#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1shs n GLY 34 N 0.00 0.90 2.89 3.38 0.00 -1.26 -4.93 105.19 106.17 1shs n GLY 34 Ca 0.00 0.79 -0.16 0.00 0.00 0.00 0.00 46.02 46.65 1shs n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1shs s ILE 35 N 2.17 -0.33 -0.21 -0.61 1.09 -1.26 -3.53 121.20 118.51 1shs s ILE 35 Ca 0.89 0.25 0.02 0.00 -1.10 0.00 0.00 60.65 60.71 1shs s ILE 35 Cb -0.88 -0.41 0.04 0.00 -1.06 0.00 0.00 42.46 40.14 1shs s ILE 35 CO 0.52 0.08 -0.14 -1.10 -0.10 0.00 0.00 174.94 174.20 1shs s GLN 36 N 2.35 2.43 0.10 2.79 -0.21 -1.11 -4.91 119.66 121.11 1shs s GLN 36 Ca 0.03 -1.02 0.01 0.00 0.02 0.00 0.00 55.36 54.41 1shs s GLN 36 Cb -0.13 -2.63 -0.04 0.00 1.00 0.00 0.00 33.01 31.21 1shs s GLN 36 CO -0.08 -0.40 0.23 0.42 -2.12 0.00 0.00 175.29 173.34 1shs s ILE 37 N 1.25 5.26 -0.29 1.08 -1.09 -1.26 -0.68 121.20 125.46 1shs s ILE 37 Ca -0.02 -0.57 -0.26 0.00 -2.23 0.00 0.00 60.65 57.57 1shs s ILE 37 Cb -0.16 -3.63 0.19 0.00 -1.58 0.00 0.00 42.46 37.28 1shs s ILE 37 CO -0.09 0.03 1.43 -0.94 -1.23 0.00 0.00 174.94 174.14 1shs s SER 38 N -2.82 -0.04 0.00 3.58 1.04 -1.06 -4.99 113.70 109.40 1shs s SER 38 Ca 0.34 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1shs s SER 38 Cb -0.12 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.08 1shs s SER 38 CO 0.28 -0.02 0.00 0.61 0.98 0.00 0.00 173.24 175.08 1shs n GLY 39 N 1.29 -0.45 3.23 7.32 0.00 -1.26 0.06 105.19 115.39 1shs n GLY 39 Ca -0.08 -1.30 -0.17 0.00 0.00 0.00 0.00 46.02 44.48 1shs n GLY 39 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1shs s LYS 40 N -2.00 1.00 0.00 1.61 -2.85 -0.57 -4.97 119.74 111.96 1shs s LYS 40 Ca 0.00 -1.26 0.00 0.00 -1.00 0.00 0.00 55.97 53.71 1shs s LYS 40 Cb 0.00 -0.79 0.00 0.00 -2.06 0.00 0.00 37.83 34.98 1shs s LYS 40 CO 0.00 0.14 0.00 0.41 0.10 0.00 0.00 175.35 176.00 1shs n GLY 41 N 0.40 -0.59 3.65 0.59 0.00 -1.26 -0.90 105.19 107.08 1shs n GLY 41 Ca -0.15 -1.64 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1shs n GLY 41 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1shs s PHE 42 N -2.98 2.79 -0.51 1.61 5.36 -1.26 -4.80 117.98 118.19 1shs s PHE 42 Ca 0.00 0.96 0.07 0.00 -0.96 0.00 0.00 56.93 57.00 1shs s PHE 42 Cb 0.00 -3.66 0.20 0.00 -0.34 0.00 0.00 43.02 39.22 1shs s PHE 42 CO 0.00 -1.69 0.74 -0.12 -1.46 0.00 0.00 175.22 172.69 1shs n MET 43 N 6.89 0.57 -1.62 10.12 1.56 -1.26 -4.93 117.12 128.46 1shs n MET 43 Ca 0.14 -2.04 -0.51 0.00 -0.27 0.00 0.00 57.70 55.02 1shs n MET 43 Cb 0.46 -1.48 -0.06 0.00 2.15 0.00 0.00 33.22 34.29 1shs n MET 43 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 1shs n PRO 44 N 2.66 1.55 -3.56 2.12 -0.02 -1.26 -4.70 135.00 131.80 1shs n PRO 44 Ca 0.17 0.53 -0.20 0.00 -2.02 0.00 0.00 63.50 61.98 1shs n PRO 44 Cb 0.57 -2.47 -0.01 0.00 -0.02 0.00 0.00 33.50 31.58 1shs n PRO 44 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1shs s ILE 45 N 5.11 4.37 -0.21 4.25 1.09 -1.26 -1.98 121.20 132.57 1shs s ILE 45 Ca 1.00 -0.96 -0.10 0.00 -1.10 0.00 0.00 60.65 59.49 1shs s ILE 45 Cb -0.83 -3.53 0.08 0.00 -1.06 0.00 0.00 42.46 37.12 1shs s ILE 45 CO 0.54 -0.22 0.48 -0.44 -0.10 0.00 0.00 174.94 175.21 1shs s SER 46 N -4.13 -0.57 -0.19 3.58 0.01 0.27 -4.95 113.70 107.72 1shs s SER 46 Ca 0.43 1.09 -0.01 0.00 1.31 0.00 0.00 55.95 58.77 1shs s SER 46 Cb -0.09 1.17 0.01 0.00 0.21 0.00 0.00 66.02 67.31 1shs s SER 46 CO 0.31 -0.21 -0.14 -0.63 0.41 0.00 0.00 173.24 172.98 1shs s ILE 47 N 1.91 2.60 -0.10 1.44 1.01 -1.26 -0.16 121.20 126.64 1shs s ILE 47 Ca -0.07 -0.76 -0.01 0.00 0.00 0.00 0.00 60.65 59.81 1shs s ILE 47 Cb -0.09 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 1shs s ILE 47 CO -0.15 0.50 -0.05 -0.63 0.00 0.00 0.00 174.94 174.61 1shs s ILE 48 N 1.29 3.86 -0.14 2.92 -1.09 0.49 -4.98 121.20 123.55 1shs s ILE 48 Ca 0.04 -0.40 0.01 0.00 -2.23 0.00 0.00 60.65 58.07 1shs