#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5ttr h PRO 11 N 0.00 -0.10 -5.39 0.00 0.13 -1.90 -3.43 132.00 121.31 5ttr h PRO 11 Ca 0.00 0.01 -0.64 0.00 -0.87 0.00 0.00 66.00 64.50 5ttr h PRO 11 Cb 0.00 0.02 -0.19 0.00 0.13 0.00 0.00 31.00 30.96 5ttr h PRO 11 CO 0.00 -0.07 -0.63 -1.17 -0.23 0.00 0.00 178.00 175.90 5ttr s LEU 12 N -10.19 3.46 -0.03 1.56 0.20 -1.26 -0.39 118.68 112.03 5ttr s LEU 12 Ca -0.14 -0.03 0.01 0.00 0.69 0.00 0.00 54.13 54.67 5ttr s LEU 12 Cb 0.06 -1.84 0.02 0.00 -0.43 0.00 0.00 46.19 44.00 5ttr s LEU 12 CO 0.66 0.20 -0.03 -0.04 -0.29 0.00 0.00 176.35 176.84 5ttr s MET 13 N 0.19 0.57 -0.11 1.98 -1.94 -0.30 -4.65 119.30 115.05 5ttr s MET 13 Ca 0.00 -0.08 0.03 0.00 -1.71 0.00 0.00 55.69 53.93 5ttr s MET 13 Cb -0.13 -0.62 -0.01 0.00 2.01 0.00 0.00 34.83 36.08 5ttr s MET 13 CO 0.02 -0.04 -0.20 0.08 -0.01 0.00 0.00 175.02 174.87 5ttr s VAL 14 N 0.65 2.41 -0.09 -6.03 1.01 -1.26 -0.62 120.40 116.47 5ttr s VAL 14 Ca -0.08 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.03 5ttr s VAL 14 Cb -0.11 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.33 5ttr s VAL 14 CO -0.00 0.55 -0.17 -0.75 0.00 0.00 0.00 175.10 174.73 5ttr s LYS 15 N 0.28 2.29 -0.13 2.72 2.20 0.79 -3.95 119.74 123.95 5ttr s LYS 15 Ca -0.15 -0.60 0.02 0.00 -0.36 0.00 0.00 55.97 54.88 5ttr s LYS 15 Cb -0.17 -1.86 -0.00 0.00 -1.51 0.00 0.00 37.83 34.29 5ttr s LYS 15 CO 0.07 0.03 -0.19 0.08 -0.36 0.00 0.00 175.35 174.98 5ttr s VAL 16 N 0.72 2.45 0.10 4.02 1.01 0.11 -1.40 120.40 127.41 5ttr s VAL 16 Ca -0.12 -0.87 0.09 0.00 0.00 0.00 0.00 61.98 61.08 5ttr s VAL 16 Cb -0.16 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 5ttr s VAL 16 CO 0.03 0.54 -0.22 -0.76 0.00 0.00 0.00 175.10 174.69 5ttr s LEU 17 N 0.53 2.28 -0.27 3.92 1.43 -0.91 -1.97 118.68 123.69 5ttr s LEU 17 Ca -0.12 -0.67 -0.07 0.00 -1.03 0.00 0.00 54.13 52.23 5ttr s LEU 17 Cb -0.16 -0.95 -0.02 0.00 0.03 0.00 0.00 46.19 45.09 5ttr s LEU 17 CO 0.04 0.09 0.08 -0.62 0.23 0.00 0.00 176.35 176.18 5ttr s ASP 18 N -1.83 5.17 0.12 2.29 -1.08 -0.15 -0.42 116.67 120.77 5ttr s ASP 18 Ca 0.08 -0.37 0.16 0.00 -0.52 0.00 0.00 52.55 51.90 5ttr s ASP 18 Cb -0.10 -1.92 -0.09 0.00 -1.46 0.00 0.00 42.92 39.35 5ttr s ASP 18 CO 0.04 -0.09 1.00 0.00 0.52 0.00 0.00 175.17 176.64 5ttr h ALA 19 N 8.25 0.65 -0.09 3.66 0.00 -1.56 -2.18 119.26 127.98 5ttr h ALA 19 Ca -0.36 -0.76 -0.04 0.00 0.00 0.00 0.00 54.91 53.75 5ttr h ALA 19 Cb 1.16 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 5ttr h ALA 19 CO 0.59 0.87 -0.12 0.28 0.00 0.00 0.00 179.25 180.87 5ttr h VAL 20 N 0.00 1.37 -0.01 0.00 2.07 -1.93 -3.37 116.25 114.38 5ttr h VAL 20 Ca -0.12 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 66.09 5ttr h VAL 20 Cb 1.55 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 33.35 5ttr h VAL 20 CO 0.06 0.37 -0.49 -1.14 0.02 0.00 0.00 177.57 176.38 5ttr n ARG 21 N -4.63 1.27 -2.84 1.57 0.63 -1.26 -5.02 116.66 106.39 5ttr n ARG 21 Ca -0.07 -0.82 -0.08 0.00 -0.92 0.00 0.00 57.85 55.95 5ttr n ARG 21 Cb 0.34 -1.41 0.03 0.00 0.45 0.00 0.00 32.46 31.87 5ttr n ARG 21 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 5ttr n GLY 22 N 1.35 0.36 3.73 5.14 0.00 -0.85 -5.03 105.19 109.89 5ttr n GLY 22 Ca 0.08 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 5ttr n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 5ttr s SER 23 N -3.19 0.08 0.54 1.61 0.01 -1.06 -5.00 113.70 106.70 5ttr s SER 23 Ca 0.18 -1.04 -0.21 0.00 1.31 0.00 0.00 55.95 56.19 5ttr s SER 23 Cb -0.08 0.75 -0.05 0.00 0.21 0.00 0.00 66.02 66.85 5ttr s SER 23 CO 0.27 -1.45 1.25 -2.84 0.41 0.00 0.00 173.24 170.88 5ttr s PRO 24 N -3.12 3.25 -0.52 12.44 0.02 -1.26 -0.98 135.00 144.82 5ttr s PRO 24 Ca 0.18 1.96 -0.27 0.00 0.02 0.00 0.00 61.00 62.89 5ttr s PRO 24 Cb -0.04 -2.18 0.03 0.00 0.02 0.00 0.00 34.50 32.34 5ttr s PRO 24 CO 0.11 -1.02 1.06 0.00 -0.33 0.00 0.00 177.00 176.82 5ttr s ALA 25 N -1.47 