#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1on4 n MET 2 N 0.00 2.55 -1.61 -0.41 2.00 -1.26 -4.82 117.12 113.57 1on4 n MET 2 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 57.70 57.58 1on4 n MET 2 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.18 1on4 n MET 2 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 1on4 n LEU 3 N 0.00 -1.07 -4.57 4.03 7.94 -1.26 -4.91 117.00 117.16 1on4 n LEU 3 Ca 0.00 0.20 -0.39 0.00 -1.11 0.00 0.00 56.01 54.71 1on4 n LEU 3 Cb 0.00 -1.86 -0.03 0.00 0.53 0.00 0.00 43.42 42.06 1on4 n LEU 3 CO 0.00 -0.47 1.95 -1.83 -1.11 0.00 0.00 177.39 175.93 1on4 s GLU 4 N -3.49 2.48 -1.32 1.96 -1.05 -1.26 -0.93 118.70 115.08 1on4 s GLU 4 Ca 0.00 1.63 -0.05 0.00 -0.15 0.00 0.00 54.97 56.40 1on4 s GLU 4 Cb 0.00 -4.50 -0.00 0.00 -0.44 0.00 0.00 34.13 29.18 1on4 s GLU 4 CO 0.00 -2.84 0.57 -0.89 0.95 0.00 0.00 175.26 173.04 1on4 n ILE 5 N 7.91 -4.03 -1.98 1.83 2.08 -1.26 -4.40 119.36 119.51 1on4 n ILE 5 Ca 0.34 -0.60 0.00 0.00 0.56 0.00 0.00 62.75 63.05 1on4 n ILE 5 Cb 0.51 -3.30 0.00 0.00 -0.75 0.00 0.00 39.64 36.10 1on4 n ILE 5 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1on4 n LYS 6 N -4.32 0.00 -3.60 0.38 4.81 -0.11 -4.63 118.16 110.69 1on4 n LYS 6 Ca -0.26 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 56.89 1on4 n LYS 6 Cb 0.66 0.00 -0.12 0.00 0.02 0.00 0.00 35.03 35.59 1on4 n LYS 6 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1on4 s ASP 7 N -4.00 3.12 -0.34 3.14 1.11 -1.26 -4.19 116.67 114.24 1on4 s ASP 7 Ca 0.00 -2.77 -0.28 0.00 0.18 0.00 0.00 52.55 49.68 1on4 s ASP 7 Cb 0.00 -0.82 0.02 0.00 1.07 0.00 0.00 42.92 43.18 1on4 s ASP 7 CO 0.00 -0.23 1.03 -2.16 1.18 0.00 0.00 175.17 174.98 1on4 s PRO 8 N 0.23 3.98 1.08 8.23 0.04 -1.26 -4.70 135.00 142.59 1on4 s PRO 8 Ca 0.22 0.88 -0.18 0.00 0.04 0.00 0.00 61.00 61.96 1on4 s PRO 8 Cb -0.15 -3.77 0.25 0.00 0.04 0.00 0.00 34.50 30.87 1on4 s PRO 8 CO -0.06 -0.94 1.27 -0.48 0.04 0.00 0.00 177.00 176.83 1on4 s LEU 9 N 3.64 1.98 -0.40 -3.56 2.34 0.05 -5.02 118.68 117.72 1on4 s LEU 9 Ca 0.43 0.29 0.10 0.00 0.06 0.00 0.00 54.13 55.01 1on4 s LEU 9 Cb -0.12 -2.14 0.34 0.00 -0.56 0.00 0.00 46.19 43.71 1on4 s LEU 9 CO 0.17 -3.38 0.88 -0.46 -1.06 0.00 0.00 176.35 172.51 1on4 n ASN 10 N -4.21 -0.37 -4.54 1.48 0.23 -1.07 -4.34 115.26 102.44 1on4 n ASN 10 Ca 0.16 -3.26 -0.43 0.00 -0.53 0.00 0.00 54.58 50.52 1on4 n ASN 10 Cb 0.59 0.35 -0.05 0.00 -2.08 0.00 0.00 39.78 38.59 1on4 n ASN 10 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1on4 s TYR 11 N -1.41 2.96 -0.42 -2.53 6.14 -0.81 -4.74 117.35 116.53 1on4 s TYR 11 Ca 0.33 0.12 -0.29 0.00 0.64 0.00 0.00 57.07 57.87 1on4 s TYR 11 Cb 0.33 -3.75 0.02 0.00 0.42 0.00 0.00 41.96 38.98 1on4 s TYR 11 CO -0.07 -1.06 1.30 -1.21 0.64 0.00 0.00 175.55 175.16 1on4 s GLU 12 N 3.40 3.67 0.35 4.97 8.01 -1.26 -0.34 118.70 137.49 1on4 s GLU 12 Ca 0.30 0.84 -0.26 0.00 0.01 0.00 0.00 54.97 55.86 1on4 s GLU 12 Cb -0.12 -3.96 -0.09 0.00 -4.31 0.00 0.00 34.13 25.64 1on4 s GLU 12 CO 0.22 -1.45 1.01 0.54 0.01 0.00 0.00 175.26 175.59 1on4 s VAL 13 N 4.96 3.92 -0.20 2.63 0.11 -0.04 -3.96 120.40 127.82 1on4 s VAL 13 Ca 0.56 1.59 -0.20 0.00 -2.93 0.00 0.00 61.98 61.00 1on4 s VAL 13 Cb -0.12 -3.88 -0.03 0.00 -1.53 0.00 0.00 36.38 30.83 1on4 s VAL 13 CO 0.31 0.12 0.58 -0.70 -3.33 0.00 0.00 175.10 172.08 1on4 s GLU 14 N -2.14 4.20 0.30 1.54 2.12 -1.26 -4.80 118.70 118.65 1on4 s GLU 14 Ca 0.52 0.53 -0.30 0.00 0.36 0.00 0.00 54.97 56.08 1on4 s GLU 14 Cb -0.22 -3.58 -0.12 0.00 0.26 0.00 0.00 34.13 30.48 1on4 s GLU 14 CO 0.27 -0.21 1.56 -2.30 -0.54 0.00 0.00 175.26 174.04 1on4 n PRO 15 N 4.98 2.63 -3.76 4.30 -0.02 -1.26 -4.90 135.00 136.97 1on4 n PRO 15 Ca -0.03 0.93 -0.00 0.00 -2.02 0.00 0.00 63.50 62.38 1on4 n PRO 15 Cb 0.50 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 1on4 n PRO 15 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1on4 s PHE 16 N -0.22 -0.03 -0.46 6.00 5.36 -1.26 -4.99 117.98 122.39 1on4 s PHE 16 Ca 0.62 -0.19 -0.08 0.00 -0.96 0.00 0.00 56.93 56.33 1on4 s PHE 16 Cb -0.51 0.60 0.11 0.00 -0.34 0.00 0.00 43.02 42.89 1on4 s PHE 16 CO 0.51 -0.55 0.32 0.99 -1.46 0.00 0.00 175.22 175.04 1on4 s THR 17 N -2.53 4.07 0.52 0.12 2.01 -1.26 -1.08 115.64 117.49 1on4 s THR 17 Ca 0.18 -1.79 0.04 0.00 0.31 0.00 0.00 61.69 60.43 1on4 s THR 17 Cb 0.01 -3.68 0.04 0.00 0.01 0.00 0.00 72.50 68.88 1on4 s THR 17 CO 0.00 -0.74 0.72 -0.36 -0.69 0.00 0.00 174.62 173.55 1on4 s PHE 18 N 1.33 2.65 -0.02 4.92 0.08 0.38 -4.90 117.98 122.42 1on4 s PHE 18 Ca 0.06 -0.22 0.06 0.00 0.12 0.00 0.00 56.93 56.96 1on4 s PHE 18 Cb -0.25 -2.60 -0.02 0.00 -0.57 0.00 0.00 43.02 39.58 1on4 s PHE 18 CO -0.01 -0.80 -0.21 -0.65 -0.10 0.00 0.00 175.22 173.45 1on4 s GLN 19 N -4.64 1.77 0.96 0.44 -0.21 -1.26 -0.86 119.66 115.86 1on4 s GLN 19 Ca 0.57 -0.76 -0.16 0.00 0.02 0.00 0.00 55.36 55.03 1on4 s GLN 19 Cb -0.10 -1.69 0.19 0.00 1.00 0.00 0.00 33.01 32.41 1on4 s GLN 19 CO 0.37 0.45 1.30 0.54 -2.12 0.00 0.00 175.29 175.82 1on4 s ASN 20 N -0.46 3.15 0.63 5.90 2.20 0.38 -0.78 114.94 125.96 1on4 s ASN 20 Ca 0.07 0.35 0.41 0.00 -0.94 0.00 0.00 52.86 52.75 1on4 s ASN 20 Cb -0.09 -0.45 2.15 0.00 -2.00 0.00 0.00 41.25 40.86 1on4 s ASN 20 CO -0.01 -2.72 2.28 0.06 -2.94 0.00 0.00 177.10 173.78 1on4 h GLN 21 N -1.63 0.00 -0.57 3.55 -0.00 -0.67 0.21 115.11 116.00 1on4 h GLN 21 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.20 1on4 h GLN 21 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.73 1on4 h GLN 21 CO 0.41 0.01 0.00 -3.47 -0.00 0.00 0.00 178.83 175.78 1on4 n ASP 22 N -3.19 2.63 0.00 0.06 2.03 -1.26 -4.78 116.55 112.04 1on4 n ASP 22 Ca -0.02 -2.22 0.00 0.00 0.52 0.00 0.00 54.79 53.07 1on4 n ASP 22 Cb 0.12 -0.41 0.00 0.00 -0.72 0.00 0.00 41.12 40.11 1on4 n ASP 22 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1on4 n GLY 23 N 0.72 0.29 3.68 0.27 0.00 0.75 -4.94 105.19 105.96 1on4 n GLY 23 