#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 0.87 2.92 3.38 0.00 -1.26 -4.93 105.19 106.17 1shs n GLY 34 Ca 0.00 0.79 -0.15 0.00 0.00 0.00 0.00 46.02 46.66 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 2.08 -0.37 -0.23 -0.61 1.09 -1.26 -3.44 121.20 118.46 1shs s ILE 35 Ca 0.89 0.22 0.02 0.00 -1.10 0.00 0.00 60.65 60.68 1shs s ILE 35 Cb -0.90 -0.46 0.04 0.00 -1.06 0.00 0.00 42.46 40.09 1shs s ILE 35 CO 0.52 0.06 -0.14 -1.10 -0.10 0.00 0.00 174.94 174.18 1shs s GLN 36 N 2.38 2.46 0.11 2.79 -0.21 -1.09 -4.91 119.66 121.19 1shs s GLN 36 Ca 0.03 -1.12 0.01 0.00 0.02 0.00 0.00 55.36 54.30 1shs s GLN 36 Cb -0.13 -2.73 -0.04 0.00 1.00 0.00 0.00 33.01 31.12 1shs s GLN 36 CO -0.09 -0.44 0.26 0.42 -2.12 0.00 0.00 175.29 173.33 1shs s ILE 37 N 1.20 5.34 -0.29 1.08 -1.09 -1.26 -0.70 121.20 125.48 1shs s ILE 37 Ca -0.03 -0.50 -0.27 0.00 -2.23 0.00 0.00 60.65 57.62 1shs s ILE 37 Cb -0.17 -3.69 0.19 0.00 -1.58 0.00 0.00 42.46 37.21 1shs s ILE 37 CO -0.08 0.01 1.40 -0.94 -1.23 0.00 0.00 174.94 174.10 1shs s SER 38 N -2.87 -0.05 0.00 3.58 1.04 -1.02 -4.98 113.70 109.40 1shs s SER 38 Ca 0.35 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.86 1shs s SER 38 Cb -0.12 0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.07 1shs s SER 38 CO 0.28 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 175.08 1shs n GLY 39 N 1.04 -0.13 3.24 7.32 0.00 -1.26 0.29 105.19 115.70 1shs n GLY 39 Ca -0.05 -1.43 -0.17 0.00 0.00 0.00 0.00 46.02 44.38 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 1.03 0.00 1.61 -2.85 -0.64 -4.97 119.74 111.92 1shs s LYS 40 Ca 0.00 -1.30 0.00 0.00 -1.00 0.00 0.00 55.97 53.67 1shs s LYS 40 Cb 0.00 -0.80 0.00 0.00 -2.06 0.00 0.00 37.83 34.97 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 0.29 -0.21 3.66 0.59 0.00 -1.26 -0.89 105.19 107.37 1shs n GLY 41 Ca -0.14 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.76 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 -2.82 3.21 -0.50 1.61 5.36 -1.26 -4.80 117.98 118.78 1shs s PHE 42 Ca 0.00 1.35 0.07 0.00 -0.96 0.00 0.00 56.93 57.39 1shs s PHE 42 Cb 0.00 -3.33 0.21 0.00 -0.34 0.00 0.00 43.02 39.56 1shs s PHE 42 CO 0.00 -0.80 0.78 -0.12 -1.46 0.00 0.00 175.22 173.62 1shs n MET 43 N 6.37 0.63 -1.60 10.12 1.56 -1.26 -4.94 117.12 128.00 1shs n MET 43 Ca 0.12 -1.97 -0.53 0.00 -0.27 0.00 0.00 57.70 55.05 1shs n MET 43 Cb 0.46 -1.47 -0.07 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 2.41 1.31 -3.19 2.12 -0.02 -1.26 -4.69 135.00 131.68 1shs n PRO 44 Ca 0.15 0.44 -0.19 0.00 -2.02 0.00 0.00 63.50 61.88 1shs n PRO 44 Cb 0.58 -2.34 0.01 0.00 -0.02 0.00 0.00 33.50 31.73 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 5.15 3.57 -0.25 4.25 1.09 -1.26 -2.07 121.20 131.68 1shs s ILE 45 Ca 1.02 -0.93 -0.12 0.00 -1.10 0.00 0.00 60.65 59.52 1shs s ILE 45 Cb -0.92 -3.23 0.09 0.00 -1.06 0.00 0.00 42.46 37.34 1shs s ILE 45 CO 0.57 -0.10 0.58 -0.44 -0.10 0.00 0.00 174.94 175.44 1shs s SER 46 N -4.26 -0.80 -0.20 3.58 0.01 0.01 -4.95 113.70 107.08 1shs s SER 46 Ca 0.50 1.32 -0.01 0.00 1.31 0.00 0.00 55.95 59.07 1shs s SER 46 Cb -0.10 1.50 0.01 0.00 0.21 0.00 0.00 66.02 67.65 1shs s SER 46 CO 0.33 -0.22 -0.12 -0.63 0.41 0.00 0.00 173.24 173.00 1shs s ILE 47 N 2.09 2.67 -0.13 1.44 1.01 -1.26 -0.03 121.20 126.99 1shs s ILE 47 Ca -0.07 -0.78 -0.03 0.00 0.00 0.00 0.00 60.65 59.77 1shs s ILE 47 Cb -0.09 -2.20 -0.03 0.00 0.01 0.00 0.00 42.46 40.16 1shs s ILE 47 CO -0.17 0.45 -0.04 -0.63 0.00 0.00 0.00 174.94 174.55 1shs s ILE 48 N 1.37 3.92 -0.13 2.92 -1.09 0.11 -4.97 121.20 123.32 1shs s ILE 48 Ca 0.05 -0.36 0.00 0.00 -2.23 0.00 0.00 60.65 58.11 1shs s ILE 48 Cb -0.14 -2.69 -0.01 0.00 -1.58 0.00 0.00 42.46 38.04 1shs s ILE 48 CO -0.08 