3.13 0.14 -1.55 0.00 -0.83 -4.66 121.76 116.51 5ttr s ALA 25 Ca 0.72 -0.81 -0.06 0.00 0.00 0.00 0.00 51.96 51.81 5ttr s ALA 25 Cb -0.33 -3.84 -0.06 0.00 0.00 0.00 0.00 23.12 18.89 5ttr s ALA 25 CO 0.39 -2.35 0.39 -1.50 0.00 0.00 0.00 175.76 172.68 5ttr s ILE 26 N 4.32 5.15 -1.24 0.00 2.07 -1.26 -4.19 121.20 126.04 5ttr s ILE 26 Ca 0.40 0.11 -0.04 0.00 -1.41 0.00 0.00 60.65 59.71 5ttr s ILE 26 Cb -0.09 -3.62 0.00 0.00 0.13 0.00 0.00 42.46 38.88 5ttr s ILE 26 CO 0.26 0.07 0.50 0.59 -1.91 0.00 0.00 174.94 174.45 5ttr n ASN 27 N 0.18 -5.24 -4.82 4.50 4.13 -0.11 -4.88 115.26 109.03 5ttr n ASN 27 Ca -0.03 -0.24 -0.36 0.00 1.68 0.00 0.00 54.58 55.64 5ttr n ASN 27 Cb 0.52 -4.08 -0.07 0.00 -1.54 0.00 0.00 39.78 34.61 5ttr n ASN 27 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 5ttr s VAL 28 N -3.06 5.13 -0.11 2.41 0.11 -1.26 -4.67 120.40 118.94 5ttr s VAL 28 Ca 0.25 0.02 -0.25 0.00 -2.93 0.00 0.00 61.98 59.07 5ttr s VAL 28 Cb -0.11 -3.23 -0.03 0.00 -1.53 0.00 0.00 36.38 31.48 5ttr s VAL 28 CO 0.31 0.58 0.78 0.00 -3.33 0.00 0.00 175.10 173.44 5ttr s ALA 29 N -1.02 3.40 -0.23 1.54 0.00 -1.26 0.42 121.76 124.61 5ttr s ALA 29 Ca 0.16 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.24 5ttr s ALA 29 Cb -0.12 -3.11 0.03 0.00 0.00 0.00 0.00 23.12 19.92 5ttr s ALA 29 CO 0.05 -0.37 -0.12 0.08 0.00 0.00 0.00 175.76 175.40 5ttr s VAL 30 N 1.43 2.39 -0.16 0.00 1.01 -0.68 -1.33 120.40 123.07 5ttr s VAL 30 Ca 0.39 -1.17 -0.05 0.00 0.00 0.00 0.00 61.98 61.15 5ttr s VAL 30 Cb -0.18 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 5ttr s VAL 30 CO 0.16 0.25 -0.01 -1.00 0.00 0.00 0.00 175.10 174.50 5ttr s HIS 31 N 1.25 3.08 -0.15 5.22 3.76 -0.83 0.00 115.29 127.63 5ttr s HIS 31 Ca -0.01 -0.20 -0.03 0.00 -0.15 0.00 0.00 55.06 54.67 5ttr s HIS 31 Cb -0.16 -1.99 -0.03 0.00 1.11 0.00 0.00 32.58 31.52 5ttr s HIS 31 CO -0.07 0.02 -0.06 0.08 -0.85 0.00 0.00 174.74 173.85 5ttr s VAL 32 N 0.35 3.72 0.31 -0.90 1.01 0.11 -1.21 120.40 123.79 5ttr s VAL 32 Ca -0.02 -0.42 0.10 0.00 0.00 0.00 0.00 61.98 61.64 5ttr s VAL 32 Cb -0.14 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.58 5ttr s VAL 32 CO 0.02 0.51 -0.10 -0.36 0.00 0.00 0.00 175.10 175.17 5ttr s PHE 33 N 0.29 2.43 -0.06 5.22 0.08 -0.78 0.24 117.98 125.39 5ttr s PHE 33 Ca -0.05 -0.38 0.01 0.00 0.12 0.00 0.00 56.93 56.63 5ttr s PHE 33 Cb -0.14 -1.23 0.02 0.00 -0.57 0.00 0.00 43.02 41.10 5ttr s PHE 33 CO 0.03 0.62 -0.07 0.50 -0.10 0.00 0.00 175.22 176.20 5ttr s ARG 34 N -3.60 1.23 -0.15 0.44 3.52 0.11 -1.79 118.95 118.70 5ttr s ARG 34 Ca 0.32 -0.22 -0.29 0.00 -0.13 0.00 0.00 55.73 55.40 5ttr s ARG 34 Cb -0.02 -1.16 -0.05 0.00 -1.56 0.00 0.00 34.95 32.17 5ttr s ARG 34 CO 0.17 -0.08 1.79 0.21 -0.81 0.00 0.00 175.30 176.58 5ttr s LYS 35 N 1.00 3.80 0.34 5.12 2.20 -0.26 0.64 119.74 132.58 5ttr s LYS 35 Ca -0.09 1.98 -0.14 0.00 -0.36 0.00 0.00 55.97 57.35 5ttr s LYS 35 Cb -0.14 -4.11 -0.09 0.00 -1.51 0.00 0.00 37.83 31.98 5ttr s LYS 35 CO -0.00 -1.30 0.74 0.00 -0.36 0.00 0.00 175.35 174.43 5ttr s ALA 36 N 5.42 3.33 0.02 3.13 0.00 0.59 -4.63 121.76 129.61 5ttr s ALA 36 Ca 0.80 -0.00 -0.04 0.00 0.00 0.00 0.00 51.96 52.71 5ttr s ALA 36 Cb -0.31 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 20.05 5ttr s ALA 36 CO 0.33 0.27 0.27 0.00 0.00 0.00 0.00 175.76 176.63 5ttr n ALA 37 N -0.53 -0.09 -0.36 0.00 0.00 -1.26 0.67 120.51 118.94 5ttr n ALA 37 Ca 0.03 0.12 -0.03 0.00 0.00 0.00 0.00 53.44 53.56 5ttr n ALA 37 Cb 0.53 0.01 -0.04 0.00 0.00 0.00 0.00 19.45 19.95 5ttr n ALA 37 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 5ttr n ASP 38 N -3.60 2.52 -0.70 0.00 5.75 -1.26 -4.67 116.55 114.59 5ttr n ASP 38 Ca 0.00 -1.83 -0.06 0.00 -0.01 0.00 0.00 54.79 52.89 5ttr n ASP 38 Cb 0.04 -0.61 -0.03 0.00 -1.03 0.00 0.00 41.12 39.49 5ttr n ASP 38 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 5ttr n ASP 39 N 2.29 -3.33 -4.84 -1.12 9.92 0.21 -4.90 116.55 