s ILE 48 Cb -0.14 -2.63 0.00 0.00 -1.58 0.00 0.00 42.46 38.12 1shs s ILE 48 CO -0.08 0.56 -0.19 -0.70 -1.23 0.00 0.00 174.94 173.31 1shs s GLU 49 N -0.36 3.13 0.26 2.79 2.12 -1.26 -0.08 118.70 125.30 1shs s GLU 49 Ca 0.06 -0.80 0.02 0.00 0.36 0.00 0.00 54.97 54.61 1shs s GLU 49 Cb -0.12 -2.52 0.02 0.00 0.26 0.00 0.00 34.13 31.77 1shs s GLU 49 CO 0.02 0.02 0.20 0.41 -0.54 0.00 0.00 175.26 175.38 1shs n GLY 50 N 4.01 2.84 0.20 -1.50 0.00 -0.05 -5.02 105.19 105.66 1shs n GLY 50 Ca -0.19 -2.23 -0.14 0.00 0.00 0.00 0.00 46.02 43.46 1shs n GLY 50 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1shs h ASP 51 N 0.28 0.71 -0.09 1.61 3.32 -2.02 -3.35 116.42 116.89 1shs h ASP 51 Ca -0.16 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.42 1shs h ASP 51 Cb 0.59 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1shs h ASP 51 CO 0.25 1.25 0.00 0.00 -1.72 0.00 0.00 179.24 179.01 1shs n GLN 52 N -3.88 2.84 -3.84 3.56 6.02 -1.26 -4.72 117.38 116.11 1shs n GLN 52 Ca -0.06 -1.74 -0.07 0.00 -0.01 0.00 0.00 57.00 55.12 1shs n GLN 52 Cb 0.74 -1.12 0.02 0.00 1.02 0.00 0.00 30.24 30.90 1shs n GLN 52 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 177.06 172.67 1shs s HIS 53 N -1.19 0.11 -0.02 1.08 -3.43 -1.26 0.61 115.29 111.19 1shs s HIS 53 Ca 0.09 -0.69 -0.00 0.00 -0.80 0.00 0.00 55.06 53.66 1shs s HIS 53 Cb 0.06 0.79 0.03 0.00 -1.43 0.00 0.00 32.58 32.03 1shs s HIS 53 CO 0.04 -1.34 0.03 0.42 -2.00 0.00 0.00 174.74 171.89 1shs s ILE 54 N -2.22 -0.05 -0.03 -5.38 1.01 0.71 -0.88 121.20 114.37 1shs s ILE 54 Ca 0.18 0.18 0.00 0.00 0.00 0.00 0.00 60.65 61.01 1shs s ILE 54 Cb -0.04 -0.07 -0.03 0.00 0.01 0.00 0.00 42.46 42.32 1shs s ILE 54 CO 0.09 0.07 0.00 -0.75 0.00 0.00 0.00 174.94 174.36 1shs s LYS 55 N 0.90 2.87 -0.08 2.79 2.20 0.89 -0.19 119.74 129.12 1shs s LYS 55 Ca -0.07 -0.53 -0.00 0.00 -0.36 0.00 0.00 55.97 55.00 1shs s LYS 55 Cb -0.11 -2.72 0.02 0.00 -1.51 0.00 0.00 37.83 33.52 1shs s LYS 55 CO -0.03 0.65 -0.05 0.08 -0.36 0.00 0.00 175.35 175.64 1shs s VAL 56 N -1.01 0.77 -0.09 4.02 1.01 0.27 -0.38 120.40 124.98 1shs s VAL 56 Ca 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.99 1shs s VAL 56 Cb -0.11 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.43 1shs s VAL 56 CO 0.07 0.31 -0.09 -0.63 0.00 0.00 0.00 175.10 174.77 1shs s ILE 57 N 1.51 3.51 -0.00 2.22 1.09 0.78 -0.89 121.20 129.41 1shs s ILE 57 Ca -0.00 -0.53 0.02 0.00 -1.10 0.00 0.00 60.65 59.04 1shs s ILE 57 Cb -0.13 -2.45 -0.01 0.00 -1.06 0.00 0.00 42.46 38.81 1shs s ILE 57 CO -0.04 0.57 -0.07 0.00 -0.10 0.00 0.00 174.94 175.29 1shs s ALA 58 N -0.38 0.59 -0.45 9.38 0.00 -0.24 -0.57 121.76 130.08 1shs s ALA 58 Ca 0.05 -0.33 -0.18 0.00 0.00 0.00 0.00 51.96 51.50 1shs s ALA 58 Cb -0.12 -0.14 0.04 0.00 0.00 0.00 0.00 23.12 22.90 1shs s ALA 58 CO 0.02 0.14 0.50 -1.58 0.00 0.00 0.00 175.76 174.84 1shs s TRP 59 N -0.23 3.14 -0.51 0.00 0.52 -0.84 -1.45 118.94 119.56 1shs s TRP 59 Ca 0.02 -0.46 0.06 0.00 0.02 0.00 0.00 56.10 55.74 1shs s TRP 59 Cb -0.03 -3.15 0.37 0.00 -1.15 0.00 0.00 33.47 29.51 1shs s TRP 59 CO -0.00 -0.82 0.98 1.28 0.02 0.00 0.00 176.95 178.41 1shs n LEU 60 N 5.77 4.19 -4.77 2.99 4.77 0.12 -4.30 117.00 125.77 1shs n LEU 60 Ca -0.07 -5.43 -0.40 0.00 -0.03 0.00 0.00 56.01 50.08 1shs n LEU 60 Cb 0.46 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1shs n LEU 60 CO 0.49 2.29 1.08 -2.16 -1.33 0.00 0.00 177.39 177.76 1shs s PRO 61 N -3.41 3.98 0.00 3.23 0.04 -1.18 -1.74 135.00 135.93 1shs s PRO 61 Ca 0.47 2.44 0.00 0.00 0.04 0.00 0.00 61.00 63.96 1shs s PRO 61 Cb 0.33 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 32.01 1shs s PRO 61 CO -0.14 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 176.72 1shs n GLY 62 N 0.55 2.94 3.80 0.56 0.00 -1.26 -5.00 105.19 106.79 1shs n GLY 62 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1shs