#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 0.30 -1.01 -0.41 -2.45 -1.26 -4.90 119.30 109.57 1on4 s MET 2 Ca 0.00 0.33 -0.01 0.00 -1.25 0.00 0.00 55.69 54.76 1on4 s MET 2 Cb 0.00 -0.71 0.00 0.00 1.25 0.00 0.00 34.83 35.37 1on4 s MET 2 CO 0.00 -0.72 0.85 -0.11 1.05 0.00 0.00 175.02 176.09 1on4 n LEU 3 N 5.34 -3.59 0.00 4.11 7.94 -1.26 -4.96 117.00 124.59 1on4 n LEU 3 Ca -0.04 -0.50 0.00 0.00 -1.11 0.00 0.00 56.01 54.37 1on4 n LEU 3 Cb 0.49 -2.64 0.00 0.00 0.53 0.00 0.00 43.42 41.80 1on4 n LEU 3 CO 0.06 0.35 0.00 -0.62 -1.11 0.00 0.00 177.39 176.07 1on4 n GLU 4 N -3.68 0.00 -3.45 1.96 1.02 -1.26 -4.97 120.64 110.26 1on4 n GLU 4 Ca -0.20 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.68 1on4 n GLU 4 Cb 0.62 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.95 1on4 n GLU 4 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1on4 n ILE 5 N -0.89 0.20 -2.74 -3.67 -0.00 -1.26 -4.90 119.36 106.10 1on4 n ILE 5 Ca 0.00 -4.23 -0.03 0.00 -0.00 0.00 0.00 62.75 58.49 1on4 n ILE 5 Cb 0.00 -1.94 0.08 0.00 -0.00 0.00 0.00 39.64 37.79 1on4 n ILE 5 CO 0.00 0.00 0.00 2.29 -0.00 0.00 0.00 176.55 178.84 1on4 n LYS 6 N 1.87 1.45 -3.18 0.38 2.85 -1.26 -5.04 118.16 115.23 1on4 n LYS 6 Ca 0.25 -2.45 -0.19 0.00 -1.05 0.00 0.00 58.31 54.88 1on4 n LYS 6 Cb 0.45 -0.64 -0.03 0.00 -0.65 0.00 0.00 35.03 34.16 1on4 n LYS 6 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1on4 n ASP 7 N -0.86 0.92 -4.86 -5.58 9.92 -1.26 -4.93 116.55 109.90 1on4 n ASP 7 Ca -0.03 -3.02 -0.31 0.00 -0.53 0.00 0.00 54.79 50.90 1on4 n ASP 7 Cb 0.84 -0.62 -0.01 0.00 -0.64 0.00 0.00 41.12 40.69 1on4 n ASP 7 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1on4 s PRO 8 N -2.39 3.75 0.34 -0.24 0.04 -1.26 -4.69 135.00 130.54 1on4 s PRO 8 Ca 0.40 0.81 0.08 0.00 0.04 0.00 0.00 61.00 62.34 1on4 s PRO 8 Cb 0.34 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.71 1on4 s PRO 8 CO -0.08 -0.42 0.12 -0.48 0.04 0.00 0.00 177.00 176.17 1on4 s LEU 9 N -4.68 3.19 -0.40 -3.56 2.34 -1.18 -4.58 118.68 109.81 1on4 s LEU 9 Ca 0.56 -0.83 0.10 0.00 0.06 0.00 0.00 54.13 54.02 1on4 s LEU 9 Cb -0.11 -1.64 0.35 0.00 -0.56 0.00 0.00 46.19 44.24 1on4 s LEU 9 CO 0.44 -0.30 0.98 0.59 -1.06 0.00 0.00 176.35 177.01 1on4 n ASN 10 N -1.11 -0.71 -4.34 1.48 4.13 -0.84 -4.23 115.26 109.63 1on4 n ASN 10 Ca -0.03 -3.20 -0.46 0.00 1.68 0.00 0.00 54.58 52.57 1on4 n ASN 10 Cb 0.62 0.62 -0.04 0.00 -1.54 0.00 0.00 39.78 39.44 1on4 n ASN 10 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1on4 s TYR 11 N -1.10 3.35 -0.42 3.10 5.04 -0.25 -4.60 117.35 122.47 1on4 s TYR 11 Ca 0.29 -1.46 -0.29 0.00 -2.44 0.00 0.00 57.07 53.18 1on4 s TYR 11 Cb 0.34 -3.89 0.02 0.00 0.35 0.00 0.00 41.96 38.78 1on4 s TYR 11 CO -0.06 -1.11 1.28 -2.00 -1.34 0.00 0.00 175.55 172.33 1on4 s GLU 12 N 1.45 3.70 0.45 4.97 2.12 -1.26 -0.75 118.70 129.38 1on4 s GLU 12 Ca 0.12 0.85 -0.21 0.00 0.36 0.00 0.00 54.97 56.09 1on4 s GLU 12 Cb -0.20 -3.95 -0.10 0.00 0.26 0.00 0.00 34.13 30.14 1on4 s GLU 12 CO -0.01 -1.41 0.98 0.14 -0.54 0.00 0.00 175.26 174.42 1on4 s VAL 13 N 4.86 4.17 -0.16 3.70 -7.23 -0.07 -4.60 120.40 121.06 1on4 s VAL 13 Ca 0.55 1.35 -0.27 0.00 -1.81 0.00 0.00 61.98 61.80 1on4 s VAL 13 Cb -0.12 -3.54 -0.01 0.00 0.56 0.00 0.00 36.38 33.27 1on4 s VAL 13 CO 0.30 -0.29 0.93 -0.70 -0.31 0.00 0.00 175.10 175.03 1on4 s GLU 14 N -3.21 4.33 0.76 4.82 2.56 -1.26 -4.80 118.70 121.89 1on4 s GLU 14 Ca 0.64 1.20 -0.15 0.00 0.00 0.00 0.00 54.97 56.66 1on4 s GLU 14 Cb -0.12 -3.58 0.05 0.00 2.00 0.00 0.00 34.13 32.48 1on4 s GLU 14 CO 0.16 -0.39 1.19 -2.30 -0.56 0.00 0.00 175.26 173.36 1on4 n PRO 15 N 5.40 0.46 -3.76 4.30 -0.02 -1.26 -5.00 135.00 135.13 1on4 n PRO 15 Ca 0.07 0.23 -0.01 0.00 -2.02 0.00 0.00 63.50 61.76 1on4 n PRO 15 Cb 0.48 -2.43 -0.00 0.00 -0.02 0.00 0.00 33.50 31.53 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 -1.90 -0.05 -0.40 6.00 5.36 -1.26 -5.01 117.98 120.72 1on4 s PHE 16 Ca 0.76 -0.20 -0.04 0.00 -0.96 0.00 0.00 56.93 56.48 1on4 s PHE 16 Cb -0.32 0.62 0.10 0.00 -0.34 0.00 0.00 43.02 43.08 1on4 s PHE 16 CO 0.48 -0.65 0.19 0.99 -1.46 0.00 0.00 175.22 174.78 1on4 s THR 17 N -2.72 3.45 0.49 0.12 2.01 -1.26 -2.62 115.64 115.11 1on4 s THR 17 Ca 0.16 -1.84 0.05 0.00 0.31 0.00 0.00 61.69 60.37 1on4 s THR 17 Cb 0.00 -3.26 0.03 0.00 0.01 0.00 0.00 72.50 69.27 1on4 s THR 17 CO 0.01 -0.58 0.68 -0.36 -0.69 0.00 0.00 174.62 173.67 1on4 s PHE 18 N 1.22 2.75 -0.04 4.92 0.08 0.01 -4.89 117.98 122.03 1on4 s PHE 18 Ca 0.05 -0.24 0.05 0.00 0.12 0.00 0.00 56.93 56.92 1on4 s PHE 18 Cb -0.23 -2.56 -0.01 0.00 -0.57 0.00 0.00 43.02 39.66 1on4 s PHE 18 CO -0.03 -0.68 -0.20 -0.65 -0.10 0.00 0.00 175.22 173.57 1on4 s GLN 19 N -4.56 1.96 0.67 0.44 1.11 -1.26 -0.68 119.66 117.33 1on4 s GLN 19 Ca 0.57 -0.70 0.01 0.00 0.01 0.00 0.00 55.36 55.24 1on4 s GLN 19 Cb -0.10 -1.71 0.11 0.00 -1.01 0.00 0.00 33.01 30.29 1on4 s GLN 19 CO 0.36 0.31 0.93 0.54 0.01 0.00 0.00 175.29 177.44 1on4 s ASN 20 N -0.09 4.60 0.13 5.90 4.22 0.02 -0.74 114.94 128.97 1on4 s ASN 20 Ca -0.02 -0.35 0.07 0.00 -2.14 0.00 0.00 52.86 50.42 1on4 s ASN 20 Cb -0.11 -0.14 0.38 0.00 1.28 0.00 0.00 41.25 42.66 1on4 s ASN 20 CO 0.02 -1.68 1.13 0.00 -2.04 0.00 0.00 177.10 174.54 1on4 n GLN 21 N -2.68 0.05 -0.37 3.55 10.64 1.00 -0.51 117.38 129.07 1on4 n GLN 21 Ca 0.14 0.48 0.08 0.00 -1.83 0.00 0.00 57.00 55.86 1on4 n GLN 21 Cb 0.61 -1.78 0.23 0.00 -0.86 0.00 0.00 30.24 28.43 1on4 n GLN 21 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1on4 n ASP 22 N -1.71 3.61 -1.39 2.61 2.03 -1.26 -4.95 116.55 115.50 1on4 n ASP 22 Ca -0.00 -2.66 -0.18 0.00 0.52 0.00 0.00 54.79 52.47 1on4 n ASP 22 Cb 0.14 -0.44 -0.07 0.00 -0.72 0.00 0.00 41.12 40.03 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 -0.11 1.65 3.67 0.27 0.00 0.34 -4.96 105.19 106.06 1on4 n GLY 23 Ca 0.18 