#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1on4 s MET 2 N 0.00 0.44 -1.61 1.57 1.00 -1.26 -4.90 119.30 114.53 1on4 s MET 2 Ca 0.00 -0.69 -0.17 0.00 0.00 0.00 0.00 55.69 54.83 1on4 s MET 2 Cb 0.00 0.16 0.14 0.00 0.00 0.00 0.00 34.83 35.13 1on4 s MET 2 CO 0.00 -0.09 0.78 1.28 0.00 0.00 0.00 175.02 177.00 1on4 n LEU 3 N 1.19 -1.80 -0.04 -0.03 4.77 -1.26 -4.85 117.00 114.97 1on4 n LEU 3 Ca -0.21 -0.88 -0.09 0.00 -0.03 0.00 0.00 56.01 54.79 1on4 n LEU 3 Cb 0.57 -2.16 -0.03 0.00 -2.33 0.00 0.00 43.42 39.47 1on4 n LEU 3 CO 0.22 0.30 0.92 -0.33 -1.33 0.00 0.00 177.39 177.17 1on4 h GLU 4 N -1.51 0.19 -1.08 3.23 5.08 -2.06 0.83 114.58 119.25 1on4 h GLU 4 Ca -0.56 -0.01 -0.59 0.00 -1.00 0.00 0.00 59.36 57.19 1on4 h GLU 4 Cb 1.37 -0.04 -0.40 0.00 0.50 0.00 0.00 28.75 30.17 1on4 h GLU 4 CO 0.73 0.13 -0.46 -0.89 -1.00 0.00 0.00 179.01 177.52 1on4 n ILE 5 N -5.01 2.69 -2.83 3.13 -0.00 -1.26 -5.09 119.36 110.99 1on4 n ILE 5 Ca -0.03 -4.27 0.00 0.00 -0.00 0.00 0.00 62.75 58.46 1on4 n ILE 5 Cb 0.06 -1.19 0.00 0.00 -0.00 0.00 0.00 39.64 38.51 1on4 n ILE 5 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 1on4 n LYS 6 N -0.66 0.00 -3.60 0.38 5.02 0.28 -4.31 118.16 115.27 1on4 n LYS 6 Ca 0.46 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.48 1on4 n LYS 6 Cb 0.80 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.70 1on4 n LYS 6 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1on4 n ASP 7 N -0.13 1.81 -3.71 4.39 5.68 -1.26 -4.73 116.55 118.61 1on4 n ASP 7 Ca 0.00 -2.95 -0.42 0.00 -0.50 0.00 0.00 54.79 50.92 1on4 n ASP 7 Cb 0.00 -0.67 -0.00 0.00 -1.14 0.00 0.00 41.12 39.31 1on4 n ASP 7 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 1on4 n PRO 8 N 1.97 3.20 -1.73 0.11 -0.04 -1.26 -4.89 135.00 132.36 1on4 n PRO 8 Ca 0.25 -2.82 -0.38 0.00 -0.04 0.00 0.00 63.50 60.50 1on4 n PRO 8 Cb 0.42 -3.12 0.05 0.00 -0.04 0.00 0.00 33.50 30.81 1on4 n PRO 8 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1on4 n LEU 9 N 5.10 5.50 -2.86 1.53 -0.00 -1.26 -4.95 117.00 120.07 1on4 n LEU 9 Ca 0.52 0.94 -0.11 0.00 -0.00 0.00 0.00 56.01 57.35 1on4 n LEU 9 Cb 0.36 -1.56 0.05 0.00 -0.00 0.00 0.00 43.42 42.27 1on4 n LEU 9 CO 0.87 -0.75 0.11 0.59 -0.00 0.00 0.00 177.39 178.20 1on4 n ASN 10 N -1.16 -0.62 -4.46 1.45 3.02 -0.96 -4.12 115.26 108.40 1on4 n ASN 10 Ca 0.12 -3.09 -0.43 0.00 -0.03 0.00 0.00 54.58 51.14 1on4 n ASN 10 Cb 0.45 0.54 -0.04 0.00 -0.61 0.00 0.00 39.78 40.13 1on4 n ASN 10 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1on4 s TYR 11 N -1.17 2.71 -0.40 3.10 5.04 -0.69 -4.70 117.35 121.23 1on4 s TYR 11 Ca 0.29 -0.46 -0.29 0.00 -2.44 0.00 0.00 57.07 54.17 1on4 s TYR 11 Cb 0.36 -4.22 0.01 0.00 0.35 0.00 0.00 41.96 38.46 1on4 s TYR 11 CO -0.05 -1.57 1.30 -1.21 -1.34 0.00 0.00 175.55 172.68 1on4 s GLU 12 N 3.98 3.70 -0.06 4.97 2.02 -1.26 -0.94 118.70 131.11 1on4 s GLU 12 Ca 0.23 0.91 -0.30 0.00 0.02 0.00 0.00 54.97 55.83 1on4 s GLU 12 Cb -0.16 -3.95 -0.02 0.00 0.10 0.00 0.00 34.13 30.09 1on4 s GLU 12 CO 0.12 -1.40 1.09 0.14 0.02 0.00 0.00 175.26 175.22 1on4 s VAL 13 N 4.89 4.55 0.34 2.63 -7.23 -0.10 -4.85 120.40 120.63 1on4 s VAL 13 Ca 0.56 1.84 -0.28 0.00 -1.81 0.00 0.00 61.98 62.29 1on4 s VAL 13 Cb -0.12 -4.18 -0.10 0.00 0.56 0.00 0.00 36.38 32.54 1on4 s VAL 13 CO 0.30 0.03 1.27 -1.61 -0.31 0.00 0.00 175.10 174.78 1on4 s GLU 14 N 1.91 4.30 0.58 4.82 2.02 -1.26 -4.81 118.70 126.25 1on4 s GLU 14 Ca 0.52 2.13 -0.18 0.00 0.02 0.00 0.00 54.97 57.46 1on4 s GLU 14 Cb -0.22 -3.00 -0.07 0.00 0.10 0.00 0.00 34.13 30.94 1on4 s GLU 14 CO 0.21 -0.20 0.69 -2.30 0.02 0.00 0.00 175.26 173.68 1on4 n PRO 15 N 0.67 0.65 -3.74 0.39 -0.02 -1.26 -4.89 135.00 126.79 1on4 n PRO 15 Ca 0.01 0.25 -0.02 0.00 -2.02 0.00 0.00 63.50 61.72 1on4 n PRO 15 Cb 0.43 -1.88 -0.01 0.00 -0.02 0.00 0.00 33.50 32.03 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 -1.64 -0.07 -0.08 6.00 5.36 -1.26 -4.99 117.98 121.30 1on4 s PHE 16 Ca 0.72 -0.19 0.05 0.00 -0.96 0.00 0.00 56.93 56.55 1on4 s PHE 16 Cb -0.44 0.62 -0.00 0.00 -0.34 0.00 0.00 43.02 42.86 1on4 s PHE 16 CO 0.51 -0.68 -0.24 0.99 -1.46 0.00 0.00 175.22 174.34 1on4 s THR 17 N -2.88 1.99 0.33 0.12 2.01 -1.26 -1.36 115.64 114.59 1on4 s THR 17 Ca 0.14 -1.01 0.06 0.00 0.31 0.00 0.00 61.69 61.20 1on4 s THR 17 Cb 0.00 -1.70 -0.07 0.00 0.01 0.00 0.00 72.50 70.74 1on4 s THR 17 CO 0.01 0.55 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.11 1on4 s PHE 18 N 0.10 2.17 -0.08 4.92 0.08 0.33 -4.99 117.98 120.51 1on4 s PHE 18 Ca -0.11 -0.72 0.02 0.00 0.12 0.00 0.00 56.93 56.24 1on4 s PHE 18 Cb -0.16 -1.37 -0.02 0.00 -0.57 0.00 0.00 43.02 40.91 1on4 s PHE 18 CO 0.06 0.31 -0.14 -0.65 -0.10 0.00 0.00 175.22 174.69 1on4 s GLN 19 N -3.74 2.88 0.79 0.44 -0.21 -1.26 -1.08 119.66 117.48 1on4 s GLN 19 Ca 0.33 -0.70 -0.12 0.00 0.02 0.00 0.00 55.36 54.89 1on4 s GLN 19 Cb 0.06 -2.47 0.07 0.00 1.00 0.00 0.00 33.01 31.67 1on4 s GLN 19 CO 0.15 0.44 1.14 0.54 -2.12 0.00 0.00 175.29 175.44 1on4 s ASN 20 N -0.24 4.67 0.11 5.90 2.20 0.58 -1.00 114.94 127.16 1on4 s ASN 20 Ca 0.01 0.97 0.21 0.00 -0.94 0.00 0.00 52.86 53.11 1on4 s ASN 20 Cb -0.13 -1.60 0.84 0.00 -2.00 0.00 0.00 41.25 38.36 1on4 s ASN 20 CO 0.03 -1.82 1.64 0.00 -2.94 0.00 0.00 177.10 174.01 1on4 n GLN 21 N -3.29 0.10 -0.50 3.55 -0.00 0.71 -0.42 117.38 117.53 1on4 n GLN 21 Ca 0.07 0.28 0.01 0.00 -0.00 0.00 0.00 57.00 57.36 1on4 n GLN 21 Cb 0.59 -1.67 0.19 0.00 -0.00 0.00 0.00 30.24 29.36 1on4 n GLN 21 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1on4 n ASP 22 N -1.84 3.48 -1.25 2.61 8.00 -1.26 -4.86 116.55 121.42 1on4 n ASP 22 Ca 0.04 -2.55 -0.14 0.00 0.71 0.00 0.00 54.79 52.84 1on4 n ASP 22 Cb 0.24 -0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 40.68 1on4 n ASP 22 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1on4 n GLY 23 N 0.20 0.98 3.34 0.44 0.00 0.44 -4.96 105.19 105.64 