0.53 -0.15 -0.70 -1.23 0.00 0.00 174.94 173.31 1shs s GLU 49 N -0.01 3.30 0.24 2.79 2.12 -1.26 0.57 118.70 126.45 1shs s GLU 49 Ca 0.01 -0.72 0.02 0.00 0.36 0.00 0.00 54.97 54.63 1shs s GLU 49 Cb -0.13 -2.60 0.02 0.00 0.26 0.00 0.00 34.13 31.68 1shs s GLU 49 CO 0.03 0.16 0.14 0.41 -0.54 0.00 0.00 175.26 175.45 1shs n GLY 50 N 3.68 3.15 0.21 -1.50 0.00 -0.28 -5.01 105.19 105.43 1shs n GLY 50 Ca -0.18 -2.24 -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 0.34 0.75 -0.07 1.61 3.32 -2.01 -3.35 116.42 117.01 1shs h ASP 51 Ca -0.16 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.42 1shs h ASP 51 Cb 0.55 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1shs h ASP 51 CO 0.25 1.25 0.00 0.00 -1.72 0.00 0.00 179.24 179.02 1shs n GLN 52 N -3.91 2.90 -3.83 3.56 6.02 -1.26 -4.70 117.38 116.17 1shs n GLN 52 Ca -0.06 -1.66 -0.07 0.00 -0.01 0.00 0.00 57.00 55.20 1shs n GLN 52 Cb 0.71 -1.08 0.02 0.00 1.02 0.00 0.00 30.24 30.91 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 -1.10 0.11 -0.02 1.08 -3.43 -1.26 0.20 115.29 110.87 1shs s HIS 53 Ca 0.06 -0.71 0.00 0.00 -0.80 0.00 0.00 55.06 53.61 1shs s HIS 53 Cb 0.04 0.80 0.02 0.00 -1.43 0.00 0.00 32.58 32.02 1shs s HIS 53 CO 0.03 -1.39 0.02 0.42 -2.00 0.00 0.00 174.74 171.81 1shs s ILE 54 N -2.26 0.03 -0.05 -5.38 1.01 0.12 -1.13 121.20 113.54 1shs s ILE 54 Ca 0.17 0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.95 1shs s ILE 54 Cb -0.04 -0.13 -0.03 0.00 0.01 0.00 0.00 42.46 42.26 1shs s ILE 54 CO 0.10 0.10 0.02 -0.75 0.00 0.00 0.00 174.94 174.40 1shs s LYS 55 N 0.89 2.95 -0.10 2.79 2.20 0.19 0.08 119.74 128.75 1shs s LYS 55 Ca -0.08 -0.46 -0.00 0.00 -0.36 0.00 0.00 55.97 55.06 1shs s LYS 55 Cb -0.11 -2.78 0.02 0.00 -1.51 0.00 0.00 37.83 33.45 1shs s LYS 55 CO -0.02 0.68 -0.06 0.08 -0.36 0.00 0.00 175.35 175.67 1shs s VAL 56 N -0.98 0.85 -0.10 4.02 1.01 0.05 0.05 120.40 125.29 1shs s VAL 56 Ca 0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 1shs s VAL 56 Cb -0.11 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 1shs s VAL 56 CO 0.06 0.33 -0.06 -0.63 0.00 0.00 0.00 175.10 174.80 1shs s ILE 57 N 1.65 3.76 0.01 2.22 1.09 0.96 -0.60 121.20 130.29 1shs s ILE 57 Ca 0.03 -0.44 0.03 0.00 -1.10 0.00 0.00 60.65 59.17 1shs s ILE 57 Cb -0.13 -2.58 -0.01 0.00 -1.06 0.00 0.00 42.46 38.68 1shs s ILE 57 CO -0.06 0.56 -0.08 0.00 -0.10 0.00 0.00 174.94 175.25 1shs s ALA 58 N -0.34 0.69 -0.47 9.38 0.00 -0.13 -0.81 121.76 130.07 1shs s ALA 58 Ca 0.05 -0.45 -0.18 0.00 0.00 0.00 0.00 51.96 51.38 1shs s ALA 58 Cb -0.12 -0.13 0.05 0.00 0.00 0.00 0.00 23.12 22.91 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 -0.44 3.14 -0.51 0.00 0.52 -0.88 -1.50 118.94 119.27 1shs s TRP 59 Ca 0.01 -0.56 0.05 0.00 0.02 0.00 0.00 56.10 55.62 1shs s TRP 59 Cb -0.05 -3.20 0.38 0.00 -1.15 0.00 0.00 33.47 29.45 1shs s TRP 59 CO 0.00 -0.85 1.02 1.28 0.02 0.00 0.00 176.95 178.42 1shs n LEU 60 N 5.73 4.52 -4.77 2.99 4.77 0.14 -4.30 117.00 126.08 1shs n LEU 60 Ca -0.08 -5.44 -0.40 0.00 -0.03 0.00 0.00 56.01 50.06 1shs n LEU 60 Cb 0.46 -0.49 0.01 0.00 -2.33 0.00 0.00 43.42 41.07 1shs n LEU 60 CO 0.49 2.29 1.09 -2.16 -1.33 0.00 0.00 177.39 177.78 1shs s PRO 61 N -3.49 3.76 0.00 3.23 0.04 -1.17 -1.57 135.00 135.79 1shs s PRO 61 Ca 0.48 2.46 0.00 0.00 0.04 0.00 0.00 61.00 63.98 1shs s PRO 61 Cb 0.34 -2.71 0.00 0.00 0.04 0.00 0.00 34.50 32.17 1shs s PRO 61 CO -0.16 -0.78 0.00 0.41 0.04 0.00 0.00 177.00 176.51 1shs n GLY 62 N 0.55 2.99 3.80 0.56 0.00 -1.26 -5.00 105.19 106.84 1shs n GLY 62 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.29 4.42 -0.12 1.61 0.11 -0.61 -4.56 120.40 118.97 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 -3.93 -0.04 0.00 -1.53 0.00 0.00 