#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b4c s LYS 2 N 0.00 1.68 -0.18 1.64 1.02 -1.25 -5.02 119.74 117.62 2b4c s LYS 2 Ca 0.00 -1.01 0.01 0.00 0.02 0.00 0.00 55.97 54.99 2b4c s LYS 2 Cb 0.00 -1.80 0.02 0.00 -0.52 0.00 0.00 37.83 35.53 2b4c s LYS 2 CO 0.00 0.47 -0.20 0.08 -0.92 0.00 0.00 175.35 174.78 2b4c s VAL 3 N -0.76 2.04 -0.15 3.17 1.01 -1.26 -0.97 120.40 123.48 2b4c s VAL 3 Ca 0.10 -0.94 -0.00 0.00 0.00 0.00 0.00 61.98 61.14 2b4c s VAL 3 Cb -0.09 -1.85 0.04 0.00 0.00 0.00 0.00 36.38 34.47 2b4c s VAL 3 CO 0.01 0.53 -0.06 -0.69 0.00 0.00 0.00 175.10 174.89 2b4c s VAL 4 N 1.30 1.12 0.60 2.92 1.01 -0.90 -5.02 120.40 121.43 2b4c s VAL 4 Ca 0.05 -0.55 -0.05 0.00 0.00 0.00 0.00 61.98 61.43 2b4c s VAL 4 Cb -0.13 -1.24 0.02 0.00 0.00 0.00 0.00 36.38 35.03 2b4c s VAL 4 CO -0.13 0.21 0.89 -0.76 0.00 0.00 0.00 175.10 175.31 2b4c s LEU 5 N 1.64 3.19 -0.16 3.92 1.02 -1.26 -2.23 118.68 124.79 2b4c s LEU 5 Ca 0.02 0.55 -0.28 0.00 0.02 0.00 0.00 54.13 54.44 2b4c s LEU 5 Cb -0.14 -3.35 0.07 0.00 0.02 0.00 0.00 46.19 42.79 2b4c s LEU 5 CO -0.08 -1.15 0.71 -0.83 0.02 0.00 0.00 176.35 175.02 2b4c s GLY 6 N -4.35 -0.55 0.29 -3.19 0.00 -1.16 -4.92 107.32 93.43 2b4c s GLY 6 Ca 0.55 1.70 -0.14 0.00 0.00 0.00 0.00 44.72 46.82 2b4c s GLY 6 CO 0.44 1.36 0.69 0.54 0.00 0.00 0.00 173.10 176.13 2b4c s LYS 7 N -0.39 3.99 -0.07 2.90 1.02 -1.26 -1.64 119.74 124.28 2b4c s LYS 7 Ca -0.05 0.61 -0.30 0.00 0.02 0.00 0.00 55.97 56.25 2b4c s LYS 7 Cb -0.03 -2.54 -0.03 0.00 -0.52 0.00 0.00 37.83 34.71 2b4c s LYS 7 CO 0.05 0.23 1.25 0.21 -0.92 0.00 0.00 175.35 176.17 2b4c s LYS 8 N -2.80 4.31 0.00 1.68 2.20 -0.90 -3.44 119.74 120.79 2b4c s LYS 8 Ca 0.51 1.73 0.00 0.00 -0.36 0.00 0.00 55.97 57.84 2b4c s LYS 8 Cb -0.11 -3.61 0.00 0.00 -1.51 0.00 0.00 37.83 32.60 2b4c s LYS 8 CO 0.19 -0.53 0.00 0.41 -0.36 0.00 0.00 175.35 175.06 2b4c n GLY 9 N 3.47 3.04 3.79 5.54 0.00 0.77 -4.93 105.19 116.88 2b4c n GLY 9 Ca 0.12 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.95 2b4c n GLY 9 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b4c s ASP 10 N 0.00 6.17 0.61 1.61 2.15 -1.22 -3.19 116.67 122.79 2b4c s ASP 10 Ca 0.00 2.03 -0.17 0.00 0.43 0.00 0.00 52.55 54.85 2b4c s ASP 10 Cb 0.00 -2.57 -0.03 0.00 -0.30 0.00 0.00 42.92 40.02 2b4c s ASP 10 CO 0.00 -0.90 1.10 0.42 -0.17 0.00 0.00 175.17 175.62 2b4c s THR 11 N -1.87 3.35 0.10 1.71 -4.23 -1.26 -3.96 115.64 109.48 2b4c s THR 11 Ca 0.68 0.69 0.00 0.00 -1.18 0.00 0.00 61.69 61.89 2b4c s THR 11 Cb -0.20 -3.22 -0.04 0.00 1.34 0.00 0.00 72.50 70.38 2b4c s THR 11 CO 0.23 -0.32 -0.02 0.54 -0.54 0.00 0.00 174.62 174.51 2b4c s VAL 12 N -2.19 0.40 -0.06 2.29 0.11 -1.09 -4.95 120.40 114.92 2b4c s VAL 12 Ca 0.68 -1.89 0.01 0.00 -2.93 0.00 0.00 61.98 57.85 2b4c s VAL 12 Cb -0.20 -1.76 0.02 0.00 -1.53 0.00 0.00 36.38 32.90 2b4c s VAL 12 CO 0.36 -0.78 -0.07 -0.70 -3.33 0.00 0.00 175.10 170.58 2b4c s GLU 13 N -3.92 1.10 -0.15 1.54 2.12 -1.26 -1.90 118.70 116.23 2b4c s GLU 13 Ca 0.14 -0.19 -0.04 0.00 0.36 0.00 0.00 54.97 55.25 2b4c s GLU 13 Cb 0.07 -1.05 -0.03 0.00 0.26 0.00 0.00 34.13 33.38 2b4c s GLU 13 CO -0.04 -0.07 -0.03 -0.51 -0.54 0.00 0.00 175.26 174.07 2b4c s LEU 14 N 0.95 3.31 0.23 2.70 1.43 0.49 -4.94 118.68 122.86 2b4c s LEU 14 Ca -0.10 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 52.90 2b4c s LEU 14 Cb -0.15 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2b4c s LEU 14 CO 0.00 0.19 0.43 0.28 0.23 0.00 0.00 176.35 177.48 2b4c s THR 15 N 0.27 5.17 -0.26 5.49 -1.32 -1.26 -0.82 115.64 122.91 2b4c s THR 15 Ca -0.02 -0.36 -0.06 0.00 -1.21 0.00 0.00 61.69 60.04 2b4c s THR 15 Cb -0.14 -3.76 0.13 0.00 -1.51 0.00 0.00 72.50 67.23 2b4c s THR 15 CO 0.03 -0.25 0.52 0.00 -2.21 0.00 0.00 174.62 172.71 2b4c s THR 17 N 2.74 1.38 0.29 0.00 2.01 -1.26 -0.40 115.64 120.39 2b4c s THR 17 Ca 0.04 -0.74 0.09 0.00 0.31 0.00 0.00 61.69 61.39 2b4c s THR 17 Cb -0.13 -1.16 -0.04 0.00 0.01 0.00 0.00 72.50 71.18 2b4c s THR 17 CO -0.17 0.39 0.08 0.00 -0.69 0.00 0.00 174.62 174.23 2b4c s ALA 18 N -0.33 3.34 0.18 7.40 0.00 -1.23 -5.02 121.76 126.10 2b4c s ALA 18 Ca 0.05 -1.66 -0.03 0.00 0.00 0.00 0.00 51.96 50.32 2b4c s ALA 18 Cb -0.08 -0.86 0.06 0.00 0.00 0.00 0.00 23.12 22.24 2b4c s ALA 18 CO -0.00 0.19 1.45 0.66 0.00 0.00 0.00 175.76 178.06 2b4c h SER 19 N 1.71 0.58 -3.75 0.00 4.64 -1.98 -3.45 113.55 111.31 2b4c h SER 19 Ca -0.45 -0.35 -0.51 0.00 -0.47 0.00 0.00 61.79 60.01 2b4c h SER 19 Cb 1.25 -0.17 0.03 0.00 -0.31 0.00 0.00 62.40 63.19 2b4c h SER 19 CO 0.61 1.08 0.53 -1.10 -0.87 0.00 0.00 176.83 177.08 2b4c s GLN 20 N -3.79 4.55 -0.02 4.77 -0.21 -1.26 -4.93 119.66 118.77 2b4c s GLN 20 Ca -0.07 1.90 0.09 0.00 0.02 0.00 0.00 55.36 57.30 2b4c s GLN 20 Cb 0.11 -3.18 0.30 0.00 1.00 0.00 0.00 33.01 31.24 2b4c s GLN 20 CO 0.85 0.07 1.20 0.36 -2.12 0.00 0.00 175.29 175.64 2b4c n LYS 21 N 1.40 1.94 0.00 2.91 2.85 -1.26 -4.57 118.16 121.43 2b4c n LYS 21 Ca 0.00 -1.20 0.00 0.00 -1.05 0.00 0.00 58.31 56.06 2b4c n LYS 21 Cb 0.44 -1.37 0.00 0.00 -0.65 0.00 0.00 35.03 33.45 2b4c n LYS 21 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2b4c n LYS 22 N 0.41 3.45 -3.37 -1.58 5.02 -1.26 -4.14 118.16 116.69 2b4c n LYS 22 Ca 0.11 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.19 2b4c n LYS 22 Cb 0.35 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 35.27 2b4c n LYS 22 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2b4c s SER 23 N -1.00 1.60 0.44 4.39 1.04 -1.26 -3.27 113.70 115.64 2b4c s SER 23 Ca 0.00 -1.97 0.04 0.00 0.48 0.00 0.00 55.95 54.50 2b4c s SER 23 Cb 0.00 0.21 0.01 0.00 0.10 0.00 0.00 66.02 66.34 2b4c s SER 23 CO 0.00 -0.25 0.62 -0.51 0.98 0.00 0.00 173.24 174.08 2b4c s ILE 24 N 1.11 3.40 0.30 -1.02 2.07 -1.26 -4.96 121.20 120.83 2b4c s ILE 