#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v61 n SER 2 N 0.00 0.00 -4.20 1.61 7.64 -1.26 -5.13 113.62 112.28 1v61 n SER 2 Ca 0.00 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.71 1v61 n SER 2 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 1v61 n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1v61 s SER 3 N -2.07 1.75 0.00 6.43 0.01 -1.26 -5.12 113.70 113.43 1v61 s SER 3 Ca 0.00 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.54 1v61 s SER 3 Cb 0.00 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.18 1v61 s SER 3 CO 0.00 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.12 1v61 n GLY 4 N 0.88 2.23 1.67 3.44 0.00 -1.26 -5.10 105.19 107.05 1v61 n GLY 4 Ca -0.18 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1v61 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v61 n SER 5 N 0.00 0.10 0.09 1.61 2.88 -1.26 -5.06 113.62 111.98 1v61 n SER 5 Ca 0.00 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1v61 n SER 5 Cb 0.00 0.07 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 1v61 n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1v61 n SER 6 N -3.01 -1.26 0.00 -3.46 2.88 -1.26 -5.10 113.62 102.41 1v61 n SER 6 Ca 0.00 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 1v61 n SER 6 Cb 0.10 1.41 0.00 0.00 -0.75 0.00 0.00 64.21 64.97 1v61 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v61 n GLY 7 N -0.61 0.62 1.41 0.46 0.00 -1.26 -5.10 105.19 100.71 1v61 n GLY 7 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1v61 n GLY 7 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1v61 n GLN 8 N 0.00 0.00 -0.53 1.61 6.02 -1.26 -4.67 117.38 118.55 1v61 n GLN 8 Ca 0.00 0.00 0.45 0.00 -0.01 0.00 0.00 57.00 57.44 1v61 n GLN 8 Cb 0.00 -0.29 0.73 0.00 1.02 0.00 0.00 30.24 31.70 1v61 n GLN 8 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.06 177.02 1v61 h ILE 9 N 0.00 0.07 -1.94 5.09 2.10 -1.99 1.24 117.51 122.09 1v61 h ILE 9 Ca 0.00 0.00 -0.65 0.00 1.08 0.00 0.00 64.86 65.29 1v61 h ILE 9 Cb 0.00 0.08 -0.37 0.00 -1.09 0.00 0.00 36.82 35.44 1v61 h ILE 9 CO 0.00 0.00 -0.12 0.00 -1.08 0.00 0.00 178.15 176.95 1v61 n LEU 10 N -3.82 5.56 0.02 2.19 -0.00 -1.26 -4.57 117.00 115.11 1v61 n LEU 10 Ca 0.36 -5.31 0.00 0.00 -0.00 0.00 0.00 56.01 51.07 1v61 n LEU 10 Cb 1.77 -0.70 0.00 0.00 -0.00 0.00 0.00 43.42 44.49 1v61 n LEU 10 CO 0.39 2.16 0.00 -1.20 -0.00 0.00 0.00 177.39 178.74 1v61 n SER 11 N -0.37 -0.16 -4.71 1.45 7.64 0.42 -5.04 113.62 112.86 1v61 n SER 11 Ca 