#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 0.76 -5.17 0.00 0.13 -1.90 -3.43 132.00 122.39 5ttr h PRO 11 Ca 0.00 -0.30 -0.66 0.00 -0.87 0.00 0.00 66.00 64.18 5ttr h PRO 11 Cb 0.00 -0.04 -0.34 0.00 0.13 0.00 0.00 31.00 30.75 5ttr h PRO 11 CO 0.00 0.91 -0.87 -1.17 -0.23 0.00 0.00 178.00 176.64 5ttr s LEU 12 N -8.91 2.02 -0.04 1.56 2.96 -1.26 -0.78 118.68 114.23 5ttr s LEU 12 Ca -0.09 -0.54 0.01 0.00 -0.22 0.00 0.00 54.13 53.29 5ttr s LEU 12 Cb 0.13 -1.34 0.02 0.00 0.50 0.00 0.00 46.19 45.50 5ttr s LEU 12 CO 0.83 0.11 -0.05 -0.04 -1.32 0.00 0.00 176.35 175.88 5ttr s MET 13 N 0.59 0.77 -0.03 1.98 -1.94 -0.70 -4.62 119.30 115.35 5ttr s MET 13 Ca -0.13 -0.11 0.07 0.00 -1.71 0.00 0.00 55.69 53.80 5ttr s MET 13 Cb -0.17 -0.77 -0.02 0.00 2.01 0.00 0.00 34.83 35.88 5ttr s MET 13 CO 0.04 -0.05 -0.24 0.14 -0.01 0.00 0.00 175.02 174.90 5ttr s VAL 14 N 0.77 1.89 -0.14 -6.03 -7.23 -1.26 -0.76 120.40 107.65 5ttr s VAL 14 Ca -0.10 -1.01 0.02 0.00 -1.81 0.00 0.00 61.98 59.08 5ttr s VAL 14 Cb -0.13 -1.57 0.01 0.00 0.56 0.00 0.00 36.38 35.25 5ttr s VAL 14 CO 0.00 0.53 -0.21 -0.54 -0.31 0.00 0.00 175.10 174.58 5ttr s LYS 15 N -0.46 2.88 -0.13 4.82 1.02 0.12 -4.17 119.74 123.81 5ttr s LYS 15 Ca 0.06 -0.80 -0.01 0.00 0.02 0.00 0.00 55.97 55.24 5ttr s LYS 15 Cb -0.10 -2.36 -0.02 0.00 -0.52 0.00 0.00 37.83 34.83 5ttr s LYS 15 CO 0.00 -0.05 -0.10 0.08 -0.92 0.00 0.00 175.35 174.36 5ttr s VAL 16 N 0.90 3.32 0.13 3.17 1.01 -0.58 -1.31 120.40 127.05 5ttr s VAL 16 Ca -0.05 -0.57 0.10 0.00 0.00 0.00 0.00 61.98 61.46 5ttr s VAL 16 Cb -0.15 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 5ttr s VAL 16 CO -0.03 0.52 -0.21 -0.76 0.00 0.00 0.00 175.10 174.62 5ttr s LEU 17 N 0.31 2.57 -0.35 3.92 2.01 0.10 -2.36 118.68 124.87 5ttr s LEU 17 Ca -0.08 -0.65 -0.12 0.00 0.01 0.00 0.00 54.13 53.29 5ttr s LEU 17 Cb -0.15 -1.41 0.00 0.00 0.01 0.00 0.00 46.19 44.64 5ttr s LEU 17 CO 0.05 0.17 0.22 -0.62 1.01 0.00 0.00 176.35 177.17 5ttr s ASP 18 N -2.21 5.84 0.29 2.29 -1.08 -0.10 -0.75 116.67 120.94 5ttr s ASP 18 Ca 0.17 -0.66 0.25 0.00 -0.52 0.00 0.00 52.55 51.79 5ttr s ASP 18 Cb -0.10 -2.07 0.55 0.00 -1.46 0.00 0.00 42.92 39.84 5ttr s ASP 18 CO 0.09 -0.29 1.64 0.00 0.52 0.00 0.00 175.17 177.13 5ttr h ALA 19 N 8.46 0.94 0.18 3.66 0.00 -1.35 -2.27 119.26 128.89 5ttr h ALA 19 Ca -0.30 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.30 5ttr h ALA 19 Cb 1.14 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.94 5ttr h ALA 19 CO 0.65 0.00 -1.52 0.28 0.00 0.00 0.00 179.25 178.66 5ttr h VAL 20 N 0.00 1.09 -0.02 0.00 2.07 -1.93 -3.38 116.25 114.07 5ttr h VAL 20 Ca 0.00 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 64.99 5ttr h VAL 20 Cb 0.85 2.86 0.00 0.00 -1.52 0.00 0.00 31.29 33.48 5ttr h VAL 20 CO 0.00 0.80 -0.14 0.54 0.02 0.00 0.00 177.57 178.79 5ttr n ARG 21 N -3.75 1.85 -3.30 1.57 5.12 -1.25 -4.99 116.66 111.91 5ttr n ARG 21 Ca -0.22 -1.55 -0.17 0.00 -1.93 0.00 0.00 57.85 53.97 5ttr n ARG 21 Cb 1.02 -1.43 0.07 0.00 -1.16 0.00 0.00 32.46 30.96 5ttr n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 5ttr n GLY 22 N 1.29 -0.23 3.57 -0.13 0.00 -0.86 -5.02 105.19 103.80 5ttr n GLY 22 Ca 0.12 0.04 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 5ttr n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 5ttr s SER 23 N -3.53 -0.08 0.51 1.61 1.04 -1.17 -5.01 113.70 107.07 5ttr s SER 23 Ca 0.31 -0.95 -0.22 0.00 0.48 0.00 0.00 55.95 55.57 5ttr s SER 23 Cb -0.14 0.57 -0.06 0.00 0.10 0.00 0.00 66.02 66.50 5ttr s SER 23 CO 0.58 -1.12 1.31 -2.84 0.98 0.00 0.00 173.24 172.15 5ttr s PRO 24 N -4.03 3.37 -0.54 4.02 0.02 -1.26 -0.93 135.00 135.65 5ttr s PRO 24 Ca 0.23 2.12 -0.24 0.00 0.02 0.00 0.00 61.00 63.13 5ttr s PRO 24 Cb -0.00 -2.34 0.04 0.00 0.02 0.00 0.00 34.50 32.22 5ttr s PRO 24 CO 0.09 -0.97 0.95 0.00 -0.33 0.00 0.00 177.00 176.74 5ttr s ALA 25 N -1.36 3.16 0.07 -1.55 0.00 -1.00 -4.68 121.76 116.40 5ttr s ALA 25 Ca 0.68 -1.17 -0.27 0.00 0.00 0.00 0.00 51.96 51.20 5ttr s ALA 25 Cb -0.37 -3.74 -0.06 0.00 0.00 0.00 0.00 23.12 18.95 5ttr s ALA 25 CO 0.45 -2.37 0.84 0.42 0.00 0.00 0.00 175.76 175.10 5ttr s ILE 26 N 3.98 4.64 -1.53 0.00 1.09 -1.26 -4.17 121.20 123.95 5ttr s ILE 26 Ca 0.32 1.80 -0.05 0.00 -1.10 0.00 0.00 60.65 61.61 5ttr s ILE 26 Cb -0.12 -4.19 0.01 0.00 -1.06 0.00 0.00 42.46 37.09 5ttr s ILE 26 CO 0.20 0.35 0.71 0.59 -0.10 0.00 0.00 174.94 176.69 5ttr n ASN 27 N 2.79 -6.17 -4.72 3.58 4.13 -0.94 -4.95 115.26 108.98 5ttr n ASN 27 Ca -0.01 -0.33 -0.40 0.00 1.68 0.00 0.00 54.58 55.52 5ttr n ASN 27 Cb 0.50 -4.96 -0.05 0.00 -1.54 0.00 0.00 39.78 33.73 5ttr n ASN 27 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 5ttr s VAL 28 N -3.21 5.01 -0.12 2.41 1.01 -1.26 -4.72 120.40 119.53 5ttr s VAL 28 Ca 0.35 1.42 -0.26 0.00 0.00 0.00 0.00 61.98 63.49 5ttr s VAL 28 Cb -0.16 -4.03 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 5ttr s VAL 28 CO 0.44 0.28 0.86 0.00 0.00 0.00 0.00 175.10 176.68 5ttr s ALA 29 N 0.62 3.42 -0.17 5.51 0.00 -1.26 -0.85 121.76 129.02 5ttr s ALA 29 Ca 0.36 0.18 0.01 0.00 0.00 0.00 0.00 51.96 52.51 5ttr s ALA 29 Cb -0.18 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.72 5ttr s ALA 29 CO 0.18 -0.49 -0.18 0.08 0.00 0.00 0.00 175.76 175.36 5ttr s VAL 30 N 1.72 2.33 -0.15 0.00 1.01 0.75 -1.10 120.40 124.98 5ttr s VAL 30 Ca 0.42 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.54 5ttr s VAL 30 Cb -0.18 -1.98 -0.00 0.00 0.00 0.00 0.00 36.38 34.22 5ttr s VAL 30 CO 0.16 0.52 -0.16 -1.00 0.00 0.00 0.00 175.10 174.63 5ttr s HIS 31 N 1.12 2.76 -0.16 5.22 3.76 -0.93 -0.13 115.29 126.92 5ttr s HIS 31 Ca 0.00 -1.01 -0.05 0.00 -0.15 0.00 0.00 55.06 53.85 5ttr s HIS 31 Cb -0.14 -1.86 -0.03 0.00 1.11 0.00 0.00 32.58 31.65 5ttr s HIS 31 CO -0.07 -0.44 0.02 0.08 -0.85 0.00 0.00 174.74 173.48 5ttr s VAL 32 N 0.71 4.39 0.34 -0.90 1.01 0.28 -0.50 120.40 125.73 5ttr s VAL 32 Ca -0.07 -0.18 0.08 0.00 0.00 0.00 0.00 61.98 61.81 5ttr s VAL 32 Cb -0.16 -2.95 -0.07 0.00 0.00 0.00 0.00 36.38 33.21 5ttr s VAL 32 CO 0.01 0.49 -0.06 -0.36 0.00 0.00 0.00 175.10 175.18 5ttr s PHE 33 N 0.24 2.28 -0.06 5.22 0.40 -0.79 -0.33 117.98 124.94 5ttr s PHE 33 Ca 0.01 -0.60 0.01 0.00 -0.60 0.00 0.00 56.93 55.75 5ttr s PHE 33 Cb -0.13 -1.36 0.02 0.00 0.51 0.00 0.00 43.02 42.05 5ttr s PHE 33 CO 0.01 0.45 -0.08 0.50 0.70 0.00 0.00 175.22 176.81 5ttr s ARG 34 N -3.67 1.26 -0.16 0.44 3.52 0.25 -2.32 118.95 118.27 5ttr s ARG 34 Ca 0.32 -0.24 -0.29 0.00 -0.13 0.00 0.00 55.73 55.39 5ttr s ARG 34 Cb 0.04 -1.15 -0.05 0.00 -1.56 0.00 0.00 34.95 32.24 5ttr s ARG 34 CO 0.15 -0.05 1.85 0.21 -0.81 0.00 0.00 175.30 176.65 5ttr s LYS 35 N 0.90 3.71 0.37 5.12 2.20 0.42 -0.07 119.74 132.39 5ttr s LYS 35 Ca -0.11 1.99 -0.09 0.00 -0.36 0.00 0.00 55.97 57.40 5ttr s LYS 35 Cb -0.15 -4.15 -0.06 0.00 -1.51 0.00 0.00 37.83 31.96 5ttr s LYS 35 CO 0.01 -1.42 0.71 0.00 -0.36 0.00 0.00 175.35 174.30 5ttr s ALA 36 N 5.80 3.41 0.05 3.13 0.00 0.40 -4.63 121.76 129.92 5ttr s ALA 36 Ca 0.83 -0.28 -0.10 0.00 0.00 0.00 0.00 51.96 52.41 5ttr s ALA 36 Cb -0.31 -2.61 -0.02 0.00 0.00 0.00 0.00 23.12 20.18 5ttr s ALA 36 CO 0.34 0.07 0.59 0.00 0.00 0.00 0.00 175.76 176.76 5ttr n ALA 37 N -1.16 -0.21 -0.20 0.00 0.00 -1.26 -0.46 120.51 117.22 5ttr n ALA 37 Ca 0.01 0.28 -0.01 0.00 0.00 0.00 0.00 53.44 53.72 5ttr n ALA 37 Cb 0.54 -0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.96 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 -4.10 1.52 -1.43 0.00 5.68 -1.26 -4.67 116.55 112.29 5ttr n ASP 38 Ca 0.01 -1.55 -0.02 0.00 -0.50 0.00 0.00 54.79 52.73 5ttr n ASP 38 Cb 0.09 -0.35 -0.01 0.00 -1.14 0.00 0.00 41.12 39.70 5ttr n ASP 38 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 5ttr n ASP 39 N 2.24 -0.85 -4.91 -1.12 8.00 0.39 -4.88 116.55 