114.78 5ttr n ASP 39 Ca 0.11 0.16 -0.37 0.00 -0.53 0.00 0.00 54.79 54.16 5ttr n ASP 39 Cb 0.34 -2.65 -0.06 0.00 -0.64 0.00 0.00 41.12 38.11 5ttr n ASP 39 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 5ttr s THR 40 N -1.33 4.94 -0.38 -3.53 2.01 -1.10 -4.82 115.64 111.43 5ttr s THR 40 Ca 0.00 0.83 -0.25 0.00 0.31 0.00 0.00 61.69 62.58 5ttr s THR 40 Cb 0.00 -3.74 0.01 0.00 0.01 0.00 0.00 72.50 68.79 5ttr s THR 40 CO 0.00 0.43 0.88 0.26 -0.69 0.00 0.00 174.62 175.50 5ttr s TRP 41 N -1.25 3.07 -0.22 4.92 0.23 -1.26 0.22 118.94 124.64 5ttr s TRP 41 Ca 0.30 0.65 -0.14 0.00 -2.03 0.00 0.00 56.10 54.89 5ttr s TRP 41 Cb -0.16 -3.60 -0.04 0.00 0.03 0.00 0.00 33.47 29.69 5ttr s TRP 41 CO 0.17 -0.83 0.30 -2.00 0.96 0.00 0.00 176.95 175.54 5ttr s GLU 42 N 3.38 4.12 -0.01 4.98 -6.30 0.21 -4.77 118.70 120.30 5ttr s GLU 42 Ca 0.36 -0.01 -0.37 0.00 -2.50 0.00 0.00 54.97 52.44 5ttr s GLU 42 Cb -0.12 -3.55 -0.16 0.00 0.00 0.00 0.00 34.13 30.30 5ttr s GLU 42 CO 0.19 -0.02 1.51 -0.35 0.02 0.00 0.00 175.26 176.61 5ttr n PRO 43 N 4.47 1.32 0.00 4.30 -0.04 -1.26 0.06 135.00 143.85 5ttr n PRO 43 Ca -0.11 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 5ttr n PRO 43 Cb 0.51 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.82 5ttr n PRO 43 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 5ttr n PHE 44 N 3.64 0.00 -3.61 0.54 -0.00 0.14 -4.82 117.46 113.35 5ttr n PHE 44 Ca 0.21 0.00 -0.12 0.00 -0.00 0.00 0.00 57.45 57.53 5ttr n PHE 44 Cb 0.19 0.00 -0.05 0.00 -0.00 0.00 0.00 39.48 39.62 5ttr n PHE 44 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 5ttr s ALA 45 N -1.72 -1.11 -0.15 3.13 0.00 -0.50 -4.97 121.76 116.43 5ttr s ALA 45 Ca 0.00 0.27 -0.16 0.00 0.00 0.00 0.00 51.96 52.07 5ttr s ALA 45 Cb 0.00 0.52 0.04 0.00 0.00 0.00 0.00 23.12 23.68 5ttr s ALA 45 CO 0.00 -0.56 0.45 0.45 0.00 0.00 0.00 175.76 176.10 5ttr s SER 46 N -2.34 -0.45 0.16 0.00 0.15 -1.26 0.07 113.70 110.03 5ttr s SER 46 Ca -0.02 0.82 -0.02 0.00 0.70 0.00 0.00 55.95 57.42 5ttr s SER 46 Cb 0.00 0.84 0.01 0.00 -1.71 0.00 0.00 66.02 65.17 5ttr s SER 46 CO -0.06 -0.20 0.25 0.61 1.20 0.00 0.00 173.24 175.03 5ttr n GLY 47 N 2.60 2.36 2.86 9.45 0.00 0.10 -4.98 105.19 117.59 5ttr n GLY 47 Ca -0.14 -1.38 -0.14 0.00 0.00 0.00 0.00 46.02 44.36 5ttr n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 5ttr s LYS 48 N -2.26 0.03 0.42 1.61 1.02 -1.25 -1.68 119.74 117.62 5ttr s LYS 48 Ca 0.11 0.26 -0.24 0.00 0.02 0.00 0.00 55.97 56.12 5ttr s LYS 48 Cb -0.01 -0.19 -0.08 0.00 -0.52 0.00 0.00 37.83 37.03 5ttr s LYS 48 CO 0.08 -0.15 1.16 0.95 -0.92 0.00 0.00 175.35 176.47 5ttr s THR 49 N 1.01 3.17 0.23 2.17 -4.23 0.17 -4.28 115.64 113.88 5ttr s THR 49 Ca -0.08 0.95 -0.04 0.00 -1.18 0.00 0.00 61.69 61.33 5ttr s THR 49 Cb -0.11 -3.51 0.05 0.00 1.34 0.00 0.00 72.50 70.27 5ttr s THR 49 CO -0.04 0.05 0.31 -1.54 -0.54 0.00 0.00 174.62 172.86 5ttr n SER 50 N -0.11 -0.03 0.05 3.99 3.41 -1.11 -0.93 113.62 118.88 5ttr n SER 50 Ca 0.05 -1.10 0.04 0.00 -0.26 0.00 0.00 58.87 57.61 5ttr n SER 50 Cb 0.47 -0.24 0.22 0.00 -0.26 0.00 0.00 64.21 64.40 5ttr n SER 50 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 5ttr n GLU 51 N -1.69 0.05 0.00 4.33 0.00 -1.26 -2.08 120.64 119.99 5ttr n GLU 51 Ca 0.04 0.50 0.12 0.00 0.00 0.00 0.00 57.16 57.82 5ttr n GLU 51 Cb 0.14 -1.64 0.17 0.00 0.00 0.00 0.00 31.44 30.11 5ttr n GLU 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 5ttr n SER 52 N -1.74 1.95 0.00 -1.84 3.41 -1.26 -4.74 113.62 109.40 5ttr n SER 52 Ca 0.00 -1.48 0.00 0.00 -0.26 0.00 0.00 58.87 57.13 5ttr n SER 52 Cb 0.04 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 5ttr n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 5ttr n GLY 53 N 1.36 1.87 3.40 5.00 0.00 -0.88 -4.77 105.19 111.15 5ttr n GLY 53 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 5ttr n GLY 53 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 5ttr s GLU 54 N -0.74 