36.38 30.89 1shs s VAL 63 CO 0.00 0.19 0.60 0.20 -3.33 0.00 0.00 175.10 172.76 1shs s ASN 64 N -1.62 6.81 0.28 3.54 0.01 -1.26 -4.91 114.94 117.78 1shs s ASN 64 Ca 0.46 0.97 0.09 0.00 -0.71 0.00 0.00 52.86 53.67 1shs s ASN 64 Cb -0.18 -2.35 0.86 0.00 0.41 0.00 0.00 41.25 39.99 1shs s ASN 64 CO 0.22 -0.11 1.29 1.17 -1.51 0.00 0.00 177.10 178.16 1shs n LYS 65 N 4.04 -0.06 -0.09 -0.60 3.00 -1.26 0.21 118.16 123.41 1shs n LYS 65 Ca -0.03 1.18 0.04 0.00 -0.00 0.00 0.00 58.31 59.50 1shs n LYS 65 Cb 0.51 -1.99 0.13 0.00 0.00 0.00 0.00 35.03 33.68 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 -5.01 1.43 0.00 1.64 4.71 -1.26 -3.11 120.64 119.04 1shs n GLU 66 Ca 0.25 -0.67 0.07 0.00 -0.01 0.00 0.00 57.16 56.80 1shs n GLU 66 Cb 0.84 -1.17 0.06 0.00 -1.01 0.00 0.00 31.44 30.15 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 0.03 2.17 -4.79 1.62 8.00 0.58 -4.95 116.55 119.21 1shs n ASP 67 Ca 0.07 -1.59 -0.38 0.00 0.71 0.00 0.00 54.79 53.61 1shs n ASP 67 Cb 0.17 0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.25 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 -1.28 5.08 -0.17 0.53 1.01 -1.18 -3.24 121.20 121.95 1shs s ILE 68 Ca 0.17 0.87 0.01 0.00 0.00 0.00 0.00 60.65 61.70 1shs s ILE 68 Cb 0.12 -3.75 0.02 0.00 0.01 0.00 0.00 42.46 38.86 1shs s ILE 68 CO 0.20 0.48 -0.19 -0.63 0.00 0.00 0.00 174.94 174.80 1shs s ILE 69 N -0.41 1.94 -0.12 2.92 1.01 0.16 -4.99 121.20 121.70 1shs s ILE 69 Ca 0.24 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 60.04 1shs s ILE 69 Cb -0.16 -1.76 0.01 0.00 0.01 0.00 0.00 42.46 40.56 1shs s ILE 69 CO 0.12 0.52 -0.19 -0.22 0.00 0.00 0.00 174.94 175.17 1shs s LEU 70 N 1.28 1.94 -0.04 2.97 0.20 -1.26 -1.69 118.68 122.08 1shs s LEU 70 Ca 0.03 -0.52 -0.27 0.00 0.69 0.00 0.00 54.13 54.07 1shs s LEU 70 Cb -0.13 -1.29 0.06 0.00 -0.43 0.00 0.00 46.19 44.40 1shs s LEU 70 CO -0.11 0.06 0.58 0.54 -0.29 0.00 0.00 176.35 177.13 1shs s ASN 71 N 0.83 -0.53 0.20 3.68 6.03 -1.11 -5.04 114.94 119.00 1shs s ASN 71 Ca -0.08 0.54 -0.17 0.00 -1.03 0.00 0.00 52.86 52.12 1shs s ASN 71 Cb -0.16 0.48 0.02 0.00 -3.03 0.00 0.00 41.25 38.56 1shs s ASN 71 CO -0.01 -0.57 0.52 0.00 -2.03 0.00 0.00 177.10 175.01 1shs s ALA 72 N -1.25 -0.81 -0.23 3.54 0.00 -1.26 -0.90 121.76 120.84 1shs s ALA 72 Ca -0.12 -0.35 -0.27 0.00 0.00 0.00 0.00 51.96 51.23 1shs s ALA 72 Cb -0.01 0.88 0.13 0.00 0.00 0.00 0.00 23.12 24.11 1shs s ALA 72 CO 0.08 -0.82 1.03 0.54 0.00 0.00 0.00 175.76 176.60 1shs s VAL 73 N -3.90 0.00 0.00 0.00 0.11 -0.73 -4.76 120.40 111.12 1shs s VAL 73 Ca 0.11 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 1shs s VAL 73 Cb -0.01 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.84 1shs s VAL 73 CO -0.01 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.37 1shs n GLY 74 N 1.57 1.35 0.10 6.54 0.00 -1.26 -2.02 105.19 111.46 1shs n GLY 74 Ca -0.11 0.29 0.07 0.00 0.00 0.00 0.00 46.02 46.27 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 11.51 2.00 -4.02 1.61 5.75 -1.26 0.01 116.55 132.14 1shs n ASP 75 Ca 0.00 -2.76 -0.22 0.00 -0.01 0.00 0.00 54.79 51.80 1shs n ASP 75 Cb 0.00 -0.33 -0.16 0.00 -1.03 0.00 0.00 41.12 39.60 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 -2.23 0.92 0.04 2.12 -4.23 -0.86 0.11 115.64 111.51 1shs s THR 76 Ca 0.23 -0.43 0.06 0.00 -1.18 0.00 0.00 61.69 60.37 1shs s THR 76 Cb 0.20 -0.82 -0.03 0.00 1.34 0.00 0.00 72.50 73.19 1shs s THR 76 CO 0.02 0.28 -0.12 -0.22 -0.54 0.00 0.00 174.62 174.04 1shs s LEU 77 N 0.23 2.89 -0.09 4.79 2.96 0.55 -1.77 118.68 128.24 1shs s LEU 77 Ca -0.04 -0.31 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1shs s LEU 77 Cb -0.10 -1.68 0.02 0.00 0.50 0.00 0.00 46.19 44.93 1shs s LEU 77 CO 0.01 0.25 -0.08 -0.70 -1.32 