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1on4 n GLY 23 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1on4 s LYS 24 N -0.94 4.36 0.11 1.61 2.36 -1.23 -4.60 119.74 121.42 1on4 s LYS 24 Ca 0.00 1.18 -0.30 0.00 -2.55 0.00 0.00 55.97 54.30 1on4 s LYS 24 Cb 0.00 -3.55 -0.06 0.00 -1.05 0.00 0.00 37.83 33.16 1on4 s LYS 24 CO 0.00 -0.30 1.15 0.54 1.55 0.00 0.00 175.35 178.29 1on4 s ASN 25 N 1.11 7.16 -0.10 1.43 4.22 -1.26 -0.47 114.94 127.03 1on4 s ASN 25 Ca 0.43 2.04 -0.05 0.00 -2.14 0.00 0.00 52.86 53.14 1on4 s ASN 25 Cb -0.17 -2.59 0.05 0.00 1.28 0.00 0.00 41.25 39.81 1on4 s ASN 25 CO 0.15 -0.36 0.22 0.68 -2.04 0.00 0.00 177.10 175.75 1on4 s VAL 26 N 0.49 -0.08 0.35 3.54 -7.23 -0.04 -4.95 120.40 112.48 1on4 s VAL 26 Ca 0.54 0.17 -0.03 0.00 -1.81 0.00 0.00 61.98 60.85 1on4 s VAL 26 Cb -0.29 -0.35 -0.04 0.00 0.56 0.00 0.00 36.38 36.25 1on4 s VAL 26 CO 0.32 0.07 0.60 -0.44 -0.31 0.00 0.00 175.10 175.34 1on4 s SER 27 N 1.36 6.37 0.32 4.85 0.01 -1.26 -0.47 113.70 124.87 1on4 s SER 27 Ca -0.08 0.69 0.05 0.00 1.31 0.00 0.00 55.95 57.91 1on4 s SER 27 Cb -0.11 -2.13 0.67 0.00 0.21 0.00 0.00 66.02 64.66 1on4 s SER 27 CO -0.08 -0.31 1.86 0.25 0.41 0.00 0.00 173.24 175.38 1on4 h LEU 28 N 1.10 0.80 -2.25 2.44 5.85 -1.45 0.55 115.31 122.36 1on4 h LEU 28 Ca -0.48 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.31 1on4 h LEU 28 Cb 1.20 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.10 1on4 h LEU 28 CO 0.64 0.43 0.25 -0.33 -0.34 0.00 0.00 178.44 179.09 1on4 h GLU 29 N 0.86 0.00 0.00 1.25 3.07 -1.87 0.40 114.58 118.29 1on4 h GLU 29 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 1on4 h GLU 29 Cb 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 1on4 h GLU 29 CO -0.22 0.00 0.00 0.43 -1.40 0.00 0.00 179.01 177.82 1on4 n SER 30 N -3.26 0.00 0.00 1.42 7.64 0.19 -4.01 113.62 115.59 1on4 n SER 30 Ca -0.00 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.11 1on4 n SER 30 Cb 0.34 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 1on4 n SER 30 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1on4 n LEU 31 N -1.37 0.24 -4.60 -3.43 4.77 0.72 -4.99 117.00 108.34 1on4 n LEU 31 Ca 0.06 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.62 1on4 n LEU 31 Cb 0.16 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 1on4 n LEU 31 CO 0.14 0.04 1.41 -0.75 -1.33 0.00 0.00 177.39 176.90 1on4 s LYS 32 N -1.30 3.40 0.00 3.23 2.20 0.11 -0.60 119.74 126.78 1on4 s LYS 32 Ca 0.00 1.17 0.00 0.00 -0.36 0.00 0.00 55.97 56.78 1on4 s LYS 32 Cb 0.00 -4.13 0.00 0.00 -1.51 0.00 0.00 37.83 32.19 1on4 s LYS 32 CO 0.00 -1.78 0.00 0.41 -0.36 0.00 0.00 175.35 173.62 1on4 n GLY 33 N 5.29 2.31 3.97 5.54 0.00 0.12 -4.82 105.19 117.60 1on4 n GLY 33 Ca 0.20 -0.39 -0.19 0.00 0.00 0.00 0.00 46.02 45.64 1on4 n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1on4 s GLU 34 N 0.00 3.05 -1.14 1.61 8.01 0.23 -4.60 118.70 125.86 1on4 s GLU 34 Ca 0.00 -1.06 -0.09 0.00 0.01 0.00 0.00 54.97 53.83 1on4 s GLU 34 Cb 0.00 -2.76 0.26 0.00 -4.31 0.00 0.00 34.13 27.32 1on4 s GLU 34 CO 0.00 0.07 1.32 1.55 0.01 0.00 0.00 175.26 178.21 1on4 n VAL 35 N -1.60 4.69 -3.56 2.63 3.14 -1.26 -3.59 118.33 118.77 1on4 n VAL 35 Ca -0.00 -5.32 -0.35 0.00 -2.96 0.00 0.00 64.34 55.71 1on4 n VAL 35 Cb 0.58 -2.43 -0.05 0.00 -1.06 0.00 0.00 33.84 30.88 1on4 n VAL 35 CO 0.00 0.00 0.00 -1.66 -6.46 0.00 0.00 176.83 168.71 1on4 s TRP 36 N -1.01 3.58 0.34 1.45 1.48 -1.23 -4.72 118.94 118.82 1on4 s TRP 36 Ca 0.34 0.80 -0.04 0.00 -1.06 0.00 0.00 56.10 56.13 1on4 s TRP 36 Cb -0.04 -2.17 -0.05 0.00 -1.16 0.00 0.00 33.47 30.06 1on4 s TRP 36 CO -0.01 0.51 0.60 -0.51 -4.06 0.00 0.00 176.95 173.48 1on4 s LEU 37 N -1.93 3.97 0.00 -4.66 1.43 -0.09 -1.66 118.68 115.74 1on4 s LEU 37 Ca 0.33 0.73 0.01 0.00 -1.03 0.00 0.00 54.13 54.17 1on4 s LEU 37 Cb -0.14 -3.58 -0.00 0.00 0.03 0.00 0.00 46.19 42.50 1on4 s LEU 37 CO 0.18 -0.28 -0.02 0.00 0.23 0.00 0.00 176.35 176.45 1on4 s ALA 38 N -2.24 0.20 0.39 4.21 0.00 0.67 -0.21 121.76 124.78 1on4 s ALA 38 Ca 0.44 -0.14 0.05 0.00 0.00 0.00 0.00 51.96 52.31 1on4 s ALA 38 Cb -0.10 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 1on4 s ALA 38 CO 0.33 0.04 0.17 0.16 0.00 0.00 0.00 175.76 176.46 1on4 s ASP 39 N -0.16 2.48 -0.03 0.00 1.47 -0.37 -0.49 116.67 119.57 1on4 s ASP 39 Ca -0.00 -1.71 -0.12 0.00 1.18 0.00 0.00 52.55 51.90 1on4 s ASP 39 Cb -0.02 0.54 0.02 0.00 -0.34 0.00 0.00 42.92 43.13 1on4 s ASP 39 CO -0.00 -0.98 0.26 0.72 0.68 0.00 0.00 175.17 175.84 1on4 s PHE 40 N -3.28 -0.15 0.01 2.11 -0.12 -1.26 -1.56 117.98 113.72 1on4 s PHE 40 Ca 0.28 0.28 -0.06 0.00 -0.05 0.00 0.00 56.93 57.38 1on4 s PHE 40 Cb 0.02 0.06 -0.00 0.00 -0.63 0.00 0.00 43.02 42.47 1on4 s PHE 40 CO 0.18 -0.30 0.11 0.96 -0.05 0.00 0.00 175.22 176.12 1on4 s ILE 41 N -0.97 0.09 0.18 -4.49 -4.36 -0.12 -4.72 121.20 106.81 1on4 s ILE 41 Ca -0.10 -0.74 0.09 0.00 -0.26 0.00 0.00 60.65 59.63 1on4 s ILE 41 Cb -0.05 -0.42 -0.04 0.00 1.25 0.00 0.00 42.46 43.20 1on4 s ILE 41 CO 0.03 -0.41 -0.08 0.72 0.24 0.00 0.00 174.94 175.44 1on4 s PHE 42 N -1.44 2.67 0.00 1.37 -0.71 -1.26 -0.49 117.98 118.13 1on4 s PHE 42 Ca -0.15 -0.20 0.00 0.00 -1.04 0.00 0.00 56.93 55.54 1on4 s PHE 42 Cb -0.08 -1.30 0.00 0.00 -1.21 0.00 0.00 43.02 40.43 1on4 s PHE 42 CO 0.01 0.51 0.00 0.25 -1.34 0.00 0.00 175.22 174.65 1on4 n THR 43 N 0.01 0.00 -3.68 -4.49 -2.24 -1.26 -5.02 114.28 97.59 1on4 n THR 43 Ca -0.11 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.40 1on4 n THR 43 Cb 0.55 0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.82 1on4 n THR 43 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1on4 n ASN 44 N 0.00 -4.17 -4.26 3.42 2.85 -1.26 -4.97 115.26 106.86 1on4 n ASN 44 Ca 0.00 -0.96 -0.14 0.00 -0.11 0.00 0.00 54.58 53.36 1on4 n ASN 44 Cb 0.00 -3.59 -0.10 0.00 1.24 0.00 0.00 39.78 37.33 1on4 n ASN 44 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1on4 n GLU 46 N -0.36 0.00 -0.09 0.00 1.02 -1.26 -4.56 