115.42 5ttr n ASP 39 Ca 0.05 0.16 -0.32 0.00 0.71 0.00 0.00 54.79 55.39 5ttr n ASP 39 Cb 0.19 -1.10 -0.04 0.00 -0.02 0.00 0.00 41.12 40.15 5ttr n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 5ttr s THR 40 N -1.43 5.31 -0.30 -3.53 2.01 -1.13 -4.83 115.64 111.74 5ttr s THR 40 Ca 0.00 -0.19 -0.17 0.00 0.31 0.00 0.00 61.69 61.64 5ttr s THR 40 Cb 0.00 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 68.87 5ttr s THR 40 CO 0.00 0.13 0.45 0.26 -0.69 0.00 0.00 174.62 174.77 5ttr s TRP 41 N -1.54 3.23 -0.12 4.92 0.52 -1.26 0.15 118.94 124.84 5ttr s TRP 41 Ca 0.36 0.36 -0.06 0.00 0.02 0.00 0.00 56.10 56.78 5ttr s TRP 41 Cb -0.13 -2.72 -0.04 0.00 -1.15 0.00 0.00 33.47 29.44 5ttr s TRP 41 CO 0.25 -0.35 0.10 -1.21 0.02 0.00 0.00 176.95 175.76 5ttr s GLU 42 N 2.21 3.41 -0.04 4.98 0.41 0.90 -4.81 118.70 125.76 5ttr s GLU 42 Ca 0.17 -0.22 -0.37 0.00 -0.41 0.00 0.00 54.97 54.14 5ttr s GLU 42 Cb -0.16 -3.11 -0.15 0.00 -1.78 0.00 0.00 34.13 28.94 5ttr s GLU 42 CO 0.11 0.69 1.58 -2.30 -0.49 0.00 0.00 175.26 174.85 5ttr n PRO 43 N 2.24 1.44 0.00 0.39 -0.02 -1.26 0.86 135.00 138.65 5ttr n PRO 43 Ca -0.19 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 5ttr n PRO 43 Cb 0.54 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 5ttr n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 5ttr n PHE 44 N 4.13 0.00 -3.54 6.00 -0.00 0.55 -4.76 117.46 119.83 5ttr n PHE 44 Ca 0.21 0.00 -0.08 0.00 -0.00 0.00 0.00 57.45 57.59 5ttr n PHE 44 Cb 0.20 0.00 -0.02 0.00 -0.00 0.00 0.00 39.48 39.66 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 -1.86 -1.80 -0.22 3.13 0.00 -0.72 -4.97 121.76 115.31 5ttr s ALA 45 Ca 0.00 0.88 -0.10 0.00 0.00 0.00 0.00 51.96 52.74 5ttr s ALA 45 Cb 0.00 0.45 0.08 0.00 0.00 0.00 0.00 23.12 23.65 5ttr s ALA 45 CO 0.00 -0.74 0.50 -1.12 0.00 0.00 0.00 175.76 174.39 5ttr s SER 46 N -2.55 -0.60 0.35 0.00 0.01 -1.26 -0.55 113.70 109.09 5ttr s SER 46 Ca 0.06 1.13 -0.07 0.00 1.31 0.00 0.00 55.95 58.39 5ttr s SER 46 Cb -0.01 1.26 0.03 0.00 0.21 0.00 0.00 66.02 67.51 5ttr s SER 46 CO -0.07 -0.22 0.59 0.61 0.41 0.00 0.00 173.24 174.56 5ttr n GLY 47 N 4.76 1.67 2.97 3.44 0.00 0.81 -5.00 105.19 113.84 5ttr n GLY 47 Ca -0.17 -1.45 -0.19 0.00 0.00 0.00 0.00 46.02 44.21 5ttr n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5ttr s LYS 48 N -2.47 0.84 0.81 1.61 0.00 -1.26 -0.18 119.74 119.08 5ttr s LYS 48 Ca 0.22 -0.23 -0.12 0.00 0.00 0.00 0.00 55.97 55.84 5ttr s LYS 48 Cb -0.03 -0.80 0.08 0.00 0.00 0.00 0.00 37.83 37.09 5ttr s LYS 48 CO 0.16 0.06 1.15 0.95 0.00 0.00 0.00 175.35 177.68 5ttr s THR 49 N 0.32 2.47 0.51 3.79 -4.23 -0.03 -4.10 115.64 114.37 5ttr s THR 49 Ca -0.05 0.18 0.03 0.00 -1.18 0.00 0.00 61.69 60.67 5ttr s THR 49 Cb -0.09 -2.51 -0.00 0.00 1.34 0.00 0.00 72.50 71.23 5ttr s THR 49 CO 0.00 -0.17 0.11 -0.94 -0.54 0.00 0.00 174.62 173.09 5ttr s SER 50 N -2.59 4.26 0.07 3.99 1.04 -1.10 -2.20 113.70 117.17 5ttr s SER 50 Ca 0.68 -1.52 -0.00 0.00 0.48 0.00 0.00 55.95 55.59 5ttr s SER 50 Cb -0.24 0.42 0.16 0.00 0.10 0.00 0.00 66.02 66.47 5ttr s SER 50 CO 0.52 -0.89 0.37 -0.62 0.98 0.00 0.00 173.24 173.60 5ttr n GLU 51 N -1.38 -0.02 0.28 4.02 4.71 -1.26 0.15 120.64 127.13 5ttr n GLU 51 Ca -0.13 0.36 0.18 0.00 -0.01 0.00 0.00 57.16 57.56 5ttr n GLU 51 Cb 0.66 -0.56 0.77 0.00 -1.01 0.00 0.00 31.44 31.30 5ttr n GLU 51 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 5ttr h SER 52 N 0.00 0.00 0.00 1.62 0.02 -1.93 -3.42 113.55 109.84 5ttr h SER 52 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 5ttr h SER 52 Cb 0.