#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5m n SER 2 N 0.00 -0.38 -3.37 1.61 7.64 -1.26 -4.94 113.62 112.92 1v5m n SER 2 Ca 0.00 1.00 -0.09 0.00 1.01 0.00 0.00 58.87 60.78 1v5m n SER 2 Cb 0.00 -0.81 -0.01 0.00 -1.01 0.00 0.00 64.21 62.38 1v5m n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1v5m s SER 3 N -0.30 0.09 0.00 6.43 0.01 -1.26 -5.19 113.70 113.49 1v5m s SER 3 Ca 0.71 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.92 1v5m s SER 3 Cb -1.00 0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.98 1v5m s SER 3 CO 0.49 -1.46 0.00 0.61 0.41 0.00 0.00 173.24 173.30 1v5m n GLY 4 N -0.50 2.08 3.67 3.44 0.00 -1.26 -5.18 105.19 107.45 1v5m n GLY 4 Ca -0.05 -0.50 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 1v5m n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v5m s SER 5 N 0.00 4.41 0.06 1.61 1.04 -1.26 -5.12 113.70 114.43 1v5m s SER 5 Ca 0.00 -0.86 0.05 0.00 0.48 0.00 0.00 55.95 55.61 1v5m s SER 5 Cb 0.00 -0.65 -0.04 0.00 0.10 0.00 0.00 66.02 65.44 1v5m s SER 5 CO 0.00 -0.23 -0.05 -0.44 0.98 0.00 0.00 173.24 173.51 1v5m s SER 6 N -3.76 4.75 0.00 7.02 0.01 -1.26 -4.83 113.70 115.63 1v5m s SER 6 Ca 0.35 -0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.41 1v5m s SER 6 Cb -0.02 -1.08 0.00 0.00 0.21 0.00 0.00 66.02 65.13 1v5m s SER 6 CO 0.21 0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.69 1v5m n GLY 7 N 1.01 6.13 3.69 3.44 0.00 -1.26 -5.19 105.19 113.01 1v5m n GLY 7 Ca -0.13 -1.72 -0.10 0.00 0.00 0.00 0.00 46.02 44.07 1v5m n GLY 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1v5m s ASN 8 N 0.77 0.16 -0.07 1.61 2.47 -1.26 -5.06 114.94 113.55 1v5m s ASN 8 Ca 0.00 -1.09 -0.14 0.00 0.42 0.00 0.00 52.86 52.06 1v5m s ASN 8 Cb 0.00 0.73 0.03 0.00 -1.45 0.00 0.00 41.25 40.56 1v5m s ASN 8 CO 0.00 -1.42 0.33 -0.76 -3.72 0.00 0.00 177.10 171.53 1v5m s LEU 9 N -3.07 0.77 -0.35 3.21 1.43 -1.26 -5.13 118.68 114.27 1v5m s LEU 9 Ca 0.20 0.37 0.02 0.00 -1.03 0.00 0.00 54.13 53.69 1v5m s LEU 9 Cb -0.03 1.24 0.11 0.00 0.03 0.00 0.00 46.19 47.53 1v5m s LEU 9 CO 0.12 -0.30 0.10 0.00 0.23 0.00 0.00 176.35 176.51 1v5m s ALA 10 N -0.63 2.38 0.02 4.21 0.00 -1.26 -5.08 121.76 121.39 1v5m s ALA 10 Ca -0.07 -2.30 -0.29 0.00 0.00 0.00 0.00 51.96 49.29 1v5m s ALA 10 Cb -0.04 -1.86 0.11 0.00 0.00 0.00 0.00 23.12 21.33 1v5m s ALA 10 CO 0.03 -1.75 1.23 0.00 0.00 0.00 0.00 175.76 175.27 1v5m s ALA 11 N 1.00 -2.13 0.48 0.00 0.00 -1.26 -5.15 121.76 114.70 1v5m s ALA 11 Ca 0.12 0.57 -0.23 0.00 0.00 0.00 0.00 51.96 52.42 1v5m s ALA 11 Cb -0.20 0.42 -0.07 0.00 0.00 0.00 0.00 23.12 23.28 1v5m s ALA 11 CO -0.13 -1.06 1.24 0.21 0.00 0.00 0.00 175.76 176.03 1v5m s LYS 12 N -2.57 3.56 -0.58 0.00 2.20 -1.26 -4.92 119.74 116.17 1v5m s LYS 12 Ca 0.14 1.96 -0.27 0.00 -0.36 0.00 0.00 55.97 57.44 1v5m s LYS 12 Cb 0.04 -2.38 -0.00 0.00 -1.51 0.00 0.00 37.83 33.97 1v5m s LYS 12 CO -0.03 -0.77 1.64 0.08 -0.36 0.00 0.00 175.35 175.92 1v5m s VAL 13 N -1.44 3.55 -0.37 4.02 1.01 -1.26 -4.94 120.40 120.97 1v5m s VAL 13 Ca 0.66 0.41 0.02 0.00 0.00 0.00 0.00 61.98 63.07 1v5m s VAL 13 Cb -0.33 -4.19 0.11 0.00 0.00 0.00 0.00 36.38 31.97 1v5m s VAL 13 CO 0.40 -1.06 0.13 -0.70 0.00 0.00 0.00 175.10 173.88 1v5m s GLU 14 N 6.23 1.24 -0.24 2.72 2.12 -1.26 -5.10 118.70 124.42 1v5m s GLU 14 Ca 0.60 -1.73 -0.15 0.00 0.36 0.00 0.00 54.97 54.05 1v5m s GLU 14 Cb -0.13 -2.63 -0.04 0.00 0.26 0.00 0.00 34.13 31.60 1v5m s GLU 14 CO 0.23 -1.02 0.38 -0.51 -0.54 0.00 0.00 175.26 173.79 1v5m s LEU 15 N 0.88 4.09 -0.04 2.70 2.01 -1.26 -5.06 118.68 122.00 1v5m s LEU 15 Ca 0.13 0.39 -0.02 0.00 0.01 0.00 0.00 54.13 54.64 1v5m s LEU 15 Cb -0.20 -2.46 0.03 0.00 0.01 0.00 0.00 46.19 43.56 1v5m s LEU 15 CO -0.11 -0.13 0.09 -0.69 1.01 0.00 0.00 176.35 176.52 1v5m s VAL 16 N 1.69 -0.04 0.11 -1.59 1.01 -1.26 -5.05 120.40 115.27 1v5m s VAL 16 Ca 0.17 0.14 -0.22 0.00 0.00 0.00 0.00 61.98 62.07 1v5m s VAL 16 Cb -0.15 -0.16 -0.05 0.00 0.00 0.00 0.00 36.38 36.02 1v5m s VAL 16 CO 0.09 0.06 1.10 0.47 0.00 0.00 0.00 175.10 176.82 1v5m n ASP 17 N 3.89 -0.74 -4.63 3.32 8.00 -1.26 -3.97 116.55 121.16 1v5m n ASP 17 Ca -0.23 1.27 -0.43 0.00 0.71 0.00 0.00 54.79 56.11 1v5m n ASP 17 Cb 0.53 -0.17 -0.03 0.00 -0.02 0.00 0.00 41.12 41.44 1v5m n ASP 17 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1v5m s ILE 18 N -5.30 3.54 -0.10 0.53 -1.09 -1.26 -3.88 121.20 113.64 1v5m s ILE 18 Ca -0.08 0.62 -0.02 0.00 -2.23 0.00 0.00 60.65 58.94 1v5m s ILE 18 Cb 