24 Ca 0.20 -0.81 -0.29 0.00 -1.41 0.00 0.00 60.65 58.33 2b4c s ILE 24 Cb -0.15 -3.20 -0.11 0.00 0.13 0.00 0.00 42.46 39.13 2b4c s ILE 24 CO -0.04 -0.11 1.46 -1.10 -1.91 0.00 0.00 174.94 173.24 2b4c s GLN 25 N -4.45 4.22 0.02 3.50 -0.21 -1.26 -4.98 119.66 116.50 2b4c s GLN 25 Ca 0.52 2.40 -0.00 0.00 0.02 0.00 0.00 55.36 58.29 2b4c s GLN 25 Cb -0.10 -3.06 -0.02 0.00 1.00 0.00 0.00 33.01 30.83 2b4c s GLN 25 CO 0.35 -0.45 -0.02 -0.59 -2.12 0.00 0.00 175.29 172.46 2b4c s PHE 26 N -0.41 0.29 -0.01 0.91 -0.71 -1.26 -4.59 117.98 112.20 2b4c s PHE 26 Ca 0.57 -0.59 -0.01 0.00 -1.04 0.00 0.00 56.93 55.86 2b4c s PHE 26 Cb -0.44 -0.21 0.00 0.00 -1.21 0.00 0.00 43.02 41.16 2b4c s PHE 26 CO 0.50 -0.22 0.02 -1.01 -1.34 0.00 0.00 175.22 173.17 2b4c s HIS 27 N -1.81 -0.01 -0.14 3.49 3.76 -1.20 -2.62 115.29 116.77 2b4c s HIS 27 Ca -0.13 0.04 -0.03 0.00 -0.15 0.00 0.00 55.06 54.79 2b4c s HIS 27 Cb -0.07 0.00 -0.03 0.00 1.11 0.00 0.00 32.58 33.59 2b4c s HIS 27 CO -0.02 -0.02 -0.04 -1.58 -0.85 0.00 0.00 174.74 172.22 2b4c s TRP 28 N -0.06 3.01 0.06 1.40 0.52 0.13 -1.08 118.94 122.93 2b4c s TRP 28 Ca -0.01 -0.23 0.01 0.00 0.02 0.00 0.00 56.10 55.89 2b4c s TRP 28 Cb -0.01 -1.90 -0.04 0.00 -1.15 0.00 0.00 33.47 30.37 2b4c s TRP 28 CO 0.00 0.05 -0.05 0.15 0.02 0.00 0.00 176.95 177.12 2b4c s LYS 29 N 0.09 0.65 0.00 4.98 1.02 -1.15 -1.65 119.74 123.68 2b4c s LYS 29 Ca -0.01 -1.13 0.00 0.00 0.02 0.00 0.00 55.97 54.86 2b4c s LYS 29 Cb -0.14 -0.03 0.00 0.00 -0.52 0.00 0.00 37.83 37.14 2b4c s LYS 29 CO 0.03 -0.04 0.00 0.27 -0.92 0.00 0.00 175.35 174.68 2b4c n ASN 30 N 0.42 0.00 0.21 2.83 0.23 -1.20 -1.36 115.26 116.40 2b4c n ASN 30 Ca -0.16 -0.88 0.06 0.00 -0.53 0.00 0.00 54.58 53.07 2b4c n ASN 30 Cb 0.59 0.00 0.47 0.00 -2.08 0.00 0.00 39.78 38.76 2b4c n ASN 30 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2b4c h SER 31 N 0.00 0.00 0.02 0.53 4.64 -1.16 -0.16 113.55 117.42 2b4c h SER 31 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b4c h SER 31 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2b4c h SER 31 CO 0.00 0.27 -0.02 0.59 -0.87 0.00 0.00 176.83 176.80 2b4c n ASN 32 N -4.02 1.26 -3.29 4.97 3.02 -1.26 -4.95 115.26 110.98 2b4c n ASN 32 Ca -0.02 -1.36 -0.16 0.00 -0.03 0.00 0.00 54.58 53.01 2b4c n ASN 32 Cb 0.34 0.01 0.08 0.00 -0.61 0.00 0.00 39.78 39.60 2b4c n ASN 32 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2b4c n GLN 33 N -0.06 -5.44 -4.33 3.52 6.02 -0.07 -5.03 117.38 111.98 2b4c n GLN 33 Ca 0.19 0.82 -0.35 0.00 -0.01 0.00 0.00 57.00 57.65 2b4c n GLN 33 Cb 0.32 -5.71 -0.10 0.00 1.02 0.00 0.00 30.24 25.78 2b4c n GLN 33 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2b4c s ILE 34 N -3.35 4.34 0.11 5.09 1.01 -1.26 -4.81 121.20 122.33 2b4c s ILE 34 Ca 0.10 -0.23 -0.32 0.00 0.00 0.00 0.00 60.65 60.20 2b4c s ILE 34 Cb -0.01 -2.85 -0.12 0.00 0.01 0.00 0.00 42.46 39.49 2b4c s ILE 34 CO 0.70 0.58 1.77 0.29 0.00 0.00 0.00 174.94 178.29 2b4c n LYS 35 N 2.43 2.56 -0.04 2.79 5.02 -1.26 -3.22 118.16 126.42 2b4c n LYS 35 Ca -0.18 0.93 -0.09 0.00 -2.02 0.00 0.00 58.31 56.94 2b4c n LYS 35 Cb 0.53 -2.78 -0.03 0.00 -0.02 0.00 0.00 35.03 32.73 2b4c n LYS 35 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2b4c n ILE 36 N 4.40 1.11 -3.65 -0.18 2.08 -0.66 -3.26 119.36 119.20 2b4c n ILE 36 Ca 0.18 0.07 -0.14 0.00 0.56 0.00 0.00 62.75 63.42 2b4c n ILE 36 Cb 0.34 -1.85 -0.07 0.00 -0.75 0.00 0.00 39.64 37.31 2b4c n ILE 36 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 2b4c s LEU 37 N -7.15 0.25 0.00 1.39 0.20 -1.21 -0.55 118.68 111.61 2b4c s LEU 37 Ca -0.17 0.21 0.00 0.00 0.69 0.00 0.00 54.13 54.86 2b4c s LEU 37 Cb 0.04 1.81 0.00 0.00 -0.43 0.00 0.00 46.19 47.62 2b4c s LEU 37 CO 0.23 -0.59 0.00 0.61 -0.29 0.00 0.00 176.35 176.31 2b4c n GLY 38 N 0.83 1.78 3.18 7.98 0.00 0.58 0.22 105.19 119.75 2b4c n GLY 38 Ca -0.20 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.72 2b4c n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b4c s ASN 39 N -0.94 -0.19 -0.70 1.61 4.22 -1.08 -1.20 114.94 116.67 2b4c s ASN 39 Ca 0.00 0.22 0.04 0.00 -2.14 0.00 0.00 52.86 50.99 2b4c s ASN 39 Cb 0.00 0.40 0.27 0.00 1.28 0.00 0.00 41.25 43.20 2b4c s ASN 39 CO 0.00 -0.28 0.91 0.00 -2.04 0.00 0.00 177.10 175.69 2b4c n GLN 40 N 2.02 3.00 0.00 3.55 1.13 -0.01 -4.49 117.38 122.58 2b4c n GLN 40 Ca -0.18 -4.69 0.00 0.00 -1.94 0.00 0.00 57.00 50.19 2b4c n GLN 40 Cb 0.57 -2.30 0.00 0.00 0.11 0.00 0.00 30.24 28.62 2b4c n GLN 40 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2b4c n GLY 41 N 0.71 2.15 0.33 1.08 0.00 -1.26 -3.44 105.19 104.77 2b4c n GLY 41 Ca 0.30 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.25 2b4c n GLY 41 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2b4c n SER 42 N 5.05 1.81 -4.17 1.61 7.64 -1.26 -4.98 113.62 119.33 2b4c n SER 42 Ca 0.00 -3.09 -0.24 0.00 1.01 0.00 0.00 58.87 56.56 2b4c n SER 42 Cb 0.00 -0.42 -0.15 0.00 -1.01 0.00 0.00 64.21 62.64 2b4c n SER 42 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2b4c s PHE 43 N -2.43 1.49 -0.32 1.43 0.08 -1.22 -5.12 117.98 111.89 2b4c s PHE 43 Ca 0.29 -0.31 -0.18 0.00 0.12 0.00 0.00 56.93 56.86 2b4c s PHE 43 Cb 0.27 -0.93 -0.01 0.00 -0.57 0.00 0.00 43.02 41.77 2b4c s PHE 43 CO -0.01 0.01 0.51 -1.17 -0.10 0.00 0.00 175.22 174.46 2b4c s LEU 44 N -0.67 4.22 -0.16 -0.37 2.96 -1.26 -0.83 118.68 122.57 2b4c s LEU 44 Ca 0.06 0.18 -0.03 0.00 -0.22 0.00 0.00 54.13 54.11 2b4c s LEU 44 Cb -0.07 -2.