n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1shs s VAL 63 N -2.36 4.41 -0.17 1.61 0.11 -0.71 -4.54 120.40 118.76 1shs s VAL 63 Ca 0.00 1.51 -0.21 0.00 -2.93 0.00 0.00 61.98 60.35 1shs s VAL 63 Cb 0.00 -3.92 -0.03 0.00 -1.53 0.00 0.00 36.38 30.91 1shs s VAL 63 CO 0.00 0.17 0.64 0.20 -3.33 0.00 0.00 175.10 172.78 1shs s ASN 64 N -1.65 6.75 0.24 3.54 0.01 -1.26 -4.90 114.94 117.66 1shs s ASN 64 Ca 0.46 0.91 0.08 0.00 -0.71 0.00 0.00 52.86 53.60 1shs s ASN 64 Cb -0.17 -2.36 0.75 0.00 0.41 0.00 0.00 41.25 39.88 1shs s ASN 64 CO 0.22 -0.24 1.12 1.17 -1.51 0.00 0.00 177.10 177.86 1shs n LYS 65 N 4.80 -0.05 -0.12 -0.60 3.00 -1.26 0.31 118.16 124.24 1shs n LYS 65 Ca -0.01 1.03 0.04 0.00 -0.00 0.00 0.00 58.31 59.36 1shs n LYS 65 Cb 0.50 -1.73 0.10 0.00 0.00 0.00 0.00 35.03 33.90 1shs n LYS 65 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1shs n GLU 66 N -4.79 1.56 0.00 1.64 4.71 -1.26 -3.08 120.64 119.42 1shs n GLU 66 Ca 0.22 -0.84 0.08 0.00 -0.01 0.00 0.00 57.16 56.60 1shs n GLU 66 Cb 0.73 -1.20 0.06 0.00 -1.01 0.00 0.00 31.44 30.02 1shs n GLU 66 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1shs n ASP 67 N 0.18 2.26 -4.76 1.62 8.00 0.92 -4.95 116.55 119.83 1shs n ASP 67 Ca 0.08 -1.63 -0.38 0.00 0.71 0.00 0.00 54.79 53.57 1shs n ASP 67 Cb 0.21 0.02 -0.06 0.00 -0.02 0.00 0.00 41.12 41.26 1shs n ASP 67 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1shs s ILE 68 N -1.31 5.13 -0.18 0.53 1.01 -1.18 -3.20 121.20 122.01 1shs s ILE 68 Ca 0.18 0.88 0.00 0.00 0.00 0.00 0.00 60.65 61.71 1shs s ILE 68 Cb 0.13 -3.77 0.02 0.00 0.01 0.00 0.00 42.46 38.85 1shs s ILE 68 CO 0.20 0.42 -0.18 -0.63 0.00 0.00 0.00 174.94 174.75 1shs s ILE 69 N 0.01 2.26 -0.13 2.92 1.01 0.17 -5.00 121.20 122.44 1shs s ILE 69 Ca 0.24 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 60.04 1shs s ILE 69 Cb -0.15 -1.96 0.01 0.00 0.01 0.00 0.00 42.46 40.37 1shs s ILE 69 CO 0.11 0.52 -0.21 -0.22 0.00 0.00 0.00 174.94 175.14 1shs s LEU 70 N 1.29 2.04 -0.03 2.97 0.20 -1.26 -1.53 118.68 122.36 1shs s LEU 70 Ca 0.04 -0.57 -0.26 0.00 0.69 0.00 0.00 54.13 54.03 1shs s LEU 70 Cb -0.13 -1.38 0.06 0.00 -0.43 0.00 0.00 46.19 44.30 1shs s LEU 70 CO -0.11 0.07 0.56 0.54 -0.29 0.00 0.00 176.35 177.12 1shs s ASN 71 N 0.85 -0.51 0.21 3.68 6.03 -1.08 -5.04 114.94 119.08 1shs s ASN 71 Ca -0.07 0.48 -0.18 0.00 -1.03 0.00 0.00 52.86 52.06 1shs s ASN 71 Cb -0.15 0.48 0.03 0.00 -3.03 0.00 0.00 41.25 38.57 1shs s ASN 71 CO -0.02 -0.58 0.55 0.00 -2.03 0.00 0.00 177.10 175.02 1shs s ALA 72 N -1.40 -1.00 -0.21 3.54 0.00 -1.26 -0.99 121.76 120.44 1shs s ALA 72 Ca -0.11 -0.20 -0.28 0.00 0.00 0.00 0.00 51.96 51.37 1shs s ALA 72 Cb -0.01 0.87 0.12 0.00 0.00 0.00 0.00 23.12 24.09 1shs s ALA 72 CO 0.07 -0.84 0.98 0.54 0.00 0.00 0.00 175.76 176.52 1shs s VAL 73 N -3.88 0.00 0.00 0.00 0.11 -0.77 -4.75 120.40 111.12 1shs s VAL 73 Ca 0.09 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.14 1shs s VAL 73 Cb -0.02 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.83 1shs s VAL 73 CO -0.02 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.36 1shs n GLY 74 N 1.44 1.34 0.09 6.54 0.00 -1.26 -1.90 105.19 111.43 1shs n GLY 74 Ca -0.12 0.32 0.06 0.00 0.00 0.00 0.00 46.02 46.28 1shs n GLY 74 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1shs n ASP 75 N 11.62 1.96 -4.05 1.61 5.75 -1.26 0.27 116.55 132.44 1shs n ASP 75 Ca 0.00 -2.64 -0.22 0.00 -0.01 0.00 0.00 54.79 51.92 1shs n ASP 75 Cb 0.00 -0.29 -0.16 0.00 -1.03 0.00 0.00 41.12 39.65 1shs n ASP 75 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1shs s THR 76 N -2.04 1.00 0.03 2.12 -4.23 -0.80 0.91 115.64 112.64 1shs s THR 76 Ca 0.20 -0.49 0.06 0.00 -1.18 0.00 0.00 61.69 60.28 1shs s THR 76 Cb 0.17 -0.87 -0.03 0.00 1.34 0.00 0.00 72.50 73.11 1shs s THR 76 CO 0.02 0.30 -0.15 -0.22 -0.54 0.00 0.00 174.62 174.02 1shs s LEU 77 N 0.09 