0.41 0.07 -0.23 0.00 1.01 0.00 0.00 58.87 60.13 1v61 n SER 11 Cb 0.44 0.30 -0.06 0.00 -1.01 0.00 0.00 64.21 63.88 1v61 n SER 11 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1v61 s GLU 12 N -2.00 2.48 0.79 1.43 -1.05 -1.15 -5.11 118.70 114.09 1v61 s GLU 12 Ca 0.00 -1.34 -0.11 0.00 -0.15 0.00 0.00 54.97 53.37 1v61 s GLU 12 Cb 0.00 -2.27 0.06 0.00 -0.44 0.00 0.00 34.13 31.48 1v61 s GLU 12 CO 0.00 0.33 1.09 -1.25 0.95 0.00 0.00 175.26 176.39 1v61 s PRO 13 N -3.75 2.16 0.36 -4.83 0.04 -1.26 -4.89 135.00 122.83 1v61 s PRO 13 Ca 0.33 0.67 -0.15 0.00 0.04 0.00 0.00 61.00 61.89 1v61 s PRO 13 Cb -0.06 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.47 1v61 s PRO 13 CO 0.22 -1.58 0.79 0.42 0.04 0.00 0.00 177.00 176.89 1v61 s ILE 14 N -3.15 4.65 -0.12 0.56 1.01 -1.26 -4.68 121.20 118.21 1v61 s ILE 14 Ca 0.61 0.97 -0.18 0.00 0.00 0.00 0.00 60.65 62.05 1v61 s ILE 14 Cb -0.14 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 1v61 s ILE 14 CO 0.54 -0.30 0.46 -1.58 0.00 0.00 0.00 174.94 174.07 1v61 s GLN 15 N -3.24 4.33 0.00 2.79 0.74 -0.78 -3.78 119.66 119.72 1v61 s GLN 15 Ca 0.55 0.42 0.00 0.00 0.05 0.00 0.00 55.36 56.38 1v61 s GLN 15 Cb -0.10 -3.44 0.00 0.00 1.10 0.00 0.00 33.01 30.57 1v61 s GLN 15 CO 0.20 0.16 0.00 0.00 -0.55 0.00 0.00 175.29 175.10 1v61 n ALA 16 N 3.69 0.00 -2.59 1.58 0.00 -1.26 0.12 120.51 122.05 1v61 n ALA 16 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.94 1v61 n ALA 16 Cb 0.52 -0.48 -0.02 0.00 0.00 0.00 0.00 19.45 19.46 1v61 n ALA 16 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1v61 s TRP 17 N -2.00 3.01 -0.09 0.00 -0.11 -1.25 -4.73 118.94 113.78 1v61 s TRP 17 Ca 0.00 1.07 0.02 0.00 1.22 0.00 0.00 56.10 58.41 1v61 s TRP 17 Cb 0.00 -3.83 0.01 0.00 -1.50 0.00 0.00 33.47 28.15 1v61 s TRP 17 CO 0.00 -1.02 -0.13 -1.83 -4.62 0.00 0.00 176.95 169.34 1v61 s GLU 18 N 3.86 1.94 0.00 5.86 4.04 -1.26 -5.06 118.70 128.08 1v61 s GLU 18 Ca 0.48 -0.47 0.00 0.00 0.04 0.00 0.00 54.97 55.02 1v61 s GLU 18 Cb -0.12 -1.66 0.00 0.00 0.02 0.00 0.00 34.13 32.36 1v61 s GLU 18 CO 0.19 -0.05 0.00 0.41 -1.84 0.00 0.00 175.26 173.97 1v61 n GLY 19 N 4.13 0.47 0.00 -3.83 0.00 -1.26 -5.07 105.19 99.64 1v61 n GLY 19 Ca -0.20 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.77 1v61 n GLY 19 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1v61 n ASP 20 N 0.00 -0.24 -4.46 1.61 -0.08 -1.26 -5.02 116.55 107.10 1v61 n ASP 20 Ca 0.00 -0.04 -0.28 0.00 -1.51 0.00 0.00 54.79 52.96 1v61 n ASP 20 Cb 0.00 0.00 