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.99 2b4c s LEU 44 CO 0.00 -0.40 -0.04 0.42 -1.32 0.00 0.00 176.35 175.00 2b4c s THR 45 N 2.36 3.75 0.01 3.68 -4.23 -0.34 -4.98 115.64 115.89 2b4c s THR 45 Ca 0.20 -0.40 -0.06 0.00 -1.18 0.00 0.00 61.69 60.24 2b4c s THR 45 Cb -0.15 -2.65 -0.05 0.00 1.34 0.00 0.00 72.50 70.99 2b4c s THR 45 CO 0.12 0.48 0.26 -0.54 -0.54 0.00 0.00 174.62 174.40 2b4c s LYS 46 N 0.55 3.57 0.37 3.99 1.02 -1.26 -0.31 119.74 127.66 2b4c s LYS 46 Ca -0.03 -0.10 0.04 0.00 0.02 0.00 0.00 55.97 55.90 2b4c s LYS 46 Cb -0.14 -3.08 -0.01 0.00 -0.52 0.00 0.00 37.83 34.08 2b4c s LYS 46 CO 0.03 0.65 0.54 0.20 -0.92 0.00 0.00 175.35 175.84 2b4c s GLY 47 N -1.74 1.57 -1.10 -3.33 0.00 0.28 -4.92 107.32 98.08 2b4c s GLY 47 Ca 0.28 -1.31 -0.21 0.00 0.00 0.00 0.00 44.72 43.48 2b4c s GLY 47 CO 0.16 -1.20 1.92 -1.05 0.00 0.00 0.00 173.10 172.94 2b4c n PRO 48 N -1.79 1.91 -4.32 2.90 -0.02 -1.20 -4.52 135.00 127.96 2b4c n PRO 48 Ca 0.00 -2.43 -0.19 0.00 -2.02 0.00 0.00 63.50 58.86 2b4c n PRO 48 Cb 0.58 -3.43 -0.08 0.00 -0.02 0.00 0.00 33.50 30.54 2b4c n PRO 48 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2b4c s SER 49 N 5.48 1.66 0.49 2.55 1.04 -1.26 -4.84 113.70 118.82 2b4c s SER 49 Ca 0.62 -1.68 0.28 0.00 0.48 0.00 0.00 55.95 55.65 2b4c s SER 49 Cb 0.05 0.51 0.87 0.00 0.10 0.00 0.00 66.02 67.55 2b4c s SER 49 CO 0.11 -0.99 1.80 0.11 0.98 0.00 0.00 173.24 175.25 2b4c h LYS 50 N 2.15 0.00 0.00 4.02 1.57 -1.94 -2.92 116.57 119.44 2b4c h LYS 50 Ca -0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2b4c h LYS 50 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2b4c h LYS 50 CO 0.44 0.03 -0.28 -0.07 -0.57 0.00 0.00 179.45 178.99 2b4c h LEU 51 N 0.00 0.00 -0.95 2.94 4.07 -1.96 -3.38 115.31 116.04 2b4c h LEU 51 Ca -0.00 -0.03 0.36 0.00 0.08 0.00 0.00 57.88 58.29 2b4c h LEU 51 Cb 0.76 0.00 -0.17 0.00 1.08 0.00 0.00 40.66 42.33 2b4c h LEU 51 CO 0.00 0.02 0.38 -3.20 -1.08 0.00 0.00 178.44 174.56 2b4c n ASN 52 N -2.67 0.21 0.12 -0.43 2.85 -1.11 0.25 115.26 114.49 2b4c n ASN 52 Ca 0.04 1.58 -0.00 0.00 -0.11 0.00 0.00 54.58 56.08 2b4c n ASN 52 Cb 0.50 -0.72 0.06 0.00 1.24 0.00 0.00 39.78 40.85 2b4c n ASN 52 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 2b4c h ASP 53 N 0.00 0.00 -0.05 1.20 3.32 -1.82 -3.34 116.42 115.73 2b4c h ASP 53 Ca 0.74 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.79 2b4c h ASP 53 Cb 1.88 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.43 2b4c h ASP 53 CO -0.77 0.64 -0.05 0.54 -1.72 0.00 0.00 179.24 177.88 2b4c n ARG 54 N -3.38 1.60 -5.03 3.56 1.74 0.14 -5.03 116.66 110.26 2b4c n ARG 54 Ca 0.01 -2.71 -0.31 0.00 -0.77 0.00 0.00 57.85 54.06 2b4c n ARG 54 Cb 0.74 -1.58 -0.14 0.00 -1.02 0.00 0.00 32.46 30.46 2b4c n ARG 54 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2b4c s ALA 55 N -2.92 2.38 0.34 7.54 0.00 0.72 -1.31 121.76 128.51 2b4c s ALA 55 Ca 0.35 -1.12 -0.12 0.00 0.00 0.00 0.00 51.96 51.07 2b4c s ALA 55 Cb 0.30 -0.68 0.05 0.00 0.00 0.00 0.00 23.12 22.79 2b4c s ALA 55 CO 0.03 0.54 0.67 -3.47 0.00 0.00 0.00 175.76 173.53 2b4c n ASP 56 N 2.16 -1.95 -3.67 0.00 2.03 -1.08 -4.92 116.55 109.12 2b4c n ASP 56 Ca -0.16 -2.40 -0.12 0.00 0.52 0.00 0.00 54.79 52.63 2b4c n ASP 56 Cb 0.52 3.26 -0.09 0.00 -0.72 0.00 0.00 41.12 44.09 2b4c n ASP 56 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2b4c s SER 57 N -2.80 -0.65 -0.30 1.67 0.15 -1.26 -1.55 113.70 108.96 2b4c s SER 57 Ca 0.15 1.19 -0.29 0.00 0.70 0.00 0.00 55.95 57.69 2b4c s SER 57 Cb -0.04 1.16 -0.01 0.00 -1.71 0.00 0.00 66.02 65.42 2b4c s SER 57 CO 0.11 -0.21 1.53 -0.60 1.20 0.00 0.00 173.24 175.27 2b4c s ARG 58 N 0.71 3.69 0.58 5.44 6.06 -1.26 -4.87 118.95 129.30 2b4c s ARG 58 Ca -0.03 1.36 0.37 0.00 -2.50 0.00 0.00 55.73 54.93 2b4c s ARG 58 Cb -0.05 -4.02 1.78 0.00 0.06 0.00 0.00 34.95 32.72 2b4c s ARG 58 CO -0.05 -1.41 2.12 0.00 -2.50 0.00 0.00 175.30 173.46 2b4c h ARG 59 N 10.75 0.00 -0.36 5.12 3.08 -1.99 -3.19 114.38 127.79 2b4c h ARG 59 Ca -0.30 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.76 2b4c h ARG 59 Cb 1.13 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.16 2b4c h ARG 59 CO 1.03 0.00 0.22 0.66 -1.07 0.00 0.00 179.97 180.81 2b4c h SER 60 N 0.00 0.36 0.84 7.04 4.64 -1.98 -2.77 113.55 121.69 2b4c h SER 60 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b4c h SER 60 Cb 0.29 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2b4c h SER 60 CO 0.00 0.26 0.00 -0.07 -0.87 0.00 0.00 176.83 176.15 2b4c h LEU 61 N 0.45 0.00 -0.06 5.97 3.38 -1.82 -3.33 115.31 119.90 2b4c h LEU 61 Ca 0.14 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.14 2b4c h LEU 61 Cb -0.01 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 2b4c h LEU 61 CO -0.06 0.00 -0.43 -0.50 0.09 0.00 0.00 178.44 177.54 2b4c h TRP 62 N 0.00 -1.24 0.00 1.13 4.06 -1.48 -1.21 115.95 117.21 2b4c h TRP 62 Ca 0.00 0.04 0.00 0.00 2.06 0.00 0.00 58.89 60.99 2b4c h TRP 62 Cb 0.42 0.55 0.00 0.00 -1.00 0.00 0.00 29.16 29.13 2b4c h TRP 62 CO 0.00 -0.50 0.00 -0.40 -3.56 0.00 0.00 178.44 173.98 2b4c n ASP 63 N -5.45 0.19 0.06 -3.49 5.68 -1.25 -2.37 116.55 109.92 2b4c n ASP 63 Ca -0.05 0.56 -0.16 0.00 -0.50 0.00 0.00 54.79 54.64 2b4c n ASP 63 Cb 0.37 -0.59 -0.14 0.00 -1.14 0.00 0.00 41.12 39.61 2b4c n ASP 63 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 2b4c h GLN 64 N 0.00 0.23 0.00 0.11 4.15 -1.40 -3.40 115.11 114.80 2b4c h GLN 64 Ca 0.00 -0.39 0.00 0.00 0.77 0.00 0.00 58.65 59.03 2b4c h GLN 64 Cb 0.21 0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.04 2b4c h GLN 64 CO 0.00 1.08 0.00 0.41 -1.93 0.00 0.00 178.83 178.39 2b4c n GLY 65 N 1.65 3.37 3.94 2.39 0.00 -0.93 -4.45 105.19 111.15 2b4c n GLY 65 Ca -0.16 -0.47 -0.26 0.00 0.00 0.00 0.00 46.02 45.13 2b4c n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b4c s ASN 66 N 0.00 6.36 -0.21 1.61 2.20 -1.22 -3.55 114.94 120.13 2b4c s ASN 66 Ca 0.00 0.30 -0.01 0.00 -0.94 0.00 0.00 52.86 52.21 2b4c s ASN 66 Cb 0.00 -1.97 0.06 0.00 -2.00 0.00 0.00 41.25 37.34 2b4c s ASN 66 CO 0.00 -0.02 -0.00 -0.36 -2.94 0.00 0.00 177.10 173.78 