1on4 n GLY 23 Ca 0.18 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.65 3.37 0.18 1.61 2.36 -1.20 -4.85 119.74 117.56 1on4 s LYS 24 Ca 0.00 -0.67 -0.30 0.00 -2.55 0.00 0.00 55.97 52.45 1on4 s LYS 24 Cb 0.00 -2.76 -0.07 0.00 -1.05 0.00 0.00 37.83 33.95 1on4 s LYS 24 CO 0.00 0.06 1.07 -0.80 1.55 0.00 0.00 175.35 177.23 1on4 s ASN 25 N 0.75 7.33 -0.09 1.43 -0.87 -1.26 -0.31 114.94 121.93 1on4 s ASN 25 Ca -0.04 2.04 -0.06 0.00 -1.57 0.00 0.00 52.86 53.22 1on4 s ASN 25 Cb -0.15 -2.60 0.03 0.00 -0.02 0.00 0.00 41.25 38.51 1on4 s ASN 25 CO 0.01 -0.16 0.21 0.68 -2.57 0.00 0.00 177.10 175.27 1on4 s VAL 26 N -0.31 -0.02 0.31 1.60 -7.23 -0.24 -4.93 120.40 109.58 1on4 s VAL 26 Ca 0.48 0.07 0.08 0.00 -1.81 0.00 0.00 61.98 60.80 1on4 s VAL 26 Cb -0.28 -0.32 -0.03 0.00 0.56 0.00 0.00 36.38 36.31 1on4 s VAL 26 CO 0.34 0.03 0.21 -0.44 -0.31 0.00 0.00 175.10 174.93 1on4 s SER 27 N 0.61 5.15 0.26 4.85 0.01 -1.26 -0.51 113.70 122.80 1on4 s SER 27 Ca -0.04 -0.50 -0.02 0.00 1.31 0.00 0.00 55.95 56.70 1on4 s SER 27 Cb -0.06 -1.03 0.48 0.00 0.21 0.00 0.00 66.02 65.63 1on4 s SER 27 CO -0.03 -0.22 1.79 0.25 0.41 0.00 0.00 173.24 175.43 1on4 h LEU 28 N 1.44 0.63 -0.97 2.44 5.85 -1.60 0.83 115.31 123.93 1on4 h LEU 28 Ca -0.45 0.07 0.24 0.00 0.84 0.00 0.00 57.88 58.58 1on4 h LEU 28 Cb 1.25 -0.04 -0.13 0.00 0.37 0.00 0.00 40.66 42.11 1on4 h LEU 28 CO 0.60 0.32 0.53 -0.33 -0.34 0.00 0.00 178.44 179.21 1on4 h GLU 29 N 0.73 0.49 0.00 1.25 4.39 -1.94 0.13 114.58 119.63 1on4 h GLU 29 Ca 0.44 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.11 1on4 h GLU 29 Cb 0.52 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1on4 h GLU 29 CO -0.31 0.32 0.00 0.43 -1.16 0.00 0.00 179.01 178.30 1on4 n SER 30 N -4.95 0.00 0.00 1.42 7.64 0.28 -1.17 113.62 116.85 1on4 n SER 30 Ca 0.26 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.43 1on4 n SER 30 Cb 0.73 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 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 -1.34 0.86 -4.62 -3.43 4.77 0.39 -4.94 117.00 108.69 1on4 n LEU 31 Ca 0.02 -0.86 -0.42 0.00 -0.03 0.00 0.00 56.01 54.72 1on4 n LEU 31 Cb 0.04 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.08 1on4 n LEU 31 CO 0.04 0.22 0.58 -0.75 -1.33 0.00 0.00 177.39 176.14 1on4 s LYS 32 N -0.12 4.02 0.00 3.23 2.20 -0.31 -1.94 119.74 126.80 1on4 s LYS 32 Ca 0.00 0.64 0.00 0.00 -0.36 0.00 0.00 55.97 56.25 1on4 s LYS 32 Cb 0.00 -3.70 0.00 0.00 -1.51 0.00 0.00 37.83 32.62 1on4 s LYS 32 CO 0.00 -0.62 0.00 0.41 -0.36 0.00 0.00 175.35 174.78 1on4 n GLY 33 N 4.12 2.40 3.89 5.54 0.00 0.12 -4.98 105.19 116.28 1on4 n GLY 33 Ca 0.03 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 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 3.70 -1.22 1.61 8.01 -0.82 -4.59 118.70 125.39 1on4 s GLU 34 Ca 0.00 0.13 -0.12 0.00 0.01 0.00 0.00 54.97 54.99 1on4 s GLU 34 Cb 0.00 -2.64 0.18 0.00 -4.31 0.00 0.00 34.13 27.37 1on4 s GLU 34 CO 0.00 0.24 1.54 1.55 0.01 0.00 0.00 175.26 178.61 1on4 n VAL 35 N -0.64 4.35 -3.28 2.63 3.14 -1.26 -3.14 118.33 120.12 1on4 n VAL 35 Ca -0.01 -4.74 -0.35 0.00 -2.96 0.00 0.00 64.34 56.29 1on4 n VAL 35 Cb 0.53 -2.43 -0.06 0.00 -1.06 0.00 0.00 33.84 30.83 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 0.81 3.60 0.30 1.45 1.48 -0.73 -4.73 118.94 121.10 1on4 s TRP 36 Ca 0.40 1.14 -0.06 0.00 -1.06 0.00 0.00 56.10 56.53 1on4 s TRP 36 Cb 0.01 -2.44 -0.06 0.00 -1.16 0.00 0.00 33.47 29.82 1on4 s TRP 36 CO 0.00 0.38 0.58 -0.51 -4.06 0.00 0.00 176.95 173.34 1on4 s LEU 37 N -2.06 4.04 -0.05 -4.66 1.43 -0.30 -0.55 118.68 116.53 1on4 s LEU 37 Ca 0.40 0.79 0.00 0.00 -1.03 0.00 0.00 54.13 54.29 1on4 s LEU 37 Cb -0.15 -3.60 0.02 0.00 0.03 0.00 0.00 46.19 42.49 1on4 s LEU 37 CO 0.20 -0.21 -0.03 0.00 0.23 0.00 0.00 176.35 176.54 1on4 s ALA 38 N -2.09 0.66 -0.46 4.21 0.00 0.66 -0.17 121.76 124.56 1on4 s ALA 38 Ca 0.45 -0.06 0.07 0.00 0.00 0.00 0.00 51.96 52.41 1on4 s ALA 38 Cb -0.11 -0.52 0.24 0.00 0.00 0.00 0.00 23.12 22.74 1on4 s ALA 38 CO 0.29 -0.16 0.79 -0.40 0.00 0.00 0.00 175.76 176.28 1on4 n ASP 39 N 4.40 -2.10 -4.80 0.00 5.68 -0.33 -0.01 116.55 119.39 1on4 n ASP 39 Ca -0.20 -3.13 -0.35 0.00 -0.50 0.00 0.00 54.79 50.61 1on4 n ASP 39 Cb 0.50 1.17 -0.05 0.00 -1.14 0.00 0.00 41.12 41.60 1on4 n ASP 39 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 1on4 s PHE 40 N 0.21 3.33 0.23 2.11 -0.12 -1.26 -4.55 117.98 117.92 1on4 s PHE 40 Ca 0.33 1.65 -0.16 0.00 -0.05 0.00 0.00 56.93 58.70 1on4 s PHE 40 Cb 0.21 -2.99 0.01 0.00 -0.63 0.00 0.00 43.02 39.62 1on4 s PHE 40 CO -0.21 -0.33 0.53 0.96 -0.05 0.00 0.00 175.22 176.12 1on4 s ILE 41 N -1.85 0.01 0.11 -4.49 -5.25 -0.93 -4.84 121.20 103.95 1on4 s ILE 41 Ca 0.59 -1.11 0.07 0.00 -0.99 0.00 0.00 60.65 59.21 1on4 s ILE 41 Cb -0.17 -1.93 -0.04 0.00 2.95 0.00 0.00 42.46 43.27 1on4 s ILE 41 CO 0.21 -0.06 -0.11 0.72 -1.79 0.00 0.00 174.94 173.92 1on4 s PHE 42 N -3.95 2.71 -0.03 1.37 -0.71 -1.26 -1.92 117.98 114.20 1on4 s PHE 42 Ca 0.15 -0.17 0.07 0.00 -1.04 0.00 0.00 56.93 55.95 1on4 s PHE 42 Cb -0.02 -1.41 -0.11 0.00 -1.21 0.00 0.00 43.02 40.27 1on4 s PHE 42 CO 0.04 0.43 0.12 -2.37 -1.34 0.00 0.00 175.22 172.10 1on4 n THR 43 N 0.66 0.16 -1.60 -4.49 5.66 -1.26 -4.86 114.28 108.55 1on4 n THR 43 Ca -0.13 -0.22 -0.24 0.00 -3.05 0.00 0.00 64.05 60.40 1on4 n THR 43 Cb 0.53 -0.04 -0.10 0.00 -1.55 0.00 0.00 70.33 69.17 1on4 n THR 43 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1on4 n ASN 44 N -1.93 1.98 -3.98 1.09 4.05 -1.26 -4.80 115.26 110.41 1on4 n ASN 44 Ca -0.05 -2.58 -0.10 0.00 0.45 0.00 0.00 54.58 52.31 1on4 n ASN 44 Cb 0.38 -1.56 -0.07 0.00 1.23 0.00 0.00 39.78 39.75 1on4 n ASN 44 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1on4 n GLU 46 N -0.19 0.00 -1.96 0.00 2.13 -1.26 -4.66 120.64 114.70 1on4 n GLU 46 Ca -0.07 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.50 1on4 n GLU 