 7.53 -0.12 0.19 4.34 2.81 -1.26 0.66 117.12 131.27 1lo5 n MET 36 Ca 0.28 1.20 -0.14 0.00 -1.81 0.00 0.00 57.70 57.24 1lo5 n MET 36 Cb 0.50 -1.79 -0.08 0.00 -0.71 0.00 0.00 33.22 31.14 1lo5 n MET 36 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1lo5 h ALA 37 N 1.34 -0.49 0.00 3.04 0.00 -1.97 -2.99 119.26 118.19 1lo5 h ALA 37 Ca 0.33 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1lo5 h ALA 37 Cb 0.52 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1lo5 h ALA 37 CO -0.79 -0.62 0.00 1.63 0.00 0.00 0.00 179.25 179.47 1lo5 n LYS 38 N -5.18 0.02 -3.70 0.00 5.02 -0.73 -4.90 118.16 108.69 1lo5 n LYS 38 Ca -0.10 0.16 -0.23 0.00 -2.02 0.00 0.00 58.31 56.12 1lo5 n LYS 38 Cb 0.27 -1.52 0.03 0.00 -0.02 0.00 0.00 35.03 33.79 1lo5 n LYS 38 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1lo5 n LYS 39 N -1.55 -3.92 -3.85 1.97 5.02 0.21 -5.00 118.16 111.04 1lo5 n LYS 39 Ca 0.05 0.58 -0.12 0.00 -2.02 0.00 0.00 58.31 56.80 1lo5 n LYS 39 Cb 0.24 -4.96 -0.12 0.00 -0.02 0.00 0.00 35.03 30.17 1lo5 n LYS 39 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1lo5 s GLU 40 N -5.95 0.20 0.05 1.97 -1.05 -1.20 -4.72 118.70 108.00 1lo5 s GLU 40 Ca 0.11 0.02 -0.30 0.00 -0.15 0.00 0.00 54.97 54.64 1lo5 s GLU 40 Cb -0.03 0.09 -0.05 0.00 -0.44 0.00 0.00 34.13 33.70 1lo5 s GLU 40 CO 0.83 -0.03 1.16 -0.08 0.95 0.00 0.00 175.26 178.08 1lo5 s THR 41 N -0.28 4.17 -0.38 1.83 -1.32 -1.26 -0.61 115.64 117.79 1lo5 s THR 41 Ca -0.03 1.56 -0.03 0.00 -1.21 0.00 0.00 61.69 61.97 1lo5 s THR 41 Cb -0.03 -4.00 0.09 0.00 -1.51 0.00 0.00 72.50 67.06 1lo5 s THR 41 CO 0.00 0.12 0.16 -0.69 -2.21 0.00 0.00 174.62 172.01 1lo5 s VAL 42 N 1.06 3.30 0.18 5.08 1.01 0.21 -4.93 120.40 126.31 1lo5 s VAL 42 Ca 0.58 -1.85 -0.31 0.00 0.00 0.00 0.00 61.98 60.40 1lo5 s VAL 42 Cb -0.28 -3.16 -0.09 0.00 0.00 0.00 0.00 36.38 32.85 1lo5 s VAL 42 CO 0.29 -0.55 1.39 0.26 0.00 0.00 0.00 175.10 176.50 1lo5 s TRP 43 N 1.19 3.18 0.05 5.22 0.52 -1.26 -2.23 118.94 125.60 1lo5 s TRP 43 Ca 0.05 1.02 -0.16 0.00 0.02 0.00 0.00 56.10 57.03 1lo5 s TRP 43 Cb -0.22 -3.71 -0.07 0.00 -1.15 0.00 0.00 33.47 28.32 1lo5 s TRP 43 CO -0.03 -2.39 1.26 -0.09 0.02 0.00 0.00 176.95 175.72 1lo5 h ARG 44 N 5.91 -0.34 -4.85 4.98 9.65 -1.66 -3.37 114.38 124.70 1lo5 h ARG 44 Ca -0.44 0.02 -0.65 0.00 -1.10 0.00 0.00 59.98 57.81 1lo5 h ARG 44 Cb 1.21 0.08 -0.18 0.00 -1.39 0.00 0.00 29.97 29.69 1lo5 h ARG 44 CO 0.82 -0.23 -0.52 -0.51 2.80 0.00 0.00 179.97 182.33 1lo5 s LEU 45 N -7.42 4.10 0.43 3.80 1.43 -1.26 -4.96 118.68 114.81 1lo5 s LEU 45 Ca -0.08 -0.18 0.36 0.00 -1.03 0.00 0.00 54.13 53.20 1lo5 s LEU 45 Cb 0.03 -2.10 1.41 0.00 0.03 0.00 0.00 46.19 45.56 1lo5 s LEU 45 CO 0.29 -0.11 1.38 1.21 0.23 0.00 0.00 176.35 179.34 1lo5 n GLU 46 N 5.05 -0.02 -0.11 1.70 2.13 -1.26 -0.38 120.64 127.75 1lo5 n GLU 46 Ca -0.14 1.04 -0.05 0.00 0.66 0.00 0.00 57.16 58.67 1lo5 n GLU 46 Cb 0.51 -2.19 0.02 0.00 0.27 0.00 0.00 31.44 30.05 1lo5 n GLU 46 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1lo5 h GLU 47 N 0.00 0.04 -1.18 5.31 3.07 -1.93 -2.58 114.58 117.30 1lo5 h GLU 47 Ca 0.80 -0.00 0.34 0.00 -0.50 0.00 0.00 59.36 60.00 1lo5 h GLU 47 Cb 2.87 -0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 30.73 1lo5 h GLU 47 CO -0.23 0.02 0.90 0.74 -1.40 0.00 0.00 179.01 179.04 1lo5 h PHE 48 N 0.04 0.00 0.00 4.33 -1.00 -1.11 -1.19 116.94 118.01 1lo5 h PHE 48 Ca 0.19 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.78 1lo5 h PHE 48 Cb 0.28 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.82 1lo5 h PHE 48 CO -0.31 0.00 -0.86 0.78 -1.61 0.00 0.00 178.31 176.30 1lo5 h GLY 49 N 0.00 0.04 1.51 -1.45 0.00 -1.63 -2.54 103.07 99.00 1lo5 h GLY 49 Ca 0.56 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.81 1lo5 h GLY 49 CO -0.01 0.07 0.00 0.54 0.00 0.00 0.00 176.54 177.14 1lo5 n ARG 50 N -3.55 0.20 -0.01 4.80 1.74 -0.45 -3.96 116.66 115.44 1lo5 n ARG 50 Ca -0.01 0.15 -0.03 0.00 -0.77 0.00 0.00 57.85 57.19 1lo5 n ARG 50 Cb 0.82 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.75 1lo5 n ARG 50 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1lo5 n PHE 51 N -1.26 0.00 -2.02 -1.55 3.01 -1.16 -5.12 117.46 109.37 1lo5 n PHE 51 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.52 1lo5 n PHE 51 Cb 0.09 -0.18 0.00 0.00 -0.01 0.00 0.00 39.48 39.39 1lo5 n PHE 51 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1lo5 n ALA 52 N -3.69 0.00 -3.59 4.37 0.00 -0.97 -5.17 120.51 111.47 1lo5 n ALA 52 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.41 1lo5 n ALA 52 Cb 0.18 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.65 1lo5 n ALA 52 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1lo5 n SER 53 N 0.00 -1.49 -3.15 0.00 3.41 -1.26 -4.75 113.62 106.37 1lo5 n SER 53 Ca 0.00 -1.95 0.06 0.00 -0.26 0.00 0.00 58.87 56.71 1lo5 n SER 53 Cb 0.00 2.46 -0.02 0.00 -0.26 0.00 0.00 64.21 66.39 1lo5 n SER 53 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1lo5 s PHE 54 N -3.83 -0.19 -1.02 7.33 5.36 -1.26 -5.08 117.98 