2b4c s PHE 67 N -1.85 1.55 1.01 1.54 0.40 0.46 -3.32 117.98 117.77 2b4c s PHE 67 Ca 0.37 -1.19 -0.17 0.00 -0.60 0.00 0.00 56.93 55.34 2b4c s PHE 67 Cb -0.11 -1.24 0.24 0.00 0.51 0.00 0.00 43.02 42.42 2b4c s PHE 67 CO 0.29 -0.67 1.13 -0.35 0.70 0.00 0.00 175.22 176.33 2b4c n PRO 68 N 4.90 -1.98 -3.19 0.24 -0.04 -1.26 -3.18 135.00 130.49 2b4c n PRO 68 Ca -0.10 -1.77 0.01 0.00 -0.04 0.00 0.00 63.50 61.60 2b4c n PRO 68 Cb 0.46 -1.37 -0.01 0.00 -0.04 0.00 0.00 33.50 32.54 2b4c n PRO 68 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2b4c s LEU 69 N 0.00 -1.47 0.17 1.53 1.98 -0.00 -4.74 118.68 116.14 2b4c s LEU 69 Ca 0.68 -0.20 -0.03 0.00 -2.89 0.00 0.00 54.13 51.69 2b4c s LEU 69 Cb -0.04 1.88 -0.05 0.00 0.66 0.00 0.00 46.19 48.64 2b4c s LEU 69 CO 0.49 -0.27 0.39 0.27 -1.89 0.00 0.00 176.35 175.34 2b4c s ILE 70 N 2.48 5.18 -0.24 6.68 -4.36 -0.59 -0.38 121.20 129.96 2b4c s ILE 70 Ca 0.12 -0.12 -0.03 0.00 -0.26 0.00 0.00 60.65 60.36 2b4c s ILE 70 Cb -0.09 -3.67 0.08 0.00 1.25 0.00 0.00 42.46 40.03 2b4c s ILE 70 CO -0.20 -0.06 0.09 -0.63 0.24 0.00 0.00 174.94 174.38 2b4c s ILE 71 N -1.76 0.33 0.52 8.37 -1.09 -0.80 -2.62 121.20 124.16 2b4c s ILE 71 Ca 0.40 -0.74 -0.05 0.00 -2.23 0.00 0.00 60.65 58.03 2b4c s ILE 71 Cb -0.12 -1.08 -0.02 0.00 -1.58 0.00 0.00 42.46 39.66 2b4c s ILE 71 CO 0.27 -0.48 0.83 -1.59 -1.23 0.00 0.00 174.94 172.73 2b4c s LYS 72 N 1.92 3.28 -1.49 2.79 -2.85 -0.43 -2.67 119.74 120.29 2b4c s LYS 72 Ca 0.05 0.09 -0.08 0.00 -1.00 0.00 0.00 55.97 55.03 2b4c s LYS 72 Cb -0.17 -2.34 0.06 0.00 -2.06 0.00 0.00 37.83 33.32 2b4c s LYS 72 CO -0.21 -0.41 0.72 0.09 0.10 0.00 0.00 175.35 175.64 2b4c n ASN 73 N -2.38 -2.43 -4.52 0.03 3.02 -1.21 -4.82 115.26 102.95 2b4c n ASN 73 Ca 0.02 -0.91 -0.45 0.00 -0.03 0.00 0.00 54.58 53.21 2b4c n ASN 73 Cb 0.56 -3.42 -0.02 0.00 -0.61 0.00 0.00 39.78 36.30 2b4c n ASN 73 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2b4c n LEU 74 N -4.46 0.67 -4.18 3.41 -0.00 -1.19 -4.65 117.00 106.61 2b4c n LEU 74 Ca -0.12 1.13 -0.12 0.00 -0.00 0.00 0.00 56.01 56.89 2b4c n LEU 74 Cb 0.60 -1.17 -0.10 0.00 -0.00 0.00 0.00 43.42 42.75 2b4c n LEU 74 CO 0.76 -2.07 -0.40 -0.54 -0.00 0.00 0.00 177.39 175.15 2b4c s LYS 75 N -1.41 0.85 0.48 1.96 1.02 -1.26 -0.16 119.74 121.22 2b4c s LYS 75 Ca 0.61 -1.28 0.24 0.00 0.02 0.00 0.00 55.97 55.56 2b4c s LYS 75 Cb -0.75 -0.33 1.19 0.00 -0.52 0.00 0.00 37.83 37.42 2b4c s LYS 75 CO 0.59 0.02 1.97 0.82 -0.92 0.00 0.00 175.35 177.82 2b4c h ILE 76 N 3.14 0.68 0.00 2.17 5.03 -1.94 -2.45 117.51 124.15 2b4c h ILE 76 Ca -0.36 -0.81 0.00 0.00 -0.12 0.00 0.00 64.86 63.57 2b4c h ILE 76 Cb 1.18 1.51 0.00 0.00 -3.03 0.00 0.00 36.82 36.48 2b4c h ILE 76 CO 0.61 0.19 0.00 -1.84 -0.68 0.00 0.00 178.15 176.42 2b4c n GLU 77 N -3.65 0.01 0.00 2.37 0.28 -1.26 -2.36 120.64 116.03 2b4c n GLU 77 Ca -0.01 0.26 0.13 0.00 -0.16 0.00 0.00 57.16 57.37 2b4c n GLU 77 Cb 0.31 -1.53 0.38 0.00 1.43 0.00 0.00 31.44 32.04 2b4c n GLU 77 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2b4c n ASP 78 N -1.55 0.77 -4.62 -1.84 8.00 -0.92 -4.87 116.55 111.51 2b4c n ASP 78 Ca 0.03 -0.62 -0.43 0.00 0.71 0.00 0.00 54.79 54.48 2b4c n ASP 78 Cb 0.18 0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.37 2b4c n ASP 78 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2b4c s SER 79 N -2.65 5.89 0.34 -2.24 0.15 -0.99 -4.91 113.70 109.28 2b4c s SER 79 Ca 0.21 2.00 -0.18 0.00 0.70 0.00 0.00 55.95 58.69 2b4c s SER 79 Cb 0.19 -2.52 0.05 0.00 -1.71 0.00 0.00 66.02 62.03 2b4c s SER 79 CO 0.56 -1.60 0.79 -0.62 1.20 0.00 0.00 173.24 173.58 2b4c s ASP 80 N 6.48 -0.07 -0.17 5.45 2.15 -0.98 -5.00 116.67 124.53 2b4c s ASP 80 Ca 0.91 -0.96 -0.09 0.00 0.43 0.00 0.00 52.55 52.84 2b4c s ASP 80 Cb -0.33 0.79 -0.05 0.00 -0.30 0.00 0.00 42.92 43.03 2b4c s ASP 80 CO 0.36 -1.54 0.14 -0.89 -0.17 0.00 0.00 175.17 173.07 2b4c s THR 81 N -2.74 5.44 0.26 1.71 2.01 -1.26 -0.90 115.64 120.15 2b4c s THR 81 Ca 0.15 0.21 0.12 0.00 0.31 0.00 0.00 61.69 62.47 2b4c s THR 81 Cb -0.05 -3.45 -0.05 0.00 0.01 0.00 0.00 72.50 68.96 2b4c s THR 81 CO 0.10 0.50 -0.19 -0.31 -0.69 0.00 0.00 174.62 174.03 2b4c s TYR 82 N -0.12 2.34 0.22 4.92 1.51 0.75 -0.49 117.35 126.48 2b4c s TYR 82 Ca 0.11 -0.32 0.02 0.00 -1.01 0.00 0.00 57.07 55.87 2b4c s TYR 82 Cb -0.11 -1.05 -0.05 0.00 -0.11 0.00 0.00 41.96 40.63 2b4c s TYR 82 CO 0.00 0.66 0.02 0.96 -1.11 0.00 0.00 175.55 176.08 2b4c s ILE 83 N -2.29 0.81 -0.04 2.71 -5.25 -0.46 -0.30 121.20 116.37 2b4c s ILE 83 Ca 0.28 -2.01 -0.00 0.00 -0.99 0.00 0.00 60.65 57.93 2b4c s ILE 83 Cb -0.06 -2.34 0.03 0.00 2.95 0.00 0.00 42.46 43.04 2b4c s ILE 83 CO 0.14 -0.30 0.02 0.00 -1.79 0.00 0.00 174.94 173.01 2b4c s GLU 85 N 1.47 3.38 -0.01 0.00 2.02 -0.24 -2.36 118.70 122.96 2b4c s GLU 85 Ca -0.04 -2.12 0.00 0.00 0.02 0.00 0.00 54.97 52.84 2b4c s GLU 85 Cb -0.13 -4.41 0.01 0.00 0.10 0.00 0.00 34.13 29.70 2b4c s GLU 85 CO -0.03 -1.35 -0.01 0.54 0.02 0.00 0.00 175.26 174.44 2b4c s VAL 86 N 0.91 0.12 -1.43 2.63 0.11 -1.11 -3.22 120.40 118.41 2b4c s VAL 86 Ca 0.14 -0.00 -0.10 0.00 -2.93 0.00 0.00 61.98 59.09 2b4c s VAL 86 Cb -0.17 -0.15 0.06 0.00 -1.53 0.00 0.00 36.38 34.60 2b4c s VAL 86 CO -0.04 0.07 0.68 -0.62 -3.33 0.00 0.00 175.10 171.86 2b4c n GLU 87 N 3.43 -4.40 -2.01 1.54 1.02 -1.26 -0.80 120.64 118.16 2b4c n GLU 87 Ca -0.18 0.60 -0.19 0.00 -0.02 0.00 0.00 57.16 57.37 2b4c n GLU 87 Cb 0.56 -5.41 -0.04 0.00 -0.02 0.00 0.00 31.44 26.53 2b4c n GLU 87 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2b4c n ASP 88 N -2.52 -5.45 -4.57 1.62 8.00 -1.26 -4.99 116.55 107.38 2b4c n ASP 88 Ca -0.01 0.20 -0.25 0.00 0.71 0.00 0.00 54.79 55.43 2b4c n ASP 88 Cb 0.55 -4.56 -0.09 0.00 -0.02 0.00 0.00 41.12 37.01 2b4c n ASP 88 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2b4c