3.07 1.04 1.61 2.12 -1.25 0.10 118.70 124.64 5ttr s GLU 54 Ca 0.00 -0.70 -0.13 0.00 0.36 0.00 0.00 54.97 54.50 5ttr s GLU 54 Cb 0.00 -2.53 0.15 0.00 0.26 0.00 0.00 34.13 32.01 5ttr s GLU 54 CO 0.00 0.35 0.67 -2.30 -0.54 0.00 0.00 175.26 173.44 5ttr n PRO 55 N 3.11 -1.19 0.00 4.30 -0.02 -1.26 -2.76 135.00 137.18 5ttr n PRO 55 Ca -0.18 -0.31 0.00 0.00 -2.02 0.00 0.00 63.50 60.99 5ttr n PRO 55 Cb 0.53 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 5ttr n PRO 55 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 5ttr n HIS 56 N -4.31 0.00 -3.83 6.00 8.25 -1.26 -4.81 115.22 115.25 5ttr n HIS 56 Ca 0.06 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.22 5ttr n HIS 56 Cb 0.55 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.51 5ttr n HIS 56 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 5ttr s GLY 57 N 0.00 1.13 0.01 -1.41 0.00 -1.26 -5.05 107.32 100.74 5ttr s GLY 57 Ca 0.00 -1.39 -0.25 0.00 0.00 0.00 0.00 44.72 43.08 5ttr s GLY 57 CO 0.00 1.27 1.38 1.41 0.00 0.00 0.00 173.10 177.16 5ttr h LEU 58 N 8.04 -0.05 -8.68 0.66 -0.00 -1.88 -3.48 115.31 109.93 5ttr h LEU 58 Ca -0.15 -0.32 -0.33 0.00 -0.00 0.00 0.00 57.88 57.08 5ttr h LEU 58 Cb 1.06 0.01 -0.12 0.00 -0.00 0.00 0.00 40.66 41.61 5ttr h LEU 58 CO 0.42 0.30 -0.45 0.42 -0.00 0.00 0.00 178.44 179.14 5ttr s THR 59 N -4.79 0.00 0.08 0.22 -4.23 -1.26 -4.73 115.64 100.92 5ttr s THR 59 Ca -0.15 -1.88 0.09 0.00 -1.18 0.00 0.00 61.69 58.57 5ttr s THR 59 Cb 0.03 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.33 5ttr s THR 59 CO 0.65 0.00 -0.22 0.42 -0.54 0.00 0.00 174.62 174.93 5ttr s THR 60 N -3.65 2.53 0.53 3.99 -4.23 -1.26 -4.62 115.64 108.93 5ttr s THR 60 Ca 0.37 -1.42 0.39 0.00 -1.18 0.00 0.00 61.69 59.84 5ttr s THR 60 Cb 0.03 -2.08 0.59 0.00 1.34 0.00 0.00 72.50 72.38 5ttr s THR 60 CO 0.20 0.24 1.73 -0.33 -0.54 0.00 0.00 174.62 175.92 5ttr h GLU 61 N 4.29 0.03 0.02 3.99 3.07 -1.99 0.41 114.58 124.40 5ttr h GLU 61 Ca -0.49 -0.00 -0.25 0.00 -0.50 0.00 0.00 59.36 58.12 5ttr h GLU 61 Cb 1.16 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 29.03 5ttr h GLU 61 CO 0.44 0.02 -1.30 1.49 -1.40 0.00 0.00 179.01 178.26 5ttr h GLU 62 N 0.03 0.04 0.00 2.33 4.81 -2.04 -3.36 114.58 116.39 5ttr h GLU 62 Ca 0.69 -0.08 -0.29 0.00 -0.13 0.00 0.00 59.36 59.55 5ttr h GLU 62 Cb 2.65 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 32.01 5ttr h GLU 62 CO -0.05 0.87 -1.73 0.39 -0.73 0.00 0.00 179.01 177.75 5ttr n GLU 63 N -3.28 0.63 -2.18 1.92 1.02 0.10 -4.66 120.64 114.19 5ttr n GLU 63 Ca -0.08 0.27 -0.31 0.00 -0.02 0.00 0.00 57.16 57.02 5ttr n GLU 63 Cb 0.99 -1.78 -0.04 0.00 -0.02 0.00 0.00 31.44 30.59 5ttr n GLU 63 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 5ttr s PHE 64 N -2.62 2.00 0.53 -0.32 5.36 0.10 -4.95 117.98 118.08 5ttr s PHE 64 Ca -0.05 0.24 0.06 0.00 -0.96 0.00 0.00 56.93 56.23 5ttr s PHE 64 Cb 0.08 -4.22 0.06 0.00 -0.34 0.00 0.00 43.02 38.59 5ttr s PHE 64 CO 0.82 -1.81 0.74 0.14 -1.46 0.00 0.00 175.22 173.65 5ttr s VAL 65 N 8.71 2.54 0.48 3.12 -7.23 -1.26 -4.93 120.40 121.82 5ttr s VAL 65 Ca 0.64 -0.89 -0.23 0.00 -1.81 0.00 0.00 61.98 59.68 5ttr s VAL 65 Cb -0.05 -2.65 -0.07 0.00 0.56 0.00 0.00 36.38 34.17 5ttr s VAL 65 CO -0.03 0.00 1.28 -0.70 -0.31 0.00 0.00 175.10 175.34 5ttr s GLU 66 N -4.63 3.58 0.00 4.82 2.56 -1.26 -4.79 118.70 118.98 5ttr s GLU 66 Ca 0.59 2.07 0.00 0.00 0.00 0.00 0.00 54.97 57.63 5ttr s GLU 66 Cb -0.08 -2.45 0.00 0.00 2.00 0.00 0.00 34.13 33.60 5ttr s GLU 66 CO 0.37 -0.78 0.00 0.41 -0.56 0.00 0.00 175.26 174.71 5ttr n GLY 67 N 0.61 -0.00 3.63 -1.50 0.00 -0.98 -4.95 105.19 101.99 5ttr n GLY 67 Ca 0.07 -1.19 -0.39 0.00 0.00 0.00 0.00 46.02 44.52 5ttr n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5ttr s ILE 68 N -2.00 5.17 0.01 -0.61 1.01 -1.26 0.85 121.20 124.37 5ttr s ILE 68 Ca 0.00 0.65 0.05 0.00 0.00 0.00 0.00 60.65 61.35 5ttr s ILE 68 Cb 0.00 