0.08 -3.53 -0.01 0.00 -1.58 0.00 0.00 42.46 37.42 1v5m s ILE 18 CO 0.44 -0.20 -0.03 1.56 -1.23 0.00 0.00 174.94 175.48 1v5m h GLN 19 N 10.99 0.00 -3.02 2.79 1.08 -1.50 -3.49 115.11 121.96 1v5m h GLN 19 Ca -0.37 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 56.70 1v5m h GLN 19 Cb 1.17 0.00 -0.23 0.00 -0.05 0.00 0.00 27.48 28.37 1v5m h GLN 19 CO 0.98 0.00 -0.33 0.50 -0.95 0.00 0.00 178.83 179.04 1v5m s ARG 20 N -1.63 0.48 -0.13 1.46 6.06 -1.25 -5.05 118.95 118.88 1v5m s ARG 20 Ca -0.03 0.17 -0.06 0.00 -2.50 0.00 0.00 55.73 53.31 1v5m s ARG 20 Cb 0.00 0.22 0.06 0.00 0.06 0.00 0.00 34.95 35.29 1v5m s ARG 20 CO 0.04 -0.10 0.30 -2.00 -2.50 0.00 0.00 175.30 171.05 1v5m s GLU 21 N -0.46 0.26 0.13 5.12 -6.30 -1.26 -1.55 118.70 114.64 1v5m s GLU 21 Ca -0.06 0.67 -0.02 0.00 -2.50 0.00 0.00 54.97 53.05 1v5m s GLU 21 Cb -0.04 -0.05 0.01 0.00 0.00 0.00 0.00 34.13 34.05 1v5m s GLU 21 CO 0.02 -0.19 0.21 0.41 0.02 0.00 0.00 175.26 175.74 1v5m n GLY 22 N 4.48 2.33 2.87 -1.50 0.00 -0.85 -5.03 105.19 107.49 1v5m n GLY 22 Ca -0.21 -1.32 -0.30 0.00 0.00 0.00 0.00 46.02 44.19 1v5m n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v5m s ALA 23 N -1.75 2.31 0.35 4.61 0.00 -1.26 -1.83 121.76 124.18 1v5m s ALA 23 Ca 0.08 -2.24 0.03 0.00 0.00 0.00 0.00 51.96 49.84 1v5m s ALA 23 Cb -0.01 -1.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.23 1v5m s ALA 23 CO 0.06 -1.73 0.11 -0.48 0.00 0.00 0.00 175.76 173.71 1v5m s LEU 24 N 1.07 1.95 -0.09 0.00 2.34 -0.48 -4.88 118.68 118.59 1v5m s LEU 24 Ca 0.11 -1.52 -0.09 0.00 0.06 0.00 0.00 54.13 52.69 1v5m s LEU 24 Cb -0.19 -0.13 -0.04 0.00 -0.56 0.00 0.00 46.19 45.27 1v5m s LEU 24 CO -0.14 -0.80 0.22 -0.13 -1.06 0.00 0.00 176.35 174.44 1v5m s ARG 25 N -3.83 3.58 0.23 1.48 0.52 -1.22 -1.27 118.95 118.44 1v5m s ARG 25 Ca 0.32 0.02 0.09 0.00 -0.52 0.00 0.00 55.73 55.64 1v5m s ARG 25 Cb 0.06 -3.20 -0.05 0.00 0.52 0.00 0.00 34.95 32.28 1v5m s ARG 25 CO 0.15 0.75 -0.16 -0.59 0.02 0.00 0.00 175.30 175.48 1v5m s PHE 26 N -1.04 1.91 0.07 -0.53 -0.71 -0.88 -0.96 117.98 115.84 1v5m s PHE 26 Ca 0.17 -0.51 -0.22 0.00 -1.04 0.00 0.00 56.93 55.34 1v5m s PHE 26 Cb -0.13 -0.88 0.05 0.00 -1.21 0.00 0.00 43.02 40.85 1v5m s PHE 26 CO 0.07 0.47 0.53 0.00 -1.34 0.00 0.00 175.22 174.95 1v5m s MET 27 N -3.61 1.08 -0.09 1.99 0.23 -0.19 -2.75 119.30 115.97 1v5m s MET 27 Ca 0.25 -0.29 0.02 0.00 -1.03 0.00 0.00 55.69 54.64 1v5m s MET 27 Cb -0.02 0.50 -0.02 0.00 -1.53 0.00 0.00 34.83 33.76 1v5m s MET 27 CO 0.10 -0.41 -0.16 0.08 -2.03 0.00 0.00 175.02 172.60 1v5m s VAL 28 N -2.73 2.89 -0.52 5.16 1.01 -1.26 0.32 120.40 125.26 1v5m s VAL 28 Ca -0.04 -0.75 -0.28 0.00 0.00 0.00 0.00 61.98 60.91 1v5m s VAL 28 Cb -0.00 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 34.23 1v5m s VAL 28 CO -0.04 0.56 1.47 0.00 0.00 0.00 0.00 175.10 177.09 1v5m s ALA 29 N -0.13 2.82 0.02 5.51 0.00 -1.20 -4.96 121.76 123.81 1v5m s ALA 29 Ca -0.02 -0.51 -0.10 0.00 0.00 0.00 0.00 51.96 51.33 1v5m s ALA 29 Cb -0.14 -4.08 0.01 0.00 0.00 0.00 0.00 23.12 18.91 1v5m s ALA 29 CO 0.04 -2.87 0.21 0.34 0.00 0.00 0.00 175.76 173.48 1v5m s ASP 30 N 4.69 -0.03 -0.37 0.00 2.15 -1.26 -4.80 116.67 117.04 1v5m s ASP 30 Ca 0.57 -0.21 -0.08 0.00 0.43 0.00 0.00 52.55 53.26 1v5m s ASP 30 Cb -0.12 0.28 0.05 0.00 -0.30 0.00 0.00 42.92 42.82 1v5m s ASP 30 CO 0.27 -0.49 0.17 -1.81 -0.17 0.00 0.00 175.17 173.14 1v5m s ASP 31 N -1.73 5.51 0.02 -0.34 1.01 -1.26 -5.07 116.67 114.82 1v5m s ASP 31 Ca -0.10 -1.19 -0.06 0.00 0.71 0.00 0.00 52.55 51.91 1v5m s ASP 31 Cb -0.04 -1.94 -0.01 0.00 1.01 0.00 0.00 42.92 41.95 1v5m s ASP 31 CO -0.01 -0.39 0.10 0.00 0.21 0.00 0.00 175.17 175.09 1v5m s ALA 32 N 1.45 -0.17 -0.54 5.23 0.00 -1.26 -5.09 121.76 121.38 1v5m s ALA 32 Ca 0.01 -0.36 -0.28 0.00 0.00 0.00 0.00 51.96 51.33 1v5m s ALA 32 Cb -0.20 0.18 -0.10 0.00 0.00 0.00 0.00 23.12 23.00 1v5m s ALA 32 CO 0.04 -0.25 2.43 0.00 0.00 0.00 0.00 175.76 177.97 1v5m n ALA 33 N 1.15 0.82 -2.73 0.00 0.00 -1.26 -4.93 120.51 113.57 1v5m n ALA 33 Ca -0.21 -0.70 -0.31 0.00 0.00 0.00 0.00 53.44 52.22 1v5m n ALA 33 Cb 0.57 -2.98 -0.07 0.00 0.00 0.00 0.00 19.45 16.97 1v5m n ALA 33 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1v5m s SER 34 N 10.95 5.33 0.00 0.00 1.04 -1.26 -5.11 113.70 124.64 1v5m s SER 34 Ca 1.06 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 57.46 1v5m s SER 34 Cb -0.43 -1.40 0.00 0.00 0.10 0.00 0.00 66.02 64.30 1v5m s SER 34 CO 0.33 