2.74 -0.10 4.79 2.96 0.57 -1.85 118.68 127.88 1shs s LEU 77 Ca -0.02 -0.36 0.00 0.00 -0.22 0.00 0.00 54.13 53.53 1shs s LEU 77 Cb -0.09 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 45.03 1shs s LEU 77 CO 0.01 0.26 -0.09 -0.70 -1.32 0.00 0.00 176.35 174.51 1shs s GLU 78 N -1.44 1.61 -0.23 1.98 2.12 -0.16 0.14 118.70 122.72 1shs s GLU 78 Ca 0.15 -0.31 -0.01 0.00 0.36 0.00 0.00 54.97 55.16 1shs s GLU 78 Cb -0.11 -1.56 0.02 0.00 0.26 0.00 0.00 34.13 32.75 1shs s GLU 78 CO 0.06 -0.18 -0.10 0.42 -0.54 0.00 0.00 175.26 174.92 1shs s ILE 79 N 1.40 2.66 -0.04 -3.70 1.01 0.52 -2.63 121.20 120.43 1shs s ILE 79 Ca -0.01 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.68 1shs s ILE 79 Cb -0.13 -2.29 0.01 0.00 0.01 0.00 0.00 42.46 40.06 1shs s ILE 79 CO -0.05 0.31 -0.07 0.00 0.00 0.00 0.00 174.94 175.13 1shs s ARG 80 N 1.32 0.99 0.23 2.79 1.70 -0.58 -0.39 118.95 125.01 1shs s ARG 80 Ca 0.02 -0.22 -0.11 0.00 -0.47 0.00 0.00 55.73 54.95 1shs s ARG 80 Cb -0.16 -0.92 -0.01 0.00 -0.57 0.00 0.00 34.95 33.29 1shs s ARG 80 CO -0.07 0.00 0.42 0.00 -1.08 0.00 0.00 175.30 174.58 1shs s ALA 81 N 0.62 -0.08 -0.05 7.88 0.00 0.24 0.43 121.76 130.80 1shs s ALA 81 Ca -0.09 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 50.93 1shs s ALA 81 Cb -0.13 1.08 0.02 0.00 0.00 0.00 0.00 23.12 24.10 1shs s ALA 81 CO 0.01 -0.80 -0.06 -1.59 0.00 0.00 0.00 175.76 173.32 1shs s LYS 82 N -4.02 1.02 -0.15 0.00 -2.85 -1.19 -1.01 119.74 111.53 1shs s LYS 82 Ca 0.23 -0.16 -0.01 0.00 -1.00 0.00 0.00 55.97 55.04 1shs s LYS 82 Cb 0.01 -0.99 -0.01 0.00 -2.06 0.00 0.00 37.83 34.78 1shs s LYS 82 CO 0.08 -0.08 -0.13 -0.98 0.10 0.00 0.00 175.35 174.35 1shs s ARG 83 N 0.95 3.33 0.70 1.78 1.70 -0.20 -4.33 118.95 122.88 1shs s ARG 83 Ca -0.10 -0.70 -0.15 0.00 -0.47 0.00 0.00 55.73 54.31 1shs s ARG 83 Cb -0.14 -2.68 0.02 0.00 -0.57 0.00 0.00 34.95 31.58 1shs s ARG 83 CO 0.00 0.09 1.16 0.45 -1.08 0.00 0.00 175.30 175.92 1shs s SER 84 N 0.65 4.59 0.47 -2.89 0.15 -1.26 -4.40 113.70 111.01 1shs s SER 84 Ca -0.07 2.17 -0.06 0.00 0.70 0.00 0.00 55.95 58.70 1shs s SER 84 Cb -0.15 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.55 1shs s SER 84 CO 0.02 -1.99 0.78 -2.16 1.20 0.00 0.00 173.24 171.10 1shs s PRO 85 N -4.03 3.57 -0.15 5.44 0.04 -1.26 -4.96 135.00 133.65 1shs s PRO 85 Ca 0.70 0.24 -0.34 0.00 0.04 0.00 0.00 61.00 61.64 1shs s PRO 85 Cb -0.25 -2.38 -0.11 0.00 0.04 0.00 0.00 34.50 31.80 1shs s PRO 85 CO 0.44 -0.18 1.96 1.28 0.04 0.00 0.00 177.00 180.54 1shs n LEU 86 N -2.12 3.21 -4.69 -3.56 4.32 -1.26 -4.92 117.00 107.97 1shs n LEU 86 Ca 0.01 0.81 -0.40 0.00 -0.02 0.00 0.00 56.01 56.40 1shs n LEU 86 Cb 0.55 -1.37 -0.05 0.00 -1.62 0.00 0.00 43.42 40.93 1shs n LEU 86 CO 0.52 -0.23 0.44 -0.32 -1.22 0.00 0.00 177.39 176.59 1shs s MET 87 N 4.65 4.34 -0.10 3.23 -2.45 -1.26 -5.06 119.30 122.66 1shs s MET 87 Ca 0.96 0.84 0.03 0.00 -1.25 0.00 0.00 55.69 56.28 1shs s MET 87 Cb -0.69 -3.51 0.01 0.00 1.25 0.00 0.00 34.83 31.89 1shs s MET 87 CO 0.50 -0.11 -0.20 0.96 1.05 0.00 0.00 175.02 177.23 1shs s ILE 88 N 1.41 1.76 0.72 10.11 -4.36 -1.26 -5.12 121.20 124.47 1shs s ILE 88 Ca 0.35 -0.83 -0.16 0.00 -0.26 0.00 0.00 60.65 59.76 1shs s ILE 88 Cb -0.17 -1.55 0.00 0.00 1.25 0.00 0.00 42.46 41.99 1shs s ILE 88 CO 0.15 0.49 0.92 0.35 0.24 0.00 0.00 174.94 177.09 1shs n THR 89 N 3.80 2.69 -0.24 8.37 -2.24 -1.26 -4.82 114.28 120.58 1shs n THR 89 Ca -0.20 -0.37 0.18 0.00 -2.27 0.00 0.00 64.05 61.38 1shs n THR 89 Cb 0.52 -1.06 0.49 0.00 -2.10 0.00 0.00 70.33 68.19 1shs n THR 89 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1shs h GLU 90 N -0.26 0.43 -0.85 -0.78 -0.00 -2.06 -1.34 114.58 109.72 1shs h GLU 90 Ca -0.47 -0.03 0.04 0.00 -0.00 0.00 0.00 59.36 58.90 1shs h GLU 90 Cb 1.34 -0.10 -0.05 0.00 -0.00 0.00 0.00 28.75 29.94 1shs h GLU 90 CO 0.46 0.28 0.56 1.03 -0.00 0.00 0.00 