#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5m s SER 2 N 0.00 -0.23 1.02 1.61 0.01 -1.26 -5.16 113.70 109.69 1v5m s SER 2 Ca 0.00 -0.39 -0.14 0.00 1.31 0.00 0.00 55.95 56.73 1v5m s SER 2 Cb 0.00 0.54 0.11 0.00 0.21 0.00 0.00 66.02 66.88 1v5m s SER 2 CO 0.00 -0.98 0.52 -0.24 0.41 0.00 0.00 173.24 172.95 1v5m n SER 3 N -0.44 -1.68 0.00 2.44 2.88 -1.26 -5.03 113.62 110.52 1v5m n SER 3 Ca -0.06 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 1v5m n SER 3 Cb 0.61 -1.20 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 1v5m n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v5m n GLY 4 N 1.35 5.54 3.95 0.46 0.00 -1.26 -5.16 105.19 110.07 1v5m n GLY 4 Ca 0.05 -1.12 -0.23 0.00 0.00 0.00 0.00 46.02 44.73 1v5m n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v5m s SER 5 N 1.00 5.32 -0.20 1.61 0.15 -1.26 -5.05 113.70 115.27 1v5m s SER 5 Ca 0.00 0.22 -0.22 0.00 0.70 0.00 0.00 55.95 56.66 1v5m s SER 5 Cb 0.00 -1.14 -0.19 0.00 -1.71 0.00 0.00 66.02 62.98 1v5m s SER 5 CO 0.00 -1.15 0.22 0.28 1.20 0.00 0.00 173.24 173.80 1v5m h SER 6 N -0.04 0.00 -2.99 5.45 0.02 -2.05 -3.51 113.55 110.43 1v5m h SER 6 Ca -0.44 -0.51 0.00 0.00 -0.84 0.00 0.00 61.79 60.00 1v5m h SER 6 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1v5m h SER 6 CO 0.56 1.46 0.00 0.61 -1.14 0.00 0.00 176.83 178.31 1v5m n GLY 7 N 1.44 2.91 3.69 -3.77 0.00 -1.26 -5.16 105.19 103.04 1v5m n GLY 7 Ca -0.31 -1.67 -0.08 0.00 0.00 0.00 0.00 46.02 43.96 1v5m n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1v5m s ASN 8 N 0.00 -0.36 -0.38 1.61 0.01 -1.26 -5.13 114.94 109.43 1v5m s ASN 8 Ca 0.00 -0.36 -0.03 0.00 -0.71 0.00 0.00 52.86 51.77 1v5m s ASN 8 Cb 0.00 0.65 0.09 0.00 0.41 0.00 0.00 41.25 42.40 1v5m s ASN 8 CO 0.00 -1.14 0.16 -0.76 -1.51 0.00 0.00 177.10 173.84 1v5m s LEU 9 N -2.84 4.93 0.14 0.60 1.43 -1.26 -4.98 118.68 116.70 1v5m s LEU 9 Ca 0.07 -1.83 -0.19 0.00 -1.03 0.00 0.00 54.13 51.15 1v5m s LEU 9 Cb -0.04 -1.81 0.02 0.00 0.03 0.00 0.00 46.19 44.40 1v5m s LEU 9 CO -0.01 -0.47 1.69 0.00 0.23 0.00 0.00 176.35 177.79 1v5m h ALA 10 N 8.04 0.19 -5.83 4.21 0.00 -2.00 -3.46 119.26 120.42 1v5m h ALA 10 Ca -0.15 0.10 -0.39 0.00 0.00 0.00 0.00 54.91 54.47 1v5m h ALA 10 Cb 1.05 0.19 0.14 0.00 0.00 0.00 0.00 17.79 19.18 1v5m h ALA 10 CO 0.66 -0.46 -0.69 0.00 0.00 0.00 0.00 179.25 178.76 1v5m n ALA 11 N -2.49 -1.40 -3.18 0.00 0.00 -1.26 -4.99 120.51 107.18 1v5m n ALA 11 Ca -0.01 0.35 -0.12 0.00 0.00 0.00 0.00 53.44 53.66 1v5m n ALA 11 Cb 0.16 -5.14 -0.04 0.00 0.00 0.00 0.00 19.45 14.43 1v5m n ALA 11 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1v5m s LYS 12 N -6.20 1.08 -0.61 0.00 1.02 -1.26 -5.12 119.74 108.65 1v5m s LYS 12 Ca 0.51 -0.49 -0.02 0.00 0.02 0.00 0.00 55.97 55.99 1v5m s LYS 12 Cb -0.23 0.49 0.16 0.00 -0.52 0.00 0.00 37.83 37.73 1v5m s LYS 12 CO 0.73 -0.42 0.41 0.08 -0.92 0.00 0.00 175.35 175.24 1v5m s VAL 13 N -3.27 3.54 -0.56 3.17 1.01 -1.26 -4.65 120.40 118.38 1v5m s VAL 13 Ca -0.01 -3.02 0.04 0.00 0.00 0.00 0.00 61.98 58.99 1v5m s VAL 13 Cb 0.00 -3.33 0.16 0.00 0.00 0.00 0.00 36.38 33.21 1v5m s VAL 13 CO -0.08 -0.87 0.38 -0.70 0.00 0.00 0.00 175.10 173.83 1v5m s GLU 14 N -0.11 1.79 0.27 2.72 2.12 -1.26 -5.10 118.70 119.12 1v5m s GLU 14 Ca 0.17 -2.70 -0.22 0.00 0.36 0.00 0.00 54.97 52.58 1v5m s GLU 14 Cb -0.21 -2.69 -0.09 0.00 0.26 0.00 0.00 34.13 31.40 1v5m s GLU 14 CO -0.03 -1.27 0.82 -0.51 -0.54 0.00 0.00 175.26 173.74 1v5m s LEU 15 N -0.60 4.33 -0.29 2.70 1.43 -1.26 -5.00 118.68 119.99 1v5m s LEU 15 Ca 0.25 1.60 -0.22 0.00 -1.03 0.00 0.00 54.13 54.73 1v5m s LEU 15 Cb -0.08 -3.80 0.17 0.00 0.03 0.00 0.00 46.19 42.51 1v5m s LEU 15 CO -0.12 -0.02 1.24 0.54 0.23 0.00 0.00 176.35 178.21 1v5m s VAL 16 N -1.58 0.00 0.04 -1.59 0.11 -1.26 -5.07 120.40 111.05 1v5m s VAL 16 Ca 0.47 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.23 1v5m s VAL 16 Cb -0.17 -1.00 -0.17 0.00 -1.53 0.00 0.00 36.38 33.51 1v5m s VAL 16 CO 0.22 0.00 1.37 0.44 -3.33 0.00 0.00 175.10 173.80 1v5m h ASP 17 N 4.15 -0.65 -2.99 3.54 5.19 -1.98 -3.42 116.42 120.26 1v5m h ASP 17 Ca -0.27 -0.03 -0.53 0.00 -0.62 0.00 0.00 57.03 55.57 1v5m h ASP 17 Cb 1.18 0.17 0.02 0.00 0.18 0.00 0.00 39.33 40.88 1v5m h ASP 17 CO 0.17 -0.35 0.74 -0.63 -3.12 0.00 0.00 179.24 176.06 1v5m s ILE 18 N -5.26 3.45 -0.19 0.35 1.01 -1.26 -3.75 121.20 115.54 1v5m s ILE 18 Ca -0.16 1.00 -0.16 0.00 0.00 0.00 0.00 60.65 61.34 1v5m s ILE 18 Cb 0.02 -3.64 -0.11 0.00 0.01 0.00 0.00 42.46 38.74 1v5m s ILE 18 CO 0.54 0.06 -0.03 