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.80 5ttr h SER 52 CO -0.23 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.07 5ttr n GLY 53 N -0.18 0.65 3.59 -3.77 0.00 0.39 -4.82 105.19 101.05 5ttr n GLY 53 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 5ttr n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 5ttr s GLU 54 N -0.71 3.01 0.26 1.61 2.02 -1.25 -1.52 118.70 122.11 5ttr s GLU 54 Ca 0.00 -0.51 -0.30 0.00 0.02 0.00 0.00 54.97 54.19 5ttr s GLU 54 Cb 0.00 -2.71 -0.09 0.00 0.10 0.00 0.00 34.13 31.43 5ttr s GLU 54 CO 0.00 0.58 1.06 -1.25 0.02 0.00 0.00 175.26 175.67 5ttr s PRO 55 N -0.57 4.69 0.31 0.39 0.05 -1.26 -2.73 135.00 135.88 5ttr s PRO 55 Ca 0.09 1.72 -0.15 0.00 0.05 0.00 0.00 61.00 62.71 5ttr s PRO 55 Cb -0.12 -3.22 -0.09 0.00 0.05 0.00 0.00 34.50 31.12 5ttr s PRO 55 CO 0.02 0.27 0.72 -1.01 0.05 0.00 0.00 177.00 177.05 5ttr s HIS 56 N -1.04 3.39 -1.14 0.56 0.09 -1.26 -4.60 115.29 111.29 5ttr s HIS 56 Ca 0.44 1.21 -0.30 0.00 -0.00 0.00 0.00 55.06 56.41 5ttr s HIS 56 Cb -0.30 -2.52 0.04 0.00 -0.00 0.00 0.00 32.58 29.80 5ttr s HIS 56 CO 0.38 0.12 0.66 0.41 -0.00 0.00 0.00 174.74 176.31 5ttr n GLY 57 N -0.28 -0.89 0.09 -2.22 0.00 -1.26 -4.95 105.19 95.68 5ttr n GLY 57 Ca 0.03 0.37 -0.13 0.00 0.00 0.00 0.00 46.02 46.29 5ttr n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 5ttr h LEU 58 N -2.23 -0.12 -8.41 0.99 3.38 -1.82 -3.46 115.31 103.65 5ttr h LEU 58 Ca -0.70 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.13 5ttr h LEU 58 Cb 1.38 0.03 -0.11 0.00 0.09 0.00 0.00 40.66 42.06 5ttr h LEU 58 CO 0.49 -0.08 -0.31 0.42 0.09 0.00 0.00 178.44 179.04 5ttr s THR 59 N -6.17 0.00 0.19 0.22 -4.23 -1.26 -4.72 115.64 99.67 5ttr s THR 59 Ca -0.14 -1.65 0.09 0.00 -1.18 0.00 0.00 61.69 58.81 5ttr s THR 59 Cb 0.06 -2.36 -0.04 0.00 1.34 0.00 0.00 72.50 71.50 5ttr s THR 59 CO 0.66 0.00 -0.06 -0.89 -0.54 0.00 0.00 174.62 173.78 5ttr s THR 60 N -3.96 3.33 0.58 3.99 2.01 -1.26 -4.54 115.64 115.79 5ttr s THR 60 Ca 0.30 -1.66 0.43 0.00 0.31 0.00 0.00 61.69 61.07 5ttr s THR 60 Cb 0.02 -2.67 0.43 0.00 0.01 0.00 0.00 72.50 70.29 5ttr s THR 60 CO 0.12 -0.15 2.31 -0.33 -0.69 0.00 0.00 174.62 175.88 5ttr h GLU 61 N 2.71 0.00 0.00 4.92 4.39 -1.98 -1.49 114.58 123.13 5ttr h GLU 61 Ca -0.46 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.20 5ttr h GLU 61 Cb 1.21 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 5ttr h GLU 61 CO 0.56 0.00 -1.15 -0.85 -1.16 0.00 0.00 179.01 176.41 5ttr n GLU 62 N -3.03 0.61 -0.01 2.33 0.00 -1.26 -3.83 120.64 115.46 5ttr n GLU 62 Ca -0.03 0.12 0.11 0.00 0.00 0.00 0.00 57.16 57.36 5ttr n GLU 62 Cb 0.08 -1.80 -0.15 0.00 0.00 0.00 0.00 31.44 29.57 5ttr n GLU 62 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 5ttr n GLU 63 N -2.69 0.46 -2.39 3.44 1.02 -0.82 -4.69 120.64 114.96 5ttr n GLU 63 Ca -0.02 -0.13 -0.42 0.00 -0.02 0.00 0.00 57.16 56.56 5ttr n GLU 63 Cb 0.61 -1.52 -0.00 0.00 -0.02 0.00 0.00 31.44 30.51 5ttr n GLU 63 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 5ttr n PHE 64 N -2.04 4.35 -2.40 -0.32 7.35 -0.62 -4.93 117.46 118.86 5ttr n PHE 64 Ca -0.02 -2.78 -0.26 0.00 -0.76 0.00 0.00 57.45 53.63 5ttr n PHE 64 Cb 0.50 -2.61 0.15 0.00 0.35 0.00 0.00 39.48 37.86 5ttr n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 5ttr s VAL 65 N 4.40 2.01 0.67 -2.13 -7.23 -1.26 -4.95 120.40 111.91 5ttr s VAL 65 Ca 0.54 -0.41 -0.16 0.00 -1.81 0.00 0.00 61.98 60.13 5ttr s VAL 65 Cb 0.06 -2.60 0.01 0.00 0.56 0.00 0.00 36.38 34.41 5ttr s VAL 65 CO 0.05 0.00 1.15 -1.83 -0.31 0.00 0.00 175.10 174.17 5ttr s GLU 66 N -5.44 2.61 0.00 4.82 -1.05 -1.26 -4.80 118.70 113.58 5ttr s GLU 66 Ca 0.71 1.58 0.00 0.00 -0.15 0.00 0.00 54.97 57.11 5ttr s GLU 66 Cb -0.03 -1.91 0.00 0.00 -0.44 0.00 0.00 34.13 31.75 5ttr s GLU 66 CO 0.48 -1.43 0.00 0.41 0.95 0.00 0.00 175.26 175.67 5ttr n GLY 67 N -0.05 -2.27 3.28 -3.83 0.00 -1.02 -4.96 105.19 96.34 5ttr n GLY 67 Ca 0.12 -1.32 -0.36 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.30 3.40 0.09 -0.61 1.01 -1.26 0.86 121.20 122.39 5ttr s ILE 68 Ca 0.00 -0.79 0.05 0.00 0.00 0.00 0.00 60.65 59.91 5ttr s ILE 68 Cb 0.00 -2.70 -0.04 0.00 0.01 0.00 0.00 42.46 39.73 5ttr s ILE 68 CO 0.00 0.20 -0.00 -0.31 0.00 0.00 0.00 174.94 174.82 5ttr s TYR 69 N 1.42 2.99 -0.18 3.97 1.51 -0.30 -0.44 117.35 126.33 5ttr s TYR 69 Ca 0.02 -0.02 0.01 0.00 -1.01 0.00 0.00 57.07 56.07 5ttr s TYR 69 Cb -0.16 -1.54 0.02 0.00 -0.11 0.00 0.00 41.96 40.16 5ttr s TYR 69 CO -0.01 0.48 -0.19 0.21 -1.11 0.00 0.00 175.55 174.92 5ttr s LYS 70 N -2.26 3.01 -0.24 -0.62 2.20 -0.98 -0.72 119.74 120.13 5ttr s LYS 70 Ca 0.25 -0.82 -0.06 0.00 -0.36 0.00 0.00 55.97 54.98 5ttr s LYS 70 Cb -0.12 -2.58 -0.02 0.00 -1.51 0.00 0.00 37.83 33.60 5ttr s LYS 70 CO 0.18 -0.19 0.03 0.08 -0.36 0.00 0.00 175.35 175.08 5ttr s VAL 71 N 1.26 3.99 -0.17 4.02 1.01 0.66 -1.88 120.40 129.30 5ttr s VAL 71 Ca 0.04 -0.28 -0.00 0.00 0.00 0.00 0.00 61.98 61.73 5ttr s VAL 71 Cb -0.13 -2.85 -0.00 0.00 0.00 0.00 0.00 36.38 33.40 5ttr s VAL 71 CO -0.12 0.37 -0.14 -0.70 0.00 0.00 0.00 175.10 174.52 5ttr s GLU 72 N 1.52 3.22 -0.18 2.72 2.12 0.34 0.11 118.70 128.55 5ttr s GLU 72 Ca 0.06 -0.74 -0.07 0.00 0.36 0.00 0.00 54.97 54.58 5ttr s GLU 72 Cb -0.15 -2.68 -0.04 0.00 0.26 0.00 0.00 34.13 31.52 5ttr s GLU 72 CO 0.01 -0.05 0.05 0.42 -0.54 0.00 0.00 175.26 175.16 5ttr s ILE 73 N 0.98 4.71 -0.87 -3.70 1.01 0.22 -2.18 121.20 121.36 5ttr s ILE 73 Ca -0.02 -0.06 -0.18 0.00 0.00 0.00 0.00 60.65 60.39 5ttr s ILE 73 Cb -0.15 -3.11 0.15 0.00 0.01 0.00 0.00 42.46 39.36 5ttr s ILE 73 CO -0.02 0.47 1.00 -0.62 0.00 0.00 0.00 174.94 175.77 5ttr s ASP 74 N 0.33 6.62 -0.07 3.58 2.15 -0.26 -1.43 116.67 127.59 5ttr s ASP 74 Ca 0.03 -2.13 -0.24 0.00 0.43 0.00 0.00 52.55 50.63 5ttr s ASP 74 Cb -0.12 -2.35 -0.28 0.00 -0.30 0.00 0.00 42.92 39.87 5ttr s ASP 74 CO 0.00 -0.96 0.90 0.71 -0.17 0.00 0.00 175.17 175.66 5ttr h THR 75 N 5.58 1.59 -0.55 1.71 1.35 -1.88 -3.30 112.91 117.40 5ttr h THR 75 Ca 0.10 -2.33 0.11 0.00 -0.55 0.00 0.00 66.41 63.74 5ttr h THR 75 Cb 1.03 3.12 -0.11 0.00 -1.73 0.00 0.00 68.15 70.47 5ttr h THR 75 CO 1.02 0.64 -0.21 0.50 -0.25 0.00 0.00 175.52 177.22 5ttr h LYS 76 N -0.55 -0.07 -0.27 4.72 3.64 -1.72 -0.43 116.57 121.89 5ttr h LYS 76 Ca -0.08 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.22 5ttr h LYS 76 Cb 1.31 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.13 5ttr h LYS 76 CO 0.09 -0.05 -0.21 0.77 -2.27 0.00 0.00 179.45 177.78 5ttr h SER 77 N -0.08 0.49 -0.30 4.20 0.02 -1.86 0.59 113.55 116.62 5ttr h SER 77 Ca 0.26 -0.15 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 5ttr h SER 77 Cb 0.48 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 5ttr h SER 77 CO -0.61 0.71 -0.04 0.22 -1.14 0.00 0.00 176.83 175.97 5ttr h TYR 78 N 0.45 0.61 0.00 3.45 3.20 -1.17 -2.78 116.97 120.74 5ttr h TYR 78 Ca 0.07 -0.12 -0.10 0.00 3.14 0.00 0.00 58.73 61.72 5ttr h TYR 78 Cb 0.61 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 5ttr h TYR 78 CO 0.02 0.72 -0.50 -1.49 -1.64 0.00 0.00 178.16 175.28 5ttr h TRP 79 N 0.33 0.00 -0.21 -3.82 4.06 -1.40 -3.29 115.95 111.62 5ttr h TRP 79 Ca 0.08 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.91 5ttr h TRP 79 Cb 0.51 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.66 5ttr h TRP 79 CO 0.05 0.48 -0.39 -0.22 -3.56 0.00 0.00 178.44 174.80 5ttr h LYS 80 N 0.00 0.48 0.00 0.49 3.11 -0.77 -1.64 116.57 118.25 5ttr h LYS 80 Ca -0.01 -0.23 0.00 0.00 -2.81 0.00 0.00 60.65 57.60 5ttr h LYS 80 Cb 1.37 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.60 5ttr h LYS 80 CO 0.06 0.79 0.00 0.00 -2.81 0.00 0.00 179.45 177.50 5ttr n ALA 81 N -2.49 1.44 0.46 5.00 0.00 -1.06 -0.28 120.51 123.58 5ttr n ALA 81 Ca -0.01 0.02 0.10 0.00 0.00 0.00 0.00 53.44 53.54 5ttr n ALA 81 Cb 0.49 -1.23 0.14 0.00 0.00 0.00 0.00 19.45 18.85 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 -1.76 2.92 0.00 0.00 4.32 -1.01 -4.95 117.00 116.52 5ttr n LEU 82 Ca 0.02 -1.31 0.00 0.00 -0.02 0.00 0.00 56.01 54.70 5ttr n LEU 82 Cb 0.13 -0.12 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 