119.29 1lo5 s PHE 54 Ca 0.13 0.21 -0.26 0.00 -0.96 0.00 0.00 56.93 56.04 1lo5 s PHE 54 Cb -0.03 0.07 -0.22 0.00 -0.34 0.00 0.00 43.02 42.50 1lo5 s PHE 54 CO 0.07 -0.10 2.15 -0.85 -1.46 0.00 0.00 175.22 175.03 1lo5 n GLU 55 N 5.42 0.17 -0.44 10.12 0.28 -1.26 -4.54 120.64 130.38 1lo5 n GLU 55 Ca -0.09 -1.54 0.38 0.00 -0.16 0.00 0.00 57.16 55.75 1lo5 n GLU 55 Cb 0.55 -3.87 0.63 0.00 1.43 0.00 0.00 31.44 30.18 1lo5 n GLU 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1lo5 n ALA 56 N 19.65 1.28 -0.15 -1.84 0.00 -1.26 0.46 120.51 138.65 1lo5 n ALA 56 Ca 0.42 0.81 0.27 0.00 0.00 0.00 0.00 53.44 54.93 1lo5 n ALA 56 Cb 0.46 -0.99 0.72 0.00 0.00 0.00 0.00 19.45 19.64 1lo5 n ALA 56 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1lo5 h GLN 57 N 0.00 0.01 -0.43 0.00 5.75 -1.85 -1.81 115.11 116.77 1lo5 h GLN 57 Ca 0.82 -0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 59.25 1lo5 h GLN 57 Cb 2.66 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 31.19 1lo5 h GLN 57 CO -0.43 0.00 -0.01 0.78 -2.65 0.00 0.00 178.83 176.52 1lo5 h GLY 58 N 0.01 0.82 1.03 2.39 0.00 -0.38 -3.12 103.07 103.82 1lo5 h GLY 58 Ca 0.40 -0.61 -0.05 0.00 0.00 0.00 0.00 47.33 47.06 1lo5 h GLY 58 CO -0.01 0.56 0.22 0.00 0.00 0.00 0.00 176.54 177.31 1lo5 h ALA 59 N 0.90 0.89 -0.95 3.60 0.00 -1.50 -2.22 119.26 119.98 1lo5 h ALA 59 Ca 0.12 -0.21 0.15 0.00 0.00 0.00 0.00 54.91 54.97 1lo5 h ALA 59 Cb 0.50 -0.26 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 1lo5 h ALA 59 CO 0.02 0.57 0.60 -0.07 0.00 0.00 0.00 179.25 180.37 1lo5 h LEU 60 N 0.99 0.74 0.16 0.00 3.38 -1.47 -1.78 115.31 117.33 1lo5 h LEU 60 Ca 0.22 0.05 -0.30 0.00 0.09 0.00 0.00 57.88 57.94 1lo5 h LEU 60 Cb 0.29 -0.09 0.02 0.00 0.09 0.00 0.00 40.66 40.98 1lo5 h LEU 60 CO -0.01 0.35 -1.32 0.00 0.09 0.00 0.00 178.44 177.55 1lo5 h ALA 61 N 1.59 -0.00 -0.19 1.53 0.00 -1.40 -3.10 119.26 117.69 1lo5 h ALA 61 Ca 0.49 -0.86 0.03 0.00 0.00 0.00 0.00 54.91 54.57 1lo5 h ALA 61 Cb 0.73 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1lo5 h ALA 61 CO -0.25 0.83 0.01 -0.91 0.00 0.00 0.00 179.25 178.93 1lo5 h ASN 62 N 0.13 -0.04 -0.42 0.00 4.21 -0.86 -2.10 115.58 116.50 1lo5 h ASN 62 Ca -0.18 0.04 0.03 0.00 1.21 0.00 0.00 56.30 57.39 1lo5 h ASN 62 Cb 2.03 0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 39.27 1lo5 h ASN 62 CO 0.23 0.00 0.28 0.40 -1.29 0.00 0.00 177.43 177.06 1lo5 h ILE 63 N 0.08 1.03 -0.93 2.81 2.04 -1.43 -0.84 117.51 120.27 1lo5 h ILE 63 Ca 0.09 -0.15 0.06 0.00 1.00 0.00 0.00 64.86 65.86 1lo5 h ILE 63 Cb 0.10 0.55 -0.06 0.00 -0.74 0.00 0.00 36.82 36.67 1lo5 h ILE 63 CO -0.14 0.08 0.59 0.00 0.00 0.00 0.00 178.15 178.68 1lo5 h ALA 64 N 1.76 1.28 -0.21 1.87 0.00 -1.29 0.12 119.26 122.79 1lo5 h ALA 64 Ca 0.17 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1lo5 h ALA 64 Cb 0.13 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1lo5 h ALA 64 CO -0.04 0.37 -0.23 0.28 0.00 0.00 0.00 179.25 179.63 1lo5 h VAL 65 N 1.08 1.33 -0.13 0.00 2.07 -1.05 -2.57 116.25 116.98 1lo5 h VAL 65 Ca 0.40 -1.41 0.05 0.00 0.82 0.00 0.00 66.70 66.56 1lo5 h VAL 65 Cb 0.16 1.75 -0.05 0.00 -1.52 0.00 0.00 31.29 31.62 1lo5 h VAL 65 CO -0.17 0.43 -0.20 0.44 0.02 0.00 0.00 177.57 178.09 1lo5 h ASP 66 N 0.22 -0.62 -0.61 0.57 3.32 -0.43 0.75 116.42 119.62 1lo5 h ASP 66 Ca 0.03 0.11 0.11 0.00 0.02 0.00 0.00 57.03 57.29 1lo5 h ASP 66 Cb 0.79 0.28 -0.12 0.00 0.22 0.00 0.00 39.33 40.51 1lo5 h ASP 66 CO 0.06 -0.25 -0.34 0.50 -1.72 0.00 0.00 179.24 177.49 1lo5 h LYS 67 N -0.25 -0.15 -0.97 3.56 3.64 -0.81 0.24 116.57 121.82 1lo5 h LYS 67 Ca 0.10 0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.62 1lo5 h LYS 67 Cb 0.40 0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 32.17 1lo5 h LYS 67 CO -0.28 -0.10 0.60 0.00 -2.27 0.00 0.00 179.45 177.40 1lo5 h ALA 68 N 1.01 1.47 -0.06 5.00 0.00 -0.20 -1.05 119.26 125.43 1lo5 h ALA 68 Ca 0.24 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 1lo5 h ALA 68 Cb 0.55 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1lo5 h ALA 68 CO -0.69 0.16 -0.61 -0.91 0.00 0.00 0.00 179.25 177.20 1lo5 h ASN 69 N 0.92 0.23 -0.06 0.00 4.21 0.34 -2.91 115.58 118.32 1lo5 h ASN 69 Ca 0.49 -0.13 -0.00 0.00 1.21 0.00 0.00 56.30 57.86 1lo5 h ASN 69 Cb 0.53 -0.07 -0.00 0.00 -1.12 0.00 0.00 38.32 37.66 1lo5 h ASN 69 CO -0.28 0.78 0.02 0.25 -1.29 0.00 0.00 177.43 176.91 1lo5 h LEU 70 N 0.15 0.08 -0.14 1.61 5.85 0.46 -1.04 115.31 122.28 1lo5 h LEU 70 Ca -0.01 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.55 1lo5 h LEU 70 Cb 1.11 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.05 1lo5 h LEU 70 CO 0.09 0.27 -0.40 -0.33 -0.34 0.00 0.00 178.44 177.73 1lo5 h GLU 71 N -0.11 -0.45 0.00 1.25 4.39 -1.38 0.39 114.58 118.67 1lo5 h GLU 71 Ca 0.02 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1lo5 h GLU 71 Cb 0.22 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1lo5 h GLU 71 CO -0.00 -0.30 0.00 -0.89 -1.16 0.00 0.00 179.01 176.66 1lo5 n ILE 72 N -5.43 0.00 -0.30 3.13 2.08 -1.08 -1.53 119.36 116.23 1lo5 n ILE 72 Ca -0.04 1.41 0.14 0.00 0.56 0.00 0.00 62.75 64.82 1lo5 n ILE 72 Cb 0.36 -2.14 0.31 0.00 -0.75 0.00 0.00 39.64 37.41 1lo5 n ILE 72 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 1lo5 h MET 73 N 0.00 0.17 -0.77 0.38 2.86 -0.96 0.50 114.93 117.11 1lo5 h MET 73 Ca 0.00 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 1lo5 h MET 73 Cb 0.00 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.57 1lo5 h MET 73 CO 0.00 0.11 0.47 1.15 1.06 0.00 0.00 176.91 179.70 1lo5 h THR 74 N 0.17 1.05 0.53 2.22 2.02 0.10 0.37 112.91 119.38 1lo5 h THR 74 Ca 0.58 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 67.42 1lo5 h THR 74 Cb 1.19 0.09 0.01 0.00 -1.74 0.00 0.00 68.15 67.69 1lo5 h THR 74 CO -0.69 0.16 -0.26 0.11 0.37 0.00 0.00 175.52 175.21 1lo5 h LYS 75 N 0.89 -0.69 -0.86 6.66 1.57 0.97 0.18 116.57 125.29 1lo5 h LYS 75 Ca 0.33 0.05 0.23 0.00 -1.87 0.00 0.00 60.65 59.38 1lo5 h LYS 75 Cb 0.11 0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.53 1lo5 h LYS 75 CO -0.15 -0.46 0.60 0.07 -0.57 0.00 0.00 179.45 178.94 1lo5 h ARG 76 N -1.02 0.14 0.00 3.15 0.11 -0.59 1.72 114.38 117.90 1lo5 h ARG 76 Ca -0.07 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.00 1lo5 h ARG 76 Cb 0.55 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.59 1lo5 h ARG 76 CO 0.12 0.09 0.00 -1.13 0.10 0.00 0.00 179.97 179.15 1lo5 n SER 77 N -4.37 0.00 -3.45 0.08 3.41 0.13 -4.85 113.62 104.57 1lo5 n SER 77 Ca 0.18 -1.09 -0.20 0.00 -0.26 0.00 0.00 58.87 57.50 1lo5 n SER 77 Cb 0.83 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.84 1lo5 n SER 77 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1lo5 n ASN 78 N -0.83 -4.85 -3.26 4.04 5.15 0.59 -3.21 115.26 112.89 1lo5 n ASN 78 Ca 0.13 -0.79 -0.19 0.00 -0.60 0.00 0.00 54.58 53.13 1lo5 n ASN 78 Cb 0.06 -4.60 -0.02 0.00 -0.53 0.00 0.00 39.78 34.69 1lo5 n ASN 78 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1lo5 n TYR 79 N -3.74 -1.68 -2.57 1.20 4.02 0.62 -4.92 117.16 110.10 1lo5 n TYR 79 Ca -0.14 0.32 -0.42 0.00 -0.01 0.00 0.00 57.90 57.65 1lo5 n TYR 79 Cb 0.63 -2.02 -0.03 0.00 -0.02 0.00 0.00 39.34 37.90 1lo5 n TYR 79 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1lo5 s THR 80 N -2.66 4.41 0.46 -0.72 -4.23 -1.20 -5.03 115.64 106.68 1lo5 s THR 80 Ca 0.33 1.76 -0.01 0.00 -1.18 0.00 0.00 61.69 62.58 1lo5 s THR 80 Cb -0.18 -4.12 -0.01 0.00 1.34 0.00 0.00 72.50 69.52 1lo5 s THR 80 CO 0.40 0.15 0.71 -2.16 -0.54 0.00 0.00 174.62 173.18 1lo5 s PRO 81 N 0.92 3.16 0.42 3.99 0.04 -1.26 -5.01 135.00 137.27 1lo5 s PRO 81 Ca 0.55 -0.30 -0.25 0.00 0.04 0.00 0.00 61.00 61.04 1lo5 s PRO 81 Cb -0.25 -2.50 -0.08 0.00 0.04 0.00 0.00 34.50 31.70 1lo5 s PRO 81 CO 0.29 -0.28 1.29 -1.50 0.04 0.00 0.00 177.00 176.84 1lo5 s ILE 82 N -2.62 2.63 -0.22 0.56 1.10 -1.26 -4.98 121.20 116.41 1lo5 s ILE 82 Ca 0.48 0.55 -0.19 0.00 -0.51 0.00 0.00 60.65 60.98 1lo5 s ILE 82 Cb -0.10 -3.31 -0.03 0.00 0.15 0.00 0.00 42.46 39.17 1lo5 s ILE 82 CO 0.40 0.06 0.54 0.42 -2.11 0.00 0.00 174.94 174.25 1lo5 s THR 83 N -1.30 5.07 0.38 4.00 -4.23 -1.26 -5.03 115.64 113.27 1lo5 s THR 83 Ca 0.59 0.99 -0.25 0.00 -1.18 0.00 0.00 61.69 61.83 1lo5 s THR 83 Cb -0.37 -3.86 -0.12 0.00 1.34 0.00 0.00 72.50 69.49 1lo5 s THR 83 CO 0.47 0.13 0.99 0.59 -0.54 0.00 0.00 174.62 176.26 1lo5 n ASN 84 N 5.10 1.20 -3.54 3.99 3.02 -1.26 -4.73 115.26 119.04 1lo5 n ASN 84 Ca -0.04 1.08 -0.26 0.00 -0.03 0.00 0.00 54.58 55.33 1lo5 n ASN 84 Cb 0.50 -1.33 -0.15 0.00 -0.61 0.00 0.00 39.78 38.20 1lo5 n ASN 84 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1lo5 s VAL 85 N -1.22 -0.14 0.30 2.41 1.01 0.00 -4.95 120.40 117.81 1lo5 s VAL 85 Ca 0.61 -0.48 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 1lo5 s VAL 85 Cb -0.60 -0.82 -0.12 0.00 0.00 0.00 0.00 36.38 34.84 1lo5 s VAL 85 CO 0.58 -0.51 1.46 -0.81 0.00 0.00 0.00 175.10 175.83 1lo5 n PRO 86 N 5.27 2.38 -0.94 2.72 -0.04 -1.26 -2.25 135.00 140.88 1lo5 n PRO 86 Ca -0.06 0.84 -0.16 0.00 -0.04 0.00 0.00 63.50 64.08 1lo5 n PRO 86 Cb 0.45 -2.54 0.12 0.00 -0.04 0.00 0.00 33.50 31.49 1lo5 n PRO 86 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1lo5 n PRO 87 N 1.58 -1.00 -3.79 0.54 -0.04 -1.26 -4.62 135.00 126.41 1lo5 n PRO 87 Ca 0.08 -1.08 -0.26 0.00 -0.04 0.00 0.00 63.50 62.20 1lo5 n PRO 87 Cb 0.35 -0.77 -0.17 0.00 -0.04 0.00 0.00 33.50 32.87 1lo5 n PRO 87 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1lo5 s GLU 88 N -4.53 0.82 0.14 0.54 2.02 0.15 -4.90 118.70 112.94 1lo5 s GLU 88 Ca 0.41 -0.20 -0.03 0.00 0.02 0.00 0.00 54.97 55.17 1lo5 s GLU 88 Cb -0.02 -1.58 -0.05 0.00 0.10 0.00 0.00 34.13 32.59 1lo5 s GLU 88 CO 0.29 -0.44 0.35 0.08 0.02 0.00 0.00 175.26 175.56 1lo5 s VAL 89 N 1.86 5.21 -0.45 2.63 1.01 -1.26 -0.50 120.40 128.91 1lo5 s VAL 89 Ca 0.02 -0.12 0.06 0.00 0.00 0.00 0.00 61.98 61.94 1lo5 s VAL 89 Cb -0.14 -3.65 0.18 0.00 0.00 0.00 0.00 36.38 32.77 1lo5 s VAL 89 CO -0.07 0.01 0.55 0.42 0.00 0.00 0.00 175.10 176.01 1lo5 s THR 90 N -1.68 -0.55 0.39 3.92 -4.23 -1.02 -4.99 115.64 107.48 1lo5 s THR 90 Ca 0.39 -1.23 -0.25 0.00 -1.18 0.00 0.00 61.69 59.42 1lo5 s THR 90 Cb -0.12 -0.43 -0.12 0.00 1.34 0.00 0.00 72.50 73.17 1lo5 s THR 90 CO 0.26 -0.41 0.97 0.52 -0.54 0.00 0.00 174.62 175.42 1lo5 n VAL 91 N 3.42 2.27 -4.00 2.29 0.31 -1.26 -3.85 118.33 117.51 1lo5 n VAL 91 Ca 0.18 -0.50 -0.13 0.00 -0.01 0.00 0.00 64.34 63.88 1lo5 n VAL 91 Cb 0.52 -1.07 -0.02 0.00 -0.91 0.00 0.00 33.84 32.36 1lo5 n VAL 91 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1lo5 s LEU 92 N -0.11 0.71 0.19 7.52 2.96 0.06 -4.97 118.68 125.04 1lo5 s LEU 92 Ca 0.62 -1.39 0.06 0.00 -0.22 0.00 0.00 54.13 53.20 1lo5 s LEU 92 Cb -0.59 1.90 -0.05 0.00 0.50 0.00 0.00 46.19 47.95 1lo5 s LEU 92 CO 0.58 -1.43 -0.10 0.28 -1.32 0.00 0.00 176.35 174.36 1lo5 s THR 93 N -2.80 1.40 0.13 3.68 -1.32 -1.26 0.41 115.64 115.88 1lo5 s THR 93 Ca 0.26 -2.12 -0.12 0.00 -1.21 0.00 0.00 61.69 58.49 1lo5 s THR 93 Cb -0.02 -2.04 -0.05 0.00 -1.51 0.00 0.00 72.50 68.89 1lo5 s THR 93 CO 0.18 -0.60 1.48 -1.13 -2.21 0.00 0.00 174.62 172.34 1lo5 h ASN 94 N 2.62 0.90 -5.00 8.08 -1.24 -1.70 -3.47 115.58 115.77 1lo5 h ASN 94 Ca -0.38 -0.44 -0.06 0.00 0.71 0.00 0.00 56.30 56.14 1lo5 h ASN 94 Cb 1.21 -0.25 -0.19 0.00 0.73 0.00 0.00 38.32 39.82 1lo5 h ASN 94 CO 0.63 1.15 0.19 -0.55 -1.29 0.00 0.00 177.43 177.56 1lo5 s SER 95 N -6.66 -0.65 -0.63 1.15 0.15 -1.26 -5.05 113.70 100.75 1lo5 s SER 95 Ca -0.12 0.67 -0.29 0.00 0.70 0.00 0.00 55.95 56.91 1lo5 s SER 95 Cb 0.10 0.54 -0.16 0.00 -1.71 0.00 0.00 66.02 64.79 1lo5 s SER 95 CO 0.85 -0.64 1.94 -2.65 1.20 0.00 0.00 173.24 173.95 1lo5 n PRO 96 N 0.82 0.00 -1.56 5.44 -0.02 -1.26 -4.72 135.00 133.70 1lo5 n PRO 96 Ca -0.19 0.00 -0.56 0.00 -2.02 0.00 0.00 63.50 60.74 1lo5 n PRO 96 Cb 0.58 -1.18 -0.07 0.00 -0.02 0.00 0.00 33.50 32.81 1lo5 n PRO 96 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1lo5 n VAL 97 N 5.58 0.01 -4.05 -1.45 0.24 -1.26 -4.97 118.33 112.43 1lo5 n VAL 97 Ca 0.48 -0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 62.48 1lo5 n VAL 97 Cb 0.00 -0.47 -0.16 0.00 -1.47 0.00 0.00 33.84 31.73 1lo5 n VAL 97 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1lo5 s GLU 98 N 0.44 2.43 0.26 7.34 2.02 -1.26 -5.08 118.70 124.84 1lo5 s GLU 98 Ca 0.88 -0.61 -0.28 0.00 0.02 0.00 0.00 54.97 54.99 1lo5 s GLU 98 Cb -1.11 -2.19 -0.15 0.00 0.10 0.00 0.00 34.13 30.78 1lo5 s GLU 98 CO 0.53 -0.23 0.76 1.28 0.02 0.00 0.00 175.26 177.62 1lo5 n LEU 99 N 4.73 0.33 -1.77 1.80 4.77 -1.26 0.68 117.00 126.27 1lo5 n LEU 99 Ca -0.18 1.14 -0.13 0.00 -0.03 0.00 0.00 56.01 56.81 1lo5 n LEU 99 Cb 0.50 -1.13 -0.04 0.00 -2.33 0.00 0.00 43.42 40.42 1lo5 n LEU 99 CO 0.22 -2.19 -0.14 0.54 -1.33 0.00 0.00 177.39 174.49 1lo5 n ARG 100 N 0.84 -1.62 -3.88 3.23 1.74 -1.26 -4.90 116.66 110.81 1lo5 n ARG 100 Ca 0.13 0.73 -0.28 0.00 -0.77 0.00 0.00 57.85 57.66 1lo5 n ARG 100 Cb 0.29 -5.11 -0.16 0.00 -1.02 0.00 0.00 32.46 26.46 1lo5 n ARG 100 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1lo5 s GLU 101 N -3.83 1.38 0.86 5.56 -6.30 0.21 -4.99 118.70 111.60 1lo5 s GLU 101 Ca 0.00 -0.53 -0.17 0.00 -2.50 0.00 0.00 54.97 51.77 1lo5 s GLU 101 Cb 0.00 -2.03 -0.15 0.00 0.00 0.00 0.00 34.13 31.95 1lo5 s GLU 101 CO 0.00 -0.45 -0.63 -2.30 0.02 0.00 0.00 175.26 171.90 1lo5 n PRO 102 N 4.88 0.00 -0.53 4.30 -0.02 -1.26 -4.17 135.00 138.19 1lo5 n PRO 102 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1lo5 n PRO 102 Cb 0.47 -0.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.98 1lo5 n PRO 102 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1lo5 n ASN 103 N 3.18 0.00 -3.57 2.55 2.85 -0.72 -4.74 115.26 114.81 1lo5 n ASN 103 Ca 0.00 -0.52 -0.01 0.00 -0.11 0.00 0.00 54.58 53.95 1lo5 n ASN 103 Cb 0.53 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.50 1lo5 n ASN 103 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1lo5 s VAL 104 N -2.98 -0.72 -0.30 3.44 1.01 -1.26 -2.94 120.40 116.65 1lo5 s VAL 104 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 61.98 61.74 1lo5 s VAL 104 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1lo5 s VAL 104 CO 0.00 0.00 0.82 -0.76 0.00 0.00 0.00 175.10 175.16 1lo5 s LEU 105 N 2.59 4.07 0.09 3.92 1.43 0.12 -1.65 118.68 129.25 1lo5 s LEU 105 Ca -0.05 0.73 -0.12 0.00 -1.03 0.00 0.00 54.13 53.66 1lo5 s LEU 105 Cb -0.09 -3.14 -0.06 0.00 0.03 0.00 0.00 46.19 42.93 1lo5 s LEU 105 CO -0.18 -0.64 0.45 -0.63 0.23 0.00 0.00 176.35 175.58 1lo5 s ILE 106 N 3.03 5.01 -0.40 -0.59 1.01 0.16 -1.44 121.20 127.98 1lo5 s ILE 106 Ca 0.34 0.62 0.02 0.00 0.00 0.00 0.00 60.65 61.63 1lo5 s ILE 106 Cb -0.14 -3.68 0.12 0.00 0.01 0.00 0.00 42.46 38.77 1lo5 s ILE 106 CO 0.12 0.30 0.17 0.00 0.00 0.00 0.00 174.94 175.54 1lo5 s PHE 108 N 0.68 2.60 -0.02 0.00 5.36 -1.25 -2.47 117.98 122.88 1lo5 s PHE 108 Ca 0.14 -0.54 -0.26 0.00 -0.96 0.00 0.00 56.93 55.31 1lo5 s PHE 108 Cb -0.22 -4.43 -0.04 0.00 -0.34 0.00 0.00 43.02 38.00 1lo5 s PHE 108 CO -0.08 -1.78 0.80 0.42 -1.46 0.00 0.00 175.22 173.12 1lo5 s ILE 109 N 4.46 