120.64 115.38 1on4 n GLU 46 Ca -0.00 0.27 -0.20 0.00 -0.02 0.00 0.00 57.16 57.21 1on4 n GLU 46 Cb 0.66 -1.11 -0.12 0.00 -0.02 0.00 0.00 31.44 30.85 1on4 n GLU 46 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1on4 h THR 47 N 0.00 1.14 -5.84 2.62 1.35 -2.02 -3.49 112.91 106.67 1on4 h THR 47 Ca 0.00 -2.22 -0.33 0.00 -0.55 0.00 0.00 66.41 63.30 1on4 h THR 47 Cb 0.00 2.53 0.14 0.00 -1.73 0.00 0.00 68.15 69.08 1on4 h THR 47 CO 0.00 0.39 -0.88 -0.38 -0.25 0.00 0.00 175.52 174.40 1on4 n ILE 48 N -4.47 -7.55 -0.12 6.82 -0.00 -1.26 -4.96 119.36 107.82 1on4 n ILE 48 Ca -0.26 -1.12 -0.06 0.00 -0.00 0.00 0.00 62.75 61.30 1on4 n ILE 48 Cb 0.63 -5.45 0.00 0.00 -0.00 0.00 0.00 39.64 34.83 1on4 n ILE 48 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1on4 s PRO 50 N -6.07 2.23 -0.39 0.00 0.04 -1.26 -4.88 135.00 124.67 1on4 s PRO 50 Ca -0.15 1.14 -0.05 0.00 0.04 0.00 0.00 61.00 61.99 1on4 s PRO 50 Cb 0.14 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.66 1on4 s PRO 50 CO 0.69 -1.65 2.40 -0.35 0.04 0.00 0.00 177.00 178.13 1on4 n PRO 51 N -3.52 1.68 -0.12 0.56 -0.04 -1.26 -4.77 135.00 127.52 1on4 n PRO 51 Ca 0.09 -0.99 -0.09 0.00 -0.04 0.00 0.00 63.50 62.47 1on4 n PRO 51 Cb 0.53 -2.08 -0.04 0.00 -0.04 0.00 0.00 33.50 31.88 1on4 n PRO 51 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1on4 h MET 52 N 4.84 -0.29 -0.06 0.54 4.05 -1.90 -0.79 114.93 121.32 1on4 h MET 52 Ca 0.28 0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.72 1on4 h MET 52 Cb 0.67 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.54 1on4 h MET 52 CO 0.77 -0.20 0.00 2.41 0.23 0.00 0.00 176.91 180.12 1on4 n THR 53 N -5.42 1.91 -0.01 -0.77 -1.04 -1.26 -4.69 114.28 102.99 1on4 n THR 53 Ca -0.00 -2.09 -0.19 0.00 -2.04 0.00 0.00 64.05 59.73 1on4 n THR 53 Cb 0.35 -0.19 -0.14 0.00 -1.82 0.00 0.00 70.33 68.53 1on4 n THR 53 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1on4 h ALA 54 N 0.42 0.05 -0.40 2.41 0.00 -1.51 -3.21 119.26 117.02 1on4 h ALA 54 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1on4 h ALA 54 Cb 1.06 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1on4 h ALA 54 CO 0.05 0.44 0.25 0.45 0.00 0.00 0.00 179.25 180.44 1on4 h HIS 55 N -0.59 0.52 -1.16 0.00 3.86 -1.82 0.24 115.15 116.19 1on4 h HIS 55 Ca -0.17 0.00 0.35 0.00 -1.16 0.00 0.00 60.37 59.39 1on4 h HIS 55 Cb 1.47 -0.17 -0.12 0.00 1.06 0.00 0.00 27.41 29.65 1on4 h HIS 55 CO 0.19 0.35 0.73 0.52 0.86 0.00 0.00 177.93 180.58 1on4 h MET 56 N 0.53 0.24 -0.05 2.45 2.86 -1.87 0.47 114.93 119.56 1on4 h MET 56 Ca 0.14 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.65 1on4 h MET 56 Cb -0.02 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 31.59 1on4 h MET 56 CO -0.03 0.16 -0.43 1.79 1.06 0.00 0.00 176.91 179.46 1on4 h THR 57 N 0.24 1.43 -0.72 2.22 1.35 -0.58 0.32 112.91 117.17 1on4 h THR 57 Ca 0.72 -1.88 0.14 0.00 -0.55 0.00 0.00 66.41 64.84 1on4 h THR 57 Cb 2.01 2.44 -0.09 0.00 -1.73 0.00 0.00 68.15 70.77 1on4 h THR 57 CO -0.40 0.54 0.25 -0.78 -0.25 0.00 0.00 175.52 174.88 1on4 h ASP 58 N -0.13 0.20 -0.07 5.36 3.58 -0.53 -0.10 116.42 124.73 1on4 h ASP 58 Ca -0.04 0.11 -0.16 0.00 0.42 0.00 0.00 57.03 57.37 1on4 h ASP 58 Cb 1.11 0.11 -0.01 0.00 1.72 0.00 0.00 39.33 42.27 1on4 h ASP 58 CO 0.09 0.07 -0.49 -0.07 -2.88 0.00 0.00 179.24 175.96 1on4 h LEU 59 N 0.39 0.69 -0.89 2.28 4.07 -0.88 -2.84 115.31 118.13 1on4 h LEU 59 Ca 0.39 -0.35 0.17 0.00 0.08 0.00 0.00 57.88 58.17 1on4 h LEU 59 Cb 0.60 -0.20 -0.10 0.00 1.08 0.00 0.00 40.66 42.05 1on4 h LEU 59 CO -0.41 1.07 0.47 -0.61 -1.08 0.00 0.00 178.44 177.88 1on4 h GLN 60 N 0.50 0.61 -0.83 1.13 5.75 0.14 0.28 115.11 122.69 1on4 h GLN 60 Ca 0.02 -0.04 0.07 0.00 -0.15 0.00 0.00 58.65 58.56 1on4 h GLN 60 Cb 1.04 -0.14 -0.07 0.00 1.07 0.00 0.00 27.48 29.38 1on4 h GLN 60 CO 0.10 0.40 0.50 -0.22 -2.65 0.00 0.00 178.83 176.96 1on4 h LYS 61 N 0.63 0.85 -0.01 1.69 3.64 -0.93 0.28 116.57 122.73 1on4 h LYS 61 Ca 0.50 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.83 1on4 h LYS 61 Cb 0.76 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1on4 h LYS 61 CO -0.39 0.56 -0.00 0.87 -2.27 0.00 0.00 179.45 178.22 1on4 h LYS 62 N 0.88 0.01 -0.99 1.90 6.56 -0.80 -3.25 116.57 120.87 1on4 h LYS 62 Ca 0.38 -0.00 0.27 0.00 -1.06 0.00 0.00 60.65 60.24 1on4 h LYS 62 Cb 0.25 -0.00 -0.13 0.00 -0.57 0.00 0.00 32.23 31.77 1on4 h LYS 62 CO -0.20 0.40 0.56 -0.07 -2.06 0.00 0.00 179.45 178.07 1on4 h LEU 63 N -0.37 0.56 -1.88 2.94 -0.00 0.14 0.23 115.31 116.92 1on4 h LEU 63 Ca 0.00 0.16 0.29 0.00 -0.00 0.00 0.00 57.88 58.33 1on4 h LEU 63 Cb 0.39 0.09 -0.05 0.00 -0.00 0.00 0.00 40.66 41.09 1on4 h LEU 63 CO 0.00 -0.01 0.73 0.11 -0.00 0.00 0.00 178.44 179.27 1on4 h LYS 64 N 0.45 0.08 -0.09 1.13 1.79 -1.00 0.66 116.57 119.58 1on4 h LYS 64 Ca 0.67 -0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 58.89 1on4 h LYS 64 Cb 1.39 -0.02 0.01 0.00 -1.58 0.00 0.00 32.23 32.03 1on4 h LYS 64 CO -0.54 0.05 -0.89 0.00 -1.08 0.00 0.00 179.45 177.00 1on4 h ALA 65 N 1.51 0.23 0.00 3.86 0.00 -0.71 -3.31 119.26 120.84 1on4 h ALA 65 Ca 0.51 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1on4 h ALA 65 Cb 1.87 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.67 1on4 h ALA 65 CO -0.06 0.68 0.00 0.93 0.00 0.00 0.00 179.25 180.81 1on4 h GLU 66 N 0.49 0.00 0.00 0.00 4.39 -0.49 -3.39 114.58 115.58 1on4 h GLU 66 Ca -0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1on4 h GLU 66 Cb 1.