#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 -1.91 0.08 -0.41 1.00 -1.26 -5.07 119.30 111.73 1on4 s MET 2 Ca 0.00 0.44 -0.04 0.00 0.00 0.00 0.00 55.69 56.10 1on4 s MET 2 Cb 0.00 -1.47 -0.05 0.00 0.00 0.00 0.00 34.83 33.31 1on4 s MET 2 CO 0.00 -4.28 0.29 -0.51 0.00 0.00 0.00 175.02 170.52 1on4 s LEU 3 N -7.50 4.33 -0.17 -0.03 1.02 -1.26 -5.11 118.68 109.95 1on4 s LEU 3 Ca 0.69 0.47 -0.11 0.00 0.02 0.00 0.00 54.13 55.20 1on4 s LEU 3 Cb -0.19 -3.01 0.06 0.00 0.02 0.00 0.00 46.19 43.06 1on4 s LEU 3 CO 0.61 0.15 0.43 -0.70 0.02 0.00 0.00 176.35 176.86 1on4 s GLU 4 N -2.36 0.43 -0.47 1.70 2.12 -1.26 -4.94 118.70 113.93 1on4 s GLU 4 Ca 0.35 0.77 -0.04 0.00 0.36 0.00 0.00 54.97 56.41 1on4 s GLU 4 Cb -0.13 0.04 0.01 0.00 0.26 0.00 0.00 34.13 34.31 1on4 s GLU 4 CO 0.23 -0.14 0.08 -0.89 -0.54 0.00 0.00 175.26 174.01 1on4 n ILE 5 N 3.97 -0.53 -2.68 -3.70 2.08 -1.26 -4.75 119.36 112.49 1on4 n ILE 5 Ca -0.21 -0.18 -0.06 0.00 0.56 0.00 0.00 62.75 62.87 1on4 n ILE 5 Cb 0.56 -0.48 0.07 0.00 -0.75 0.00 0.00 39.64 39.04 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 -2.23 0.66 -3.59 0.38 4.81 -1.26 -5.09 118.16 111.84 1on4 n LYS 6 Ca -0.08 -1.29 -0.27 0.00 -0.87 0.00 0.00 58.31 55.80 1on4 n LYS 6 Cb 0.21 -0.22 -0.10 0.00 0.02 0.00 0.00 35.03 34.95 1on4 n LYS 6 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1on4 n ASP 7 N -0.23 2.72 -4.88 3.14 9.92 -1.26 -4.99 116.55 120.98 1on4 n ASP 7 Ca -0.10 -3.18 -0.29 0.00 -0.53 0.00 0.00 54.79 50.69 1on4 n ASP 7 Cb 0.74 -0.69 0.09 0.00 -0.64 0.00 0.00 41.12 40.62 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 -1.71 1.89 0.21 -0.24 0.04 -1.26 -4.57 135.00 129.36 1on4 s PRO 8 Ca 0.33 0.18 -0.00 0.00 0.04 0.00 0.00 61.00 61.54 1on4 s PRO 8 Cb 0.06 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1on4 s PRO 8 CO -0.10 -1.66 0.11 -0.48 0.04 0.00 0.00 177.00 174.91 1on4 s LEU 9 N -5.64 1.38 -0.41 -3.56 2.34 -1.24 -4.49 118.68 107.06 1on4 s LEU 9 Ca 0.62 -1.36 0.09 0.00 0.06 0.00 0.00 54.13 53.54 1on4 s LEU 9 Cb -0.12 0.25 0.36 0.00 -0.56 0.00 0.00 46.19 46.12 1on4 s LEU 9 CO 0.50 -0.79 1.07 0.59 -1.06 0.00 0.00 176.35 176.66 1on4 n ASN 10 N -0.31 -1.11 -4.66 1.48 3.02 0.15 -4.06 115.26 109.77 1on4 n ASN 10 Ca 0.00 -3.16 -0.43 0.00 -0.03 0.00 0.00 54.58 50.96 1on4 n ASN 10 Cb 0.66 0.88 -0.02 0.00 -0.61 0.00 0.00 39.78 40.69 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 -0.74 3.28 -0.15 3.10 6.14 -1.02 -4.69 117.35 123.28 1on4 s TYR 11 Ca 0.27 1.41 -0.29 0.00 0.64 0.00 0.00 57.07 59.09 1on4 s TYR 11 Cb 0.35 -3.30 -0.01 0.00 0.42 0.00 0.00 41.96 39.41 1on4 s TYR 11 CO -0.06 -0.65 1.16 -1.21 0.64 0.00 0.00 175.55 175.43 1on4 s GLU 12 N 3.19 4.29 -0.10 4.97 2.02 -1.26 -1.51 118.70 130.31 1on4 s GLU 12 Ca 0.46 1.55 -0.09 0.00 0.02 0.00 0.00 54.97 56.91 1on4 s GLU 12 Cb -0.16 -3.65 -0.04 0.00 0.10 0.00 0.00 34.13 30.37 1on4 s GLU 12 CO 0.08 -0.57 0.20 0.08 0.02 0.00 0.00 175.26 175.07 1on4 s VAL 13 N 2.90 5.40 -0.08 2.63 1.01 0.27 -3.08 120.40 129.46 1on4 s VAL 13 Ca 0.51 0.35 -0.24 0.00 0.00 0.00 0.00 61.98 62.60 1on4 s VAL 13 Cb -0.20 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1on4 s VAL 13 CO 0.15 0.61 0.73 -1.61 0.00 0.00 0.00 175.10 174.97 1on4 s GLU 14 N -1.00 4.42 0.24 2.72 0.41 -1.26 -4.84 118.70 119.39 1on4 s GLU 14 Ca 0.17 0.92 -0.30 0.00 -0.41 0.00 0.00 54.97 55.34 1on4 s GLU 14 Cb -0.13 -3.46 -0.14 0.00 -1.78 0.00 0.00 34.13 28.62 1on4 s GLU 14 CO 0.06 0.01 1.22 -2.30 -0.49 0.00 0.00 175.26 173.76 1on4 n PRO 15 N 3.96 1.62 -3.64 0.39 -0.02 -1.26 -4.93 135.00 131.12 1on4 n PRO 15 Ca -0.00 0.57 -0.03 0.00 -2.02 0.00 0.00 63.50 62.02 1on4 n PRO 15 Cb 0.51 -2.10 -0.01 0.00 -0.02 0.00 0.00 33.50 31.88 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 -0.47 -0.13 -0.31 6.00 5.36 -1.26 -4.99 117.98 122.18 1on4 s PHE 16 Ca 0.66 -0.04 -0.00 0.00 -0.96 0.00 0.00 56.93 56.59 1on4 s PHE 16 Cb -0.71 0.57 0.06 0.00 -0.34 0.00 0.00 43.02 42.60 1on4 s PHE 16 CO 0.54 -0.49 -0.00 0.99 -1.46 0.00 0.00 175.22 174.81 1on4 s THR 17 N -2.81 2.74 0.40 0.12 2.01 -1.26 -1.19 115.64 115.64 1on4 s THR 17 Ca 0.11 -1.62 0.08 0.00 0.31 0.00 0.00 61.69 60.57 1on4 s THR 17 Cb 0.01 -2.66 0.00 0.00 0.01 0.00 0.00 72.50 69.86 1on4 s THR 17 CO -0.03 -0.20 0.54 -0.36 -0.69 0.00 0.00 174.62 173.89 1on4 s PHE 18 N 1.17 2.90 -0.07 4.92 0.40 0.66 -4.95 117.98 123.00 1on4 s PHE 18 Ca -0.03 -0.35 0.05 0.00 -0.60 0.00 0.00 56.93 56.00 1on4 s PHE 18 Cb -0.20 -2.27 -0.01 0.00 0.51 0.00 0.00 43.02 41.05 1on4 s PHE 18 CO -0.03 -0.31 -0.24 -0.65 0.70 0.00 0.00 175.22 174.69 1on4 s GLN 19 N -4.30 2.69 0.67 0.44 -0.21 -1.26 -1.45 119.66 116.24 1on4 s GLN 19 Ca 0.52 -0.88 -0.08 0.00 0.02 0.00 0.00 55.36 54.94 1on4 s GLN 19 Cb -0.10 -2.22 0.03 0.00 1.00 0.00 0.00 33.01 31.72 1on4 s GLN 19 CO 0.32 0.34 1.01 0.54 -2.12 0.00 0.00 175.29 175.39 1on4 s ASN 20 N -0.06 5.19 0.00 5.90 2.20 0.20 -0.69 114.94 127.67 1on4 s ASN 20 Ca -0.06 0.72 0.25 0.00 -0.94 0.00 0.00 52.86 52.82 1on4 s ASN 20 Cb -0.15 -1.51 1.08 0.00 -2.00 0.00 0.00 41.25 38.67 1on4 s ASN 20 CO 0.05 -1.39 1.80 0.00 -2.94 0.00 0.00 177.10 174.62 1on4 n GLN 21 N -2.86 0.03 0.00 3.55 -0.00 -0.41 -0.68 117.38 117.01 1on4 n GLN 21 Ca 0.06 0.07 0.00 0.00 -0.00 0.00 0.00 57.00 57.14 1on4 n GLN 21 Cb 0.59 -1.50 0.00 0.00 -0.00 0.00 0.00 30.24 29.33 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 -1.48 0.09 -1.37 2.61 8.00 -1.26 -4.89 116.55 118.25 1on4 n ASP 22 Ca 0.06 -1.96 -0.13 0.00 0.71 0.00 0.00 54.79 53.48 1on4 n ASP 22 Cb 0.28 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.32 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 0.44 0.26 3.16 0.44 0.00 0.14 -4.98 105.19 104.66 1on4 n GLY 23 Ca 0.00 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 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 -4.23 2.67 0.28 1.61 2.36 -1.23 -4.91 119.74 116.29 1on4 s LYS 24 Ca 0.00 -0.75 -0.29 0.00 -2.55 0.00 0.00 55.97 52.38 1on4 s LYS 24 Cb 0.00 -2.05 -0.09 0.00 -1.05 0.00 0.00 37.83 34.64 1on4 s LYS 24 CO 0.00 0.14 1.00 -0.80 1.55 0.00 0.00 175.35 177.24 1on4 s ASN 25 N 0.43 7.41 0.00 1.43 -0.87 -1.26 -0.63 114.94 121.44 1on4 s ASN 25 Ca -0.18 2.04 0.02 0.00 -1.57 0.00 0.00 52.86 53.17 1on4 s ASN 25 Cb -0.17 -2.61 -0.01 0.00 -0.02 0.00 0.00 41.25 38.44 1on4 s ASN 25 CO 0.07 -0.02 -0.07 0.68 -2.57 0.00 0.00 177.10 175.19 1on4 s VAL 26 N -1.28 0.54 0.23 1.60 -7.23 -0.53 -4.93 120.40 108.79 1on4 s VAL 26 Ca 0.45 -0.39 0.07 0.00 -1.81 0.00 0.00 61.98 60.31 1on4 s VAL 26 Cb -0.26 -0.47 -0.04 0.00 0.56 0.00 0.00 36.38 36.17 1on4 s VAL 26 CO 0.33 0.09 0.09 -0.44 -0.31 0.00 0.00 175.10 174.86 1on4 s SER 27 N -0.34 5.11 0.38 4.85 0.01 -1.26 -0.25 113.70 122.20 1on4 s SER 27 Ca 0.01 -0.37 0.09 0.00 1.31 0.00 0.00 55.95 57.00 1on4 s SER 27 Cb -0.03 -1.18 0.85 0.00 0.21 0.00 0.00 66.02 65.86 1on4 s SER 27 CO -0.00 0.02 1.93 0.25 0.41 0.00 0.00 173.24 175.85 1on4 h LEU 28 N 1.99 0.58 -1.96 2.44 5.85 -1.51 0.13 115.31 122.83 1on4 h LEU 28 Ca -0.47 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.41 1on4 h LEU 28 Cb 1.23 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 1on4 h LEU 28 CO 0.60 0.34 0.37 -0.33 -0.34 0.00 0.00 178.44 179.09 1on4 h GLU 29 N 0.64 0.04 0.00 1.25 3.07 -1.92 0.28 114.58 117.94 1on4 h GLU 29 Ca 0.35 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 1on4 h GLU 29 Cb 0.51 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1on4 h GLU 29 CO -0.13 0.03 0.00 0.43 -1.40 0.00 0.00 179.01 177.94 1on4 n SER 30 N -4.40 0.00 0.00 1.42 7.64 0.44 -3.70 113.62 115.02 1on4 n SER 30 Ca 0.09 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.18 1on4 n SER 30 Cb 0.57 -0.33 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 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 -1.33 0.95 -4.60 -3.43 4.77 0.39 -4.97 117.00 108.79 1on4 n LEU 31 Ca 0.04 0.00 -0.48 0.00 -0.03 0.00 0.00 56.01 55.54 1on4 n LEU 31 Cb 0.09 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.14 1on4 n LEU 31 CO 0.08 0.16 0.79 1.17 -1.33 0.00 0.00 177.39 178.26 1on4 n LYS 32 N -1.72 1.37 0.00 3.23 0.00 0.70 -1.07 118.16 120.66 1on4 n LYS 32 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 58.31 58.80 1on4 n LYS 32 Cb 0.25 -2.03 0.00 0.00 0.00 0.00 0.00 35.03 33.25 1on4 n LYS 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1on4 n GLY 33 N 2.08 2.70 3.98 3.14 0.00 -0.24 -4.94 105.19 111.90 1on4 n GLY 33 Ca 0.14 -0.27 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 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 3.18 -1.18 1.61 0.41 -0.23 -4.59 118.70 117.90 1on4 s GLU 34 Ca 0.00 -0.84 -0.07 0.00 -0.41 0.00 0.00 54.97 53.66 1on4 s GLU 34 Cb 0.00 -2.78 0.24 0.00 -1.78 0.00 0.00 34.13 29.81 1on4 s GLU 34 CO 0.00 0.07 1.71 1.55 -0.49 0.00 0.00 175.26 178.10 1on4 n VAL 35 N -1.69 4.88 -2.91 2.63 3.14 -1.26 -3.47 118.33 119.66 1on4 n VAL 35 Ca -0.02 -5.15 -0.38 0.00 -2.96 0.00 0.00 64.34 55.83 1on4 n VAL 35 Cb 0.58 -2.20 -0.06 0.00 -1.06 0.00 0.00 33.84 31.10 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 -1.26 3.82 0.18 1.45 1.48 -1.14 -4.80 118.94 118.68 1on4 s TRP 36 Ca 0.36 1.68 -0.14 0.00 -1.06 0.00 0.00 56.10 56.94 1on4 s TRP 36 Cb 0.08 -2.82 -0.07 0.00 -1.16 0.00 0.00 33.47 29.50 1on4 s TRP 36 CO 0.05 0.39 0.57 -0.51 -4.06 0.00 0.00 176.95 173.40 1on4 s LEU 37 N -1.55 4.28 -0.03 -4.66 2.01 -1.23 -0.72 118.68 116.78 1on4 s LEU 37 Ca 0.42 1.07 0.01 0.00 0.01 0.00 0.00 54.13 55.64 1on4 s LEU 37 Cb -0.21 -3.45 0.02 0.00 0.01 0.00 0.00 46.19 42.56 1on4 s LEU 37 CO 0.26 0.03 -0.02 0.00 1.01 0.00 0.00 176.35 177.63 1on4 s ALA 38 N -1.59 0.45 0.31 4.21 0.00 0.37 -0.29 121.76 125.22 1on4 s ALA 38 Ca 0.42 0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.47 1on4 s ALA 38 Cb -0.14 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.60 1on4 s ALA 38 CO 0.20 -0.03 0.11 -0.51 0.00 0.00 0.00 175.76 175.53 1on4 s ASP 39 N 0.89 1.79 -0.25 0.00 1.01 0.27 -0.34 116.67 120.03 1on4 s ASP 39 Ca -0.10 -1.48 -0.11 0.00 0.71 0.00 0.00 52.55 51.57 1on4 s ASP 39 Cb -0.13 0.23 0.10 0.00 1.01 0.00 0.00 42.92 44.13 1on4 s ASP 39 CO -0.01 -0.78 0.57 0.72 0.21 0.00 0.00 175.17 175.88 1on4 s PHE 40 N -3.53 -1.04 0.13 4.23 -0.71 -1.26 -1.07 117.98 114.73 1on4 s PHE 40 Ca 0.35 1.94 -0.01 0.00 -1.04 0.00 0.00 56.93 58.16 1on4 s PHE 40 Cb 0.06 0.57 -0.04 0.00 -1.21 0.00 0.00 43.02 42.40 1on4 s PHE 40 CO 0.15 -0.54 0.07 0.96 -1.34 0.00 0.00 175.22 174.52 1on4 s ILE 41 N 2.32 0.10 0.03 -4.49 -5.25 -1.20 -4.55 121.20 108.17 1on4 s ILE 41 Ca -0.06 -1.88 0.01 0.00 -0.99 0.00 0.00 60.65 57.73 1on4 s ILE 41 Cb -0.10 -2.02 -0.02 0.00 2.95 0.00 0.00 42.46 43.27 1on4 s ILE 41 CO -0.17 -0.46 -0.05 0.72 -1.79 0.00 0.00 174.94 173.19 1on4 s PHE 42 N -4.04 0.43 -0.02 1.37 -0.71 -1.26 -0.53 117.98 113.22 1on4 s PHE 42 Ca 0.23 -0.43 0.05 0.00 -1.04 0.00 0.00 56.93 55.74 1on4 s PHE 42 Cb 0.07 -0.28 -0.07 0.00 -1.21 0.00 0.00 43.02 41.53 1on4 s PHE 42 CO 0.01 -0.11 0.08 -2.37 -1.34 0.00 0.00 175.22 171.49 1on4 n THR 43 N 1.79 0.12 -1.46 -4.49 5.66 -1.26 -4.83 114.28 109.81 1on4 n THR 43 Ca -0.21 -0.15 -0.39 0.00 -3.05 0.00 0.00 64.05 60.24 1on4 n THR 43 Cb 0.56 -0.09 -0.06 0.00 -1.55 0.00 0.00 70.33 69.19 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 -1.87 2.76 0.00 1.09 5.15 -1.26 -4.13 115.26 116.99 1on4 n ASN 44 Ca -0.04 -2.69 0.00 0.00 -0.60 0.00 0.00 54.58 51.25 1on4 n ASN 44 Cb 0.33 -1.31 0.00 0.00 -0.53 0.00 0.00 39.78 38.27 1on4 n ASN 44 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1on4 n GLU 46 N -1.49 0.57 0.00 0.00 2.13 -1.26 -5.15 120.64 115.45 1on4 n GLU 46 