#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 5.24 -0.05 1.61 1.04 -1.26 -4.87 113.70 115.42 1v5m s SER 2 Ca 0.00 -1.38 -0.02 0.00 0.48 0.00 0.00 55.95 55.03 1v5m s SER 2 Cb 0.00 -2.58 0.03 0.00 0.10 0.00 0.00 66.02 63.58 1v5m s SER 2 CO 0.00 -2.79 0.08 -0.44 0.98 0.00 0.00 173.24 171.07 1v5m s SER 3 N 6.80 0.77 0.03 7.02 0.01 -1.26 -5.04 113.70 122.02 1v5m s SER 3 Ca 0.67 0.13 -0.18 0.00 1.31 0.00 0.00 55.95 57.88 1v5m s SER 3 Cb -0.02 -0.03 -0.22 0.00 0.21 0.00 0.00 66.02 65.95 1v5m s SER 3 CO 0.07 -0.22 1.14 1.23 0.41 0.00 0.00 173.24 175.88 1v5m h GLY 4 N 8.11 0.57 -0.60 3.44 0.00 -2.07 -3.34 103.07 109.19 1v5m h GLY 4 Ca -0.21 -0.95 0.06 0.00 0.00 0.00 0.00 47.33 46.23 1v5m h GLY 4 CO 0.23 0.84 -0.56 0.23 0.00 0.00 0.00 176.54 177.29 1v5m h SER 5 N 0.06 -1.93 -0.95 0.19 0.87 -2.00 -3.41 113.55 106.38 1v5m h SER 5 Ca -0.08 0.27 -0.64 0.00 -1.23 0.00 0.00 61.79 60.11 1v5m h SER 5 Cb 1.39 0.82 0.10 0.00 -0.44 0.00 0.00 62.40 64.27 1v5m h SER 5 CO 0.14 -0.35 -0.47 -1.20 -0.53 0.00 0.00 176.83 174.42 1v5m n SER 6 N -5.34 -1.13 -4.41 6.23 7.64 -1.25 -4.94 113.62 110.41 1v5m n SER 6 Ca -0.01 1.07 -0.33 0.00 1.01 0.00 0.00 58.87 60.61 1v5m n SER 6 Cb 0.32 -0.90 -0.14 0.00 -1.01 0.00 0.00 64.21 62.48 1v5m n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v5m s GLY 7 N -0.90 1.49 -0.28 0.23 0.00 -1.26 -5.06 107.32 101.53 1v5m s GLY 7 Ca 0.62 -0.98 -0.18 0.00 0.00 0.00 0.00 44.72 44.18 1v5m s GLY 7 CO 0.53 -0.63 0.87 0.54 0.00 0.00 0.00 173.10 174.41 1v5m s ASN 8 N -0.40 -0.66 0.31 1.64 4.22 -1.26 -5.18 114.94 113.61 1v5m s ASN 8 Ca 0.04 1.10 0.08 0.00 -2.14 0.00 0.00 52.86 51.94 1v5m s ASN 8 Cb -0.12 1.24 -0.04 0.00 1.28 0.00 0.00 41.25 43.61 1v5m s ASN 8 CO 0.02 -0.18 0.15 -0.76 -2.04 0.00 0.00 177.10 174.30 1v5m s LEU 9 N 1.23 3.42 0.06 3.54 2.01 -1.26 -5.10 118.68 122.58 1v5m s LEU 9 Ca -0.07 -0.59 -0.30 0.00 0.01 0.00 0.00 54.13 53.18 1v5m s LEU 9 Cb -0.04 -1.95 -0.05 0.00 0.01 0.00 0.00 46.19 44.16 1v5m s LEU 9 CO -0.14 -0.20 1.08 0.00 1.01 0.00 0.00 176.35 178.10 1v5m s ALA 10 N -2.32 3.29 -0.31 4.21 0.00 -1.26 -5.02 121.76 120.34 1v5m s ALA 10 Ca 0.36 0.71 0.01 0.00 0.00 0.00 0.00 51.96 53.04 1v5m s ALA 10 Cb -0.05 -3.38 0.08 0.00 0.00 0.00 0.00 23.12 19.77 1v5m s ALA 10 CO 0.23 -0.29 0.00 0.00 0.00 0.00 0.00 175.76 175.70 1v5m s ALA 11 N 0.77 2.79 -0.05 0.00 0.00 -1.26 -5.08 121.76 118.94 1v5m s ALA 11 Ca 0.54 -2.09 0.01 0.00 0.00 0.00 0.00 51.96 50.42 1v5m s ALA 11 Cb -0.26 -1.88 0.02 0.00 0.00 0.00 0.00 23.12 21.00 1v5m s ALA 11 CO 0.30 -1.43 -0.03 -1.59 0.00 0.00 0.00 175.76 173.00 1v5m s LYS 12 N 1.08 0.73 -0.00 0.00 -2.85 -1.26 -5.14 119.74 112.30 1v5m s LYS 12 Ca -0.00 -0.05 0.01 0.00 -1.00 0.00 0.00 55.97 54.93 1v5m s LYS 12 Cb -0.20 -0.81 -0.00 0.00 -2.06 0.00 0.00 37.83 34.76 1v5m s LYS 12 CO -0.05 -0.12 -0.03 0.54 0.10 0.00 0.00 175.35 175.79 1v5m s VAL 13 N 1.07 0.27 -0.46 1.79 0.11 -1.26 -5.11 120.40 116.81 1v5m s VAL 13 Ca -0.09 -0.15 -0.29 0.00 -2.93 0.00 0.00 61.98 58.52 1v5m s VAL 13 Cb -0.14 -0.23 0.01 0.00 -1.53 0.00 0.00 36.38 34.49 1v5m s VAL 13 CO -0.01 0.07 1.39 -0.70 -3.33 0.00 0.00 175.10 172.51 1v5m s GLU 14 N -0.10 3.52 0.42 1.54 -6.30 -1.26 -4.98 118.70 111.54 1v5m s GLU 14 Ca 0.01 0.77 0.04 0.00 -2.50 0.00 0.00 54.97 53.29 1v5m s GLU 14 Cb -0.01 -4.04 -0.02 0.00 0.00 0.00 0.00 34.13 30.05 1v5m s GLU 14 CO -0.00 -1.65 0.12 -0.48 0.02 0.00 0.00 175.26 173.27 1v5m s LEU 15 N 5.51 2.03 -0.05 2.70 0.05 -1.26 -5.16 118.68 122.50 1v5m s LEU 15 Ca 0.58 -1.67 0.05 0.00 0.05 0.00 0.00 54.13 53.13 1v5m s LEU 15 Cb -0.12 -0.18 -0.02 0.00 -2.05 0.00 0.00 46.19 43.82 1v5m s LEU 15 CO 0.31 -0.92 -0.19 -0.69 -0.55 0.00 0.00 176.35 174.30 1v5m s VAL 16 N -3.17 2.60 0.14 1.48 1.01 -1.26 -5.04 120.40 116.15 1v5m s VAL 16 Ca 0.22 -0.88 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 1v5m s VAL 16 Cb 0.02 -1.99 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 1v5m s VAL 16 CO 0.13 0.58 1.57 0.44 0.00 0.00 0.00 175.10 177.82 1v5m h ASP 17 N 5.70 -1.46 -1.60 3.32 3.32 -1.98 -3.39 116.42 120.33 1v5m h ASP 17 Ca -0.40 0.20 -0.66 0.00 0.02 0.00 0.00 57.03 56.19 1v5m h ASP 17 Cb 1.16 0.60 0.00 0.00 0.22 0.00 0.00 39.33 41.32 1v5m h ASP 17 CO 0.49 -0.42 1.18 -0.38 -1.72 0.00 0.00 179.24 178.40 1v5m n ILE 18 N -5.43 0.38 -0.07 0.35 -0.00 -1.26 -4.22 119.36 109.11 1v5m n ILE 18 Ca -0.03 -0.17 -0.20 0.00 -0.00 0.00 0.00 62.75 62.35 1v5m n ILE 18 Cb 0.36 -1.69 -0.12 0.00 -0.00 