s GLN 89 N -4.38 2.05 -0.50 -1.24 -0.21 0.02 -5.11 119.66 110.29 2b4c s GLN 89 Ca 0.00 -1.40 0.04 0.00 0.02 0.00 0.00 55.36 54.02 2b4c s GLN 89 Cb 0.00 -2.09 0.13 0.00 1.00 0.00 0.00 33.01 32.05 2b4c s GLN 89 CO 0.00 0.40 0.25 0.15 -2.12 0.00 0.00 175.29 173.97 2b4c s LYS 90 N -3.17 1.88 -0.54 2.91 1.02 -1.26 -2.73 119.74 117.85 2b4c s LYS 90 Ca 0.27 -2.53 -0.28 0.00 0.02 0.00 0.00 55.97 53.45 2b4c s LYS 90 Cb -0.07 -3.20 0.02 0.00 -0.52 0.00 0.00 37.83 34.05 2b4c s LYS 90 CO 0.16 -1.11 1.32 -1.21 -0.92 0.00 0.00 175.35 173.59 2b4c s GLU 91 N -0.18 3.45 -0.01 1.68 2.02 -0.99 -4.81 118.70 119.85 2b4c s GLU 91 Ca 0.17 0.47 -0.15 0.00 0.02 0.00 0.00 54.97 55.48 2b4c s GLU 91 Cb -0.26 -4.05 -0.06 0.00 0.10 0.00 0.00 34.13 29.87 2b4c s GLU 91 CO -0.00 -1.75 0.42 -1.21 0.02 0.00 0.00 175.26 172.74 2b4c s GLU 92 N 5.14 3.98 -0.15 1.61 2.02 -1.26 -1.86 118.70 128.17 2b4c s GLU 92 Ca 0.50 0.41 -0.06 0.00 0.02 0.00 0.00 54.97 55.85 2b4c s GLU 92 Cb -0.10 -3.25 0.07 0.00 0.10 0.00 0.00 34.13 30.95 2b4c s GLU 92 CO 0.27 0.62 0.33 0.54 0.02 0.00 0.00 175.26 177.04 2b4c s VAL 93 N -0.86 -0.43 -0.18 2.63 0.11 0.59 -3.69 120.40 118.58 2b4c s VAL 93 Ca 0.24 0.21 -0.21 0.00 -2.93 0.00 0.00 61.98 59.29 2b4c s VAL 93 Cb -0.16 -0.53 -0.03 0.00 -1.53 0.00 0.00 36.38 34.13 2b4c s VAL 93 CO 0.13 0.09 0.63 -1.58 -3.33 0.00 0.00 175.10 171.04 2b4c s GLN 94 N 2.29 4.25 -0.26 1.54 2.00 -0.14 -0.18 119.66 129.16 2b4c s GLN 94 Ca -0.02 0.64 -0.08 0.00 -2.00 0.00 0.00 55.36 53.91 2b4c s GLN 94 Cb -0.12 -3.55 -0.03 0.00 0.80 0.00 0.00 33.01 30.11 2b4c s GLN 94 CO -0.10 -0.18 0.09 -1.17 -0.50 0.00 0.00 175.29 173.42 2b4c s LEU 95 N 1.71 3.54 -0.28 3.68 2.96 -0.08 -2.12 118.68 128.10 2b4c s LEU 95 Ca 0.30 -0.21 0.03 0.00 -0.22 0.00 0.00 54.13 54.03 2b4c s LEU 95 Cb -0.16 -1.95 0.07 0.00 0.50 0.00 0.00 46.19 44.65 2b4c s LEU 95 CO 0.11 -0.05 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.27 2b4c s LEU 96 N 1.63 3.76 -0.07 -0.68 1.43 -0.95 -2.32 118.68 121.49 2b4c s LEU 96 Ca 0.06 -1.59 -0.01 0.00 -1.03 0.00 0.00 54.13 51.56 2b4c s LEU 96 Cb -0.15 -1.56 -0.03 0.00 0.03 0.00 0.00 46.19 44.48 2b4c s LEU 96 CO 0.04 -0.24 -0.01 0.68 0.23 0.00 0.00 176.35 177.06 2b4c s VAL 97 N 1.06 4.21 0.33 -1.59 -7.23 -1.26 -3.00 120.40 112.92 2b4c s VAL 97 Ca -0.04 -0.32 0.06 0.00 -1.81 0.00 0.00 61.98 59.87 2b4c s VAL 97 Cb -0.20 -2.78 -0.07 0.00 0.56 0.00 0.00 36.38 33.90 2b4c s VAL 97 CO -0.06 0.58 0.01 -0.36 -0.31 0.00 0.00 175.10 174.96 2b4c s PHE 98 N -0.90 2.09 0.20 2.82 0.40 -0.65 -4.63 117.98 117.30 2b4c s PHE 98 Ca 0.14 -0.80 -0.08 0.00 -0.60 0.00 0.00 56.93 55.59 2b4c s PHE 98 Cb -0.11 -1.34 -0.02 0.00 0.51 0.00 0.00 43.02 42.06 2b4c s PHE 98 CO 0.03 0.21 0.30 0.20 0.70 0.00 0.00 175.22 176.65 2b4c s GLY 99 N -3.52 0.74 -0.03 4.36 0.00 -1.16 -2.13 107.32 105.58 2b4c s GLY 99 Ca 0.34 -1.10 0.03 0.00 0.00 0.00 0.00 44.72 43.99 2b4c s GLY 99 CO 0.15 -0.93 -0.11 -2.27 0.00 0.00 0.00 173.10 169.94 2b4c s LEU 100 N -3.03 1.85 -0.04 0.66 2.96 -1.26 -1.37 118.68 118.45 2b4c s LEU 100 Ca 0.24 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 53.94 2b4c s LEU 100 Cb 0.03 -0.65 0.02 0.00 0.50 0.00 0.00 46.19 46.10 2b4c s LEU 100 CO 0.05 0.10 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.25 2b4c s THR 101 N 0.08 0.49 -0.34 3.68 2.01 -0.63 -4.94 115.64 116.00 2b4c s THR 101 Ca -0.02 -0.12 -0.15 0.00 0.31 0.00 0.00 61.69 61.72 2b4c s THR 101 Cb -0.08 -0.52 -0.01 0.00 0.01 0.00 0.00 72.50 71.90 2b4c s THR 101 CO 0.01 0.21 0.34 0.00 -0.69 0.00 0.00 174.62 174.48 2b4c s ALA 102 N 0.81 3.50 0.03 7.40 0.00 -1.26 -1.78 121.76 130.46 2b4c s ALA 102 Ca -0.10 -1.23 -0.15 0.00 0.00 0.00 0.00 51.96 50.47 2b4c s ALA 102 Cb -0.13 -2.79 -0.35 0.00 0.00 0.00 0.00 23.12 19.85 2b4c s ALA 102 CO 0.00 -1.04 0.99 -0.91 0.00 0.00 0.00 175.76 174.80 2b4c h ASN 103 N 8.46 0.83 -4.24 0.00 2.35 -1.88 -3.46 115.58 117.64 2b4c h ASN 103 Ca -0.30 -0.90 -0.51 0.00 -0.55 0.00 0.00 56.30 54.03 2b4c h ASN 103 Cb 1.15 -0.27 0.13 0.00 0.05 0.00 0.00 38.32 39.37 2b4c h ASN 103 CO 0.68 1.71 0.35 -0.94 -1.65 0.00 0.00 177.43 177.57 2b4c s SER 104 N -7.57 4.61 0.53 5.81 1.04 -1.23 -4.96 113.70 111.92 2b4c s SER 104 Ca -0.09 2.00 -0.21 0.00 0.48 0.00 0.00 55.95 58.13 2b4c s SER 104 Cb 0.04 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.55 2b4c s SER 104 CO 0.94 -1.97 1.11 0.47 0.98 0.00 0.00 173.24 174.77 2b4c n ASP 105 N -2.97 1.54 0.21 7.02 10.43 -1.26 -4.90 116.55 126.61 2b4c n ASP 105 Ca 0.10 0.92 0.05 0.00 2.57 0.00 0.00 54.79 58.44 2b4c n ASP 105 Cb 0.52 -1.44 0.46 0.00 1.84 0.00 0.00 41.12 42.49 2b4c n ASP 105 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2b4c h THR 106 N 1.09 1.11 -3.44 -3.53 1.03 -1.94 -3.31 112.91 103.92 2b4c h THR 106 Ca -0.48 -0.98 -0.70 0.00 -0.01 0.00 0.00 66.41 64.25 2b4c h THR 106 Cb 1.34 1.54 -0.36 0.00 -1.07 0.00 0.00 68.15 69.60 2b4c h THR 106 CO 0.54 0.27 -0.26 -1.00 -0.01 0.00 0.00 175.52 175.07 2b4c s HIS 107 N -4.31 3.61 0.57 0.00 3.76 -1.26 -3.91 115.29 113.76 2b4c s HIS 107 Ca -0.03 -2.87 -0.17 0.00 -0.15 0.00 0.00 55.06 51.84 2b4c s HIS 107 Cb 0.14 -3.20 -0.04 0.00 1.11 0.00 0.00 32.58 30.59 2b4c s HIS 107 CO 0.69 -0.78 1.09 -0.51 -0.85 0.00 0.00 174.74 174.38 2b4c s LEU 108 N -0.67 3.61 0.87 0.89 1.43 -1.04 -5.06 118.68 118.71 2b4c s LEU 108 Ca 0.22 1.98 -0.12 0.00 -1.03 0.00 0.00 54.13 55.18 2b4c s LEU 108 Cb -0.14 -4.56 0.15 0.00 0.03 0.00 0.00 46.19 41.67 2b4c s LEU 108 CO -0.08 -1.21 1.22 -0.76 0.23 0.00 0.00 176.35 175.74 2b4c s LEU 109 N -4.18 2.72 -0.46 1.79 1.43 -1.26 -4.95 118.68 113.77 2b4c s LEU 109 Ca 0.68 0.32 -0.28 0.00 -1.03 0.00 0.00 54.13 53.82 2b4c s LEU 109 Cb -0.19 -2.57 -0.00 0.00 0.03 0.00 0.00 46.19 43.46 2b4c s LEU 109 CO 0.32 -2.31 