0.00 0.00 0.00 0.00 174.94 175.51 1v5m n GLN 19 N 4.32 0.52 -3.62 2.79 1.13 -0.88 -5.04 117.38 116.60 1v5m n GLN 19 Ca 0.12 0.51 -0.16 0.00 -1.94 0.00 0.00 57.00 55.53 1v5m n GLN 19 Cb 0.43 -1.68 -0.07 0.00 0.11 0.00 0.00 30.24 29.03 1v5m n GLN 19 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1v5m s ARG 20 N -2.36 0.91 -0.14 -1.09 3.00 -1.26 -5.07 118.95 112.95 1v5m s ARG 20 Ca -0.24 0.02 -0.18 0.00 -1.00 0.00 0.00 55.73 54.33 1v5m s ARG 20 Cb 0.05 0.42 0.04 0.00 0.00 0.00 0.00 34.95 35.47 1v5m s ARG 20 CO 0.42 -0.28 0.47 -2.00 0.00 0.00 0.00 175.30 173.91 1v5m s GLU 21 N -1.43 0.63 0.08 5.12 -6.30 -1.26 -1.89 118.70 113.65 1v5m s GLU 21 Ca -0.11 0.47 -0.26 0.00 -2.50 0.00 0.00 54.97 52.56 1v5m s GLU 21 Cb -0.02 0.30 0.08 0.00 0.00 0.00 0.00 34.13 34.49 1v5m s GLU 21 CO 0.06 -0.11 0.83 0.20 0.02 0.00 0.00 175.26 176.26 1v5m s GLY 22 N -0.18 -0.43 -0.49 -1.50 0.00 -0.68 -5.03 107.32 99.01 1v5m s GLY 22 Ca -0.04 0.63 -0.10 0.00 0.00 0.00 0.00 44.72 45.22 1v5m s GLY 22 CO 0.02 0.20 0.38 0.00 0.00 0.00 0.00 173.10 173.70 1v5m s ALA 23 N -3.34 3.45 0.31 3.20 0.00 -1.26 -0.55 121.76 123.57 1v5m s ALA 23 Ca 0.06 -2.58 0.03 0.00 0.00 0.00 0.00 51.96 49.47 1v5m s ALA 23 Cb -0.01 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 20.17 1v5m s ALA 23 CO -0.07 -1.94 0.14 -0.48 0.00 0.00 0.00 175.76 173.42 1v5m s LEU 24 N 1.32 1.75 0.06 0.00 2.34 -0.68 -4.96 118.68 118.50 1v5m s LEU 24 Ca 0.06 -1.53 -0.13 0.00 0.06 0.00 0.00 54.13 52.59 1v5m s LEU 24 Cb -0.26 0.09 -0.06 0.00 -0.56 0.00 0.00 46.19 45.40 1v5m s LEU 24 CO -0.01 -0.85 0.43 -0.13 -1.06 0.00 0.00 176.35 174.74 1v5m s ARG 25 N -3.84 3.87 0.14 1.48 3.00 -1.24 -1.98 118.95 120.39 1v5m s ARG 25 Ca 0.34 0.34 0.05 0.00 0.00 0.00 0.00 55.73 56.47 1v5m s ARG 25 Cb 0.05 -3.09 -0.04 0.00 0.00 0.00 0.00 34.95 31.87 1v5m s ARG 25 CO 0.16 0.61 -0.12 -0.59 0.00 0.00 0.00 175.30 175.36 1v5m s PHE 26 N -1.27 1.34 0.15 -0.53 -0.71 -1.00 -0.87 117.98 115.10 1v5m s PHE 26 Ca 0.30 -0.65 -0.14 0.00 -1.04 0.00 0.00 56.93 55.40 1v5m s PHE 26 Cb -0.15 -0.68 0.02 0.00 -1.21 0.00 0.00 43.02 40.99 1v5m s PHE 26 CO 0.16 0.13 0.39 0.00 -1.34 0.00 0.00 175.22 174.56 1v5m s MET 27 N -3.23 1.17 -0.11 1.99 0.23 0.08 -2.96 119.30 116.47 1v5m s MET 27 Ca 0.13 -0.91 0.02 0.00 -1.03 0.00 0.00 55.69 53.91 1v5m s MET 27 Cb -0.01 0.45 0.01 0.00 -1.53 0.00 0.00 34.83 33.75 1v5m s MET 27 CO 0.02 -0.46 -0.19 0.08 -2.03 0.00 0.00 175.02 172.44 1v5m s VAL 28 N -3.88 1.76 -0.42 5.16 1.01 -1.26 -0.00 120.40 122.77 1v5m s VAL 28 Ca 0.09 -0.81 -0.27 0.00 0.00 0.00 0.00 61.98 60.98 1v5m s VAL 28 Cb 0.02 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 1v5m s VAL 28 CO -0.06 0.49 2.12 0.00 0.00 0.00 0.00 175.10 177.66 1v5m s ALA 29 N 0.76 2.26 0.02 5.51 0.00 -1.16 -4.87 121.76 124.28 1v5m s ALA 29 Ca -0.10 0.10 -0.29 0.00 0.00 0.00 0.00 51.96 51.67 1v5m s ALA 29 Cb -0.16 -4.21 0.10 0.00 0.00 0.00 0.00 23.12 18.86 1v5m s ALA 29 CO 0.01 -3.58 1.06 0.34 0.00 0.00 0.00 175.76 173.60 1v5m s ASP 30 N 9.15 -0.19 0.42 0.00 -1.08 -1.26 -4.81 116.67 118.91 1v5m s ASP 30 Ca 0.88 -0.17 0.08 0.00 -0.52 0.00 0.00 52.55 52.82 1v5m s ASP 30 Cb -0.21 0.33 0.01 0.00 -1.46 0.00 0.00 42.92 41.59 1v5m s ASP 30 CO 0.29 -0.58 0.57 -1.81 0.52 0.00 0.00 175.17 174.16 1v5m s ASP 31 N -2.72 5.67 0.30 -0.34 1.01 -1.26 -5.13 116.67 114.20 1v5m s ASP 31 Ca 0.10 -0.40 -0.14 0.00 0.71 0.00 0.00 52.55 52.82 1v5m s ASP 31 Cb 0.00 -0.69 0.02 0.00 1.01 0.00 0.00 42.92 43.27 1v5m s ASP 31 CO -0.03 -0.75 0.62 0.00 0.21 0.00 0.00 175.17 175.21 1v5m s ALA 32 N -2.35 -0.46 -0.04 5.23 0.00 -1.26 -5.08 121.76 117.80 1v5m s ALA 32 Ca 0.55 -0.80 -0.06 0.00 0.00 0.00 0.00 51.96 51.64 1v5m s ALA 32 Cb -0.10 0.93 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 1v5m s ALA 32 CO 0.33 -0.93 0.34 0.00 0.00 0.00 0.00 175.76 175.51 1v5m h ALA 33 N 2.10 -0.31 0.00 0.00 0.00 -2.05 -3.41 119.26 115.59 1v5m h ALA 33 Ca -0.26 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 1v5m h ALA 33 Cb 1.25 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 1v5m h ALA 33 CO 0.34 -0.29 -0.58 1.03 0.00 0.00 0.00 179.25 179.75 1v5m h SER 34 N -0.75 0.00 0.00 0.00 0.87 -2.06 -3.51 113.55 108.10 1v5m h SER 34 Ca -0.02 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1v5m h SER 34 Cb 0.