0.14 0.00 2.34 0.00 0.00 41.12 43.60 1v61 n ASP 20 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 1v61 s ASP 21 N -1.74 3.79 -0.03 1.67 1.11 -1.26 -5.01 116.67 115.21 1v61 s ASP 21 Ca 0.00 0.26 0.20 0.00 0.18 0.00 0.00 52.55 53.20 1v61 s ASP 21 Cb 0.00 -0.52 -0.24 0.00 1.07 0.00 0.00 42.92 43.22 1v61 s ASP 21 CO 0.00 -2.29 0.51 0.00 1.18 0.00 0.00 175.17 174.56 1v61 n ILE 22 N -3.41 0.60 1.29 0.77 3.06 -1.26 -3.96 119.36 116.45 1v61 n ILE 22 Ca 0.13 -0.62 0.13 0.00 -2.50 0.00 0.00 62.75 59.89 1v61 n ILE 22 Cb 0.60 -0.27 0.37 0.00 0.54 0.00 0.00 39.64 40.87 1v61 n ILE 22 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1v61 n LYS 23 N -2.53 1.28 0.03 9.51 4.76 -1.26 -3.68 118.16 126.27 1v61 n LYS 23 Ca -0.11 -0.82 0.06 0.00 -2.87 0.00 0.00 58.31 54.57 1v61 n LYS 23 Cb 0.75 -1.48 -0.09 0.00 -1.84 0.00 0.00 35.03 32.37 1v61 n LYS 23 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 1v61 n THR 24 N -0.14 0.65 0.00 -0.18 5.66 -1.25 -4.45 114.28 114.57 1v61 n THR 24 Ca 0.14 -0.60 0.00 0.00 -3.05 0.00 0.00 64.05 60.54 1v61 n THR 24 Cb 0.38 -0.35 0.00 0.00 -1.55 0.00 0.00 70.33 68.81 1v61 n THR 24 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1v61 n LEU 25 N -2.61 1.01 -2.43 1.09 4.77 -1.24 -4.90 117.00 112.69 1v61 n LEU 25 Ca -0.07 0.31 -0.03 0.00 -0.03 0.00 0.00 56.01 56.18 1v61 n LEU 25 Cb 0.69 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.84 1v61 n LEU 25 CO 0.43 0.00 0.52 0.61 -1.33 0.00 0.00 177.39 177.62 1v61 n GLY 26 N 0.59 0.32 7.00 -0.72 0.00 -1.26 -5.02 105.19 106.11 1v61 n GLY 26 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1v61 n GLY 26 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1v61 n ASN 27 N -0.66 -1.10 -4.17 1.61 2.85 -1.26 -4.44 115.26 108.10 1v61 n ASN 27 Ca -0.14 0.00 -0.34 0.00 -0.11 0.00 0.00 54.58 53.99 1v61 n ASN 27 Cb 0.72 0.00 -0.15 0.00 1.24 0.00 0.00 39.78 41.59 1v61 n ASN 27 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1v61 s VAL 28 N 0.00 2.58 0.00 3.44 1.01 -1.26 -3.97 120.40 122.19 1v61 s VAL 28 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.98 1v61 s VAL 28 Cb 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.14 1v61 s VAL 28 CO 0.00 0.32 0.07 -0.38 0.00 0.00 0.00 175.10 175.11 1v61 n ILE 29 N 4.64 0.00 -4.10 2.22 5.41 0.19 -4.89 119.36 122.83 1v61 n ILE 29 Ca -0.18 0.39 -0.28 0.00 1.00 0.00 0.00 62.75 63.68 1v61 n ILE 29 Cb 0.48 -1.03 -0.17 0.00 -0.71 0.00 0.00 39.64 38.21 1v61 n ILE 29 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 