4.93 0.20 3.12 1.09 -0.72 -2.44 121.20 131.84 1lo5 s ILE 109 Ca 0.29 1.68 -0.07 0.00 -1.10 0.00 0.00 60.65 61.46 1lo5 s ILE 109 Cb -0.11 -4.14 -0.02 0.00 -1.06 0.00 0.00 42.46 37.12 1lo5 s ILE 109 CO 0.07 0.24 0.27 -0.62 -0.10 0.00 0.00 174.94 174.80 1lo5 s ASP 110 N 0.72 0.06 -1.45 3.58 2.15 0.34 0.98 116.67 123.05 1lo5 s ASP 110 Ca 0.42 -1.11 -0.03 0.00 0.43 0.00 0.00 52.55 52.26 1lo5 s ASP 110 Cb -0.19 0.45 0.02 0.00 -0.30 0.00 0.00 42.92 42.90 1lo5 s ASP 110 CO 0.22 -0.94 0.47 0.29 -0.17 0.00 0.00 175.17 175.05 1lo5 n LYS 111 N -0.28 -3.29 -4.17 4.34 5.02 -0.82 0.30 118.16 119.25 1lo5 n LYS 111 Ca -0.02 0.40 -0.15 0.00 -2.02 0.00 0.00 58.31 56.52 1lo5 n LYS 111 Cb 0.64 -4.62 -0.11 0.00 -0.02 0.00 0.00 35.03 30.92 1lo5 n LYS 111 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1lo5 s PHE 112 N -3.86 1.08 -0.06 2.13 -0.71 -0.71 -4.28 117.98 111.57 1lo5 s PHE 112 Ca 0.12 -0.61 -0.30 0.00 -1.04 0.00 0.00 56.93 55.10 1lo5 s PHE 112 Cb -0.07 -0.59 0.09 0.00 -1.21 0.00 0.00 43.02 41.24 1lo5 s PHE 112 CO 0.89 0.01 0.79 -0.08 -1.34 0.00 0.00 175.22 175.50 1lo5 s THR 113 N -2.20 0.00 1.13 -4.49 -1.32 -0.95 -0.25 115.64 107.56 1lo5 s THR 113 Ca 0.04 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.36 1lo5 s THR 113 Cb -0.04 -1.00 0.26 0.00 -1.51 0.00 0.00 72.50 70.20 1lo5 s THR 113 CO 0.01 0.00 1.07 -2.16 -2.21 0.00 0.00 174.62 171.32 1lo5 s PRO 114 N -1.51 -0.67 -1.33 7.08 0.04 -1.26 -0.82 135.00 136.53 1lo5 s PRO 114 Ca -0.06 0.36 -0.17 0.00 0.04 0.00 0.00 61.00 61.17 1lo5 s PRO 114 Cb -0.00 -1.62 0.06 0.00 0.04 0.00 0.00 34.50 32.97 1lo5 s PRO 114 CO 0.04 -3.44 1.87 -0.35 0.04 0.00 0.00 177.00 175.17 1lo5 n PRO 115 N -4.64 3.05 -3.15 0.56 -0.04 -1.26 -4.75 135.00 124.76 1lo5 n PRO 115 Ca 0.07 -3.07 0.04 0.00 -0.04 0.00 0.00 63.50 60.50 1lo5 n PRO 115 Cb 0.58 -3.45 -0.01 0.00 -0.04 0.00 0.00 33.50 30.58 1lo5 n PRO 115 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1lo5 s VAL 116 N 4.16 -0.99 -0.12 0.52 1.01 -1.26 -5.09 120.40 118.62 1lo5 s VAL 116 Ca 0.53 -0.00 -0.08 0.00 0.00 0.00 0.00 61.98 62.43 1lo5 s VAL 116 Cb 0.07 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.49 1lo5 s VAL 116 CO 0.04 -0.00 0.31 0.54 0.00 0.00 0.00 175.10 175.98 1lo5 s VAL 117 N 2.85 -0.02 -0.08 2.92 0.11 -1.26 -4.58 120.40 120.33 1lo5 s VAL 117 Ca 0.19 0.09 -0.13 0.00 -2.93 0.00 0.00 61.98 59.19 1lo5 s VAL 117 Cb -0.14 -0.45 -0.05 0.00 -1.53 0.00 0.00 36.38 34.21 1lo5 s VAL 117 CO -0.22 0.04 0.32 0.20 -3.33 0.00 0.00 175.10 172.11 1lo5 s ASN 118 N 0.96 6.60 0.00 3.54 0.01 0.12 -4.94 114.94 121.24 1lo5 s ASN 118 Ca -0.07 0.71 0.03 0.00 -0.71 0.00 0.00 52.86 52.83 1lo5 s ASN 118 Cb -0.07 -2.20 -0.01 0.00 0.41 0.00 0.00 41.25 39.38 1lo5 s ASN 118 CO -0.07 0.25 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.97 1lo5 s VAL 119 N -0.46 0.85 -0.09 1.60 1.01 -1.25 0.94 120.40 122.99 1lo5 s VAL 119 Ca 0.20 -0.55 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 1lo5 s VAL 119 Cb -0.14 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.54 1lo5 s VAL 119 CO 0.08 0.17 0.23 -0.89 0.00 0.00 0.00 175.10 174.70 1lo5 s THR 120 N -0.38 -0.01 -0.26 3.92 2.01 0.22 -4.98 115.64 116.17 1lo5 s THR 120 Ca 0.03 0.04 -0.13 0.00 0.31 0.00 0.00 61.69 61.94 1lo5 s THR 120 Cb -0.05 -0.34 -0.04 0.00 0.01 0.00 0.00 72.50 72.08 1lo5 s THR 120 CO -0.00 0.01 0.28 0.26 -0.69 0.00 0.00 174.62 174.48 1lo5 s TRP 121 N 0.39 3.26 -0.21 4.92 0.52 -1.26 -0.41 118.94 126.15 1lo5 s TRP 121 Ca -0.02 0.30 -0.06 0.00 0.02 0.00 0.00 56.10 56.34 1lo5 s TRP 121 Cb -0.04 -2.45 -0.03 0.00 -1.15 0.00 0.00 33.47 29.81 1lo5 s TRP 121 CO -0.02 -0.13 0.02 -0.51 0.02 0.00 0.00 176.95 176.33 1lo5 s LEU 122 N 1.72 3.36 -0.43 2.99 1.43 -0.80 -1.96 118.68 124.98 1lo5 s LEU 122 Ca 0.11 -0.17 -0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1lo5 s LEU 122 Cb -0.15 -1.86 0.12 0.00 0.03 0.00 0.00 46.19 44.32 1lo5 s LEU 122 CO 0.09 0.05 0.23 -0.60 0.23 0.00 0.00 176.35 176.36 1lo5 s ARG 123 N 1.09 2.07 -0.81 1.70 3.52 0.21 -1.05 118.95 125.68 1lo5 s ARG 123 Ca 0.03 -1.89 -0.04 0.00 -0.13 0.00 0.00 55.73 53.70 1lo5 s ARG 123 Cb -0.14 -3.61 0.00 0.00 -1.56 0.00 0.00 34.95 29.64 1lo5 s ARG 123 CO 0.02 -1.09 0.70 0.09 -0.81 0.00 0.00 175.30 174.21 1lo5 n ASN 124 N 4.49 -3.84 0.00 -2.12 3.02 -0.27 -2.94 115.26 113.59 1lo5 n ASN 124 Ca -0.01 -0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.19 1lo5 n ASN 124 Cb 0.41 -3.32 0.00 0.00 -0.61 0.00 0.00 39.78 36.26 1lo5 n ASN 124 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lo5 n GLY 125 N -1.32 2.15 3.82 7.41 0.00 -1.26 -5.01 105.19 110.97 1lo5 n GLY 125 Ca -0.05 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 1lo5 n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lo5 s LYS 126 N 0.00 3.63 0.86 1.61 1.02 -1.15 -4.86 119.74 120.85 1lo5 s LYS 126 Ca 0.00 1.09 -0.12 0.00 0.02 0.00 0.00 55.97 56.96 1lo5 s LYS 126 Cb 0.00 -2.08 0.11 0.00 -0.52 0.00 0.00 37.83 35.33 1lo5 s LYS 126 CO 0.00 -0.55 1.10 -2.14 -0.92 0.00 0.00 175.35 