0.00 0.00 176.35 174.51 1shs s GLU 78 N -1.54 1.46 -0.24 1.98 2.12 -0.08 0.14 118.70 122.54 1shs s GLU 78 Ca 0.17 -0.26 -0.01 0.00 0.36 0.00 0.00 54.97 55.23 1shs s GLU 78 Cb -0.11 -1.44 0.03 0.00 0.26 0.00 0.00 34.13 32.87 1shs s GLU 78 CO 0.07 -0.17 -0.09 0.42 -0.54 0.00 0.00 175.26 174.95 1shs s ILE 79 N 1.37 2.64 -0.04 -3.70 1.01 0.44 -2.73 121.20 120.19 1shs s ILE 79 Ca -0.02 -1.08 0.02 0.00 0.00 0.00 0.00 60.65 59.57 1shs s ILE 79 Cb -0.14 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 40.03 1shs s ILE 79 CO -0.04 0.24 -0.07 0.00 0.00 0.00 0.00 174.94 175.07 1shs s ARG 80 N 1.29 1.00 0.23 2.79 1.70 -0.68 -0.52 118.95 124.76 1shs s ARG 80 Ca -0.00 -0.22 -0.10 0.00 -0.47 0.00 0.00 55.73 54.94 1shs s ARG 80 Cb -0.16 -0.93 -0.01 0.00 -0.57 0.00 0.00 34.95 33.28 1shs s ARG 80 CO -0.06 0.00 0.40 0.00 -1.08 0.00 0.00 175.30 174.56 1shs s ALA 81 N 0.61 0.03 -0.05 7.88 0.00 -0.11 0.36 121.76 130.49 1shs s ALA 81 Ca -0.09 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.86 1shs s ALA 81 Cb -0.13 1.11 0.02 0.00 0.00 0.00 0.00 23.12 24.13 1shs s ALA 81 CO 0.01 -0.79 -0.05 -1.59 0.00 0.00 0.00 175.76 173.33 1shs s LYS 82 N -4.04 0.93 -0.17 0.00 -2.85 -1.20 -1.09 119.74 111.32 1shs s LYS 82 Ca 0.25 -0.14 -0.01 0.00 -1.00 0.00 0.00 55.97 55.06 1shs s LYS 82 Cb 0.01 -0.90 -0.00 0.00 -2.06 0.00 0.00 37.83 34.88 1shs s LYS 82 CO 0.09 -0.06 -0.12 -0.98 0.10 0.00 0.00 175.35 174.38 1shs s ARG 83 N 0.86 3.29 0.74 1.78 1.70 -0.18 -4.32 118.95 122.81 1shs s ARG 83 Ca -0.12 -0.70 -0.14 0.00 -0.47 0.00 0.00 55.73 54.30 1shs s ARG 83 Cb -0.15 -2.75 0.04 0.00 -0.57 0.00 0.00 34.95 31.53 1shs s ARG 83 CO 0.01 -0.03 1.16 0.45 -1.08 0.00 0.00 175.30 175.81 1shs s SER 84 N 0.98 4.31 0.44 -2.89 0.15 -1.26 -4.41 113.70 111.01 1shs s SER 84 Ca -0.02 2.20 -0.06 0.00 0.70 0.00 0.00 55.95 58.77 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 -0.01 -2.18 0.75 -2.16 1.20 0.00 0.00 173.24 170.84 1shs s PRO 85 N -4.13 3.60 -0.14 5.44 0.04 -1.26 -4.97 135.00 133.58 1shs s PRO 85 Ca 0.70 0.22 -0.35 0.00 0.04 0.00 0.00 61.00 61.62 1shs s PRO 85 Cb -0.25 -2.41 -0.12 0.00 0.04 0.00 0.00 34.50 31.76 1shs s PRO 85 CO 0.47 -0.12 1.91 1.28 0.04 0.00 0.00 177.00 180.58 1shs n LEU 86 N -1.91 3.23 -4.70 -3.56 4.32 -1.26 -4.92 117.00 108.20 1shs n LEU 86 Ca 0.01 0.91 -0.40 0.00 -0.02 0.00 0.00 56.01 56.51 1shs n LEU 86 Cb 0.55 -1.34 -0.05 0.00 -1.62 0.00 0.00 43.42 40.95 1shs n LEU 86 CO 0.51 -0.17 0.35 -0.32 -1.22 0.00 0.00 177.39 176.55 1shs s MET 87 N 4.30 4.34 -0.10 3.23 -2.45 -1.26 -5.05 119.30 122.32 1shs s MET 87 Ca 0.95 0.72 0.03 0.00 -1.25 0.00 0.00 55.69 56.14 1shs s MET 87 Cb -0.73 -3.49 0.01 0.00 1.25 0.00 0.00 34.83 31.86 1shs s MET 87 CO 0.53 -0.03 -0.19 0.96 1.05 0.00 0.00 175.02 177.34 1shs s ILE 88 N 1.16 1.73 0.75 10.11 -4.36 -1.26 -5.12 121.20 124.21 1shs s ILE 88 Ca 0.33 -0.81 -0.15 0.00 -0.26 0.00 0.00 60.65 59.75 1shs s ILE 88 Cb -0.17 -1.52 0.01 0.00 1.25 0.00 0.00 42.46 42.03 1shs s ILE 88 CO 0.14 0.49 0.89 0.35 0.24 0.00 0.00 174.94 177.04 1shs n THR 89 N 3.77 2.28 -0.21 8.37 -2.24 -1.26 -4.82 114.28 120.17 1shs n THR 89 Ca -0.20 -0.33 0.15 0.00 -2.27 0.00 0.00 64.05 61.40 1shs n THR 89 Cb 0.52 -1.01 0.47 0.00 -2.10 0.00 0.00 70.33 68.21 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 -0.48 0.47 -0.89 -0.78 -0.00 -2.06 -1.71 114.58 109.14 1shs h GLU 90 Ca -0.46 -0.03 0.05 0.00 -0.00 0.00 0.00 59.36 58.92 1shs h GLU 90 Cb 1.33 -0.11 -0.05 0.00 -0.00 0.00 0.00 28.75 29.92 1shs h GLU 90 CO 0.45 0.31 0.58 1.03 -0.00 0.00 0.00 179.01 181.38 1shs h SER 91 N 0.49 0.92 -4.07 3.06 0.87 -2.05 -3.44 113.55 109.33 1shs h SER 91 Ca 0.41 -0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.47 1shs h SER 91 Cb 