0.00 0.00 39.64 38.19 1v5m n ILE 18 CO 0.00 0.00 0.00 1.56 -0.00 0.00 0.00 176.55 178.11 1v5m h GLN 19 N 10.15 0.06 -1.93 0.38 1.08 -1.54 -3.49 115.11 119.83 1v5m h GLN 19 Ca -0.41 -0.11 -0.02 0.00 -1.45 0.00 0.00 58.65 56.66 1v5m h GLN 19 Cb 1.30 0.04 -0.22 0.00 -0.05 0.00 0.00 27.48 28.55 1v5m h GLN 19 CO 0.98 1.05 0.19 0.50 -0.95 0.00 0.00 178.83 180.60 1v5m s ARG 20 N -2.36 0.80 -0.13 1.46 3.52 -1.25 -5.06 118.95 115.92 1v5m s ARG 20 Ca -0.24 0.88 -0.06 0.00 -0.13 0.00 0.00 55.73 56.17 1v5m s ARG 20 Cb 0.04 0.39 0.06 0.00 -1.56 0.00 0.00 34.95 33.87 1v5m s ARG 20 CO 0.66 -0.11 0.30 -2.00 -0.81 0.00 0.00 175.30 173.34 1v5m s GLU 21 N 0.24 0.25 0.24 5.12 -6.30 -1.26 -1.26 118.70 115.73 1v5m s GLU 21 Ca -0.00 0.69 0.00 0.00 -2.50 0.00 0.00 54.97 53.16 1v5m s GLU 21 Cb -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 34.13 34.04 1v5m s GLU 21 CO 0.00 -0.20 0.31 0.41 0.02 0.00 0.00 175.26 175.81 1v5m n GLY 22 N 4.60 2.58 2.98 -1.50 0.00 -0.60 -5.02 105.19 108.24 1v5m n GLY 22 Ca -0.19 -1.60 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 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 -2.52 2.66 0.30 4.61 0.00 -1.26 -1.41 121.76 124.13 1v5m s ALA 23 Ca 0.22 -2.33 0.03 0.00 0.00 0.00 0.00 51.96 49.88 1v5m s ALA 23 Cb -0.00 -1.88 -0.04 0.00 0.00 0.00 0.00 23.12 21.20 1v5m s ALA 23 CO 0.16 -1.63 0.15 -0.48 0.00 0.00 0.00 175.76 173.95 1v5m s LEU 24 N 1.03 1.67 -0.02 0.00 2.34 -0.77 -4.89 118.68 118.04 1v5m s LEU 24 Ca 0.09 -1.53 -0.11 0.00 0.06 0.00 0.00 54.13 52.64 1v5m s LEU 24 Cb -0.19 0.15 -0.05 0.00 -0.56 0.00 0.00 46.19 45.54 1v5m s LEU 24 CO -0.10 -0.86 0.32 -0.13 -1.06 0.00 0.00 176.35 174.52 1v5m s ARG 25 N -3.86 3.72 0.16 1.48 3.00 -1.24 -1.84 118.95 120.38 1v5m s ARG 25 Ca 0.36 0.17 0.08 0.00 0.00 0.00 0.00 55.73 56.34 1v5m s ARG 25 Cb 0.05 -3.16 -0.04 0.00 0.00 0.00 0.00 34.95 31.80 1v5m s ARG 25 CO 0.17 0.69 -0.17 -0.59 0.00 0.00 0.00 175.30 175.39 1v5m s PHE 26 N -1.15 1.76 0.14 -0.53 -0.71 -0.40 -1.25 117.98 115.84 1v5m s PHE 26 Ca 0.23 -0.49 -0.13 0.00 -1.04 0.00 0.00 56.93 55.51 1v5m s PHE 26 Cb -0.15 -0.87 0.01 0.00 -1.21 0.00 0.00 43.02 40.80 1v5m s PHE 26 CO 0.12 0.31 0.35 0.00 -1.34 0.00 0.00 175.22 174.66 1v5m s MET 27 N -2.87 1.11 -0.11 1.99 0.23 -0.32 -2.14 119.30 117.20 1v5m s MET 27 Ca 0.16 -0.92 0.02 0.00 -1.03 0.00 0.00 55.69 53.92 1v5m s MET 27 Cb -0.05 0.43 0.01 0.00 -1.53 0.00 0.00 34.83 33.69 1v5m s MET 27 CO 0.06 -0.42 -0.17 0.08 -2.03 0.00 0.00 175.02 172.54 1v5m s VAL 28 N -3.88 1.63 -0.45 5.16 1.01 -1.26 -0.79 120.40 121.83 1v5m s VAL 28 Ca 0.09 -0.73 -0.27 0.00 0.00 0.00 0.00 61.98 61.06 1v5m s VAL 28 Cb 0.02 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 1v5m s VAL 28 CO -0.07 0.47 1.96 0.00 0.00 0.00 0.00 175.10 177.46 1v5m s ALA 29 N 0.86 2.40 -0.08 5.51 0.00 -1.12 -4.91 121.76 124.43 1v5m s ALA 29 Ca -0.09 -0.07 -0.30 0.00 0.00 0.00 0.00 51.96 51.51 1v5m s ALA 29 Cb -0.15 -4.18 0.10 0.00 0.00 0.00 0.00 23.12 18.89 1v5m s ALA 29 CO -0.00 -3.41 0.84 0.34 0.00 0.00 0.00 175.76 173.53 1v5m s ASP 30 N 8.01 -0.49 0.66 0.00 2.15 -1.26 -4.82 116.67 120.92 1v5m s ASP 30 Ca 0.80 0.43 -0.03 0.00 0.43 0.00 0.00 52.55 54.18 1v5m s ASP 30 Cb -0.19 0.42 0.06 0.00 -0.30 0.00 0.00 42.92 42.92 1v5m s ASP 30 CO 0.28 -0.52 0.93 -0.62 -0.17 0.00 0.00 175.17 175.07 1v5m s ASP 31 N -1.43 4.86 -0.12 -0.34 2.15 -1.26 -5.11 116.67 115.41 1v5m s ASP 31 Ca -0.04 0.16 -0.05 0.00 0.43 0.00 0.00 52.55 53.05 1v5m s ASP 31 Cb -0.00 -0.83 0.06 0.00 -0.30 0.00 0.00 42.92 41.84 1v5m s ASP 31 CO 0.02 -1.50 0.26 0.00 -0.17 0.00 0.00 175.17 173.78 1v5m s ALA 32 N -3.07 -0.57 0.10 3.66 0.00 -1.26 -5.04 121.76 115.58 1v5m s ALA 32 Ca 0.60 0.97 -0.15 0.00 0.00 0.00 0.00 51.96 53.39 1v5m s ALA 32 Cb -0.10 -0.85 -0.08 0.00 0.00 0.00 0.00 23.12 22.09 1v5m s ALA 32 CO 0.43 -0.44 1.43 0.00 0.00 0.00 0.00 175.76 177.17 1v5m h ALA 33 N 7.79 0.41 -2.94 0.00 0.00 -2.03 -3.47 119.26 119.02 1v5m h ALA 33 Ca -0.26 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 1v5m h ALA 33 Cb 1.13 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1v5m h ALA 33 CO 0.24 0.40 0.10 -1.12 0.00 0.00 0.00 179.25 178.87 1v5m s SER 34 N -6.48 -0.08 0.00 0.00 0.01 -1.26 -5.17 113.70 100.72 1v5m s SER 34 Ca -0.13 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.27 1v5m s SER 34 Cb 0.08 0.70 0.00 0.00 0.21 0.00 0.00 66.02 67.02 1v5m s SER 34 CO 0.82 -1.34 0.00 0.61 0.41 0.00 0.00 173.24 173.74 1v5m n GLY 