5ttr n LEU 82 CO 0.11 0.59 0.00 0.61 -1.22 0.00 0.00 177.39 177.49 5ttr n GLY 83 N 1.14 0.25 3.86 -0.72 0.00 0.62 -5.05 105.19 105.29 5ttr n GLY 83 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.08 5.05 -0.44 -0.61 1.01 -0.65 -4.97 121.20 118.51 5ttr s ILE 84 Ca 0.00 0.54 -0.13 0.00 0.00 0.00 0.00 60.65 61.06 5ttr s ILE 84 Cb 0.00 -3.66 0.07 0.00 0.01 0.00 0.00 42.46 38.88 5ttr s ILE 84 CO 0.00 0.31 0.33 -0.55 0.00 0.00 0.00 174.94 175.02 5ttr s SER 85 N -1.70 5.92 0.74 3.58 0.15 -1.26 -2.98 113.70 118.15 5ttr s SER 85 Ca 0.33 -1.36 -0.11 0.00 0.70 0.00 0.00 55.95 55.51 5ttr s SER 85 Cb -0.14 -2.09 0.05 0.00 -1.71 0.00 0.00 66.02 62.12 5ttr s SER 85 CO 0.18 -0.58 1.10 -2.16 1.20 0.00 0.00 173.24 172.98 5ttr s PRO 86 N 1.55 2.42 -0.17 5.44 0.04 -1.26 -5.01 135.00 138.01 5ttr s PRO 86 Ca 0.03 0.18 -0.20 0.00 0.04 0.00 0.00 61.00 61.06 5ttr s PRO 86 Cb -0.23 -2.04 -0.17 0.00 0.04 0.00 0.00 34.50 32.10 5ttr s PRO 86 CO 0.05 -1.26 0.30 0.35 0.04 0.00 0.00 177.00 176.48 5ttr h PHE 87 N -0.76 0.00 -3.72 0.56 3.57 -1.86 -3.47 116.94 111.26 5ttr h PHE 87 Ca -0.45 0.00 -0.49 0.00 3.53 0.00 0.00 57.97 60.55 5ttr h PHE 87 Cb 1.29 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.01 5ttr h PHE 87 CO 0.40 0.98 0.13 -1.01 -2.23 0.00 0.00 178.31 176.58 5ttr s HIS 88 N -2.22 3.44 0.08 0.41 3.76 -1.26 -4.96 115.29 114.54 5ttr s HIS 88 Ca -0.21 1.31 -0.14 0.00 -0.15 0.00 0.00 55.06 55.86 5ttr s HIS 88 Cb 0.02 -2.59 -0.17 0.00 1.11 0.00 0.00 32.58 30.95 5ttr s HIS 88 CO 0.51 0.14 1.27 0.93 -0.85 0.00 0.00 174.74 176.74 5ttr h GLU 89 N 2.54 0.71 0.00 1.40 4.39 -1.99 -3.36 114.58 118.27 5ttr h GLU 89 Ca -0.48 -0.58 0.04 0.00 0.34 0.00 0.00 59.36 58.68 5ttr h GLU 89 Cb 1.18 0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.95 5ttr h GLU 89 CO 0.65 1.19 0.34 -2.39 -1.16 0.00 0.00 179.01 177.65 5ttr n HIS 90 N -4.03 -1.81 -4.94 4.33 1.44 -1.26 -3.58 115.22 105.37 5ttr n HIS 90 Ca -0.08 -1.39 -0.29 0.00 -2.01 0.00 0.00 57.72 53.95 5ttr n HIS 90 Cb 0.70 0.69 -0.15 0.00 0.12 0.00 0.00 29.99 31.36 5ttr n HIS 90 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 5ttr s ALA 91 N -1.91 2.00 0.02 1.59 0.00 -0.51 -4.91 121.76 118.04 5ttr s ALA 91 Ca 0.16 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 51.01 5ttr s ALA 91 Cb -0.04 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.62 5ttr s ALA 91 CO 0.08 0.48 -0.03 -2.00 0.00 0.00 0.00 175.76 174.28 5ttr s GLU 92 N -0.95 0.29 -0.11 0.00 2.12 -1.26 0.72 118.70 119.51 5ttr s GLU 92 Ca 0.10 -0.46 0.01 0.00 0.36 0.00 0.00 54.97 54.97 5ttr s GLU 92 Cb -0.09 -0.05 0.02 0.00 0.26 0.00 0.00 34.13 34.27 5ttr s GLU 92 CO 0.01 -0.00 -0.11 0.08 -0.54 0.00 0.00 175.26 174.69 5ttr s VAL 93 N -0.98 1.24 -0.18 3.70 1.01 0.12 -4.93 120.40 120.38 5ttr s VAL 93 Ca -0.09 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 5ttr s VAL 93 Cb -0.07 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 5ttr s VAL 93 CO -0.00 0.40 -0.05 -0.69 0.00 0.00 0.00 175.10 174.76 5ttr s VAL 94 N 1.35 3.62 0.08 2.92 1.01 -1.26 -0.24 120.40 127.87 5ttr s VAL 94 Ca -0.01 -0.44 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 5ttr s VAL 94 Cb -0.14 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.63 5ttr s VAL 94 CO -0.05 0.46 0.12 0.72 0.00 0.00 0.00 175.10 176.35 5ttr s PHE 95 N 0.81 0.28 -0.18 5.22 -0.71 0.10 -5.00 117.98 118.50 5ttr s PHE 95 Ca -0.01 -0.75 -0.17 0.00 -1.04 0.00 0.00 56.93 54.96 5ttr s PHE 95 Cb -0.15 -0.17 -0.04 0.00 -1.21 0.00 0.00 43.02 41.46 5ttr s PHE 95 CO 0.02 -0.49 0.44 0.99 -1.34 0.00 0.00 175.22 174.83 5ttr s THR 96 N -3.88 5.18 0.19 -4.49 2.01 -1.26 -1.15 115.64 112.23 5ttr s THR 96 Ca 0.06 0.81 0.10 0.00 0.31 0.00 0.00 61.69 62.98 5ttr s THR 96 Cb 0.06 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 5ttr s THR 96 CO -0.10 0.26 -0.17 0.00 -0.69 0.00 0.00 174.62 173.91 5ttr s ALA 97 N 1.19 