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1v5m h SER 34 CO 0.04 1.02 0.00 0.61 -0.53 0.00 0.00 176.83 177.97 1v5m n GLY 35 N 1.58 -1.52 2.77 5.77 0.00 -1.26 -4.98 105.19 107.54 1v5m n GLY 35 Ca -0.15 -1.74 -0.24 0.00 0.00 0.00 0.00 46.02 43.89 1v5m n GLY 35 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v5m n PRO 36 N 0.00 -2.71 0.00 1.61 -0.04 -1.26 -5.08 135.00 127.52 1v5m n PRO 36 Ca 0.00 -1.38 0.00 0.00 -0.04 0.00 0.00 63.50 62.08 1v5m n PRO 36 Cb 0.00 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 1v5m n PRO 36 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1v5m n GLY 37 N -3.26 3.35 0.00 0.55 0.00 -1.26 -5.05 105.19 99.52 1v5m n GLY 37 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1v5m n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v5m n GLY 38 N 0.00 -3.17 3.85 -0.02 0.00 -1.26 -4.61 105.19 99.98 1v5m n GLY 38 Ca 0.00 0.48 -0.32 0.00 0.00 0.00 0.00 46.02 46.18 1v5m n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v5m s THR 39 N -2.13 4.61 0.44 2.61 2.01 -1.26 -5.00 115.64 116.91 1v5m s THR 39 Ca 0.00 1.05 -0.22 0.00 0.31 0.00 0.00 61.69 62.82 1v5m s THR 39 Cb 0.00 -3.67 -0.11 0.00 0.01 0.00 0.00 72.50 68.72 1v5m s THR 39 CO 0.00 -0.46 0.70 0.00 -0.69 0.00 0.00 174.62 174.18 1v5m n ALA 40 N -1.04 -0.91 -0.42 7.40 0.00 -1.26 -4.77 120.51 119.50 1v5m n ALA 40 Ca 0.05 0.17 0.35 0.00 0.00 0.00 0.00 53.44 54.01 1v5m n ALA 40 Cb 0.54 -1.88 0.63 0.00 0.00 0.00 0.00 19.45 18.73 1v5m n ALA 40 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 1v5m h GLN 41 N 0.96 0.10 -4.25 0.00 3.07 -1.94 -3.42 115.11 109.63 1v5m h GLN 41 Ca -0.42 -0.01 -0.52 0.00 0.09 0.00 0.00 58.65 57.79 1v5m h GLN 41 Cb 1.38 -0.02 0.05 0.00 0.08 0.00 0.00 27.48 28.97 1v5m h GLN 41 CO 0.53 0.06 -0.14 0.91 0.09 0.00 0.00 178.83 180.28 1v5m n TRP 42 N -4.77 0.10 -4.23 0.06 7.02 -1.26 -4.93 117.44 109.44 1v5m n TRP 42 Ca 0.37 0.72 -0.33 0.00 -1.02 0.00 0.00 57.50 57.24 1v5m n TRP 42 Cb 1.38 -1.44 -0.16 0.00 -2.42 0.00 0.00 31.31 28.67 1v5m n TRP 42 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 1v5m s GLN 43 N -0.31 3.02 0.18 -0.99 -1.52 -1.15 -4.97 119.66 113.92 1v5m s GLN 43 Ca 0.56 -0.82 -0.33 0.00 -1.95 0.00 0.00 55.36 52.82 1v5m s GLN 43 Cb -0.79 -2.57 -0.14 0.00 -0.22 0.00 0.00 33.01 29.29 1v5m s GLN 43 CO 0.40 -0.16 1.55 1.63 -0.25 0.00 0.00 175.29 178.46 1v5m n LYS 44 N 4.50 2.17 -3.91 2.91 5.02 -1.26 -2.38 118.16 125.21 1v5m n LYS 44 Ca -0.21 0.78 -0.08 0.00 -2.02 0.00 0.00 58.31 56.79 1v5m n LYS 44 Cb 0.50 -2.53 -0.03 0.00 -0.02 0.00 0.00 35.03 32.95 1v5m n LYS 44 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1v5m s ARG 46 N -3.92 2.39 -0.12 0.00 3.52 0.09 -1.69 118.95 119.21 1v5m s ARG 46 Ca 0.15 -0.84 -0.25 0.00 -0.13 0.00 0.00 55.73 54.66 1v5m s ARG 46 Cb -0.04 -2.45 -0.02 0.00 -1.56 0.00 0.00 34.95 30.88 1v5m s ARG 46 CO 0.08 -0.34 0.80 -1.17 -0.81 0.00 0.00 175.30 173.86 1v5m s LEU 47 N 1.35 4.24 -0.10 -0.88 2.96 0.29 -1.86 118.68 124.67 1v5m s LEU 47 Ca 0.01 1.22 -0.00 0.00 -0.22 0.00 0.00 54.13 55.14 1v5m s LEU 47 Cb -0.15 -3.21 0.02 0.00 0.50 0.00 0.00 46.19 43.35 1v5m s LEU 47 CO -0.10 -0.29 -0.08 -0.22 -1.32 0.00 0.00 176.35 174.34 1v5m s LEU 48 N 1.61 1.22 -0.44 -0.68 2.96 -0.64 -1.69 118.68 121.02 1v5m s LEU 48 Ca 0.39 -0.28 -0.09 0.00 -0.22 0.00 0.00 54.13 53.93 1v5m s LEU 48 Cb -0.17 -0.80 0.10 0.00 0.50 0.00 0.00 46.19 45.81 1v5m s LEU 48 CO 0.16 -0.10 0.29 -0.22 -1.32 0.00 0.00 176.35 175.16 1v5m s LEU 49 N 1.55 5.38 0.13 -0.68 0.20 -0.79 -1.43 118.68 123.03 1v5m s LEU 49 Ca 0.02 -1.72 0.10 0.00 0.69 0.00 0.00 54.13 53.22 1v5m s LEU 49 Cb -0.13 -1.98 -0.04 0.00 -0.43 0.00 0.00 46.19 43.61 1v5m s LEU 49 CO -0.06 -0.60 -0.25 -0.13 -0.29 0.00 0.00 176.35 175.02 1v5m s ARG 50 N 1.37 1.32 0.50 1.98 0.52 -1.15 -2.07 118.95 121.42 1v5m s ARG 50 Ca 0.04 -1.31 -0.21 0.00 -0.52 0.00 0.00 55.73 53.73 1v5m s ARG 50 Cb -0.24 -1.72 -0.07 0.00 0.52 0.00 0.00 34.95 33.44 1v5m s ARG 50 CO 0.00 0.40 1.12 -0.98 0.02 0.00 0.00 175.30 175.86 1v5m s ARG 51 N -2.10 3.62 0.57 3.54 1.70 -1.25 -1.07 118.95 123.96 1v5m s ARG 51 Ca 0.12 1.61 -0.04 0.00 -0.47 0.00 0.00 55.73 56.96 1v5m s ARG 51 Cb -0.10 -2.19 0.01 0.00 -0.57 0.00 0.00 34.95 32.11 1v5m s ARG 51 CO 0.06 -0.63 0.85 0.00 -1.08 0.00 0.00 175.30 174.50 1v5m s ALA 52 N -1.72 3.44 0.72 7.88 0.00 -0.56 -4.70 121.76 126.81 1v5m s ALA 52 Ca 0.68 -0.85 -0.11 0.00 0.00 0.00 0.00 51.96 51.67 1v5m s ALA 52 Cb -0.24 -2.45 0.02 0.00 0.00 0.00 0.00 23.12 20.45 1v5m s ALA 52 CO 0.28 -0.75 1.09 0.14 0.00 0.00 0.00 175.76 176.52 1v5m s VAL 53 N -2.90 3.56 -0.33 0.00 -7.23 -1.26 -4.79 120.40 107.46 1v5m s VAL 53 Ca 0.54 0.51 -0.29 0.00 -1.81 0.00 0.00 61.98 60.92 1v5m s VAL 53 Cb -0.10 -3.42 -0.12 0.00 0.56 0.00 0.00 36.38 33.29 1v5m s VAL 53 CO 0.43 -0.66 1.38 0.00 -0.31 0.00 0.00 175.10 175.94 1v5m n ALA 54 N -3.09 0.11 0.00 1.32 0.00 -1.26 -2.15 120.51 115.44 1v5m n ALA 54 Ca 0.07 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1v5m n ALA 54 Cb 0.56 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1v5m n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v5m n GLY 55 N 4.82 3.16 3.85 0.00 0.00 -1.26 -5.11 105.19 110.65 1v5m n GLY 55 Ca 0.35 -0.54 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 1v5m n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1v5m s GLU 56 N 0.00 3.02 0.00 1.61 2.56 -0.92 -5.08 118.70 119.90 1v5m s GLU 56 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 54.97 54.00 1v5m s GLU 56 Cb 0.00 -2.64 0.00 0.00 2.00 0.00 0.00 34.13 33.49 1v5m s GLU 56 CO 0.00 0.42 0.30 0.54 -0.56 0.00 0.00 175.26 175.96 1v5m n ARG 57 N -1.09 0.00 -4.34 4.30 5.12 -1.26 -4.29 116.66 115.10 1v5m n ARG 57 Ca -0.08 0.35 -0.19 0.00 -1.93 0.00 0.00 57.85 55.99 1v5m n ARG 57 Cb 0.57 -1.02 -0.09 0.00 -1.16 0.00 0.00 32.46 30.76 1v5m n ARG 57 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1v5m s PHE 58 N -1.29 1.64 -0.18 -1.55 0.40 -1.26 -1.49 117.98 114.25 1v5m s PHE 58 Ca 0.00 -1.44 -0.08 0.00 -0.60 0.00 0.00 56.93 54.81 1v5m s PHE 58 Cb 0.00 -0.84 0.07 0.00 0.51 0.00 0.00 43.02 42.76 1v5m s PHE 58 CO 0.00 -0.60 0.40 0.50 0.70 0.00 0.00 175.22 176.23 1v5m s ARG 59 N -3.72 0.34 0.52 0.44 3.52 -0.23 -1.68 118.95 118.13 1v5m s ARG 59 Ca 0.36 0.90 -0.08 0.00 -0.13 0.00 0.00 55.73 56.77 1v5m s ARG 59 Cb 0.04 0.14 -0.04 0.00 -1.56 0.00 0.00 34.95 33.53 1v5m s ARG 59 CO 0.19 -0.21 0.88 -0.51 -0.81 0.00 0.00 175.30 174.84 1v5m s LEU 60 N 2.05 3.51 -0.19 -0.88 1.43 0.10 -2.95 118.68 121.76 1v5m s LEU 60 Ca -0.05 1.16 -0.04 0.00 -1.03 0.00 0.00 54.13 54.17 1v5m s LEU 60 Cb -0.10 -4.14 0.08 0.00 0.03 0.00 0.00 46.19 42.06 1v5m s LEU 60 CO -0.12 -0.66 0.18 -1.61 0.23 0.00 0.00 176.35 174.37 1v5m s GLU 61 N -4.75 0.14 -0.85 1.70 2.02 -0.52 -2.53 118.70 113.92 1v5m s GLU 61 Ca 0.51 0.13 -0.12 0.00 0.02 0.00 0.00 54.97 55.52 1v5m s GLU 61 Cb -0.11 -1.36 0.22 0.00 0.10 0.00 0.00 34.13 32.99 1v5m s GLU 61 CO 0.46 -0.65 0.78 -0.06 0.02 0.00 0.00 175.26 175.81 1v5m s PHE 62 N 2.27 3.80 -0.20 1.61 0.40 -1.24 -1.62 117.98 122.99 1v5m s PHE 62 Ca 0.05 -2.22 -0.29 0.00 -0.60 0.00 0.00 56.93 53.87 1v5m s PHE 62 Cb -0.16 -3.72 -0.02 0.00 0.51 0.00 0.00 43.02 39.63 1v5m s PHE 62 CO -0.11 -0.96 1.49 -0.06 0.70 0.00 0.00 175.22 176.28 1v5m s PHE 63 N -0.13 2.35 -0.19 0.36 0.08 -0.78 -1.97 117.98 117.70 1v5m s PHE 63 Ca 0.20 0.65 -0.03 0.00 0.12 0.00 0.00 56.93 57.87 1v5m s PHE 63 Cb -0.11 -3.87 0.06 0.00 -0.57 0.00 0.00 43.02 38.53 1v5m s PHE 63 CO -0.08 -2.57 0.04 0.08 -0.10 0.00 0.00 175.22 172.59 1v5m s VAL 64 N 4.54 0.48 1.01 -0.44 1.01 -1.26 -0.73 120.40 125.01 1v5m s VAL 64 Ca 0.65 -0.55 -0.13 0.00 0.00 0.00 0.00 61.98 61.96 1v5m s VAL 64 Cb -0.24 -1.01 0.20 0.00 0.00 0.00 0.00 36.38 35.33 1v5m s VAL 64 CO 0.25 -0.23 1.09 -2.16 0.00 0.00 0.00 175.10 174.06 1v5m s PRO 65 N 1.88 0.30 0.00 2.72 0.04 -1.26 -4.64 135.00 134.03 1v5m s PRO 65 Ca -0.01 0.48 0.08 0.00 0.04 0.00 0.00 61.00 61.60 1v5m s PRO 65 Cb -0.17 -1.72 0.51 0.00 0.04 0.00 0.00 34.50 33.15 1v5m s PRO 65 CO -0.08 -2.81 0.95 -0.35 0.04 0.00 0.00 177.00 174.75 1v5m n PRO 66 N -4.23 0.49 -0.03 0.56 -0.04 -0.86 -2.07 135.00 128.82 1v5m n PRO 66 Ca 0.05 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.56 1v5m n PRO 66 Cb 0.57 -1.27 -0.16 0.00 -0.04 0.00 0.00 33.50 32.60 1v5m n PRO 66 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1v5m n LYS 67 N -0.77 0.67 -1.73 0.54 5.02 -1.26 -4.76 118.16 115.87 1v5m n LYS 67 Ca 0.06 -0.12 -0.38 0.00 -2.02 0.00 0.00 58.31 55.85 1v5m n LYS 67 Cb 0.03 -1.54 0.05 0.00 -0.02 0.00 0.00 35.03 33.55 1v5m n LYS 67 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1v5m n ALA 68 N -2.40 1.35 0.06 7.82 0.00 -0.88 -4.92 120.51 121.53 1v5m n ALA 68 Ca -0.12 0.08 -0.09 0.00 0.00 0.00 0.00 53.44 53.30 1v5m n ALA 68 Cb 0.75 -2.33 0.03 0.00 0.00 0.00 0.00 19.45 17.90 1v5m n ALA 68 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1v5m h SER 69 N 1.09 0.44 -3.35 0.00 0.02 -1.93 -3.45 113.55 106.37 1v5m h SER 69 Ca -0.51 -0.30 -0.65 0.00 -0.84 0.00 0.00 61.79 59.49 1v5m h SER 69 Cb 1.32 -0.13 -0.12 0.00 0.14 0.00 0.00 62.40 63.61 1v5m h SER 69 CO 0.55 1.04 -0.66 -0.13 -1.14 0.00 0.00 176.83 176.49 1v5m s ARG 70 N -3.57 2.60 0.24 3.45 1.81 -1.26 -5.10 118.95 