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1on4 n GLU 46 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1on4 n GLU 46 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1on4 n THR 47 N 0.00 0.00 -2.53 6.31 -2.24 -1.26 -5.02 114.28 109.54 1on4 n THR 47 Ca 0.00 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 1on4 n THR 47 Cb 0.00 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.26 1on4 n THR 47 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1on4 n ILE 48 N 0.00 0.24 0.26 2.28 -0.00 -1.26 -4.99 119.36 115.90 1on4 n ILE 48 Ca 0.00 -1.34 -0.16 0.00 -0.00 0.00 0.00 62.75 61.26 1on4 n ILE 48 Cb 0.00 1.01 -0.08 0.00 -0.00 0.00 0.00 39.64 40.57 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 -5.73 3.26 -1.11 0.00 0.04 -1.26 -4.90 135.00 125.30 1on4 s PRO 50 Ca -0.16 1.27 -0.20 0.00 0.04 0.00 0.00 61.00 61.95 1on4 s PRO 50 Cb 0.04 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.49 1on4 s PRO 50 CO 0.60 -0.87 1.94 -0.35 0.04 0.00 0.00 177.00 178.37 1on4 n PRO 51 N -1.98 2.04 0.00 0.56 -0.04 -1.26 -4.79 135.00 129.53 1on4 n PRO 51 Ca 0.09 -2.43 0.00 0.00 -0.04 0.00 0.00 63.50 61.12 1on4 n PRO 51 Cb 0.53 -3.35 0.00 0.00 -0.04 0.00 0.00 33.50 30.63 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 7.55 0.00 0.00 0.54 2.81 -1.26 -4.19 117.12 122.57 1on4 n MET 52 Ca 0.48 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.37 1on4 n MET 52 Cb 0.43 -0.45 0.00 0.00 -0.71 0.00 0.00 33.22 32.49 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 -0.26 0.00 0.23 2.03 -1.04 -1.26 -4.04 114.28 109.94 1on4 n THR 53 Ca 0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.87 1on4 n THR 53 Cb 0.00 -0.10 -0.07 0.00 -1.82 0.00 0.00 70.33 68.34 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 2.80 -1.06 -0.97 2.41 0.00 -1.94 0.21 119.26 120.71 1on4 h ALA 54 Ca 0.00 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.84 1on4 h ALA 54 Cb 0.10 0.60 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 1on4 h ALA 54 CO 0.00 -1.08 0.62 0.45 0.00 0.00 0.00 179.25 179.24 1on4 h HIS 55 N -0.76 1.14 -0.25 0.00 3.86 -1.82 0.13 115.15 117.44 1on4 h HIS 55 Ca -0.05 0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 59.04 1on4 h HIS 55 Cb 0.65 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 1on4 h HIS 55 CO -0.19 0.55 -0.45 0.52 0.86 0.00 0.00 177.93 179.22 1on4 h MET 56 N 1.08 0.65 -0.11 2.45 2.86 -1.79 0.56 114.93 120.63 1on4 h MET 56 Ca 0.44 -0.35 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1on4 h MET 56 Cb 0.26 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 1on4 h MET 56 CO -0.20 0.96 -0.09 1.79 1.06 0.00 0.00 176.91 180.43 1on4 h THR 57 N 0.52 1.34 -0.59 2.22 1.35 0.12 0.34 112.91 118.22 1on4 h THR 57 Ca 0.03 -1.19 0.12 0.00 -0.55 0.00 0.00 66.41 64.82 1on4 h THR 57 Cb 0.98 1.89 -0.10 0.00 -1.73 0.00 0.00 68.15 69.19 1on4 h THR 57 CO 0.09 0.34 0.01 0.44 -0.25 0.00 0.00 175.52 176.15 1on4 h ASP 58 N -0.12 -0.25 -0.16 5.36 3.32 -0.78 -1.14 116.42 122.65 1on4 h ASP 58 Ca 0.02 0.14 -0.12 0.00 0.02 0.00 0.00 57.03 57.09 1on4 h ASP 58 Cb 0.58 0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 1on4 h ASP 58 CO 0.02 -0.10 -0.30 -0.07 -1.72 0.00 0.00 179.24 177.07 1on4 h LEU 59 N 0.12 0.67 -0.89 1.55 4.07 -0.71 -3.16 115.31 116.96 1on4 h LEU 59 Ca 0.30 -0.26 0.24 0.00 0.08 0.00 0.00 57.88 58.24 1on4 h LEU 59 Cb 0.48 -0.18 -0.14 0.00 1.08 0.00 0.00 40.66 41.90 1on4 h LEU 59 CO -0.50 0.93 0.28 -0.61 -1.08 0.00 0.00 178.44 177.46 1on4 h GLN 60 N 0.56 0.23 0.12 1.13 -0.00 0.99 0.29 115.11 118.42 1on4 h GLN 60 Ca 0.07 -0.01 0.02 0.00 -0.00 0.00 0.00 58.65 58.72 1on4 h GLN 60 Cb 0.79 -0.05 -0.04 0.00 0.00 0.00 0.00 27.48 28.18 1on4 h GLN 60 CO 0.06 0.15 -0.29 -0.22 0.00 0.00 0.00 178.83 178.54 1on4 h LYS 61 N 0.24 -0.48 -0.66 1.69 3.64 -1.49 -2.35 116.57 117.16 1on4 h LYS 61 Ca 0.57 0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.92 1on4 h LYS 61 Cb 1.15 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 33.05 1on4 h LYS 61 CO -0.64 -0.32 0.18 -0.22 -2.27 0.00 0.00 179.45 176.18 1on4 h LYS 62 N -0.50 1.05 -1.00 1.90 3.64 -1.08 -3.07 116.57 117.50 1on4 h LYS 62 Ca 0.03 -0.24 0.34 0.00 -1.27 0.00 0.00 60.65 59.51 1on4 h LYS 62 Cb 0.53 -0.14 -0.16 0.00 -0.41 0.00 0.00 32.23 32.06 1on4 h LYS 62 CO -0.17 0.93 0.55 -0.07 -2.27 0.00 0.00 179.45 178.42 1on4 h LEU 63 N 0.98 0.46 -0.95 5.20 -0.00 -0.02 0.33 115.31 121.31 1on4 h LEU 63 Ca 0.21 0.20 0.27 0.00 -0.00 0.00 0.00 57.88 58.57 1on4 h LEU 63 Cb 0.34 0.17 -0.14 0.00 -0.00 0.00 0.00 40.66 41.03 1on4 h LEU 63 CO -0.00 -0.20 0.45 0.11 -0.00 0.00 0.00 178.44 178.80 1on4 h LYS 64 N 0.26 0.32 -0.00 1.13 1.79 -1.37 0.59 116.57 119.29 1on4 h LYS 64 Ca 0.75 -0.02 -0.16 0.00 -2.18 0.00 0.00 60.65 59.04 1on4 h LYS 64 Cb 1.77 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 32.32 1on4 h LYS 64 CO -0.64 0.21 -0.76 0.00 -1.08 0.00 0.00 179.45 177.18 1on4 h ALA 65 N 1.80 0.74 0.00 3.86 0.00 -0.54 -3.28 119.26 121.84 1on4 h ALA 65 Ca 0.65 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1on4 h ALA 65 Cb 1.