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.72 5ttr s ILE 68 CO 0.00 0.18 -0.13 -0.31 0.00 0.00 0.00 174.94 174.68 5ttr s TYR 69 N 1.87 2.72 -0.28 3.97 2.02 0.17 -1.10 117.35 126.72 5ttr s TYR 69 Ca 0.17 -0.15 -0.02 0.00 -0.37 0.00 0.00 57.07 56.70 5ttr s TYR 69 Cb -0.15 -1.55 0.04 0.00 -0.40 0.00 0.00 41.96 39.90 5ttr s TYR 69 CO 0.09 0.30 -0.02 0.21 -1.57 0.00 0.00 175.55 174.56 5ttr s LYS 70 N -1.35 2.60 -0.35 -0.62 2.20 -0.74 -0.72 119.74 120.77 5ttr s LYS 70 Ca 0.15 -1.14 -0.16 0.00 -0.36 0.00 0.00 55.97 54.46 5ttr s LYS 70 Cb -0.11 -3.13 -0.01 0.00 -1.51 0.00 0.00 37.83 33.07 5ttr s LYS 70 CO 0.06 -0.54 0.39 0.08 -0.36 0.00 0.00 175.35 174.98 5ttr s VAL 71 N 1.29 5.14 -0.14 4.02 1.01 -0.08 -1.87 120.40 129.77 5ttr s VAL 71 Ca -0.03 0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 5ttr s VAL 71 Cb -0.19 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.32 5ttr s VAL 71 CO -0.02 -0.13 -0.08 -0.70 0.00 0.00 0.00 175.10 174.17 5ttr s GLU 72 N 2.09 3.51 -0.22 2.72 2.12 -0.35 -0.37 118.70 128.19 5ttr s GLU 72 Ca 0.13 -0.60 -0.07 0.00 0.36 0.00 0.00 54.97 54.79 5ttr s GLU 72 Cb -0.16 -2.77 -0.03 0.00 0.26 0.00 0.00 34.13 31.43 5ttr s GLU 72 CO 0.12 0.24 0.05 0.42 -0.54 0.00 0.00 175.26 175.55 5ttr s ILE 73 N 0.32 4.29 -1.19 -3.70 1.01 0.17 -1.97 121.20 120.13 5ttr s ILE 73 Ca -0.07 -0.19 -0.18 0.00 0.00 0.00 0.00 60.65 60.21 5ttr s ILE 73 Cb -0.15 -2.97 0.10 0.00 0.01 0.00 0.00 42.46 39.44 5ttr s ILE 73 CO 0.04 0.39 1.55 -0.62 0.00 0.00 0.00 174.94 176.30 5ttr s ASP 74 N 1.20 6.81 0.01 3.58 -1.08 -0.44 -2.00 116.67 124.75 5ttr s ASP 74 Ca 0.04 -2.35 -0.21 0.00 -0.52 0.00 0.00 52.55 49.51 5ttr s ASP 74 Cb -0.14 -2.52 -0.19 0.00 -1.46 0.00 0.00 42.92 38.61 5ttr s ASP 74 CO 0.03 -1.12 1.20 0.71 0.52 0.00 0.00 175.17 176.51 5ttr h THR 75 N 5.61 1.41 -0.80 1.71 1.35 -1.89 -3.23 112.91 117.06 5ttr h THR 75 Ca 0.34 -1.71 0.18 0.00 -0.55 0.00 0.00 66.41 64.67 5ttr h THR 75 Cb 0.91 2.28 -0.11 0.00 -1.73 0.00 0.00 68.15 69.50 5ttr h THR 75 CO 1.37 0.50 0.29 0.50 -0.25 0.00 0.00 175.52 177.92 5ttr h LYS 76 N -0.11 0.36 -0.62 4.72 3.64 -1.69 -1.63 116.57 121.25 5ttr h LYS 76 Ca -0.02 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 5ttr h LYS 76 Cb 0.97 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.68 5ttr h LYS 76 CO 0.07 0.24 0.11 0.77 -2.27 0.00 0.00 179.45 178.36 5ttr h SER 77 N 0.37 0.95 -0.14 4.20 0.02 -1.86 -0.27 113.55 116.81 5ttr h SER 77 Ca 0.47 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.20 5ttr h SER 77 Cb 0.81 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 5ttr h SER 77 CO -0.49 0.94 0.06 0.22 -1.14 0.00 0.00 176.83 176.42 5ttr h TYR 78 N 0.94 0.21 0.03 3.45 3.20 -1.32 -2.37 116.97 121.11 5ttr h TYR 78 Ca 0.19 -0.02 -0.19 0.00 3.14 0.00 0.00 58.73 61.85 5ttr h TYR 78 Cb 0.40 -0.06 0.02 0.00 1.54 0.00 0.00 36.73 38.62 5ttr h TYR 78 CO 0.03 0.29 -0.78 -1.49 -1.64 0.00 0.00 178.16 174.57 5ttr h TRP 79 N 0.07 0.73 -0.94 -3.82 4.06 -1.41 -3.24 115.95 111.40 5ttr h TRP 79 Ca 0.05 -0.42 0.10 0.00 2.06 0.00 0.00 58.89 60.68 5ttr h TRP 79 Cb 0.16 -0.08 -0.08 0.00 -1.00 0.00 0.00 29.16 28.17 5ttr h TRP 79 CO -0.02 1.25 0.58 0.87 -3.56 0.00 0.00 178.44 177.57 5ttr h LYS 80 N 0.00 0.95 0.00 0.49 1.57 -0.85 -0.58 116.57 118.15 5ttr h LYS 80 Ca -0.10 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 5ttr h LYS 80 Cb 1.49 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.58 5ttr h LYS 80 CO 0.15 0.63 0.00 0.00 -0.57 0.00 0.00 179.45 179.66 5ttr n ALA 81 N -2.36 2.03 -0.02 3.86 0.00 -0.90 -1.67 120.51 121.45 5ttr n ALA 81 Ca 0.16 -0.09 0.05 0.00 0.00 0.00 0.00 53.44 53.56 5ttr n ALA 81 Cb 0.28 -1.30 0.12 0.00 0.00 0.00 0.00 19.45 18.55 5ttr n ALA 81 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 5ttr n LEU 82 N -1.22 2.65 0.00 0.00 7.99 -0.26 -4.97 117.00 121.19 5ttr n LEU 82 Ca 0.10 -1.76 0.00 0.00 -0.01 0.00 0.00 56.01 54.34 5ttr n LEU 82 Cb 0.13 -0.17 0.00 0.00 -0.11 