2.73 -0.23 7.40 0.00 0.25 -4.71 121.76 128.39 5ttr s ALA 97 Ca 0.22 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.62 5ttr s ALA 97 Cb -0.15 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.45 5ttr s ALA 97 CO 0.09 0.45 0.00 0.09 0.00 0.00 0.00 175.76 176.39 5ttr n ASN 98 N 0.17 -4.87 0.01 0.00 3.02 -1.26 -2.45 115.26 109.88 5ttr n ASN 98 Ca -0.12 0.05 -0.10 0.00 -0.03 0.00 0.00 54.58 54.39 5ttr n ASN 98 Cb 0.56 -3.10 -0.03 0.00 -0.61 0.00 0.00 39.78 36.59 5ttr n ASN 98 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 5ttr h ASP 99 N 0.00 -0.40 -0.28 6.41 3.04 -1.90 -2.48 116.42 120.81 5ttr h ASP 99 Ca -0.04 0.08 0.00 0.00 -3.24 0.00 0.00 57.03 53.82 5ttr h ASP 99 Cb 0.86 0.19 0.00 0.00 -1.04 0.00 0.00 39.33 39.34 5ttr h ASP 99 CO 0.06 -0.17 0.00 -1.20 -2.04 0.00 0.00 179.24 175.89 5ttr n SER 100 N -5.27 1.95 0.00 4.15 7.64 -1.26 -4.98 113.62 115.85 5ttr n SER 100 Ca -0.03 -2.10 0.00 0.00 1.01 0.00 0.00 58.87 57.74 5ttr n SER 100 Cb 0.19 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 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 0.77 3.12 3.67 0.23 0.00 -0.93 -5.05 105.19 106.99 5ttr n GLY 101 Ca 0.10 -2.00 -0.46 0.00 0.00 0.00 0.00 46.02 43.66 5ttr n GLY 101 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 5ttr n PRO 102 N -1.06 2.22 -4.32 1.61 -0.02 -1.26 -4.36 135.00 127.80 5ttr n PRO 102 Ca 0.00 0.81 -0.17 0.00 -2.02 0.00 0.00 63.50 62.12 5ttr n PRO 102 Cb 0.00 -2.61 -0.10 0.00 -0.02 0.00 0.00 33.50 30.77 5ttr n PRO 102 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 5ttr s ARG 103 N 2.02 1.39 -0.18 -0.52 6.06 -1.26 -4.39 118.95 122.07 5ttr s ARG 103 Ca 0.83 -1.74 -0.03 0.00 -2.50 0.00 0.00 55.73 52.28 5ttr s ARG 103 Cb -0.66 -0.34 -0.02 0.00 0.06 0.00 0.00 34.95 33.99 5ttr s ARG 103 CO 0.42 -0.25 -0.05 1.03 -2.50 0.00 0.00 175.30 173.95 5ttr s ARG 104 N -4.00 3.52 -0.18 5.12 0.52 0.17 -4.85 118.95 119.26 5ttr s ARG 104 Ca 0.36 -0.58 -0.08 0.00 -0.52 0.00 0.00 55.73 54.90 5ttr s ARG 104 Cb 0.08 -2.93 -0.04 0.00 0.52 0.00 0.00 34.95 32.57 5ttr s ARG 104 CO 0.12 0.06 0.10 0.71 0.02 0.00 0.00 175.30 176.31 5ttr s TYR 105 N 0.83 3.37 -0.19 -0.53 2.02 0.04 -1.37 117.35 121.52 5ttr s TYR 105 Ca -0.01 0.26 -0.01 0.00 -0.37 0.00 0.00 57.07 56.93 5ttr s TYR 105 Cb -0.15 -2.09 0.00 0.00 -0.40 0.00 0.00 41.96 39.32 5ttr s TYR 105 CO 0.02 0.30 -0.13 0.99 -1.57 0.00 0.00 175.55 175.15 5ttr s THR 106 N 0.16 2.69 -0.22 -0.71 2.01 -0.40 -1.72 115.64 117.44 5ttr s THR 106 Ca 0.07 -0.74 -0.07 0.00 0.31 0.00 0.00 61.69 61.27 5ttr s THR 106 Cb -0.12 -2.17 -0.03 0.00 0.01 0.00 0.00 72.50 70.19 5ttr s THR 106 CO -0.00 0.49 0.05 -0.63 -0.69 0.00 0.00 174.62 173.84 5ttr s ILE 107 N 1.21 4.27 -0.24 1.82 1.09 0.06 -2.20 121.20 127.22 5ttr s ILE 107 Ca 0.02 -0.19 -0.07 0.00 -1.10 0.00 0.00 60.65 59.31 5ttr s ILE 107 Cb -0.14 -2.97 -0.03 0.00 -1.06 0.00 0.00 42.46 38.26 5ttr s ILE 107 CO -0.06 0.38 0.06 0.00 -0.10 0.00 0.00 174.94 175.23 5ttr s ALA 108 N 1.25 3.17 -0.06 9.38 0.00 -0.89 0.11 121.76 134.72 5ttr s ALA 108 Ca 0.04 -1.08 0.04 0.00 0.00 0.00 0.00 51.96 50.96 5ttr s ALA 108 Cb -0.15 -2.04 -0.02 0.00 0.00 0.00 0.00 23.12 20.91 5ttr s ALA 108 CO 0.03 -0.40 -0.16 0.00 0.00 0.00 0.00 175.76 175.23 5ttr s ALA 109 N 1.45 2.57 -0.17 0.00 0.00 -0.43 -2.19 121.76 122.98 5ttr s ALA 109 Ca 0.05 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.04 5ttr s ALA 109 Cb -0.15 -0.94 0.03 0.00 0.00 0.00 0.00 23.12 22.06 5ttr s ALA 109 CO 0.03 0.50 -0.14 -0.48 0.00 0.00 0.00 175.76 175.67 5ttr s LEU 110 N -0.52 1.94 0.04 0.00 0.05 -0.64 -0.72 118.68 118.82 5ttr s LEU 110 Ca 0.07 -0.64 -0.08 0.00 0.05 0.00 0.00 54.13 53.54 5ttr s LEU 110 Cb -0.12 -1.24 -0.05 0.00 -2.05 0.00 0.00 46.19 42.74 5ttr s LEU 110 CO 0.01 -0.08 0.33 -0.76 -0.55 0.00 0.00 176.35 175.30 5ttr s LEU 111 N 1.43 4.36 -0.14 1.48 1.43 0.07 -2.69 118.68 124.62 5ttr s LEU 