1.57 -1.58 0.23 0.00 0.00 176.35 174.57 2b4c s GLN 110 N -5.65 3.32 -0.24 1.70 0.74 -1.26 -3.85 119.66 114.42 2b4c s GLN 110 Ca 0.69 0.90 -0.01 0.00 0.05 0.00 0.00 55.36 56.98 2b4c s GLN 110 Cb -0.06 -4.14 -0.01 0.00 1.10 0.00 0.00 33.01 29.89 2b4c s GLN 110 CO 0.50 -1.89 0.21 0.41 -0.55 0.00 0.00 175.29 173.97 2b4c n GLY 111 N 5.30 0.14 0.00 2.59 0.00 -1.26 -5.06 105.19 106.89 2b4c n GLY 111 Ca 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2b4c n GLY 111 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2b4c n GLN 112 N -1.72 3.88 -4.84 1.61 7.27 -1.25 -4.84 117.38 117.49 2b4c n GLN 112 Ca -0.01 0.00 -0.25 0.00 0.07 0.00 0.00 57.00 56.81 2b4c n GLN 112 Cb 0.52 0.00 -0.16 0.00 2.41 0.00 0.00 30.24 33.02 2b4c n GLN 112 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 2b4c s SER 113 N 1.00 2.08 -0.18 1.69 1.04 -1.26 -2.99 113.70 115.09 2b4c s SER 113 Ca 0.00 -0.33 -0.13 0.00 0.48 0.00 0.00 55.95 55.98 2b4c s SER 113 Cb 0.00 -0.34 -0.05 0.00 0.10 0.00 0.00 66.02 65.73 2b4c s SER 113 CO 0.00 0.20 0.24 -0.22 0.98 0.00 0.00 173.24 174.44 2b4c s LEU 114 N -0.27 4.23 -0.16 2.42 2.96 0.21 -4.95 118.68 123.12 2b4c s LEU 114 Ca 0.04 0.41 0.01 0.00 -0.22 0.00 0.00 54.13 54.37 2b4c s LEU 114 Cb -0.08 -2.28 0.01 0.00 0.50 0.00 0.00 46.19 44.33 2b4c s LEU 114 CO 0.00 0.12 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.08 2b4c s THR 115 N 0.46 2.33 -0.08 3.68 2.01 -1.26 -1.63 115.64 121.15 2b4c s THR 115 Ca 0.14 -0.88 -0.01 0.00 0.31 0.00 0.00 61.69 61.24 2b4c s THR 115 Cb -0.12 -1.96 0.03 0.00 0.01 0.00 0.00 72.50 70.45 2b4c s THR 115 CO 0.02 0.53 0.00 -0.76 -0.69 0.00 0.00 174.62 173.72 2b4c s LEU 116 N 0.92 0.63 -0.11 4.42 1.43 -1.10 -2.65 118.68 122.23 2b4c s LEU 116 Ca -0.04 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2b4c s LEU 116 Cb -0.15 -0.46 -0.02 0.00 0.03 0.00 0.00 46.19 45.59 2b4c s LEU 116 CO -0.03 -0.20 -0.13 -0.89 0.23 0.00 0.00 176.35 175.33 2b4c s THR 117 N 1.96 3.06 -0.15 5.49 2.01 -0.73 -2.99 115.64 124.29 2b4c s THR 117 Ca 0.05 -0.68 -0.08 0.00 0.31 0.00 0.00 61.69 61.29 2b4c s THR 117 Cb -0.12 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 2b4c s THR 117 CO -0.06 0.54 0.11 -0.76 -0.69 0.00 0.00 174.62 173.77 2b4c s LEU 118 N 0.07 4.19 -0.08 4.42 1.02 -1.26 -1.60 118.68 125.44 2b4c s LEU 118 Ca -0.05 0.31 -0.30 0.00 0.02 0.00 0.00 54.13 54.11 2b4c s LEU 118 Cb -0.15 -2.04 -0.03 0.00 0.02 0.00 0.00 46.19 43.99 2b4c s LEU 118 CO 0.04 0.30 1.26 -1.61 0.02 0.00 0.00 176.35 176.36 2b4c s GLU 119 N -0.36 4.31 -0.02 1.70 8.01 -0.47 -4.95 118.70 126.92 2b4c s GLU 119 Ca 0.11 1.72 0.04 0.00 0.01 0.00 0.00 54.97 56.86 2b4c s GLU 119 Cb -0.12 -3.62 -0.01 0.00 -4.31 0.00 0.00 34.13 26.07 2b4c s GLU 119 CO 0.01 -0.54 -0.15 0.45 0.01 0.00 0.00 175.26 175.04 2b4c s SER 120 N 1.71 1.82 0.60 -0.19 0.15 -1.26 -2.99 113.70 113.54 2b4c s SER 120 Ca 0.57 -0.28 -0.18 0.00 0.70 0.00 0.00 55.95 56.76 2b4c s SER 120 Cb -0.25 -0.29 -0.03 0.00 -1.71 0.00 0.00 66.02 63.74 2b4c s SER 120 CO 0.21 0.17 1.16 -2.84 1.20 0.00 0.00 173.24 173.14 2b4c s PRO 121 N -0.23 2.98 0.11 5.44 0.02 -1.26 -4.92 135.00 137.14 2b4c s PRO 121 Ca 0.03 1.64 -0.34 0.00 0.02 0.00 0.00 61.00 62.36 2b4c s PRO 121 Cb -0.07 -1.95 -0.13 0.00 0.02 0.00 0.00 34.50 32.36 2b4c s PRO 121 CO 0.00 -1.15 1.66 -2.30 -0.33 0.00 0.00 177.00 174.88 2b4c n PRO 122 N -1.79 2.22 -1.82 5.54 -0.02 -1.26 -3.52 135.00 134.35 2b4c n PRO 122 Ca 0.12 0.81 -0.02 0.00 -2.02 0.00 0.00 63.50 62.39 2b4c n PRO 122 Cb 0.51 -2.60 0.01 0.00 -0.02 0.00 0.00 33.50 31.39 2b4c n PRO 122 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b4c n GLY 123 N 3.69 0.12 3.15 -1.23 0.00 -1.26 -5.09 105.19 104.56 2b4c n GLY 123 Ca 0.18 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 2b4c n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b4c s SER 124 N -2.72 0.08 -0.58 1.61 0.01 -1.23 -5.11 113.70 105.75 2b4c s SER 124 Ca 0.05 -0.39 0.04 0.00 1.31 0.00 0.00 55.95 56.96 2b4c s SER 124 Cb -0.01 0.25 0.16 0.00 0.21 0.00 0.00 66.02 66.63 2b4c s SER 124 CO 0.14 -0.51 0.38 -0.44 0.41 0.00 0.00 173.24 173.23 2b4c s SER 125 N -1.97 4.08 0.61 2.44 0.01 -1.26 -5.04 113.70 112.56 2b4c s SER 125 Ca -0.07 -3.38 -0.15 0.00 1.31 0.00 0.00 55.95 53.66 2b4c s SER 125 Cb -0.02 -1.38 -0.03 0.00 0.21 0.00 0.00 66.02 64.80 2b4c s SER 125 CO -0.03 -0.16 1.06 -2.84 0.41 0.00 0.00 173.24 171.68 2b4c s PRO 126 N -0.72 3.26 -0.12 12.44 0.02 -1.26 -5.01 135.00 143.61 2b4c s PRO 126 Ca 0.23 1.16 -0.04 0.00 0.02 0.00 0.00 61.00 62.38 2b4c s PRO 126 Cb -0.11 -2.03 0.06 0.00 0.02 0.00 0.00 34.50 32.44 2b4c s PRO 126 CO -0.11 -0.86 0.15 -1.12 -0.33 0.00 0.00 177.00 174.73 2b4c s SER 127 N -2.95 1.25 -0.06 2.53 0.01 -1.23 -4.75 113.70 108.50 2b4c s SER 127 Ca 0.63 -0.01 0.05 0.00 1.31 0.00 0.00 55.95 57.93 2b4c s SER 127 Cb -0.16 0.15 -0.02 0.00 0.21 0.00 0.00 66.02 66.21 2b4c s SER 127 CO 0.40 -0.28 -0.21 -0.69 0.41 0.00 0.00 173.24 172.87 2b4c s VAL 128 N 2.26 2.46 -0.32 3.43 1.01 -1.26 -0.84 120.40 127.14 2b4c s VAL 128 Ca 0.04 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.10 2b4c s VAL 128 Cb -0.14 -1.93 0.10 0.00 0.00 0.00 0.00 36.38 34.41 2b4c s VAL 128 CO -0.07 0.57 0.06 -1.58 0.00 0.00 0.00 175.10 174.08 2b4c s GLN 129 N -0.35 1.12 0.62 2.72 0.74 0.42 -3.85 119.66 121.09 2b4c s GLN 129 Ca 0.02 -1.41 -0.02 0.00 0.05 0.00 0.00 55.36 54.00 2b4c s GLN 129 Cb -0.12 -2.57 0.05 0.00 1.10 0.00 0.00 33.01 31.47 2b4c s GLN 129 CO 0.02 -0.93 0.88 0.00 -0.55 0.00 0.00 175.29 174.71 2b4c s ARG 131 N -4.98 0.39 0.79 0.00 3.52 0.77 -2.22 118.95 117.22 2b4c s ARG 131 Ca 0.59 -0.16 -0.11 0.00 -0.13 0.00 0.00 55.73 55.93 2b4c s ARG 131 Cb -0.10 0.17 0.08 0.00 -1.56 0.00 0.00 34.95 33.54 2b4c s ARG 131 CO 0.41 -0.08 1.14 -1.54 -0.81 0.00 