1v61 s PHE 30 N -0.75 1.83 -0.05 1.39 2.19 -1.26 -4.98 117.98 116.36 1v61 s PHE 30 Ca 0.00 -0.94 0.03 0.00 0.33 0.00 0.00 56.93 56.35 1v61 s PHE 30 Cb 0.00 -1.39 0.00 0.00 -1.31 0.00 0.00 43.02 40.32 1v61 s PHE 30 CO 0.00 -0.55 -0.14 0.00 1.83 0.00 0.00 175.22 176.36 1v61 s MET 31 N 1.41 1.62 0.23 10.12 0.23 -1.26 -3.28 119.30 128.37 1v61 s MET 31 Ca 0.01 -0.49 -0.22 0.00 -1.03 0.00 0.00 55.69 53.96 1v61 s MET 31 Cb -0.13 -1.39 0.04 0.00 -1.53 0.00 0.00 34.83 31.82 1v61 s MET 31 CO -0.07 0.14 0.75 0.45 -2.03 0.00 0.00 175.02 174.26 1v61 s SER 32 N 0.29 -0.30 -0.54 -1.18 0.15 -1.25 -5.02 113.70 105.86 1v61 s SER 32 Ca -0.08 -0.46 -0.24 0.00 0.70 0.00 0.00 55.95 55.87 1v61 s SER 32 Cb -0.13 0.66 0.04 0.00 -1.71 0.00 0.00 66.02 64.88 1v61 s SER 32 CO 0.03 -1.19 0.93 -1.58 1.20 0.00 0.00 173.24 172.62 1v61 s GLN 33 N -3.76 3.35 0.44 5.44 0.74 -1.26 -3.22 119.66 121.39 1v61 s GLN 33 Ca 0.10 -0.23 0.07 0.00 0.05 0.00 0.00 55.36 55.35 1v61 s GLN 33 Cb -0.04 -4.04 -0.02 0.00 1.10 0.00 0.00 33.01 30.01 1v61 s GLN 33 CO 0.03 -1.44 0.36 0.14 -0.55 0.00 0.00 175.29 173.83 1v61 s VAL 34 N 3.89 2.47 -0.26 1.34 -7.23 0.14 -4.89 120.40 115.86 1v61 s VAL 34 Ca 0.31 -1.40 0.02 0.00 -1.81 0.00 0.00 61.98 59.10 1v61 s VAL 34 Cb -0.12 -2.88 0.06 0.00 0.56 0.00 0.00 36.38 34.00 1v61 s VAL 34 CO 0.20 0.00 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.20 1v61 s VAL 35 N -2.53 2.02 -0.09 1.32 1.01 -1.26 0.11 120.40 120.98 1v61 s VAL 35 Ca 0.46 -1.55 -0.01 0.00 0.00 0.00 0.00 61.98 60.88 1v61 s VAL 35 Cb -0.02 -2.17 0.03 0.00 0.00 0.00 0.00 36.38 34.21 1v61 s VAL 35 CO 0.27 -0.05 -0.02 -0.32 0.00 0.00 0.00 175.10 174.97 1v61 s MET 36 N 1.17 0.92 0.06 2.72 -2.45 0.53 -0.78 119.30 121.46 1v61 s MET 36 Ca -0.08 -0.04 0.06 0.00 -1.25 0.00 0.00 55.69 54.38 1v61 s MET 36 Cb -0.20 -1.23 -0.03 0.00 1.25 0.00 0.00 34.83 34.63 1v61 s MET 36 CO -0.05 -0.31 -0.16 -1.14 1.05 0.00 0.00 175.02 174.41 1v61 s GLN 37 N 1.88 1.01 0.08 4.11 0.74 -1.26 -4.38 119.66 121.83 1v61 s GLN 37 Ca 0.05 -0.92 -0.19 0.00 0.05 0.00 0.00 55.36 54.36 1v61 s GLN 37 Cb -0.13 -1.08 -0.05 0.00 1.10 0.00 0.00 33.01 32.85 1v61 s GLN 37 CO -0.06 0.26 1.32 1.25 -0.55 0.00 0.00 175.29 177.50 1v61 h HIS 38 N 4.58 -1.05 0.00 1.67 -0.00 -1.97 -3.41 115.15 114.98 1v61 h HIS 38 Ca -0.41 0.06 0.00 0.00 -0.00 0.00 0.00 60.37 60.02 1v61 h HIS 38 Cb 1.18 0.51 0.00 0.00 -0.00 0.00 0.00 27.41 29.10 1v61 h HIS 38 CO 0.57 -0.25 0.00 0.41 -0.00 0.00 0.00 177.93 178.66 