35 N -0.45 0.74 3.60 3.44 0.00 -1.26 -5.11 105.19 106.14 1v5m n GLY 35 Ca -0.04 -2.06 -0.30 0.00 0.00 0.00 0.00 46.02 43.63 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 -1.24 -1.01 0.00 1.61 0.04 -1.26 -5.09 135.00 128.05 1v5m s PRO 36 Ca 0.00 0.01 0.00 0.00 0.04 0.00 0.00 61.00 61.05 1v5m s PRO 36 Cb 0.00 -1.61 0.00 0.00 0.04 0.00 0.00 34.50 32.93 1v5m s PRO 36 CO 0.00 -3.58 0.00 0.41 0.04 0.00 0.00 177.00 173.87 1v5m n GLY 37 N -0.97 5.19 0.00 0.56 0.00 -1.26 -5.18 105.19 103.52 1v5m n GLY 37 Ca 0.12 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.53 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 0.98 -2.03 0.17 -0.02 0.00 -1.26 -5.03 105.19 98.00 1v5m n GLY 38 Ca 0.00 -1.17 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 1v5m n GLY 38 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1v5m h THR 39 N 0.00 0.76 -3.79 2.61 2.02 -2.02 -3.46 112.91 109.02 1v5m h THR 39 Ca 0.00 -0.79 -0.24 0.00 0.77 0.00 0.00 66.41 66.16 1v5m h THR 39 Cb 0.00 1.16 -0.27 0.00 -1.74 0.00 0.00 68.15 67.30 1v5m h THR 39 CO 0.00 0.15 -0.72 0.00 0.37 0.00 0.00 175.52 175.32 1v5m s ALA 40 N -4.42 0.09 0.63 6.16 0.00 -1.26 -5.01 121.76 117.94 1v5m s ALA 40 Ca -0.14 -0.13 0.38 0.00 0.00 0.00 0.00 51.96 52.08 1v5m s ALA 40 Cb 0.02 0.01 2.09 0.00 0.00 0.00 0.00 23.12 25.23 1v5m s ALA 40 CO 0.52 -0.01 2.18 1.96 0.00 0.00 0.00 175.76 180.41 1v5m h GLN 41 N 5.89 0.00 -6.45 0.00 1.08 -1.98 -3.43 115.11 110.22 1v5m h GLN 41 Ca -0.26 0.00 -0.62 0.00 -1.45 0.00 0.00 58.65 56.33 1v5m h GLN 41 Cb 1.21 0.00 0.10 0.00 -0.05 0.00 0.00 27.48 28.73 1v5m h GLN 41 CO 0.49 0.00 0.24 0.91 -0.95 0.00 0.00 178.83 179.52 1v5m n TRP 42 N -2.97 1.41 -4.53 2.96 7.02 -1.26 -4.79 117.44 115.28 1v5m n TRP 42 Ca -0.03 0.66 -0.24 0.00 -1.02 0.00 0.00 57.50 56.88 1v5m n TRP 42 Cb 0.18 -2.29 -0.16 0.00 -2.42 0.00 0.00 31.31 26.62 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 -1.05 1.56 0.19 -0.99 -0.21 -0.91 -4.94 119.66 113.31 1v5m s GLN 43 Ca 0.64 -0.37 -0.32 0.00 0.02 0.00 0.00 55.36 55.33 1v5m s GLN 43 Cb -0.74 -1.31 -0.11 0.00 1.00 0.00 0.00 33.01 31.85 1v5m s GLN 43 CO 0.56 0.02 1.71 -1.59 -2.12 0.00 0.00 175.29 173.88 1v5m s LYS 44 N 0.65 4.14 0.27 2.91 -2.85 -1.26 -1.28 119.74 122.32 1v5m s LYS 44 Ca -0.13 2.57 -0.20 0.00 -1.00 0.00 0.00 55.97 57.20 1v5m s LYS 44 Cb -0.15 -3.17 0.02 0.00 -2.06 0.00 0.00 37.83 32.47 1v5m s LYS 44 CO 0.03 -0.74 0.67 0.00 0.10 0.00 0.00 175.35 175.41 1v5m s ARG 46 N -3.92 2.92 -0.32 0.00 3.52 -0.31 -1.84 118.95 119.00 1v5m s ARG 46 Ca 0.12 -0.87 -0.21 0.00 -0.13 0.00 0.00 55.73 54.63 1v5m s ARG 46 Cb -0.05 -2.59 -0.00 0.00 -1.56 0.00 0.00 34.95 30.74 1v5m s ARG 46 CO 0.06 -0.24 0.67 -1.17 -0.81 0.00 0.00 175.30 173.81 1v5m s LEU 47 N 1.28 4.15 -0.20 -0.88 2.96 -0.50 -2.09 118.68 123.40 1v5m s LEU 47 Ca 0.04 0.42 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 1v5m s LEU 47 Cb -0.14 -2.87 0.03 0.00 0.50 0.00 0.00 46.19 43.71 1v5m s LEU 47 CO -0.12 -0.54 -0.17 -0.22 -1.32 0.00 0.00 176.35 173.97 1v5m s LEU 48 N 2.72 2.44 -0.58 -0.68 2.96 -1.06 -1.56 118.68 122.93 1v5m s LEU 48 Ca 0.27 -0.79 -0.14 0.00 -0.22 0.00 0.00 54.13 53.25 1v5m s LEU 48 Cb -0.15 -1.51 0.14 0.00 0.50 0.00 0.00 46.19 45.18 1v5m s LEU 48 CO 0.13 -0.04 0.51 -0.22 -1.32 0.00 0.00 176.35 175.41 1v5m s LEU 49 N 1.26 6.16 0.25 -0.68 0.20 -0.39 -2.90 118.68 122.59 1v5m s LEU 49 Ca 0.02 -1.99 0.10 0.00 0.69 0.00 0.00 54.13 52.95 1v5m s LEU 49 Cb -0.14 -2.16 -0.04 0.00 -0.43 0.00 0.00 46.19 43.41 1v5m s LEU 49 CO -0.11 -0.77 -0.05 -0.13 -0.29 0.00 0.00 176.35 175.00 1v5m s ARG 50 N 1.27 2.16 0.01 1.98 0.52 -1.25 -1.71 118.95 121.93 1v5m s ARG 50 Ca 0.06 -1.43 -0.16 0.00 -0.52 0.00 0.00 55.73 53.69 1v5m s ARG 50 Cb -0.26 -2.11 -0.06 0.00 0.52 0.00 0.00 34.95 33.05 1v5m s ARG 50 CO 0.00 0.38 0.44 0.50 0.02 0.00 0.00 175.30 176.64 1v5m s ARG 51 N -3.45 4.00 0.09 3.54 3.52 -1.26 -2.97 118.95 122.41 1v5m s ARG 51 Ca 0.30 0.48 -0.03 0.00 -0.13 0.00 0.00 55.73 56.35 1v5m s ARG 51 Cb -0.07 -3.23 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 1v5m s ARG 51 CO 0.18 0.66 0.28 0.00 -0.81 0.00 0.00 175.30 175.61 1v5m s ALA 52 N -1.00 3.90 0.26 6.12 0.00 0.16 -4.92 121.76 126.28 1v5m s ALA 52 Ca 0.25 -0.70 0.09 0.00 0.00 0.00 0.00 51.96 51.60 1v5m s ALA 52 Cb -0.17 -1.98 -0.05 0.00 0.00 0.00 0.00 23.12 20.92 1v5m s ALA 52 CO 0.14 0.75 -0.13 0.14 0.00 0.00 0.00 175.76 176.66 1v5m s VAL 53 N -1.54 1.96 -1.41 0.00 -7.23 -1.26 -4.63 