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.18 1on4 h GLU 66 CO 0.18 0.00 0.29 -2.95 -1.16 0.00 0.00 179.01 175.36 1on4 h ASN 67 N 0.00 0.00 0.00 1.42 -1.07 0.05 -3.38 115.58 112.60 1on4 h ASN 67 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 1on4 h ASN 67 Cb 0.79 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.04 1on4 h ASN 67 CO 0.00 0.00 0.00 -0.38 0.07 0.00 0.00 177.43 177.12 1on4 n ILE 68 N -2.62 0.00 -3.23 6.14 -0.00 -1.26 -0.70 119.36 117.69 1on4 n ILE 68 Ca -0.02 0.00 -0.22 0.00 -0.00 0.00 0.00 62.75 62.51 1on4 n ILE 68 Cb 0.32 0.00 -0.07 0.00 -0.00 0.00 0.00 39.64 39.89 1on4 n ILE 68 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1on4 n ASP 69 N -1.31 -1.04 -4.10 4.38 -0.08 -1.26 -5.13 116.55 108.01 1on4 n ASP 69 Ca 0.00 -2.54 -0.11 0.00 -1.51 0.00 0.00 54.79 50.63 1on4 n ASP 69 Cb 0.00 -0.06 -0.11 0.00 2.34 0.00 0.00 41.12 43.29 1on4 n ASP 69 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1on4 s VAL 70 N 0.09 0.55 0.18 5.18 -7.23 0.13 -4.74 120.40 114.55 1on4 s VAL 70 Ca 0.33 -1.44 0.05 0.00 -1.81 0.00 0.00 61.98 59.11 1on4 s VAL 70 Cb 0.05 -1.05 -0.05 0.00 0.56 0.00 0.00 36.38 35.90 1on4 s VAL 70 CO -0.16 -0.62 -0.08 -0.13 -0.31 0.00 0.00 175.10 173.80 1on4 s ARG 71 N -2.57 1.19 -0.50 4.82 0.52 -1.26 -4.55 118.95 116.60 1on4 s ARG 71 Ca -0.01 -1.54 -0.13 0.00 -0.52 0.00 0.00 55.73 53.52 1on4 s ARG 71 Cb -0.03 -0.72 0.11 0.00 0.52 0.00 0.00 34.95 34.83 1on4 s ARG 71 CO -0.02 0.05 0.41 -1.50 0.02 0.00 0.00 175.30 174.26 1on4 s ILE 72 N -3.28 4.87 0.51 1.52 2.07 -0.35 -0.92 121.20 125.62 1on4 s ILE 72 Ca 0.21 -1.47 -0.18 0.00 -1.41 0.00 0.00 60.65 57.80 1on4 s ILE 72 Cb 0.03 -4.08 -0.07 0.00 0.13 0.00 0.00 42.46 38.47 1on4 s ILE 72 CO 0.04 -0.75 1.01 -0.63 -1.91 0.00 0.00 174.94 172.70 1on4 s ILE 73 N 1.53 4.20 -0.29 2.00 1.09 0.71 -2.37 121.20 128.07 1on4 s ILE 73 Ca 0.04 1.16 -0.01 0.00 -1.10 0.00 0.00 60.65 60.74 1on4 s ILE 73 Cb -0.27 -3.57 0.13 0.00 -1.06 0.00 0.00 42.46 37.69 1on4 s ILE 73 CO 0.03 -0.50 0.26 -0.55 -0.10 0.00 0.00 174.94 174.08 1on4 s SER 74 N -2.66 2.04 0.30 3.58 0.15 -0.16 -1.24 113.70 115.70 1on4 s SER 74 Ca 0.62 -0.88 -0.08 0.00 0.70 0.00 0.00 55.95 56.31 1on4 s SER 74 Cb -0.12 0.34 -0.06 0.00 -1.71 0.00 0.00 66.02 64.46 1on4 s SER 74 CO 0.28 -0.40 0.60 0.72 1.20 0.00 0.00 173.24 175.64 1on4 s PHE 75 N 2.29 3.46 -0.35 3.44 -0.12 -0.60 -0.84 117.98 125.25 1on4 s PHE 75 Ca 0.09 0.81 -0.29 0.00 -0.05 0.00 0.00 56.93 57.50 1on4 s PHE 75 Cb -0.14 -2.23 0.01 0.00 -0.63 0.00 0.00 43.02 40.02 1on4 s PHE 75 CO -0.33 0.14 1.26 0.45 -0.05 0.00 0.00 175.22 176.69 1on4 s SER 76 N -2.89 6.65 -0.63 1.98 0.15 0.70 -0.95 113.70 118.70 1on4 s SER 76 Ca 0.47 1.00 -0.28 0.00 0.70 0.00 0.00 55.95 57.84 1on4 s SER 76 Cb -0.11 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 61.68 1on4 s SER 76 CO 0.27 -1.14 1.32 -0.69 1.20 0.00 0.00 173.24 174.20 1on4 s VAL 77 N 4.46 3.81 -0.11 4.45 1.01 0.36 -4.37 120.40 130.02 1on4 s VAL 77 Ca 0.54 0.63 -0.02 0.00 0.00 0.00 0.00 61.98 63.13 1on4 s VAL 77 Cb -0.14 -4.68 0.00 0.00 0.00 0.00 0.00 36.38 31.56 1on4 s VAL 77 CO 0.25 -1.46 0.13 -0.67 0.00 0.00 0.00 175.10 173.35 1on4 n ASP 78 N 9.31 -3.18 -0.08 3.32 -0.08 -1.26 -4.24 116.55 120.35 1on4 n ASP 78 Ca 0.08 0.06 0.00 0.00 -1.51 0.00 0.00 54.79 53.42 1on4 n ASP 78 Cb 0.49 -1.87 0.01 0.00 2.34 0.00 0.00 41.12 42.09 1on4 n ASP 78 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1on4 n PRO 79 N -0.75 1.07 0.05 -0.67 -0.04 -1.26 -1.01 135.00 132.39 1on4 n PRO 79 Ca 0.01 -0.10 -0.06 0.00 -0.04 0.00 0.00 63.50 63.32 1on4 n PRO 79 Cb 0.26 -1.05 -0.04 0.00 -0.04 0.00 0.00 33.50 32.63 1on4 n PRO 79 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1on4 h GLU 80 N 0.15 -0.22 0.05 0.54 4.81 -1.93 -3.36 114.58 114.62 1on4 h GLU 80 Ca 0.00 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1on4 h GLU 80 Cb 0.07 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1on4 h GLU 80 CO 0.00 0.00 -0.02 -0.91 -0.73 0.00 0.00 179.01 177.35 1on4 h ASN 81 N -1.02 -0.06 0.17 1.04 2.35 -1.95 -3.42 115.58 112.70 1on4 h ASN 81 Ca -0.02 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 1on4 h ASN 81 Cb 0.33 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1on4 h ASN 81 CO 0.04 0.28 -0.08 -0.78 -1.65 0.00 0.00 177.43 175.24 1on4 h ASP 82 N -0.70 -0.20 -3.99 5.81 1.82 -1.32 -3.50 116.42 114.34 1on4 h ASP 82 Ca -0.01 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1on4 h ASP 82 Cb 0.05 0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.11 1on4 h ASP 82 CO 0.01 -0.09 0.00 0.29 -1.61 0.00 0.00 179.24 177.84 1on4 n LYS 83 N -2.91 0.00 -0.34 0.28 5.02 -1.25 -4.52 118.16 114.44 1on4 n LYS 83 Ca -0.03 0.00 0.21 0.00 -2.02 0.00 0.00 58.31 56.48 1on4 n LYS 83 Cb 0.09 0.00 0.46 0.00 -0.02 0.00 0.00 35.03 35.56 1on4 n LYS 83 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1on4 h PRO 84 N 0.00 0.44 0.00 1.97 0.13 -1.91 0.32 132.00 132.95 1on4 h PRO 84 Ca 0.00 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1on4 h PRO 84 Cb 0.00 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.03 1on4 h PRO 84 CO 0.00 0.29 -0.04 0.87 -0.23 0.00 0.00 178.00 178.89 1on4 h LYS 85 N 0.45 0.00 -0.32 0.86 6.56 -1.88 0.11 116.57 122.35 1on4 h LYS 85 Ca 0.64 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 60.19 1on4 h LYS 85 Cb 1.46 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 33.10 1on4 h LYS 85 CO -0.40 0.04 0.04 1.96 -2.06 0.00 0.00 179.45 179.03 1on4 h GLN 86 N 0.00 0.55 -0.25 3.15 1.08 -1.16 -0.35 115.11 118.13 1on4 h GLN 86 Ca -0.00 -0.16 0.03 0.00 -1.45 0.00 0.00 58.65 57.07 1on4 h GLN 86 Cb 0.40 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.75 1on4 h GLN 86 CO 0.01 0.65 0.08 -0.07 -0.95 0.00 0.00 178.83 178.55 1on4 h LEU 87 N 0.37 0.09 -0.34 1.46 3.38 -1.09 -0.74 115.31 118.43 1on4 h LEU 87 Ca 0.10 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1on4 h LEU 87 Cb 0.38 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1on4 h LEU 87 CO 0.01 0.08 0.14 0.50 0.09 0.00 0.00 178.44 179.27 1on4 h LYS 88 N 0.19 0.51 -0.51 1.13 3.64 -0.76 0.27 116.57 121.05 1on4 h LYS 88 Ca 0.11 -0.09 0.06 0.00 -1.27 0.00 0.00 60.65 59.46 1on4 h LYS 88 Cb 0.08 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.76 1on4 h LYS 88 CO -0.12 0.49 0.22 0.87 -2.27 0.00 0.00 179.45 178.65 1on4 h LYS 89 N 0.41 0.42 -0.67 1.90 6.56 -0.94 0.19 116.57 124.44 1on4 h LYS 89 Ca 