1v61 n GLY 39 N -1.18 -2.09 2.77 5.26 0.00 -1.26 -4.83 105.19 103.87 1v61 n GLY 39 Ca -0.00 0.67 -0.29 0.00 0.00 0.00 0.00 46.02 46.39 1v61 n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v61 s ALA 40 N -1.00 2.68 0.00 4.61 0.00 -1.26 -4.93 121.76 121.86 1v61 s ALA 40 Ca 0.00 -2.99 0.00 0.00 0.00 0.00 0.00 51.96 48.97 1v61 s ALA 40 Cb 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 23.12 21.14 1v61 s ALA 40 CO 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 175.76 173.71 1v61 n GLU 42 N -2.15 0.00 -4.06 0.00 -0.58 -1.26 -5.17 120.64 107.42 1v61 n GLU 42 Ca 0.00 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.61 1v61 n GLU 42 Cb 0.00 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.82 1v61 n GLU 42 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1v61 s GLU 43 N -1.24 1.76 0.16 3.49 2.02 -1.26 -5.12 118.70 118.51 1v61 s GLU 43 Ca 0.00 -1.59 -0.32 0.00 0.02 0.00 0.00 54.97 53.09 1v61 s GLU 43 Cb 0.00 0.44 -0.17 0.00 0.10 0.00 0.00 34.13 34.50 1v61 s GLU 43 CO 0.00 -0.72 0.78 0.36 0.02 0.00 0.00 175.26 175.70 1v61 n LYS 44 N -0.48 0.28 -3.57 1.61 2.85 -1.26 -4.89 118.16 112.69 1v61 n LYS 44 Ca -0.00 0.10 -0.41 0.00 -1.05 0.00 0.00 58.31 56.95 1v61 n LYS 44 Cb 0.62 -1.32 -0.09 0.00 -0.65 0.00 0.00 35.03 33.59 1v61 n LYS 44 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 1v61 s GLU 45 N -0.72 2.45 0.17 -1.58 2.12 -1.26 -4.99 118.70 114.88 1v61 s GLU 45 Ca 0.71 -1.78 -0.30 0.00 0.36 0.00 0.00 54.97 53.96 1v61 s GLU 45 Cb -0.98 -3.90 -0.07 0.00 0.26 0.00 0.00 34.13 29.43 1v61 s GLU 45 CO 0.56 -1.19 1.01 -1.21 -0.54 0.00 0.00 175.26 173.89 1v61 s GLU 46 N 1.32 4.70 0.23 4.30 2.02 -1.26 0.20 118.70 130.22 1v61 s GLU 46 Ca 0.06 1.56 -0.18 0.00 0.02 0.00 0.00 54.97 56.43 1v61 s GLU 46 Cb -0.26 -3.31 0.02 0.00 0.10 0.00 0.00 34.13 30.68 1v61 s GLU 46 CO -0.01 0.25 0.59 1.03 0.02 0.00 0.00 175.26 177.14 1v61 s ARG 47 N -0.48 1.54 -0.09 1.61 0.52 0.30 -4.88 118.95 117.46 1v61 s ARG 47 Ca 0.46 -0.93 -0.01 0.00 -0.52 0.00 0.00 55.73 54.73 1v61 s ARG 47 Cb -0.26 0.55 -0.03 0.00 0.52 0.00 0.00 34.95 35.73 1v61 s ARG 47 CO 0.33 -0.67 -0.04 -0.47 0.02 0.00 0.00 175.30 174.46 1v61 s TYR 48 N -3.90 3.02 -0.17 -0.53 5.04 0.21 0.26 117.35 121.27 1v61 s TYR 48 Ca 0.11 -0.01 0.01 0.00 -2.44 0.00 0.00 57.07 54.74 1v61 s TYR 48 Cb -0.03 -1.79 0.03 0.00 0.35 0.00 0.00 41.96 40.52 1v61 s TYR 48 CO 0.02 0.28 -0.16 -0.06 -1.34 0.00 0.00 175.55 174.28 1v61 s PHE 49 N -0.55 2.55 -0.34 4.97 0.40 -1.20 -0.03 117.98 