172.84 1lo5 s PRO 127 N -4.06 1.57 0.11 -1.68 0.02 -1.26 0.63 135.00 130.34 1lo5 s PRO 127 Ca 0.61 0.63 -0.10 0.00 0.02 0.00 0.00 61.00 62.17 1lo5 s PRO 127 Cb -0.13 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.53 1lo5 s PRO 127 CO 0.34 -1.98 0.24 0.08 -0.33 0.00 0.00 177.00 175.35 1lo5 s VAL 128 N -3.09 0.12 0.00 3.83 1.01 -0.83 -4.69 120.40 116.74 1lo5 s VAL 128 Ca 0.62 -1.16 0.11 0.00 0.00 0.00 0.00 61.98 61.55 1lo5 s VAL 128 Cb -0.16 -1.44 0.18 0.00 0.00 0.00 0.00 36.38 34.96 1lo5 s VAL 128 CO 0.55 -0.53 1.03 0.41 0.00 0.00 0.00 175.10 176.56 1lo5 n THR 129 N -0.12 0.00 -1.54 3.92 -1.04 -1.26 -4.79 114.28 109.45 1lo5 n THR 129 Ca -0.13 -0.43 -0.41 0.00 -2.04 0.00 0.00 64.05 61.04 1lo5 n THR 129 Cb 0.63 0.67 -0.01 0.00 -1.82 0.00 0.00 70.33 69.79 1lo5 n THR 129 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1lo5 n THR 130 N 0.21 3.39 -2.73 12.58 -2.24 -1.26 -4.33 114.28 119.91 1lo5 n THR 130 Ca -0.08 -2.70 -0.10 0.00 -2.27 0.00 0.00 64.05 58.90 1lo5 n THR 130 Cb 0.88 -2.56 0.05 0.00 -2.10 0.00 0.00 70.33 66.59 1lo5 n THR 130 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lo5 n GLY 131 N 4.04 -0.15 3.58 3.38 0.00 -1.26 -4.07 105.19 110.71 1lo5 n GLY 131 Ca 0.57 0.01 -0.35 0.00 0.00 0.00 0.00 46.02 46.25 1lo5 n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1lo5 s VAL 132 N -3.22 4.62 0.19 1.61 -7.23 -1.26 -4.21 120.40 110.90 1lo5 s VAL 132 Ca 0.11 -0.09 0.00 0.00 -1.81 0.00 0.00 61.98 60.19 1lo5 s VAL 132 Cb -0.01 -3.10 -0.04 0.00 0.56 0.00 0.00 36.38 33.79 1lo5 s VAL 132 CO 0.44 0.43 0.07 -0.94 -0.31 0.00 0.00 175.10 174.79 1lo5 s SER 133 N 0.65 0.72 0.08 4.85 1.04 -1.21 -5.03 113.70 114.81 1lo5 s SER 133 Ca 0.03 -1.29 0.01 0.00 0.48 0.00 0.00 55.95 55.18 1lo5 s SER 133 Cb -0.13 0.24 -0.01 0.00 0.10 0.00 0.00 66.02 66.22 1lo5 s SER 133 CO 0.02 -0.72 0.05 -1.84 0.98 0.00 0.00 173.24 171.73 1lo5 n GLU 134 N -0.27 0.36 -4.64 4.02 0.28 -1.26 -2.30 120.64 116.83 1lo5 n GLU 134 Ca -0.02 -0.75 -0.23 0.00 -0.16 0.00 0.00 57.16 55.99 1lo5 n GLU 134 Cb 0.65 0.54 -0.15 0.00 1.43 0.00 0.00 31.44 33.91 1lo5 n GLU 134 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 1lo5 s THR 135 N -2.15 1.11 1.18 3.84 -4.23 -1.14 -4.96 115.64 109.29 1lo5 s THR 135 Ca 0.07 -0.58 -0.17 0.00 -1.18 0.00 0.00 61.69 59.83 1lo5 s THR 135 Cb 0.00 -0.94 0.21 0.00 1.34 0.00 0.00 72.50 73.11 1lo5 s THR 135 CO 0.05 0.32 0.43 1.33 -0.54 0.00 0.00 174.62 176.22 1lo5 n VAL 136 N 2.89 0.00 -2.12 2.29 0.24 -1.26 -4.32 118.33 116.04 1lo5 n VAL 136 Ca -0.15 -0.28 -0.43 0.00 -2.04 0.00 0.00 64.34 61.44 1lo5 n VAL 136 Cb 0.55 -0.75 -0.02 0.00 -1.47 0.00 0.00 33.84 32.14 1lo5 n VAL 136 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1lo5 s PHE 137 N -2.23 2.05 0.29 6.34 0.40 -1.26 -4.74 117.98 118.82 1lo5 s PHE 137 Ca 0.58 0.61 -0.22 0.00 -0.60 0.00 0.00 56.93 57.30 1lo5 s PHE 137 Cb -0.15 -4.12 -0.09 0.00 0.51 0.00 0.00 43.02 39.17 1lo5 s PHE 137 CO 0.60 -2.71 0.84 -0.51 0.70 0.00 0.00 175.22 174.14 1lo5 s LEU 138 N 5.99 4.30 0.46 -0.37 1.43 -0.54 -4.91 118.68 125.04 1lo5 s LEU 138 Ca 0.73 1.62 -0.12 0.00 -1.03 0.00 0.00 54.13 55.32 1lo5 s LEU 138 Cb -0.21 -3.87 -0.06 0.00 0.03 0.00 0.00 46.19 42.07 1lo5 s LEU 138 CO 0.32 -0.05 0.86 -2.16 0.23 0.00 0.00 176.35 175.54 1lo5 s PRO 139 N -2.15 3.80 0.24 1.29 0.04 -1.26 -1.65 135.00 135.31 1lo5 s PRO 139 Ca 0.48 0.62 0.04 0.00 0.04 0.00 0.00 61.00 62.18 1lo5 s PRO 139 Cb -0.17 -2.29 -0.05 0.00 0.04 0.00 0.00 34.50 32.03 1lo5 s PRO 139 CO 0.21 -0.16 -0.01 1.03 0.04 0.00 0.00 177.00 178.11 1lo5 s ARG 140 N -4.07 1.37 0.54 4.56 0.52 -1.24 -4.81 118.95 115.81 1lo5 s ARG 140 Ca 0.54 -1.69 0.34 0.00 -0.52 0.00 0.00 55.73 54.40 1lo5 s ARG 140 Cb -0.10 -0.70 1.51 0.00 0.52 0.00 0.00 34.95 36.18 1lo5 s ARG 140 CO 0.34 -0.08 2.02 0.93 0.02 0.00 0.00 175.30 178.53 1lo5 h GLU 141 N 2.44 0.00 -0.54 3.54 4.39 -1.99 -2.42 114.58 120.00 1lo5 h GLU 141 Ca -0.39 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.31 1lo5 h GLU 141 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1lo5 h GLU 141 CO 0.65 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 178.10 1lo5 n ASP 142 N -2.98 3.40 -0.07 1.42 5.68 -1.26 -4.95 116.55 117.78 1lo5 n ASP 142 Ca 0.00 -1.98 -0.01 0.00 -0.50 0.00 0.00 54.79 52.30 1lo5 n ASP 142 Cb 0.25 -0.36 -0.00 0.00 -1.14 0.00 0.00 41.12 39.87 1lo5 n ASP 142 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1lo5 n HIS 143 N 1.39 0.00 -0.98 2.11 8.25 -0.91 -5.02 115.22 120.06 1lo5 n HIS 143 Ca 0.21 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 1lo5 n HIS 143 Cb 0.56 -0.81 0.00 0.00 1.12 0.00 0.00 29.99 30.87 1lo5 n HIS 143 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1lo5 n LEU 144 N -0.11 0.00 -4.17 2.41 4.77 -1.26 -4.90 117.00 113.74 1lo5 n LEU 144 Ca -0.01 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.83 1lo5 n LEU 144 Cb 0.18 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.16 1lo5 n LEU 144 CO 0.01 -0.15 -0.42 -0.36 -1.33 0.00 0.00 177.39 175.15 1lo5 s PHE 