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.56 3.99 0.08 1.61 2.36 -1.25 -4.80 119.74 118.18 1on4 s LYS 24 Ca 0.00 -0.30 -0.30 0.00 -2.55 0.00 0.00 55.97 52.82 1on4 s LYS 24 Cb 0.00 -3.26 -0.05 0.00 -1.05 0.00 0.00 37.83 33.47 1on4 s LYS 24 CO 0.00 0.32 1.02 -0.80 1.55 0.00 0.00 175.35 177.43 1on4 s ASN 25 N 0.27 7.37 -0.10 1.43 0.01 -1.26 -0.80 114.94 121.86 1on4 s ASN 25 Ca 0.05 1.83 -0.04 0.00 -0.71 0.00 0.00 52.86 53.99 1on4 s ASN 25 Cb -0.12 -2.58 0.05 0.00 0.41 0.00 0.00 41.25 39.01 1on4 s ASN 25 CO -0.00 -0.20 0.20 0.68 -1.51 0.00 0.00 177.10 176.27 1on4 s VAL 26 N 0.39 -0.32 0.35 1.60 -7.23 0.14 -4.97 120.40 110.36 1on4 s VAL 26 Ca 0.50 0.32 0.06 0.00 -1.81 0.00 0.00 61.98 61.05 1on4 s VAL 26 Cb -0.24 -0.36 -0.01 0.00 0.56 0.00 0.00 36.38 36.33 1on4 s VAL 26 CO 0.30 0.13 0.50 -0.44 -0.31 0.00 0.00 175.10 175.28 1on4 s SER 27 N 2.34 5.96 0.55 4.85 0.01 -1.26 -0.80 113.70 125.34 1on4 s SER 27 Ca 0.03 -0.11 0.30 0.00 1.31 0.00 0.00 55.95 57.47 1on4 s SER 27 Cb -0.12 -1.29 1.46 0.00 0.21 0.00 0.00 66.02 66.28 1on4 s SER 27 CO -0.07 -0.46 1.91 -0.07 0.41 0.00 0.00 173.24 174.96 1on4 h LEU 28 N 0.83 0.00 -0.92 2.44 4.07 -1.90 -0.17 115.31 119.66 1on4 h LEU 28 Ca -0.46 0.00 0.25 0.00 0.08 0.00 0.00 57.88 57.75 1on4 h LEU 28 Cb 1.26 0.00 -0.16 0.00 1.08 0.00 0.00 40.66 42.83 1on4 h LEU 28 CO 0.54 0.00 0.10 -0.33 -1.08 0.00 0.00 178.44 177.67 1on4 h GLU 29 N 0.00 0.07 0.00 1.13 5.08 -1.93 0.47 114.58 119.40 1on4 h GLU 29 Ca 0.33 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1on4 h GLU 29 Cb 1.43 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.67 1on4 h GLU 29 CO -0.00 0.05 0.00 -1.13 -1.00 0.00 0.00 179.01 176.92 1on4 n SER 30 N -5.39 0.00 0.00 1.42 3.41 -0.07 -3.42 113.62 109.57 1on4 n SER 30 Ca 0.22 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.96 1on4 n SER 30 Cb 0.72 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 1on4 n SER 30 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1on4 n LEU 31 N -1.34 0.00 -4.59 1.04 4.77 0.64 -4.96 117.00 112.56 1on4 n LEU 31 Ca 0.08 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.64 1on4 n LEU 31 Cb 0.18 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1on4 n LEU 31 CO 0.16 0.00 1.23 -0.75 -1.33 0.00 0.00 177.39 176.71 1on4 s LYS 32 N -1.82 3.48 0.00 3.23 2.36 0.13 -0.86 119.74 126.26 1on4 s LYS 32 Ca 0.00 0.74 0.00 0.00 -2.55 0.00 0.00 55.97 54.16 1on4 s LYS 32 Cb 0.00 -4.06 0.00 0.00 -1.05 0.00 0.00 37.83 32.72 1on4 s LYS 32 CO 0.00 -1.70 0.00 0.41 1.55 0.00 0.00 175.35 175.61 1on4 n GLY 33 N 5.14 1.12 3.86 5.54 0.00 -1.25 -4.96 105.19 114.63 1on4 n GLY 33 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 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 3.15 -1.20 1.61 8.01 -0.04 -4.80 118.70 125.43 1on4 s GLU 34 Ca 0.00 -0.69 -0.09 0.00 0.01 0.00 0.00 54.97 54.20 1on4 s GLU 34 Cb 0.00 -2.82 0.21 0.00 -4.31 0.00 0.00 34.13 27.21 1on4 s GLU 34 CO 0.00 0.53 1.58 1.55 0.01 0.00 0.00 175.26 178.93 1on4 n VAL 35 N -0.16 4.57 -3.17 2.63 3.14 -1.26 -3.10 118.33 120.98 1on4 n VAL 35 Ca -0.07 -4.94 -0.32 0.00 -2.96 0.00 0.00 64.34 56.04 1on4 n VAL 35 Cb 0.53 -2.36 -0.06 0.00 -1.06 0.00 0.00 33.84 30.90 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 -0.21 3.38 0.03 1.45 1.48 -1.10 -4.67 118.94 119.30 1on4 s TRP 36 Ca 0.37 1.17 -0.01 0.00 -1.06 0.00 0.00 56.10 56.57 1on4 s TRP 36 Cb 0.03 -2.50 -0.04 0.00 -1.16 0.00 0.00 33.47 29.80 1on4 s TRP 36 CO 0.01 0.11 0.19 -0.51 -4.06 0.00 0.00 176.95 172.70 1on4 s LEU 37 N -2.98 4.35 -0.08 -4.66 1.43 -0.15 -0.48 118.68 116.10 1on4 s LEU 37 Ca 0.53 0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.95 1on4 s LEU 37 Cb -0.10 -2.80 0.01 0.00 0.03 0.00 0.00 46.19 43.33 1on4 s LEU 37 CO 0.18 0.21 -0.14 0.00 0.23 0.00 0.00 176.35 176.83 1on4 s ALA 38 N -1.43 1.46 -0.34 4.21 0.00 0.99 -0.31 121.76 126.34 1on4 s ALA 38 Ca 0.32 -0.55 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 1on4 s ALA 38 Cb -0.13 -0.68 0.13 0.00 0.00 0.00 0.00 23.12 22.45 1on4 s ALA 38 CO 0.24 0.06 0.20 -0.51 0.00 0.00 0.00 175.76 175.74 1on4 s ASP 39 N 0.77 3.04 -0.03 0.00 1.11 -0.27 -0.26 116.67 121.03 1on4 s ASP 39 Ca -0.12 -2.03 -0.16 0.00 0.18 0.00 0.00 52.55 50.42 1on4 s ASP 39 Cb -0.16 -0.38 -0.05 0.00 1.07 0.00 0.00 42.92 43.40 1on4 s ASP 39 CO 0.02 -0.33 0.44 0.72 1.18 0.00 0.00 175.17 177.20 1on4 s PHE 40 N 1.25 3.66 0.20 4.23 -0.71 -1.26 -4.26 117.98 121.09 1on4 s PHE 40 Ca 0.17 0.97 -0.20 0.00 -1.04 0.00 0.00 56.93 56.82 1on4 s PHE 40 Cb -0.22 -2.38 0.04 0.00 -1.21 0.00 0.00 43.02 39.25 1on4 s PHE 40 CO -0.05 0.49 0.59 0.96 -1.34 0.00 0.00 175.22 175.86 1on4 s ILE 41 N -0.53 0.01 -0.47 -4.49 -4.36 -1.25 -4.44 121.20 105.66 1on4 s ILE 41 Ca 0.24 -0.52 -0.08 0.00 -0.26 0.00 0.00 60.65 60.04 1on4 s ILE 41 Cb -0.16 -1.42 0.12 0.00 1.25 0.00 0.00 42.46 42.25 1on4 s ILE 41 CO 0.13 -0.06 0.33 0.72 0.24 0.00 0.00 174.94 176.30 1on4 s PHE 42 N -3.83 3.47 -1.61 1.37 -0.71 -1.26 -3.67 117.98 111.74 1on4 s PHE 42 Ca 0.06 -2.05 -0.10 0.00 -1.04 0.00 0.00 56.93 53.81 1on4 s PHE 42 Cb -0.02 -3.43 -0.09 0.00 -1.21 0.00 0.00 43.02 38.27 1on4 s PHE 42 CO -0.05 -0.98 2.96 0.25 -1.34 0.00 0.00 175.22 176.06 1on4 n THR 43 N 4.74 4.29 -3.02 -4.49 -2.24 -1.26 -4.61 114.28 107.68 1on4 n THR 43 Ca -0.05 -2.56 -0.15 0.00 -2.27 0.00 0.00 64.05 59.03 1on4 n THR 43 Cb 0.41 -2.61 0.01 0.00 -2.10 0.00 0.00 70.33 66.04 1on4 n THR 43 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1on4 n ASN 44 N 3.58 -0.25 -4.22 3.42 6.94 -1.26 -4.62 115.26 118.85 1on4 n ASN 44 Ca 0.78 -3.23 -0.28 0.00 -0.02 0.00 0.00 54.58 51.83 1on4 n ASN 44 Cb 0.23 0.25 -0.16 0.00 -2.36 0.00 0.00 39.78 37.75 1on4 n ASN 44 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1on4 h GLU 46 N 5.74 -0.57 -4.35 0.00 4.22 -2.02 -3.35 114.58 114.25 1on4 h GLU 46 Ca -0.38 0.04 -0.66 0.00 0.08 0.00 0.00 59.36 58.44 1on4 h GLU 46 Cb 1.15 0.13 0.03 0.00 0.50 0.00 0.00 28.75 30.56 1on4 h GLU 46 CO 0.48 -0.38 2.47 0.25 -2.18 0.00 0.00 179.01 179.65 1on4 n THR 47 N -5.10 2.14 -1.57 0.32 -2.24 -1.26 -4.94 114.28 101.63 1on4 n THR 47 Ca -0.07 -1.85 -0.37 0.00 -2.27 0.00 0.00 64.05 59.49 1on4 n THR 47 Cb 0.23 -2.37 0.07 0.00 -2.10 0.00 0.00 70.33 66.16 1on4 n THR 47 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1on4 n ILE 48 N 5.78 3.78 0.06 2.28 -6.64 -1.26 -4.83 119.36 118.52 1on4 n ILE 48 Ca 0.50 -0.47 0.00 0.00 -1.77 0.00 0.00 62.75 61.01 1on4 n ILE 48 Cb 0.39 -1.20 0.00 0.00 -1.44 0.00 0.00 39.64 37.40 1on4 n ILE 48 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1on4 s PRO 50 N -2.00 3.41 -1.37 0.00 0.04 -1.26 -4.85 135.00 128.97 1on4 s PRO 50 Ca 0.00 2.22 -0.14 0.00 0.04 0.00 0.00 61.00 63.13 1on4 s PRO 50 Cb 0.00 -2.41 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 1on4 s PRO 50 CO 0.00 -0.97 2.37 -0.35 0.04 0.00 0.00 177.00 178.09 1on4 n PRO 51 N -0.67 2.83 0.00 0.56 -0.04 -1.26 -4.74 135.00 131.68 1on4 n PRO 51 Ca 0.08 -2.32 0.00 0.00 -0.04 0.00 0.00 63.50 61.22 1on4 n PRO 51 Cb 0.44 -3.06 0.00 0.00 -0.04 0.00 0.00 33.50 30.85 1on4 n PRO 51 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1on4 n MET 52 N 5.46 0.00 -1.19 0.54 2.81 -1.26 -4.13 117.12 119.36 1on4 n MET 52 Ca 0.58 0.00 -0.22 0.00 -1.81 0.00 0.00 57.70 56.25 1on4 n MET 52 Cb 0.33 -0.51 -0.00 0.00 -0.71 0.00 0.00 33.22 32.33 1on4 n MET 52 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1on4 n THR 53 N -0.14 3.07 -0.01 2.03 -1.04 -1.26 -4.11 114.28 112.82 1on4 n THR 53 Ca 0.00 -2.33 -0.03 0.00 -2.04 0.00 0.00 64.05 59.65 1on4 n THR 53 Cb 0.00 -1.44 -0.01 0.00 -1.82 0.00 0.00 70.33 67.06 1on4 n THR 53 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1on4 n ALA 54 N 0.51 1.79 -0.12 2.41 0.00 -1.26 -3.50 120.51 120.35 1on4 n ALA 54 Ca 0.40 -0.32 -0.06 0.00 0.00 0.00 0.00 53.44 53.47 1on4 n ALA 54 Cb 0.57 0.09 0.02 0.00 0.00 0.00 0.00 19.45 20.14 1on4 n ALA 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1on4 h HIS 55 N -0.34 0.33 -0.97 0.00 3.86 -1.75 0.17 115.15 116.45 1on4 h HIS 55 Ca 0.00 0.02 0.11 0.00 -1.16 0.00 0.00 60.37 59.34 1on4 h HIS 55 Cb 0.34 -0.09 -0.13 0.00 1.06 0.00 0.00 27.41 28.58 1on4 h HIS 55 CO -0.14 0.16 -0.49 -0.12 0.86 0.00 0.00 177.93 178.20 1on4 n MET 56 N -4.95 -0.34 -0.13 2.45 1.56 -1.26 -1.08 117.12 113.37 1on4 n MET 56 Ca 0.02 1.47 -0.12 0.00 -0.27 0.00 0.00 57.70 58.80 1on4 n MET 56 Cb 0.11 -2.17 -0.02 0.00 2.15 0.00 0.00 33.22 33.29 1on4 n MET 56 CO 0.00 0.00 0.00 1.79 -0.73 0.00 0.00 175.97 177.03 1on4 h THR 57 N 0.00 1.28 0.00 1.12 1.35 -1.18 0.31 112.91 115.79 1on4 h THR 57 Ca 0.23 -1.36 -0.03 0.00 -0.55 0.00 0.00 66.41 64.70 1on4 h THR 57 Cb 0.48 1.33 -0.00 0.00 -1.73 0.00 0.00 68.15 68.23 1on4 h THR 57 CO -0.93 0.45 -0.14 -0.78 -0.25 0.00 0.00 175.52 173.87 1on4 h ASP 58 N 0.62 0.00 -0.06 5.36 3.58 -0.62 -0.28 116.42 125.03 1on4 h ASP 58 Ca 0.08 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 1on4 h ASP 58 Cb 0.78 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.83 1on4 h ASP 58 CO 0.06 0.14 -0.12 -0.07 -2.88 0.00 0.00 179.24 176.38 1on4 h LEU 59 N 0.00 0.20 -0.95 2.28 4.07 -0.66 -3.34 115.31 116.92 1on4 h LEU 59 Ca -0.00 -0.57 0.26 0.00 0.08 0.00 0.00 57.88 57.65 1on4 h LEU 59 Cb 0.27 -0.06 -0.17 0.00 1.08 0.00 0.00 40.66 41.78 1on4 h LEU 59 CO 0.02 0.73 0.07 -0.61 -1.08 0.00 0.00 178.44 177.57 1on4 h GLN 60 N -0.33 0.04 -0.65 1.13 -0.00 0.12 0.35 115.11 115.77 1on4 h GLN 60 Ca 0.00 -0.00 0.06 0.00 -0.00 0.00 0.00 58.65 58.71 1on4 h GLN 60 Cb 0.70 -0.01 -0.08 0.00 0.00 0.00 0.00 27.48 28.09 1on4 h GLN 60 CO 0.03 0.03 -0.39 -0.22 0.00 0.00 0.00 178.83 178.28 1on4 h LYS 61 N 0.04 -0.00 -0.06 1.69 3.64 -1.28 0.15 116.57 120.76 1on4 h LYS 61 Ca 0.58 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.83 1on4 h LYS 61 Cb 1.19 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 1on4 h LYS 61 CO -0.85 -0.00 -0.55 -0.22 -2.27 0.00 0.00 179.45 175.56 1on4 h LYS 62 N -0.00 0.17 -0.03 1.90 3.64 -0.64 -2.99 116.57 118.63 1on4 h LYS 62 Ca 0.10 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1on4 h LYS 62 Cb 0.27 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1on4 h LYS 62 CO -0.62 0.67 0.02 -0.07 -2.27 0.00 0.00 179.45 177.19 1on4 h LEU 63 N 0.13 0.00 -2.17 5.20 -0.00 0.69 0.44 115.31 119.60 1on4 h LEU 63 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.87 1on4 h LEU 63 Cb 1.01 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.66 1on4 h LEU 63 CO 0.08 0.00 -0.06 0.50 -0.00 0.00 0.00 178.44 178.96 1on4 h LYS 64 N 0.00 0.00 0.17 1.13 3.64 -0.60 0.41 116.57 121.32 1on4 h LYS 64 Ca 0.01 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1on4 h LYS 64 Cb 0.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1on4 h LYS 64 CO -0.00 0.06 -0.08 0.00 -2.27 0.00 0.00 179.45 177.16 1on4 h ALA 65 N 1.94 -0.22 -0.32 5.00 0.00 -0.33 -3.36 119.26 121.96 1on4 h ALA 65 Ca -0.00 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 54.92 1on4 h ALA 65 Cb 0.14 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1on4 h ALA 65 CO 0.01 -0.21 0.38 0.93 0.00 0.00 0.00 179.25 180.36 1on4 h GLU 66 N -1.05 0.00 -0.36 0.00 4.39 -0.79 -2.82 114.58 113.96 1on4 h GLU 66 Ca -0.02 0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.81 1on4 h GLU 66 Cb 0.24 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 1on4 h GLU 66 CO 0.04 0.00 0.22 -1.71 -1.16 0.00 0.00 179.01 176.40 1on4 n ASN 67 N -3.64 0.07 0.00 1.42 4.05 0.14 -3.82 115.26 113.48 1on4 n ASN 67 Ca 0.05 0.41 0.00 0.00 0.45 0.00 0.00 54.58 55.49 1on4 n ASN 67 Cb 0.53 -0.20 0.00 0.00 1.23 0.00 0.00 39.78 41.34 1on4 n ASN 67 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1on4 n ILE 68 N -3.31 