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1on4 h ALA 65 CO -0.60 0.95 -0.74 0.93 0.00 0.00 0.00 179.25 179.80 1on4 h GLU 66 N 0.00 0.00 -0.37 0.00 4.39 -0.63 -3.42 114.58 114.55 1on4 h GLU 66 Ca -0.01 0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.77 1on4 h GLU 66 Cb 1.35 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.93 1on4 h GLU 66 CO 0.10 0.00 -0.07 0.27 -1.16 0.00 0.00 179.01 178.15 1on4 n ASN 67 N -2.52 -0.11 0.00 1.42 6.94 0.18 -4.30 115.26 116.87 1on4 n ASN 67 Ca 0.02 0.63 0.00 0.00 -0.02 0.00 0.00 54.58 55.21 1on4 n ASN 67 Cb 0.51 -0.20 0.00 0.00 -2.36 0.00 0.00 39.78 37.73 1on4 n ASN 67 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 1on4 n ILE 68 N -4.53 0.00 -2.69 1.53 -0.00 -1.26 -0.10 119.36 112.31 1on4 n ILE 68 Ca 0.07 0.00 -0.11 0.00 -0.00 0.00 0.00 62.75 62.70 1on4 n ILE 68 Cb 0.21 0.00 0.02 0.00 -0.00 0.00 0.00 39.64 39.87 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 0.00 1.65 -4.72 4.38 2.03 -1.26 -5.06 116.55 113.58 1on4 n ASP 69 Ca 0.00 -2.81 -0.42 0.00 0.52 0.00 0.00 54.79 52.08 1on4 n ASP 69 Cb 0.00 -0.53 -0.03 0.00 -0.72 0.00 0.00 41.12 39.83 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 -3.26 4.47 -0.03 5.18 -7.23 0.86 -4.85 120.40 115.54 1on4 s VAL 70 Ca 0.30 1.87 0.07 0.00 -1.81 0.00 0.00 61.98 62.41 1on4 s VAL 70 Cb 0.45 -4.20 -0.02 0.00 0.56 0.00 0.00 36.38 33.17 1on4 s VAL 70 CO 0.01 0.20 -0.25 -0.13 -0.31 0.00 0.00 175.10 174.62 1on4 s ARG 71 N 0.63 2.26 -0.67 4.82 0.52 -1.26 -4.62 118.95 120.63 1on4 s ARG 71 Ca 0.52 -0.91 -0.27 0.00 -0.52 0.00 0.00 55.73 54.55 1on4 s ARG 71 Cb -0.24 -2.07 0.02 0.00 0.52 0.00 0.00 34.95 33.18 1on4 s ARG 71 CO 0.30 0.48 1.35 -1.50 0.02 0.00 0.00 175.30 175.95 1on4 s ILE 72 N -0.43 3.74 0.40 1.52 2.07 -1.05 -3.51 121.20 123.93 1on4 s ILE 72 Ca 0.05 0.50 -0.23 0.00 -1.41 0.00 0.00 60.65 59.56 1on4 s ILE 72 Cb -0.11 -4.71 -0.11 0.00 0.13 0.00 0.00 42.46 37.67 1on4 s ILE 72 CO 0.01 -1.57 0.95 -0.63 -1.91 0.00 0.00 174.94 171.80 1on4 s ILE 73 N 6.04 4.30 -0.28 2.00 1.09 0.60 -1.51 121.20 133.44 1on4 s ILE 73 Ca 0.43 1.59 -0.02 0.00 -1.10 0.00 0.00 60.65 61.54 1on4 s ILE 73 Cb -0.09 -3.73 0.12 0.00 -1.06 0.00 0.00 42.46 37.69 1on4 s ILE 73 CO 0.19 -0.16 0.21 -0.55 -0.10 0.00 0.00 174.94 174.53 1on4 s SER 74 N -1.98 2.45 0.26 3.58 0.15 0.02 -0.56 113.70 117.63 1on4 s SER 74 Ca 0.58 -0.93 -0.28 0.00 0.70 0.00 0.00 55.95 56.02 1on4 s SER 74 Cb -0.13 0.12 -0.09 0.00 -1.71 0.00 0.00 66.02 64.21 1on4 s SER 74 CO 0.17 -0.40 0.92 0.72 1.20 0.00 0.00 173.24 175.85 1on4 s PHE 75 N 2.24 3.87 0.08 3.44 -0.12 -0.23 -0.44 117.98 126.83 1on4 s PHE 75 Ca 0.09 1.83 -0.30 0.00 -0.05 0.00 0.00 56.93 58.50 1on4 s PHE 75 Cb -0.15 -2.93 -0.06 0.00 -0.63 0.00 0.00 43.02 39.25 1on4 s PHE 75 CO -0.32 0.38 1.15 -1.54 -0.05 0.00 0.00 175.22 174.83 1on4 s SER 76 N -1.34 7.16 -0.97 1.98 1.04 0.59 -3.23 113.70 118.93 1on4 s SER 76 Ca 0.44 1.99 -0.24 0.00 0.48 0.00 0.00 55.95 58.62 1on4 s SER 76 Cb -0.23 -2.58 0.04 0.00 0.10 0.00 0.00 66.02 63.35 1on4 s SER 76 CO 0.28 -0.38 1.48 -0.69 0.98 0.00 0.00 173.24 174.91 1on4 s VAL 77 N 0.74 3.85 0.00 5.02 1.01 0.31 -4.02 120.40 127.31 1on4 s VAL 77 Ca 0.56 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1on4 s VAL 77 Cb -0.28 -4.93 0.00 0.00 0.00 0.00 0.00 36.38 31.16 1on4 s VAL 77 CO 0.30 -1.83 0.00 -0.67 0.00 0.00 0.00 175.10 172.91 1on4 n ASP 78 N 9.46 -1.72 -0.00 3.32 -0.08 -1.26 -4.58 116.55 121.68 1on4 n ASP 78 Ca 0.30 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.59 1on4 n ASP 78 Cb 0.50 -0.86 0.33 0.00 2.34 0.00 0.00 41.12 43.43 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 0.00 0.53 -0.46 -0.67 0.13 -1.77 0.13 132.00 129.90 1on4 h PRO 79 Ca 0.00 -0.09 0.09 0.00 -0.87 0.00 0.00 66.00 65.13 1on4 h PRO 79 Cb 0.23 -0.09 -0.09 0.00 0.13 0.00 0.00 31.00 31.19 1on4 h PRO 79 CO 0.00 0.51 -0.12 1.49 -0.23 0.00 0.00 178.00 179.64 1on4 h GLU 80 N 0.52 -0.01 -0.58 0.86 4.81 -1.95 -1.48 114.58 116.75 1on4 h GLU 80 Ca 0.12 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.19 1on4 h GLU 80 Cb 0.23 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.51 1on4 h GLU 80 CO -0.00 -0.01 0.16 0.09 -0.73 0.00 0.00 179.01 178.52 1on4 n ASN 81 N -5.34 4.36 -3.01 1.04 3.02 -1.05 -4.54 115.26 109.73 1on4 n ASN 81 Ca 0.04 -3.25 -0.14 0.00 -0.03 0.00 0.00 54.58 51.20 1on4 n ASN 81 Cb 0.25 -0.69 -0.03 0.00 -0.61 0.00 0.00 39.78 38.70 1on4 n ASN 81 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1on4 n ASP 82 N -0.34 -2.11 -4.54 6.41 -0.08 0.44 -4.66 116.55 111.67 1on4 n ASP 82 Ca 0.35 -2.76 -0.50 0.00 -1.51 0.00 0.00 54.79 50.38 1on4 n ASP 82 Cb 1.23 0.79 -0.04 0.00 2.34 0.00 0.00 41.12 45.44 1on4 n ASP 82 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 1on4 n LYS 83 N 2.65 0.82 -0.01 -0.67 2.85 -1.17 -4.41 118.16 118.23 1on4 n LYS 83 Ca 0.21 0.29 0.21 0.00 -1.05 0.00 0.00 58.31 57.98 1on4 n LYS 83 Cb 0.54 -1.70 0.70 0.00 -0.65 0.00 0.00 35.03 33.92 1on4 n LYS 83 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 1on4 h PRO 84 N 2.80 0.00 -0.00 -1.58 0.13 -1.97 0.14 132.00 131.52 1on4 h PRO 84 Ca -0.41 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.61 1on4 h PRO 84 Cb 1.37 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.49 1on4 h PRO 84 CO 0.66 0.00 -0.49 0.87 -0.23 0.00 0.00 178.00 178.81 1on4 h LYS 85 N 0.00 0.01 -0.12 0.86 1.57 -1.92 0.18 116.57 117.15 1on4 h LYS 85 Ca 0.26 -0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.97 1on4 h LYS 85 Cb 1.08 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.39 1on4 h LYS 85 CO -0.00 0.50 -0.20 0.37 -0.57 0.00 0.00 179.45 179.55 1on4 h GLN 86 N 0.00 0.34 -0.53 3.15 5.75 -1.04 0.48 115.11 123.26 1on4 h GLN 86 Ca -0.00 -0.21 0.10 0.00 -0.15 0.00 0.00 58.65 58.39 1on4 h GLN 86 Cb 0.87 0.02 -0.09 0.00 1.07 0.00 0.00 27.48 29.36 1on4 h GLN 86 CO 0.06 0.79 0.00 -0.07 -2.65 0.00 0.00 178.83 176.97 1on4 h LEU 87 N -0.08 -0.22 -0.52 -2.39 3.38 -1.40 0.75 115.31 114.82 1on4 h LEU 87 Ca 0.01 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1on4 h LEU 87 Cb 0.77 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1on4 h LEU 87 CO 0.04 -0.08 0.19 0.50 0.09 0.00 0.00 178.44 179.19 1on4 h LYS 88 N 0.12 0.79 0.24 1.13 3.64 -0.54 0.33 116.57 122.27 1on4 h LYS 88 Ca 0.27 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1on4 h LYS 88 Cb 0.41 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1on4 h LYS 88 CO -0.44 0.71 -0.18 0.87 -2.27 0.00 0.00 179.45 178.13 1on4 h LYS 