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.37 1v5m n GLY 35 N 0.80 5.34 3.58 7.32 0.00 -1.26 -5.08 105.19 115.89 1v5m n GLY 35 Ca -0.11 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.06 1v5m n GLY 35 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5m s PRO 36 N 1.94 3.08 0.04 1.61 0.04 -1.26 -4.79 135.00 135.66 1v5m s PRO 36 Ca 0.00 1.01 -0.03 0.00 0.04 0.00 0.00 61.00 62.02 1v5m s PRO 36 Cb 0.00 -4.25 -0.01 0.00 0.04 0.00 0.00 34.50 30.28 1v5m s PRO 36 CO 0.00 -2.17 -0.06 0.41 0.04 0.00 0.00 177.00 175.22 1v5m n GLY 37 N 5.48 -0.13 0.00 0.56 0.00 -1.26 -5.14 105.19 104.71 1v5m n GLY 37 Ca 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 3.09 0.51 3.15 -0.02 0.00 -1.26 -5.09 105.19 105.57 1v5m n GLY 38 Ca -0.03 -1.02 -0.40 0.00 0.00 0.00 0.00 46.02 44.57 1v5m n GLY 38 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1v5m n THR 39 N 0.00 0.62 -1.58 2.61 -1.04 -1.26 -4.77 114.28 108.86 1v5m n THR 39 Ca 0.00 -0.48 -0.42 0.00 -2.04 0.00 0.00 64.05 61.11 1v5m n THR 39 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1v5m n THR 39 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1v5m n ALA 40 N -0.97 -0.17 -0.43 2.41 0.00 -1.26 -4.79 120.51 115.30 1v5m n ALA 40 Ca 0.11 0.27 0.36 0.00 0.00 0.00 0.00 53.44 54.18 1v5m n ALA 40 Cb 0.38 -2.02 0.63 0.00 0.00 0.00 0.00 19.45 18.44 1v5m n ALA 40 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1v5m h GLN 41 N 1.59 0.10 -4.45 0.00 -0.00 -2.00 -3.42 115.11 106.93 1v5m h GLN 41 Ca -0.42 -0.01 -0.58 0.00 -0.00 0.00 0.00 58.65 57.64 1v5m h GLN 41 Cb 1.35 -0.02 0.04 0.00 0.00 0.00 0.00 27.48 28.85 1v5m h GLN 41 CO 0.57 0.06 0.01 0.91 0.00 0.00 0.00 178.83 180.38 1v5m n TRP 42 N -4.74 0.40 -4.63 3.99 7.02 -1.26 -4.93 117.44 113.29 1v5m n TRP 42 Ca 0.37 0.78 -0.33 0.00 -1.02 0.00 0.00 57.50 57.30 1v5m n TRP 42 Cb 1.39 -1.54 -0.16 0.00 -2.42 0.00 0.00 31.31 28.57 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 -0.07 3.06 0.15 -0.99 -0.21 -1.11 -4.95 119.66 115.55 1v5m s GLN 43 Ca 0.66 -0.83 -0.34 0.00 0.02 0.00 0.00 55.36 54.87 1v5m s GLN 43 Cb -0.92 -2.47 -0.14 0.00 1.00 0.00 0.00 33.01 30.48 1v5m s GLN 43 CO 0.42 -0.01 1.60 1.63 -2.12 0.00 0.00 175.29 176.81 1v5m n LYS 44 N 4.08 2.18 -3.75 2.91 5.02 -1.26 -2.07 118.16 125.26 1v5m n LYS 44 Ca -0.20 0.79 -0.10 0.00 -2.02 0.00 0.00 58.31 56.78 1v5m n LYS 44 Cb 0.52 -2.56 -0.04 0.00 -0.02 0.00 0.00 35.03 32.92 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 -3.88 3.04 -0.32 0.00 3.52 -0.23 -1.38 118.95 119.70 1v5m s ARG 46 Ca 0.10 -0.81 -0.19 0.00 -0.13 0.00 0.00 55.73 54.69 1v5m s ARG 46 Cb -0.01 -2.73 -0.01 0.00 -1.56 0.00 0.00 34.95 30.64 1v5m s ARG 46 CO -0.02 -0.24 0.59 -1.17 -0.81 0.00 0.00 175.30 173.64 1v5m s LEU 47 N 1.33 4.21 -0.25 -0.88 2.96 -0.76 -1.91 118.68 123.38 1v5m s LEU 47 Ca 0.04 0.26 0.02 0.00 -0.22 0.00 0.00 54.13 54.23 1v5m s LEU 47 Cb -0.14 -2.73 0.05 0.00 0.50 0.00 0.00 46.19 43.87 1v5m s LEU 47 CO -0.09 -0.48 -0.12 -0.22 -1.32 0.00 0.00 176.35 174.11 1v5m s LEU 48 N 2.54 3.27 -0.39 -0.68 2.96 -1.10 -2.00 118.68 123.28 1v5m s LEU 48 Ca 0.23 -1.28 -0.15 0.00 -0.22 0.00 0.00 54.13 52.71 1v5m s LEU 48 Cb -0.15 -1.55 0.01 0.00 0.50 0.00 0.00 46.19 45.00 1v5m s LEU 48 CO 0.13 -0.16 0.33 -0.22 -1.32 0.00 0.00 176.35 175.11 1v5m s LEU 49 N 1.14 4.82 -0.02 -0.68 0.20 -0.59 -3.19 118.68 120.36 1v5m s LEU 49 Ca -0.07 -0.64 -0.05 0.00 0.69 0.00 0.00 54.13 54.07 1v5m s LEU 49 Cb -0.19 -2.24 0.00 0.00 -0.43 0.00 0.00 46.19 43.33 1v5m s LEU 49 CO -0.06 -0.42 0.11 0.00 -0.29 0.00 0.00 176.35 175.69 1v5m s ARG 50 N 1.86 0.31 0.37 1.98 1.70 -1.25 -1.88 118.95 122.05 1v5m s ARG 50 Ca 0.08 -0.18 -0.27 0.00 -0.47 0.00 0.00 55.73 54.90 1v5m s ARG 50 Cb -0.18 0.13 -0.09 0.00 -0.57 0.00 0.00 34.95 34.24 1v5m s ARG 50 CO 0.11 -0.06 1.26 -0.98 -1.08 0.00 0.00 175.30 174.55 1v5m s ARG 51 N -0.76 4.15 0.51 3.89 1.70 -1.25 -2.62 118.95 124.56 1v5m s ARG 51 Ca -0.08 2.07 -0.08 0.00 -0.47 0.00 0.00 55.73 57.17 1v5m s ARG 51 Cb -0.05 -2.86 -0.04 0.00 -0.57 0.00 0.00 34.95 31.43 1v5m s ARG 51 CO 0.01 -0.31 0.86 0.00 -1.08 0.00 0.00 175.30 174.77 1v5m s ALA 52 N -1.26 3.30 0.07 7.88 0.00 0.16 -4.84 121.76 127.08 1v5m s ALA 52 Ca 0.54 -0.31 0.09 0.00 0.00 0.00 0.00 51.96 52.27 1v5m s ALA 52 Cb -0.36 -2.77 -0.03 0.00 0.00 0.00 0.00 23.12 19.96 1v5m s ALA 52 CO 0.47 -0.38 -0.24 0.14 0.00 0.00 0.00 175.76 175.75 1v5m s VAL 53 N -2.80 1.95 -1.56 0.00 -7.23 -1.26 -4.74 120.40 104.76 1v5m s VAL 53 Ca 