179.01 181.35 1shs h SER 91 N 0.44 0.90 -4.11 3.06 0.87 -2.05 -3.43 113.55 109.22 1shs h SER 91 Ca 0.46 -0.01 -0.50 0.00 -1.23 0.00 0.00 61.79 60.51 1shs h SER 91 Cb 1.08 -0.20 0.04 0.00 -0.44 0.00 0.00 62.40 62.88 1shs h SER 91 CO -0.18 0.61 0.32 -1.61 -0.53 0.00 0.00 176.83 175.45 1shs s GLU 92 N -5.89 3.68 0.01 2.24 2.02 -0.51 -5.09 118.70 115.16 1shs s GLU 92 Ca -0.11 0.66 0.00 0.00 0.02 0.00 0.00 54.97 55.54 1shs s GLU 92 Cb 0.19 -2.18 -0.01 0.00 0.10 0.00 0.00 34.13 32.23 1shs s GLU 92 CO 0.79 -0.38 -0.02 1.03 0.02 0.00 0.00 175.26 176.70 1shs s ARG 93 N -4.72 0.14 -0.82 1.61 0.52 -1.26 -4.80 118.95 109.62 1shs s ARG 93 Ca 0.54 -0.19 -0.26 0.00 -0.52 0.00 0.00 55.73 55.30 1shs s ARG 93 Cb -0.11 -0.03 0.03 0.00 0.52 0.00 0.00 34.95 35.37 1shs s ARG 93 CO 0.45 0.00 1.34 0.42 0.02 0.00 0.00 175.30 177.53 1shs s ILE 94 N -0.41 3.77 0.48 1.52 1.01 -1.26 -4.82 121.20 121.49 1shs s ILE 94 Ca -0.04 0.08 0.15 0.00 0.00 0.00 0.00 60.65 60.84 1shs s ILE 94 Cb -0.03 -4.94 0.23 0.00 0.01 0.00 0.00 42.46 37.73 1shs s ILE 94 CO -0.00 -1.86 2.08 0.40 0.00 0.00 0.00 174.94 175.55 1shs h ILE 95 N 6.26 1.06 -1.51 2.92 2.04 -2.05 -3.45 117.51 122.78 1shs h ILE 95 Ca -0.15 -0.28 0.09 0.00 1.00 0.00 0.00 64.86 65.53 1shs h ILE 95 Cb 1.04 1.13 -0.24 0.00 -0.74 0.00 0.00 36.82 38.01 1shs h ILE 95 CO 1.32 0.08 0.57 -0.47 0.00 0.00 0.00 178.15 179.66 1shs s TYR 96 N -4.90 -0.35 -0.28 1.37 6.14 -1.26 -5.18 117.35 112.88 1shs s TYR 96 Ca -0.05 0.64 -0.18 0.00 0.64 0.00 0.00 57.07 58.12 1shs s TYR 96 Cb 0.16 0.44 0.11 0.00 0.42 0.00 0.00 41.96 43.10 1shs s TYR 96 CO 0.68 -0.30 0.86 0.45 0.64 0.00 0.00 175.55 177.88 1shs s SER 97 N -0.90 -0.68 0.00 4.32 0.15 -1.26 -5.00 113.70 110.33 1shs s SER 97 Ca -0.00 1.14 0.10 0.00 0.70 0.00 0.00 55.95 57.89 1shs s SER 97 Cb -0.01 1.25 0.12 0.00 -1.71 0.00 0.00 66.02 65.67 1shs s SER 97 CO -0.01 -0.18 0.91 -0.62 1.20 0.00 0.00 173.24 174.54 1shs n GLU 98 N 3.59 0.90 -3.11 5.44 1.02 -1.26 -4.96 120.64 122.26 1shs n GLU 98 Ca -0.18 -1.29 -0.40 0.00 -0.02 0.00 0.00 57.16 55.28 1shs n GLU 98 Cb 0.58 -1.21 -0.06 0.00 -0.02 0.00 0.00 31.44 30.73 1shs n GLU 98 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1shs s ILE 99 N -0.89 5.03 0.32 -3.67 1.09 -1.26 -5.03 121.20 116.80 1shs s ILE 99 Ca 0.14 1.23 -0.29 0.00 -1.10 0.00 0.00 60.65 60.62 1shs s ILE 99 Cb 0.09 -3.96 -0.11 0.00 -1.06 0.00 0.00 42.46 37.43 1shs s ILE 99 CO 0.13 0.14 1.46 -2.16 -0.10 0.00 0.00 174.94 174.42 1shs s PRO 100 N 1.66 4.20 0.04 2.79 0.04 -1.26 -4.96 135.00 137.50 1shs s PRO 100 Ca 0.30 2.44 -0.02 0.00 0.04 0.00 0.00 61.00 63.76 1shs s PRO 100 Cb -0.16 -3.03 -0.27 0.00 0.04 0.00 0.00 34.50 31.07 1shs s PRO 100 CO 0.11 -0.46 0.99 0.93 0.04 0.00 0.00 177.00 178.61 1shs h GLU 101 N 3.97 0.23 -4.78 4.56 4.39 -2.01 -3.48 114.58 117.47 1shs h GLU 101 Ca -0.48 -0.39 -0.55 0.00 0.34 0.00 0.00 59.36 58.27 1shs h GLU 101 Cb 1.23 0.15 0.08 0.00 -0.10 0.00 0.00 28.75 30.10 1shs h GLU 101 CO 0.71 1.12 -0.32 -0.85 -1.16 0.00 0.00 179.01 178.51 1shs n GLU 102 N -3.46 0.00 -0.13 2.33 0.00 -1.26 -4.78 120.64 113.35 1shs n GLU 102 Ca -0.12 0.00 -0.25 0.00 0.00 0.00 0.00 57.16 56.79 1shs n GLU 102 Cb 1.03 -0.88 -0.11 0.00 0.00 0.00 0.00 31.44 31.48 1shs n GLU 102 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1shs n GLU 103 N 0.88 0.61 -3.23 3.44 1.02 -1.26 -4.81 120.64 117.29 1shs n GLU 103 Ca 0.15 0.26 -0.39 0.00 -0.02 0.00 0.00 57.16 57.15 1shs n GLU 103 Cb 0.17 -1.53 -0.07 0.00 -0.02 0.00 0.00 31.44 29.99 1shs n GLU 103 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1shs s GLU 104 N -2.50 4.17 0.03 3.49 2.12 -1.26 -1.04 118.70 123.71 1shs s GLU 104 Ca -0.36 0.42 -0.00 0.00 0.36 0.00 0.00 54.97 55.39 1shs s GLU 104 Cb 0.12 -3.58 -0.03 0.00 0.26 0.00 0.00 34.13 30.90 1shs s GLU 104 CO 0.55 -0.19 -0.03 0.96 -0.54 0.00 0.00 175.26 176.00 1shs s ILE 105 