120.40 106.28 1v5m s VAL 53 Ca 0.36 -2.23 -0.05 0.00 -1.81 0.00 0.00 61.98 58.25 1v5m s VAL 53 Cb -0.13 -2.30 0.03 0.00 0.56 0.00 0.00 36.38 34.54 1v5m s VAL 53 CO 0.25 -0.41 0.71 0.00 -0.31 0.00 0.00 175.10 175.34 1v5m n ALA 54 N -0.55 -1.78 0.00 1.32 0.00 -1.26 -4.69 120.51 113.55 1v5m n ALA 54 Ca -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1v5m n ALA 54 Cb 0.62 -2.58 0.00 0.00 0.00 0.00 0.00 19.45 17.49 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 -1.69 -0.15 3.13 0.00 0.00 -1.26 -5.13 105.19 100.09 1v5m n GLY 55 Ca -0.19 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 1v5m n GLY 55 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1v5m n GLU 56 N 0.00 0.01 0.00 1.61 2.13 -1.26 -4.94 120.64 118.19 1v5m n GLU 56 Ca 0.00 0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.83 1v5m n GLU 56 Cb 0.00 -1.07 0.00 0.00 0.27 0.00 0.00 31.44 30.64 1v5m n GLU 56 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1v5m n ARG 57 N 1.82 0.00 -4.60 5.31 1.74 -1.26 -4.19 116.66 115.48 1v5m n ARG 57 Ca 0.03 0.45 -0.27 0.00 -0.77 0.00 0.00 57.85 57.29 1v5m n ARG 57 Cb 0.52 -1.13 -0.11 0.00 -1.02 0.00 0.00 32.46 30.73 1v5m n ARG 57 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1v5m s PHE 58 N -1.56 2.43 -0.27 -1.55 0.40 -1.26 0.37 117.98 116.53 1v5m s PHE 58 Ca 0.00 -0.72 -0.09 0.00 -0.60 0.00 0.00 56.93 55.52 1v5m s PHE 58 Cb 0.00 -1.71 0.12 0.00 0.51 0.00 0.00 43.02 41.94 1v5m s PHE 58 CO 0.00 0.38 0.59 0.50 0.70 0.00 0.00 175.22 177.39 1v5m s ARG 59 N -3.74 0.52 0.41 0.44 3.52 -1.16 -1.51 118.95 117.44 1v5m s ARG 59 Ca 0.35 1.34 -0.12 0.00 -0.13 0.00 0.00 55.73 57.17 1v5m s ARG 59 Cb 0.10 0.70 -0.07 0.00 -1.56 0.00 0.00 34.95 34.12 1v5m s ARG 59 CO 0.17 -0.21 0.80 -0.51 -0.81 0.00 0.00 175.30 174.74 1v5m s LEU 60 N 2.76 3.82 -0.04 -0.88 2.01 0.20 -3.87 118.68 122.67 1v5m s LEU 60 Ca -0.05 1.22 -0.02 0.00 0.01 0.00 0.00 54.13 55.29 1v5m s LEU 60 Cb -0.12 -4.10 0.03 0.00 0.01 0.00 0.00 46.19 42.01 1v5m s LEU 60 CO -0.17 -0.41 0.04 -1.61 1.01 0.00 0.00 176.35 175.21 1v5m s GLU 61 N -3.80 0.08 -0.88 1.70 2.02 -1.14 -1.57 118.70 115.11 1v5m s GLU 61 Ca 0.53 0.29 -0.09 0.00 0.02 0.00 0.00 54.97 55.72 1v5m s GLU 61 Cb -0.10 -0.58 0.23 0.00 0.10 0.00 0.00 34.13 33.78 1v5m s GLU 61 CO 0.30 -0.30 0.81 -0.06 0.02 0.00 0.00 175.26 176.03 1v5m s PHE 62 N 1.97 3.87 -0.35 1.61 0.40 -1.22 -2.56 117.98 121.70 1v5m s PHE 62 Ca 0.03 -2.44 -0.28 0.00 -0.60 0.00 0.00 56.93 53.64 1v5m s PHE 62 Cb -0.12 -3.65 -0.02 0.00 0.51 0.00 0.00 43.02 39.74 1v5m s PHE 62 CO -0.03 -0.92 1.81 -0.06 0.70 0.00 0.00 175.22 176.71 1v5m s PHE 63 N -0.48 1.79 -0.21 0.36 0.08 -0.89 -2.11 117.98 116.53 1v5m s PHE 63 Ca 0.23 0.64 -0.00 0.00 0.12 0.00 0.00 56.93 57.92 1v5m s PHE 63 Cb -0.11 -4.12 0.05 0.00 -0.57 0.00 0.00 43.02 38.27 1v5m s PHE 63 CO -0.08 -2.91 -0.04 0.08 -0.10 0.00 0.00 175.22 172.17 1v5m s VAL 64 N 7.08 1.25 1.02 -0.44 1.01 -1.26 -1.16 120.40 127.91 1v5m s VAL 64 Ca 0.79 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 61.70 1v5m s VAL 64 Cb -0.22 -1.53 0.20 0.00 0.00 0.00 0.00 36.38 34.83 1v5m s VAL 64 CO 0.33 -0.05 1.09 -2.16 0.00 0.00 0.00 175.10 174.31 1v5m s PRO 65 N 1.54 0.26 0.00 2.72 0.04 -1.26 -4.62 135.00 133.67 1v5m s PRO 65 Ca -0.03 0.47 0.10 0.00 0.04 0.00 0.00 61.00 61.58 1v5m s PRO 65 Cb -0.17 -1.72 0.60 0.00 0.04 0.00 0.00 34.50 33.24 1v5m s PRO 65 CO -0.07 -2.84 1.04 -0.35 0.04 0.00 0.00 177.00 174.82 1v5m n PRO 66 N -4.24 0.49 -0.06 0.56 -0.04 -0.40 -1.73 135.00 129.59 1v5m n PRO 66 Ca 0.05 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.54 1v5m n PRO 66 Cb 0.57 -1.32 0.06 0.00 -0.04 0.00 0.00 33.50 32.77 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 -0.82 1.62 -1.65 0.54 5.02 -1.26 -4.74 118.16 116.87 1v5m n LYS 67 Ca 0.08 -1.41 -0.30 0.00 -2.02 0.00 0.00 58.31 54.66 1v5m n LYS 67 Cb 0.03 -1.14 0.09 0.00 -0.02 0.00 0.00 35.03 34.00 1v5m n LYS 67 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1v5m s ALA 68 N -0.79 2.32 0.00 7.82 0.00 -0.70 -5.00 121.76 125.41 1v5m s ALA 68 Ca 0.10 -0.34 -0.00 0.00 0.00 0.00 0.00 51.96 51.72 1v5m s ALA 68 Cb 0.06 -3.06 -0.26 0.00 0.00 0.00 0.00 23.12 19.85 1v5m s ALA 68 CO 0.08 -1.72 0.85 0.77 0.00 0.00 0.00 175.76 175.74 1v5m h SER 69 N -1.08 0.31 -3.66 0.00 0.02 -1.96 -3.47 113.55 103.71 1v5m h SER 69 Ca -0.47 -0.45 -0.66 0.00 -0.84 0.00 0.00 61.79 59.37 1v5m h SER 69 Cb 1.28 -0.10 -0.21 0.00 0.14 0.00 0.00 62.40 63.52 1v5m