89 N 0.71 -0.41 -0.57 1.90 1.57 -0.59 0.29 116.57 119.46 1on4 h LYS 89 Ca 0.17 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 59.06 1on4 h LYS 89 Cb 0.23 0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.57 1on4 h LYS 89 CO -0.01 -0.28 0.22 0.35 -0.57 0.00 0.00 179.45 179.16 1on4 h PHE 90 N -0.43 0.38 0.18 -1.35 3.57 -0.53 0.12 116.94 118.89 1on4 h PHE 90 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1on4 h PHE 90 Cb 0.38 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 1on4 h PHE 90 CO -0.12 0.11 -0.15 0.00 -2.23 0.00 0.00 178.31 175.93 1on4 h ALA 91 N 1.38 -0.32 -0.31 2.41 0.00 -0.20 -0.49 119.26 121.73 1on4 h ALA 91 Ca 0.28 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.22 1on4 h ALA 91 Cb 0.32 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1on4 h ALA 91 CO -0.27 -0.70 0.22 0.00 0.00 0.00 0.00 179.25 178.50 1on4 h ALA 92 N 0.45 2.26 -0.12 0.00 0.00 -0.29 -2.05 119.26 119.52 1on4 h ALA 92 Ca -0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1on4 h ALA 92 Cb 0.31 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1on4 h ALA 92 CO -0.02 -0.35 -0.13 -0.91 0.00 0.00 0.00 179.25 177.85 1on4 h ASN 93 N 0.03 0.32 -4.00 0.00 2.35 0.60 -3.43 115.58 111.45 1on4 h ASN 93 Ca 0.15 -0.49 -0.54 0.00 -0.55 0.00 0.00 56.30 54.87 1on4 h ASN 93 Cb 0.56 -0.09 0.11 0.00 0.05 0.00 0.00 38.32 38.95 1on4 h ASN 93 CO -0.01 0.74 0.64 -0.31 -1.65 0.00 0.00 177.43 176.85 1on4 s TYR 94 N -4.25 2.53 -1.25 1.19 1.51 -0.33 -4.87 117.35 111.87 1on4 s TYR 94 Ca -0.14 1.34 -0.15 0.00 -1.01 0.00 0.00 57.07 57.11 1on4 s TYR 94 Cb 0.04 -3.79 -0.04 0.00 -0.11 0.00 0.00 41.96 38.06 1on4 s TYR 94 CO 0.74 -2.63 2.24 -0.35 -1.11 0.00 0.00 175.55 174.44 1on4 n PRO 95 N -0.35 2.54 -4.25 -1.71 -0.04 -1.26 -4.86 135.00 125.06 1on4 n PRO 95 Ca 0.06 -2.24 -0.29 0.00 -0.04 0.00 0.00 63.50 60.99 1on4 n PRO 95 Cb 0.43 -3.05 -0.04 0.00 -0.04 0.00 0.00 33.50 30.80 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 1.46 2.59 0.13 1.53 0.05 -1.26 -4.88 118.68 118.30 1on4 s LEU 96 Ca 0.52 -1.38 0.06 0.00 0.05 0.00 0.00 54.13 53.38 1on4 s LEU 96 Cb 0.14 -1.04 -0.04 0.00 -2.05 0.00 0.00 46.19 43.20 1on4 s LEU 96 CO -0.02 -0.94 -0.14 -0.55 -0.55 0.00 0.00 176.35 174.14 1on4 s SER 97 N -4.08 2.09 0.47 1.48 0.15 -1.26 -4.93 113.70 107.62 1on4 s SER 97 Ca 0.24 -0.83 0.32 0.00 0.70 0.00 0.00 55.95 56.38 1on4 s SER 97 Cb 0.00 -0.08 1.51 0.00 -1.71 0.00 0.00 66.02 65.74 1on4 s SER 97 CO 0.14 -0.14 1.96 -0.26 1.20 0.00 0.00 173.24 176.15 1on4 h PHE 98 N 3.43 0.00 0.00 3.44 0.04 -1.99 -3.41 116.94 118.45 1on4 h PHE 98 Ca -0.40 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.37 1on4 h PHE 98 Cb 1.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.35 1on4 h PHE 98 CO 0.66 0.00 0.00 -0.25 -0.60 0.00 0.00 178.31 178.12 1on4 n ASP 99 N -2.75 0.00 -2.70 2.17 9.92 -1.26 -0.59 116.55 121.34 1on4 n ASP 99 Ca -0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 54.79 54.18 1on4 n ASP 99 Cb 0.19 0.00 0.10 0.00 -0.64 0.00 0.00 41.12 40.76 1on4 n ASP 99 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1on4 n ASN 100 N 0.00 -1.29 -3.65 -2.24 5.15 -1.26 -5.11 115.26 106.86 1on4 n ASN 100 Ca 0.00 -2.61 -0.25 0.00 -0.60 0.00 0.00 54.58 51.13 1on4 n ASN 100 Cb 0.00 0.78 -0.17 0.00 -0.53 0.00 0.00 39.78 39.86 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 -0.44 0.29 -0.75 1.20 -0.11 0.25 -2.53 118.94 116.85 1on4 s TRP 101 Ca 0.23 -0.25 -0.14 0.00 1.22 0.00 0.00 56.10 57.17 1on4 s TRP 101 Cb 0.40 -0.69 0.20 0.00 -1.50 0.00 0.00 33.47 31.88 1on4 s TRP 101 CO -0.06 -0.44 0.69 -0.51 -4.62 0.00 0.00 176.95 172.00 1on4 s ASP 102 N 2.10 6.55 -0.43 5.86 1.01 -0.57 -4.82 116.67 126.37 1on4 s ASP 102 Ca 0.02 -2.51 -0.29 0.00 0.71 0.00 0.00 52.55 50.49 1on4 s ASP 102 Cb -0.15 -2.19 0.02 0.00 1.01 0.00 0.00 42.92 41.61 1on4 s ASP 102 CO -0.07 -0.62 1.27 -0.36 0.21 0.00 0.00 175.17 175.60 1on4 s PHE 103 N 0.46 2.63 0.07 4.23 0.08 -1.26 -0.80 117.98 123.39 1on4 s PHE 103 Ca 0.15 0.72 -0.10 0.00 0.12 0.00 0.00 56.93 57.82 1on4 s PHE 103 Cb -0.15 -4.32 -0.06 0.00 -0.57 0.00 0.00 43.02 37.92 1on4 s PHE 103 CO -0.06 -1.60 0.39 -0.51 -0.10 0.00 0.00 175.22 173.33 1on4 s LEU 104 N 4.87 4.35 -0.03 -0.37 1.43 0.42 -1.29 118.68 128.06 1on4 s LEU 104 Ca 0.54 0.77 -0.00 0.00 -1.03 0.00 0.00 54.13 54.41 1on4 s LEU 104 Cb -0.11 -2.94 -0.00 0.00 0.03 0.00 0.00 46.19 43.17 1on4 s LEU 104 CO 0.31 0.19 -0.01 0.71 0.23 0.00 0.00 176.35 177.78 1on4 h THR 105 N 2.91 0.00 -1.59 5.49 1.35 -1.21 0.17 112.91 120.02 1on4 h THR 105 Ca -0.49 -0.30 -0.13 0.00 -0.55 0.00 0.00 66.41 64.94 1on4 h THR 105 Cb 1.19 0.00 0.01 0.00 -1.73 0.00 0.00 68.15 67.63 1on4 h THR 105 CO 0.66 0.00 -0.18 0.61 -0.25 0.00 0.00 175.52 176.36 1on4 n GLY 106 N 1.90 0.27 3.54 5.82 0.00 -1.26 -4.23 105.19 111.23 1on4 n GLY 106 Ca -0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.70 0.00 -1.43 1.61 9.36 -1.26 -2.89 117.16 118.85 1on4 n TYR 107 Ca -0.04 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 60.89 1on4 n TYR 107 Cb 0.54 0.00 0.13 0.00 -0.63 0.00 0.00 39.34 39.38 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 -2.02 3.61 0.23 2.98 1.04 -1.26 -4.49 113.70 113.78 1on4 s SER 108 Ca 0.00 1.16 -0.10 0.00 0.48 0.00 0.00 55.95 57.50 1on4 s SER 108 Cb 0.00 -1.81 0.34 0.00 0.10 0.00 0.00 66.02 64.65 1on4 s SER 108 CO 0.00 -2.51 1.65 1.56 0.98 0.00 0.00 173.24 174.92 1on4 h GLN 109 N -1.46 0.09 -0.28 4.02 1.08 -1.86 -0.61 115.11 116.09 1on4 h GLN 109 Ca -0.50 -0.01 0.04 0.00 -1.45 0.00 0.00 58.65 56.73 1on4 h GLN 109 Cb 1.31 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.68 1on4 h GLN 109 CO 0.59 0.06 0.06 0.77 -0.95 0.00 0.00 178.83 179.37 1on4 h SER 110 N 0.10 0.02 0.83 1.46 0.02 -1.91 0.36 113.55 114.43 1on4 h SER 110 Ca 0.36 