0.51 -1.45 -0.11 0.00 -1.81 0.00 0.00 61.98 59.12 1v5m s VAL 53 Cb -0.10 -1.71 0.09 0.00 0.56 0.00 0.00 36.38 35.21 1v5m s VAL 53 CO 0.45 0.18 0.67 0.00 -0.31 0.00 0.00 175.10 176.08 1v5m n ALA 54 N 1.47 -1.56 -2.00 1.32 0.00 -1.26 -4.72 120.51 113.76 1v5m n ALA 54 Ca -0.18 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1v5m n ALA 54 Cb 0.53 -2.84 0.00 0.00 0.00 0.00 0.00 19.45 17.14 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 -1.67 0.60 3.72 0.00 0.00 -1.26 -5.16 105.19 101.42 1v5m n GLY 55 Ca -0.08 0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 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 3.82 0.84 0.02 1.61 2.56 -1.26 -5.00 118.70 121.29 1v5m s GLU 56 Ca 0.00 0.52 -0.17 0.00 0.00 0.00 0.00 54.97 55.32 1v5m s GLU 56 Cb 0.00 -1.79 -0.10 0.00 2.00 0.00 0.00 34.13 34.25 1v5m s GLU 56 CO 0.00 -2.45 1.14 0.00 -0.56 0.00 0.00 175.26 173.39 1v5m h ARG 57 N -1.69 -0.60 -5.17 4.30 3.08 -1.99 -3.36 114.38 108.95 1v5m h ARG 57 Ca -0.52 0.04 -0.54 0.00 0.07 0.00 0.00 59.98 59.03 1v5m h ARG 57 Cb 1.32 0.14 -0.13 0.00 0.08 0.00 0.00 29.97 31.37 1v5m h ARG 57 CO 0.58 -0.40 -0.56 -0.06 -1.07 0.00 0.00 179.97 178.46 1v5m s PHE 58 N -4.15 1.91 -0.26 3.04 0.40 -1.26 0.39 117.98 118.04 1v5m s PHE 58 Ca -0.09 -1.07 -0.14 0.00 -0.60 0.00 0.00 56.93 55.03 1v5m s PHE 58 Cb 0.01 -1.29 0.09 0.00 0.51 0.00 0.00 43.02 42.33 1v5m s PHE 58 CO 0.27 -0.07 0.63 0.50 0.70 0.00 0.00 175.22 177.25 1v5m s ARG 59 N -3.81 0.62 -0.00 0.44 3.52 -1.08 -1.12 118.95 117.53 1v5m s ARG 59 Ca 0.28 1.20 -0.14 0.00 -0.13 0.00 0.00 55.73 56.94 1v5m s ARG 59 Cb 0.06 0.25 -0.06 0.00 -1.56 0.00 0.00 34.95 33.64 1v5m s ARG 59 CO 0.14 -0.16 0.39 -0.51 -0.81 0.00 0.00 175.30 174.34 1v5m s LEU 60 N 1.86 4.46 -0.12 -0.88 2.01 0.30 -3.86 118.68 122.45 1v5m s LEU 60 Ca -0.09 0.91 0.01 0.00 0.01 0.00 0.00 54.13 54.97 1v5m s LEU 60 Cb -0.07 -2.59 0.02 0.00 0.01 0.00 0.00 46.19 43.56 1v5m s LEU 60 CO -0.18 0.32 -0.13 -1.61 1.01 0.00 0.00 176.35 175.76 1v5m s GLU 61 N -1.16 2.01 -0.72 1.70 2.02 -1.19 -0.58 118.70 120.78 1v5m s GLU 61 Ca 0.24 -0.47 -0.10 0.00 0.02 0.00 0.00 54.97 54.66 1v5m s GLU 61 Cb -0.16 -1.83 0.19 0.00 0.10 0.00 0.00 34.13 32.42 1v5m s GLU 61 CO 0.13 -0.16 0.62 -0.06 0.02 0.00 0.00 175.26 175.80 1v5m s PHE 62 N 1.31 3.60 -0.46 1.61 0.40 -1.20 -2.73 117.98 120.51 1v5m s PHE 62 Ca -0.01 -2.16 -0.28 0.00 -0.60 0.00 0.00 56.93 53.88 1v5m s PHE 62 Cb -0.14 -3.60 -0.01 0.00 0.51 0.00 0.00 43.02 39.78 1v5m s PHE 62 CO -0.06 -0.95 1.65 -0.06 0.70 0.00 0.00 175.22 176.50 1v5m s PHE 63 N 0.27 2.00 -0.24 0.36 0.08 -0.80 -1.14 117.98 118.51 1v5m s PHE 63 Ca 0.16 0.64 0.00 0.00 0.12 0.00 0.00 56.93 57.85 1v5m s PHE 63 Cb -0.16 -4.21 0.06 0.00 -0.57 0.00 0.00 43.02 38.14 1v5m s PHE 63 CO -0.06 -2.40 -0.04 0.08 -0.10 0.00 0.00 175.22 172.71 1v5m s VAL 64 N 6.88 1.44 1.02 -0.44 1.01 -1.26 -0.79 120.40 128.27 1v5m s VAL 64 Ca 0.67 -1.21 -0.13 0.00 0.00 0.00 0.00 61.98 61.32 1v5m s VAL 64 Cb -0.16 -1.75 0.20 0.00 0.00 0.00 0.00 36.38 34.67 1v5m s VAL 64 CO 0.29 -0.15 1.09 -2.16 0.00 0.00 0.00 175.10 174.17 1v5m s PRO 65 N 1.43 0.21 0.00 2.72 0.04 -1.26 -4.65 135.00 133.49 1v5m s PRO 65 Ca -0.04 0.45 0.09 0.00 0.04 0.00 0.00 61.00 61.54 1v5m s PRO 65 Cb -0.19 -1.72 0.56 0.00 0.04 0.00 0.00 34.50 33.19 1v5m s PRO 65 CO -0.07 -2.86 1.00 -0.35 0.04 0.00 0.00 177.00 174.76 1v5m n PRO 66 N -4.26 0.49 -0.02 0.56 -0.04 0.03 -1.76 135.00 130.00 1v5m n PRO 66 Ca 0.05 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.52 1v5m n PRO 66 Cb 0.58 -1.30 0.02 0.00 -0.04 0.00 0.00 33.50 32.76 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 -0.80 2.94 -1.04 0.54 5.02 -1.26 -4.73 118.16 118.83 1v5m n LYS 67 Ca 0.07 -1.59 -0.21 0.00 -2.02 0.00 0.00 58.31 54.56 1v5m n LYS 67 Cb 0.03 -1.04 0.16 0.00 -0.02 0.00 0.00 35.03 34.16 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 -0.42 -1.78 -0.08 7.82 0.00 -0.72 -5.01 120.51 120.31 1v5m n ALA 68 Ca 0.02 -1.20 -0.06 0.00 0.00 0.00 0.00 53.44 52.20 1v5m n ALA 68 Cb 0.28 -0.07 -0.16 0.00 0.00 0.00 0.00 19.45 19.50 1v5m n ALA 68 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1v5m n SER 69 N -3.98 0.08 -4.14 0.00 3.41 -1.26 -4.98 113.62 102.75 1v5m n SER 69 Ca 0.11 0.04 -0.17 0.00 -0.26 0.00 0.00 58.87 58.59 1v5m n SER 69 Cb 0.42 1.06 -0.12 0.00 -0.26 0.00 0.00 64.21 65.31 1v5m n SER 69 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1v5m s ARG 70 N -2.67 0.75 0.28 4.33 1.81 -1.26 -5.13 118.95 117.05 1v5m s ARG 70 Ca -0.09 -0.89 -0.29 0.00 -1.72 0.00 0.00 55.73 52.73 1v5m s ARG 70 Cb 0.07 -0.70 -0.10 0.00 -0.45 0.00 0.00 34.95 33.78 1v5m s ARG 70 CO 0.84 0.15 1.25 -1.25 -0.68 0.00 0.00 175.30 175.61 1v5m s PRO 71 N -1.66 4.44 -0.15 3.54 0.04 -1.26 -4.53 135.00 135.42 1v5m s PRO 71 Ca -0.04 2.05 -0.28 0.00 0.04 0.00 0.00 61.00 62.78 1v5m s PRO 71 Cb -0.10 -3.14 -0.25 0.00 0.04 0.00 0.00 34.50 31.05 1v5m s PRO 71 CO 0.02 -0.10 0.70 -0.22 0.04 0.00 0.00 177.00 177.44 1v5m h LYS 72 N 4.13 0.00 -2.37 4.56 3.64 -1.40 -3.40 116.57 121.73 1v5m h LYS 72 Ca -0.47 -0.00 -0.65 0.00 -1.27 0.00 0.00 60.65 58.25 1v5m h LYS 72 Cb 1.22 0.00 -0.38 0.00 -0.41 0.00 0.00 32.23 32.66 1v5m h LYS 72 CO 0.69 1.00 -0.24 0.28 -2.27 0.00 0.00 179.45 178.91 1v5m n VAL 73 N -4.58 3.14 -2.55 2.00 0.31 -1.15 -5.00 118.33 110.49 1v5m n VAL 73 Ca -0.13 -5.41 -0.41 0.00 -0.01 0.00 0.00 64.34 58.38 1v5m n VAL 73 Cb 0.51 -2.09 -0.03 0.00 -0.91 0.00 0.00 33.84 31.32 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 -2.33 6.17 -0.08 4.52 1.04 -1.26 -3.24 113.70 118.52 1v5m s SER 74 Ca 0.38 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.37 1v5m s SER 74 Cb 0.13 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.66 1v5m s SER 74 CO 0.02 -1.83 -0.07 -0.63 0.98 0.00 0.00 173.24 171.71 1v5m s ILE 75 N 5.72 3.68 0.55 -1.02 1.01 0.25 -4.96 121.20 126.43 1v5m s ILE 75 Ca 0.35 -0.48 -0.19 0.00 0.00 0.00 0.00 60.65 60.33 1v5m s ILE 75 Cb -0.08 -2.51 -0.05 0.00 0.01 0.00 0.00 42.46 39.82 1v5m s ILE 75 CO 0.15 0.59 1.13 -2.16 0.00 0.00 0.00 174.94 174.65 1v5m s PRO 76 N -0.66 3.32 0.41 2.79 0.04 -1.26 0.11 135.00 139.74 1v5m s PRO 76 Ca 0.10 1.59 0.14 0.00 0.04 0.00 0.00 61.00 62.87 1v5m s PRO 76 Cb -0.11 -2.00 0.87 0.00 0.04 0.00 0.00 34.50 33.29 1v5m s PRO 76 CO 0.02 -0.88 1.91 1.25 0.04 0.00 0.00 177.00 179.34 1v5m h LEU 77 N 1.11 0.00 -1.10 -3.56 7.12 -1.43 -2.54 115.31 114.91 1v5m h LEU 77 Ca -0.50 0.00 -0.06 0.00 0.13 0.00 0.00 57.88 57.45 1v5m h LEU 77 Cb 1.26 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 41.37 1v5m h LEU 77 CO 0.57 0.28 -0.03 -1.28 -0.13 0.00 0.00 178.44 177.84 1v5m h SER 78 N 0.00 0.57 -0.90 1.25 0.87 -1.93 -2.76 113.55 110.65 1v5m h SER 78 Ca -0.00 -0.13 0.11 0.00 -1.23 0.00 0.00 61.79 60.54 1v5m h SER 78 Cb 0.50 -0.15 -0.08 0.00 -0.44 0.00 0.00 62.40 62.23 1v5m h SER 78 CO 0.04 0.66 0.53 0.00 -0.53 0.00 0.00 176.83 177.53 1v5m h ALA 79 N 1.41 1.32 -2.50 6.23 0.00 -1.83 -3.42 119.26 120.46 1v5m h ALA 79 Ca 0.11 0.03 -0.54 0.00 0.00 0.00 0.00 54.91 54.52 1v5m h ALA 79 Cb 0.41 -0.15 0.05 0.00 0.00 0.00 0.00 17.79 18.10 1v5m h ALA 79 CO 0.02 0.13 1.00 -0.89 0.00 0.00 0.00 179.25 179.51 1v5m n ILE 80 N -4.71 0.12 -0.01 0.00 2.08 -1.04 -0.45 119.36 115.36 1v5m n ILE 80 Ca 0.16 -0.02 -0.01 0.00 0.56 0.00 0.00 62.75 63.44 1v5m n ILE 80 Cb 0.32 -1.92 -0.01 0.00 -0.75 0.00 0.00 39.64 37.28 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 4.10 0.08 -3.72 1.39 -5.35 -0.82 -4.89 119.36 110.14 1v5m n ILE 81 Ca 0.17 -0.05 -0.14 0.00 -0.27 0.00 0.00 62.75 62.47 1v5m n ILE 81 Cb 0.34 -0.96 -0.09 0.00 -1.74 0.00 0.00 39.64 37.19 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 -2.03 0.59 -0.19 6.28 -6.30 -1.15 -5.08 118.70 110.83 1v5m s GLU 82 Ca -0.01 0.38 -0.01 0.00 -2.50 0.00 0.00 54.97 52.84 1v5m s GLU 82 Cb 0.00 0.28 0.05 0.00 0.00 0.00 0.00 34.13 34.46 1v5m s GLU 82 CO 0.05 -0.11 -0.04 0.54 0.02 0.00 0.00 175.26 175.72 1v5m s VAL 83 N -0.27 1.11 0.63 3.70 0.11 -1.26 -1.73 120.40 122.69 1v5m s VAL 83 Ca -0.04 -0.76 -0.15 0.00 -2.93 0.00 0.00 61.98 58.10 1v5m s VAL 83 Cb -0.03 -1.37 -0.02 0.00 -1.53 0.00 0.00 36.38 33.43 1v5m s VAL 83 CO 0.02 0.01 1.07 -0.13 -3.33 0.00 0.00 175.10 172.74 1v5m s ARG 84 N 1.61 3.12 -0.05 1.54 1.81 -0.69 -4.92 118.95 121.39 1v5m s ARG 84 Ca -0.01 1.19 0.16 0.00 -1.72 0.00 0.00 55.73 55.35 1v5m s ARG 84 Cb -0.16 -2.01 0.30 0.00 -0.45 0.00 0.00 34.95 32.63 1v5m s ARG 84 CO -0.07 -0.97 1.13 0.25 -0.68 0.00 0.00 175.30 174.96 1v5m n THR 85 N -2.35 0.53 -3.92 0.02 -2.24 -1.26 -3.17 114.28 101.89 1v5m n THR 85 Ca 0.09 -1.21 -0.09 0.00 -2.27 0.00 0.00 64.05 60.57 1v5m n THR 85 Cb 0.53 0.56 -0.05 0.00 -2.10 0.00 0.00 70.33 69.27 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 -0.78 0.01 0.13 4.28 -1.32 -1.26 -5.01 115.64 111.69 1v5m s THR 86 Ca 0.25 -1.21 0.05 0.00 -1.21 0.00 0.00 61.69 59.58 1v5m s THR 86 Cb 0.27 -1.98 -0.04 0.00 -1.51 0.00 0.00 72.50 69.24 