0.00 0.00 43.42 43.27 5ttr n LEU 82 CO 0.13 0.64 0.00 0.61 -1.51 0.00 0.00 177.39 177.26 5ttr n GLY 83 N 0.50 0.73 3.78 -0.72 0.00 -0.67 -5.06 105.19 103.74 5ttr n GLY 83 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 5ttr n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5ttr s ILE 84 N -2.21 4.76 -0.35 -0.61 -1.09 -0.97 -4.98 121.20 115.75 5ttr s ILE 84 Ca 0.00 1.36 -0.11 0.00 -2.23 0.00 0.00 60.65 59.67 5ttr s ILE 84 Cb 0.00 -3.98 0.01 0.00 -1.58 0.00 0.00 42.46 36.92 5ttr s ILE 84 CO 0.00 0.46 0.19 -0.44 -1.23 0.00 0.00 174.94 173.93 5ttr s SER 85 N -0.56 5.70 0.68 3.58 0.01 -1.26 -2.76 113.70 119.10 5ttr s SER 85 Ca 0.32 -0.81 -0.07 0.00 1.31 0.00 0.00 55.95 56.69 5ttr s SER 85 Cb -0.20 -2.03 0.04 0.00 0.21 0.00 0.00 66.02 64.05 5ttr s SER 85 CO 0.20 -0.32 1.01 -2.16 0.41 0.00 0.00 173.24 172.37 5ttr s PRO 86 N 1.58 2.46 -0.10 12.44 0.04 -1.26 -4.98 135.00 145.18 5ttr s PRO 86 Ca 0.03 -0.07 -0.13 0.00 0.04 0.00 0.00 61.00 60.88 5ttr s PRO 86 Cb -0.18 -2.16 -0.11 0.00 0.04 0.00 0.00 34.50 32.09 5ttr s PRO 86 CO 0.07 -1.09 0.39 0.35 0.04 0.00 0.00 177.00 176.76 5ttr h PHE 87 N -0.53 -0.06 -3.80 0.56 3.57 -1.49 -3.47 116.94 111.73 5ttr h PHE 87 Ca -0.45 -0.00 -0.48 0.00 3.53 0.00 0.00 57.97 60.57 5ttr h PHE 87 Cb 1.29 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 40.03 5ttr h PHE 87 CO 0.39 0.32 0.34 -1.01 -2.23 0.00 0.00 178.31 176.12 5ttr s HIS 88 N -2.12 3.88 0.32 0.41 0.09 -1.26 -4.96 115.29 111.63 5ttr s HIS 88 Ca -0.08 1.86 0.06 0.00 -0.00 0.00 0.00 55.06 56.90 5ttr s HIS 88 Cb -0.01 -2.95 0.53 0.00 -0.00 0.00 0.00 32.58 30.15 5ttr s HIS 88 CO 0.29 0.37 1.78 0.93 -0.00 0.00 0.00 174.74 178.10 5ttr h GLU 89 N 3.79 0.35 -2.13 1.40 4.39 -1.98 -3.35 114.58 117.05 5ttr h GLU 89 Ca -0.46 -0.12 0.34 0.00 0.34 0.00 0.00 59.36 59.46 5ttr h GLU 89 Cb 1.20 -0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 29.75 5ttr h GLU 89 CO 0.67 0.58 0.89 -3.38 -1.16 0.00 0.00 179.01 176.61 5ttr s HIS 90 N -4.49 0.03 -0.09 4.33 -3.43 -1.26 -3.39 115.29 106.98 5ttr s HIS 90 Ca -0.06 -0.15 0.04 0.00 -0.80 0.00 0.00 55.06 54.08 5ttr s HIS 90 Cb 0.14 0.57 -0.00 0.00 -1.43 0.00 0.00 32.58 31.85 5ttr s HIS 90 CO 0.77 -0.30 -0.22 0.00 -2.00 0.00 0.00 174.74 172.99 5ttr s ALA 91 N -2.04 2.25 0.10 -1.38 0.00 -0.85 -4.91 121.76 114.93 5ttr s ALA 91 Ca 0.29 -0.97 0.09 0.00 0.00 0.00 0.00 51.96 51.36 5ttr s ALA 91 Cb -0.00 -0.85 -0.03 0.00 0.00 0.00 0.00 23.12 22.23 5ttr s ALA 91 CO -0.00 0.32 -0.23 -2.00 0.00 0.00 0.00 175.76 173.84 5ttr s GLU 92 N 0.22 1.27 -0.26 0.00 -6.30 -1.26 0.41 118.70 112.79 5ttr s GLU 92 Ca -0.14 -1.18 -0.00 0.00 -2.50 0.00 0.00 54.97 51.15 5ttr s GLU 92 Cb -0.17 -1.58 0.08 0.00 0.00 0.00 0.00 34.13 32.46 5ttr s GLU 92 CO 0.07 0.38 0.02 0.08 0.02 0.00 0.00 175.26 175.83 5ttr s VAL 93 N -1.06 1.19 -0.20 3.70 1.01 0.50 -4.96 120.40 120.58 5ttr s VAL 93 Ca 0.09 -1.23 -0.07 0.00 0.00 0.00 0.00 61.98 60.77 5ttr s VAL 93 Cb -0.10 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 5ttr s VAL 93 CO 0.04 -0.34 0.05 0.54 0.00 0.00 0.00 175.10 175.40 5ttr s VAL 94 N 1.51 4.52 0.07 2.92 0.11 -1.26 -0.91 120.40 127.36 5ttr s VAL 94 Ca 0.01 -0.12 -0.01 0.00 -2.93 0.00 0.00 61.98 58.93 5ttr s VAL 94 Cb -0.18 -3.05 -0.04 0.00 -1.53 0.00 0.00 36.38 31.58 5ttr s VAL 94 CO -0.12 0.42 -0.01 0.72 -3.33 0.00 0.00 175.10 172.78 5ttr s PHE 95 N 0.80 0.58 -0.10 1.54 -0.71 0.10 -4.98 117.98 115.21 5ttr s PHE 95 Ca 0.03 -1.10 -0.14 0.00 -1.04 0.00 0.00 56.93 54.69 5ttr s PHE 95 Cb -0.14 -0.40 -0.05 0.00 -1.21 0.00 0.00 43.02 41.22 5ttr s PHE 95 CO 0.02 -0.41 0.33 0.99 -1.34 0.00 0.00 175.22 174.81 5ttr s THR 96 N -3.94 5.23 0.18 -4.49 2.01 -1.26 0.46 115.64 113.83 5ttr s THR 96 Ca 0.10 0.64 0.09 0.00 0.31 0.00 0.00 61.69 62.83 5ttr s THR 96 Cb 0.08 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 5ttr s THR 96 CO -0.08 0.48 -0.18 0.00 -0.69 0.00 0.00 174.62 174.14 5ttr s ALA 97 N -0.22 