117.12 1v5m s ARG 70 Ca -0.05 -0.79 -0.30 0.00 -1.72 0.00 0.00 55.73 52.87 1v5m s ARG 70 Cb 0.10 -2.57 -0.09 0.00 -0.45 0.00 0.00 34.95 31.94 1v5m s ARG 70 CO 0.84 0.56 1.27 -1.25 -0.68 0.00 0.00 175.30 176.04 1v5m s PRO 71 N -2.15 4.42 0.03 3.54 0.04 -1.26 -4.65 135.00 134.98 1v5m s PRO 71 Ca 0.25 2.05 -0.14 0.00 0.04 0.00 0.00 61.00 63.19 1v5m s PRO 71 Cb -0.12 -3.17 -0.35 0.00 0.04 0.00 0.00 34.50 30.91 1v5m s PRO 71 CO 0.17 -0.16 1.01 -0.22 0.04 0.00 0.00 177.00 177.83 1v5m h LYS 72 N 4.67 0.51 -2.14 4.56 3.64 -1.66 -3.38 116.57 122.77 1v5m h LYS 72 Ca -0.46 -0.87 -0.55 0.00 -1.27 0.00 0.00 60.65 57.50 1v5m h LYS 72 Cb 1.22 0.33 -0.41 0.00 -0.41 0.00 0.00 32.23 32.95 1v5m h LYS 72 CO 0.73 1.42 -0.86 0.28 -2.27 0.00 0.00 179.45 178.75 1v5m n VAL 73 N -3.69 1.84 -1.96 2.00 0.31 -0.95 -5.00 118.33 110.88 1v5m n VAL 73 Ca -0.16 -5.16 -0.40 0.00 -0.01 0.00 0.00 64.34 58.61 1v5m n VAL 73 Cb 1.10 -0.94 -0.03 0.00 -0.91 0.00 0.00 33.84 33.06 1v5m n VAL 73 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1v5m s SER 74 N -3.09 5.36 -0.14 4.52 1.04 -1.26 -3.66 113.70 116.47 1v5m s SER 74 Ca 0.45 0.74 -0.03 0.00 0.48 0.00 0.00 55.95 57.59 1v5m s SER 74 Cb 0.31 -2.52 -0.03 0.00 0.10 0.00 0.00 66.02 63.88 1v5m s SER 74 CO -0.12 -2.23 -0.02 -0.63 0.98 0.00 0.00 173.24 171.22 1v5m s ILE 75 N 8.80 4.07 0.38 -1.02 1.01 -1.05 -4.96 121.20 128.42 1v5m s ILE 75 Ca 0.75 -0.31 -0.26 0.00 0.00 0.00 0.00 60.65 60.83 1v5m s ILE 75 Cb -0.16 -2.76 -0.09 0.00 0.01 0.00 0.00 42.46 39.46 1v5m s ILE 75 CO 0.25 0.52 1.20 -2.16 0.00 0.00 0.00 174.94 174.75 1v5m s PRO 76 N 0.01 4.13 0.37 2.79 0.04 -1.26 0.01 135.00 141.09 1v5m s PRO 76 Ca 0.02 1.92 0.04 0.00 0.04 0.00 0.00 61.00 63.02 1v5m s PRO 76 Cb -0.13 -2.78 0.71 0.00 0.04 0.00 0.00 34.50 32.34 1v5m s PRO 76 CO 0.02 -0.28 2.01 1.25 0.04 0.00 0.00 177.00 180.04 1v5m h LEU 77 N 2.83 0.59 -1.92 -3.56 7.12 -1.64 -1.63 115.31 117.11 1v5m h LEU 77 Ca -0.49 -0.03 0.11 0.00 0.13 0.00 0.00 57.88 57.60 1v5m h LEU 77 Cb 1.23 -0.15 -0.02 0.00 -0.53 0.00 0.00 40.66 41.19 1v5m h LEU 77 CO 0.63 0.47 0.30 0.77 -0.13 0.00 0.00 178.44 180.48 1v5m h SER 78 N 0.69 0.08 -0.71 1.25 4.64 -1.92 -0.95 113.55 116.63 1v5m h SER 78 Ca 0.18 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.46 1v5m h SER 78 Cb -0.01 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.03 1v5m h SER 78 CO -0.03 0.05 0.28 0.00 -0.87 0.00 0.00 176.83 176.26 1v5m h ALA 79 N 1.79 0.92 -2.41 5.18 0.00 -1.67 -3.43 119.26 119.64 1v5m h ALA 79 Ca 0.20 -0.18 -0.56 0.00 0.00 0.00 0.00 54.91 54.37 1v5m h ALA 79 Cb 0.68 -0.28 0.05 0.00 0.00 0.00 0.00 17.79 18.24 1v5m h ALA 79 CO -0.02 0.54 0.98 -0.89 0.00 0.00 0.00 179.25 179.86 1v5m n ILE 80 N -4.36 0.17 0.00 0.00 2.08 -0.36 0.23 119.36 117.11 1v5m n ILE 80 Ca 0.06 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.34 1v5m n ILE 80 Cb 0.18 -1.86 0.00 0.00 -0.75 0.00 0.00 39.64 37.21 1v5m n ILE 80 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 1v5m n ILE 81 N 4.11 0.00 -3.71 1.39 -5.35 -0.84 -4.85 119.36 110.11 1v5m n ILE 81 Ca 0.18 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.52 1v5m n ILE 81 Cb 0.33 -0.89 -0.09 0.00 -1.74 0.00 0.00 39.64 37.25 1v5m n ILE 81 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1v5m s GLU 82 N -1.96 0.62 -0.16 6.28 -6.30 -1.19 -5.08 118.70 110.91 1v5m s GLU 82 Ca 0.00 0.42 -0.00 0.00 -2.50 0.00 0.00 54.97 52.88 1v5m s GLU 82 Cb 0.00 0.29 0.04 0.00 0.00 0.00 0.00 34.13 34.46 1v5m s GLU 82 CO 0.00 -0.12 -0.06 0.54 0.02 0.00 0.00 175.26 175.64 1v5m s VAL 83 N -0.25 1.14 -0.43 3.70 0.11 -1.26 -1.65 120.40 121.76 1v5m s VAL 83 Ca -0.04 -0.59 -0.22 0.00 -2.93 0.00 0.00 61.98 58.20 1v5m s VAL 83 Cb -0.03 -1.27 0.02 0.00 -1.53 0.00 0.00 36.38 33.56 1v5m s VAL 83 CO 0.02 0.18 0.71 -0.13 -3.33 0.00 0.00 175.10 172.56 1v5m s ARG 84 N 1.63 3.43 -0.21 1.54 0.52 -1.00 -4.93 118.95 119.92 1v5m s ARG 84 Ca 0.01 -0.15 -0.00 0.00 -0.52 0.00 0.00 55.73 55.08 1v5m s ARG 84 Cb -0.15 -3.91 0.17 0.00 0.52 0.00 0.00 34.95 31.58 1v5m s ARG 84 CO -0.08 -1.01 1.86 0.25 0.02 0.00 0.00 175.30 176.34 1v5m n THR 85 N 5.94 2.38 -3.70 0.02 -2.24 -1.26 -1.52 114.28 113.90 1v5m n THR 85 Ca 0.00 -1.18 -0.11 0.00 -2.27 0.00 0.00 64.05 60.49 1v5m n THR 85 Cb 0.48 -1.26 -0.10 0.00 -2.10 0.00 0.00 70.33 67.35 1v5m n THR 85 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1v5m s THR 86 N -1.54 -0.02 0.13 4.28 -1.32 -1.26 -4.96 115.64 110.96 1v5m s THR 86 Ca 0.22 0.06 0.04 0.00 -1.21 0.00 0.00 61.69 60.80 1v5m