0.12 -0.03 0.01 0.00 -1.06 0.00 0.00 60.65 59.69 1on4 h LYS 89 Cb 0.17 -0.09 -0.03 0.00 -0.57 0.00 0.00 32.23 31.70 1on4 h LYS 89 CO -0.01 0.28 0.45 0.35 -2.06 0.00 0.00 179.45 178.45 1on4 h PHE 90 N 0.43 0.84 -0.06 -1.35 3.57 -0.58 -2.08 116.94 117.71 1on4 h PHE 90 Ca 0.24 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 1on4 h PHE 90 Cb 0.20 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1on4 h PHE 90 CO -0.13 0.53 -0.19 0.00 -2.23 0.00 0.00 178.31 176.29 1on4 h ALA 91 N 1.25 1.57 0.00 2.41 0.00 0.20 0.17 119.26 124.86 1on4 h ALA 91 Ca 0.25 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1on4 h ALA 91 Cb -0.10 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1on4 h ALA 91 CO -0.06 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.51 1on4 h ALA 92 N 1.72 1.00 0.00 0.00 0.00 0.05 -3.33 119.26 118.70 1on4 h ALA 92 Ca 0.02 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 1on4 h ALA 92 Cb 0.39 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1on4 h ALA 92 CO 0.03 0.00 -1.62 0.09 0.00 0.00 0.00 179.25 177.75 1on4 n ASN 93 N -2.55 1.94 -4.69 0.00 3.02 0.20 -4.92 115.26 108.26 1on4 n ASN 93 Ca 0.01 0.35 -0.44 0.00 -0.03 0.00 0.00 54.58 54.47 1on4 n ASN 93 Cb 0.24 -0.79 -0.04 0.00 -0.61 0.00 0.00 39.78 38.59 1on4 n ASN 93 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1on4 n TYR 94 N -4.38 2.48 -1.97 3.10 4.02 0.35 -4.83 117.16 115.92 1on4 n TYR 94 Ca -0.31 0.08 -0.39 0.00 -0.01 0.00 0.00 57.90 57.27 1on4 n TYR 94 Cb 0.66 -2.63 -0.03 0.00 -0.02 0.00 0.00 39.34 37.32 1on4 n TYR 94 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1on4 n PRO 95 N 4.45 2.41 -4.12 -0.72 -0.04 -1.26 -4.77 135.00 130.95 1on4 n PRO 95 Ca 0.18 -2.65 -0.28 0.00 -0.04 0.00 0.00 63.50 60.71 1on4 n PRO 95 Cb 0.32 -3.39 -0.02 0.00 -0.04 0.00 0.00 33.50 30.37 1on4 n PRO 95 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1on4 s LEU 96 N 4.71 2.56 -0.06 1.53 0.05 -1.26 -4.79 118.68 121.42 1on4 s LEU 96 Ca 0.56 -1.37 0.02 0.00 0.05 0.00 0.00 54.13 53.39 1on4 s LEU 96 Cb 0.07 -1.05 0.02 0.00 -2.05 0.00 0.00 46.19 43.19 1on4 s LEU 96 CO 0.06 -1.07 -0.08 -0.55 -0.55 0.00 0.00 176.35 174.16 1on4 s SER 97 N -4.19 1.36 0.63 1.48 0.15 -1.26 -5.03 113.70 106.83 1on4 s SER 97 Ca 0.26 -0.21 0.39 0.00 0.70 0.00 0.00 55.95 57.09 1on4 s SER 97 Cb -0.01 -0.64 2.10 0.00 -1.71 0.00 0.00 66.02 65.76 1on4 s SER 97 CO 0.16 -0.01 2.27 -0.26 1.20 0.00 0.00 173.24 176.60 1on4 h PHE 98 N 7.09 0.00 0.00 3.44 0.04 -1.97 -3.41 116.94 122.14 1on4 h PHE 98 Ca -0.34 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.43 1on4 h PHE 98 Cb 1.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.32 1on4 h PHE 98 CO 0.49 0.01 0.00 -3.47 -0.60 0.00 0.00 178.31 174.75 1on4 n ASP 99 N -3.25 0.00 -2.74 2.17 -0.08 -1.26 -0.55 116.55 110.84 1on4 n ASP 99 Ca -0.02 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.11 1on4 n ASP 99 Cb 0.12 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.59 1on4 n ASP 99 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1on4 n ASN 100 N -1.49 2.12 -3.92 1.67 6.94 -1.26 -5.02 115.26 114.30 1on4 n ASN 100 Ca 0.00 -3.01 -0.31 0.00 -0.02 0.00 0.00 54.58 51.24 1on4 n ASN 100 Cb 0.00 -0.54 -0.15 0.00 -2.36 0.00 0.00 39.78 36.73 1on4 n ASN 100 CO 0.00 0.00 0.00 0.86 -1.03 0.00 0.00 177.26 177.09 1on4 s TRP 101 N -3.09 2.79 -0.55 -2.53 -0.11 0.29 -1.21 118.94 114.52 1on4 s TRP 101 Ca 0.35 -2.28 -0.17 0.00 1.22 0.00 0.00 56.10 55.22 1on4 s TRP 101 Cb 0.42 -2.18 0.12 0.00 -1.50 0.00 0.00 33.47 30.33 1on4 s TRP 101 CO -0.04 -0.88 0.54 -0.51 -4.62 0.00 0.00 176.95 171.44 1on4 s ASP 102 N 1.25 6.19 -0.70 5.86 1.01 -1.00 -4.85 116.67 124.42 1on4 s ASP 102 Ca 0.05 -1.69 -0.27 0.00 0.71 0.00 0.00 52.55 51.35 1on4 s ASP 102 Cb -0.18 -2.23 0.02 0.00 1.01 0.00 0.00 42.92 41.54 1on4 s ASP 102 CO -0.12 -0.90 1.32 -0.36 0.21 0.00 0.00 175.17 175.32 1on4 s PHE 103 N 1.83 2.27 0.08 4.23 0.08 -1.26 -0.99 117.98 124.22 1on4 s PHE 103 Ca 0.05 0.11 -0.16 0.00 0.12 0.00 0.00 56.93 57.05 1on4 s PHE 103 Cb -0.28 -4.56 -0.06 0.00 -0.57 0.00 0.00 43.02 37.54 1on4 s PHE 103 CO 0.04 -2.03 0.51 -0.51 -0.10 0.00 0.00 175.22 173.13 1on4 s LEU 104 N 5.93 4.44 0.00 -0.37 1.43 -0.02 0.10 118.68 130.19 1on4 s LEU 104 Ca 0.40 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.58 1on4 s LEU 104 Cb -0.08 -2.95 0.00 0.00 0.03 0.00 0.00 46.19 43.19 1on4 s LEU 104 CO 0.17 0.22 0.00 0.35 0.23 0.00 0.00 176.35 177.33 1on4 n THR 105 N 1.37 0.00 0.00 5.49 -2.24 0.04 -0.22 114.28 118.72 1on4 n THR 105 Ca -0.09 0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1on4 n THR 105 Cb 0.52 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.53 1on4 n THR 105 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1on4 n GLY 106 N 2.08 2.30 5.01 3.38 0.00 -1.25 -4.56 105.19 112.15 1on4 n GLY 106 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1on4 n GLY 106 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1on4 n TYR 107 N 0.00 0.00 -1.68 1.61 4.01 -1.26 -4.58 117.16 115.26 1on4 n TYR 107 Ca 0.00 0.00 -0.47 0.00 -0.16 0.00 0.00 57.90 57.27 1on4 n TYR 107 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 1on4 n TYR 107 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1on4 n SER 108 N 0.94 3.49 -0.30 7.72 3.41 -1.26 -4.48 113.62 123.13 1on4 n SER 108 Ca 0.00 0.99 -0.08 0.00 -0.26 0.00 0.00 58.87 59.53 1on4 n SER 108 Cb 0.00 -1.41 -0.04 0.00 -0.26 0.00 0.00 64.21 62.50 1on4 n SER 108 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1on4 h GLN 109 N 8.50 -0.12 -0.93 4.33 7.50 -1.96 0.46 115.11 132.89 1on4 h GLN 109 Ca -0.48 0.01 0.20 0.00 0.50 0.00 0.00 58.65 58.88 1on4 h GLN 109 Cb 1.26 0.03 -0.18 0.00 0.05 0.00 0.00 27.48 28.64 1on4 h GLN 109 CO 0.93 -0.08 -0.19 0.77 -1.50 0.00 0.00 178.83 178.76 1on4 h SER 110 N -0.12 -0.80 0.68 1.46 0.02 -1.93 0.56 113.55 113.42 1on4 h SER 110 Ca 0.21 0.28 -0.03 0.00 -0.84 0.00 0.00 61.79 61.40 1on4 h SER 110 