0.88 -0.20 0.04 0.00 -0.44 0.00 0.00 62.40 62.68 1shs h SER 91 CO -0.15 0.62 0.31 -1.61 -0.53 0.00 0.00 176.83 175.46 1shs s GLU 92 N -5.92 3.64 0.01 2.24 2.02 -0.64 -5.09 118.70 114.96 1shs s GLU 92 Ca -0.12 0.61 0.00 0.00 0.02 0.00 0.00 54.97 55.48 1shs s GLU 92 Cb 0.19 -2.19 -0.01 0.00 0.10 0.00 0.00 34.13 32.22 1shs s GLU 92 CO 0.80 -0.39 -0.01 1.03 0.02 0.00 0.00 175.26 176.70 1shs s ARG 93 N -4.82 0.14 -0.91 1.61 0.52 -1.26 -4.79 118.95 109.45 1shs s ARG 93 Ca 0.53 -0.27 -0.24 0.00 -0.52 0.00 0.00 55.73 55.23 1shs s ARG 93 Cb -0.11 0.04 0.05 0.00 0.52 0.00 0.00 34.95 35.45 1shs s ARG 93 CO 0.47 -0.02 1.36 0.42 0.02 0.00 0.00 175.30 177.55 1shs s ILE 94 N -0.63 3.90 0.53 1.52 1.01 -1.26 -4.82 121.20 121.45 1shs s ILE 94 Ca -0.07 -0.38 0.20 0.00 0.00 0.00 0.00 60.65 60.40 1shs s ILE 94 Cb -0.04 -4.99 0.31 0.00 0.01 0.00 0.00 42.46 37.75 1shs s ILE 94 CO -0.00 -1.88 2.12 0.40 0.00 0.00 0.00 174.94 175.58 1shs h ILE 95 N 6.47 0.87 -1.49 2.92 2.04 -2.05 -3.44 117.51 122.82 1shs h ILE 95 Ca 0.02 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.98 1shs h ILE 95 Cb 1.03 0.93 -0.24 0.00 -0.74 0.00 0.00 36.82 37.79 1shs h ILE 95 CO 1.36 0.00 0.59 -0.47 0.00 0.00 0.00 178.15 179.63 1shs s TYR 96 N -4.99 -0.34 -0.29 1.37 6.14 -1.26 -5.18 117.35 112.80 1shs s TYR 96 Ca -0.05 0.63 -0.16 0.00 0.64 0.00 0.00 57.07 58.13 1shs s TYR 96 Cb 0.17 0.44 0.12 0.00 0.42 0.00 0.00 41.96 43.12 1shs s TYR 96 CO 0.67 -0.28 0.86 0.45 0.64 0.00 0.00 175.55 177.88 1shs s SER 97 N -0.87 -0.69 0.00 4.32 0.15 -1.26 -5.00 113.70 110.35 1shs s SER 97 Ca 0.00 1.11 0.13 0.00 0.70 0.00 0.00 55.95 57.89 1shs s SER 97 Cb -0.01 1.29 0.16 0.00 -1.71 0.00 0.00 66.02 65.74 1shs s SER 97 CO -0.01 -0.17 1.00 -0.62 1.20 0.00 0.00 173.24 174.63 1shs n GLU 98 N 3.97 1.25 -3.19 5.44 1.02 -1.26 -4.96 120.64 122.91 1shs n GLU 98 Ca -0.19 -1.47 -0.40 0.00 -0.02 0.00 0.00 57.16 55.09 1shs n GLU 98 Cb 0.58 -1.27 -0.06 0.00 -0.02 0.00 0.00 31.44 30.67 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 -1.09 5.07 0.32 -3.67 1.09 -1.26 -5.03 121.20 116.63 1shs s ILE 99 Ca 0.18 1.08 -0.29 0.00 -1.10 0.00 0.00 60.65 60.51 1shs s ILE 99 Cb 0.12 -3.89 -0.11 0.00 -1.06 0.00 0.00 42.46 37.51 1shs s ILE 99 CO 0.17 0.16 1.51 -2.16 -0.10 0.00 0.00 174.94 174.52 1shs s PRO 100 N 1.67 4.15 0.04 2.79 0.04 -1.26 -4.96 135.00 137.47 1shs s PRO 100 Ca 0.27 2.52 0.01 0.00 0.04 0.00 0.00 61.00 63.84 1shs s PRO 100 Cb -0.16 -3.02 -0.26 0.00 0.04 0.00 0.00 34.50 31.11 1shs s PRO 100 CO 0.10 -0.54 0.99 0.93 0.04 0.00 0.00 177.00 178.52 1shs h GLU 101 N 4.06 0.16 -5.05 4.56 4.39 -2.00 -3.47 114.58 117.23 1shs h GLU 101 Ca -0.48 -0.28 -0.59 0.00 0.34 0.00 0.00 59.36 58.35 1shs h GLU 101 Cb 1.23 0.10 0.08 0.00 -0.10 0.00 0.00 28.75 30.06 1shs h GLU 101 CO 0.72 1.03 -0.33 -0.85 -1.16 0.00 0.00 179.01 178.42 1shs n GLU 102 N -3.39 0.00 -0.12 2.33 0.00 -1.26 -4.78 120.64 113.42 1shs n GLU 102 Ca -0.11 0.00 -0.26 0.00 0.00 0.00 0.00 57.16 56.79 1shs n GLU 102 Cb 1.02 -0.94 -0.11 0.00 0.00 0.00 0.00 31.44 31.41 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 0.94 0.61 -3.21 3.44 1.02 -1.26 -4.81 120.64 117.37 1shs n GLU 103 Ca 0.16 0.30 -0.40 0.00 -0.02 0.00 0.00 57.16 57.20 1shs n GLU 103 Cb 0.18 -1.56 -0.07 0.00 -0.02 0.00 0.00 31.44 29.97 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 -2.49 4.15 0.04 3.49 2.12 -1.26 -1.02 118.70 123.74 1shs s GLU 104 Ca -0.35 0.44 0.00 0.00 0.36 0.00 0.00 54.97 55.42 1shs s GLU 104 Cb 0.12 -3.60 -0.03 0.00 0.26 0.00 0.00 34.13 30.88 1shs s GLU 104 CO 0.55 -0.25 -0.04 0.96 -0.54 0.00 0.00 175.26 175.94 1shs s ILE 105 N 1.95 0.29 0.05 -3.70 -4.36 -0.25 -4.69 121.20 110.49 1shs s ILE 105 Ca 0.24 -1.36 -0.28 0.00 -0.26 0.00 0.00 