46 Cb 0.63 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 32.28 1on4 n GLU 46 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 1on4 s THR 47 N 0.44 3.39 -0.66 6.31 -4.23 -1.26 -4.84 115.64 114.78 1on4 s THR 47 Ca 0.00 -0.52 -0.21 0.00 -1.18 0.00 0.00 61.69 59.78 1on4 s THR 47 Cb 0.00 -4.13 -0.17 0.00 1.34 0.00 0.00 72.50 69.54 1on4 s THR 47 CO 0.00 -0.77 1.88 -0.38 -0.54 0.00 0.00 174.62 174.81 1on4 n ILE 48 N 8.08 1.60 0.01 2.99 -0.00 -1.26 -4.58 119.36 126.19 1on4 n ILE 48 Ca 0.43 -1.32 -0.18 0.00 -0.00 0.00 0.00 62.75 61.68 1on4 n ILE 48 Cb 0.46 -2.24 -0.12 0.00 -0.00 0.00 0.00 39.64 37.75 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 -3.01 3.10 -0.93 0.00 0.04 -1.26 -4.90 135.00 128.04 1on4 s PRO 50 Ca -0.13 0.90 -0.20 0.00 0.04 0.00 0.00 61.00 61.61 1on4 s PRO 50 Cb 0.03 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 32.44 1on4 s PRO 50 CO 0.82 -0.97 2.00 -0.35 0.04 0.00 0.00 177.00 178.54 1on4 n PRO 51 N -3.04 1.82 0.02 0.56 -0.04 -1.26 -4.73 135.00 128.33 1on4 n PRO 51 Ca 0.07 -2.02 -0.01 0.00 -0.04 0.00 0.00 63.50 61.50 1on4 n PRO 51 Cb 0.54 -3.00 -0.00 0.00 -0.04 0.00 0.00 33.50 30.99 1on4 n PRO 51 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1on4 h MET 52 N 7.44 -0.05 -0.48 0.54 2.86 -1.92 -3.36 114.93 119.95 1on4 h MET 52 Ca 0.46 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.10 1on4 h MET 52 Cb 0.66 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.33 1on4 h MET 52 CO 1.94 -0.04 0.00 2.41 1.06 0.00 0.00 176.91 182.29 1on4 n THR 53 N -2.19 0.72 0.48 2.22 -1.04 -1.26 -4.34 114.28 108.87 1on4 n THR 53 Ca -0.01 -0.86 -0.20 0.00 -2.04 0.00 0.00 64.05 60.95 1on4 n THR 53 Cb 0.02 0.76 -0.09 0.00 -1.82 0.00 0.00 70.33 69.20 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 3.88 -1.23 -0.42 2.41 0.00 -1.91 -0.25 119.26 121.75 1on4 h ALA 54 Ca 0.00 -0.27 0.09 0.00 0.00 0.00 0.00 54.91 54.73 1on4 h ALA 54 Cb 0.92 0.47 -0.09 0.00 0.00 0.00 0.00 17.79 19.09 1on4 h ALA 54 CO 0.00 -1.17 -0.24 0.45 0.00 0.00 0.00 179.25 178.29 1on4 h HIS 55 N -1.26 -0.63 -0.80 0.00 3.86 -1.76 0.41 115.15 114.97 1on4 h HIS 55 Ca -0.13 0.05 0.19 0.00 -1.16 0.00 0.00 60.37 59.33 1on4 h HIS 55 Cb 0.94 0.34 -0.13 0.00 1.06 0.00 0.00 27.41 29.62 1on4 h HIS 55 CO -0.00 -0.32 0.13 0.52 0.86 0.00 0.00 177.93 179.11 1on4 h MET 56 N -0.16 0.17 -0.16 2.45 2.86 -1.78 0.11 114.93 118.42 1on4 h MET 56 Ca 0.20 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.80 1on4 h MET 56 Cb 0.47 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 1on4 h MET 56 CO -0.52 0.11 -0.02 1.15 1.06 0.00 0.00 176.91 178.70 1on4 h THR 57 N 0.17 1.27 -0.45 2.22 2.02 0.15 0.20 112.91 118.50 1on4 h THR 57 Ca 0.47 -0.93 0.07 0.00 0.77 0.00 0.00 66.41 66.80 1on4 h THR 57 Cb 0.87 1.56 -0.06 0.00 -1.74 0.00 0.00 68.15 68.78 1on4 h THR 57 CO -0.64 0.28 0.08 0.44 0.37 0.00 0.00 175.52 176.05 1on4 h ASP 58 N 0.02 -0.01 -0.50 4.18 3.32 0.04 -1.09 116.42 122.38 1on4 h ASP 58 Ca 0.04 0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 1on4 h ASP 58 Cb 0.43 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1on4 h ASP 58 CO 0.01 0.03 0.01 -0.07 -1.72 0.00 0.00 179.24 177.50 1on4 h LEU 59 N 0.21 0.85 -0.82 1.55 4.07 -0.71 -3.20 115.31 117.27 1on4 h LEU 59 Ca 0.22 -0.30 0.19 0.00 0.08 0.00 0.00 57.88 58.08 1on4 h LEU 59 Cb 0.29 -0.23 -0.12 0.00 1.08 0.00 0.00 40.66 41.68 1on4 h LEU 59 CO -0.30 0.94 0.25 -0.61 -1.08 0.00 0.00 178.44 177.65 1on4 h GLN 60 N 0.74 0.29 -0.02 1.13 5.75 0.70 0.67 115.11 124.37 1on4 h GLN 60 Ca 0.14 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.66 1on4 h GLN 60 Cb 0.50 -0.07 -0.05 0.00 1.07 0.00 0.00 27.48 28.93 1on4 h GLN 60 CO 0.02 0.19 -0.33 -0.22 -2.65 0.00 0.00 178.83 175.84 1on4 h LYS 61 N 0.30 -0.46 -0.09 1.69 3.64 -1.45 -2.13 116.57 118.07 1on4 h LYS 61 Ca 0.49 0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.83 1on4 h LYS 61 Cb 0.90 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 1on4 h LYS 61 CO -0.55 -0.30 -0.28 -0.22 -2.27 0.00 0.00 179.45 175.82 1on4 h LYS 62 N -0.47 0.16 -0.98 1.90 3.11 -0.89 -2.90 116.57 116.50 1on4 h LYS 62 Ca 0.06 -0.06 0.17 0.00 -2.81 0.00 0.00 60.65 58.02 1on4 h LYS 62 Cb 0.57 -0.01 -0.10 0.00 -1.00 0.00 0.00 32.23 31.68 1on4 h LYS 62 CO -0.28 0.44 0.59 1.25 -2.81 0.00 0.00 179.45 178.63 1on4 h LEU 63 N 0.15 0.77 -1.78 5.20 7.12 0.87 0.37 115.31 128.01 1on4 h LEU 63 Ca 0.02 0.09 0.25 0.00 0.13 0.00 0.00 57.88 58.37 1on4 h LEU 63 Cb 0.58 -0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 40.63 1on4 h LEU 63 CO 0.04 0.30 0.78 0.50 -0.13 0.00 0.00 178.44 179.94 1on4 h LYS 64 N 0.78 0.00 -0.04 1.25 1.63 -1.25 0.51 116.57 119.45 1on4 h LYS 64 Ca 0.55 0.00 -0.24 0.00 -0.85 0.00 0.00 60.65 60.11 1on4 h LYS 64 Cb 0.79 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.44 1on4 h LYS 64 CO -0.36 0.00 -0.92 0.00 -3.45 0.00 0.00 179.45 174.72 1on4 h ALA 65 N 1.24 0.16 0.00 5.00 0.00 -1.12 -3.13 119.26 121.42 1on4 h ALA 65 Ca 0.41 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1on4 h ALA 65 Cb 1.97 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.80 1on4 h ALA 65 CO -0.00 0.64 0.00 0.93 0.00 0.00 0.00 179.25 180.81 1on4 h GLU 66 N 0.36 0.00 -2.16 0.00 4.39 -0.47 -3.39 114.58 113.32 1on4 h GLU 66 Ca -0.10 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.47 1on4 h GLU 66 Cb 1.57 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 30.18 1on4 h GLU 66 CO 0.18 0.00 -0.17 -1.71 -1.16 0.00 0.00 179.01 176.15 1on4 n ASN 67 N -2.98 4.20 -0.08 1.42 4.05 0.14 -3.84 115.26 118.17 1on4 n ASN 67 Ca 0.03 -2.25 -0.12 0.00 0.45 0.00 0.00 54.58 52.69 1on4 n ASN 67 Cb 0.42 -1.09 -0.08 0.00 1.23 0.00 0.00 39.78 40.26 1on4 n ASN 67 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 1on4 h ILE 68 N 2.01 0.00 0.00 -1.44 5.03 -1.81 -3.42 117.51 117.87 1on4 h ILE 68 Ca 0.12 