s THR 86 Cb 0.17 -0.63 -0.04 0.00 -1.51 0.00 0.00 72.50 70.50 1v5m s THR 86 CO 0.01 0.03 0.10 -0.04 -2.21 0.00 0.00 174.62 172.50 1v5m s MET 87 N 1.07 2.85 0.00 7.08 1.00 -1.26 -4.87 119.30 125.16 1v5m s MET 87 Ca -0.07 -0.82 0.00 0.00 0.00 0.00 0.00 55.69 54.81 1v5m s MET 87 Cb -0.07 -2.66 0.00 0.00 0.00 0.00 0.00 34.83 32.11 1v5m s MET 87 CO -0.09 0.51 0.00 -0.35 0.00 0.00 0.00 175.02 175.09 1v5m n PRO 88 N -0.00 0.41 -1.00 2.03 -0.04 -1.26 -4.76 135.00 130.38 1v5m n PRO 88 Ca -0.09 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 62.94 1v5m n PRO 88 Cb 0.53 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.92 1v5m n PRO 88 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1v5m n LEU 89 N 0.00 3.37 0.03 1.53 -0.00 -1.26 -4.11 117.00 116.56 1v5m n LEU 89 Ca 0.00 -2.57 0.00 0.00 -0.00 0.00 0.00 56.01 53.44 1v5m n LEU 89 Cb 0.00 -0.97 0.00 0.00 -0.00 0.00 0.00 43.42 42.45 1v5m n LEU 89 CO 0.00 -0.75 0.00 1.21 -0.00 0.00 0.00 177.39 177.85 1v5m n GLU 90 N 7.24 0.00 -3.10 1.96 2.13 -1.26 -5.07 120.64 122.54 1v5m n GLU 90 Ca 0.49 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.92 1v5m n GLU 90 Cb 0.41 -0.15 -0.06 0.00 0.27 0.00 0.00 31.44 31.91 1v5m n GLU 90 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 1v5m s MET 91 N -1.40 4.41 -0.02 5.31 -1.94 -1.26 -5.01 119.30 119.39 1v5m s MET 91 Ca 0.00 0.98 -0.23 0.00 -1.71 0.00 0.00 55.69 54.73 1v5m s MET 91 Cb 0.00 -3.21 -0.16 0.00 2.01 0.00 0.00 34.83 33.46 1v5m s MET 91 CO 0.00 0.58 1.08 -1.00 -0.01 0.00 0.00 175.02 175.67 1v5m h PRO 92 N 4.30 -0.27 0.00 2.03 0.13 -1.97 -3.44 132.00 132.78 1v5m h PRO 92 Ca -0.48 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1v5m h PRO 92 Cb 1.21 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1v5m h PRO 92 CO 0.65 0.11 -0.25 0.39 -0.23 0.00 0.00 178.00 178.67 1v5m n GLU 93 N -5.01 0.00 -0.80 0.86 -0.58 -1.26 -5.03 120.64 108.82 1v5m n GLU 93 Ca -0.09 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.51 1v5m n GLU 93 Cb 0.26 -0.50 -0.11 0.00 -0.57 0.00 0.00 31.44 30.52 1v5m n GLU 93 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1v5m n LYS 94 N -1.97 0.00 -0.72 3.49 4.01 -1.26 -4.67 118.16 117.03 1v5m n LYS 94 Ca 0.00 0.00 -0.14 0.00 -0.51 0.00 0.00 58.31 57.66 1v5m n LYS 94 Cb 0.13 -0.61 0.09 0.00 -0.51 0.00 0.00 35.03 34.12 1v5m n LYS 94 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1v5m n ASP 95 N 3.69 4.06 -3.21 4.39 8.00 -1.26 -4.52 116.55 127.70 1v5m n ASP 95 Ca 0.36 -2.93 -0.33 0.00 0.71 0.00 0.00 54.79 52.60 1v5m n ASP 95 Cb 0.06 -0.76 -0.01 0.00 -0.02 0.00 0.00 41.12 40.39 1v5m n ASP 95 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1v5m n ASN 96 N -0.28 5.69 -3.78 -2.24 6.94 -1.26 -4.33 115.26 116.00 1v5m n ASN 96 Ca 0.33 -3.69 -0.13 0.00 -0.02 0.00 0.00 54.58 51.07 1v5m n ASN 96 Cb 1.03 -0.81 -0.11 0.00 -2.36 0.00 0.00 39.78 37.53 1v5m n ASN 96 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1v5m s THR 97 N -4.45 0.01 -0.04 5.53 -4.23 -1.26 -1.93 115.64 109.26 1v5m s THR 97 Ca 0.45 -0.05 -0.06 0.00 -1.18 0.00 0.00 61.69 60.85 1v5m s THR 97 Cb 0.25 -0.40 0.01 0.00 1.34 0.00 0.00 72.50 73.70 1v5m s THR 97 CO -0.14 -0.03 0.15 0.72 -0.54 0.00 0.00 174.62 174.79 1v5m s PHE 98 N 0.02 -0.11 -0.13 3.99 -0.12 -1.06 -4.43 117.98 116.13 1v5m s PHE 98 Ca -0.01 0.26 -0.07 0.00 -0.05 0.00 0.00 56.93 57.06 1v5m s PHE 98 Cb -0.02 0.03 -0.04 0.00 -0.63 0.00 0.00 43.02 42.35 1v5m s PHE 98 CO 0.01 -0.14 0.12 0.08 -0.05 0.00 0.00 175.22 175.23 1v5m s VAL 99 N -0.34 5.33 -0.39 -2.49 1.01 -0.57 -1.95 120.40 120.98 1v5m s VAL 99 Ca -0.04 0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 1v5m s VAL 99 Cb -0.03 -3.34 0.10 0.00 0.00 0.00 0.00 36.38 33.11 1v5m s VAL 99 CO 0.01 0.58 0.18 -0.76 0.00 0.00 0.00 175.10 175.10 1v5m s LEU 100 N -0.69 5.06 -0.73 3.92 1.43 -1.08 -2.38 118.68 124.21 1v5m s LEU 100 Ca 0.13 -1.89 -0.21 0.00 -1.03 0.00 0.00 54.13 51.13 1v5m s LEU 100 Cb -0.12 -1.82 0.10 0.00 0.03 0.00 0.00 46.19 44.38 1v5m s LEU 100 CO 0.03 -0.50 0.97 -0.75 0.23 0.00 0.00 176.35 176.32 1v5m s LYS 101 N 1.17 3.25 0.95 1.70 2.20 -0.66 -2.25 119.74 126.10 1v5m s LYS 101 Ca 0.06 -1.21 -0.14 0.00 -0.36 0.00 0.00 55.97 54.32 1v5m s LYS 101 Cb -0.22 -4.44 0.16 0.00 -1.51 0.00 0.00 37.83 31.81 1v5m s LYS 101 CO -0.03 -1.75 1.17 0.14 -0.36 0.00 0.00 175.35 174.52 1v5m s VAL 102 N 3.39 1.95 0.40 4.02 -7.23 -0.85 -1.99 120.40 120.09 1v5m s VAL 102 Ca 0.23 0.00 0.27 0.00 -1.81 0.00 0.00 61.98 60.67 1v5m s VAL 102 Cb -0.14 -2.79 0.28 