Cb 0.53 0.56 0.01 0.00 0.14 0.00 0.00 62.40 63.64 1on4 h SER 110 CO -0.83 -0.31 -0.33 -0.08 -1.14 0.00 0.00 176.83 174.15 1on4 h GLU 111 N 0.00 -0.88 -0.15 3.45 4.22 -1.18 -0.92 114.58 119.13 1on4 h GLU 111 Ca 0.46 0.06 -0.07 0.00 0.08 0.00 0.00 59.36 59.89 1on4 h GLU 111 Cb 0.75 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1on4 h GLU 111 CO -0.94 -0.59 -0.23 0.97 -2.18 0.00 0.00 179.01 176.04 1on4 h ILE 112 N -1.16 1.23 0.24 2.32 6.09 -1.19 -2.58 117.51 122.45 1on4 h ILE 112 Ca -0.09 -1.07 -0.01 0.00 -1.37 0.00 0.00 64.86 62.32 1on4 h ILE 112 Cb 0.70 1.37 0.00 0.00 0.47 0.00 0.00 36.82 39.36 1on4 h ILE 112 CO 0.15 0.33 -0.12 -0.08 -3.07 0.00 0.00 178.15 175.37 1on4 h GLU 113 N 0.24 -0.31 -0.22 2.19 4.22 0.17 0.23 114.58 121.11 1on4 h GLU 113 Ca 0.04 0.02 0.05 0.00 0.08 0.00 0.00 59.36 59.55 1on4 h GLU 113 Cb 0.54 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 1on4 h GLU 113 CO 0.04 -0.21 -0.08 1.49 -2.18 0.00 0.00 179.01 178.07 1on4 h GLU 114 N -0.35 -0.04 -0.12 1.92 4.81 -1.14 0.29 114.58 119.95 1on4 h GLU 114 Ca -0.03 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1on4 h GLU 114 Cb 0.25 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.57 1on4 h GLU 114 CO 0.05 -0.02 -0.51 0.35 -0.73 0.00 0.00 179.01 178.15 1on4 h PHE 115 N -0.04 -1.50 0.00 0.92 3.57 -1.53 0.09 116.94 118.45 1on4 h PHE 115 Ca 0.11 0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 1on4 h PHE 115 Cb 0.20 0.67 -0.01 0.00 2.79 0.00 0.00 35.95 39.60 1on4 h PHE 115 CO -0.25 -0.53 -0.34 0.00 -2.23 0.00 0.00 178.31 174.96 1on4 h ALA 116 N -0.19 1.11 0.71 2.41 0.00 0.58 0.13 119.26 124.00 1on4 h ALA 116 Ca 0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1on4 h ALA 116 Cb 0.68 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.42 1on4 h ALA 116 CO -0.42 0.42 -0.34 1.25 0.00 0.00 0.00 179.25 180.16 1on4 h LEU 117 N 0.00 -0.81 -0.52 0.00 7.12 -0.16 0.23 115.31 121.18 1on4 h LEU 117 Ca -0.00 0.03 0.06 0.00 0.13 0.00 0.00 57.88 58.09 1on4 h LEU 117 Cb 0.77 0.21 -0.05 0.00 -0.53 0.00 0.00 40.66 41.06 1on4 h LEU 117 CO 0.04 -0.46 0.23 0.50 -0.13 0.00 0.00 178.44 178.62 1on4 h LYS 118 N -1.19 0.43 0.06 1.25 1.63 -0.67 -1.92 116.57 116.17 1on4 h LYS 118 Ca -0.10 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 1on4 h LYS 118 Cb 0.73 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 32.25 1on4 h LYS 118 CO 0.16 0.29 -0.17 1.03 -3.45 0.00 0.00 179.45 177.30 1on4 h SER 119 N 0.45 -0.52 0.00 4.20 0.87 -0.86 -3.42 113.55 114.28 1on4 h SER 119 Ca 0.24 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 1on4 h SER 119 Cb 0.20 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 1on4 h SER 119 CO -0.20 -0.19 -0.15 0.49 -0.53 0.00 0.00 176.83 176.25 1on4 n PHE 120 N -3.42 -1.02 -0.37 2.24 3.72 0.47 -4.73 117.46 114.35 1on4 n PHE 120 Ca -0.03 0.18 0.00 0.00 -0.05 0.00 0.00 57.45 57.55 1on4 n PHE 120 Cb 0.14 0.34 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 1on4 n PHE 120 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1on4 n LYS 121 N -3.20 0.00 -3.07 -1.08 0.00 0.53 -4.92 118.16 106.42 1on4 n LYS 121 Ca 0.00 0.05 -0.18 0.00 -0.00 0.00 0.00 58.31 58.18 1on4 n LYS 121 Cb 0.07 -0.37 -0.02 0.00 -0.00 0.00 0.00 35.03 34.72 1on4 n LYS 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1on4 n ALA 122 N -0.32 1.35 -2.69 0.58 0.00 -1.14 -4.96 120.51 113.32 1on4 n ALA 122 Ca 0.00 -2.88 0.00 0.00 0.00 0.00 0.00 53.44 50.56 1on4 n ALA 122 Cb 0.12 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1on4 n ALA 122 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1on4 n ILE 123 N 0.89 0.00 0.37 0.00 -5.35 -1.26 -4.81 119.36 109.20 1on4 n ILE 123 Ca 0.19 0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.50 1on4 n ILE 123 Cb 0.61 -1.03 -0.08 0.00 -1.74 0.00 0.00 39.64 37.40 1on4 n ILE 123 CO 0.00 0.00 0.00 -0.37 -1.76 0.00 0.00 176.55 174.42 1on4 h VAL 124 N -0.02 0.21 -1.12 7.28 -1.51 -1.93 -3.43 116.25 115.73 1on4 h VAL 124 Ca 0.00 -0.18 0.00 0.00 -1.23 0.00 0.00 66.70 65.29 1on4 h VAL 124 Cb 0.00 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 29.41 1on4 h VAL 124 CO 0.00 0.02 0.00 0.29 -1.23 0.00 0.00 177.57 176.65 1on4 n LYS 125 N -5.45 3.58 -2.94 5.19 4.01 -1.26 -4.92 118.16 116.37 1on4 n LYS 125 Ca -0.13 0.00 -0.11 0.00 -0.51 0.00 0.00 58.31 57.56 1on4 n LYS 125 Cb 0.39 0.00 0.01 0.00 -0.51 0.00 0.00 35.03 34.92 1on4 n LYS 125 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1on4 n LYS 126 N 0.00 -2.45 -1.39 1.97 5.02 -1.26 -4.82 118.16 115.23 1on4 n LYS 126 Ca 0.00 2.10 -0.43 0.00 -2.02 0.00 0.00 58.31 57.96 1on4 n LYS 126 Cb 0.00 -4.88 -0.03 0.00 -0.02 0.00 0.00 35.03 30.09 1on4 n LYS 126 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1on4 n PRO 127 N -0.02 2.03 0.26 1.97 -0.04 -1.26 -4.65 135.00 133.29 1on4 n PRO 127 Ca 0.06 -2.15 0.09 0.00 -0.04 0.00 0.00 63.50 61.47 1on4 n PRO 127 Cb 0.41 -3.07 0.69 0.00 -0.04 0.00 0.00 33.50 31.49 1on4 n PRO 127 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1on4 h GLU 128 N 7.19 0.00 0.00 0.54 5.08 -1.95 -3.46 114.58 121.98 1on4 h GLU 128 Ca 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 1on4 h GLU 128 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1on4 h GLU 128 CO 1.93 0.03 0.00 0.41 -1.00 0.00 0.00 179.01 180.38 1on4 n GLY 129 N -1.39 1.83 1.40 -3.84 0.00 -1.26 -4.52 105.19 97.42 1on4 n GLY 129 Ca -0.03 0.19 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 1on4 n GLY 129 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1on4 n GLU 130 N 0.00 1.11 0.00 1.61 1.02 -1.26 -3.39 120.64 119.73 1on4 n GLU 130 Ca 0.00 -0.22 0.00 0.00 -0.02 0.00 0.00 57.16 56.92 1on4 n GLU 130 Cb 0.00 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 1on4 n GLU 130 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1on4 n ASP 131 N 1.03 0.00 -3.51 1.62 2.03 -1.26 -5.02 116.55 111.44 1on4 n ASP 131 Ca 0.04 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 