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.86 1on4 h ILE 68 Cb 1.13 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.92 1on4 h ILE 68 CO 0.23 0.00 0.00 -0.67 -0.68 0.00 0.00 178.15 177.03 1on4 n ASP 69 N -4.89 0.00 -4.76 1.72 2.03 -1.26 -5.13 116.55 104.25 1on4 n ASP 69 Ca -0.04 -1.00 -0.40 0.00 0.52 0.00 0.00 54.79 53.88 1on4 n ASP 69 Cb 0.29 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.65 1on4 n ASP 69 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1on4 s VAL 70 N 0.00 3.42 0.21 5.18 -7.23 -1.25 -5.00 120.40 115.73 1on4 s VAL 70 Ca 0.00 1.35 0.08 0.00 -1.81 0.00 0.00 61.98 61.60 1on4 s VAL 70 Cb 0.00 -3.83 -0.05 0.00 0.56 0.00 0.00 36.38 33.07 1on4 s VAL 70 CO 0.00 0.26 -0.16 -0.13 -0.31 0.00 0.00 175.10 174.76 1on4 s ARG 71 N -1.73 1.36 -0.39 4.82 0.52 -1.26 -4.36 118.95 117.91 1on4 s ARG 71 Ca 0.48 -1.58 -0.13 0.00 -0.52 0.00 0.00 55.73 53.99 1on4 s ARG 71 Cb -0.31 -1.25 0.03 0.00 0.52 0.00 0.00 34.95 33.94 1on4 s ARG 71 CO 0.40 0.22 0.25 -1.50 0.02 0.00 0.00 175.30 174.69 1on4 s ILE 72 N -2.72 4.87 0.22 1.52 2.07 -1.21 -1.15 121.20 124.81 1on4 s ILE 72 Ca 0.22 -0.80 -0.08 0.00 -1.41 0.00 0.00 60.65 58.57 1on4 s ILE 72 Cb -0.02 -3.73 -0.07 0.00 0.13 0.00 0.00 42.46 38.77 1on4 s ILE 72 CO 0.08 -0.29 0.53 -0.63 -1.91 0.00 0.00 174.94 172.72 1on4 s ILE 73 N 1.60 4.97 -0.32 2.00 1.09 0.76 -1.75 121.20 129.56 1on4 s ILE 73 Ca 0.03 0.37 0.04 0.00 -1.10 0.00 0.00 60.65 60.00 1on4 s ILE 73 Cb -0.19 -3.63 0.17 0.00 -1.06 0.00 0.00 42.46 37.75 1on4 s ILE 73 CO 0.08 -0.08 0.49 -0.55 -0.10 0.00 0.00 174.94 174.78 1on4 s SER 74 N -2.45 -0.40 0.52 3.58 0.15 -1.05 -1.18 113.70 112.85 1on4 s SER 74 Ca 0.46 -0.46 -0.17 0.00 0.70 0.00 0.00 55.95 56.48 1on4 s SER 74 Cb -0.11 1.44 -0.08 0.00 -1.71 0.00 0.00 66.02 65.56 1on4 s SER 74 CO 0.23 -0.29 1.00 0.72 1.20 0.00 0.00 173.24 176.09 1on4 s PHE 75 N 2.35 3.33 0.63 3.44 -0.12 -1.26 -0.52 117.98 125.82 1on4 s PHE 75 Ca 0.12 1.50 -0.13 0.00 -0.05 0.00 0.00 56.93 58.37 1on4 s PHE 75 Cb -0.11 -2.85 -0.02 0.00 -0.63 0.00 0.00 43.02 39.41 1on4 s PHE 75 CO -0.21 -0.49 1.05 0.45 -0.05 0.00 0.00 175.22 175.96 1on4 s SER 76 N -2.84 5.75 -0.09 1.98 0.15 0.50 -2.20 113.70 116.95 1on4 s SER 76 Ca 0.61 1.67 0.01 0.00 0.70 0.00 0.00 55.95 58.94 1on4 s SER 76 Cb -0.11 -2.51 0.02 0.00 -1.71 0.00 0.00 66.02 61.71 1on4 s SER 76 CO 0.29 -1.19 -0.10 -0.69 1.20 0.00 0.00 173.24 172.75 1on4 s VAL 77 N -2.78 1.11 -1.06 4.45 1.01 -0.81 -4.51 120.40 117.81 1on4 s VAL 77 Ca 0.60 -0.40 -0.13 0.00 0.00 0.00 0.00 61.98 62.04 1on4 s VAL 77 Cb -0.14 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.14 1on4 s VAL 77 CO 0.45 0.37 0.83 -0.67 0.00 0.00 0.00 175.10 176.08 1on4 n ASP 78 N 4.36 -6.00 0.16 3.32 -0.08 -1.26 -4.47 116.55 112.57 1on4 n ASP 78 Ca -0.18 -0.83 0.11 0.00 -1.51 0.00 0.00 54.79 52.38 1on4 n ASP 78 Cb 0.51 -4.13 0.57 0.00 2.34 0.00 0.00 41.12 40.40 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 -3.60 0.16 0.17 -0.67 -0.04 -1.26 -0.23 135.00 129.53 1on4 n PRO 79 Ca -0.08 0.58 -0.14 0.00 -0.04 0.00 0.00 63.50 63.82 1on4 n PRO 79 Cb 0.60 -1.94 -0.08 0.00 -0.04 0.00 0.00 33.50 32.04 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 0.00 -0.69 0.12 0.54 4.81 -1.91 -2.99 114.58 114.46 1on4 h GLU 80 Ca 0.00 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1on4 h GLU 80 Cb 0.11 0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1on4 h GLU 80 CO 0.00 -0.46 -0.06 -2.95 -0.73 0.00 0.00 179.01 174.82 1on4 h ASN 81 N -0.71 -0.13 -0.28 1.04 7.08 -1.82 -3.38 115.58 117.37 1on4 h ASN 81 Ca -0.03 -0.31 -0.70 0.00 -3.08 0.00 0.00 56.30 52.18 1on4 h ASN 81 Cb 0.65 0.03 -0.03 0.00 -2.08 0.00 0.00 38.32 36.90 1on4 h ASN 81 CO -0.13 0.47 3.27 0.47 -2.08 0.00 0.00 177.43 179.43 1on4 n ASP 82 N -4.85 6.78 -4.63 6.14 8.00 0.68 -4.95 116.55 123.73 1on4 n ASP 82 Ca -0.06 -2.78 -0.35 0.00 0.71 0.00 0.00 54.79 52.31 1on4 n ASP 82 Cb 0.21 -1.56 0.10 0.00 -0.02 0.00 0.00 41.12 39.85 1on4 n ASP 82 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1on4 n LYS 83 N 4.16 0.43 -0.33 -1.24 5.02 -1.13 -4.36 118.16 120.70 1on4 n LYS 83 Ca 0.65 0.21 0.26 0.00 -2.02 0.00 0.00 58.31 57.40 1on4 n LYS 83 Cb 0.30 -2.26 0.55 0.00 -0.02 0.00 0.00 35.03 33.60 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 -0.41 0.31 -0.92 1.97 0.13 -1.92 0.12 132.00 131.27 1on4 h PRO 84 Ca -0.47 -0.02 0.27 0.00 -0.87 0.00 0.00 66.00 64.91 1on4 h PRO 84 Cb 1.32 -0.07 -0.15 0.00 0.13 0.00 0.00 31.00 32.24 1on4 h PRO 84 CO 0.46 0.20 0.34 0.87 -0.23 0.00 0.00 178.00 179.64 1on4 h LYS 85 N 0.31 0.23 -0.20 0.86 1.57 -1.89 0.55 116.57 118.00 1on4 h LYS 85 Ca 0.61 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.35 1on4 h LYS 85 Cb 1.69 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.94 1on4 h LYS 85 CO -0.27 0.15 0.03 1.96 -0.57 0.00 0.00 179.45 180.75 1on4 h GLN 86 N 0.24 0.33 -0.64 3.15 1.08 -1.06 0.99 115.11 119.19 1on4 h GLN 86 Ca 0.61 -0.09 -0.09 0.00 -1.45 0.00 0.00 58.65 57.64 1on4 h GLN 86 Cb 1.30 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 28.67 1on4 h GLN 86 CO -0.65 0.48 0.05 -0.07 -0.95 0.00 0.00 178.83 177.69 1on4 h LEU 87 N 0.12 1.07 -0.47 1.46 4.07 -1.37 0.15 115.31 120.34 1on4 h LEU 87 Ca 0.06 -0.29 -0.00 0.00 0.08 0.00 0.00 57.88 57.73 1on4 h LEU 87 Cb 0.31 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 41.74 1on4 h LEU 87 CO 0.00 1.09 0.30 0.50 -1.08 0.00 0.00 178.44 179.25 1on4 h LYS 88 N 1.02 0.64 -0.37 1.13 3.64 -0.66 0.20 116.57 122.16 1on4 h LYS 88 Ca 0.19 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.56 1on4 h LYS 88 Cb 0.51 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.15 1on4 h LYS 88 CO 0.02 0.45 0.13 -0.22 -2.27 0.00 0.00 179.45 177.56 1on4 h LYS 89 N 0.64 0.27 -0.83 1.90 3.64 -0.44 0.54 116.57 122.29 1on4 h LYS 89 Ca 0.17 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.56 1on4 h LYS 89 Cb -0.03 