60.65 58.99 1shs s ILE 105 Cb -0.16 -0.91 0.10 0.00 1.25 0.00 0.00 42.46 42.74 1shs s ILE 105 CO 0.09 -0.69 1.15 -0.72 0.24 0.00 0.00 174.94 175.01 1shs s TYR 106 N -2.52 -0.08 -0.17 1.37 1.13 -0.07 -0.93 117.35 116.08 1shs s TYR 106 Ca -0.04 -0.10 -0.14 0.00 -1.41 0.00 0.00 57.07 55.39 1shs s TYR 106 Cb -0.02 0.58 0.05 0.00 -1.10 0.00 0.00 41.96 41.47 1shs s TYR 106 CO -0.04 -0.50 0.43 1.03 -2.51 0.00 0.00 175.55 173.96 1shs s ARG 107 N -2.78 0.48 -0.13 -3.49 0.52 0.33 -1.61 118.95 112.27 1shs s ARG 107 Ca 0.13 0.65 -0.01 0.00 -0.52 0.00 0.00 55.73 55.99 1shs s ARG 107 Cb 0.02 0.18 -0.02 0.00 0.52 0.00 0.00 34.95 35.65 1shs s ARG 107 CO -0.02 -0.09 -0.10 0.95 0.02 0.00 0.00 175.30 176.07 1shs s THR 108 N 0.54 3.38 0.01 0.02 -4.23 0.15 -0.42 115.64 115.09 1shs s THR 108 Ca -0.03 -0.55 0.08 0.00 -1.18 0.00 0.00 61.69 60.01 1shs s THR 108 Cb -0.04 -2.43 -0.02 0.00 1.34 0.00 0.00 72.50 71.34 1shs s THR 108 CO -0.03 0.53 -0.26 -0.63 -0.54 0.00 0.00 174.62 173.69 1shs s ILE 109 N 0.15 2.10 -0.36 2.99 1.01 0.36 -2.42 121.20 125.04 1shs s ILE 109 Ca -0.05 -1.22 -0.12 0.00 0.00 0.00 0.00 60.65 59.27 1shs s ILE 109 Cb -0.14 -1.76 0.01 0.00 0.01 0.00 0.00 42.46 40.57 1shs s ILE 109 CO 0.04 0.50 0.22 -0.54 0.00 0.00 0.00 174.94 175.16 1shs s LYS 110 N -0.86 3.09 0.54 2.79 -0.14 0.13 -0.33 119.74 124.94 1shs s LYS 110 Ca 0.11 -0.91 -0.12 0.00 -1.36 0.00 0.00 55.97 53.69 1shs s LYS 110 Cb -0.10 -3.77 -0.05 0.00 -1.68 0.00 0.00 37.83 32.22 1shs s LYS 110 CO 0.00 -0.61 0.95 -0.51 -0.76 0.00 0.00 175.35 174.42 1shs s LEU 111 N 1.63 3.49 -0.02 3.17 1.43 0.30 -2.67 118.68 126.00 1shs s LEU 111 Ca 0.04 1.36 0.01 0.00 -1.03 0.00 0.00 54.13 54.51 1shs s LEU 111 Cb -0.18 -4.34 0.07 0.00 0.03 0.00 0.00 46.19 41.76 1shs s LEU 111 CO 0.08 -0.68 0.66 -0.81 0.23 0.00 0.00 176.35 175.83 1shs n PRO 112 N -2.13 1.31 -3.54 1.29 -0.04 -1.22 -4.80 135.00 125.87 1shs n PRO 112 Ca 0.05 -0.26 -0.12 0.00 -0.04 0.00 0.00 63.50 63.12 1shs n PRO 112 Cb 0.54 -1.51 -0.05 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.24 -1.85 0.47 0.55 0.00 -1.26 -4.94 121.76 113.49 1shs s ALA 113 Ca 0.05 1.37 -0.19 0.00 0.00 0.00 0.00 51.96 53.18 1shs s ALA 113 Cb 0.03 -0.25 -0.09 0.00 0.00 0.00 0.00 23.12 22.81 1shs s ALA 113 CO 0.02 -0.41 0.98 0.95 0.00 0.00 0.00 175.76 177.29 1shs s THR 114 N -1.58 4.34 0.21 0.00 -4.23 -1.26 -4.49 115.64 108.64 1shs s THR 114 Ca -0.03 1.33 0.01 0.00 -1.18 0.00 0.00 61.69 61.81 1shs s THR 114 Cb -0.00 -3.61 -0.05 0.00 1.34 0.00 0.00 72.50 70.18 1shs s THR 114 CO 0.02 -0.44 0.08 0.68 -0.54 0.00 0.00 174.62 174.42 1shs s VAL 115 N -2.32 0.42 -0.86 2.29 -7.23 0.10 -0.46 120.40 112.35 1shs s VAL 115 Ca 0.62 -1.99 -0.16 0.00 -1.81 0.00 0.00 61.98 58.64 1shs s VAL 115 Cb -0.10 -2.44 0.18 0.00 0.56 0.00 0.00 36.38 34.57 1shs s VAL 115 CO 0.21 -0.15 0.91 -0.54 -0.31 0.00 0.00 175.10 175.22 1shs s LYS 116 N -4.04 3.57 0.29 4.82 1.02 -0.34 -4.36 119.74 120.71 1shs s LYS 116 Ca 0.34 -2.12 0.04 0.00 0.02 0.00 0.00 55.97 54.24 1shs s LYS 116 Cb 0.07 -4.62 0.73 0.00 -0.52 0.00 0.00 37.83 33.49 1shs s LYS 116 CO 0.10 -1.50 1.70 0.93 -0.92 0.00 0.00 175.35 175.66 1shs h GLU 117 N 8.28 0.40 -1.05 1.68 3.07 -1.88 -0.31 114.58 124.77 1shs h GLU 117 Ca 0.11 -0.02 0.28 0.00 -0.50 0.00 0.00 59.36 59.22 1shs h GLU 117 Cb 1.04 -0.09 -0.09 0.00 -0.84 0.00 0.00 28.75 28.77 1shs h GLU 117 CO 0.91 0.26 0.69 0.93 -1.40 0.00 0.00 179.01 180.41 1shs h GLU 118 N 0.41 0.31 -0.36 2.33 3.07 -1.92 -2.02 114.58 116.40 1shs h GLU 118 Ca 0.56 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.40 1shs h GLU 118 Cb 1.05 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.89 1shs h GLU 118 CO -0.52 0.21 0.00 0.09 -1.40 0.00 0.00 179.01 177.39 1shs n ASN 