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.31 1on4 h SER 110 Cb 0.59 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1on4 h SER 110 CO -0.60 0.05 -0.46 -0.33 -1.14 0.00 0.00 176.83 174.35 1on4 h GLU 111 N 0.17 -1.15 -0.16 3.45 3.07 -1.66 -3.23 114.58 115.08 1on4 h GLU 111 Ca 0.13 0.08 -0.05 0.00 -0.50 0.00 0.00 59.36 59.02 1on4 h GLU 111 Cb 0.13 0.26 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1on4 h GLU 111 CO -0.17 -0.76 -0.12 0.97 -1.40 0.00 0.00 179.01 177.53 1on4 h ILE 112 N -1.19 1.17 0.00 3.13 6.09 -0.79 -3.32 117.51 122.61 1on4 h ILE 112 Ca -0.11 -0.76 0.00 0.00 -1.37 0.00 0.00 64.86 62.62 1on4 h ILE 112 Cb 0.93 1.19 0.00 0.00 0.47 0.00 0.00 36.82 39.41 1on4 h ILE 112 CO 0.15 0.24 0.00 -0.62 -3.07 0.00 0.00 178.15 174.84 1on4 n GLU 113 N -4.28 0.00 -0.02 2.19 1.02 0.13 -0.18 120.64 119.50 1on4 n GLU 113 Ca -0.01 0.58 -0.09 0.00 -0.02 0.00 0.00 57.16 57.63 1on4 n GLU 113 Cb 0.26 -1.29 -0.03 0.00 -0.02 0.00 0.00 31.44 30.36 1on4 n GLU 113 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1on4 h GLU 114 N 0.00 -0.05 -0.65 3.49 4.81 -1.66 0.25 114.58 120.76 1on4 h GLU 114 Ca 0.00 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 1on4 h GLU 114 Cb 0.00 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 29.28 1on4 h GLU 114 CO 0.00 -0.04 -0.48 0.35 -0.73 0.00 0.00 179.01 178.11 1on4 h PHE 115 N -0.06 -1.45 0.00 0.92 3.57 -1.64 -0.62 116.94 117.66 1on4 h PHE 115 Ca 0.08 0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.57 1on4 h PHE 115 Cb 0.18 0.72 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 1on4 h PHE 115 CO -0.21 -0.43 -0.49 0.00 -2.23 0.00 0.00 178.31 174.96 1on4 h ALA 116 N 0.54 1.15 0.90 2.41 0.00 0.52 0.93 119.26 125.71 1on4 h ALA 116 Ca 0.17 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1on4 h ALA 116 Cb 0.55 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.27 1on4 h ALA 116 CO -0.74 0.61 -0.43 1.25 0.00 0.00 0.00 179.25 179.94 1on4 h LEU 117 N 0.00 -1.02 0.15 0.00 7.12 0.27 0.18 115.31 122.01 1on4 h LEU 117 Ca -0.00 0.04 0.01 0.00 0.13 0.00 0.00 57.88 58.05 1on4 h LEU 117 Cb 0.88 0.26 -0.03 0.00 -0.53 0.00 0.00 40.66 41.25 1on4 h LEU 117 CO 0.06 -0.73 -0.25 0.11 -0.13 0.00 0.00 178.44 177.50 1on4 h LYS 118 N -1.21 -0.46 0.22 1.25 6.56 -1.01 -2.28 116.57 119.64 1on4 h LYS 118 Ca -0.12 0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 1on4 h LYS 118 Cb 0.92 0.11 -0.03 0.00 -0.57 0.00 0.00 32.23 32.66 1on4 h LYS 118 CO 0.20 -0.31 -0.41 1.03 -2.06 0.00 0.00 179.45 177.90 1on4 h SER 119 N -0.48 -1.20 0.00 0.86 0.87 -0.74 -3.38 113.55 109.48 1on4 h SER 119 Ca 0.02 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1on4 h SER 119 Cb 0.49 0.42 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1on4 h SER 119 CO -0.12 -0.48 -0.42 0.49 -0.53 0.00 0.00 176.83 175.77 1on4 n PHE 120 N -4.84 -0.22 -0.55 2.24 3.72 0.23 -4.65 117.46 113.38 1on4 n PHE 120 Ca -0.08 0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1on4 n PHE 120 Cb 0.34 0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.98 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 -3.21 0.00 -2.74 -1.08 0.00 0.39 -4.96 118.16 106.55 1on4 n LYS 121 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.21 1on4 n LYS 121 Cb 0.21 -0.57 0.04 0.00 -0.00 0.00 0.00 35.03 34.71 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 -0.52 2.66 -1.45 0.58 0.00 -0.99 -4.71 120.51 116.08 1on4 n ALA 122 Ca 0.00 -2.77 -0.29 0.00 0.00 0.00 0.00 53.44 50.38 1on4 n ALA 122 Cb 0.18 -0.96 0.19 0.00 0.00 0.00 0.00 19.45 18.86 1on4 n ALA 122 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1on4 s ILE 123 N -2.29 1.86 -0.13 0.00 -4.36 -1.26 -4.81 121.20 110.21 1on4 s ILE 123 Ca 0.28 0.00 -0.08 0.00 -0.26 0.00 0.00 60.65 60.59 1on4 s ILE 123 Cb 0.43 -2.70 0.05 0.00 1.25 0.00 0.00 42.46 41.48 1on4 s ILE 123 CO -0.00 0.00 0.32 0.68 0.24 0.00 0.00 174.94 176.18 1on4 s VAL 124 N -3.31 -0.03 0.00 8.37 -7.23 -1.26 -4.96 120.40 111.98 1on4 s VAL 124 Ca 0.69 0.10 0.00 0.00 -1.81 0.00 0.00 61.98 60.96 1on4 s VAL 124 Cb -0.11 -0.48 0.00 0.00 0.56 0.00 0.00 36.38 36.35 1on4 s VAL 124 CO 0.54 0.04 0.00 1.17 -0.31 0.00 0.00 175.10 176.55 1on4 n LYS 125 N 4.04 0.00 -4.53 4.82 0.00 -1.26 -4.77 118.16 116.46 1on4 n LYS 125 Ca -0.23 0.00 -0.26 0.00 0.00 0.00 0.00 58.31 57.83 1on4 n LYS 125 Cb 0.55 0.00 -0.14 0.00 0.00 0.00 0.00 35.03 35.44 1on4 n LYS 125 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1on4 s LYS 126 N -1.02 1.34 -1.07 1.64 -0.14 -1.26 -5.04 119.74 114.17 1on4 s LYS 126 Ca 0.00 -1.06 -0.17 0.00 -1.36 0.00 0.00 55.97 53.38 1on4 s LYS 126 Cb 0.00 -1.54 -0.08 0.00 -1.68 0.00 0.00 37.83 34.54 1on4 s LYS 126 CO 0.00 0.38 2.10 -0.35 -0.76 0.00 0.00 175.35 176.72 1on4 n PRO 127 N 1.52 2.14 -3.08 -1.68 -0.04 -1.26 -4.66 135.00 127.94 1on4 n PRO 127 Ca -0.18 -2.09 0.01 0.00 -0.04 0.00 0.00 63.50 61.20 1on4 n PRO 127 Cb 0.53 -3.00 -0.01 0.00 -0.04 0.00 0.00 33.50 30.99 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 4.07 0.62 -0.03 0.54 2.12 -1.26 -5.04 118.70 119.72 1on4 s GLU 128 Ca 0.53 -0.19 -0.11 0.00 0.36 0.00 0.00 54.97 55.56 1on4 s GLU 128 Cb 0.14 0.08 0.04 0.00 0.26 0.00 0.00 34.13 34.65 1on4 s GLU 128 CO 0.02 -0.90 0.50 0.41 -0.54 0.00 0.00 175.26 174.75 1on4 n GLY 129 N 4.22 0.31 3.27 -1.50 0.00 -1.26 -5.00 105.19 105.23 1on4 n GLY 129 Ca 0.09 -0.88 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.36 1.77 -3.87 1.61 -0.58 -1.26 -4.28 120.64 113.67 1on4 n GLU 130 Ca 0.02 -2.22 -0.33 0.00 -0.42 0.00 0.00 57.16 54.21 1on4 n GLU 130 Cb 0.21 -3.26 0.01 0.00 -0.57 0.00 0.00 31.44 27.84 1on4 n GLU 130 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1on4 n ASP 131 N 9.73 -4.73 -2.91 1.62 2.03 -1.26 -4.96 116.55 116.07 1on4 n ASP 131 Ca 0.48 -1.07 -0.09 0.00 0.52 