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 1on4 h LYS 89 CO -0.03 0.18 0.54 0.35 -2.27 0.00 0.00 179.45 178.22 1on4 h PHE 90 N 0.28 1.02 0.00 1.91 3.57 -0.20 -1.29 116.94 122.23 1on4 h PHE 90 Ca 0.17 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 1on4 h PHE 90 Cb 0.15 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 1on4 h PHE 90 CO -0.15 0.61 -0.19 0.00 -2.23 0.00 0.00 178.31 176.36 1on4 h ALA 91 N 1.33 1.11 0.00 2.41 0.00 -0.07 0.15 119.26 124.20 1on4 h ALA 91 Ca 0.32 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1on4 h ALA 91 Cb -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1on4 h ALA 91 CO -0.09 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1on4 n ALA 92 N -2.25 1.74 -0.06 0.00 0.00 0.13 -4.04 120.51 116.03 1on4 n ALA 92 Ca -0.01 0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.44 1on4 n ALA 92 Cb 0.36 -1.41 -0.02 0.00 0.00 0.00 0.00 19.45 18.38 1on4 n ALA 92 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1on4 n ASN 93 N -2.29 1.68 -4.64 0.00 3.02 0.20 -4.85 115.26 108.38 1on4 n ASN 93 Ca 0.02 0.28 -0.42 0.00 -0.03 0.00 0.00 54.58 54.43 1on4 n ASN 93 Cb 0.26 -0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 38.75 1on4 n ASN 93 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1on4 s TYR 94 N -2.64 1.32 -1.32 3.10 2.02 0.28 -4.84 117.35 115.28 1on4 s TYR 94 Ca -0.22 -0.12 -0.13 0.00 -0.37 0.00 0.00 57.07 56.23 1on4 s TYR 94 Cb 0.03 -4.13 -0.04 0.00 -0.40 0.00 0.00 41.96 37.41 1on4 s TYR 94 CO 0.33 -4.98 2.37 -0.35 -1.57 0.00 0.00 175.55 171.35 1on4 n PRO 95 N 7.86 2.76 -1.41 -1.71 -0.04 -1.26 -4.57 135.00 136.64 1on4 n PRO 95 Ca 0.22 -2.21 -0.05 0.00 -0.04 0.00 0.00 63.50 61.42 1on4 n PRO 95 Cb 0.42 -2.98 0.02 0.00 -0.04 0.00 0.00 33.50 30.93 1on4 n PRO 95 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1on4 n LEU 96 N 5.38 0.00 -3.81 1.53 -0.00 -1.26 -5.01 117.00 113.83 1on4 n LEU 96 Ca 0.58 -0.63 -0.13 0.00 -0.00 0.00 0.00 56.01 55.84 1on4 n LEU 96 Cb 0.31 -0.13 -0.13 0.00 -0.00 0.00 0.00 43.42 43.47 1on4 n LEU 96 CO 0.89 -0.58 -0.23 -0.55 -0.00 0.00 0.00 177.39 176.92 1on4 s SER 97 N -1.98 -0.12 0.58 1.45 0.15 -1.26 -5.00 113.70 107.52 1on4 s SER 97 Ca 0.16 0.25 0.28 0.00 0.70 0.00 0.00 55.95 57.34 1on4 s SER 97 Cb -0.01 0.22 1.57 0.00 -1.71 0.00 0.00 66.02 66.09 1on4 s SER 97 CO 0.11 -0.07 2.05 -0.26 1.20 0.00 0.00 173.24 176.27 1on4 h PHE 98 N 6.35 0.00 0.00 3.44 0.04 -1.97 -3.36 116.94 121.44 1on4 h PHE 98 Ca -0.30 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.47 1on4 h PHE 98 Cb 1.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.33 1on4 h PHE 98 CO 0.41 0.00 0.00 -3.47 -0.60 0.00 0.00 178.31 174.65 1on4 n ASP 99 N -3.91 0.00 -2.91 2.17 2.03 -1.26 -0.85 116.55 111.83 1on4 n ASP 99 Ca 0.04 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.22 1on4 n ASP 99 Cb 0.41 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.83 1on4 n ASP 99 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1on4 n ASN 100 N -1.34 0.25 -3.53 1.67 5.15 -1.26 -5.06 115.26 111.14 1on4 n ASN 100 Ca 0.00 -2.97 -0.22 0.00 -0.60 0.00 0.00 54.58 50.79 1on4 n ASN 100 Cb 0.00 -0.04 -0.14 0.00 -0.53 0.00 0.00 39.78 39.07 1on4 n ASN 100 CO 0.00 0.00 0.00 0.86 1.40 0.00 0.00 177.26 179.52 1on4 s TRP 101 N -1.96 -0.05 -1.11 1.20 -0.11 -0.03 -3.29 118.94 113.60 1on4 s TRP 101 Ca 0.31 -0.17 -0.12 0.00 1.22 0.00 0.00 56.10 57.34 1on4 s TRP 101 Cb 0.38 -0.57 0.22 0.00 -1.50 0.00 0.00 33.47 32.00 1on4 s TRP 101 CO -0.04 -0.64 1.22 -0.51 -4.62 0.00 0.00 176.95 172.35 1on4 s ASP 102 N 2.23 7.11 -0.12 5.86 1.01 -0.72 -4.80 116.67 127.25 1on4 s ASP 102 Ca 0.06 -3.13 -0.30 0.00 0.71 0.00 0.00 52.55 49.89 1on4 s ASP 102 Cb -0.16 -2.31 -0.02 0.00 1.01 0.00 0.00 42.92 41.44 1on4 s ASP 102 CO -0.17 -0.57 1.24 -0.36 0.21 0.00 0.00 175.17 175.52 1on4 s PHE 103 N 0.40 2.98 0.11 4.23 0.08 -1.26 -2.54 117.98 121.98 1on4 s PHE 103 Ca 0.35 1.08 0.04 0.00 0.12 0.00 0.00 56.93 58.52 1on4 s PHE 103 Cb -0.07 -3.48 -0.04 0.00 -0.57 0.00 0.00 43.02 38.87 1on4 s PHE 103 CO -0.05 -1.58 0.08 -0.51 -0.10 0.00 0.00 175.22 173.06 1on4 s LEU 104 N 2.97 3.73 0.00 -0.37 1.43 0.32 -0.21 118.68 126.56 1on4 s LEU 104 Ca 0.55 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.56 1on4 s LEU 104 Cb -0.23 -2.40 0.00 0.00 0.03 0.00 0.00 46.19 43.59 1on4 s LEU 104 CO 0.18 0.13 0.23 0.35 0.23 0.00 0.00 176.35 177.47 1on4 n THR 105 N 0.17 0.00 0.00 5.49 -2.24 -0.17 -0.37 114.28 117.16 1on4 n THR 105 Ca -0.09 0.50 0.00 0.00 -2.27 0.00 0.00 64.05 62.19 1on4 n THR 105 Cb 0.53 -1.05 0.00 0.00 -2.10 0.00 0.00 70.33 67.71 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 1.31 1.25 6.70 3.38 0.00 -1.26 -3.04 105.19 113.52 1on4 n GLY 106 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1on4 n GLY 106 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1on4 n TYR 107 N -2.00 0.00 -1.87 1.61 9.36 -1.26 -2.85 117.16 120.15 1on4 n TYR 107 Ca 0.00 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.81 1on4 n TYR 107 Cb 0.00 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 38.70 1on4 n TYR 107 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 1on4 s SER 108 N -3.83 6.44 0.37 2.98 0.01 -1.26 -4.45 113.70 113.96 1on4 s SER 108 Ca 0.00 2.95 0.07 0.00 1.31 0.00 0.00 55.95 60.29 1on4 s SER 108 Cb 0.00 -2.66 0.79 0.00 0.21 0.00 0.00 66.02 64.37 1on4 s SER 108 CO 0.00 -0.80 1.95 1.56 0.41 0.00 0.00 173.24 176.35 1on4 h GLN 109 N 3.35 0.68 -0.79 12.44 1.08 -1.91 0.20 115.11 130.16 1on4 h GLN 109 Ca -0.50 -0.04 0.15 0.00 -1.45 0.00 0.00 58.65 56.81 1on4 h GLN 109 Cb 1.23 -0.15 -0.10 0.00 -0.05 0.00 0.00 27.48 28.41 1on4 h GLN 109 CO 0.66 0.45 0.33 0.77 -0.95 0.00 0.00 178.83 180.09 1on4 h SER 110 N 0.70 0.31 0.67 1.46 0.02 -1.90 0.55 113.55 115.36 1on4 h SER 110 Ca 0.33 0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.36 1on4 h SER 110 Cb 0.37 0.09 