119 N -4.55 3.94 -4.77 1.42 3.02 -0.14 -5.02 115.26 109.16 1shs n ASN 119 Ca 0.25 -2.69 -0.39 0.00 -0.03 0.00 0.00 54.58 51.72 1shs n ASN 119 Cb 0.93 -0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 39.58 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 -2.26 3.26 0.43 5.41 0.00 -0.76 -4.64 121.76 123.20 1shs s ALA 120 Ca 0.40 0.90 0.06 0.00 0.00 0.00 0.00 51.96 53.32 1shs s ALA 120 Cb 0.29 -3.34 -0.05 0.00 0.00 0.00 0.00 23.12 20.02 1shs s ALA 120 CO 0.13 -0.32 0.12 -1.54 0.00 0.00 0.00 175.76 174.15 1shs s SER 121 N -1.09 4.23 -0.28 0.00 1.04 -0.72 -4.97 113.70 111.91 1shs s SER 121 Ca 0.52 -1.25 -0.21 0.00 0.48 0.00 0.00 55.95 55.49 1shs s SER 121 Cb -0.30 -0.29 0.13 0.00 0.10 0.00 0.00 66.02 65.66 1shs s SER 121 CO 0.38 -0.58 0.97 0.00 0.98 0.00 0.00 173.24 174.99 1shs s ALA 122 N -2.68 -2.07 0.03 5.32 0.00 -1.26 -1.85 121.76 119.25 1shs s ALA 122 Ca 0.35 2.06 0.07 0.00 0.00 0.00 0.00 51.96 54.43 1shs s ALA 122 Cb 0.05 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 1shs s ALA 122 CO 0.19 -0.29 -0.19 0.15 0.00 0.00 0.00 175.76 175.61 1shs s LYS 123 N 0.78 1.35 -0.27 0.00 1.02 -0.67 -4.97 119.74 116.97 1shs s LYS 123 Ca -0.03 -0.86 -0.02 0.00 0.02 0.00 0.00 55.97 55.09 1shs s LYS 123 Cb -0.04 -1.41 0.09 0.00 -0.52 0.00 0.00 37.83 35.94 1shs s LYS 123 CO -0.10 0.36 0.08 0.12 -0.92 0.00 0.00 175.35 174.89 1shs s PHE 124 N -0.73 1.36 -0.01 3.18 5.36 -1.26 -0.96 117.98 124.92 1shs s PHE 124 Ca 0.07 -1.38 0.00 0.00 -0.96 0.00 0.00 56.93 54.65 1shs s PHE 124 Cb -0.08 -1.41 0.02 0.00 -0.34 0.00 0.00 43.02 41.20 1shs s PHE 124 CO 0.01 -0.80 0.01 -1.83 -1.46 0.00 0.00 175.22 171.16 1shs s GLU 125 N 1.74 -0.00 -1.07 10.12 -1.05 -0.91 -4.85 118.70 122.67 1shs s GLU 125 Ca 0.06 0.10 -0.05 0.00 -0.15 0.00 0.00 54.97 54.93 1shs s GLU 125 Cb -0.17 -0.15 0.01 0.00 -0.44 0.00 0.00 34.13 33.37 1shs s GLU 125 CO -0.21 -0.09 0.93 0.09 0.95 0.00 0.00 175.26 176.92 1shs n ASN 126 N 3.70 -4.49 -0.01 0.83 3.02 -1.26 -2.15 115.26 114.90 1shs n ASN 126 Ca -0.21 -0.46 -0.00 0.00 -0.03 0.00 0.00 54.58 53.88 1shs n ASN 126 Cb 0.54 -4.24 -0.00 0.00 -0.61 0.00 0.00 39.78 35.47 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 -1.54 0.26 3.12 7.41 0.00 -1.26 -4.89 105.19 108.28 1shs n GLY 127 Ca -0.07 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.51 2.38 0.06 1.61 1.01 -0.91 0.28 120.40 123.32 1shs s VAL 128 Ca 0.00 -1.29 -0.21 0.00 0.00 0.00 0.00 61.98 60.48 1shs s VAL 128 Cb 0.00 -2.25 -0.06 0.00 0.00 0.00 0.00 36.38 34.07 1shs s VAL 128 CO 0.00 0.17 0.63 -0.22 0.00 0.00 0.00 175.10 175.68 1shs s LEU 129 N 1.22 4.50 -0.12 3.92 2.96 -0.57 -2.15 118.68 128.43 1shs s LEU 129 Ca -0.03 1.32 -0.02 0.00 -0.22 0.00 0.00 54.13 55.18 1shs s LEU 129 Cb -0.17 -3.01 0.04 0.00 0.50 0.00 0.00 46.19 43.55 1shs s LEU 129 CO -0.07 0.19 0.02 -0.44 -1.32 0.00 0.00 176.35 174.73 1shs s SER 130 N -0.74 2.14 -0.14 3.68 0.01 -0.13 -0.96 113.70 117.56 1shs s SER 130 Ca 0.32 -0.39 -0.03 0.00 1.31 0.00 0.00 55.95 57.15 1shs s SER 130 Cb -0.20 -0.50 -0.03 0.00 0.21 0.00 0.00 66.02 65.50 1shs s SER 130 CO 0.20 -0.24 -0.04 -0.69 0.41 0.00 0.00 173.24 172.88 1shs s VAL 131 N 1.93 3.88 -0.23 3.43 1.01 0.23 -1.67 120.40 128.98 1shs s VAL 131 Ca 0.03 -0.37 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 1shs s VAL 131 Cb -0.14 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 1shs s VAL 131 CO -0.07 0.51 0.07 -0.63 0.00 0.00 0.00 175.10 174.99 1shs s ILE 132 N 0.14 4.43 -0.24 2.22 -1.09 -0.77 -0.77 121.20 125.12 1shs s ILE 132 Ca -0.01 -0.14 0.02 0.00 -2.23 0.00 0.00 60.65 58.29 1shs s ILE 132 Cb -0.14 -3.05 0.05 0.00 -1.58 0.00 0.00 42.46 37.74 1shs s ILE 132 CO 0.03 0.36 -0.13 -0.76 -1.23 0.00 0.00 174.94 173.21 1shs s