54.95 1on4 n ASP 131 Cb 0.53 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1on4 n ASP 131 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1on4 n GLN 132 N 0.00 4.64 0.00 -0.67 1.13 -1.26 -3.69 117.38 117.53 1on4 n GLN 132 Ca 0.00 -3.57 0.00 0.00 -1.94 0.00 0.00 57.00 51.49 1on4 n GLN 132 Cb 0.00 -2.63 0.00 0.00 0.11 0.00 0.00 30.24 27.72 1on4 n GLN 132 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1on4 n VAL 133 N 1.63 0.00 0.00 5.09 0.31 -1.23 -4.93 118.33 119.20 1on4 n VAL 133 Ca 0.60 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.93 1on4 n VAL 133 Cb 0.25 -0.52 0.00 0.00 -0.91 0.00 0.00 33.84 32.67 1on4 n VAL 133 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1on4 n ILE 134 N -2.29 0.00 -1.99 2.52 5.41 -1.22 -4.79 119.36 117.00 1on4 n ILE 134 Ca 0.00 1.34 0.00 0.00 1.00 0.00 0.00 62.75 65.09 1on4 n ILE 134 Cb 0.13 -2.17 0.00 0.00 -0.71 0.00 0.00 39.64 36.88 1on4 n ILE 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1on4 n HIS 135 N -1.82 0.00 -1.25 1.39 1.44 -1.26 -5.16 115.22 108.55 1on4 n HIS 135 Ca 0.00 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.41 1on4 n HIS 135 Cb 0.00 0.10 0.14 0.00 0.12 0.00 0.00 29.99 30.34 1on4 n HIS 135 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1on4 s GLN 136 N 0.00 1.22 -0.48 -1.40 -0.21 -1.26 -4.94 119.66 112.59 1on4 s GLN 136 Ca 0.00 0.73 0.06 0.00 0.02 0.00 0.00 55.36 56.17 1on4 s GLN 136 Cb 0.00 -1.81 0.20 0.00 1.00 0.00 0.00 33.01 32.40 1on4 s GLN 136 CO 0.00 -2.24 0.64 0.45 -2.12 0.00 0.00 175.29 172.02 1on4 n SER 137 N -3.87 -2.33 -4.82 5.90 2.88 -1.26 -4.90 113.62 105.22 1on4 n SER 137 Ca 0.07 -2.83 -0.32 0.00 -1.33 0.00 0.00 58.87 54.45 1on4 n SER 137 Cb 0.56 1.00 -0.01 0.00 -0.75 0.00 0.00 64.21 65.01 1on4 n SER 137 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1on4 s SER 138 N 0.07 6.09 -0.02 -3.46 1.04 -1.26 -4.72 113.70 111.44 1on4 s SER 138 Ca 0.31 1.72 -0.02 0.00 0.48 0.00 0.00 55.95 58.44 1on4 s SER 138 Cb 0.06 -2.52 -0.04 0.00 0.10 0.00 0.00 66.02 63.62 1on4 s SER 138 CO -0.13 -0.95 0.14 -0.36 0.98 0.00 0.00 173.24 172.93 1on4 s PHE 139 N -2.53 3.47 -0.04 5.02 0.08 0.67 -4.26 117.98 120.40 1on4 s PHE 139 Ca 0.62 0.33 -0.01 0.00 0.12 0.00 0.00 56.93 57.98 1on4 s PHE 139 Cb -0.14 -1.81 0.03 0.00 -0.57 0.00 0.00 43.02 40.53 1on4 s PHE 139 CO 0.35 0.62 0.08 0.71 -0.10 0.00 0.00 175.22 176.88 1on4 s TYR 140 N -1.25 -0.05 -0.39 0.36 1.51 0.36 -1.20 117.35 116.69 1on4 s TYR 140 Ca 0.24 0.26 -0.17 0.00 -1.01 0.00 0.00 57.07 56.40 1on4 s TYR 140 Cb -0.12 -0.16 0.01 0.00 -0.11 0.00 0.00 41.96 41.57 1on4 s TYR 140 CO 0.15 -0.11 0.45 -1.17 -1.11 0.00 0.00 175.55 173.76 1on4 s LEU 141 N 1.04 4.63 -0.06 -1.29 0.20 0.38 -0.24 118.68 123.35 1on4 s LEU 141 Ca -0.08 -0.42 -0.23 0.00 0.69 0.00 0.00 54.13 54.09 1on4 s LEU 141 Cb -0.12 -2.44 -0.04 0.00 -0.43 0.00 0.00 46.19 43.16 1on4 s LEU 141 CO -0.04 -0.52 0.68 -0.69 -0.29 0.00 0.00 176.35 175.49 1on4 s VAL 142 N 2.22 5.04 1.15 1.68 1.01 -0.66 -1.94 120.40 128.89 1on4 s VAL 142 Ca 0.14 1.41 -0.19 0.00 0.00 0.00 0.00 61.98 63.34 1on4 s VAL 142 Cb -0.16 -4.02 0.28 0.00 0.00 0.00 0.00 36.38 32.48 1on4 s VAL 142 CO 0.14 0.27 1.07 0.61 0.00 0.00 0.00 175.10 177.18 1on4 n GLY 143 N 3.05 -2.64 0.21 4.51 0.00 0.93 -3.52 105.19 107.72 1on4 n GLY 143 Ca -0.02 -1.51 -0.07 0.00 0.00 0.00 0.00 46.02 44.41 1on4 n GLY 143 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1on4 h PRO 144 N 0.00 -0.47 -2.80 1.61 0.13 -1.81 -3.27 132.00 125.38 1on4 h PRO 144 Ca -0.40 0.03 -0.52 0.00 -0.87 0.00 0.00 66.00 64.25 1on4 h PRO 144 Cb 1.20 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1on4 h PRO 144 CO 0.26 -0.31 2.69 -0.40 -0.23 0.00 0.00 178.00 180.00 1on4 n ASP 145 N -4.20 7.47 0.00 1.44 5.75 -1.26 0.12 116.55 125.87 1on4 n ASP 145 Ca -0.06 -2.51 0.00 0.00 -0.01 0.00 0.00 54.79 52.21 1on4 n ASP 145 Cb 0.19 -1.46 0.00 0.00 -1.03 0.00 0.00 41.12 38.82 1on4 n ASP 145 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1on4 n GLY 146 N 3.33 1.73 3.72 6.12 0.00 -1.23 -4.93 105.19 113.92 1on4 n GLY 146 Ca 0.66 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.27 1on4 n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1on4 s LYS 147 N 0.00 4.57 0.17 1.61 -2.85 -1.26 -0.86 119.74 121.12 1on4 s LYS 147 Ca 0.00 1.53 -0.30 0.00 -1.00 0.00 0.00 55.97 56.20 1on4 s LYS 147 Cb 0.00 -3.40 -0.07 0.00 -2.06 0.00 0.00 37.83 32.30 1on4 s LYS 147 CO 0.00 -0.02 1.03 0.08 0.10 0.00 0.00 175.35 176.54 1on4 s VAL 148 N 0.67 4.08 -0.07 1.79 1.01 0.53 -0.05 120.40 128.37 1on4 s VAL 148 Ca 0.52 1.84 0.01 0.00 0.00 0.00 0.00 61.98 64.34 1on4 s VAL 148 Cb -0.24 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 31.92 1on4 s VAL 148 CO 0.29 0.33 -0.06 0.18 0.00 0.00 0.00 175.10 175.85 1on4 n LEU 149 N 2.27 2.87 -3.77 3.92 4.77 -0.82 -1.93 117.00 124.31 1on4 n LEU 149 Ca 0.01 -0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.83 1on4 n LEU 149 Cb 0.47 -0.22 -0.11 0.00 -2.33 0.00 0.00 43.42 41.23 1on4 n LEU 149 CO 0.52 0.59 -0.03 -0.54 -1.33 0.00 0.00 177.39 176.61 1on4 s LYS 150 N -2.14 0.35 0.03 3.23 1.02 -1.24 -0.77 119.74 120.23 1on4 s LYS 150 Ca -0.09 0.43 0.02 0.00 0.02 0.00 0.00 55.97 56.35 1on4 s LYS 150 Cb 0.02 0.17 -0.02 0.00 -0.52 0.00 0.00 37.83 37.48 1on4 s LYS 150 CO 0.16 -0.05 -0.07 -0.51 -0.92 0.00 0.00 175.35 173.97 1on4 s ASP 151 N 0.19 0.73 0.06 2.83 1.11 -1.26 -0.47 116.67 119.87 1on4 s ASP 151 Ca -0.00 -0.42 -0.12 0.00 0.18 0.00 0.00 52.55 52.18 1on4 s ASP 151 Cb -0.02 0.01 0.01 0.00 1.07 0.00 0.00 42.92 44.00 1on4 s ASP 151 CO 0.00 -0.14 0.28 -0.31 1.18 0.00 0.00 175.17 176.18 1on4 s TYR 152 N -1.05 -0.04 -0.09 4.23 1.51 -0.34 -1.00 117.35 120.58 1on4 s TYR 152 Ca -0.07 -0.21 -0.08 0.00 -1.01 0.00 0.00 57.07 55.70 1on4 s TYR 152 Cb -0.08 0.06 -0.04 0.00 -0.11 0.00 0.00 41.96 41.79 1on4 s TYR 152 CO 0.00 -0.53 -0.18 -1.71 -1.11 0.00 0.00 175.55 172.02 1on4 n ASN 153 