0.01 0.00 0.14 0.00 0.00 62.40 63.01 1on4 h SER 110 CO -0.11 0.10 -0.32 -0.33 -1.14 0.00 0.00 176.83 175.02 1on4 h GLU 111 N 0.45 -0.87 -0.54 3.45 5.08 -0.84 -1.74 114.58 119.57 1on4 h GLU 111 Ca 0.44 0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.86 1on4 h GLU 111 Cb 0.69 0.20 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 1on4 h GLU 111 CO -0.42 -0.58 0.32 0.97 -1.00 0.00 0.00 179.01 178.30 1on4 h ILE 112 N -1.17 1.16 0.03 3.13 6.09 -1.17 -0.45 117.51 125.13 1on4 h ILE 112 Ca -0.09 -0.36 0.00 0.00 -1.37 0.00 0.00 64.86 63.04 1on4 h ILE 112 Cb 0.69 0.40 -0.01 0.00 0.47 0.00 0.00 36.82 38.37 1on4 h ILE 112 CO 0.15 0.17 -0.09 -0.33 -3.07 0.00 0.00 178.15 174.98 1on4 h GLU 113 N 0.75 -0.13 -0.28 2.19 5.08 0.11 0.20 114.58 122.49 1on4 h GLU 113 Ca 0.20 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1on4 h GLU 113 Cb -0.02 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1on4 h GLU 113 CO -0.04 -0.08 0.14 1.49 -1.00 0.00 0.00 179.01 179.52 1on4 h GLU 114 N -0.13 0.29 -0.10 2.33 4.81 -1.01 0.12 114.58 120.89 1on4 h GLU 114 Ca -0.00 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1on4 h GLU 114 Cb 0.13 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1on4 h GLU 114 CO -0.04 0.19 -0.06 0.35 -0.73 0.00 0.00 179.01 178.72 1on4 h PHE 115 N 0.30 -0.14 -0.08 0.92 3.57 -1.07 -0.14 116.94 120.31 1on4 h PHE 115 Ca 0.12 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.53 1on4 h PHE 115 Cb 0.03 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 1on4 h PHE 115 CO -0.09 -0.10 -0.38 0.00 -2.23 0.00 0.00 178.31 175.51 1on4 h ALA 116 N 1.02 1.22 0.42 2.41 0.00 -0.24 0.17 119.26 124.26 1on4 h ALA 116 Ca 0.06 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1on4 h ALA 116 Cb 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1on4 h ALA 116 CO -0.14 0.54 -0.38 1.25 0.00 0.00 0.00 179.25 180.53 1on4 h LEU 117 N 0.13 -1.00 0.38 0.00 7.12 -0.25 0.16 115.31 121.85 1on4 h LEU 117 Ca 0.01 0.08 -0.00 0.00 0.13 0.00 0.00 57.88 58.10 1on4 h LEU 117 Cb 0.74 0.33 -0.03 0.00 -0.53 0.00 0.00 40.66 41.17 1on4 h LEU 117 CO 0.06 -0.53 -0.47 0.11 -0.13 0.00 0.00 178.44 177.47 1on4 h LYS 118 N -0.80 -0.85 -0.59 1.25 6.56 -0.64 -1.83 116.57 119.66 1on4 h LYS 118 Ca -0.04 0.06 -0.08 0.00 -1.06 0.00 0.00 60.65 59.53 1on4 h LYS 118 Cb 0.71 0.19 -0.02 0.00 -0.57 0.00 0.00 32.23 32.54 1on4 h LYS 118 CO -0.04 -0.57 0.06 1.03 -2.06 0.00 0.00 179.45 177.87 1on4 h SER 119 N -0.88 0.97 0.00 0.86 0.87 -0.66 -3.42 113.55 111.28 1on4 h SER 119 Ca -0.04 -0.28 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1on4 h SER 119 Cb 0.80 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 1on4 h SER 119 CO -0.12 1.00 -0.38 0.49 -0.53 0.00 0.00 176.83 177.29 1on4 n PHE 120 N -4.27 -0.39 -0.22 2.24 3.72 0.33 -4.67 117.46 114.20 1on4 n PHE 120 Ca 0.03 0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.49 1on4 n PHE 120 Cb 0.30 0.21 0.00 0.00 -0.94 0.00 0.00 39.48 39.06 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 -3.06 0.00 -3.86 -1.08 0.00 0.13 -4.97 118.16 105.31 1on4 n LYS 121 Ca 0.00 0.01 -0.09 0.00 -0.00 0.00 0.00 58.31 58.23 1on4 n LYS 121 Cb 0.19 -0.22 -0.08 0.00 -0.00 0.00 0.00 35.03 34.92 1on4 n LYS 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1on4 s ALA 122 N -2.15 -0.24 0.33 0.58 0.00 -1.11 -4.92 121.76 114.26 1on4 s ALA 122 Ca 0.00 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.43 1on4 s ALA 122 Cb 0.00 0.42 0.01 0.00 0.00 0.00 0.00 23.12 23.54 1on4 s ALA 122 CO 0.00 -0.46 0.05 0.44 0.00 0.00 0.00 175.76 175.79 1on4 n ILE 123 N 0.17 0.00 -4.02 0.00 -5.35 -1.26 -2.15 119.36 106.74 1on4 n ILE 123 Ca -0.16 -1.53 -0.12 0.00 -0.27 0.00 0.00 62.75 60.67 1on4 n ILE 123 Cb 0.61 0.21 -0.12 0.00 -1.74 0.00 0.00 39.64 38.61 1on4 n ILE 123 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1on4 s VAL 124 N -2.11 0.30 -0.00 7.28 -7.23 -1.26 -5.00 120.40 112.39 1on4 s VAL 124 Ca 0.04 -0.74 -0.01 0.00 -1.81 0.00 0.00 61.98 59.47 1on4 s VAL 124 Cb -0.00 -0.37 0.00 0.00 0.56 0.00 0.00 36.38 36.57 1on4 s VAL 124 CO 0.02 -0.29 0.01 1.17 -0.31 0.00 0.00 175.10 175.71 1on4 n LYS 125 N 1.97 -1.59 -1.62 4.82 3.00 -1.26 -4.78 118.16 118.70 1on4 n LYS 125 Ca -0.20 1.50 0.00 0.00 -0.00 0.00 0.00 58.31 59.61 1on4 n LYS 125 Cb 0.56 -1.88 0.00 0.00 0.00 0.00 0.00 35.03 33.72 1on4 n LYS 125 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1on4 n LYS 126 N 0.56 -3.16 -2.65 1.64 0.00 -1.26 -4.98 118.16 108.31 1on4 n LYS 126 Ca -0.02 2.47 -0.34 0.00 0.00 0.00 0.00 58.31 60.42 1on4 n LYS 126 Cb 0.03 -2.75 -0.05 0.00 0.00 0.00 0.00 35.03 32.26 1on4 n LYS 126 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1on4 s PRO 127 N -1.39 4.03 -0.06 1.64 0.04 -1.26 -4.90 135.00 133.09 1on4 s PRO 127 Ca 0.00 1.29 -0.15 0.00 0.04 0.00 0.00 61.00 62.18 1on4 s PRO 127 Cb 0.00 -2.21 -0.30 0.00 0.04 0.00 0.00 34.50 32.03 1on4 s PRO 127 CO 0.00 -0.22 0.69 0.93 0.04 0.00 0.00 177.00 178.44 1on4 h GLU 128 N 1.86 0.35 0.00 4.56 4.39 -1.94 -3.48 114.58 120.31 1on4 h GLU 128 Ca -0.49 -0.59 0.00 0.00 0.34 0.00 0.00 59.36 58.62 1on4 h GLU 128 Cb 1.20 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 30.08 1on4 h GLU 128 CO 0.60 1.28 0.00 0.41 -1.16 0.00 0.00 179.01 180.15 1on4 n GLY 129 N 1.78 0.00 3.88 -3.84 0.00 -1.26 -5.17 105.19 100.58 1on4 n GLY 129 Ca -0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 1on4 n GLY 129 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1on4 s GLU 130 N 0.00 2.88 0.00 1.61 8.01 -1.26 -4.92 118.70 125.02 1on4 s GLU 130 Ca 0.00 0.46 0.00 0.00 0.01 0.00 0.00 54.97 55.44 1on4 s GLU 130 Cb 0.00 -2.03 0.00 0.00 -4.31 0.00 0.00 34.13 27.79 1on4 s GLU 130 CO 0.00 -1.02 0.00 -0.40 0.01 0.00 0.00 175.26 173.85 1on4 n ASP 131 N -3.00 0.00 -3.03 -0.19 5.75 -1.26 -3.60 116.55 111.23 1on4 n ASP 131 Ca 0.07 0.00 -0.15 0.00 -0.01 0.00 0.00 54.79 54.70 