0.00 175.30 174.42 2b4c s SER 132 N -0.84 4.55 0.47 -2.12 1.04 -0.46 -3.21 113.70 113.12 2b4c s SER 132 Ca -0.09 0.69 0.12 0.00 0.48 0.00 0.00 55.95 57.15 2b4c s SER 132 Cb -0.05 -1.21 1.08 0.00 0.10 0.00 0.00 66.02 65.94 2b4c s SER 132 CO 0.01 -1.85 2.10 -0.65 0.98 0.00 0.00 173.24 173.83 2b4c h PRO 133 N -0.96 0.26 0.00 4.02 0.11 -1.87 -3.39 132.00 130.16 2b4c h PRO 133 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2b4c h PRO 133 Cb 1.32 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2b4c h PRO 133 CO 0.64 0.17 -0.03 2.89 -0.21 0.00 0.00 178.00 181.46 2b4c n ARG 134 N -4.50 0.02 -3.16 1.05 1.85 -1.26 -4.98 116.66 105.68 2b4c n ARG 134 Ca 0.01 0.01 0.02 0.00 -1.00 0.00 0.00 57.85 56.88 2b4c n ARG 134 Cb 0.10 -0.19 -0.01 0.00 -1.05 0.00 0.00 32.46 31.31 2b4c n ARG 134 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2b4c s GLY 135 N -3.19 -1.29 -0.29 2.89 0.00 -1.26 -5.13 107.32 99.06 2b4c s GLY 135 Ca -0.01 0.52 -0.16 0.00 0.00 0.00 0.00 44.72 45.08 2b4c s GLY 135 CO 0.01 3.74 0.95 1.25 0.00 0.00 0.00 173.10 179.06 2b4c s LYS 136 N 2.07 0.40 -0.17 2.90 2.20 -1.26 -4.96 119.74 120.93 2b4c s LYS 136 Ca 0.15 0.71 -0.12 0.00 -0.36 0.00 0.00 55.97 56.36 2b4c s LYS 136 Cb -0.04 0.11 -0.05 0.00 -1.51 0.00 0.00 37.83 36.33 2b4c s LYS 136 CO -0.12 -0.09 0.21 1.21 -0.36 0.00 0.00 175.35 176.21 2b4c s ASN 137 N 1.44 6.34 -0.13 1.43 2.47 -1.26 -1.35 114.94 123.88 2b4c s ASN 137 Ca -0.09 0.40 0.02 0.00 0.42 0.00 0.00 52.86 53.61 2b4c s ASN 137 Cb -0.04 -2.13 -0.00 0.00 -1.45 0.00 0.00 41.25 37.62 2b4c s ASN 137 CO -0.15 0.17 -0.18 -0.63 -3.72 0.00 0.00 177.10 172.59 2b4c s ILE 138 N 0.22 2.54 0.27 -5.21 1.01 -0.94 -5.02 121.20 114.07 2b4c s ILE 138 Ca 0.13 -0.84 0.12 0.00 0.00 0.00 0.00 60.65 60.06 2b4c s ILE 138 Cb -0.12 -2.03 -0.05 0.00 0.01 0.00 0.00 42.46 40.27 2b4c s ILE 138 CO 0.02 0.54 -0.20 -1.10 0.00 0.00 0.00 174.94 174.19 2b4c s GLN 139 N 0.49 1.66 0.00 2.79 -0.21 -1.26 -1.46 119.66 121.67 2b4c s GLN 139 Ca -0.12 -1.75 0.00 0.00 0.02 0.00 0.00 55.36 53.51 2b4c s GLN 139 Cb -0.16 -1.76 0.00 0.00 1.00 0.00 0.00 33.01 32.08 2b4c s GLN 139 CO 0.05 0.33 0.00 0.41 -2.12 0.00 0.00 175.29 173.96 2b4c n GLY 140 N -0.55 1.55 0.00 3.09 0.00 -1.25 -4.94 105.19 103.10 2b4c n GLY 140 Ca -0.06 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2b4c n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b4c n GLY 141 N 0.00 0.23 0.11 -0.02 0.00 -1.26 -4.66 105.19 99.58 2b4c n GLY 141 Ca 0.00 0.19 -0.15 0.00 0.00 0.00 0.00 46.02 46.06 2b4c n GLY 141 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2b4c h LYS 142 N 0.00 0.22 -4.65 1.61 1.63 -2.00 -3.41 116.57 109.97 2b4c h LYS 142 Ca 0.00 -0.20 -0.46 0.00 -0.85 0.00 0.00 60.65 59.14 2b4c h LYS 142 Cb 0.00 0.05 -0.31 0.00 -0.60 0.00 0.00 32.23 31.36 2b4c h LYS 142 CO 0.00 0.87 -0.80 -0.08 -3.45 0.00 0.00 179.45 175.99 2b4c s THR 143 N -3.46 0.91 -0.22 1.00 -1.32 -1.26 -4.48 115.64 106.81 2b4c s THR 143 Ca -0.15 -0.41 -0.03 0.00 -1.21 0.00 0.00 61.69 59.89 2b4c s THR 143 Cb 0.02 -0.82 0.00 0.00 -1.51 0.00 0.00 72.50 70.20 2b4c s THR 143 CO 0.75 0.28 -0.07 -0.76 -2.21 0.00 0.00 174.62 172.61 2b4c s LEU 144 N 0.30 2.86 -0.04 9.08 1.02 -1.16 -4.91 118.68 125.83 2b4c s LEU 144 Ca -0.06 -0.54 -0.02 0.00 0.02 0.00 0.00 54.13 53.54 2b4c s LEU 144 Cb -0.11 -1.69 0.02 0.00 0.02 0.00 0.00 46.19 44.44 2b4c s LEU 144 CO 0.01 -0.04 0.08 -0.44 0.02 0.00 0.00 176.35 175.98 2b4c s SER 145 N 1.42 -0.05 -0.22 2.29 0.01 -1.26 -2.71 113.70 113.17 2b4c s SER 145 Ca 0.04 0.16 -0.09 0.00 1.31 0.00 0.00 55.95 57.38 2b4c s SER 145 Cb -0.15 0.11 -0.05 0.00 0.21 0.00 0.00 66.02 66.15 2b4c s SER 145 CO -0.05 -0.08 0.13 -0.69 0.41 0.00 0.00 173.24 172.95 2b4c s VAL 146 N 0.58 5.15 -0.08 3.43 1.01 -0.64 -4.97 120.40 124.87 2b4c s VAL 146 Ca -0.04 0.10 -0.17 0.00 0.00 0.00 0.00 61.98 61.87 2b4c s VAL 146 Cb -0.06 -3.38 -0.29 0.00 0.00 0.00 0.00 36.38 32.65 2b4c s VAL 146 CO -0.02 0.39 0.66 0.28 0.00 0.00 0.00 175.10 176.40 2b4c h SER 147 N 7.25 0.44 -3.87 3.32 0.02 -1.87 0.62 113.55 119.45 2b4c h SER 147 Ca -0.38 -0.88 -0.64 0.00 -0.84 0.00 0.00 61.79 59.04 2b4c h SER 147 Cb 1.17 -0.14 -0.17 0.00 0.14 0.00 0.00 62.40 63.40 2b4c h SER 147 CO 0.68 1.58 -0.49 -1.10 -1.14 0.00 0.00 176.83 176.37 2b4c s GLN 148 N -2.48 3.93 0.13 3.45 -1.52 -1.26 -4.00 119.66 117.92 2b4c s GLN 148 Ca -0.18 -0.30 0.05 0.00 -1.95 0.00 0.00 55.36 52.99 2b4c s GLN 148 Cb 0.04 -3.67 -0.04 0.00 -0.22 0.00 0.00 33.01 29.12 2b4c s GLN 148 CO 0.79 -0.20 -0.12 -0.51 -0.25 0.00 0.00 175.29 175.00 2b4c s LEU 149 N 1.79 2.46 0.36 2.90 1.43 -1.16 -5.02 118.68 121.45 2b4c s LEU 149 Ca 0.08 -0.90 0.04 0.00 -1.03 0.00 0.00 54.13 52.32 2b4c s LEU 149 Cb -0.16 -0.42 -0.06 0.00 0.03 0.00 0.00 46.19 45.59 2b4c s LEU 149 CO 0.11 -0.25 0.06 -1.83 0.23 0.00 0.00 176.35 174.67 2b4c s GLU 150 N -3.18 1.78 0.39 1.70 1.03 -1.26 -4.17 118.70 114.99 2b4c s GLU 150 Ca 0.12 -2.02 0.27 0.00 0.03 0.00 0.00 54.97 53.37 2b4c s GLU 150 Cb -0.01 -0.97 0.91 0.00 -0.80 0.00 0.00 34.13 33.25 2b4c s GLU 150 CO 0.02 -0.23 1.79 1.25 -1.33 0.00 0.00 175.26 176.75 2b4c h LEU 151 N 1.96 0.00 -1.35 1.83 5.85 -1.97 -3.16 115.31 118.47 2b4c h LEU 151 Ca -0.40 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 2b4c h LEU 151 Cb 1.25 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 2b4c h LEU 151 CO 0.69 0.00 -0.05 0.06 -0.34 0.00 0.00 178.44 178.80 2b4c h GLN 152 N 0.00 0.00 -0.81 1.25 3.07 -2.03 -3.06 115.11 113.52 2b4c h GLN 152 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2b4c h GLN 152 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.21 2b4c h GLN 152 CO 0.00 0.05 0.00 -0.25 0.09 0.00 0.00 178.83 178.72 2b4c n ASP 153 N -3.17 1.89 -4.57 0.06 8.00 -1.20 -4.82 116.55 112.74 2b4c n ASP 