1v5m s THR 86 CO -0.09 -0.07 -0.12 -0.04 -2.21 0.00 0.00 174.62 172.09 1v5m s MET 87 N -3.97 1.00 0.00 7.08 1.00 -1.26 -4.88 119.30 118.27 1v5m s MET 87 Ca 0.17 -1.29 0.00 0.00 0.00 0.00 0.00 55.69 54.58 1v5m s MET 87 Cb -0.01 -0.74 0.00 0.00 0.00 0.00 0.00 34.83 34.09 1v5m s MET 87 CO 0.05 0.12 0.00 -0.35 0.00 0.00 0.00 175.02 174.84 1v5m n PRO 88 N 0.31 0.50 -0.75 2.03 -0.04 -1.26 -4.78 135.00 131.01 1v5m n PRO 88 Ca -0.14 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.23 1v5m n PRO 88 Cb 0.58 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.92 1v5m n PRO 88 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1v5m n LEU 89 N 0.00 3.98 0.00 1.53 7.99 -1.26 -3.22 117.00 126.02 1v5m n LEU 89 Ca 0.00 -2.52 0.00 0.00 -0.01 0.00 0.00 56.01 53.48 1v5m n LEU 89 Cb 0.00 -1.07 0.00 0.00 -0.11 0.00 0.00 43.42 42.24 1v5m n LEU 89 CO 0.00 1.16 -0.15 -1.84 -1.51 0.00 0.00 177.39 175.05 1v5m n GLU 90 N 2.60 0.00 -2.52 3.23 0.28 -1.26 -5.08 120.64 117.88 1v5m n GLU 90 Ca 0.32 0.00 -0.41 0.00 -0.16 0.00 0.00 57.16 56.91 1v5m n GLU 90 Cb 0.69 -0.53 -0.04 0.00 1.43 0.00 0.00 31.44 32.99 1v5m n GLU 90 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 177.13 178.38 1v5m s MET 91 N -1.47 4.64 0.00 3.44 1.75 -1.20 -4.90 119.30 121.56 1v5m s MET 91 Ca 0.00 1.73 0.00 0.00 -1.25 0.00 0.00 55.69 56.17 1v5m s MET 91 Cb 0.00 -3.25 0.00 0.00 2.84 0.00 0.00 34.83 34.42 1v5m s MET 91 CO 0.00 0.17 0.31 -0.35 -0.65 0.00 0.00 175.02 174.51 1v5m n PRO 92 N 1.85 0.49 -2.21 4.11 -0.04 -1.26 -4.73 135.00 133.21 1v5m n PRO 92 Ca 0.01 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.42 1v5m n PRO 92 Cb 0.46 -1.17 0.02 0.00 -0.04 0.00 0.00 33.50 32.77 1v5m n PRO 92 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1v5m n GLU 93 N 0.04 -1.27 -3.66 0.54 4.07 -1.26 -5.03 120.64 114.06 1v5m n GLU 93 Ca 0.00 0.25 -0.38 0.00 -0.06 0.00 0.00 57.16 56.96 1v5m n GLU 93 Cb 0.09 -3.11 -0.12 0.00 -0.06 0.00 0.00 31.44 28.24 1v5m n GLU 93 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1v5m s LYS 94 N -3.89 3.39 0.00 5.31 -0.14 -1.26 -4.97 119.74 118.17 1v5m s LYS 94 Ca 0.07 -0.68 -0.03 0.00 -1.36 0.00 0.00 55.97 53.97 1v5m s LYS 94 Cb -0.01 -3.54 -0.12 0.00 -1.68 0.00 0.00 37.83 32.48 1v5m s LYS 94 CO 0.21 -0.38 2.59 -3.47 -0.76 0.00 0.00 175.35 173.53 1v5m n ASP 95 N 4.98 4.82 -2.17 2.83 2.03 -1.26 -3.83 116.55 123.95 1v5m n ASP 95 Ca -0.14 -2.34 -0.02 0.00 0.52 0.00 0.00 54.79 52.81 1v5m n ASP 95 Cb 0.49 -1.16 0.05 0.00 -0.72 0.00 0.00 41.12 39.78 1v5m n ASP 95 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1v5m n ASN 96 N 2.04 2.00 -3.67 1.67 6.94 -1.26 -3.49 115.26 119.49 1v5m n ASN 96 Ca 0.20 -2.46 -0.12 0.00 -0.02 0.00 0.00 54.58 52.17 1v5m n ASN 96 Cb 0.65 -0.42 -0.06 0.00 -2.36 0.00 0.00 39.78 37.59 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 -2.93 0.06 -0.16 5.53 -4.23 -1.25 -2.55 115.64 110.11 1v5m s THR 97 Ca 0.34 -0.49 -0.28 0.00 -1.18 0.00 0.00 61.69 60.08 1v5m s THR 97 Cb 0.36 -0.96 0.07 0.00 1.34 0.00 0.00 72.50 73.30 1v5m s THR 97 CO -0.06 -0.27 0.69 0.72 -0.54 0.00 0.00 174.62 175.16 1v5m s PHE 98 N -2.56 -0.72 -0.21 3.99 -0.12 -1.14 -4.65 117.98 112.56 1v5m s PHE 98 Ca -0.05 1.52 -0.10 0.00 -0.05 0.00 0.00 56.93 58.25 1v5m s PHE 98 Cb -0.01 0.34 -0.05 0.00 -0.63 0.00 0.00 43.02 42.67 1v5m s PHE 98 CO -0.03 -0.49 0.14 0.08 -0.05 0.00 0.00 175.22 174.87 1v5m s VAL 99 N -0.40 5.37 -0.48 -2.49 1.01 -1.19 -2.28 120.40 119.93 1v5m s VAL 99 Ca -0.05 0.18 -0.16 0.00 0.00 0.00 0.00 61.98 61.95 1v5m s VAL 99 Cb -0.03 -3.47 0.08 0.00 0.00 0.00 0.00 36.38 32.97 1v5m s VAL 99 CO 0.05 0.41 0.42 -0.76 0.00 0.00 0.00 175.10 175.22 1v5m s LEU 100 N 0.60 5.67 -0.46 3.92 1.43 -1.04 -1.70 118.68 127.10 1v5m s LEU 100 Ca 0.08 -1.37 -0.18 0.00 -1.03 0.00 0.00 54.13 51.63 1v5m s LEU 100 Cb -0.12 -2.20 0.04 0.00 0.03 0.00 0.00 46.19 43.95 1v5m s LEU 100 CO 0.00 -0.68 0.53 -0.75 0.23 0.00 0.00 176.35 175.69 1v5m s LYS 101 N 1.68 3.12 0.79 1.70 2.20 -0.70 -1.99 119.74 126.53 1v5m s LYS 101 Ca 0.04 -0.83 -0.06 0.00 -0.36 0.00 0.00 55.97 54.76 1v5m s LYS 101 Cb -0.25 -4.04 0.14 0.00 -1.51 0.00 0.00 37.83 32.17 1v5m s LYS 101 CO 0.06 -1.04 1.09 0.14 -0.36 0.00 0.00 175.35 175.25 1v5m s VAL 102 N 2.37 2.13 0.14 4.02 -7.23 -0.96 -1.95 120.40 118.91 1v5m s VAL 102 Ca 0.14 -0.36 0.30 0.00 -1.81 0.00 0.00 61.98 60.24 1v5m s VAL 102 Cb -0.18 -2.77 0.33 0.00 0.56 0.00 0.00 36.38 34.31 1v5m s VAL 102 CO 0.13 0.00 1.93 1.05 -0.31 0.00 0.00 175.10 177.90 1v5m h GLU 103 N -0.87 0.00 -1.12 4.82 -0.00 -1.10 -2.90 114.58 113.41 1v5m h GLU 103 Ca -0.40 0.00 -0.23 0.00 -0.00 0.00 0.00 59.36 58.72 1v5m h GLU 103 Cb 1.27 0.00 -0.13 0.00 -0.00 0.00 0.00 28.75 29.89 1v5m h GLU 103 CO 0.43 0.09 0.30 -1.71 -0.00 0.00 0.00 179.01 178.12 1v5m n ASN 104 N -3.25 3.93 -3.95 3.06 5.15 -1.26 -4.88 115.26 114.07 1v5m n ASN 104 Ca 0.00 -2.74 -0.39 0.00 -0.60 0.00 0.00 54.58 50.85 1v5m n ASN 104 Cb 0.35 -0.73 0.02 0.00 -0.53 0.00 0.00 39.78 38.88 1v5m n ASN 104 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1v5m n GLY 105 N -0.06 -0.98 2.72 8.20 0.00 -1.09 -4.97 105.19 109.01 1v5m n GLY 105 Ca 0.25 0.42 -0.19 0.00 0.00 0.00 0.00 46.02 46.51 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 -3.37 0.13 -0.05 4.61 0.00 -1.26 -4.98 121.76 116.83 1v5m s ALA 106 Ca 0.36 0.29 -0.10 0.00 0.00 0.00 0.00 51.96 52.51 1v5m s ALA 106 Cb -0.19 -0.60 -0.05 0.00 0.00 0.00 0.00 23.12 22.29 1v5m s ALA 106 CO 0.94 -0.44 0.27 -1.21 0.00 0.00 0.00 175.76 175.32 1v5m s GLU 107 N 2.01 3.66 -0.36 0.00 2.02 -1.25 -2.27 118.70 122.50 1v5m s GLU 107 Ca 0.02 0.11 0.01 0.00 0.02 0.00 0.00 54.97 55.13 1v5m s GLU 107 Cb -0.12 -3.19 0.11 0.00 0.10 0.00 0.00 34.13 31.04 1v5m s GLU 107 CO -0.04 0.72 0.15 0.71 0.02 0.00 0.00 175.26 176.83 1v5m s TYR 108 N -1.09 1.88 -0.37 1.61 1.51 -0.84 -3.28 117.35 116.77 1v5m s TYR 108 Ca 0.20 -2.04 -0.29 0.00 -1.01 0.00 0.00 57.07 53.93 1v5m s TYR 108 Cb -0.14 -1.81 0.01 0.00 -0.11 0.00 0.00 41.96 39.91 1v5m s TYR 108 CO 0.10 -0.85 1.33 0.42 -1.11 0.00 0.00 175.55 175.44 1v5m s ILE 109 N 1.11 4.05 -0.09 2.71 1.01 0.15 -2.49 121.20 127.65 1v5m s ILE 109 Ca 0.13 1.13 -0.01 0.00 0.00 0.00 0.00 60.65 61.90 1v5m s ILE 109 Cb -0.20 -4.23 -0.03 0.00 0.01 0.00 0.00 42.46 38.01 1v5m s ILE 109 CO -0.14 -0.65 -0.04 -0.76 0.00 0.00 0.00 174.94 173.34 1v5m s LEU 110 N 4.83 3.30 -0.36 2.97 1.02 -0.97 -1.02 118.68 128.46 1v5m s LEU 110 Ca 0.57 0.00 -0.01 0.00 0.02 0.00 0.00 54.13 54.72 1v5m s LEU 110 Cb -0.14 -1.75 0.09 0.00 0.02 0.00 0.00 46.19 44.41 1v5m s LEU 110 CO 0.28 0.33 0.10 -0.70 0.02 0.00 0.00 176.35 176.38 1v5m s GLU 111 N -0.59 2.03 0.95 1.70 2.12 -0.13 -2.89 118.70 121.88 1v5m s GLU 111 Ca 0.09 -1.65 -0.15 0.00 0.36 0.00 0.00 54.97 53.62 1v5m s GLU 111 Cb -0.12 -3.36 0.20 0.00 0.26 0.00 0.00 34.13 31.12 1v5m s GLU 111 CO 0.02 -0.89 1.31 0.95 -0.54 0.00 0.00 175.26 176.10 1v5m s THR 112 N 1.12 2.01 0.05 -1.70 -4.23 -1.06 -3.39 115.64 108.44 1v5m s THR 112 Ca 0.04 -0.06 -0.19 0.00 -1.18 0.00 0.00 61.69 60.30 1v5m s THR 112 Cb -0.21 -2.95 -0.09 0.00 1.34 0.00 0.00 72.50 70.59 1v5m s THR 112 CO -0.04 0.00 1.30 0.40 -0.54 0.00 0.00 174.62 175.74 1v5m h ILE 113 N -1.59 0.00 -2.97 2.99 2.04 -1.89 -3.48 117.51 112.62 1v5m h ILE 113 Ca -0.43 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.31 1v5m h ILE 113 Cb 1.23 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1v5m h ILE 113 CO 0.36 0.00 -0.02 -0.90 0.00 0.00 0.00 178.15 177.58 1v5m n ASP 114 N -4.03 -0.87 0.11 1.72 5.75 -1.26 -5.01 116.55 112.95 1v5m n ASP 114 Ca -0.06 -2.00 0.18 0.00 -0.01 0.00 0.00 54.79 52.90 1v5m n ASP 114 Cb 0.24 1.56 0.74 0.00 -1.03 0.00 0.00 41.12 42.63 1v5m n ASP 114 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1v5m h SER 115 N 1.08 0.00 -0.72 -1.12 4.64 -1.92 0.15 113.55 115.66 1v5m h SER 115 Ca -0.16 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.13 1v5m h SER 115 Cb 0.66 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.71 1v5m h SER 115 CO 0.21 0.00 0.31 -0.07 -0.87 0.00 0.00 176.83 176.41 1v5m h LEU 116 N 0.00 0.97 0.13 5.97 3.38 -1.95 -1.01 115.31 122.80 1v5m h LEU 116 Ca 0.16 -0.16 -0.29 0.00 0.09 0.00 0.00 57.88 57.69 1v5m h LEU 116 Cb 0.72 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1v5m h LEU 116 CO -0.00 0.86 -1.44 1.56 0.09 0.00 0.00 178.44 179.51 1v5m h GLN 117 N 1.02 0.28 0.49 1.13 1.08 -1.50 -3.27 115.11 114.34 1v5m h GLN 117 Ca 0.24 -0.48 -0.02 0.00 -1.45 0.00 0.00 58.65 56.95 1v5m h GLN 117 Cb 0.17 0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.76 1v5m h GLN 117 CO -0.02 1.23 -0.46 -0.22 -0.95 0.00 0.00 178.83 178.40 1v5m h LYS 118 N -0.22 -0.91 -0.96 1.46 3.11 -0.78 -0.56 116.57 117.72 1v5m h LYS 118 Ca -0.30 0.06 0.24 0.00 -2.81 0.00 0.00 60.65 57.84 1v5m h LYS 118 Cb 1.82 0.21 -0.07 0.00 -1.00 0.00 0.00 32.23 33.19 1v5m h LYS 118 CO 0.09 -0.60 0.64 1.25 -2.81 0.00 0.00 179.45 178.01 1v5m h HIS 119 N -0.94 0.48 -0.42 1.91 2.76 -1.37 0.11 115.15 117.67 1v5m h HIS 119 Ca -0.06 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.03 1v5m h HIS 119 Cb 0.81 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.61 1v5m h HIS 119 CO -0.22 0.09 -0.09 0.77 -1.30 0.00 0.00 177.93 177.19 1v5m h SER 120 N 0.33 0.80 0.77 3.26 0.02 -1.41 -3.04 113.55 114.29 1v5m h SER 120 Ca 0.51 -0.36 -0.04 0.00 -0.84 0.00 0.00 61.79 61.06 1v5m h SER 120 Cb 1.39 -0.22 0.01 0.00 0.14 0.00 0.00 62.40 63.72 1v5m h SER 120 CO -0.18 0.97 -0.37 -0.50 -1.14 0.00 0.00 176.83 175.61 1v5m h TRP 121 N 0.62 -0.96 -0.99 3.45 4.06 0.75 -1.09 115.95 121.80 1v5m h TRP 121 Ca 0.11 -0.02 0.33 0.00 2.06 0.00 0.00 58.89 61.36 1v5m h TRP 121 Cb 0.61 0.32 -0.18 0.00 -1.00 0.00 0.00 29.16 28.91 1v5m h TRP 121 CO 0.05 -0.58 0.25 0.28 -3.56 0.00 0.00 178.44 174.88 1v5m h VAL 122 N -1.21 0.04 -0.20 1.49 2.07 -1.40 0.70 116.25 117.74 1v5m h VAL 122 Ca -0.11 -0.01 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 1v5m h VAL 122 Cb 0.81 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1v5m h VAL 122 CO 0.17 0.01 -0.35 0.00 0.02 0.00 0.00 177.57 177.41 1v5m h ALA 123 N 1.97 0.32 -0.37 1.67 0.00 -1.42 0.50 119.26 121.93 1v5m h ALA 123 Ca 0.70 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1v5m h ALA 123 Cb 1.62 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 1v5m h ALA 123 CO -0.84 0.38 0.18 -0.44 0.00 0.00 0.00 179.25 178.53 1v5m h ASP 124 N 0.28 0.45 0.29 0.00 3.32 0.16 0.61 116.42 121.53 1v5m h ASP 124 Ca 0.01 -0.03 -0.33 0.00 0.02 0.00 0.00 57.03 56.70 1v5m h ASP 124 Cb 0.95 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.37 1v5m h ASP 124 CO 0.08 0.39 -1.79 0.40 -1.72 0.00 0.00 179.24 176.61 1v5m h ILE 125 N 0.52 0.85 0.00 0.35 2.04 -0.41 -3.27 117.51 117.58 1v5m h ILE 125 Ca 0.13 -2.55 -0.09 0.00 1.00 0.00 0.00 64.86 63.35 1v5m h ILE 125 Cb 0.06 2.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.72 1v5m h ILE 125 CO -0.02 0.80 -0.41 1.56 0.00 0.00 0.00 178.15 180.07 1v5m h GLN 126 N 0.06 0.00 -0.02 2.37 1.08 0.25 -1.14 115.11 117.70 1v5m h GLN 126 Ca -0.34 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 56.66 1v5m h GLN 126 Cb 2.04 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 29.46 1v5m h GLN 126 CO 0.12 0.41 -0.84 0.78 -0.95 0.00 0.00 178.83 178.35 1v5m h GLY 127 N 2.33 0.34 0.00 3.46 0.00 0.10 -3.27 103.07 106.04 1v5m h GLY 127 Ca -0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 47.33 46.66 1v5m h GLY 127 CO 0.05 0.49 -0.64 0.00 0.00 0.00 0.00 176.54 176.45 1v5m n VAL 129 N -4.53 -0.41 -3.65 0.00 3.14 -0.44 -4.55 118.33 107.89 1v5m n VAL 129 Ca -0.20 2.05 -0.02 0.00 -2.96 0.00 0.00 64.34 63.21 1v5m n VAL 129 Cb 0.55 -3.17 -0.07 0.00 -1.06 0.00 0.00 33.84 30.10 1v5m n VAL 129 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 1v5m s ASP 130 N -4.77 -0.28 0.09 6.55 1.01 -1.23 -4.97 116.67 113.07 1v5m s ASP 130 Ca -0.11 0.47 -0.18 0.00 0.71 0.00 0.00 52.55 53.45 1v5m s ASP 130 Cb 0.31 0.94 -0.04 0.00 1.01 0.00 0.00 42.92 45.14 1v5m s ASP 130 CO 0.76 -0.08 0.91 -1.20 0.21 0.00 0.00 175.17 175.77 1v5m n SER 131 N 2.98 -0.60 0.00 0.27 7.64 -1.26 -4.57 113.62 118.08 1v5m n SER 131 Ca -0.16 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.76 1v5m n SER 131 Cb 0.57 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 1v5m n SER 131 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v5m n GLY 132 N -1.14 4.03 0.19 0.23 0.00 -1.26 -1.69 105.19 105.54 1v5m n GLY 132 Ca 0.01 0.16 0.04 0.00 0.00 0.00 0.00 46.02 46.23 1v5m n GLY 132 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v5m h PRO 133 N 0.00 0.00 -6.34 1.61 0.13 -1.88 -3.45 132.00 122.08 1v5m h PRO 133 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 1v5m h PRO 133 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 1v5m h PRO 133 CO 0.00 0.39 -0.28 -1.54 -0.23 0.00 0.00 178.00 176.34 1v5m s SER 134 N -6.65 5.32 -0.06 1.44 1.04 -0.68 -4.91 113.70 109.21 1v5m s SER 134 Ca -0.01 -0.63 0.05 0.00 0.48 0.00 0.00 55.95 55.84 1v5m s SER 134 Cb 0.13 -0.46 -0.01 0.00 0.10 0.00 0.00 66.02 65.78 1v5m s SER 134 CO 0.70 -0.81 -0.23 -0.55 0.98 0.00 0.00 173.24 173.33 1v5m s SER 135 N -4.31 3.24 0.00 7.02 0.15 -1.26 -4.58 113.70 113.96 1v5m s SER 135 Ca 0.52 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.71 1v5m s SER 135 Cb -0.07 -0.88 0.00 0.00 -1.71 0.00 0.00 66.02 63.36 1v5m s SER 135 CO 0.31 0.25 0.00 0.61 1.20 0.00 0.00 173.24 175.62