0.00 0.56 0.00 0.00 36.38 34.29 1v5m s VAL 102 CO 0.03 0.00 2.06 1.05 -0.31 0.00 0.00 175.10 177.93 1v5m h GLU 103 N -1.61 0.00 -1.15 4.82 4.11 0.27 -2.50 114.58 118.51 1v5m h GLU 103 Ca -0.48 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 58.80 1v5m h GLU 103 Cb 1.31 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.48 1v5m h GLU 103 CO 0.54 0.13 0.19 0.09 0.07 0.00 0.00 179.01 180.04 1v5m n ASN 104 N -3.66 3.79 -3.99 3.06 3.02 -1.26 -4.86 115.26 111.36 1v5m n ASN 104 Ca -0.02 -2.51 -0.42 0.00 -0.03 0.00 0.00 54.58 51.60 1v5m n ASN 104 Cb 0.25 -0.70 0.02 0.00 -0.61 0.00 0.00 39.78 38.74 1v5m n ASN 104 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1v5m n GLY 105 N 0.21 -0.94 2.72 7.41 0.00 -0.94 -4.96 105.19 108.69 1v5m n GLY 105 Ca 0.17 0.39 -0.19 0.00 0.00 0.00 0.00 46.02 46.39 1v5m n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v5m s ALA 106 N -3.42 0.13 -0.09 4.61 0.00 -1.25 -4.97 121.76 116.77 1v5m s ALA 106 Ca 0.41 0.28 -0.12 0.00 0.00 0.00 0.00 51.96 52.52 1v5m s ALA 106 Cb -0.22 -0.62 -0.05 0.00 0.00 0.00 0.00 23.12 22.24 1v5m s ALA 106 CO 0.95 -0.46 0.30 -1.21 0.00 0.00 0.00 175.76 175.34 1v5m s GLU 107 N 2.07 3.92 -0.35 0.00 2.02 -1.25 -2.00 118.70 123.11 1v5m s GLU 107 Ca 0.03 0.16 0.02 0.00 0.02 0.00 0.00 54.97 55.20 1v5m s GLU 107 Cb -0.12 -3.29 0.10 0.00 0.10 0.00 0.00 34.13 30.93 1v5m s GLU 107 CO -0.04 0.55 0.09 0.71 0.02 0.00 0.00 175.26 176.60 1v5m s TYR 108 N -0.51 2.81 -0.34 1.61 1.51 -0.95 -2.96 117.35 118.51 1v5m s TYR 108 Ca 0.19 -2.48 -0.29 0.00 -1.01 0.00 0.00 57.07 53.48 1v5m s TYR 108 Cb -0.14 -2.38 0.02 0.00 -0.11 0.00 0.00 41.96 39.34 1v5m s TYR 108 CO 0.08 -0.90 1.15 0.42 -1.11 0.00 0.00 175.55 175.19 1v5m s ILE 109 N 1.07 4.35 -0.09 2.71 1.01 1.00 -2.64 121.20 128.61 1v5m s ILE 109 Ca 0.11 1.52 -0.00 0.00 0.00 0.00 0.00 60.65 62.28 1v5m s ILE 109 Cb -0.19 -4.38 -0.03 0.00 0.01 0.00 0.00 42.46 37.87 1v5m s ILE 109 CO -0.14 -0.58 -0.06 -0.76 0.00 0.00 0.00 174.94 173.41 1v5m s LEU 110 N 4.01 3.21 -0.38 2.97 1.02 -0.82 -0.74 118.68 127.94 1v5m s LEU 110 Ca 0.49 -0.04 -0.05 0.00 0.02 0.00 0.00 54.13 54.55 1v5m s LEU 110 Cb -0.12 -1.72 0.08 0.00 0.02 0.00 0.00 46.19 44.45 1v5m s LEU 110 CO 0.21 0.32 0.17 -0.70 0.02 0.00 0.00 176.35 176.37 1v5m s GLU 111 N -0.54 2.35 0.33 1.70 2.12 -0.05 -2.58 118.70 122.04 1v5m s GLU 111 Ca 0.08 -1.53 -0.05 0.00 0.36 0.00 0.00 54.97 53.84 1v5m s GLU 111 Cb -0.12 -3.56 0.07 0.00 0.26 0.00 0.00 34.13 30.78 1v5m s GLU 111 CO 0.02 -0.91 0.45 0.25 -0.54 0.00 0.00 175.26 174.54 1v5m n THR 112 N 4.73 0.00 0.02 -1.70 -2.24 -0.81 -3.59 114.28 110.70 1v5m n THR 112 Ca -0.08 -0.40 -0.01 0.00 -2.27 0.00 0.00 64.05 61.29 1v5m n THR 112 Cb 0.43 -1.69 -0.00 0.00 -2.10 0.00 0.00 70.33 66.96 1v5m n THR 112 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1v5m h ILE 113 N -1.11 0.00 -4.51 2.28 2.04 -1.94 -3.47 117.51 110.81 1v5m h ILE 113 Ca -0.15 -0.01 -0.44 0.00 1.00 0.00 0.00 64.86 65.26 1v5m h ILE 113 Cb 0.43 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.41 1v5m h ILE 113 CO 0.11 0.00 -0.37 -0.67 0.00 0.00 0.00 178.15 177.22 1v5m n ASP 114 N -2.17 1.15 -0.03 1.72 2.03 -1.26 -4.92 116.55 113.07 1v5m n ASP 114 Ca -0.01 -2.73 0.09 0.00 0.52 0.00 0.00 54.79 52.66 1v5m n ASP 114 Cb 0.02 0.83 0.48 0.00 -0.72 0.00 0.00 41.12 41.73 1v5m n ASP 114 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1v5m h SER 115 N 1.30 0.38 0.62 1.67 4.64 -1.93 -2.27 113.55 117.96 1v5m h SER 115 Ca -0.25 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.04 1v5m h SER 115 Cb 0.97 -0.08 0.01 0.00 -0.31 0.00 0.00 62.40 62.98 1v5m h SER 115 CO 0.40 0.25 -0.30 0.17 -0.87 0.00 0.00 176.83 176.48 1v5m h LEU 116 N 0.44 -0.71 -0.62 5.97 -0.00 -1.96 -1.20 115.31 117.23 1v5m h LEU 116 Ca 0.21 -0.02 0.11 0.00 -0.00 0.00 0.00 57.88 58.19 1v5m h LEU 116 Cb 0.28 0.18 -0.08 0.00 -0.00 0.00 0.00 40.66 41.04 1v5m h LEU 116 CO -0.05 -0.40 0.17 1.56 -0.00 0.00 0.00 178.44 179.71 1v5m h GLN 117 N -0.99 0.30 0.45 0.17 1.08 -1.88 -0.92 115.11 113.31 1v5m h GLN 117 Ca -0.09 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.08 1v5m h GLN 117 Cb 0.68 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 1v5m h GLN 117 CO 0.14 0.20 -0.26 -0.22 -0.95 0.00 0.00 178.83 177.74 1v5m h LYS 118 N 0.31 -0.63 -0.96 1.46 3.64 -1.36 -1.31 116.57 117.72 1v5m h LYS 118 Ca 0.33 0.04 0.30 0.00 -1.27 0.00 0.00 60.65 60.05 1v5m h LYS 118 Cb 0.47 0.14 -0.15 0.00 -0.41 0.00 0.00 32.23 32.29 1v5m h LYS 118 CO -0.39 -0.42 0.43 1.25 -2.27 