0.00 -2.88 -1.44 -0.00 -1.07 -1.07 119.36 109.60 1on4 n ILE 68 Ca 0.11 0.00 -0.10 0.00 -0.00 0.00 0.00 62.75 62.76 1on4 n ILE 68 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.06 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 -2.58 -2.52 -3.74 4.38 -0.08 -1.25 -5.15 116.55 105.61 1on4 n ASP 69 Ca 0.00 -2.98 -0.15 0.00 -1.51 0.00 0.00 54.79 50.16 1on4 n ASP 69 Cb 0.00 1.26 -0.08 0.00 2.34 0.00 0.00 41.12 44.64 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 0.49 0.00 -0.05 5.18 -7.23 -0.23 -4.30 120.40 114.26 1on4 s VAL 70 Ca 0.32 -1.90 -0.18 0.00 -1.81 0.00 0.00 61.98 58.40 1on4 s VAL 70 Cb 0.11 -2.50 0.04 0.00 0.56 0.00 0.00 36.38 34.59 1on4 s VAL 70 CO -0.15 0.00 0.41 -0.60 -0.31 0.00 0.00 175.10 174.45 1on4 s ARG 71 N -3.73 0.73 -0.40 4.82 6.06 -1.26 -4.66 118.95 120.50 1on4 s ARG 71 Ca 0.37 0.04 -0.09 0.00 -2.50 0.00 0.00 55.73 53.55 1on4 s ARG 71 Cb 0.04 0.33 0.07 0.00 0.06 0.00 0.00 34.95 35.45 1on4 s ARG 71 CO 0.19 -0.20 0.23 -1.50 -2.50 0.00 0.00 175.30 171.52 1on4 s ILE 72 N -1.05 4.16 0.26 4.11 -1.16 -0.79 -0.97 121.20 125.75 1on4 s ILE 72 Ca -0.11 -1.33 -0.10 0.00 -0.51 0.00 0.00 60.65 58.60 1on4 s ILE 72 Cb -0.04 -3.50 -0.07 0.00 0.61 0.00 0.00 42.46 39.46 1on4 s ILE 72 CO 0.05 -0.44 0.58 -0.63 -2.81 0.00 0.00 174.94 171.69 1on4 s ILE 73 N 1.42 4.91 -0.30 2.00 1.09 0.58 -1.48 121.20 129.42 1on4 s ILE 73 Ca 0.02 0.47 -0.01 0.00 -1.10 0.00 0.00 60.65 60.03 1on4 s ILE 73 Cb -0.22 -3.64 0.13 0.00 -1.06 0.00 0.00 42.46 37.67 1on4 s ILE 73 CO 0.02 -0.14 0.26 -0.44 -0.10 0.00 0.00 174.94 174.54 1on4 s SER 74 N -2.50 2.15 0.33 3.58 0.01 -0.00 -1.12 113.70 116.15 1on4 s SER 74 Ca 0.48 -1.09 -0.27 0.00 1.31 0.00 0.00 55.95 56.38 1on4 s SER 74 Cb -0.11 0.25 -0.09 0.00 0.21 0.00 0.00 66.02 66.27 1on4 s SER 74 CO 0.23 -0.38 1.04 0.72 0.41 0.00 0.00 173.24 175.26 1on4 s PHE 75 N 2.09 3.50 0.84 2.43 -0.12 -1.26 -0.57 117.98 124.90 1on4 s PHE 75 Ca 0.11 1.71 -0.12 0.00 -0.05 0.00 0.00 56.93 58.58 1on4 s PHE 75 Cb -0.15 -3.14 0.09 0.00 -0.63 0.00 0.00 43.02 39.19 1on4 s PHE 75 CO -0.28 -0.39 1.13 0.45 -0.05 0.00 0.00 175.22 176.08 1on4 s SER 76 N -1.28 4.19 -0.13 1.98 0.15 0.61 -3.75 113.70 115.47 1on4 s SER 76 Ca 0.50 1.04 -0.04 0.00 0.70 0.00 0.00 55.95 58.15 1on4 s SER 76 Cb -0.26 -1.66 0.06 0.00 -1.71 0.00 0.00 66.02 62.45 1on4 s SER 76 CO 0.32 -2.13 0.15 -0.69 1.20 0.00 0.00 173.24 172.09 1on4 s VAL 77 N -3.32 -0.22 -1.25 4.45 1.01 -1.24 -4.76 120.40 115.07 1on4 s VAL 77 Ca 0.62 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 62.63 1on4 s VAL 77 Cb -0.13 -0.43 -0.00 0.00 0.00 0.00 0.00 36.38 35.81 1on4 s VAL 77 CO 0.52 -0.02 0.64 -0.67 0.00 0.00 0.00 175.10 175.58 1on4 n ASP 78 N 5.31 -3.02 0.28 3.32 -0.08 -1.26 -4.64 116.55 116.47 1on4 n ASP 78 Ca -0.05 -1.00 0.19 0.00 -1.51 0.00 0.00 54.79 52.42 1on4 n ASP 78 Cb 0.50 -3.30 0.91 0.00 2.34 0.00 0.00 41.12 41.56 1on4 n ASP 78 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1on4 h PRO 79 N -1.89 0.00 0.12 -0.67 0.13 -1.86 -2.02 132.00 125.81 1on4 h PRO 79 Ca -0.65 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.49 1on4 h PRO 79 Cb 1.37 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.47 1on4 h PRO 79 CO 0.54 0.00 -0.19 0.93 -0.23 0.00 0.00 178.00 179.05 1on4 h GLU 80 N 0.00 -0.35 0.50 0.86 5.08 -1.90 0.32 114.58 119.08 1on4 h GLU 80 Ca 0.00 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1on4 h GLU 80 Cb 0.23 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1on4 h GLU 80 CO 0.00 -0.24 -0.24 -0.91 -1.00 0.00 0.00 179.01 176.62 1on4 h ASN 81 N -0.37 -0.57 0.03 1.42 2.35 -1.93 -3.41 115.58 113.11 1on4 h ASN 81 Ca 0.02 0.02 -0.10 0.00 -0.55 0.00 0.00 56.30 55.69 1on4 h ASN 81 Cb 0.38 0.15 0.01 0.00 0.05 0.00 0.00 38.32 38.91 1on4 h ASN 81 CO -0.10 -0.29 -0.40 0.44 -1.65 0.00 0.00 177.43 175.43 1on4 h ASP 82 N -0.90 0.30 -3.92 5.81 3.32 -1.26 -3.51 116.42 116.26 1on4 h ASP 82 Ca -0.07 -0.85 0.05 0.00 0.02 0.00 0.00 57.03 56.18 1on4 h ASP 82 Cb 0.52 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 1on4 h ASP 82 CO 0.11 1.12 -0.33 0.29 -1.72 0.00 0.00 179.24 178.71 1on4 n LYS 83 N -4.38 -1.10 0.22 3.56 5.02 0.11 -3.78 118.16 117.80 1on4 n LYS 83 Ca -0.11 0.87 0.17 0.00 -2.02 0.00 0.00 58.31 57.22 1on4 n LYS 83 Cb 0.61 -1.17 0.84 0.00 -0.02 0.00 0.00 35.03 35.28 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 -0.19 0.00 -0.87 1.97 0.13 -1.97 0.63 132.00 131.69 1on4 h PRO 84 Ca -0.03 0.00 0.21 0.00 -0.87 0.00 0.00 66.00 65.31 1on4 h PRO 84 Cb 0.35 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.35 1on4 h PRO 84 CO 0.01 0.00 0.34 -0.22 -0.23 0.00 0.00 178.00 177.90 1on4 h LYS 85 N 0.00 0.34 -0.25 0.86 1.63 -1.94 0.14 116.57 117.35 1on4 h LYS 85 Ca 0.07 -0.02 -0.16 0.00 -0.85 0.00 0.00 60.65 59.70 1on4 h LYS 85 Cb 0.42 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 1on4 h LYS 85 CO -0.00 0.22 -0.46 1.96 -3.45 0.00 0.00 179.45 177.72 1on4 h GLN 86 N 0.35 0.75 0.10 1.90 1.08 -0.96 0.16 115.11 118.49 1on4 h GLN 86 Ca 0.54 -0.48 0.01 0.00 -1.45 0.00 0.00 58.65 57.27 1on4 h GLN 86 Cb 1.02 0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 28.49 1on4 h GLN 86 CO -0.55 1.10 -0.14 -0.07 -0.95 0.00 0.00 178.83 178.23 1on4 h LEU 87 N 0.49 -0.37 -0.89 1.46 4.07 -1.41 0.11 115.31 118.77 1on4 h LEU 87 Ca 0.01 0.04 -0.04 0.00 0.08 0.00 0.00 57.88 57.98 1on4 h LEU 87 Cb 1.07 0.14 -0.03 0.00 1.08 0.00 0.00 40.66 42.91 1on4 h LEU 87 CO 0.10 -0.21 0.32 0.50 -1.08 0.00 0.00 178.44 178.08 1on4 h LYS 88 N -0.28 1.13 0.61 1.13 3.64 -0.63 0.18 116.57 122.34 1on4 h LYS 88 Ca 0.02 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.19 1on4 h LYS 88 Cb 0.29 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1on4 h LYS 88 CO -0.06 0.90 -0.43 0.87 -2.27 0.00 0.00 179.45 178.45 1on4 h LYS 89 N 1.10 -0.97 -0.66 1.90 1.57 -0.52 -2.83 