2.10 -1.01 7.40 0.00 0.25 -4.77 121.76 125.51 5ttr s ALA 97 Ca 0.20 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 50.61 5ttr s ALA 97 Cb -0.14 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.79 5ttr s ALA 97 CO 0.08 0.24 0.00 0.09 0.00 0.00 0.00 175.76 176.16 5ttr n ASN 98 N 0.17 -3.17 0.07 0.00 3.02 -1.26 -2.32 115.26 111.77 5ttr n ASN 98 Ca -0.12 0.25 -0.14 0.00 -0.03 0.00 0.00 54.58 54.54 5ttr n ASN 98 Cb 0.57 -2.87 -0.08 0.00 -0.61 0.00 0.00 39.78 36.79 5ttr n ASN 98 CO 0.00 0.00 0.00 -0.78 -2.62 0.00 0.00 177.26 173.86 5ttr h ASP 99 N 0.00 -1.38 -0.04 6.41 1.82 -1.92 -3.05 116.42 118.26 5ttr h ASP 99 Ca -0.24 0.15 0.00 0.00 -0.39 0.00 0.00 57.03 56.55 5ttr h ASP 99 Cb 0.95 0.51 0.00 0.00 0.68 0.00 0.00 39.33 41.48 5ttr h ASP 99 CO 0.31 -0.46 0.00 -1.20 -1.61 0.00 0.00 179.24 176.28 5ttr n SER 100 N -5.00 0.47 0.00 2.28 7.64 -1.26 -4.99 113.62 112.75 5ttr n SER 100 Ca -0.07 -1.46 0.00 0.00 1.01 0.00 0.00 58.87 58.35 5ttr n SER 100 Cb 0.34 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 5ttr n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 5ttr n GLY 101 N 0.90 2.07 3.67 0.23 0.00 -1.15 -5.06 105.19 105.86 5ttr n GLY 101 Ca 0.15 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 5ttr n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 5ttr s PRO 102 N -1.65 4.14 0.26 1.61 0.04 -1.26 -4.21 135.00 133.92 5ttr s PRO 102 Ca 0.00 2.60 0.01 0.00 0.04 0.00 0.00 61.00 63.65 5ttr s PRO 102 Cb 0.00 -3.90 -0.04 0.00 0.04 0.00 0.00 34.50 30.60 5ttr s PRO 102 CO 0.00 -0.90 0.13 1.03 0.04 0.00 0.00 177.00 177.30 5ttr s ARG 103 N 3.67 1.42 -0.22 4.56 3.00 -1.26 -4.83 118.95 125.29 5ttr s ARG 103 Ca 0.85 -1.78 -0.05 0.00 0.00 0.00 0.00 55.73 54.75 5ttr s ARG 103 Cb -0.44 -0.05 -0.02 0.00 0.00 0.00 0.00 34.95 34.45 5ttr s ARG 103 CO 0.39 -0.38 0.00 1.03 0.00 0.00 0.00 175.30 176.34 5ttr s ARG 104 N -3.98 3.53 -0.16 3.54 0.52 0.19 -4.90 118.95 117.68 5ttr s ARG 104 Ca 0.38 -0.55 -0.08 0.00 -0.52 0.00 0.00 55.73 54.95 5ttr s ARG 104 Cb 0.07 -3.11 -0.04 0.00 0.52 0.00 0.00 34.95 32.38 5ttr s ARG 104 CO 0.15 -0.13 0.12 0.71 0.02 0.00 0.00 175.30 176.17 5ttr s TYR 105 N 1.36 3.44 -0.14 -0.53 2.02 0.48 -1.15 117.35 122.82 5ttr s TYR 105 Ca 0.04 0.36 0.01 0.00 -0.37 0.00 0.00 57.07 57.11 5ttr s TYR 105 Cb -0.15 -2.05 0.02 0.00 -0.40 0.00 0.00 41.96 39.38 5ttr s TYR 105 CO 0.00 0.43 -0.18 0.99 -1.57 0.00 0.00 175.55 175.23 5ttr s THR 106 N -0.18 1.78 -0.12 -0.71 2.01 -0.87 -1.15 115.64 116.41 5ttr s THR 106 Ca 0.10 -0.79 -0.03 0.00 0.31 0.00 0.00 61.69 61.28 5ttr s THR 106 Cb -0.12 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.74 5ttr s THR 106 CO 0.01 0.49 0.01 -0.63 -0.69 0.00 0.00 174.62 173.81 5ttr s ILE 107 N 1.17 4.38 -0.12 1.82 -1.09 0.21 -1.81 121.20 125.76 5ttr s ILE 107 Ca -0.01 -0.21 0.02 0.00 -2.23 0.00 0.00 60.65 58.23 5ttr s ILE 107 Cb -0.14 -2.88 -0.01 0.00 -1.58 0.00 0.00 42.46 37.85 5ttr s ILE 107 CO -0.07 0.56 -0.18 0.00 -1.23 0.00 0.00 174.94 174.02 5ttr s ALA 108 N -0.43 2.41 0.05 9.38 0.00 -0.64 -0.15 121.76 132.38 5ttr s ALA 108 Ca 0.08 -0.94 0.09 0.00 0.00 0.00 0.00 51.96 51.19 5ttr s ALA 108 Cb -0.12 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.94 5ttr s ALA 108 CO 0.02 0.25 -0.25 0.00 0.00 0.00 0.00 175.76 175.78 5ttr s ALA 109 N 0.38 2.12 -0.20 0.00 0.00 -0.49 -2.62 121.76 120.95 5ttr s ALA 109 Ca -0.14 -1.22 -0.01 0.00 0.00 0.00 0.00 51.96 50.59 5ttr s ALA 109 Cb -0.17 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.52 5ttr s ALA 109 CO 0.07 0.50 -0.13 -1.17 0.00 0.00 0.00 175.76 175.03 5ttr s LEU 110 N -1.24 2.50 -0.08 0.00 0.20 -0.69 -2.15 118.68 117.22 5ttr s LEU 110 Ca 0.11 -0.52 -0.03 0.00 0.69 0.00 0.00 54.13 54.38 5ttr s LEU 110 Cb -0.10 -1.60 -0.04 0.00 -0.43 0.00 0.00 46.19 44.03 5ttr s LEU 110 CO 0.02 -0.00 0.04 -0.76 -0.29 0.00 0.00 176.35 175.35 5ttr s LEU 111 N 1.35 3.78 -0.00 -0.68 1.02 0.44 -2.19 118.68 122.39 5ttr s