153 Ca 0.01 -2.18 -0.43 0.00 0.71 0.00 0.00 54.79 52.90 2b4c n ASP 153 Cb 0.34 -0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 40.92 2b4c n ASP 153 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2b4c s SER 154 N -0.27 6.51 0.00 -2.24 1.04 -1.16 -4.79 113.70 112.78 2b4c s SER 154 Ca 0.12 0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.71 2b4c s SER 154 Cb 0.09 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.71 2b4c s SER 154 CO 0.04 -1.23 0.00 0.61 0.98 0.00 0.00 173.24 173.64 2b4c n GLY 155 N 4.96 -0.55 3.77 7.32 0.00 0.39 -4.96 105.19 116.11 2b4c n GLY 155 Ca 0.08 -0.67 -0.38 0.00 0.00 0.00 0.00 46.02 45.05 2b4c n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b4c s THR 156 N -4.00 4.23 0.22 2.61 2.01 -1.26 -1.75 115.64 117.70 2b4c s THR 156 Ca 0.00 1.84 0.11 0.00 0.31 0.00 0.00 61.69 63.94 2b4c s THR 156 Cb 0.00 -4.13 -0.05 0.00 0.01 0.00 0.00 72.50 68.33 2b4c s THR 156 CO 0.00 0.36 -0.17 0.26 -0.69 0.00 0.00 174.62 174.38 2b4c s TRP 157 N -1.35 2.42 -0.08 4.92 0.52 -0.11 -4.07 118.94 121.19 2b4c s TRP 157 Ca 0.43 -0.30 -0.01 0.00 0.02 0.00 0.00 56.10 56.23 2b4c s TRP 157 Cb -0.22 -1.14 0.03 0.00 -1.15 0.00 0.00 33.47 30.99 2b4c s TRP 157 CO 0.27 0.58 0.01 0.99 0.02 0.00 0.00 176.95 178.82 2b4c s THR 158 N -2.01 0.35 -0.05 2.01 2.01 -1.20 -3.12 115.64 113.63 2b4c s THR 158 Ca 0.26 0.11 0.04 0.00 0.31 0.00 0.00 61.69 62.40 2b4c s THR 158 Cb -0.07 -0.53 0.00 0.00 0.01 0.00 0.00 72.50 71.91 2b4c s THR 158 CO 0.14 0.23 -0.15 0.00 -0.69 0.00 0.00 174.62 174.14 2b4c s THR 160 N 0.20 2.63 -0.18 0.00 2.01 -0.76 -0.73 115.64 118.81 2b4c s THR 160 Ca -0.07 -0.84 -0.03 0.00 0.31 0.00 0.00 61.69 61.07 2b4c s THR 160 Cb -0.12 -2.04 -0.01 0.00 0.01 0.00 0.00 72.50 70.34 2b4c s THR 160 CO 0.03 0.56 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.75 2b4c s VAL 161 N -0.01 3.35 -0.10 3.82 1.01 -0.49 -0.43 120.40 127.56 2b4c s VAL 161 Ca -0.06 -0.52 -0.00 0.00 0.00 0.00 0.00 61.98 61.40 2b4c s VAL 161 Cb -0.15 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 2b4c s VAL 161 CO 0.05 0.46 -0.08 -1.48 0.00 0.00 0.00 175.10 174.05 2b4c s LEU 162 N 0.98 3.07 -0.17 3.92 2.34 -0.02 -2.11 118.68 126.69 2b4c s LEU 162 Ca -0.00 -0.11 -0.08 0.00 0.06 0.00 0.00 54.13 53.99 2b4c s LEU 162 Cb -0.15 -1.68 0.07 0.00 -0.56 0.00 0.00 46.19 43.87 2b4c s LEU 162 CO 0.00 0.28 0.38 -1.58 -1.06 0.00 0.00 176.35 174.37 2b4c s GLN 163 N -0.33 0.33 -1.32 1.48 2.00 0.18 -3.58 119.66 118.41 2b4c s GLN 163 Ca 0.04 0.84 -0.00 0.00 -2.00 0.00 0.00 55.36 54.24 2b4c s GLN 163 Cb -0.13 0.08 -0.00 0.00 0.80 0.00 0.00 33.01 33.76 2b4c s GLN 163 CO 0.02 -0.20 0.65 0.09 -0.50 0.00 0.00 175.29 175.35 2b4c n ASN 164 N 4.74 -1.09 -0.99 6.67 3.02 -1.26 -1.83 115.26 124.53 2b4c n ASN 164 Ca -0.17 -0.85 -0.13 0.00 -0.03 0.00 0.00 54.58 53.40 2b4c n ASN 164 Cb 0.53 -3.89 -0.06 0.00 -0.61 0.00 0.00 39.78 35.75 2b4c n ASN 164 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2b4c n GLN 165 N -4.28 -1.50 -4.98 3.52 3.00 -1.26 -4.98 117.38 106.90 2b4c n GLN 165 Ca -0.30 0.94 -0.27 0.00 -0.01 0.00 0.00 57.00 57.36 2b4c n GLN 165 Cb 0.68 -5.27 -0.16 0.00 0.00 0.00 0.00 30.24 25.49 2b4c n GLN 165 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 2b4c s LYS 166 N -3.03 1.79 0.04 -1.09 3.01 -0.76 -5.15 119.74 114.55 2b4c s LYS 166 Ca 0.00 -0.71 0.04 0.00 -1.01 0.00 0.00 55.97 54.29 2b4c s LYS 166 Cb 0.00 -1.65 -0.02 0.00 -1.01 0.00 0.00 37.83 35.15 2b4c s LYS 166 CO 0.00 0.38 -0.12 -1.59 0.51 0.00 0.00 175.35 174.52 2b4c s LYS 167 N -0.29 0.82 0.04 1.68 -2.85 -1.26 -0.65 119.74 117.22 2b4c s LYS 167 Ca 0.03 -0.73 0.03 0.00 -1.00 0.00 0.00 55.97 54.30 2b4c s LYS 167 Cb -0.10 -0.79 -0.02 0.00 -2.06 0.00 0.00 37.83 34.87 2b4c s LYS 167 CO 0.01 0.19 -0.10 0.54 0.10 0.00 0.00 175.35 176.09 2b4c s VAL 168 N -0.92 0.73 0.13 1.79 0.11 -0.90 -4.98 120.40 116.35 2b4c s VAL 168 Ca -0.01 -1.02 0.07 0.00 -2.93 0.00 0.00 61.98 58.09 2b4c s VAL 168 Cb -0.08 -0.73 -0.04 0.00 -1.53 0.00 0.00 36.38 34.00 2b4c s VAL 168 CO 0.01 -0.24 -0.05 -1.83 -3.33 0.00 0.00 175.10 169.67 2b4c s GLU 169 N -1.38 2.30 0.08 1.54 1.03 -1.26 -1.39 118.70 119.62 2b4c s GLU 169 Ca -0.05 -1.02 0.08 0.00 0.03 0.00 0.00 54.97 54.01 2b4c s GLU 169 Cb -0.09 -2.37 -0.03 0.00 -0.80 0.00 0.00 34.13 30.85 2b4c s GLU 169 CO 0.01 0.49 -0.22 -0.06 -1.33 0.00 0.00 175.26 174.15 2b4c s PHE 170 N -1.43 1.92 -0.10 4.83 0.08 0.09 -4.99 117.98 118.38 2b4c s PHE 170 Ca 0.24 -0.40 0.02 0.00 0.12 0.00 0.00 56.93 56.92 2b4c s PHE 170 Cb -0.11 -1.09 0.01 0.00 -0.57 0.00 0.00 43.02 41.27 2b4c s PHE 170 CO 0.16 0.17 -0.16 0.15 -0.10 0.00 0.00 175.22 175.45 2b4c s LYS 171 N -1.60 2.23 0.02 0.44 1.02 -1.26 -2.28 119.74 118.31 2b4c s LYS 171 Ca 0.08 -0.58 0.03 0.00 0.02 0.00 0.00 55.97 55.52 2b4c s LYS 171 Cb -0.10 -1.85 -0.01 0.00 -0.52 0.00 0.00 37.83 35.35 2b4c s LYS 171 CO 0.03 -0.01 -0.08 0.96 -0.92 0.00 0.00 175.35 175.33 2b4c s ILE 172 N 0.82 0.63 -0.27 2.17 -4.36 -1.18 -4.97 121.20 114.04 2b4c s ILE 172 Ca -0.10 -0.62 -0.12 0.00 -0.26 0.00 0.00 60.65 59.55 2b4c s ILE 172 Cb -0.16 -0.58 -0.05 0.00 1.25 0.00 0.00 42.46 42.93 2b4c s ILE 172 CO 0.01 -0.02 0.25 -1.81 0.24 0.00 0.00 174.94 173.62 2b4c s ASP 173 N -0.71 6.12 -0.12 4.36 1.01 -1.26 -0.94 116.67 125.13 2b4c s ASP 173 Ca -0.01 0.12 0.02 0.00 0.71 0.00 0.00 52.55 53.39 2b4c s ASP 173 Cb -0.05 -2.15 0.01 0.00 1.01 0.00 0.00 42.92 41.74 2b4c s ASP 173 CO 0.00 -0.08 -0.18 -0.63 0.21 0.00 0.00 175.17 174.49 2b4c s ILE 174 N 1.77 1.73 -0.55 0.77 1.01 -0.72 -5.02 121.20 120.19 2b4c s ILE 174 Ca 0.10 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 60.01 2b4c s ILE 174 Cb -0.16 -1.56 0.04 0.00 0.01 0.00 0.00 42.46 40.79 2b4c s ILE 174 CO 0.10 0.49 0.64 1.33 0.00 0.00 0.00 174.94 177.50