116.57 116.18 1on4 h LYS 89 Ca 0.26 0.07 0.09 0.00 -1.87 0.00 0.00 60.65 59.19 1on4 h LYS 89 Cb 0.18 0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.67 1on4 h LYS 89 CO -0.02 -0.64 0.43 0.35 -0.57 0.00 0.00 179.45 179.00 1on4 h PHE 90 N -1.00 0.58 0.00 -1.35 3.04 -0.25 0.15 116.94 118.11 1on4 h PHE 90 Ca -0.07 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.88 1on4 h PHE 90 Cb 0.83 -0.19 -0.00 0.00 2.56 0.00 0.00 35.95 39.15 1on4 h PHE 90 CO -0.15 0.28 -0.04 0.00 -2.02 0.00 0.00 178.31 176.39 1on4 h ALA 91 N 1.66 1.03 0.00 2.41 0.00 -0.57 0.18 119.26 123.97 1on4 h ALA 91 Ca 0.30 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1on4 h ALA 91 Cb 0.44 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1on4 h ALA 91 CO -0.09 0.05 -0.07 0.00 0.00 0.00 0.00 179.25 179.13 1on4 h ALA 92 N 1.96 1.00 0.00 0.00 0.00 -0.45 -3.35 119.26 118.42 1on4 h ALA 92 Ca -0.00 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1on4 h ALA 92 Cb 0.45 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1on4 h ALA 92 CO 0.00 0.09 -1.30 0.09 0.00 0.00 0.00 179.25 178.13 1on4 n ASN 93 N -3.17 1.92 -4.67 0.00 5.03 0.42 -4.76 115.26 110.03 1on4 n ASN 93 Ca 0.01 0.39 -0.42 0.00 0.87 0.00 0.00 54.58 55.43 1on4 n ASN 93 Cb 0.39 -0.80 -0.03 0.00 -1.02 0.00 0.00 39.78 38.32 1on4 n ASN 93 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1on4 s TYR 94 N -2.66 1.85 -1.11 3.10 1.51 0.06 -4.87 117.35 115.24 1on4 s TYR 94 Ca -0.29 0.02 -0.18 0.00 -1.01 0.00 0.00 57.07 55.61 1on4 s TYR 94 Cb 0.06 -4.02 -0.06 0.00 -0.11 0.00 0.00 41.96 37.83 1on4 s TYR 94 CO 0.42 -4.37 2.07 -0.35 -1.11 0.00 0.00 175.55 172.21 1on4 n PRO 95 N 6.97 2.17 -3.81 -1.71 -0.04 -1.26 -4.60 135.00 132.73 1on4 n PRO 95 Ca 0.18 -2.24 -0.28 0.00 -0.04 0.00 0.00 63.50 61.11 1on4 n PRO 95 Cb 0.42 -3.12 -0.04 0.00 -0.04 0.00 0.00 33.50 30.73 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 1.87 4.29 -0.17 1.53 0.05 -1.26 -4.97 118.68 120.02 1on4 s LEU 96 Ca 0.53 0.34 -0.10 0.00 0.05 0.00 0.00 54.13 54.94 1on4 s LEU 96 Cb 0.14 -3.08 -0.05 0.00 -2.05 0.00 0.00 46.19 41.15 1on4 s LEU 96 CO 0.02 0.04 0.17 -0.55 -0.55 0.00 0.00 176.35 175.48 1on4 s SER 97 N -2.92 6.30 0.57 1.48 0.15 -1.26 -4.94 113.70 113.08 1on4 s SER 97 Ca 0.37 0.34 0.31 0.00 0.70 0.00 0.00 55.95 57.68 1on4 s SER 97 Cb -0.12 -2.11 1.75 0.00 -1.71 0.00 0.00 66.02 63.84 1on4 s SER 97 CO 0.28 0.20 2.19 -0.26 1.20 0.00 0.00 173.24 176.85 1on4 h PHE 98 N 6.36 0.00 0.00 3.44 0.04 -1.96 -3.40 116.94 121.42 1on4 h PHE 98 Ca -0.43 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.34 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 0.62 0.05 0.00 -0.25 -0.60 0.00 0.00 178.31 178.12 1on4 n ASP 99 N -3.62 0.00 -2.68 2.17 8.00 -1.26 -0.79 116.55 118.37 1on4 n ASP 99 Ca -0.02 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.39 1on4 n ASP 99 Cb 0.15 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.28 1on4 n ASP 99 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1on4 n ASN 100 N -0.65 1.53 -3.93 -2.24 5.15 -1.26 -5.07 115.26 108.79 1on4 n ASN 100 Ca 0.00 -2.64 -0.30 0.00 -0.60 0.00 0.00 54.58 51.04 1on4 n ASN 100 Cb 0.00 -0.52 -0.16 0.00 -0.53 0.00 0.00 39.78 38.57 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 -3.22 2.28 -0.84 1.20 -0.11 0.03 -1.89 118.94 116.38 1on4 s TRP 101 Ca 0.27 -1.65 -0.14 0.00 1.22 0.00 0.00 56.10 55.80 1on4 s TRP 101 Cb 0.44 -1.54 0.22 0.00 -1.50 0.00 0.00 33.47 31.09 1on4 s TRP 101 CO 0.02 -0.75 0.79 -0.51 -4.62 0.00 0.00 176.95 171.89 1on4 s ASP 102 N 1.44 6.77 -0.19 5.86 1.01 -0.55 -4.94 116.67 126.07 1on4 s ASP 102 Ca -0.05 -2.68 -0.29 0.00 0.71 0.00 0.00 52.55 50.24 1on4 s ASP 102 Cb -0.18 -2.22 -0.01 0.00 1.01 0.00 0.00 42.92 41.52 1on4 s ASP 102 CO -0.07 -0.59 1.24 -0.36 0.21 0.00 0.00 175.17 175.60 1on4 s PHE 103 N 0.25 2.89 -0.06 4.23 0.08 -1.26 -0.82 117.98 123.30 1on4 s PHE 103 Ca 0.19 1.05 -0.03 0.00 0.12 0.00 0.00 56.93 58.27 1on4 s PHE 103 Cb -0.10 -3.53 -0.04 0.00 -0.57 0.00 0.00 43.02 38.79 1on4 s PHE 103 CO -0.09 -1.53 0.08 -0.51 -0.10 0.00 0.00 175.22 173.08 1on4 s LEU 104 N 3.57 3.98 -0.01 -0.37 1.43 0.27 -0.00 118.68 127.56 1on4 s LEU 104 Ca 0.53 0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.88 1on4 s LEU 104 Cb -0.20 -2.13 -0.00 0.00 0.03 0.00 0.00 46.19 43.89 1on4 s LEU 104 CO 0.14 0.33 -0.00 0.71 0.23 0.00 0.00 176.35 177.76 1on4 h THR 105 N 3.62 0.00 -1.34 5.49 1.35 -1.23 0.18 112.91 120.98 1on4 h THR 105 Ca -0.51 -0.07 -0.28 0.00 -0.55 0.00 0.00 66.41 65.00 1on4 h THR 105 Cb 1.20 0.00 -0.06 0.00 -1.73 0.00 0.00 68.15 67.56 1on4 h THR 105 CO 0.60 0.00 -0.31 0.61 -0.25 0.00 0.00 175.52 176.17 1on4 n GLY 106 N 1.89 0.60 5.49 5.82 0.00 -1.26 -4.36 105.19 113.37 1on4 n GLY 106 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.33 0.00 -1.38 1.61 9.36 -1.26 -3.25 117.16 118.91 1on4 n TYR 107 Ca -0.15 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.75 1on4 n TYR 107 Cb 0.54 0.00 0.08 0.00 -0.63 0.00 0.00 39.34 39.33 1on4 n TYR 107 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 1on4 s SER 108 N -3.14 4.63 0.22 2.98 1.04 -1.26 -4.54 113.70 113.64 1on4 s SER 108 Ca 0.00 1.88 -0.10 0.00 0.48 0.00 0.00 55.95 58.21 1on4 s SER 108 Cb 0.00 -2.53 0.33 0.00 0.10 0.00 0.00 66.02 63.92 1on4 s SER 108 CO 0.00 -1.95 1.64 1.56 0.98 0.00 0.00 173.24 175.47 1on4 h GLN 109 N -0.82 0.08 -0.48 4.02 1.08 -1.95 -0.00 115.11 117.03 1on4 h GLN 109 Ca -0.44 -0.00 0.10 0.00 -1.45 0.00 0.00 58.65 56.85 1on4 h GLN 109 Cb 1.24 -0.02 -0.09 0.00 -0.05 0.00 0.00 27.48 28.56 1on4 h GLN 109 CO 0.52 0.05 -0.05 1.03 -0.95 0.00 0.00 178.83 179.43 1on4 h SER 110 N 0.08 -0.31 0.53 1.46 0.87 -1.92 0.43 113.55 114.67 1on4 h SER 110 Ca 0.35 0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 61.01 1on4 h SER 110 Cb 0.58 0.25 0.01 0.00 -0.44 0.00 0.00 62.40 