145 N 0.40 1.06 -0.12 -1.77 0.08 0.65 -3.67 117.98 114.62 1lo5 s PHE 145 Ca 0.00 -0.65 0.01 0.00 0.12 0.00 0.00 56.93 56.41 1lo5 s PHE 145 Cb 0.00 -0.58 0.02 0.00 -0.57 0.00 0.00 43.02 41.89 1lo5 s PHE 145 CO 0.00 0.00 -0.13 0.50 -0.10 0.00 0.00 175.22 175.49 1lo5 s ARG 146 N -2.74 2.05 0.37 0.44 3.52 -0.66 -1.74 118.95 120.18 1lo5 s ARG 146 Ca 0.05 -0.48 0.07 0.00 -0.13 0.00 0.00 55.73 55.24 1lo5 s ARG 146 Cb -0.03 -1.84 -0.07 0.00 -1.56 0.00 0.00 34.95 31.45 1lo5 s ARG 146 CO 0.00 -0.15 -0.00 0.21 -0.81 0.00 0.00 175.30 174.55 1lo5 s LYS 147 N 1.25 1.83 0.11 5.12 2.20 0.28 -1.46 119.74 129.07 1lo5 s LYS 147 Ca -0.02 -2.01 0.02 0.00 -0.36 0.00 0.00 55.97 53.61 1lo5 s LYS 147 Cb -0.14 -1.44 -0.04 0.00 -1.51 0.00 0.00 37.83 34.70 1lo5 s LYS 147 CO -0.05 -0.04 -0.07 -0.06 -0.36 0.00 0.00 175.35 174.77 1lo5 s PHE 148 N -2.85 0.98 -0.26 4.03 0.40 -1.26 -1.76 117.98 117.27 1lo5 s PHE 148 Ca 0.34 -0.89 -0.12 0.00 -0.60 0.00 0.00 56.93 55.66 1lo5 s PHE 148 Cb 0.08 -0.55 0.09 0.00 0.51 0.00 0.00 43.02 43.15 1lo5 s PHE 148 CO 0.17 -0.11 0.60 -1.01 0.70 0.00 0.00 175.22 175.57 1lo5 s HIS 149 N -3.57 -1.03 0.06 0.36 3.76 -1.03 -2.88 115.29 110.96 1lo5 s HIS 149 Ca 0.13 1.97 0.09 0.00 -0.15 0.00 0.00 55.06 57.11 1lo5 s HIS 149 Cb 0.05 0.58 -0.03 0.00 1.11 0.00 0.00 32.58 34.29 1lo5 s HIS 149 CO -0.03 -0.53 -0.25 0.71 -0.85 0.00 0.00 174.74 173.79 1lo5 s TYR 150 N 2.02 2.19 -0.08 1.40 1.51 -0.97 0.12 117.35 123.53 1lo5 s TYR 150 Ca -0.08 -0.40 -0.03 0.00 -1.01 0.00 0.00 57.07 55.55 1lo5 s TYR 150 Cb -0.08 -1.29 0.04 0.00 -0.11 0.00 0.00 41.96 40.52 1lo5 s TYR 150 CO -0.18 0.14 0.06 -1.17 -1.11 0.00 0.00 175.55 173.29 1lo5 s LEU 151 N -1.34 0.30 0.57 -1.29 2.96 -0.52 -3.28 118.68 116.08 1lo5 s LEU 151 Ca 0.11 -0.14 -0.14 0.00 -0.22 0.00 0.00 54.13 53.73 1lo5 s LEU 151 Cb -0.10 -0.23 -0.05 0.00 0.50 0.00 0.00 46.19 46.31 1lo5 s LEU 151 CO 0.02 -0.27 1.01 -2.16 -1.32 0.00 0.00 176.35 173.64 1lo5 s PRO 152 N 2.12 3.68 -0.24 0.98 0.04 -1.26 0.15 135.00 140.47 1lo5 s PRO 152 Ca 0.04 0.93 -0.28 0.00 0.04 0.00 0.00 61.00 61.74 1lo5 s PRO 152 Cb -0.13 -2.09 0.15 0.00 0.04 0.00 0.00 34.50 32.47 1lo5 s PRO 152 CO -0.05 -0.50 1.17 -0.59 0.04 0.00 0.00 177.00 177.07 1lo5 s PHE 153 N -2.79 -0.26 -0.39 0.56 -0.71 -1.15 -4.85 117.98 108.39 1lo5 s PHE 153 Ca 0.58 0.53 -0.17 0.00 -1.04 0.00 0.00 56.93 56.84 1lo5 s PHE 153 Cb -0.11 0.45 0.01 0.00 -1.21 0.00 0.00 43.02 42.15 1lo5 s PHE 153 CO 0.40 -0.19 0.43 -1.17 -1.34 0.00 0.00 175.22 173.36 1lo5 s LEU 154 N -0.55 4.64 0.98 -1.99 2.96 -1.26 -1.75 118.68 121.71 1lo5 s LEU 154 Ca 0.04 -0.43 -0.25 0.00 -0.22 0.00 0.00 54.13 53.26 1lo5 s LEU 154 Cb -0.03 -2.41 -0.19 0.00 0.50 0.00 0.00 46.19 44.07 1lo5 s LEU 154 CO -0.06 -0.50 -1.38 -2.65 -1.32 0.00 0.00 176.35 170.44 1lo5 n PRO 155 N 5.58 0.00 -2.54 0.98 -0.02 -1.26 -4.89 135.00 132.84 1lo5 n PRO 155 Ca -0.07 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.42 1lo5 n PRO 155 Cb 0.48 -0.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.99 1lo5 n PRO 155 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1lo5 n SER 156 N 3.43 -0.35 0.00 2.55 7.64 -1.26 -4.18 113.62 121.45 1lo5 n SER 156 Ca -0.02 -1.05 0.00 0.00 1.01 0.00 0.00 58.87 58.81 1lo5 n SER 156 Cb 0.70 0.53 0.00 0.00 -1.01 0.00 0.00 64.21 64.44 1lo5 n SER 156 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1lo5 n THR 157 N -0.29 0.00 1.63 0.44 -2.24 -1.26 -4.57 114.28 107.99 1lo5 n THR 157 Ca 0.02 -0.19 0.04 0.00 -2.27 0.00 0.00 64.05 61.65 1lo5 n THR 157 Cb 0.18 0.85 0.19 0.00 -2.10 0.00 0.00 70.33 69.44 1lo5 n THR 157 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1lo5 n GLU 158 N -0.53 1.28 -3.85 -0.78 -0.58 -1.26 -4.86 120.64 110.06 1lo5 n GLU 158 Ca 0.00 -0.44 -0.10 0.00 -0.42 0.00 0.00 57.16 56.20 1lo5 n GLU 158 Cb 0.00 -1.17 -0.09 0.00 -0.57 0.00 0.00 31.44 29.61 1lo5 n GLU 158 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1lo5 s ASP 159 N -1.18 0.04 -0.04 1.62 1.01 -1.26 -5.08 116.67 111.78 1lo5 s ASP 159 Ca 0.15 -0.35 -0.01 0.00 0.71 0.00 0.00 52.55 53.05 1lo5 s ASP 159 Cb 0.08 0.28 0.03 0.00 1.01 0.00 0.00 42.92 44.31 1lo5 s ASP 159 CO 0.11 -0.54 0.02 0.68 0.21 0.00 0.00 175.17 175.66 1lo5 s VAL 160 N -2.44 0.07 0.35 -1.27 -7.23 -1.26 -4.71 120.40 103.91 1lo5 s VAL 160 Ca -0.06 0.22 0.08 0.00 -1.81 0.00 0.00 61.98 60.41 1lo5 s VAL 160 Cb -0.02 -0.23 -0.03 0.00 0.56 0.00 0.00 36.38 36.66 1lo5 s VAL 160 CO -0.03 0.16 0.25 -0.31 -0.31 0.00 0.00 175.10 174.86 1lo5 s TYR 161 N 1.51 2.80 -0.20 2.82 1.51 -0.37 -1.12 117.35 124.30 1lo5 s TYR 161 Ca -0.03 -0.37 -0.16 0.00 -1.01 0.00 0.00 57.07 55.49 1lo5 s TYR 161 Cb -0.13 -1.81 0.05 0.00 -0.11 0.00 0.00 41.96 39.97 1lo5 s TYR 161 CO -0.03 0.19 0.52 -0.51 -1.11 0.00 0.00 175.55 174.60 1lo5 s ASP 162 N -3.96 -0.57 -0.37 2.29 1.01 -0.21 -0.78 116.67 114.08 1lo5 s ASP 162 Ca 0.41 1.06 -0.14 0.00 0.71 0.00 0.00 52.55 54.59 1lo5 s ASP 162 Cb -0.04 1.04 -0.00 0.00 1.01 0.00 0.00 42.92 44.93 1lo5 s ASP 162 CO 0.25 -0.19 0.27 0.00 0.21 