LEU 111 Ca 0.05 0.21 -0.10 0.00 0.02 0.00 0.00 54.13 54.31 5ttr s LEU 111 Cb -0.14 -1.91 0.01 0.00 0.02 0.00 0.00 46.19 44.17 5ttr s LEU 111 CO -0.08 0.38 0.20 -0.44 0.02 0.00 0.00 176.35 176.43 5ttr s SER 112 N -1.00 -0.06 0.27 2.29 0.01 -0.78 -1.56 113.70 112.88 5ttr s SER 112 Ca 0.15 -0.09 -0.07 0.00 1.31 0.00 0.00 55.95 57.24 5ttr s SER 112 Cb -0.12 0.25 0.47 0.00 0.21 0.00 0.00 66.02 66.83 5ttr s SER 112 CO 0.04 -0.40 1.57 -0.65 0.41 0.00 0.00 173.24 174.22 5ttr h PRO 113 N 4.14 0.01 -0.33 12.44 0.11 -1.99 -2.75 132.00 143.62 5ttr h PRO 113 Ca -0.30 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 5ttr h PRO 113 Cb 1.19 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 5ttr h PRO 113 CO 0.40 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.86 5ttr n TYR 114 N -5.57 0.63 -3.61 0.65 4.02 -1.26 -1.17 117.16 110.85 5ttr n TYR 114 Ca 0.16 -0.61 -0.12 0.00 -0.01 0.00 0.00 57.90 57.32 5ttr n TYR 114 Cb 0.51 -0.11 -0.05 0.00 -0.02 0.00 0.00 39.34 39.67 5ttr n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 5ttr s SER 115 N -1.25 -0.32 -0.19 7.72 0.15 -1.04 -4.96 113.70 113.82 5ttr s SER 115 Ca 0.29 -0.12 -0.25 0.00 0.70 0.00 0.00 55.95 56.58 5ttr s SER 115 Cb 0.19 0.48 0.06 0.00 -1.71 0.00 0.00 66.02 65.04 5ttr s SER 115 CO 0.14 -0.80 0.65 -0.72 1.20 0.00 0.00 173.24 173.71 5ttr s TYR 116 N -3.24 -0.68 0.09 3.44 -0.85 -1.26 -1.87 117.35 112.98 5ttr s TYR 116 Ca -0.01 1.54 0.07 0.00 -0.52 0.00 0.00 57.07 58.15 5ttr s TYR 116 Cb 0.00 0.28 -0.03 0.00 0.38 0.00 0.00 41.96 42.60 5ttr s TYR 116 CO -0.08 -0.42 -0.19 -1.12 -1.52 0.00 0.00 175.55 172.22 5ttr s SER 117 N -0.13 2.25 0.12 -0.18 0.01 -0.93 -4.95 113.70 109.88 5ttr s SER 117 Ca -0.04 -0.66 0.08 0.00 1.31 0.00 0.00 55.95 56.65 5ttr s SER 117 Cb -0.03 -0.11 -0.04 0.00 0.21 0.00 0.00 66.02 66.05 5ttr s SER 117 CO 0.03 0.02 -0.21 -0.89 0.41 0.00 0.00 173.24 172.60 5ttr s THR 118 N -1.18 1.78 -0.00 1.44 2.01 -1.26 -1.70 115.64 116.73 5ttr s THR 118 Ca 0.04 -1.64 -0.02 0.00 0.31 0.00 0.00 61.69 60.37 5ttr s THR 118 Cb -0.10 -1.65 -0.00 0.00 0.01 0.00 0.00 72.50 70.75 5ttr s THR 118 CO 0.03 -0.10 0.04 -0.89 -0.69 0.00 0.00 174.62 173.01 5ttr s THR 119 N -1.34 0.05 -0.08 -0.82 2.01 -1.08 -4.97 115.64 109.41 5ttr s THR 119 Ca 0.09 -0.43 0.02 0.00 0.31 0.00 0.00 61.69 61.68 5ttr s THR 119 Cb -0.09 -0.20 -0.02 0.00 0.01 0.00 0.00 72.50 72.19 5ttr s THR 119 CO 0.05 -0.24 -0.13 0.00 -0.69 0.00 0.00 174.62 173.61 5ttr s ALA 120 N -0.73 2.69 -0.22 7.40 0.00 -1.26 -1.62 121.76 128.02 5ttr s ALA 120 Ca -0.08 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 50.96 5ttr s ALA 120 Cb -0.05 -1.08 0.04 0.00 0.00 0.00 0.00 23.12 22.04 5ttr s ALA 120 CO -0.00 0.46 -0.13 0.08 0.00 0.00 0.00 175.76 176.16 5ttr s VAL 121 N -0.39 1.97 -0.10 0.00 1.01 -0.75 -4.99 120.40 117.15 5ttr s VAL 121 Ca 0.04 -1.24 -0.01 0.00 0.00 0.00 0.00 61.98 60.77 5ttr s VAL 121 Cb -0.12 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 5ttr s VAL 121 CO 0.02 0.19 -0.04 -0.69 0.00 0.00 0.00 175.10 174.58 5ttr s VAL 122 N 1.25 3.91 0.24 2.92 1.01 -1.26 -2.04 120.40 126.43 5ttr s VAL 122 Ca -0.03 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.54 5ttr s VAL 122 Cb -0.17 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 5ttr s VAL 122 CO -0.08 0.57 0.26 0.42 0.00 0.00 0.00 175.10 176.26 5ttr s THR 123 N -0.46 0.00 0.00 3.92 -4.23 -0.30 -4.95 115.64 109.62 5ttr s THR 123 Ca 0.07 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 5ttr s THR 123 Cb -0.12 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.27 5ttr s THR 123 CO 0.02 0.00 0.00 -3.20 -0.54 0.00 0.00 174.62 170.90 5ttr n ASN 124 N -0.56 0.03 0.00 3.99 4.05 -1.26 0.57 115.26 122.08 5ttr n ASN 124 Ca 0.02 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.05 5ttr n ASN 124 Cb 0.64 -0.01 0.00 0.00 1.23 0.00 0.00 39.78 41.64 5ttr n ASN 124 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56