1on4 n ASP 131 Cb 0.57 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.66 1on4 n ASP 131 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1on4 n GLN 132 N 0.90 1.01 -0.01 0.11 1.13 -1.26 -4.81 117.38 114.44 1on4 n GLN 132 Ca 0.00 -3.06 -0.02 0.00 -1.94 0.00 0.00 57.00 51.97 1on4 n GLN 132 Cb 0.00 -1.48 -0.01 0.00 0.11 0.00 0.00 30.24 28.86 1on4 n GLN 132 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 1on4 n VAL 133 N 0.22 0.12 0.01 5.09 0.24 -1.24 -4.93 118.33 117.85 1on4 n VAL 133 Ca 0.19 -0.04 -0.01 0.00 -2.04 0.00 0.00 64.34 62.45 1on4 n VAL 133 Cb 0.69 -1.21 -0.00 0.00 -1.47 0.00 0.00 33.84 31.85 1on4 n VAL 133 CO 0.00 0.00 0.00 -0.29 -2.14 0.00 0.00 176.83 174.40 1on4 h ILE 134 N -0.05 0.00 0.00 1.34 -0.00 -1.89 -3.50 117.51 113.40 1on4 h ILE 134 Ca -0.05 -0.17 0.00 0.00 -0.00 0.00 0.00 64.86 64.64 1on4 h ILE 134 Cb 1.06 0.00 0.00 0.00 -0.00 0.00 0.00 36.82 37.88 1on4 h ILE 134 CO -0.03 0.00 0.00 1.41 -0.00 0.00 0.00 178.15 179.53 1on4 n HIS 135 N -2.57 0.00 -3.58 2.19 8.25 -1.26 -5.06 115.22 113.19 1on4 n HIS 135 Ca -0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.25 1on4 n HIS 135 Cb 0.01 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.13 1on4 n HIS 135 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1on4 n GLN 136 N -0.22 -1.56 -1.18 -0.41 1.13 -1.26 -4.82 117.38 109.05 1on4 n GLN 136 Ca 0.00 1.03 -0.35 0.00 -1.94 0.00 0.00 57.00 55.74 1on4 n GLN 136 Cb 0.00 -3.12 -0.03 0.00 0.11 0.00 0.00 30.24 27.20 1on4 n GLN 136 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1on4 n SER 137 N -2.13 7.80 -4.70 1.08 2.88 -1.26 -4.90 113.62 112.39 1on4 n SER 137 Ca -0.22 -2.52 -0.24 0.00 -1.33 0.00 0.00 58.87 54.57 1on4 n SER 137 Cb 0.64 -1.45 0.10 0.00 -0.75 0.00 0.00 64.21 62.75 1on4 n SER 137 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1on4 s SER 138 N 2.48 4.42 0.05 -3.46 0.01 -1.26 -4.63 113.70 111.32 1on4 s SER 138 Ca 0.63 -0.18 0.01 0.00 1.31 0.00 0.00 55.95 57.72 1on4 s SER 138 Cb 0.16 -0.27 -0.04 0.00 0.21 0.00 0.00 66.02 66.08 1on4 s SER 138 CO -0.05 -1.81 0.10 -0.36 0.41 0.00 0.00 173.24 171.53 1on4 s PHE 139 N -3.16 3.26 0.01 2.43 0.08 0.69 -4.59 117.98 116.70 1on4 s PHE 139 Ca 0.65 0.14 0.08 0.00 0.12 0.00 0.00 56.93 57.93 1on4 s PHE 139 Cb -0.06 -1.68 -0.02 0.00 -0.57 0.00 0.00 43.02 40.68 1on4 s PHE 139 CO 0.44 0.54 -0.26 0.71 -0.10 0.00 0.00 175.22 176.55 1on4 s TYR 140 N -1.34 2.29 -0.32 0.36 1.51 0.98 -1.06 117.35 119.77 1on4 s TYR 140 Ca 0.28 -0.42 -0.07 0.00 -1.01 0.00 0.00 57.07 55.84 1on4 s TYR 140 Cb -0.12 -1.43 0.02 0.00 -0.11 0.00 0.00 41.96 40.32 1on4 s TYR 140 CO 0.20 0.03 0.10 -1.17 -1.11 0.00 0.00 175.55 173.60 1on4 s LEU 141 N -0.87 4.14 -0.24 -1.29 0.20 0.56 -0.25 118.68 120.93 1on4 s LEU 141 Ca 0.11 -0.93 -0.10 0.00 0.69 0.00 0.00 54.13 53.89 1on4 s LEU 141 Cb -0.10 -1.89 -0.05 0.00 -0.43 0.00 0.00 46.19 43.73 1on4 s LEU 141 CO 0.00 -0.27 0.15 -0.69 -0.29 0.00 0.00 176.35 175.25 1on4 s VAL 142 N 1.46 5.26 1.11 1.68 1.01 0.28 -2.51 120.40 128.70 1on4 s VAL 142 Ca 0.01 0.15 -0.18 0.00 0.00 0.00 0.00 61.98 61.95 1on4 s VAL 142 Cb -0.18 -3.45 0.25 0.00 0.00 0.00 0.00 36.38 32.99 1on4 s VAL 142 CO 0.03 0.35 1.18 -0.83 0.00 0.00 0.00 175.10 175.83 1on4 s GLY 143 N 1.09 1.65 0.13 4.51 0.00 0.13 -1.78 107.32 113.03 1on4 s GLY 143 Ca 0.07 -1.01 -0.14 0.00 0.00 0.00 0.00 44.72 43.65 1on4 s GLY 143 CO 0.05 -0.18 1.52 -0.56 0.00 0.00 0.00 173.10 173.93 1on4 h PRO 144 N -2.23 0.79 -0.98 2.90 0.13 -1.79 -0.94 132.00 129.87 1on4 h PRO 144 Ca -0.45 -0.32 -0.62 0.00 -0.87 0.00 0.00 66.00 63.74 1on4 h PRO 144 Cb 1.28 -0.04 -0.30 0.00 0.13 0.00 0.00 31.00 32.07 1on4 h PRO 144 CO 0.37 0.93 0.73 -0.40 -0.23 0.00 0.00 178.00 179.40 1on4 n ASP 145 N -4.31 6.37 0.00 1.44 5.75 -1.26 0.15 116.55 124.70 1on4 n ASP 145 Ca -0.01 -3.74 0.00 0.00 -0.01 0.00 0.00 54.79 51.03 1on4 n ASP 145 Cb 0.38 -0.91 0.00 0.00 -1.03 0.00 0.00 41.12 39.56 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 -0.98 1.96 3.69 6.12 0.00 -0.36 -4.82 105.19 110.79 1on4 n GLY 146 Ca 0.61 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.19 4.41 0.10 1.61 -2.85 -1.26 -0.92 119.74 120.63 1on4 s LYS 147 Ca 0.00 1.46 -0.30 0.00 -1.00 0.00 0.00 55.97 56.13 1on4 s LYS 147 Cb 0.00 -3.54 -0.06 0.00 -2.06 0.00 0.00 37.83 32.17 1on4 s LYS 147 CO 0.00 -0.33 1.19 0.14 0.10 0.00 0.00 175.35 176.45 1on4 s VAL 148 N 2.00 3.91 -0.04 1.79 -7.23 -0.11 0.17 120.40 120.89 1on4 s VAL 148 Ca 0.50 1.44 0.06 0.00 -1.81 0.00 0.00 61.98 62.18 1on4 s VAL 148 Cb -0.20 -3.92 -0.09 0.00 0.56 0.00 0.00 36.38 32.73 1on4 s VAL 148 CO 0.20 0.15 0.09 0.18 -0.31 0.00 0.00 175.10 175.40 1on4 n LEU 149 N 3.52 0.00 -3.85 1.32 4.77 -1.04 -1.71 117.00 120.00 1on4 n LEU 149 Ca 0.08 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.94 1on4 n LEU 149 Cb 0.46 0.08 -0.13 0.00 -2.33 0.00 0.00 43.42 41.50 1on4 n LEU 149 CO 0.55 0.08 -0.26 -0.54 -1.33 0.00 0.00 177.39 175.89 1on4 s LYS 150 N -2.33 0.17 -0.08 3.23 -0.14 -1.25 -4.27 119.74 115.08 1on4 s LYS 150 Ca -0.03 0.01 -0.04 0.00 -1.36 0.00 0.00 55.97 54.55 1on4 s LYS 150 Cb 0.03 0.08 0.03 0.00 -1.68 0.00 0.00 37.83 36.29 1on4 s LYS 150 CO 0.28 -0.03 0.18 0.16 -0.76 0.00 0.00 175.35 175.18 1on4 s ASP 151 N -0.24 -0.17 -0.00 2.83 1.47 -1.26 -0.32 116.67 118.97 1on4 s ASP 151 Ca -0.03 0.37 -0.25 0.00 1.18 0.00 0.00 52.55 53.82 1on4 s ASP 151 Cb -0.02 0.29 0.06 0.00 -0.34 0.00 0.00 42.92 42.90 1on4 s ASP 151 CO 0.00 -0.13 0.55 -0.72 0.68 0.00 0.00 175.17 175.56 1on4 s TYR 152 N 0.88 -0.49 -0.11 2.11 1.13 -0.17 0.17 117.35 120.87 1on4 s TYR 152 Ca -0.07 0.71 -0.01 0.00 -1.41 0.00 0.00 57.07 56.29 1on4 s TYR 152 Cb -0.08 0.34 0.03 0.00 -1.10 0.00 0.00 41.96 41.14 1on4 s TYR 152 CO -0.05 -0.59 -0.04 1.21 -2.51 0.00 0.00 175.55 173.57 1on4 s ASN 153 N -1.56 2.05 0.34 -0.18 2.47 -1.17 -0.22 114.94 116.66 1on4 s ASN 153 Ca -0.09 -0.28 