h SER 69 CO 0.61 1.38 -0.85 0.00 -1.14 0.00 0.00 176.83 176.83 1v5m s ARG 70 N -2.62 1.42 0.53 3.45 1.70 -1.26 -5.13 118.95 117.04 1v5m s ARG 70 Ca -0.08 -1.40 -0.20 0.00 -0.47 0.00 0.00 55.73 53.58 1v5m s ARG 70 Cb 0.07 -1.82 -0.06 0.00 -0.57 0.00 0.00 34.95 32.57 1v5m s ARG 70 CO 0.84 0.42 1.14 -1.25 -1.08 0.00 0.00 175.30 175.36 1v5m s PRO 71 N -2.29 3.42 -0.22 3.89 0.04 -1.26 -4.58 135.00 134.00 1v5m s PRO 71 Ca 0.16 1.64 -0.10 0.00 0.04 0.00 0.00 61.00 62.74 1v5m s PRO 71 Cb -0.09 -2.07 -0.18 0.00 0.04 0.00 0.00 34.50 32.20 1v5m s PRO 71 CO 0.07 -0.80 -0.03 1.17 0.04 0.00 0.00 177.00 177.45 1v5m n LYS 72 N -1.17 0.64 -3.27 4.56 4.81 -0.90 -4.69 118.16 118.15 1v5m n LYS 72 Ca 0.11 0.31 -0.26 0.00 -0.87 0.00 0.00 58.31 57.60 1v5m n LYS 72 Cb 0.50 -1.61 -0.07 0.00 0.02 0.00 0.00 35.03 33.88 1v5m n LYS 72 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1v5m n VAL 73 N -3.88 1.80 -2.31 3.15 0.31 -1.15 -5.02 118.33 111.23 1v5m n VAL 73 Ca -0.42 -5.04 -0.43 0.00 -0.01 0.00 0.00 64.34 58.44 1v5m n VAL 73 Cb 0.90 -1.81 -0.02 0.00 -0.91 0.00 0.00 33.84 32.00 1v5m n VAL 73 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1v5m s SER 74 N -2.45 6.36 -0.12 4.52 0.01 -1.26 -3.43 113.70 117.32 1v5m s SER 74 Ca 0.41 1.00 -0.01 0.00 1.31 0.00 0.00 55.95 58.66 1v5m s SER 74 Cb 0.19 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 63.86 1v5m s SER 74 CO -0.06 -1.38 -0.09 -0.63 0.41 0.00 0.00 173.24 171.48 1v5m s ILE 75 N 5.37 3.42 0.49 1.44 1.01 -0.61 -4.97 121.20 127.36 1v5m s ILE 75 Ca 0.63 -0.54 -0.22 0.00 0.00 0.00 0.00 60.65 60.52 1v5m s ILE 75 Cb -0.16 -2.44 -0.07 0.00 0.01 0.00 0.00 42.46 39.80 1v5m s ILE 75 CO 0.31 0.53 1.15 -2.16 0.00 0.00 0.00 174.94 174.77 1v5m s PRO 76 N 0.04 3.60 0.48 2.79 0.04 -1.26 0.60 135.00 141.29 1v5m s PRO 76 Ca -0.03 1.71 0.27 0.00 0.04 0.00 0.00 61.00 62.99 1v5m s PRO 76 Cb -0.14 -2.25 1.12 0.00 0.04 0.00 0.00 34.50 33.28 1v5m s PRO 76 CO 0.04 -0.67 1.91 1.25 0.04 0.00 0.00 177.00 179.56 1v5m h LEU 77 N 1.71 0.00 -0.78 -3.56 7.12 -1.59 -2.77 115.31 115.44 1v5m h LEU 77 Ca -0.50 0.00 -0.13 0.00 0.13 0.00 0.00 57.88 57.39 1v5m h LEU 77 Cb 1.25 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.37 1v5m h LEU 77 CO 0.59 0.15 -0.56 -1.28 -0.13 0.00 0.00 178.44 177.21 1v5m h SER 78 N 0.00 0.15 -0.45 1.25 0.87 -1.92 -3.06 113.55 110.38 1v5m h SER 78 Ca -0.00 -0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.41 1v5m h SER 78 Cb 0.62 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.52 1v5m h SER 78 CO 0.02 0.68 0.03 0.00 -0.53 0.00 0.00 176.83 177.03 1v5m h ALA 79 N 1.32 1.09 -2.48 6.23 0.00 -1.87 -3.43 119.26 120.13 1v5m h ALA 79 Ca -0.00 -0.26 -0.53 0.00 0.00 0.00 0.00 54.91 54.12 1v5m h ALA 79 Cb 1.02 -0.21 0.04 0.00 0.00 0.00 0.00 17.79 18.64 1v5m h ALA 79 CO 0.08 0.58 1.15 0.42 0.00 0.00 0.00 179.25 181.48 1v5m s ILE 80 N -5.05 2.62 -0.02 0.00 -1.09 -1.16 0.72 121.20 117.23 1v5m s ILE 80 Ca -0.10 0.01 0.01 0.00 -2.23 0.00 0.00 60.65 58.34 1v5m s ILE 80 Cb 0.15 -3.01 -0.02 0.00 -1.58 0.00 0.00 42.46 38.00 1v5m s ILE 80 CO 0.81 -0.00 -0.01 2.30 -1.23 0.00 0.00 174.94 176.81 1v5m n ILE 81 N 4.95 0.13 -3.78 2.92 -5.35 -0.76 -4.89 119.36 112.58 1v5m n ILE 81 Ca 0.18 -0.06 -0.13 0.00 -0.27 0.00 0.00 62.75 62.47 1v5m n ILE 81 Cb 0.39 -0.73 -0.14 0.00 -1.74 0.00 0.00 39.64 37.42 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 -2.05 0.13 -0.08 6.28 2.12 -1.06 -5.06 118.70 118.98 1v5m s GLU 82 Ca -0.02 0.31 0.03 0.00 0.36 0.00 0.00 54.97 55.65 1v5m s GLU 82 Cb 0.01 -0.07 0.01 0.00 0.26 0.00 0.00 34.13 34.34 1v5m s GLU 82 CO 0.06 -0.11 -0.17 0.54 -0.54 0.00 0.00 175.26 175.04 1v5m s VAL 83 N 0.73 1.55 0.30 3.70 0.11 -1.26 -0.45 120.40 125.08 1v5m s VAL 83 Ca -0.05 -0.72 -0.01 0.00 -2.93 0.00 0.00 61.98 58.27 1v5m s VAL 83 Cb -0.07 -1.37 -0.04 0.00 -1.53 0.00 0.00 36.38 33.37 1v5m s VAL 83 CO -0.04 0.45 0.51 -0.60 -3.33 0.00 0.00 175.10 172.10 1v5m s ARG 84 N 0.55 3.52 0.00 1.54 3.52 0.60 -4.89 118.95 123.80 1v5m s ARG 84 Ca -0.16 -0.28 0.00 0.00 -0.13 0.00 0.00 55.73 55.17 1v5m s ARG 84 Cb -0.17 -2.70 0.00 0.00 -1.56 0.00 0.00 34.95 30.53 1v5m s ARG 84 CO 0.06 0.22 0.00 0.25 -0.81 0.00 0.00 175.30 175.01 1v5m n THR 85 N -1.38 0.00 -3.80 4.11 -2.24 -1.26 -0.88 114.28 108.82 1v5m n THR 85 Ca -0.04 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.50 1v5m n THR 85 Cb 0.55 -0.39 -0.02 0.00 -2.10 0.00 0.00 70.33 68.37 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 -1.71 5.23 0.24 4.28 -1.32 -1.26 -4.37 115.64 116.73 1v5m s THR 86 Ca 0.00 -0.74 0.11 0.00 -1.21 0.00 0.00 61.69 59.85 1v5m s THR 86 Cb 0.00 -3.82 -0.05 0.00 -1.51 0.00 0.00 72.50 67.12 1v5m s THR 86 CO 0.00 -0.32 -0.20 -0.04 -2.21 0.00 0.00 174.62 171.85 1v5m s MET 87 N -3.83 1.58 0.00 7.08 1.00 -1.26 -4.95 119.30 118.91 1v5m s MET 87 Ca 0.36 -1.67 0.00 0.00 0.00 0.00 0.00 55.69 54.38 1v5m s MET 87 Cb -0.10 -1.71 0.00 0.00 0.00 0.00 0.00 34.83 33.03 1v5m s MET 87 CO 0.30 0.33 0.00 -0.35 0.00 0.00 0.00 175.02 175.31 1v5m n PRO 88 N -0.32 0.22 -0.87 2.03 -0.04 -1.26 -4.82 135.00 129.95 1v5m n PRO 88 Ca -0.08 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.29 1v5m n PRO 88 Cb 0.59 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 5.10 0.00 1.53 7.99 -1.26 -3.60 117.00 126.75 1v5m n LEU 89 Ca 0.00 -2.94 0.00 0.00 -0.01 0.00 0.00 56.01 53.06 1v5m n LEU 89 Cb 0.00 -1.32 0.00 0.00 -0.11 0.00 0.00 43.42 41.99 1v5m n LEU 89 CO 0.00 1.50 -0.40 -0.62 -1.51 0.00 0.00 177.39 176.36 1v5m n GLU 90 N 2.31 0.00 -1.61 3.23 -0.58 -1.26 -5.07 120.64 117.66 1v5m n GLU 90 Ca 0.33 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.76 1v5m n GLU 90 Cb 0.81 -0.68 0.05 0.00 -0.57 0.00 0.00 31.44 31.05 1v5m n GLU 90 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1v5m s MET 91 N -1.89 2.94 0.00 3.49 -1.94 -1.24 -4.89 119.30 115.77 1v5m s MET 91 Ca 0.00 0.89 0.00 0.00 -1.71 0.00 0.00 55.69 54.87 1v5m s MET 91 Cb 0.00 -1.99 0.00 0.00 2.01 0.00 0.00 34.83 34.85 1v5m s MET 91 CO 0.00 -1.08 0.25 -0.35 -0.01 0.00 0.00 175.02 173.82 1v5m n PRO 92 N -3.11 0.48 -2.92 2.03 -0.04 -1.26 -4.74 135.00 125.44 1v5m n PRO 92 Ca 0.07 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.41 1v5m n PRO 92 Cb 0.54 -1.24 0.06 0.00 -0.04 0.00 0.00 33.50 32.82 1v5m n PRO 92 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1v5m n GLU 93 N 0.24 -3.27 -4.01 0.54 1.02 -1.26 -5.01 120.64 108.89 1v5m n GLU 93 Ca 0.00 0.63 -0.35 0.00 -0.02 0.00 0.00 57.16 57.43 1v5m n GLU 93 Cb 0.12 -4.84 -0.10 0.00 -0.02 0.00 0.00 31.44 26.60 1v5m n GLU 93 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1v5m s LYS 94 N -4.51 3.96 -0.50 3.49 -0.14 -1.26 -4.99 119.74 115.78 1v5m s LYS 94 Ca 0.17 -0.35 -0.01 0.00 -1.36 0.00 0.00 55.97 54.41 1v5m s LYS 94 Cb -0.02 -3.21 0.35 0.00 -1.68 0.00 0.00 37.83 33.27 1v5m s LYS 94 CO 0.54 0.26 2.01 -0.25 -0.76 0.00 0.00 175.35 177.15 1v5m n ASP 95 N 3.58 6.98 -1.57 2.83 9.92 -1.26 -4.18 116.55 132.85 1v5m n ASP 95 Ca -0.17 -3.44 0.02 0.00 -0.53 0.00 0.00 54.79 50.67 1v5m n ASP 95 Cb 0.52 -1.00 0.06 0.00 -0.64 0.00 0.00 41.12 40.06 1v5m n ASP 95 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1v5m n ASN 96 N -0.35 1.44 -4.07 -2.24 6.94 -1.26 -3.88 115.26 111.84 1v5m n ASN 96 Ca 0.48 -2.47 -0.10 0.00 -0.02 0.00 0.00 54.58 52.47 1v5m n ASN 96 Cb 0.66 -0.38 -0.11 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 -1.50 0.37 -0.08 5.53 -4.23 -1.26 -1.32 115.64 113.15 1v5m s THR 97 Ca 0.35 -1.40 -0.20 0.00 -1.18 0.00 0.00 61.69 59.26 1v5m s THR 97 Cb 0.38 -0.97 0.04 0.00 1.34 0.00 0.00 72.50 73.29 1v5m s THR 97 CO -0.12 -0.67 0.47 0.72 -0.54 0.00 0.00 174.62 174.48 1v5m s PHE 98 N -2.52 -0.42 -0.09 3.99 -0.12 -1.10 -4.49 117.98 113.23 1v5m s PHE 98 Ca -0.03 0.83 -0.04 0.00 -0.05 0.00 0.00 56.93 57.64 1v5m s PHE 98 Cb -0.02 0.21 -0.04 0.00 -0.63 0.00 0.00 43.02 42.54 1v5m s PHE 98 CO -0.04 -0.41 0.08 0.08 -0.05 0.00 0.00 175.22 174.88 1v5m s VAL 99 N -0.81 4.96 -0.38 -2.49 1.01 -0.06 -1.94 120.40 120.69 1v5m s VAL 99 Ca -0.09 -0.04 -0.06 0.00 0.00 0.00 0.00 61.98 61.79 1v5m s VAL 99 Cb -0.03 -3.15 0.07 0.00 0.00 0.00 0.00 36.38 33.27 1v5m s VAL 99 CO 0.05 0.58 0.17 -0.76 0.00 0.00 0.00 175.10 175.14 1v5m s LEU 100 N -1.07 4.78 -0.58 3.92 1.43 -1.01 -0.29 118.68 125.86 1v5m s LEU 100 Ca 0.15 -1.49 -0.18 0.00 -1.03 0.00 0.00 54.13 51.58 1v5m s LEU 100 Cb -0.12 -1.88 0.11 0.00 0.03 0.00 0.00 46.19 44.33 1v5m s LEU 100 CO 0.05 -0.45 0.64 -0.75 0.23 0.00 0.00 176.35 176.07 1v5m s LYS 101 N 1.33 3.03 1.00 1.70 2.36 0.40 -1.83 119.74 127.74 1v5m s LYS 101 Ca 0.02 -1.47 -0.16 0.00 -2.55 0.00 0.00 55.97 51.80 1v5m s LYS 101 Cb -0.22 -4.28 0.21 0.00 -1.05 0.00 0.00 37.83 32.49 1v5m s LYS 101 CO 0.00 -1.47 1.25 0.14 1.55 0.00 0.00 175.35 176.83 1v5m s VAL 102 N 2.28 1.91 0.15 4.02 -7.23 -0.98 -1.83 120.40 118.72 1v5m s VAL 102 Ca 0.09 0.00 -0.10 0.00 -1.81 0.00 0.00 61.98 60.16 1v5m s VAL 102 Cb -0.26 -2.87 -0.06 0.00 0.56 0.00 0.00 36.38 33.76 1v5m s VAL 102 CO 0.05 0.00 1.46 1.05 -0.31 0.00 0.00 175.10 177.35 1v5m h GLU 103 N -1.81 0.86 0.00 4.82 -0.00 -0.04 -2.87 114.58 115.53 1v5m h GLU 103 Ca -0.45 -0.49 -0.00 0.00 -0.00 0.00 0.00 59.36 58.42 1v5m h GLU 103 Cb 1.26 0.04 -0.00 0.00 -0.00 0.00 0.00 28.75 30.05 1v5m h GLU 103 CO 0.40 1.13 -0.00 -0.97 -0.00 0.00 0.00 179.01 179.57 1v5m h ASN 104 N 0.68 0.00 -0.16 3.06 -1.24 -1.94 -3.46 115.58 112.53 1v5m h ASN 104 Ca 0.04 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.05 1v5m h ASN 104 Cb 1.05 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.10 1v5m h ASN 104 CO 0.10 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.86 1v5m n GLY 105 N -1.20 0.57 2.97 1.57 0.00 -1.08 -5.12 105.19 102.89 1v5m n GLY 105 Ca -0.03 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.31 1.05 -0.24 4.61 0.00 -1.26 -4.96 121.76 119.65 1v5m s ALA 106 Ca 0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 51.96 51.57 1v5m s ALA 106 Cb 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.54 1v5m s ALA 106 CO 0.00 0.05 0.16 -1.21 0.00 0.00 0.00 175.76 174.75 1v5m s GLU 107 N 0.80 4.02 -0.45 0.00 2.02 -1.24 -2.32 118.70 121.54 1v5m s GLU 107 Ca -0.13 -0.29 -0.01 0.00 0.02 0.00 0.00 54.97 54.56 1v5m s GLU 107 Cb -0.15 -3.53 0.12 0.00 0.10 0.00 0.00 34.13 30.66 1v5m s GLU 107 CO 0.02 0.02 0.22 0.71 0.02 0.00 0.00 175.26 176.25 1v5m s TYR 108 N 1.18 3.55 -0.29 1.61 1.51 -0.76 -2.77 117.35 121.38 1v5m s TYR 108 Ca 0.07 -2.66 -0.29 0.00 -1.01 0.00 0.00 57.07 53.18 1v5m s TYR 108 Cb -0.14 -3.13 0.01 0.00 -0.11 0.00 0.00 41.96 38.59 1v5m s TYR 108 CO 0.05 -0.92 1.20 0.42 -1.11 0.00 0.00 175.55 175.19 1v5m s ILE 109 N 0.73 4.31 -0.05 2.71 1.01 0.03 -2.41 121.20 127.53 1v5m s ILE 109 Ca 0.11 1.51 0.02 0.00 0.00 0.00 0.00 60.65 62.29 1v5m s ILE 109 Cb -0.22 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 37.98 1v5m s ILE 109 CO -0.04 -0.43 -0.09 -0.76 0.00 0.00 0.00 174.94 173.61 1v5m s LEU 110 N 3.97 3.06 -0.40 2.97 1.02 -0.82 -1.17 118.68 127.31 1v5m s LEU 110 Ca 0.52 -0.08 -0.05 0.00 0.02 0.00 0.00 54.13 54.53 1v5m s LEU 110 Cb -0.15 -1.67 0.09 0.00 0.02 0.00 0.00 46.19 44.48 1v5m s LEU 110 CO 0.19 0.35 0.20 -0.70 0.02 0.00 0.00 176.35 176.40 1v5m s GLU 111 N -0.88 2.29 0.89 1.70 2.12 -0.38 -2.71 118.70 121.73 1v5m s GLU 111 Ca 0.13 -1.61 -0.13 0.00 0.36 0.00 0.00 54.97 53.71 1v5m s GLU 111 Cb -0.11 -3.60 0.13 0.00 0.26 0.00 0.00 34.13 30.81 1v5m s GLU 111 CO 0.02 -0.97 1.20 0.95 -0.54 0.00 0.00 175.26 175.92 1v5m s THR 112 N 1.26 1.98 0.03 -1.70 -4.23 -0.44 -3.67 115.64 108.88 1v5m s THR 112 Ca 0.04 0.00 -0.22 0.00 -1.18 0.00 0.00 61.69 60.33 1v5m s THR 112 Cb -0.23 -2.90 -0.12 0.00 1.34 0.00 0.00 72.50 70.59 1v5m s THR 112 CO -0.01 0.00 1.27 0.40 -0.54 0.00 0.00 174.62 175.73 1v5m h ILE 113 N -1.39 0.00 -4.08 2.99 5.03 -1.90 -3.47 117.51 114.69 1v5m h ILE 113 Ca -0.47 -0.04 -0.28 0.00 -0.12 0.00 0.00 64.86 63.95 1v5m h ILE 113 Cb 1.31 0.00 -0.15 0.00 -3.03 0.00 0.00 36.82 34.95 1v5m h ILE 113 CO 0.57 0.00 -0.63 -1.81 -0.68 0.00 0.00 178.15 175.60 1v5m s ASP 114 N -3.35 0.79 0.19 1.72 1.11 -1.26 -5.01 116.67 110.86 1v5m s ASP 114 Ca -0.12 -1.30 -0.21 0.00 0.18 0.00 0.00 52.55 51.10 1v5m s ASP 114 Cb 0.01 0.23 0.13 0.00 1.07 0.00 0.00 42.92 44.35 1v5m s ASP 114 CO 0.35 -0.71 1.58 0.77 1.18 0.00 0.00 175.17 178.34 1v5m h SER 115 N 2.61 -1.22 -0.95 0.27 4.64 -1.90 0.21 113.55 117.21 1v5m h SER 115 Ca -0.37 0.24 0.29 0.00 -0.47 0.00 0.00 61.79 61.48 1v5m h SER 115 Cb 1.23 0.60 -0.16 0.00 -0.31 0.00 0.00 62.40 63.76 1v5m h SER 115 CO 0.59 -0.31 0.29 -0.07 -0.87 0.00 0.00 176.83 176.47 1v5m h LEU 116 N -0.15 0.02 -0.13 5.97 3.38 -1.97 0.29 115.31 122.71 1v5m h LEU 116 Ca 0.24 0.23 -0.03 0.00 0.09 0.00 0.00 57.88 58.41 1v5m h LEU 116 Cb 0.56 0.30 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1v5m h LEU 116 CO -0.71 -0.26 -0.04 1.56 0.09 0.00 0.00 178.44 179.09 1v5m h GLN 117 N 0.14 0.26 0.01 1.13 1.08 -1.01 -2.74 115.11 113.97 1v5m h GLN 117 Ca 0.65 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.75 1v5m h GLN 117 Cb 1.44 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.86 1v5m h GLN 117 CO -0.74 0.56 -0.04 -0.22 -0.95 0.00 0.00 178.83 177.45 1v5m h LYS 118 N -0.05 -0.05 -0.87 1.46 3.64 0.37 -1.46 116.57 119.60 1v5m h LYS 118 Ca 0.03 0.00 0.20 0.00 -1.27 0.00 0.00 60.65 59.62 1v5m h LYS 118 Cb 0.46 0.01 -0.16 0.00 -0.41 0.00 0.00 32.23 32.13 1v5m h