62.79 1on4 h SER 110 CO -0.61 -0.11 -0.25 -0.33 -0.53 0.00 0.00 176.83 175.00 1on4 h GLU 111 N 0.06 -0.68 0.00 2.24 5.08 -1.66 -3.31 114.58 116.32 1on4 h GLU 111 Ca 0.24 0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.64 1on4 h GLU 111 Cb 0.37 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1on4 h GLU 111 CO -0.45 -0.45 -0.03 0.97 -1.00 0.00 0.00 179.01 178.05 1on4 h ILE 112 N -0.81 0.09 0.34 3.13 -0.00 -0.78 -3.21 117.51 116.27 1on4 h ILE 112 Ca -0.07 -0.58 -0.01 0.00 -0.00 0.00 0.00 64.86 64.20 1on4 h ILE 112 Cb 0.54 1.53 -0.03 0.00 -0.00 0.00 0.00 36.82 38.87 1on4 h ILE 112 CO 0.12 0.03 -0.46 -0.08 -0.00 0.00 0.00 178.15 177.76 1on4 h GLU 113 N 0.00 -0.80 -0.22 2.19 4.81 -0.23 -0.69 114.58 119.63 1on4 h GLU 113 Ca -0.00 0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.34 1on4 h GLU 113 Cb 0.53 0.18 -0.07 0.00 0.63 0.00 0.00 28.75 30.02 1on4 h GLU 113 CO 0.00 -0.53 -0.26 1.49 -0.73 0.00 0.00 179.01 178.98 1on4 h GLU 114 N -0.83 -0.27 -0.53 1.92 4.81 -1.68 0.44 114.58 118.45 1on4 h GLU 114 Ca -0.04 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.26 1on4 h GLU 114 Cb 0.75 0.06 -0.08 0.00 0.63 0.00 0.00 28.75 30.11 1on4 h GLU 114 CO -0.12 -0.18 -0.48 0.35 -0.73 0.00 0.00 179.01 177.85 1on4 h PHE 115 N -0.28 -1.51 0.00 0.92 3.57 -1.72 -0.03 116.94 117.89 1on4 h PHE 115 Ca 0.13 0.08 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 1on4 h PHE 115 Cb 0.48 0.73 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 1on4 h PHE 115 CO -0.40 -0.38 -0.38 0.00 -2.23 0.00 0.00 178.31 174.91 1on4 h ALA 116 N -0.06 1.31 0.27 2.41 0.00 0.72 0.10 119.26 124.01 1on4 h ALA 116 Ca 0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1on4 h ALA 116 Cb 0.45 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1on4 h ALA 116 CO -0.61 0.48 -0.13 1.25 0.00 0.00 0.00 179.25 180.24 1on4 h LEU 117 N 0.00 -0.31 -0.21 0.00 7.12 0.03 0.24 115.31 122.18 1on4 h LEU 117 Ca -0.00 -0.22 0.05 0.00 0.13 0.00 0.00 57.88 57.84 1on4 h LEU 117 Cb 0.70 0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 40.86 1on4 h LEU 117 CO 0.05 0.17 -0.17 0.50 -0.13 0.00 0.00 178.44 178.86 1on4 h LYS 118 N -0.91 -0.17 0.42 1.25 3.11 -0.91 -2.26 116.57 117.10 1on4 h LYS 118 Ca -0.04 0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.79 1on4 h LYS 118 Cb 0.51 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.78 1on4 h LYS 118 CO 0.06 -0.11 -0.20 0.77 -2.81 0.00 0.00 179.45 177.15 1on4 h SER 119 N -0.18 -0.48 0.00 4.20 0.02 -0.85 -3.44 113.55 112.82 1on4 h SER 119 Ca 0.12 0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.99 1on4 h SER 119 Cb 0.36 0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1on4 h SER 119 CO -0.31 -0.23 -1.16 0.49 -1.14 0.00 0.00 176.83 174.47 1on4 n PHE 120 N -4.17 0.00 -0.60 3.45 3.72 0.62 -4.71 117.46 115.77 1on4 n PHE 120 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1on4 n PHE 120 Cb 0.22 -0.48 0.00 0.00 -0.94 0.00 0.00 39.48 38.28 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 -4.14 0.00 -4.44 -1.08 0.00 0.10 -4.95 118.16 103.64 1on4 n LYS 121 Ca -0.19 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 57.89 1on4 n LYS 121 Cb 0.51 -0.73 -0.09 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 s ALA 122 N -1.78 2.44 0.03 0.58 0.00 -0.97 -4.95 121.76 117.11 1on4 s ALA 122 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 51.96 50.31 1on4 s ALA 122 Cb 0.00 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.94 1on4 s ALA 122 CO 0.00 -0.37 0.00 -0.89 0.00 0.00 0.00 175.76 174.50 1on4 n ILE 123 N -0.73 -0.04 -1.77 0.00 2.08 -1.26 -3.69 119.36 113.94 1on4 n ILE 123 Ca -0.03 0.05 -0.01 0.00 0.56 0.00 0.00 62.75 63.32 1on4 n ILE 123 Cb 0.66 -0.07 -0.00 0.00 -0.75 0.00 0.00 39.64 39.47 1on4 n ILE 123 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 1on4 n VAL 124 N -2.21 -4.74 -1.03 1.39 0.31 -1.26 -4.86 118.33 105.93 1on4 n VAL 124 Ca -0.00 0.52 -0.33 0.00 -0.01 0.00 0.00 64.34 64.51 1on4 n VAL 124 Cb 0.04 -4.50 -0.03 0.00 -0.91 0.00 0.00 33.84 28.44 1on4 n VAL 124 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1on4 n LYS 125 N 0.26 2.02 -2.96 5.55 4.81 -1.26 -4.88 118.16 121.69 1on4 n LYS 125 Ca -0.04 -1.76 -0.41 0.00 -0.87 0.00 0.00 58.31 55.22 1on4 n LYS 125 Cb 0.06 -2.74 -0.05 0.00 0.02 0.00 0.00 35.03 32.33 1on4 n LYS 125 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1on4 s LYS 126 N 3.96 4.10 -0.82 1.64 2.20 -1.26 -4.97 119.74 124.59 1on4 s LYS 126 Ca 0.49 0.73 -0.08 0.00 -0.36 0.00 0.00 55.97 56.76 1on4 s LYS 126 Cb 0.13 -3.67 -0.16 0.00 -1.51 0.00 0.00 37.83 32.61 1on4 s LYS 126 CO 0.02 -0.54 3.14 -0.35 -0.36 0.00 0.00 175.35 177.26 1on4 n PRO 127 N 5.99 2.75 -2.69 4.03 -0.04 -1.26 -4.22 135.00 139.56 1on4 n PRO 127 Ca 0.03 -1.56 0.02 0.00 -0.04 0.00 0.00 63.50 61.95 1on4 n PRO 127 Cb 0.48 -2.39 0.01 0.00 -0.04 0.00 0.00 33.50 31.56 1on4 n PRO 127 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1on4 s GLU 128 N 1.76 0.07 0.00 0.54 2.12 -1.26 -5.10 118.70 116.83 1on4 s GLU 128 Ca 0.65 -0.03 0.00 0.00 0.36 0.00 0.00 54.97 55.95 1on4 s GLU 128 Cb 0.23 0.01 0.00 0.00 0.26 0.00 0.00 34.13 34.63 1on4 s GLU 128 CO -0.03 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.00 1on4 n GLY 129 N 3.49 3.10 3.50 -1.50 0.00 -1.26 -5.14 105.19 107.39 1on4 n GLY 129 Ca 0.05 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.34 1on4 n GLY 129 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1on4 s GLU 130 N 1.86 1.73 0.00 1.61 2.12 -1.26 -4.94 118.70 119.83 1on4 s GLU 130 Ca 0.00 -1.84 0.00 0.00 0.36 0.00 0.00 54.97 53.49 1on4 s GLU 130 Cb 0.00 -1.74 0.00 0.00 0.26 0.00 0.00 34.13 32.65 1on4 s GLU 130 CO 0.00 0.25 0.00 -3.47 -0.54 0.00 0.00 175.26 171.50 1on4 n ASP 131 N -0.69 0.00 -3.41 -1.70 -0.08 -1.26 -4.53 116.55 104.88 1on4 n ASP 131 Ca -0.05 