0.15 0.00 0.42 0.00 0.00 52.86 53.06 1on4 s ASN 153 Cb -0.01 -0.68 0.57 0.00 -1.45 0.00 0.00 41.25 39.68 1on4 s ASN 153 CO 0.04 -0.16 1.70 1.23 -3.72 0.00 0.00 177.10 176.19 1on4 h GLY 154 N 8.23 0.00 0.07 1.21 0.00 -1.93 -3.40 103.07 107.25 1on4 h GLY 154 Ca -0.25 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 1on4 h GLY 154 CO 0.35 0.00 -0.03 -2.08 0.00 0.00 0.00 176.54 174.77 1on4 h VAL 155 N 0.00 0.00 -3.80 4.60 2.07 -1.89 -3.46 116.25 113.77 1on4 h VAL 155 Ca -0.00 -0.20 -0.56 0.00 0.82 0.00 0.00 66.70 66.76 1on4 h VAL 155 Cb 0.93 0.00 -0.32 0.00 -1.52 0.00 0.00 31.29 30.39 1on4 h VAL 155 CO 0.06 0.00 -0.83 -0.70 0.02 0.00 0.00 177.57 176.12 1on4 s GLU 156 N -1.82 1.82 0.00 1.57 2.12 -1.26 -5.05 118.70 116.07 1on4 s GLU 156 Ca -0.01 -0.59 0.00 0.00 0.36 0.00 0.00 54.97 54.73 1on4 s GLU 156 Cb 0.00 -1.55 0.00 0.00 0.26 0.00 0.00 34.13 32.84 1on4 s GLU 156 CO 0.04 0.20 0.00 0.09 -0.54 0.00 0.00 175.26 175.06 1on4 n ASN 157 N 3.26 0.00 -0.55 -1.70 3.02 -1.26 -4.30 115.26 113.74 1on4 n ASN 157 Ca -0.19 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.34 1on4 n ASN 157 Cb 0.53 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.68 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 -1.50 0.00 -0.08 3.41 -1.04 -1.26 -4.62 114.28 109.18 1on4 n THR 158 Ca 0.00 -0.06 -0.15 0.00 -2.04 0.00 0.00 64.05 61.80 1on4 n THR 158 Cb 0.00 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.47 1on4 n THR 158 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1on4 h PRO 159 N 1.31 0.84 0.00 -2.82 0.13 -1.86 -3.39 132.00 126.21 1on4 h PRO 159 Ca 0.00 -0.51 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1on4 h PRO 159 Cb 0.14 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.32 1on4 h PRO 159 CO 0.19 1.15 0.00 0.66 -0.23 0.00 0.00 178.00 179.76 1on4 n TYR 160 N -4.07 0.00 0.06 1.56 4.01 -1.25 -1.00 117.16 116.46 1on4 n TYR 160 Ca -0.04 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.58 1on4 n TYR 160 Cb 0.59 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.57 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 -0.85 0.72 7.72 3.32 -0.64 0.45 116.42 127.15 1on4 h ASP 161 Ca 0.00 0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 1on4 h ASP 161 Cb 0.00 0.35 0.01 0.00 0.22 0.00 0.00 39.33 39.90 1on4 h ASP 161 CO 0.00 -0.35 -0.35 -0.78 -1.72 0.00 0.00 179.24 176.04 1on4 h ASP 162 N -0.42 -0.82 0.69 6.45 3.58 -1.93 0.15 116.42 124.11 1on4 h ASP 162 Ca 0.07 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.49 1on4 h ASP 162 Cb 0.51 0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.78 1on4 h ASP 162 CO -0.25 -0.54 -0.36 0.40 -2.88 0.00 0.00 179.24 175.62 1on4 h ILE 163 N -1.06 0.00 -0.25 2.25 5.03 -1.82 0.19 117.51 121.85 1on4 h ILE 163 Ca -0.10 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 64.70 1on4 h ILE 163 Cb 0.76 0.00 -0.06 0.00 -3.03 0.00 0.00 36.82 34.50 1on4 h ILE 163 CO 0.16 0.00 -0.13 0.40 -0.68 0.00 0.00 178.15 177.91 1on4 h ILE 164 N -0.96 0.60 -0.32 -0.67 5.03 -0.21 0.12 117.51 121.10 1on4 h ILE 164 Ca -0.09 0.00 0.07 0.00 -0.12 0.00 0.00 64.86 64.72 1on4 h ILE 164 Cb 0.74 0.60 -0.07 0.00 -3.03 0.00 0.00 36.82 35.06 1on4 h ILE 164 CO 0.14 0.00 -0.14 -1.28 -0.68 0.00 0.00 178.15 176.18 1on4 h SER 165 N -0.10 -0.49 0.60 1.72 0.87 -0.80 0.16 113.55 115.51 1on4 h SER 165 Ca 0.14 0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.79 1on4 h SER 165 Cb 0.30 0.28 0.01 0.00 -0.44 0.00 0.00 62.40 62.54 1on4 h SER 165 CO -0.32 -0.18 -0.29 -0.78 -0.53 0.00 0.00 176.83 174.74 1on4 h ASP 166 N -0.09 -0.68 -0.10 6.23 3.58 0.18 0.21 116.42 125.74 1on4 h ASP 166 Ca 0.16 0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.65 1on4 h ASP 166 Cb 0.34 0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.54 1on4 h ASP 166 CO -0.38 -0.47 -0.06 0.58 -2.88 0.00 0.00 179.24 176.03 1on4 h VAL 167 N -0.84 0.82 -0.82 2.25 2.07 -0.67 -1.72 116.25 117.34 1on4 h VAL 167 Ca -0.08 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.46 1on4 h VAL 167 Cb 0.63 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 1on4 h VAL 167 CO 0.14 0.00 0.54 0.11 0.02 0.00 0.00 177.57 178.37 1on4 h LYS 168 N -0.06 1.05 0.49 1.57 6.56 -0.55 0.19 116.57 125.83 1on4 h LYS 168 Ca 0.06 -0.06 -0.02 0.00 -1.06 0.00 0.00 60.65 59.57 1on4 h LYS 168 Cb 0.14 -0.24 -0.00 0.00 -0.57 0.00 0.00 32.23 31.56 1on4 h LYS 168 CO -0.14 0.69 -0.32 0.66 -2.06 0.00 0.00 179.45 178.29 1on4 h SER 169 N 1.08 -0.82 -0.60 0.86 4.64 -0.02 0.36 113.55 119.05 1on4 h SER 169 Ca 0.31 0.05 0.12 0.00 -0.47 0.00 0.00 61.79 61.80 1on4 h SER 169 Cb -0.08 0.24 -0.09 0.00 -0.31 0.00 0.00 62.40 62.16 1on4 h SER 169 CO -0.08 -0.48 0.06 0.00 -0.87 0.00 0.00 176.83 175.46 1on4 h ALA 170 N -1.41 0.65 0.95 5.18 0.00 -1.27 -0.51 119.26 122.85 1on4 h ALA 170 Ca -0.07 0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1on4 h ALA 170 Cb 0.62 0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.67 1on4 h ALA 170 CO 0.06 -0.36 -0.49 0.77 0.00 0.00 0.00 179.25 179.23 1on4 h SER 171 N 0.18 -1.19 0.00 0.00 0.02 -0.53 -3.43 113.55 108.60 1on4 h SER 171 Ca 0.32 0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 61.24 1on4 h SER 171 Cb 0.49 0.32 -0.07 0.00 0.14 0.00 0.00 62.40 63.28 1on4 h SER 171 CO -0.46 -0.81 -0.16 1.07 -1.14 0.00 0.00 176.83 175.33 1on4 n THR 172 N -5.66 0.00 -3.65 -2.27 5.66 -0.86 -5.02 114.28 102.49 1on4 n THR 172 Ca -0.16 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.56 1on4 n THR 172 Cb 0.53 0.28 0.04 0.00 -1.55 0.00 0.00 70.33 69.63 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 -3.21 0.00 1.09 4.77 -0.02 -4.98 117.00 114.65 1on4 n LEU 173 Ca -0.16 -0.95 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 1on4 n LEU 173 Cb 0.51 -2.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.07 1on4 n LEU 173 CO -0.08 0.41 0.00 2.29 -1.33 0.00 0.00 177.39 178.68