0.00 0.00 175.17 175.71 1lo5 s ARG 164 N 1.72 3.42 -0.26 0.00 6.06 0.45 -2.05 118.95 128.30 1lo5 s ARG 164 Ca 0.06 -0.31 0.02 0.00 -2.50 0.00 0.00 55.73 53.00 1lo5 s ARG 164 Cb -0.18 -3.88 0.06 0.00 0.06 0.00 0.00 34.95 31.01 1lo5 s ARG 164 CO 0.10 -0.81 -0.08 0.08 -2.50 0.00 0.00 175.30 172.10 1lo5 s VAL 165 N 2.53 1.90 -0.24 7.11 1.01 0.13 0.71 120.40 133.56 1lo5 s VAL 165 Ca 0.20 -1.51 -0.10 0.00 0.00 0.00 0.00 61.98 60.57 1lo5 s VAL 165 Cb -0.15 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.08 1lo5 s VAL 165 CO 0.15 -0.10 0.14 -1.61 0.00 0.00 0.00 175.10 173.68 1lo5 s GLU 166 N 1.21 4.00 0.22 2.72 2.02 0.27 -1.25 118.70 127.89 1lo5 s GLU 166 Ca -0.06 -0.31 0.00 0.00 0.02 0.00 0.00 54.97 54.62 1lo5 s GLU 166 Cb -0.19 -3.48 -0.05 0.00 0.10 0.00 0.00 34.13 30.51 1lo5 s GLU 166 CO -0.06 0.04 0.10 -1.58 0.02 0.00 0.00 175.26 173.78 1lo5 s HIS 167 N 1.09 1.31 -2.29 1.61 2.46 -1.26 0.16 115.29 118.37 1lo5 s HIS 167 Ca 0.07 -1.25 0.24 0.00 0.47 0.00 0.00 55.06 54.58 1lo5 s HIS 167 Cb -0.14 -0.72 0.98 0.00 -0.13 0.00 0.00 32.58 32.57 1lo5 s HIS 167 CO 0.04 -0.46 1.68 0.91 -2.47 0.00 0.00 174.74 174.45 1lo5 n TRP 168 N -0.34 0.10 0.41 3.88 8.01 -1.26 -3.55 117.44 124.69 1lo5 n TRP 168 Ca -0.00 -0.05 0.10 0.00 -1.31 0.00 0.00 57.50 56.23 1lo5 n TRP 168 Cb 0.66 0.00 -0.14 0.00 -2.01 0.00 0.00 31.31 29.82 1lo5 n TRP 168 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1lo5 n GLY 169 N 1.09 -0.89 3.79 6.99 0.00 -1.26 -4.90 105.19 110.01 1lo5 n GLY 169 Ca 0.17 -0.51 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 1lo5 n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lo5 s LEU 170 N -3.74 4.41 0.05 0.99 1.02 -1.23 -4.58 118.68 115.59 1lo5 s LEU 170 Ca -0.01 1.67 0.25 0.00 0.02 0.00 0.00 54.13 56.07 1lo5 s LEU 170 Cb 0.14 -3.71 0.59 0.00 0.02 0.00 0.00 46.19 43.23 1lo5 s LEU 170 CO 0.83 0.03 1.49 0.47 0.02 0.00 0.00 176.35 179.19 1lo5 n ASP 171 N 0.87 0.49 -3.57 2.29 9.92 -1.26 -4.87 116.55 120.42 1lo5 n ASP 171 Ca -0.01 0.04 -0.15 0.00 -0.53 0.00 0.00 54.79 54.14 1lo5 n ASP 171 Cb 0.50 0.04 -0.06 0.00 -0.64 0.00 0.00 41.12 40.96 1lo5 n ASP 171 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 1lo5 s GLU 172 N -3.06 0.86 0.99 -1.24 1.03 -1.26 -5.15 118.70 110.87 1lo5 s GLU 172 Ca 0.10 0.49 -0.17 0.00 0.03 0.00 0.00 54.97 55.42 1lo5 s GLU 172 Cb 0.16 0.41 -0.15 0.00 -0.80 0.00 0.00 34.13 33.75 1lo5 s GLU 172 CO 0.67 -0.21 -0.82 -2.30 -1.33 0.00 0.00 175.26 171.28 1lo5 n PRO 173 N 1.54 0.00 -3.98 -4.83 -0.02 -1.26 -4.92 135.00 121.53 1lo5 n PRO 173 Ca -0.15 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 60.98 1lo5 n PRO 173 Cb 0.56 -0.99 -0.15 0.00 -0.02 0.00 0.00 33.50 32.91 1lo5 n PRO 173 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1lo5 s LEU 174 N 7.93 2.68 -0.08 2.45 2.96 -0.38 -4.97 118.68 129.27 1lo5 s LEU 174 Ca 0.40 -0.50 -0.04 0.00 -0.22 0.00 0.00 54.13 53.76 1lo5 s LEU 174 Cb -0.17 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 1lo5 s LEU 174 CO 0.82 -0.02 0.10 -0.76 -1.32 0.00 0.00 176.35 175.17 1lo5 s LEU 175 N 1.41 4.11 -0.16 -0.68 1.43 -1.26 -0.69 118.68 122.84 1lo5 s LEU 175 Ca 0.05 0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 53.43 1lo5 s LEU 175 Cb -0.14 -2.11 0.06 0.00 0.03 0.00 0.00 46.19 44.03 1lo5 s LEU 175 CO -0.06 0.36 0.08 -0.54 0.23 0.00 0.00 176.35 176.42 1lo5 s LYS 176 N -1.22 0.13 0.14 1.70 -0.14 -0.87 -4.94 119.74 114.54 1lo5 s LYS 176 Ca 0.17 -0.07 -0.08 0.00 -1.36 0.00 0.00 55.97 54.64 1lo5 s LYS 176 Cb -0.12 -1.69 -0.06 0.00 -1.68 0.00 0.00 37.83 34.28 1lo5 s LYS 176 CO 0.07 -0.62 0.43 -1.58 -0.76 0.00 0.00 175.35 172.89 1lo5 s HIS 177 N 2.10 3.51 -0.02 3.18 5.65 -1.26 0.95 115.29 129.40 1lo5 s HIS 177 Ca 0.02 0.72 -0.00 0.00 0.25 0.00 0.00 55.06 56.05 1lo5 s HIS 177 Cb -0.16 -2.13 0.02 0.00 -1.18 0.00 0.00 32.58 29.14 1lo5 s HIS 177 CO -0.08 0.43 0.04 -0.46 -0.65 0.00 0.00 174.74 174.01 1lo5 s TRP 178 N -1.59 -0.01 -0.20 3.88 -0.00 0.04 -4.95 118.94 116.11 1lo5 s TRP 178 Ca 0.39 0.13 -0.16 0.00 -0.00 0.00 0.00 56.10 56.47 1lo5 s TRP 178 Cb -0.13 -0.14 0.06 0.00 -0.00 0.00 0.00 33.47 33.26 1lo5 s TRP 178 CO 0.21 -0.07 0.51 -1.83 -0.00 0.00 0.00 176.95 175.78 1lo5 s GLU 179 N 0.70 0.57 0.13 5.86 -1.05 -1.26 -1.24 118.70 122.40 1lo5 s GLU 179 Ca -0.06 0.80 -0.31 0.00 -0.15 0.00 0.00 54.97 55.25 1lo5 s GLU 179 Cb -0.08 0.20 -0.10 0.00 -0.44 0.00 0.00 34.13 33.71 1lo5 s GLU 179 CO -0.02 -0.10 1.66 0.12 0.95 0.00 0.00 175.26 177.86 1lo5 s PHE 180 N 0.72 2.65 -0.15 4.83 2.19 -1.26 -5.00 117.98 121.97 1lo5 s PHE 180 Ca -0.04 0.37 -0.07 0.00 0.33 0.00 0.00 56.93 57.53 1lo5 s PHE 180 Cb -0.05 -4.01 -0.04 0.00 -1.31 0.00 0.00 43.02 37.61 1lo5 s PHE 180 CO -0.05 -3.92 0.09 0.34 1.83 0.00 0.00 175.22 173.51 1lo5 s ASP 181 N 1.88 5.96 0.00 6.13 2.15 -1.26 -4.97 116.67 126.56 1lo5 s ASP 181 Ca 0.74 0.26 0.00 0.00 0.43 0.00 0.00 52.55 53.98 1lo5 s ASP 181 Cb -0.43 -1.95 0.00 0.00 -0.30 0.00 0.00 42.92 40.24 1lo5 s ASP 181 CO 0.33 0.30 0.26 0.00 -0.17 0.00 0.00 175.17 175.88