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.08 1on4 n ASP 131 Cb 0.61 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.97 1on4 n ASP 131 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 1on4 s GLN 132 N 0.00 0.29 0.00 -0.67 -0.21 -1.26 -4.81 119.66 113.00 1on4 s GLN 132 Ca 0.00 0.17 0.00 0.00 0.02 0.00 0.00 55.36 55.55 1on4 s GLN 132 Cb 0.00 -0.77 0.00 0.00 1.00 0.00 0.00 33.01 33.24 1on4 s GLN 132 CO 0.00 -0.80 0.00 0.28 -2.12 0.00 0.00 175.29 172.65 1on4 n VAL 133 N 5.33 0.00 -0.02 1.09 0.31 -1.26 -4.87 118.33 118.91 1on4 n VAL 133 Ca -0.03 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.24 1on4 n VAL 133 Cb 0.49 -0.66 -0.02 0.00 -0.91 0.00 0.00 33.84 32.73 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 -2.46 1.19 -2.67 2.52 -0.00 -1.26 -4.86 119.36 111.82 1on4 n ILE 134 Ca 0.00 0.19 -0.05 0.00 -0.00 0.00 0.00 62.75 62.89 1on4 n ILE 134 Cb 0.16 -1.86 0.06 0.00 -0.00 0.00 0.00 39.64 38.01 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 -3.82 -1.52 -3.18 1.39 1.44 -1.26 -5.14 115.22 103.13 1on4 n HIS 135 Ca -0.10 -1.35 -0.18 0.00 -2.01 0.00 0.00 57.72 54.09 1on4 n HIS 135 Cb 0.32 1.39 0.00 0.00 0.12 0.00 0.00 29.99 31.83 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 0.12 2.93 -0.48 -1.40 1.11 -1.26 -4.86 119.66 115.81 1on4 s GLN 136 Ca 0.13 -1.16 0.06 0.00 0.01 0.00 0.00 55.36 54.40 1on4 s GLN 136 Cb 0.25 -2.78 0.18 0.00 -1.01 0.00 0.00 33.01 29.66 1on4 s GLN 136 CO -0.06 -0.15 0.63 0.45 0.01 0.00 0.00 175.29 176.17 1on4 s SER 137 N -4.28 -0.78 -0.17 5.90 0.15 -1.26 -4.88 113.70 108.37 1on4 s SER 137 Ca 0.51 -1.94 -0.23 0.00 0.70 0.00 0.00 55.95 54.99 1on4 s SER 137 Cb -0.10 1.38 -0.02 0.00 -1.71 0.00 0.00 66.02 65.57 1on4 s SER 137 CO 0.32 -0.09 0.75 -0.44 1.20 0.00 0.00 173.24 174.98 1on4 s SER 138 N 0.79 6.86 0.24 5.45 0.01 -1.26 -4.44 113.70 121.35 1on4 s SER 138 Ca 0.29 1.05 -0.30 0.00 1.31 0.00 0.00 55.95 58.30 1on4 s SER 138 Cb -0.00 -2.41 -0.09 0.00 0.21 0.00 0.00 66.02 63.73 1on4 s SER 138 CO -0.08 -0.33 1.02 -0.36 0.41 0.00 0.00 173.24 173.90 1on4 s PHE 139 N 1.94 3.79 -0.23 2.43 0.08 0.92 -4.08 117.98 122.83 1on4 s PHE 139 Ca 0.35 1.80 -0.02 0.00 0.12 0.00 0.00 56.93 59.17 1on4 s PHE 139 Cb -0.16 -3.13 0.07 0.00 -0.57 0.00 0.00 43.02 39.23 1on4 s PHE 139 CO 0.12 -0.04 0.05 0.71 -0.10 0.00 0.00 175.22 175.96 1on4 s TYR 140 N -1.04 1.19 -0.54 0.36 1.51 0.64 -1.23 117.35 118.24 1on4 s TYR 140 Ca 0.43 -1.08 -0.26 0.00 -1.01 0.00 0.00 57.07 55.15 1on4 s TYR 140 Cb -0.29 -1.18 0.03 0.00 -0.11 0.00 0.00 41.96 40.42 1on4 s TYR 140 CO 0.36 -0.69 1.03 -1.17 -1.11 0.00 0.00 175.55 173.97 1on4 s LEU 141 N 1.80 3.85 -0.35 -1.29 0.20 0.56 -0.01 118.68 123.44 1on4 s LEU 141 Ca 0.02 -0.07 -0.22 0.00 0.69 0.00 0.00 54.13 54.54 1on4 s LEU 141 Cb -0.17 -3.05 0.00 0.00 -0.43 0.00 0.00 46.19 42.55 1on4 s LEU 141 CO -0.13 -1.28 0.73 -0.69 -0.29 0.00 0.00 176.35 174.69 1on4 s VAL 142 N 4.27 4.81 0.68 1.68 1.01 0.37 -1.37 120.40 131.84 1on4 s VAL 142 Ca 0.37 0.84 -0.16 0.00 0.00 0.00 0.00 61.98 63.03 1on4 s VAL 142 Cb -0.10 -4.14 0.01 0.00 0.00 0.00 0.00 36.38 32.15 1on4 s VAL 142 CO 0.23 -0.34 1.17 -0.83 0.00 0.00 0.00 175.10 175.34 1on4 s GLY 143 N 1.77 2.37 0.11 4.51 0.00 0.10 -2.71 107.32 113.47 1on4 s GLY 143 Ca 0.29 0.80 -0.31 0.00 0.00 0.00 0.00 44.72 45.50 1on4 s GLY 143 CO 0.15 1.18 1.59 -0.56 0.00 0.00 0.00 173.10 175.46 1on4 h PRO 144 N 0.07 -0.63 0.00 2.90 0.13 -1.80 -0.63 132.00 132.05 1on4 h PRO 144 Ca -0.48 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1on4 h PRO 144 Cb 1.28 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.55 1on4 h PRO 144 CO 0.52 -0.42 0.07 -0.44 -0.23 0.00 0.00 178.00 177.51 1on4 h ASP 145 N -0.65 0.00 0.00 1.44 3.32 -1.90 -3.34 116.42 115.29 1on4 h ASP 145 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1on4 h ASP 145 Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.23 1on4 h ASP 145 CO -0.24 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.89 1on4 n GLY 146 N -1.16 1.31 3.65 2.75 0.00 -0.25 -4.92 105.19 106.57 1on4 n GLY 146 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 4.08 0.15 1.61 -2.85 -1.20 -0.89 119.74 120.63 1on4 s LYS 147 Ca 0.00 1.48 -0.30 0.00 -1.00 0.00 0.00 55.97 56.15 1on4 s LYS 147 Cb 0.00 -3.82 -0.07 0.00 -2.06 0.00 0.00 37.83 31.87 1on4 s LYS 147 CO 0.00 -0.91 1.17 0.08 0.10 0.00 0.00 175.35 175.79 1on4 s VAL 148 N 3.94 3.79 -0.06 1.79 1.01 0.07 0.02 120.40 130.96 1on4 s VAL 148 Ca 0.56 1.45 0.07 0.00 0.00 0.00 0.00 61.98 64.06 1on4 s VAL 148 Cb -0.20 -3.93 -0.11 0.00 0.00 0.00 0.00 36.38 32.15 1on4 s VAL 148 CO 0.19 0.21 0.07 0.18 0.00 0.00 0.00 175.10 175.74 1on4 n LEU 149 N 2.84 0.00 -3.85 3.92 4.77 -0.47 -1.09 117.00 123.12 1on4 n LEU 149 Ca 0.05 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.91 1on4 n LEU 149 Cb 0.46 0.15 -0.10 0.00 -2.33 0.00 0.00 43.42 41.59 1on4 n LEU 149 CO 0.55 0.15 -0.14 -0.54 -1.33 0.00 0.00 177.39 176.07 1on4 s LYS 150 N -2.29 0.47 0.05 3.23 1.02 -1.24 -3.11 119.74 117.87 1on4 s LYS 150 Ca -0.04 -0.27 0.06 0.00 0.02 0.00 0.00 55.97 55.74 1on4 s LYS 150 Cb 0.03 0.20 -0.02 0.00 -0.52 0.00 0.00 37.83 37.52 1on4 s LYS 150 CO 0.33 -0.11 -0.16 -0.51 -0.92 0.00 0.00 175.35 173.98 1on4 s ASP 151 N -1.15 1.93 0.08 2.83 1.11 -1.26 -0.33 116.67 119.88 1on4 s ASP 151 Ca -0.12 -0.51 -0.14 0.00 0.18 0.00 0.00 52.55 51.96 1on4 s ASP 151 Cb -0.06 -0.13 0.02 0.00 1.07 0.00 0.00 42.92 43.82 1on4 s ASP 151 CO 0.02 0.05 0.33 -0.47 1.18 0.00 0.00 175.17 176.28 1on4 s TYR 152 N -0.90 -0.11 -0.11 4.23 6.14 -0.37 -1.48 117.35 124.75 1on4 s TYR 152 Ca 0.03 -0.13 0.04 0.00 0.64 0.00 0.00 57.07 57.65 1on4 s TYR 152 Cb -0.08 0.14 -0.04 0.00 0.42 0.00 0.00 41.96 42.39 1on4 s TYR 152 CO 0.02 -0.59 0.13 -1.71 0.64 0.00 0.00 175.55 174.03 1on4 n ASN 153 N 0.17 1.51 0.00 4.32 5.15 -0.69 -0.05 115.26 125.66 