LEU 133 N 1.34 3.09 0.24 2.97 1.02 0.11 -1.75 118.68 125.70 1shs s LEU 133 Ca 0.05 -1.19 -0.30 0.00 0.02 0.00 0.00 54.13 52.71 1shs s LEU 133 Cb -0.15 -1.53 -0.10 0.00 0.02 0.00 0.00 46.19 44.44 1shs s LEU 133 CO 0.04 -0.14 1.37 -2.84 0.02 0.00 0.00 176.35 174.80 1shs s PRO 134 N 1.15 4.33 0.41 1.29 0.02 -1.26 0.14 135.00 141.08 1shs s PRO 134 Ca -0.05 2.19 -0.25 0.00 0.02 0.00 0.00 61.00 62.90 1shs s PRO 134 Cb -0.18 -3.14 -0.08 0.00 0.02 0.00 0.00 34.50 31.12 1shs s PRO 134 CO -0.07 -0.32 1.26 0.15 -0.33 0.00 0.00 177.00 177.69 1shs s LYS 135 N -0.42 3.94 0.51 5.54 1.02 0.13 -1.20 119.74 129.26 1shs s LYS 135 Ca 0.57 2.06 -0.20 0.00 0.02 0.00 0.00 55.97 58.42 1shs s LYS 135 Cb -0.39 -2.69 -0.07 0.00 -0.52 0.00 0.00 37.83 34.15 1shs s LYS 135 CO 0.42 -0.49 1.07 0.00 -0.92 0.00 0.00 175.35 175.44 1shs s ALA 136 N -1.32 2.80 0.25 5.17 0.00 0.39 -4.61 121.76 124.44 1shs s ALA 136 Ca 0.58 0.67 -0.04 0.00 0.00 0.00 0.00 51.96 53.17 1shs s ALA 136 Cb -0.36 -3.29 0.39 0.00 0.00 0.00 0.00 23.12 19.87 1shs s ALA 136 CO 0.45 -0.52 1.83 0.93 0.00 0.00 0.00 175.76 178.46 1shs h GLU 137 N 1.34 0.87 0.00 0.00 4.39 -1.93 -1.17 114.58 118.08 1shs h GLU 137 Ca -0.49 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.15 1shs h GLU 137 Cb 1.24 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1shs h GLU 137 CO 0.58 0.58 0.00 -1.13 -1.16 0.00 0.00 179.01 177.88 1shs n SER 138 N -4.67 0.14 -0.60 1.42 3.41 -1.26 -1.91 113.62 110.15 1shs n SER 138 Ca 0.14 0.55 0.05 0.00 -0.26 0.00 0.00 58.87 59.35 1shs n SER 138 Cb 0.25 -0.57 0.15 0.00 -0.26 0.00 0.00 64.21 63.77 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 -1.67 2.90 -4.53 4.04 7.64 -0.45 -4.93 113.62 116.62 1shs n SER 139 Ca 0.01 -2.07 -0.43 0.00 1.01 0.00 0.00 58.87 57.40 1shs n SER 139 Cb 0.09 -0.23 -0.06 0.00 -1.01 0.00 0.00 64.21 63.00 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 -1.12 4.77 0.37 0.44 1.01 -0.80 -4.90 121.20 120.96 1shs s ILE 140 Ca 0.22 0.30 -0.28 0.00 0.00 0.00 0.00 60.65 60.90 1shs s ILE 140 Cb 0.12 -4.23 -0.11 0.00 0.01 0.00 0.00 42.46 38.25 1shs s ILE 140 CO 0.14 -0.61 1.49 0.29 0.00 0.00 0.00 174.94 176.25 1shs n LYS 141 N 6.41 2.66 -4.16 2.79 5.02 -1.26 -5.00 118.16 124.62 1shs n LYS 141 Ca 0.00 0.93 -0.31 0.00 -2.02 0.00 0.00 58.31 56.92 1shs n LYS 141 Cb 0.48 -2.66 -0.08 0.00 -0.02 0.00 0.00 35.03 32.75 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 -1.98 2.61 0.83 1.97 1.02 -1.26 -5.11 119.74 117.83 1shs s LYS 142 Ca 0.54 -0.78 -0.11 0.00 0.02 0.00 0.00 55.97 55.64 1shs s LYS 142 Cb -0.48 -2.58 0.09 0.00 -0.52 0.00 0.00 37.83 34.35 1shs s LYS 142 CO 0.63 0.56 1.10 0.20 -0.92 0.00 0.00 175.35 176.91 1shs s GLY 143 N -2.15 1.66 -0.04 -3.33 0.00 -1.26 -5.08 107.32 97.11 1shs s GLY 143 Ca 0.25 0.22 0.01 0.00 0.00 0.00 0.00 44.72 45.19 1shs s GLY 143 CO 0.17 0.62 -0.03 -0.42 0.00 0.00 0.00 173.10 173.44 1shs s ILE 144 N -2.87 0.45 0.15 0.90 1.01 -1.26 -5.15 121.20 114.43 1shs s ILE 144 Ca 0.63 -0.05 -0.06 0.00 0.00 0.00 0.00 60.65 61.16 1shs s ILE 144 Cb -0.18 -0.50 -0.06 0.00 0.01 0.00 0.00 42.46 41.73 1shs s ILE 144 CO 0.57 0.21 0.40 0.20 0.00 0.00 0.00 174.94 176.32 1shs s ASN 145 N 1.06 6.52 0.20 3.58 0.01 -1.26 -5.09 114.94 119.96 1shs s ASN 145 Ca -0.09 0.65 0.06 0.00 -0.71 0.00 0.00 52.86 52.77 1shs s ASN 145 Cb -0.14 -2.11 -0.04 0.00 0.41 0.00 0.00 41.25 39.37 1shs s ASN 145 CO -0.01 0.05 0.14 -0.63 -1.51 0.00 0.00 177.10 175.14 1shs s ILE 146 N -1.65 4.36 0.00 0.60 1.01 -1.26 -5.37 121.20 118.89 1shs s ILE 146 Ca 0.41 -1.27 0.00 0.00 0.00 0.00 0.00 60.65 59.79 1shs s ILE 146 Cb -0.12 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 39.07 1shs s ILE 146 CO 0.23 -0.21 0.00 -1.84 0.00 0.00 0.00 174.94 173.13