N 1.78 0.18 0.03 -3.70 -4.36 -0.18 -4.69 121.20 110.25 1shs s ILE 105 Ca 0.24 -1.26 -0.29 0.00 -0.26 0.00 0.00 60.65 59.08 1shs s ILE 105 Cb -0.15 -0.75 0.10 0.00 1.25 0.00 0.00 42.46 42.90 1shs s ILE 105 CO 0.10 -0.68 1.16 -0.72 0.24 0.00 0.00 174.94 175.03 1shs s TYR 106 N -2.38 -0.09 -0.17 1.37 1.13 -0.07 -0.59 117.35 116.54 1shs s TYR 106 Ca -0.07 -0.08 -0.15 0.00 -1.41 0.00 0.00 57.07 55.37 1shs s TYR 106 Cb -0.03 0.57 0.05 0.00 -1.10 0.00 0.00 41.96 41.45 1shs s TYR 106 CO -0.04 -0.46 0.44 1.03 -2.51 0.00 0.00 175.55 174.01 1shs s ARG 107 N -2.73 0.50 -0.14 -3.49 0.52 0.47 -1.51 118.95 112.58 1shs s ARG 107 Ca 0.13 0.65 -0.00 0.00 -0.52 0.00 0.00 55.73 55.99 1shs s ARG 107 Cb 0.02 0.21 -0.01 0.00 0.52 0.00 0.00 34.95 35.69 1shs s ARG 107 CO -0.02 -0.08 -0.12 0.95 0.02 0.00 0.00 175.30 176.05 1shs s THR 108 N 0.42 3.08 -0.03 0.02 -4.23 0.11 -0.35 115.64 114.67 1shs s THR 108 Ca -0.02 -0.65 0.07 0.00 -1.18 0.00 0.00 61.69 59.92 1shs s THR 108 Cb -0.04 -2.30 -0.02 0.00 1.34 0.00 0.00 72.50 71.48 1shs s THR 108 CO -0.02 0.52 -0.24 -0.63 -0.54 0.00 0.00 174.62 173.71 1shs s ILE 109 N 0.41 2.23 -0.38 2.99 1.01 0.37 -2.58 121.20 125.25 1shs s ILE 109 Ca -0.10 -1.04 -0.14 0.00 0.00 0.00 0.00 60.65 59.37 1shs s ILE 109 Cb -0.16 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.52 1shs s ILE 109 CO 0.05 0.58 0.27 -0.54 0.00 0.00 0.00 174.94 175.30 1shs s LYS 110 N -0.61 3.23 0.55 2.79 -0.14 0.14 -0.32 119.74 125.38 1shs s LYS 110 Ca 0.10 -0.83 -0.11 0.00 -1.36 0.00 0.00 55.97 53.76 1shs s LYS 110 Cb -0.10 -3.89 -0.05 0.00 -1.68 0.00 0.00 37.83 32.10 1shs s LYS 110 CO -0.01 -0.60 0.94 -0.51 -0.76 0.00 0.00 175.35 174.42 1shs s LEU 111 N 1.70 3.45 -0.02 3.17 1.43 0.26 -2.74 118.68 125.93 1shs s LEU 111 Ca 0.06 1.32 0.01 0.00 -1.03 0.00 0.00 54.13 54.49 1shs s LEU 111 Cb -0.18 -4.31 0.07 0.00 0.03 0.00 0.00 46.19 41.80 1shs s LEU 111 CO 0.10 -0.71 0.61 -0.81 0.23 0.00 0.00 176.35 175.78 1shs n PRO 112 N -2.27 1.34 -3.55 1.29 -0.04 -1.23 -4.79 135.00 125.75 1shs n PRO 112 Ca 0.05 -0.27 -0.11 0.00 -0.04 0.00 0.00 63.50 63.12 1shs n PRO 112 Cb 0.54 -1.56 -0.04 0.00 -0.04 0.00 0.00 33.50 32.40 1shs n PRO 112 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1shs s ALA 113 N -1.15 -1.88 0.47 0.55 0.00 -1.26 -4.94 121.76 113.55 1shs s ALA 113 Ca 0.05 1.39 -0.19 0.00 0.00 0.00 0.00 51.96 53.20 1shs s ALA 113 Cb 0.04 -0.30 -0.09 0.00 0.00 0.00 0.00 23.12 22.77 1shs s ALA 113 CO 0.01 -0.43 0.98 0.95 0.00 0.00 0.00 175.76 177.28 1shs s THR 114 N -1.70 4.29 0.19 0.00 -4.23 -1.26 -4.50 115.64 108.43 1shs s THR 114 Ca -0.01 1.31 0.01 0.00 -1.18 0.00 0.00 61.69 61.82 1shs s THR 114 Cb -0.01 -3.59 -0.05 0.00 1.34 0.00 0.00 72.50 70.19 1shs s THR 114 CO -0.00 -0.42 0.05 0.68 -0.54 0.00 0.00 174.62 174.38 1shs s VAL 115 N -2.29 0.51 -0.91 2.29 -7.23 0.14 -0.67 120.40 112.24 1shs s VAL 115 Ca 0.62 -1.98 -0.17 0.00 -1.81 0.00 0.00 61.98 58.64 1shs s VAL 115 Cb -0.11 -2.28 0.16 0.00 0.56 0.00 0.00 36.38 34.71 1shs s VAL 115 CO 0.21 -0.31 1.02 -0.54 -0.31 0.00 0.00 175.10 175.17 1shs s LYS 116 N -3.99 3.63 0.32 4.82 1.02 -0.58 -4.32 119.74 120.65 1shs s LYS 116 Ca 0.29 -2.04 0.10 0.00 0.02 0.00 0.00 55.97 54.34 1shs s LYS 116 Cb 0.07 -4.76 0.90 0.00 -0.52 0.00 0.00 37.83 33.52 1shs s LYS 116 CO 0.07 -1.61 1.72 0.93 -0.92 0.00 0.00 175.35 175.54 1shs h GLU 117 N 8.41 0.53 -1.01 1.68 3.07 -1.88 -0.42 114.58 124.95 1shs h GLU 117 Ca 0.15 -0.03 0.24 0.00 -0.50 0.00 0.00 59.36 59.21 1shs h GLU 117 Cb 1.02 -0.12 -0.10 0.00 -0.84 0.00 0.00 28.75 28.71 1shs h GLU 117 CO 1.00 0.35 0.64 0.93 -1.40 0.00 0.00 179.01 180.52 1shs h GLU 118 N 0.55 0.49 -0.38 2.33 3.07 -1.92 -2.22 114.58 116.49 1shs h GLU 118 Ca 0.65 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.48 1shs h GLU 118 Cb 1.27 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 1shs h GLU 118 CO -0.49 0.32 0.00 0.09 -1.40 0.00 0.00 179.01 177.53 1shs n ASN 119 N -4.68 4.22 -4.77 1.42 3.02 -0.18 -5.01 115.26 109.29 1shs n ASN 119 Ca 0.24 -2.78 -0.38 0.00 -0.03 0.00 0.00 54.58 51.63 1shs n ASN 119 Cb 0.77 -0.53 -0.03 0.00 -0.61 0.00 0.00 39.78 39.38 1shs n ASN 119 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1shs s ALA 120 N -2.42 3.22 0.41 5.41 0.00 -0.84 -4.62 121.76 122.92 1shs s ALA 120 Ca 0.43 0.90 0.07 0.00 0.00 0.00 0.00 51.96 53.36 1shs s ALA 120 Cb 0.32 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 20.03 1shs s ALA 120 CO 0.13 -0.35 0.08 -1.54 0.00 0.00 0.00 175.76 174.07 1shs s SER 121 N -1.14 4.10 -0.28 0.00 1.04 -0.61 -4.97 113.70 111.84 1shs s SER 121 Ca 0.53 -1.25 -0.22 0.00 0.48 0.00 0.00 55.95 55.49 1shs s SER 121 Cb -0.29 -0.43 0.11 0.00 0.10 0.00 0.00 66.02 65.51 1shs s SER 121 CO 0.37 -0.48 0.93 0.00 0.98 0.00 0.00 173.24 175.04 1shs s ALA 122 N -2.66 -1.99 0.06 5.32 0.00 -1.26 -1.67 121.76 119.56 1shs s ALA 122 Ca 0.37 2.03 0.07 0.00 0.00 0.00 0.00 51.96 54.44 1shs s ALA 122 Cb 0.07 -1.45 -0.03 0.00 0.00 0.00 0.00 23.12 21.72 1shs s ALA 122 CO 0.20 -0.29 -0.19 0.15 0.00 0.00 0.00 175.76 175.63 1shs s LYS 123 N 0.64 1.16 -0.27 0.00 1.02 -0.43 -4.97 119.74 116.89 1shs s LYS 123 Ca -0.01 -0.97 -0.03 0.00 0.02 0.00 0.00 55.97 54.97 1shs s LYS 123 Cb -0.05 -1.30 0.09 0.00 -0.52 0.00 0.00 37.83 36.06 1shs s LYS 123 CO -0.08 0.32 0.10 0.12 -0.92 0.00 0.00 175.35 174.89 1shs s PHE 124 N -0.96 0.86 -0.01 3.18 5.36 -1.26 -0.64 117.98 124.50 1shs s PHE 124 Ca 0.05 -1.11 0.00 0.00 -0.96 0.00 0.00 56.93 54.91 1shs s PHE 124 Cb -0.09 -1.17 0.02 0.00 -0.34 0.00 0.00 43.02 41.44 1shs s PHE 124 CO 0.02 -0.79 0.02 -1.83 -1.46 0.00 0.00 175.22 171.18 1shs s GLU 125 N 1.91 -0.01 -0.94 10.12 -1.05 -0.91 -4.85 118.70 122.97 1shs s GLU 125 Ca 0.07 0.12 -0.05 0.00 -0.15 0.00 0.00 54.97 54.97 1shs s GLU 125 Cb -0.17 -0.19 0.01 0.00 -0.44 0.00 0.00 34.13 33.34 1shs s GLU 125 CO -0.27 -0.11 0.82 0.09 0.95 0.00 0.00 175.26 176.73 1shs n ASN 126 N 3.85 -4.45 -0.17 0.83 3.02 -1.26 -2.31 115.26 114.76 1shs n ASN 126 Ca -0.23 -0.40 -0.02 0.00 -0.03 0.00 0.00 54.58 53.90 1shs n ASN 126 Cb 0.53 -3.74 -0.01 0.00 -0.61 0.00 0.00 39.78 35.95 1shs n ASN 126 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1shs n GLY 127 N -1.47 0.45 3.08 7.41 0.00 -1.26 -4.89 105.19 108.50 1shs n GLY 127 Ca -0.04 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 1shs n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1shs s VAL 128 N -1.68 2.15 0.05 1.61 1.01 -0.98 0.14 120.40 122.70 1shs s VAL 128 Ca 0.00 -1.47 -0.22 0.00 0.00 0.00 0.00 61.98 60.29 1shs s VAL 128 Cb 0.00 -2.18 -0.06 0.00 0.00 0.00 0.00 36.38 34.14 1shs s VAL 128 CO 0.00 0.11 0.64 -0.22 0.00 0.00 0.00 175.10 175.63 1shs s LEU 129 N 1.15 4.48 -0.10 3.92 2.96 -0.53 -2.14 118.68 128.42 1shs s LEU 129 Ca -0.06 1.32 -0.02 0.00 -0.22 0.00 0.00 54.13 55.15 1shs s LEU 129 Cb -0.18 -3.02 0.04 0.00 0.50 0.00 0.00 46.19 43.52 1shs s LEU 129 CO -0.07 0.16 0.01 -0.44 -1.32 0.00 0.00 176.35 174.69 1shs s SER 130 N -0.60 1.87 -0.13 3.68 0.01 0.19 -1.08 113.70 117.64 1shs s SER 130 Ca 0.32 -0.25 -0.02 0.00 1.31 0.00 0.00 55.95 57.32 1shs s SER 130 Cb -0.20 -0.46 -0.02 0.00 0.21 0.00 0.00 66.02 65.55 1shs s SER 130 CO 0.20 -0.22 -0.07 -0.69 0.41 0.00 0.00 173.24 172.87 1shs s VAL 131 N 1.96 3.63 -0.22 3.43 1.01 -0.07 -1.32 120.40 128.81 1shs s VAL 131 Ca 0.04 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 1shs s VAL 131 Cb -0.13 -2.55 -0.03 0.00 0.00 0.00 0.00 36.38 33.67 1shs s VAL 131 CO -0.06 0.53 0.05 -0.63 0.00 0.00 0.00 175.10 174.98 1shs s ILE 132 N 0.09 4.27 -0.24 2.22 -1.09 -0.67 -0.57 121.20 125.21 1shs s ILE 132 Ca -0.02 -0.20 0.02 0.00 -2.23 0.00 0.00 60.65 58.23 1shs s ILE 132 Cb -0.14 -2.96 0.05 0.00 -1.58 0.00 0.00 42.46 37.83 1shs s ILE 132 CO 0.03 0.39 -0.12 -0.76 -1.23 0.00 0.00 174.94 173.25 1shs s LEU 133 N 1.22 3.09 0.25 2.97 1.02 0.74 -1.57 118.68 126.40 1shs s LEU 133 Ca 0.04 -1.23 -0.30 0.00 0.02 0.00 0.00 54.13 52.67 1shs s LEU 133 Cb -0.14 -1.49 -0.10 0.00 0.02 0.00 0.00 46.19 44.48 1shs s LEU 133 CO 0.03 -0.16 1.39 -2.84 0.02 0.00 0.00 176.35 174.79 1shs s PRO 134 N 1.17 4.31 0.43 1.29 0.02 -1.26 -0.20 135.00 140.75 1shs s PRO 134 Ca -0.06 2.24 -0.25 0.00 0.02 0.00 0.00 61.00 62.95 1shs s PRO 134 Cb -0.19 -3.12 -0.08 0.00 0.02 0.00 0.00 34.50 31.14 1shs s PRO 134 CO -0.07 -0.35 1.24 0.15 -0.33 0.00 0.00 177.00 177.65 1shs s LYS 135 N -0.57 3.86 0.50 5.54 1.02 0.20 -1.52 119.74 128.76 1shs s LYS 135 Ca 0.57 1.99 -0.20 0.00 0.02 0.00 0.00 55.97 58.35 1shs s LYS 135 Cb -0.40 -2.61 -0.08 0.00 -0.52 0.00 0.00 37.83 34.22 1shs s LYS 135 CO 0.44 -0.53 1.06 0.00 -0.92 0.00 0.00 175.35 175.40 1shs s ALA 136 N -1.37 2.83 0.24 5.17 0.00 0.15 -4.63 121.76 124.15 1shs s ALA 136 Ca 0.60 0.67 -0.06 0.00 0.00 0.00 0.00 51.96 53.17 1shs s ALA 136 Cb -0.34 -3.28 0.34 0.00 0.00 0.00 0.00 23.12 19.84 1shs s ALA 136 CO 0.43 -0.43 1.82 0.93 0.00 0.00 0.00 175.76 178.51 1shs h GLU 137 N 1.48 0.79 0.00 0.00 4.39 -1.93 -0.72 114.58 118.59 1shs h GLU 137 Ca -0.50 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.16 1shs h GLU 137 Cb 1.23 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 1shs h GLU 137 CO 0.58 0.52 0.00 -1.13 -1.16 0.00 0.00 179.01 177.83 1shs n SER 138 N -4.72 0.19 -0.59 1.42 3.41 -1.26 -1.83 113.62 110.25 1shs n SER 138 Ca 0.12 0.57 0.05 0.00 -0.26 0.00 0.00 58.87 59.36 1shs n SER 138 Cb 0.23 -0.60 0.15 0.00 -0.26 0.00 0.00 64.21 63.72 1shs n SER 138 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1shs n SER 139 N -1.74 2.91 -4.53 4.04 7.64 -0.28 -4.92 113.62 116.74 1shs n SER 139 Ca 0.01 -2.10 -0.43 0.00 1.01 0.00 0.00 58.87 57.36 1shs n SER 139 Cb 0.08 -0.24 -0.06 0.00 -1.01 0.00 0.00 64.21 62.98 1shs n SER 139 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1shs s ILE 140 N -1.17 4.71 0.41 0.44 1.01 -0.76 -4.89 121.20 120.94 1shs s ILE 140 Ca 0.23 0.26 -0.27 0.00 0.00 0.00 0.00 60.65 60.87 1shs s ILE 140 Cb 0.13 -4.29 -0.10 0.00 0.01 0.00 0.00 42.46 38.21 1shs s ILE 140 CO 0.13 -0.71 1.43 0.29 0.00 0.00 0.00 174.94 176.08 1shs n LYS 141 N 6.58 2.38 -4.22 2.79 5.02 -1.26 -5.00 118.16 124.44 1shs n LYS 141 Ca 0.00 0.84 -0.30 0.00 -2.02 0.00 0.00 58.31 56.83 1shs n LYS 141 Cb 0.48 -2.59 -0.09 0.00 -0.02 0.00 0.00 35.03 32.80 1shs n LYS 141 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1shs s LYS 142 N -2.24 2.31 0.84 1.97 1.02 -1.26 -5.11 119.74 117.27 1shs s LYS 142 Ca 0.57 -0.93 -0.11 0.00 0.02 0.00 0.00 55.97 55.53 1shs s LYS 142 Cb -0.48 -2.40 0.10 0.00 -0.52 0.00 0.00 37.83 34.53 1shs s LYS 142 CO 0.61 0.53 1.10 0.20 -0.92 0.00 0.00 175.35 176.86 1shs s GLY 143 N -2.15 1.66 -0.04 -3.33 0.00 -1.26 -5.08 107.32 97.12 1shs s GLY 143 Ca 0.22 0.23 0.00 0.00 0.00 0.00 0.00 44.72 45.17 1shs s GLY 143 CO 0.14 0.63 -0.01 -0.42 0.00 0.00 0.00 173.10 173.45 1shs s ILE 144 N -2.86 0.29 0.20 0.90 1.01 -1.26 -5.15 121.20 114.33 1shs s ILE 144 Ca 0.63 0.06 -0.06 0.00 0.00 0.00 0.00 60.65 61.28 1shs s ILE 144 Cb -0.18 -0.39 -0.06 0.00 0.01 0.00 0.00 42.46 41.84 1shs s ILE 144 CO 0.57 0.19 0.47 0.20 0.00 0.00 0.00 174.94 176.36 1shs s ASN 145 N 1.26 6.53 0.19 3.58 0.01 -1.26 -5.08 114.94 120.16 1shs s ASN 145 Ca -0.06 0.72 0.06 0.00 -0.71 0.00 0.00 52.86 52.87 1shs s ASN 145 Cb -0.13 -2.14 -0.04 0.00 0.41 0.00 0.00 41.25 39.34 1shs s ASN 145 CO -0.02 -0.04 0.11 -0.63 -1.51 0.00 0.00 177.10 175.02 1shs s ILE 146 N -1.79 4.29 0.00 0.60 1.01 -1.26 -5.36 121.20 118.69 1shs s ILE 146 Ca 0.44 -1.24 0.00 0.00 0.00 0.00 0.00 60.65 59.85 1shs s ILE 146 Cb -0.11 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.14 1shs s ILE 146 CO 0.24 -0.16 0.00 -1.84 0.00 0.00 0.00 174.94 173.18