0.00 0.00 54.79 54.63 1on4 n ASP 131 Cb 0.43 -1.97 -0.01 0.00 -0.72 0.00 0.00 41.12 38.84 1on4 n ASP 131 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1on4 s GLN 132 N -5.98 1.03 0.00 -0.67 -1.52 -1.26 -4.88 119.66 106.38 1on4 s GLN 132 Ca 0.25 -1.27 0.00 0.00 -1.95 0.00 0.00 55.36 52.39 1on4 s GLN 132 Cb -0.13 -0.34 0.00 0.00 -0.22 0.00 0.00 33.01 32.32 1on4 s GLN 132 CO 0.92 -1.34 0.00 1.55 -0.25 0.00 0.00 175.29 176.17 1on4 n VAL 133 N 2.97 0.00 -0.02 1.09 3.14 -1.26 -4.79 118.33 119.46 1on4 n VAL 133 Ca 0.20 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.58 1on4 n VAL 133 Cb 0.54 0.00 -0.00 0.00 -1.06 0.00 0.00 33.84 33.32 1on4 n VAL 133 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 1on4 h ILE 134 N 0.00 0.00 0.00 1.55 2.04 -1.98 -3.46 117.51 115.66 1on4 h ILE 134 Ca 0.00 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1on4 h ILE 134 Cb 0.00 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1on4 h ILE 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.15 1on4 n HIS 135 N -4.31 0.00 -2.22 1.37 1.44 -1.26 -4.92 115.22 105.32 1on4 n HIS 135 Ca -0.01 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.29 1on4 n HIS 135 Cb 0.02 0.03 -0.03 0.00 0.12 0.00 0.00 29.99 30.13 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 3.25 -1.06 -1.40 1.11 -1.26 -4.72 119.66 115.59 1on4 s GLN 136 Ca 0.00 0.85 -0.03 0.00 0.01 0.00 0.00 55.36 56.18 1on4 s GLN 136 Cb 0.00 -4.17 0.31 0.00 -1.01 0.00 0.00 33.01 28.14 1on4 s GLN 136 CO 0.00 -1.97 1.47 -1.13 0.01 0.00 0.00 175.29 173.67 1on4 n SER 137 N 10.15 6.37 -4.78 5.90 3.41 -1.26 -4.84 113.62 128.57 1on4 n SER 137 Ca 0.17 -3.44 -0.36 0.00 -0.26 0.00 0.00 58.87 54.99 1on4 n SER 137 Cb 0.49 -1.24 -0.05 0.00 -0.26 0.00 0.00 64.21 63.15 1on4 n SER 137 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1on4 s SER 138 N -1.83 6.96 0.23 4.04 0.01 -1.26 -4.48 113.70 117.36 1on4 s SER 138 Ca 0.32 1.95 -0.02 0.00 1.31 0.00 0.00 55.95 59.51 1on4 s SER 138 Cb 0.06 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.67 1on4 s SER 138 CO 0.09 -0.35 0.44 -0.36 0.41 0.00 0.00 173.24 173.47 1on4 s PHE 139 N -1.69 3.48 0.02 2.43 0.08 0.37 -4.22 117.98 118.45 1on4 s PHE 139 Ca 0.56 0.42 0.00 0.00 0.12 0.00 0.00 56.93 58.03 1on4 s PHE 139 Cb -0.20 -1.92 -0.02 0.00 -0.57 0.00 0.00 43.02 40.32 1on4 s PHE 139 CO 0.25 0.32 -0.04 0.71 -0.10 0.00 0.00 175.22 176.37 1on4 s TYR 140 N -1.93 0.31 -0.22 0.36 1.51 0.54 -2.00 117.35 115.92 1on4 s TYR 140 Ca 0.40 -0.45 0.01 0.00 -1.01 0.00 0.00 57.07 56.02 1on4 s TYR 140 Cb -0.11 -0.21 0.03 0.00 -0.11 0.00 0.00 41.96 41.56 1on4 s TYR 140 CO 0.29 -0.14 -0.14 -1.17 -1.11 0.00 0.00 175.55 173.28 1on4 s LEU 141 N -1.27 2.77 -0.08 -1.29 0.20 0.26 -0.48 118.68 118.79 1on4 s LEU 141 Ca -0.12 -0.93 -0.20 0.00 0.69 0.00 0.00 54.13 53.56 1on4 s LEU 141 Cb -0.09 -1.54 -0.04 0.00 -0.43 0.00 0.00 46.19 44.09 1on4 s LEU 141 CO -0.01 -0.09 0.58 -0.69 -0.29 0.00 0.00 176.35 175.86 1on4 s VAL 142 N 1.24 5.09 0.67 1.68 1.01 0.10 -1.72 120.40 128.48 1on4 s VAL 142 Ca -0.00 1.18 -0.11 0.00 0.00 0.00 0.00 61.98 63.04 1on4 s VAL 142 Cb -0.16 -3.92 0.17 0.00 0.00 0.00 0.00 36.38 32.47 1on4 s VAL 142 CO -0.09 0.31 0.58 0.61 0.00 0.00 0.00 175.10 176.52 1on4 n GLY 143 N 3.07 -2.71 0.31 4.51 0.00 0.81 -2.88 105.19 108.31 1on4 n GLY 143 Ca -0.05 -1.46 -0.11 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.72 -2.87 1.61 0.13 -1.81 -3.30 132.00 125.05 1on4 h PRO 144 Ca -0.22 0.05 -0.74 0.00 -0.87 0.00 0.00 66.00 64.22 1on4 h PRO 144 Cb 0.68 0.16 -0.11 0.00 0.13 0.00 0.00 31.00 31.87 1on4 h PRO 144 CO 0.14 -0.48 2.53 -0.25 -0.23 0.00 0.00 178.00 179.72 1on4 n ASP 145 N -4.95 7.45 -4.16 1.44 9.92 -1.26 -1.08 116.55 123.91 1on4 n ASP 145 Ca -0.09 -3.06 -0.32 0.00 -0.53 0.00 0.00 54.79 50.78 1on4 n ASP 145 Cb 0.29 -1.41 -0.04 0.00 -0.64 0.00 0.00 41.12 39.32 1on4 n ASP 145 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1on4 n GLY 146 N 2.21 -0.33 2.84 0.44 0.00 -1.24 -4.94 105.19 104.17 1on4 n GLY 146 Ca 0.60 0.14 -0.18 0.00 0.00 0.00 0.00 46.02 46.57 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 -6.88 0.48 0.30 1.61 -2.85 -1.26 -0.57 119.74 110.58 1on4 s LYS 147 Ca 0.42 0.03 -0.28 0.00 -1.00 0.00 0.00 55.97 55.14 1on4 s LYS 147 Cb -0.23 -0.63 -0.09 0.00 -2.06 0.00 0.00 37.83 34.81 1on4 s LYS 147 CO 0.93 -0.13 1.00 0.14 0.10 0.00 0.00 175.35 177.38 1on4 s VAL 148 N 1.08 3.91 -0.04 1.79 -7.23 -0.57 -0.13 120.40 119.20 1on4 s VAL 148 Ca -0.09 1.73 0.02 0.00 -1.81 0.00 0.00 61.98 61.83 1on4 s VAL 148 Cb -0.14 -4.03 -0.03 0.00 0.56 0.00 0.00 36.38 32.74 1on4 s VAL 148 CO -0.01 0.27 0.07 0.18 -0.31 0.00 0.00 175.10 175.30 1on4 n LEU 149 N 0.86 0.04 -3.84 1.32 4.77 -0.70 -1.89 117.00 117.56 1on4 n LEU 149 Ca 0.01 -0.18 -0.10 0.00 -0.03 0.00 0.00 56.01 55.71 1on4 n LEU 149 Cb 0.48 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.49 1on4 n LEU 149 CO 0.48 0.01 -0.08 -0.54 -1.33 0.00 0.00 177.39 175.93 1on4 s LYS 150 N -1.84 0.77 0.51 3.23 1.02 -1.22 -3.60 119.74 118.62 1on4 s LYS 150 Ca -0.00 -0.76 0.01 0.00 0.02 0.00 0.00 55.97 55.23 1on4 s LYS 150 Cb 0.02 0.32 -0.00 0.00 -0.52 0.00 0.00 37.83 37.64 1on4 s LYS 150 CO 0.10 -0.24 0.03 -0.51 -0.92 0.00 0.00 175.35 173.81 1on4 s ASP 151 N -2.43 3.95 0.14 2.83 1.11 -1.26 -0.57 116.67 120.43 1on4 s ASP 151 Ca -0.01 -1.71 -0.25 0.00 0.18 0.00 0.00 52.55 50.76 1on4 s ASP 151 Cb 0.02 0.68 0.07 0.00 1.07 0.00 0.00 42.92 44.75 1on4 s ASP 151 CO -0.07 -0.94 0.78 -0.31 1.18 0.00 0.00 175.17 175.81 1on4 s TYR 152 N -2.95 -0.33 -0.40 4.23 2.02 -0.75 -4.57 117.35 114.59 1on4 s TYR 152 Ca 0.04 0.07 0.10 0.00 -0.37 0.00 0.00 57.07 56.91 1on4 s TYR 152 Cb 0.00 0.60 0.34 0.00 -0.40 0.00 0.00 41.96 42.51 1on4 s TYR 152 CO 0.03 -0.84 0.89 -1.71 -1.57 0.00 0.00 175.55 172.34 