0.00 0.00 179.45 178.06 1v5m h HIS 119 N -0.66 0.69 -0.07 1.91 2.76 -0.99 0.22 115.15 119.01 1v5m h HIS 119 Ca -0.06 0.04 -0.00 0.00 -2.20 0.00 0.00 60.37 58.15 1v5m h HIS 119 Cb 0.52 -0.15 -0.00 0.00 1.55 0.00 0.00 27.41 29.33 1v5m h HIS 119 CO 0.03 -0.22 0.04 1.03 -1.30 0.00 0.00 177.93 177.51 1v5m h SER 120 N 0.25 0.09 0.19 3.26 0.87 -0.91 -2.92 113.55 114.38 1v5m h SER 120 Ca 0.68 -0.07 0.01 0.00 -1.23 0.00 0.00 61.79 61.18 1v5m h SER 120 Cb 1.52 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 63.42 1v5m h SER 120 CO -0.65 0.13 -0.48 -0.50 -0.53 0.00 0.00 176.83 174.79 1v5m h TRP 121 N 0.04 -1.39 -1.04 2.24 4.06 0.62 -1.16 115.95 119.33 1v5m h TRP 121 Ca 0.03 0.03 0.37 0.00 2.06 0.00 0.00 58.89 61.38 1v5m h TRP 121 Cb 0.06 0.58 -0.16 0.00 -1.00 0.00 0.00 29.16 28.64 1v5m h TRP 121 CO -0.05 -0.57 0.59 0.28 -3.56 0.00 0.00 178.44 175.13 1v5m h VAL 122 N -0.75 0.17 -0.00 1.49 2.07 -1.41 0.36 116.25 118.17 1v5m h VAL 122 Ca -0.02 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 1v5m h VAL 122 Cb 0.73 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1v5m h VAL 122 CO -0.22 0.03 0.00 0.00 0.02 0.00 0.00 177.57 177.40 1v5m h ALA 123 N 1.88 0.00 -0.72 1.67 0.00 -1.05 -0.13 119.26 120.91 1v5m h ALA 123 Ca 0.79 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.61 1v5m h ALA 123 Cb 2.00 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.73 1v5m h ALA 123 CO -0.64 -0.35 0.43 -0.44 0.00 0.00 0.00 179.25 178.24 1v5m h ASP 124 N -0.28 0.67 0.09 0.00 3.32 0.56 0.42 116.42 121.19 1v5m h ASP 124 Ca 0.00 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 1v5m h ASP 124 Cb 0.29 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1v5m h ASP 124 CO 0.00 0.44 -0.04 0.40 -1.72 0.00 0.00 179.24 178.32 1v5m h ILE 125 N 0.80 0.00 -0.52 0.35 2.04 -1.02 -3.19 117.51 115.96 1v5m h ILE 125 Ca 0.31 -0.06 0.10 0.00 1.00 0.00 0.00 64.86 66.22 1v5m h ILE 125 Cb 0.14 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.12 1v5m h ILE 125 CO -0.16 0.00 -0.13 1.56 0.00 0.00 0.00 178.15 179.42 1v5m h GLN 126 N -0.17 -0.00 -0.06 2.37 1.08 -1.04 0.32 115.11 117.61 1v5m h GLN 126 Ca -0.01 0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.21 1v5m h GLN 126 Cb 0.09 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.52 1v5m h GLN 126 CO 0.02 -0.00 0.62 0.78 -0.95 0.00 0.00 178.83 179.30 1v5m h GLY 127 N -0.00 0.00 0.09 3.46 0.00 -0.27 0.97 103.07 107.32 1v5m h GLY 127 Ca 0.25 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 47.19 1v5m h GLY 127 CO -0.54 0.00 -2.39 0.00 0.00 0.00 0.00 176.54 173.61 1v5m n VAL 129 N -3.44 -0.06 -3.69 0.00 3.14 0.33 -4.68 118.33 109.93 1v5m n VAL 129 Ca -0.45 1.49 -0.01 0.00 -2.96 0.00 0.00 64.34 62.41 1v5m n VAL 129 Cb 0.98 -2.47 0.01 0.00 -1.06 0.00 0.00 33.84 31.30 1v5m n VAL 129 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1v5m n ASP 130 N -4.02 -0.85 -3.30 6.55 8.00 -1.19 -4.96 116.55 116.78 1v5m n ASP 130 Ca 0.42 -1.43 -0.27 0.00 0.71 0.00 0.00 54.79 54.22 1v5m n ASP 130 Cb 1.82 1.38 -0.12 0.00 -0.02 0.00 0.00 41.12 44.18 1v5m n ASP 130 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1v5m n SER 131 N -0.91 -0.03 0.00 -2.24 3.41 -1.26 -4.72 113.62 107.87 1v5m n SER 131 Ca -0.01 0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 1v5m n SER 131 Cb 0.30 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 1v5m n SER 131 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v5m n GLY 132 N 4.62 0.73 3.77 5.00 0.00 -1.16 -4.99 105.19 113.17 1v5m n GLY 132 Ca 0.49 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.16 1v5m n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5m s PRO 133 N 0.49 3.16 -0.01 1.61 0.04 -1.25 -4.98 135.00 134.06 1v5m s PRO 133 Ca 0.00 1.53 0.06 0.00 0.04 0.00 0.00 61.00 62.63 1v5m s PRO 133 Cb 0.00 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.47 1v5m s PRO 133 CO 0.00 -0.99 0.12 -1.13 0.04 0.00 0.00 177.00 175.04 1v5m n SER 134 N -1.70 3.73 -4.68 6.66 3.41 -1.26 -5.00 113.62 114.78 1v5m n SER 134 Ca 0.11 -0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.29 1v5m n SER 134 Cb 0.51 1.25 -0.03 0.00 -0.26 0.00 0.00 64.21 65.68 1v5m n SER 134 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1v5m s SER 135 N -2.62 6.73 0.00 4.04 0.15 -1.26 -5.13 113.70 115.61 1v5m s SER 135 Ca -0.02 2.23 0.00 0.00 0.70 0.00 0.00 55.95 58.86 1v5m s SER 135 Cb 0.04 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 1v5m s SER 135 CO 0.23 -0.83 0.00 0.61 1.20 0.00 0.00 173.24 174.45