111 Ca 0.03 0.65 -0.29 0.00 -1.03 0.00 0.00 54.13 53.50 5ttr s LEU 111 Cb -0.14 -2.83 0.07 0.00 0.03 0.00 0.00 46.19 43.33 5ttr s LEU 111 CO -0.10 0.21 0.70 -0.44 0.23 0.00 0.00 176.35 176.95 5ttr s SER 112 N -1.76 -0.69 0.39 2.29 0.01 -0.64 -0.97 113.70 112.32 5ttr s SER 112 Ca 0.30 1.02 0.19 0.00 1.31 0.00 0.00 55.95 58.77 5ttr s SER 112 Cb -0.13 0.92 1.13 0.00 0.21 0.00 0.00 66.02 68.15 5ttr s SER 112 CO 0.17 -0.46 1.73 -0.65 0.41 0.00 0.00 173.24 174.45 5ttr h PRO 113 N 3.82 0.35 -0.06 12.44 0.11 -1.99 -2.73 132.00 143.94 5ttr h PRO 113 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 5ttr h PRO 113 Cb 1.15 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.18 5ttr h PRO 113 CO 0.25 0.23 0.00 0.66 -0.21 0.00 0.00 178.00 178.93 5ttr n TYR 114 N -4.70 0.07 -3.91 0.65 4.02 -1.26 -2.45 117.16 109.58 5ttr n TYR 114 Ca 0.28 -0.49 -0.09 0.00 -0.01 0.00 0.00 57.90 57.59 5ttr n TYR 114 Cb 0.96 -0.05 -0.08 0.00 -0.02 0.00 0.00 39.34 40.16 5ttr n TYR 114 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 5ttr s SER 115 N -0.98 0.19 -0.12 7.72 0.01 -1.03 -5.01 113.70 114.48 5ttr s SER 115 Ca 0.04 -0.68 -0.22 0.00 1.31 0.00 0.00 55.95 56.40 5ttr s SER 115 Cb 0.02 0.29 0.05 0.00 0.21 0.00 0.00 66.02 66.60 5ttr s SER 115 CO 0.03 -0.66 0.54 -0.72 0.41 0.00 0.00 173.24 172.84 5ttr s TYR 116 N -3.59 -0.53 0.13 2.43 -0.85 -1.26 -1.62 117.35 112.05 5ttr s TYR 116 Ca 0.03 1.11 0.09 0.00 -0.52 0.00 0.00 57.07 57.78 5ttr s TYR 116 Cb 0.04 0.25 -0.04 0.00 0.38 0.00 0.00 41.96 42.59 5ttr s TYR 116 CO -0.09 -0.42 -0.21 -1.12 -1.52 0.00 0.00 175.55 172.19 5ttr s SER 117 N -0.54 2.74 0.06 -0.18 0.01 -1.10 -4.96 113.70 109.73 5ttr s SER 117 Ca -0.07 -0.76 0.05 0.00 1.31 0.00 0.00 55.95 56.48 5ttr s SER 117 Cb -0.03 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 66.01 5ttr s SER 117 CO 0.04 0.05 -0.14 -0.89 0.41 0.00 0.00 173.24 172.71 5ttr s THR 118 N -1.47 1.11 -0.08 1.44 2.01 -1.26 -1.63 115.64 115.77 5ttr s THR 118 Ca 0.11 -1.19 -0.08 0.00 0.31 0.00 0.00 61.69 60.84 5ttr s THR 118 Cb -0.08 -1.04 0.02 0.00 0.01 0.00 0.00 72.50 71.40 5ttr s THR 118 CO 0.06 -0.14 0.22 -0.89 -0.69 0.00 0.00 174.62 173.17 5ttr s THR 119 N -1.12 0.01 -0.01 -0.82 2.01 -0.93 -4.98 115.64 109.80 5ttr s THR 119 Ca -0.01 -0.06 0.05 0.00 0.31 0.00 0.00 61.69 61.98 5ttr s THR 119 Cb -0.09 -0.33 -0.03 0.00 0.01 0.00 0.00 72.50 72.06 5ttr s THR 119 CO 0.02 -0.03 -0.14 0.00 -0.69 0.00 0.00 174.62 173.77 5ttr s ALA 120 N -0.02 2.70 -0.28 7.40 0.00 -1.26 -2.09 121.76 128.20 5ttr s ALA 120 Ca -0.01 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.90 5ttr s ALA 120 Cb -0.02 -0.91 0.08 0.00 0.00 0.00 0.00 23.12 22.27 5ttr s ALA 120 CO 0.00 0.57 0.00 0.08 0.00 0.00 0.00 175.76 176.42 5ttr s VAL 121 N -0.84 1.69 -0.11 0.00 1.01 -0.93 -4.98 120.40 116.23 5ttr s VAL 121 Ca 0.14 -1.64 -0.05 0.00 0.00 0.00 0.00 61.98 60.42 5ttr s VAL 121 Cb -0.11 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 5ttr s VAL 121 CO 0.03 -0.36 0.10 -0.69 0.00 0.00 0.00 175.10 174.18 5ttr s VAL 122 N 1.26 5.17 0.09 2.92 1.01 -1.26 -1.28 120.40 128.31 5ttr s VAL 122 Ca 0.02 0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.12 5ttr s VAL 122 Cb -0.19 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 5ttr s VAL 122 CO -0.10 0.61 -0.11 -0.89 0.00 0.00 0.00 175.10 174.61 5ttr s THR 123 N -0.99 0.95 -0.35 3.92 2.01 -0.47 -4.95 115.64 115.75 5ttr s THR 123 Ca 0.15 -1.55 -0.18 0.00 0.31 0.00 0.00 61.69 60.41 5ttr s THR 123 Cb -0.12 -1.27 -0.00 0.00 0.01 0.00 0.00 72.50 71.12 5ttr s THR 123 CO 0.04 -0.49 0.50 0.21 -0.69 0.00 0.00 174.62 174.18 5ttr s ASN 124 N -2.28 6.30 0.00 3.53 2.47 -1.26 0.44 114.94 124.14 5ttr s ASN 124 Ca 0.03 -0.09 0.00 0.00 0.42 0.00 0.00 52.86 53.23 5ttr s ASN 124 Cb -0.04 -2.26 0.00 0.00 -1.45 0.00 0.00 41.25 37.49 5ttr s ASN 124 CO 0.00 -0.48 0.18 -0.81 -3.72 0.00 0.00 177.10 172.27