1on4 n ASN 153 N -0.38 -0.36 -0.32 2.29 5.15 -1.19 -0.48 115.26 119.97 1on4 n ASN 153 Ca -0.10 -3.25 0.29 0.00 -0.60 0.00 0.00 54.58 50.91 1on4 n ASN 153 Cb 0.62 0.34 0.62 0.00 -0.53 0.00 0.00 39.78 40.83 1on4 n ASN 153 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1on4 h GLY 154 N 2.99 0.69 0.00 8.20 0.00 -1.84 -1.39 103.07 111.73 1on4 h GLY 154 Ca 0.02 -0.11 0.06 0.00 0.00 0.00 0.00 47.33 47.30 1on4 h GLY 154 CO 0.36 -0.09 -0.32 -2.08 0.00 0.00 0.00 176.54 174.41 1on4 h VAL 155 N 0.21 0.27 -2.29 4.60 2.07 -1.86 -3.40 116.25 115.84 1on4 h VAL 155 Ca 0.59 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.82 1on4 h VAL 155 Cb 1.86 0.27 -0.34 0.00 -1.52 0.00 0.00 31.29 31.56 1on4 h VAL 155 CO -0.18 0.00 -0.59 -1.61 0.02 0.00 0.00 177.57 175.21 1on4 s GLU 156 N -6.00 0.26 0.00 1.57 2.02 -0.52 -5.08 118.70 110.94 1on4 s GLU 156 Ca -0.15 0.21 0.00 0.00 0.02 0.00 0.00 54.97 55.05 1on4 s GLU 156 Cb 0.12 -0.92 0.00 0.00 0.10 0.00 0.00 34.13 33.43 1on4 s GLU 156 CO 0.67 -0.73 0.00 0.09 0.02 0.00 0.00 175.26 175.31 1on4 n ASN 157 N 5.33 0.00 0.00 -0.19 3.02 -1.24 -4.61 115.26 117.57 1on4 n ASN 157 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 1on4 n ASN 157 Cb 0.49 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 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 0.16 3.41 -1.04 -1.26 -4.27 114.28 111.28 1on4 n THR 158 Ca 0.00 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.03 1on4 n THR 158 Cb 0.00 0.00 0.22 0.00 -1.82 0.00 0.00 70.33 68.73 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 0.00 0.00 0.00 -2.82 0.13 -1.87 -3.40 132.00 124.05 1on4 h PRO 159 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1on4 h PRO 159 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1on4 h PRO 159 CO 0.00 0.52 0.00 0.66 -0.23 0.00 0.00 178.00 178.95 1on4 n TYR 160 N -3.60 0.00 -0.10 1.56 4.01 -1.26 -1.80 117.16 115.97 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 0.59 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.63 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 -0.21 0.81 7.72 3.32 -1.90 0.21 116.42 126.37 1on4 h ASP 161 Ca 0.00 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.10 1on4 h ASP 161 Cb 0.00 0.17 0.01 0.00 0.22 0.00 0.00 39.33 39.73 1on4 h ASP 161 CO 0.00 -0.06 -0.39 -2.24 -1.72 0.00 0.00 179.24 174.82 1on4 h ASP 162 N 0.06 -0.92 0.35 6.45 2.03 -1.89 0.78 116.42 123.27 1on4 h ASP 162 Ca 0.17 0.03 -0.02 0.00 -0.73 0.00 0.00 57.03 56.48 1on4 h ASP 162 Cb 0.24 0.24 0.00 0.00 -0.83 0.00 0.00 39.33 38.98 1on4 h ASP 162 CO -0.31 -0.66 -0.17 0.40 -1.03 0.00 0.00 179.24 177.47 1on4 h ILE 163 N -1.10 0.65 -0.43 4.15 2.04 -1.88 0.72 117.51 121.65 1on4 h ILE 163 Ca -0.11 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 1on4 h ILE 163 Cb 0.84 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 1on4 h ILE 163 CO 0.18 0.08 0.27 0.40 0.00 0.00 0.00 178.15 179.08 1on4 h ILE 164 N -0.70 1.13 -0.34 -0.67 5.03 -0.69 0.29 117.51 121.56 1on4 h ILE 164 Ca -0.05 -0.30 0.07 0.00 -0.12 0.00 0.00 64.86 64.47 1on4 h ILE 164 Cb 0.49 0.55 -0.08 0.00 -3.03 0.00 0.00 36.82 34.75 1on4 h ILE 164 CO 0.08 0.13 -0.26 -1.28 -0.68 0.00 0.00 178.15 176.14 1on4 h SER 165 N 0.58 -0.86 0.36 1.72 0.87 -0.66 0.23 113.55 115.78 1on4 h SER 165 Ca 0.16 0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.87 1on4 h SER 165 Cb -0.01 0.42 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 1on4 h SER 165 CO -0.03 -0.28 -0.29 -0.78 -0.53 0.00 0.00 176.83 174.91 1on4 h ASP 166 N -0.22 -0.77 -0.61 6.23 3.58 -0.24 0.22 116.42 124.60 1on4 h ASP 166 Ca 0.17 0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.66 1on4 h ASP 166 Cb 0.48 0.25 -0.03 0.00 1.72 0.00 0.00 39.33 41.76 1on4 h ASP 166 CO -0.47 -0.43 0.32 0.58 -2.88 0.00 0.00 179.24 176.36 1on4 h VAL 167 N -0.66 1.20 -0.51 2.25 2.07 -0.70 0.06 116.25 119.97 1on4 h VAL 167 Ca -0.03 -0.53 -0.10 0.00 0.82 0.00 0.00 66.70 66.87 1on4 h VAL 167 Cb 0.58 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1on4 h VAL 167 CO -0.02 0.22 -0.07 0.11 0.02 0.00 0.00 177.57 177.84 1on4 h LYS 168 N 0.83 0.91 0.39 1.57 6.56 -0.40 0.29 116.57 126.71 1on4 h LYS 168 Ca 0.21 -0.30 -0.01 0.00 -1.06 0.00 0.00 60.65 59.50 1on4 h LYS 168 Cb 0.07 -0.08 -0.03 0.00 -0.57 0.00 0.00 32.23 31.62 1on4 h LYS 168 CO -0.03 0.94 -0.52 1.03 -2.06 0.00 0.00 179.45 178.81 1on4 h SER 169 N 0.82 -1.47 -0.97 0.86 0.87 -0.01 0.72 113.55 114.37 1on4 h SER 169 Ca 0.14 0.13 0.14 0.00 -1.23 0.00 0.00 61.79 60.97 1on4 h SER 169 Cb 0.58 0.50 -0.08 0.00 -0.44 0.00 0.00 62.40 62.96 1on4 h SER 169 CO 0.04 -0.64 0.61 0.00 -0.53 0.00 0.00 176.83 176.31 1on4 h ALA 170 N -0.79 1.65 0.43 6.23 0.00 -0.80 -2.20 119.26 123.78 1on4 h ALA 170 Ca -0.05 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1on4 h ALA 170 Cb 0.85 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1on4 h ALA 170 CO -0.13 0.08 -0.23 0.77 0.00 0.00 0.00 179.25 179.75 1on4 h SER 171 N 0.86 -0.55 0.00 0.00 0.02 0.06 -3.45 113.55 110.49 1on4 h SER 171 Ca 0.50 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.47 1on4 h SER 171 Cb 0.63 0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.32 1on4 h SER 171 CO -0.26 -0.37 0.00 1.07 -1.14 0.00 0.00 176.83 176.12 1on4 n THR 172 N -3.70 0.00 -3.83 -2.27 5.66 -0.31 -5.03 114.28 104.79 1on4 n THR 172 Ca -0.07 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.57 1on4 n THR 172 Cb 0.24 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.05 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 -1.78 -0.76 1.09 4.77 0.09 -4.94 117.00 115.46 1on4 n LEU 173 Ca 0.00 -1.08 0.10 0.00 -0.03 0.00 0.00 56.01 55.00 1on4 n LEU 173 Cb 0.00 -1.98 0.08 0.00 -2.33 0.00 0.00 43.42 39.19 1on4 n LEU 173 CO 0.00 0.52 0.55 0.29 -1.33 0.00 0.00 177.39 177.42