LYS 118 CO 0.01 -0.03 -0.06 1.25 -2.27 0.00 0.00 179.45 178.35 1v5m h HIS 119 N -0.05 -0.19 -0.49 1.91 2.76 -1.41 0.24 115.15 117.92 1v5m h HIS 119 Ca -0.00 0.07 0.10 0.00 -2.20 0.00 0.00 60.37 58.34 1v5m h HIS 119 Cb 0.05 0.22 -0.09 0.00 1.55 0.00 0.00 27.41 29.14 1v5m h HIS 119 CO -0.29 -0.35 -0.11 0.77 -1.30 0.00 0.00 177.93 176.65 1v5m h SER 120 N 0.04 -0.43 0.46 3.26 0.02 -1.13 -0.89 113.55 114.88 1v5m h SER 120 Ca 0.48 0.14 -0.02 0.00 -0.84 0.00 0.00 61.79 61.55 1v5m h SER 120 Cb 0.86 0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1v5m h SER 120 CO -0.83 -0.15 -0.22 -0.50 -1.14 0.00 0.00 176.83 173.99 1v5m h TRP 121 N 0.01 -0.57 -1.04 3.45 4.06 0.50 -0.30 115.95 122.06 1v5m h TRP 121 Ca 0.24 -0.01 0.27 0.00 2.06 0.00 0.00 58.89 61.44 1v5m h TRP 121 Cb 0.36 0.19 -0.11 0.00 -1.00 0.00 0.00 29.16 28.60 1v5m h TRP 121 CO -0.41 -0.35 0.65 0.28 -3.56 0.00 0.00 178.44 175.05 1v5m h VAL 122 N -0.62 0.51 -0.02 1.49 2.07 -0.72 0.12 116.25 119.08 1v5m h VAL 122 Ca -0.06 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1v5m h VAL 122 Cb 0.47 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1v5m h VAL 122 CO 0.10 0.08 -0.07 0.00 0.02 0.00 0.00 177.57 177.70 1v5m h ALA 123 N 1.66 0.03 -0.57 1.67 0.00 -0.76 0.75 119.26 122.03 1v5m h ALA 123 Ca 0.62 -0.36 0.08 0.00 0.00 0.00 0.00 54.91 55.26 1v5m h ALA 123 Cb 1.46 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1v5m h ALA 123 CO -0.36 -0.09 0.38 -0.44 0.00 0.00 0.00 179.25 178.74 1v5m h ASP 124 N -0.55 0.41 0.00 0.00 5.19 0.50 0.54 116.42 122.50 1v5m h ASP 124 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1v5m h ASP 124 Cb 0.73 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.16 1v5m h ASP 124 CO 0.01 0.26 -0.10 0.40 -3.12 0.00 0.00 179.24 176.69 1v5m h ILE 125 N 0.46 0.00 -0.58 0.35 2.04 -0.85 -3.23 117.51 115.70 1v5m h ILE 125 Ca 0.26 -0.90 0.14 0.00 1.00 0.00 0.00 64.86 65.36 1v5m h ILE 125 Cb 0.42 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 1v5m h ILE 125 CO -0.07 0.00 0.41 1.56 0.00 0.00 0.00 178.15 180.04 1v5m h GLN 126 N -0.90 0.14 0.00 2.37 4.20 -0.79 0.22 115.11 120.34 1v5m h GLN 126 Ca 0.00 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.65 1v5m h GLN 126 Cb 0.10 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1v5m h GLN 126 CO 0.00 0.09 -0.23 0.78 -0.67 0.00 0.00 178.83 178.80 1v5m h GLY 127 N 0.14 0.00 0.00 3.46 0.00 -0.05 -3.30 103.07 103.32 1v5m h GLY 127 Ca 0.28 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.38 1v5m h GLY 127 CO -0.04 0.00 -1.35 0.00 0.00 0.00 0.00 176.54 175.15 1v5m n VAL 129 N -4.43 -0.07 -3.65 0.00 3.14 -0.08 -4.31 118.33 108.93 1v5m n VAL 129 Ca -0.32 1.19 -0.01 0.00 -2.96 0.00 0.00 64.34 62.24 1v5m n VAL 129 Cb 0.65 -1.96 -0.06 0.00 -1.06 0.00 0.00 33.84 31.40 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 -4.07 -0.21 -0.59 6.55 1.01 -1.25 -4.97 116.67 113.14 1v5m s ASP 130 Ca -0.04 0.36 -0.13 0.00 0.71 0.00 0.00 52.55 53.44 1v5m s ASP 130 Cb 0.21 0.88 -0.16 0.00 1.01 0.00 0.00 42.92 44.86 1v5m s ASP 130 CO 0.64 -0.06 1.46 -0.24 0.21 0.00 0.00 175.17 177.18 1v5m n SER 131 N 2.88 -0.26 -3.91 0.27 2.88 -1.26 -4.66 113.62 109.55 1v5m n SER 131 Ca -0.16 -0.07 -0.26 0.00 -1.33 0.00 0.00 58.87 57.05 1v5m n SER 131 Cb 0.57 -0.45 -0.17 0.00 -0.75 0.00 0.00 64.21 63.41 1v5m n SER 131 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1v5m s GLY 132 N 3.10 0.81 0.03 0.46 0.00 -1.25 -5.03 107.32 105.44 1v5m s GLY 132 Ca 0.79 -0.52 -0.22 0.00 0.00 0.00 0.00 44.72 44.78 1v5m s GLY 132 CO 0.31 0.76 1.33 -0.56 0.00 0.00 0.00 173.10 174.94 1v5m h PRO 133 N 8.08 0.27 -6.16 2.90 0.13 -1.93 -3.43 132.00 131.86 1v5m h PRO 133 Ca -0.30 -0.14 -0.45 0.00 -0.87 0.00 0.00 66.00 64.24 1v5m h PRO 133 Cb 1.13 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.29 1v5m h PRO 133 CO 0.41 0.67 -0.75 0.45 -0.23 0.00 0.00 178.00 178.55 1v5m n SER 134 N -4.63 -4.73 -3.99 1.44 2.88 -1.26 -4.96 113.62 98.37 1v5m n SER 134 Ca -0.07 -0.73 -0.31 0.00 -1.33 0.00 0.00 58.87 56.44 1v5m n SER 134 Cb 0.33 -4.20 -0.15 0.00 -0.75 0.00 0.00 64.21 59.45 1v5m n SER 134 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1v5m s SER 135 N -3.45 4.70 0.00 -3.46 1.04 -1.26 -5.18 113.70 106.09 1v5m s SER 135 Ca 0.56 -2.15 0.00 0.00 0.48 0.00 0.00 55.95 54.84 1v5m s SER 135 Cb -0.27 -1.57 0.00 0.00 0.10 0.00 0.00 66.02 64.28 1v5m s SER 135 CO 0.80 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 175.26