1on4 n ASN 153 Ca -0.17 -0.39 0.00 0.00 -0.60 0.00 0.00 54.58 53.42 1on4 n ASN 153 Cb 0.62 1.06 0.00 0.00 -0.53 0.00 0.00 39.78 40.92 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 1.49 1.27 0.24 8.20 0.00 -1.26 -4.24 105.19 110.88 1on4 n GLY 154 Ca 0.00 -0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.15 1on4 n GLY 154 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1on4 h VAL 155 N 0.00 0.00 0.00 1.61 2.07 -1.90 -3.49 116.25 114.54 1on4 h VAL 155 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1on4 h VAL 155 Cb 0.00 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1on4 h VAL 155 CO 0.00 0.00 0.00 1.21 0.02 0.00 0.00 177.57 178.80 1on4 n GLU 156 N -2.58 0.00 0.00 1.57 4.07 -1.26 -4.92 120.64 117.52 1on4 n GLU 156 Ca -0.02 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.08 1on4 n GLU 156 Cb 0.09 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.47 1on4 n GLU 156 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1on4 n ASN 157 N 5.11 0.00 -4.00 4.31 4.13 -1.26 -3.89 115.26 119.66 1on4 n ASN 157 Ca 0.00 0.00 -0.36 0.00 1.68 0.00 0.00 54.58 55.90 1on4 n ASN 157 Cb 0.00 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.19 1on4 n ASN 157 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 1on4 n THR 158 N 0.00 3.36 -0.28 3.41 -1.04 -1.26 -4.95 114.28 113.52 1on4 n THR 158 Ca 0.00 -5.27 0.02 0.00 -2.04 0.00 0.00 64.05 56.76 1on4 n THR 158 Cb 0.00 -2.30 0.15 0.00 -1.82 0.00 0.00 70.33 66.36 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 5.66 0.74 0.00 -2.82 0.13 -1.90 -3.40 132.00 130.42 1on4 h PRO 159 Ca 0.18 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1on4 h PRO 159 Cb 0.76 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.72 1on4 h PRO 159 CO 0.94 0.49 0.00 0.66 -0.23 0.00 0.00 178.00 179.86 1on4 n TYR 160 N -4.75 0.00 -0.14 1.56 4.02 -1.26 -1.70 117.16 114.89 1on4 n TYR 160 Ca 0.12 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.98 1on4 n TYR 160 Cb 0.25 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.61 1on4 n TYR 160 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1on4 h ASP 161 N 0.00 -0.21 0.00 7.72 3.32 -1.61 0.43 116.42 126.07 1on4 h ASP 161 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1on4 h ASP 161 Cb 0.00 0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1on4 h ASP 161 CO 0.00 -0.07 0.00 -0.67 -1.72 0.00 0.00 179.24 176.78 1on4 n ASP 162 N -5.23 0.00 -0.16 6.45 2.03 -1.26 -0.88 116.55 117.51 1on4 n ASP 162 Ca 0.04 0.84 -0.09 0.00 0.52 0.00 0.00 54.79 56.11 1on4 n ASP 162 Cb 0.24 -0.42 -0.07 0.00 -0.72 0.00 0.00 41.12 40.16 1on4 n ASP 162 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1on4 h ILE 163 N 0.00 0.00 -0.30 5.18 5.03 -1.92 0.22 117.51 125.71 1on4 h ILE 163 Ca 0.00 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.76 1on4 h ILE 163 Cb 0.00 0.00 -0.02 0.00 -3.03 0.00 0.00 36.82 33.77 1on4 h ILE 163 CO 0.00 0.00 0.17 0.40 -0.68 0.00 0.00 178.15 178.04 1on4 h ILE 164 N -0.17 1.01 -0.61 -0.67 5.03 -0.27 0.14 117.51 121.97 1on4 h ILE 164 Ca 0.07 -0.12 0.12 0.00 -0.12 0.00 0.00 64.86 64.81 1on4 h ILE 164 Cb 0.35 0.64 -0.09 0.00 -3.03 0.00 0.00 36.82 34.69 1on4 h ILE 164 CO -0.48 0.06 0.08 -1.28 -0.68 0.00 0.00 178.15 175.85 1on4 h SER 165 N 0.34 -0.11 0.57 1.72 0.87 -0.12 0.11 113.55 116.93 1on4 h SER 165 Ca 0.12 0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.78 1on4 h SER 165 Cb 0.02 0.20 0.01 0.00 -0.44 0.00 0.00 62.40 62.18 1on4 h SER 165 CO -0.07 -0.05 -0.28 -0.78 -0.53 0.00 0.00 176.83 175.13 1on4 h ASP 166 N 0.20 -0.65 -0.92 6.23 3.58 0.38 0.24 116.42 125.48 1on4 h ASP 166 Ca 0.32 -0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.76 1on4 h ASP 166 Cb 0.50 0.17 -0.05 0.00 1.72 0.00 0.00 39.33 41.67 1on4 h ASP 166 CO -0.46 -0.36 0.61 0.58 -2.88 0.00 0.00 179.24 176.73 1on4 h VAL 167 N -0.93 1.20 -0.28 2.25 2.07 -0.81 0.18 116.25 119.94 1on4 h VAL 167 Ca -0.08 -0.41 -0.13 0.00 0.82 0.00 0.00 66.70 66.90 1on4 h VAL 167 Cb 0.64 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1on4 h VAL 167 CO 0.13 0.22 -0.36 0.11 0.02 0.00 0.00 177.57 177.69 1on4 h LYS 168 N 1.21 0.63 -0.16 1.57 6.56 -0.71 0.36 116.57 126.02 1on4 h LYS 168 Ca 0.35 -0.30 0.05 0.00 -1.06 0.00 0.00 60.65 59.69 1on4 h LYS 168 Cb -0.08 -0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 31.53 1on4 h LYS 168 CO -0.09 0.89 -0.17 0.77 -2.06 0.00 0.00 179.45 178.79 1on4 h SER 169 N 0.52 -0.53 -0.08 0.86 0.02 0.50 -0.09 113.55 114.75 1on4 h SER 169 Ca 0.05 0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1on4 h SER 169 Cb 0.87 0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.66 1on4 h SER 169 CO 0.07 -0.21 0.03 0.00 -1.14 0.00 0.00 176.83 175.58 1on4 h ALA 170 N 0.87 0.10 0.00 3.77 0.00 -0.10 -1.15 119.26 122.76 1on4 h ALA 170 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1on4 h ALA 170 Cb 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1on4 h ALA 170 CO -0.28 -0.31 0.00 0.43 0.00 0.00 0.00 179.25 179.09 1on4 n SER 171 N -4.94 0.00 -3.91 0.00 7.64 0.06 -4.91 113.62 107.56 1on4 n SER 171 Ca -0.06 0.19 -0.29 0.00 1.01 0.00 0.00 58.87 59.72 1on4 n SER 171 Cb 0.11 -0.36 0.02 0.00 -1.01 0.00 0.00 64.21 62.96 1on4 n SER 171 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1on4 n THR 172 N -1.36 -2.46 -0.98 0.44 -2.24 -0.06 -4.83 114.28 102.79 1on4 n THR 172 Ca 0.07 -0.14 0.03 0.00 -2.27 0.00 0.00 64.05 61.75 1on4 n THR 172 Cb 0.17 -2.87 0.05 0.00 -2.10 0.00 0.00 70.33 65.58 1on4 n THR 172 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1on4 n LEU 173 N -4.55 1.34 -0.59 3.22 -0.00 -1.11 -5.07 117.00 110.24 1on4 n LEU 173 Ca -0.05 -1.81 0.07 0.00 -0.00 0.00 0.00 56.01 54.23 1on4 n LEU 173 Cb 0.56 -0.15 0.06 0.00 -0.00 0.00 0.00 43.42 43.90 1on4 n LEU 173 CO 0.75 0.43 0.48 2.29 -0.00 0.00 0.00 177.39 181.35