N 0.33 1.31 0.00 2.29 5.15 1.00 -0.24 115.26 125.11 1on4 n ASN 153 Ca -0.17 0.21 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 1on4 n ASN 153 Cb 0.61 -0.49 0.00 0.00 -0.53 0.00 0.00 39.78 39.36 1on4 n ASN 153 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1on4 n GLY 154 N 2.29 1.38 0.00 8.20 0.00 -0.05 -4.50 105.19 112.51 1on4 n GLY 154 Ca -0.17 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1on4 n GLY 154 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1on4 n VAL 155 N 0.00 0.00 -2.47 1.61 0.31 -1.26 -2.11 118.33 114.42 1on4 n VAL 155 Ca 0.00 1.09 -0.43 0.00 -0.01 0.00 0.00 64.34 64.99 1on4 n VAL 155 Cb 0.00 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.10 1on4 n VAL 155 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1on4 n GLU 156 N -1.07 3.24 0.00 5.55 4.71 -1.26 -4.91 120.64 126.91 1on4 n GLU 156 Ca 0.00 -3.34 0.00 0.00 -0.01 0.00 0.00 57.16 53.81 1on4 n GLU 156 Cb 0.00 -3.24 0.00 0.00 -1.01 0.00 0.00 31.44 27.19 1on4 n GLU 156 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1on4 n ASN 157 N 6.44 0.00 0.00 1.62 3.02 -0.89 -4.84 115.26 120.60 1on4 n ASN 157 Ca 0.45 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.00 1on4 n ASN 157 Cb 0.42 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 1on4 n ASN 157 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1on4 n THR 158 N 0.00 0.00 0.00 3.41 -1.04 -1.26 -0.88 114.28 114.51 1on4 n THR 158 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1on4 n THR 158 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1on4 n THR 158 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1on4 n PRO 159 N 0.00 0.00 0.00 -2.82 -0.04 -1.26 -0.00 135.00 130.88 1on4 n PRO 159 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1on4 n PRO 159 Cb 0.00 -0.19 0.00 0.00 -0.04 0.00 0.00 33.50 33.27 1on4 n PRO 159 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1on4 n TYR 160 N 0.00 0.00 -0.10 0.54 4.01 -1.25 -0.59 117.16 119.77 1on4 n TYR 160 Ca 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.68 1on4 n TYR 160 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1on4 n TYR 160 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1on4 h ASP 161 N 0.00 -0.60 0.90 7.72 3.32 -1.41 0.85 116.42 127.19 1on4 h ASP 161 Ca 0.00 0.14 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 1on4 h ASP 161 Cb 0.00 0.32 0.01 0.00 0.22 0.00 0.00 39.33 39.88 1on4 h ASP 161 CO 0.00 -0.21 -0.43 -2.24 -1.72 0.00 0.00 179.24 174.64 1on4 h ASP 162 N -0.12 -1.02 0.59 6.45 2.03 -1.86 0.11 116.42 122.59 1on4 h ASP 162 Ca 0.18 0.03 -0.03 0.00 -0.73 0.00 0.00 57.03 56.48 1on4 h ASP 162 Cb 0.39 0.26 0.01 0.00 -0.83 0.00 0.00 39.33 39.16 1on4 h ASP 162 CO -0.43 -0.72 -0.28 0.40 -1.03 0.00 0.00 179.24 177.18 1on4 h ILE 163 N -1.24 0.41 -0.33 4.15 2.04 -1.91 0.11 117.51 120.75 1on4 h ILE 163 Ca -0.12 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1on4 h ILE 163 Cb 0.93 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 1on4 h ILE 163 CO 0.20 0.01 0.19 0.40 0.00 0.00 0.00 178.15 178.95 1on4 h ILE 164 N -0.84 1.12 -0.15 -0.67 5.03 -0.91 -0.46 117.51 120.64 1on4 h ILE 164 Ca -0.08 -0.31 0.05 0.00 -0.12 0.00 0.00 64.86 64.39 1on4 h ILE 164 Cb 0.62 0.74 -0.05 0.00 -3.03 0.00 0.00 36.82 35.10 1on4 h ILE 164 CO 0.13 0.13 -0.17 -1.28 -0.68 0.00 0.00 178.15 176.28 1on4 h SER 165 N 0.41 -0.52 0.18 1.72 0.87 -0.60 0.19 113.55 115.80 1on4 h SER 165 Ca 0.12 0.10 0.01 0.00 -1.23 0.00 0.00 61.79 60.79 1on4 h SER 165 Cb 0.04 0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.22 1on4 h SER 165 CO -0.02 -0.21 -0.28 -0.78 -0.53 0.00 0.00 176.83 175.00 1on4 h ASP 166 N -0.20 -0.80 -0.51 6.23 3.58 -0.44 0.41 116.42 124.69 1on4 h ASP 166 Ca 0.10 0.09 -0.09 0.00 0.42 0.00 0.00 57.03 57.55 1on4 h ASP 166 Cb 0.35 0.29 -0.02 0.00 1.72 0.00 0.00 39.33 41.67 1on4 h ASP 166 CO -0.27 -0.39 -0.01 0.58 -2.88 0.00 0.00 179.24 176.28 1on4 h VAL 167 N -0.54 1.26 -0.24 2.25 2.07 -0.85 0.75 116.25 120.95 1on4 h VAL 167 Ca 0.02 -1.10 -0.13 0.00 0.82 0.00 0.00 66.70 66.31 1on4 h VAL 167 Cb 0.54 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1on4 h VAL 167 CO -0.13 0.40 -0.38 0.11 0.02 0.00 0.00 177.57 177.58 1on4 h LYS 168 N 0.87 0.55 0.63 1.57 6.56 -0.41 0.15 116.57 126.49 1on4 h LYS 168 Ca 0.16 -0.27 -0.02 0.00 -1.06 0.00 0.00 60.65 59.46 1on4 h LYS 168 Cb 0.52 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.17 1on4 h LYS 168 CO 0.03 0.84 -0.48 1.03 -2.06 0.00 0.00 179.45 178.81 1on4 h SER 169 N 0.46 -1.26 -0.98 0.86 0.87 0.50 0.13 113.55 114.13 1on4 h SER 169 Ca 0.04 0.09 0.20 0.00 -1.23 0.00 0.00 61.79 60.88 1on4 h SER 169 Cb 0.87 0.39 -0.09 0.00 -0.44 0.00 0.00 62.40 63.13 1on4 h SER 169 CO 0.07 -0.69 0.61 0.00 -0.53 0.00 0.00 176.83 176.30 1on4 h ALA 170 N -0.92 1.87 0.35 6.23 0.00 -0.84 -0.48 119.26 125.47 1on4 h ALA 170 Ca -0.08 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1on4 h ALA 170 Cb 0.89 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1on4 h ALA 170 CO 0.02 -0.21 -0.24 0.77 0.00 0.00 0.00 179.25 179.59 1on4 h SER 171 N 0.65 -0.62 0.00 0.00 0.02 -0.05 -3.45 113.55 110.10 1on4 h SER 171 Ca 0.54 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.52 1on4 h SER 171 Cb 1.00 0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.72 1on4 h SER 171 CO -0.31 -0.36 -0.02 1.07 -1.14 0.00 0.00 176.83 176.08 1on4 n THR 172 N -3.80 0.00 -3.37 -2.27 5.66 -0.13 -4.95 114.28 105.43 1on4 n THR 172 Ca -0.07 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.69 1on4 n THR 172 Cb 0.24 0.04 0.02 0.00 -1.55 0.00 0.00 70.33 69.07 1on4 n THR 172 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1on4 n LEU 173 N 0.00 -2.13 0.00 1.09 4.32 0.25 -4.95 117.00 115.59 1on4 n LEU 173 Ca -0.02 -0.43 0.00 0.00 -0.02 0.00 0.00 56.01 55.54 1on4 n LEU 173 Cb 0.20 -2.49 0.00 0.00 -1.62 0.00 0.00 43.42 39.51 1on4 n LEU 173 CO -0.01 0.25 0.00 0.29 -1.22 0.00 0.00 177.39 176.70