123.78 1v61 s PHE 49 Ca 0.09 -1.53 -0.07 0.00 -0.60 0.00 0.00 56.93 54.82 1v61 s PHE 49 Cb -0.12 -1.78 0.04 0.00 0.51 0.00 0.00 43.02 41.67 1v61 s PHE 49 CO 0.02 -0.76 0.11 -0.51 0.70 0.00 0.00 175.22 174.78 1v61 s LEU 50 N 1.36 4.33 -0.36 -0.37 1.43 0.22 -3.85 118.68 121.44 1v61 s LEU 50 Ca 0.04 -1.13 -0.24 0.00 -1.03 0.00 0.00 54.13 51.77 1v61 s LEU 50 Cb -0.14 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.22 1v61 s LEU 50 CO -0.11 -0.33 0.81 -0.22 0.23 0.00 0.00 176.35 176.73 1v61 s LEU 51 N 1.41 4.11 0.00 1.79 2.96 -1.21 -1.28 118.68 126.46 1v61 s LEU 51 Ca -0.01 0.40 0.22 0.00 -0.22 0.00 0.00 54.13 54.52 1v61 s LEU 51 Cb -0.19 -3.07 0.61 0.00 0.50 0.00 0.00 46.19 44.04 1v61 s LEU 51 CO 0.03 -0.75 1.51 0.49 -1.32 0.00 0.00 176.35 176.31 1v61 n PHE 52 N 6.47 0.90 -3.22 5.38 3.01 -0.93 0.56 117.46 129.64 1v61 n PHE 52 Ca 0.04 -0.47 -0.16 0.00 1.01 0.00 0.00 57.45 57.87 1v61 n PHE 52 Cb 0.48 -0.00 0.06 0.00 -0.01 0.00 0.00 39.48 40.01 1v61 n PHE 52 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1v61 n SER 53 N 1.59 -4.34 0.00 4.37 2.88 -1.26 -3.98 113.62 112.88 1v61 n SER 53 Ca 0.23 -0.40 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1v61 n SER 53 Cb 0.61 -3.76 0.00 0.00 -0.75 0.00 0.00 64.21 60.31 1v61 n SER 53 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1v61 n SER 54 N -1.94 0.00 -3.84 -3.46 7.64 -1.26 -5.00 113.62 105.76 1v61 n SER 54 Ca -0.05 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.71 1v61 n SER 54 Cb 0.56 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.67 1v61 n SER 54 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1v61 s VAL 55 N 0.00 0.07 -0.68 0.44 0.11 -1.26 0.13 120.40 119.21 1v61 s VAL 55 Ca 0.00 -0.57 -0.10 0.00 -2.93 0.00 0.00 61.98 58.38 1v61 s VAL 55 Cb 0.00 -0.47 0.18 0.00 -1.53 0.00 0.00 36.38 34.56 1v61 s VAL 55 CO 0.00 -0.31 0.57 -0.22 -3.33 0.00 0.00 175.10 171.81 1v61 s LEU 56 N -1.23 6.05 0.01 2.54 1.98 0.59 -2.18 118.68 126.44 1v61 s LEU 56 Ca -0.13 -2.54 -0.30 0.00 -2.89 0.00 0.00 54.13 48.26 1v61 s LEU 56 Cb -0.06 -2.06 -0.04 0.00 0.66 0.00 0.00 46.19 44.68 1v61 s LEU 56 CO 0.02 -0.55 1.12 -0.63 -1.89 0.00 0.00 176.35 174.42 1v61 s ILE 57 N 0.40 4.38 -0.14 6.68 -1.09 -0.41 -2.36 121.20 128.67 1v61 s ILE 57 Ca 0.14 1.71 -0.03 0.00 -2.23 0.00 0.00 60.65 60.24 1v61 s ILE 57 Cb -0.18 -4.09 -0.03 0.00 -1.58 0.00 0.00 42.46 36.58 1v61 s ILE 57 CO -0.05 0.09 -0.03 -0.04 -1.23 0.00 0.00 174.94 173.69 1v61 s MET 58 N 1.36 3.50 0.19 2.79 -1.94 -1.17 0.73 119.30 124.76 1v61 s MET 58 Ca 0.55 -0.49 0.08 0.00 -1.71 0.00 0.00 55.69 54.12 1v61 s MET 58 Cb -0.25 -2.88 -0.05 0.00 2.01 0.00 0.00 34.83 33.66 1v61 s MET 58 CO 0.26 0.36 -0.15 -0.51 -0.01 0.00 0.00 175.02 174.98 1v61 s LEU 59 N 0.05 2.52 0.00 -0.03 1.02 0.95 -0.43 118.68 122.77 1v61 s LEU 59 Ca 0.01 -0.98 -0.04 0.00 0.02 0.00 0.00 54.13 53.14 1v61 s LEU 59 Cb -0.13 -0.69 -0.00 0.00 0.02 0.00 0.00 46.19 45.39 1v61 s LEU 59 CO 0.02 -0.15 0.07 -0.44 0.02 0.00 0.00 176.35 175.88 1v61 s SER 60 N -3.13 0.08 -0.61 2.29 0.01 -0.16 0.67 113.70 112.84 1v61 s SER 60 Ca 0.20 -0.25 0.03 0.00 1.31 0.00 0.00 55.95 57.24 1v61 s SER 60 Cb -0.02 0.17 0.15 0.00 0.21 0.00 0.00 66.02 66.53 1v61 s SER 60 CO 0.06 -0.30 0.38 0.00 0.41 0.00 0.00 173.24 173.80 1v61 s ALA 61 N -1.19 3.54 -0.12 1.44 0.00 -1.26 -0.92 121.76 123.25 1v61 s ALA 61 Ca -0.13 -3.45 -0.19 0.00 0.00 0.00 0.00 51.96 48.19 1v61 s ALA 61 Cb -0.07 -2.29 -0.17 0.00 0.00 0.00 0.00 23.12 20.58 1v61 s ALA 61 CO 0.00 -2.06 0.52 0.77 0.00 0.00 0.00 175.76 174.99 1v61 h SER 62 N 6.28 -0.01 -0.43 0.00 0.02 -1.98 -3.47 113.55 113.97 1v61 h SER 62 Ca 0.00 -0.63 0.00 0.00 -0.84 0.00 0.00 61.79 60.32 1v61 h SER 62 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1v61 h SER 62 CO 0.71 0.80 0.00 -0.81 -1.14 0.00 0.00 176.83 176.39 1v61 n PRO 63 N -4.68 0.63 -0.75 3.45 -0.04 -1.26 -5.04 135.00 127.31 1v61 n PRO 63 Ca -0.07 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.10 1v61 n PRO 63 Cb 0.31 0.00 0.25 0.00 -0.04 0.00 0.00 33.50 34.02 1v61 n PRO 63 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1v61 s ARG 64 N -0.74 -1.62 0.95 0.54 1.70 -1.26 -4.97 118.95 113.55 1v61 s ARG 64 Ca 0.00 0.22 -0.10 0.00 -0.47 0.00 0.00 55.73 55.37 1v61 s ARG 64 Cb 0.00 -1.52 0.17 0.00 -0.57 0.00 0.00 34.95 33.02 1v61 s ARG 64 CO 0.00 -4.03 1.13 1.41 -1.08 0.00 0.00 175.30 172.73 1v61 s MET 65 N -5.07 0.72 -0.02 3.89 -2.45 -1.26 -4.71 119.30 110.40 1v61 s MET 65 Ca 0.69 1.44 -0.01 0.00 -1.25 0.00 0.00 55.69 56.56 1v61 s MET 65 Cb -0.15 -1.70 0.01 0.00 1.25 0.00 0.00 34.83 34.24 1v61 s MET 65 CO 0.58 -2.80 0.03 0.45 1.05 0.00 0.00 175.02 174.33 1v61 n SER 66 N -4.34 -2.26 0.00 1.11 2.88 -1.26 -5.08 113.62 104.67 1v61 n SER 66 Ca 0.10 0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.90 1v61 n SER 66 Cb 0.52 -1.72 0.00 0.00 -0.75 0.00 0.00 64.21 62.26 1v61 n SER 66 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v61 n GLY 67 N 0.30 2.88 3.46 0.46 0.00 -1.26 -5.09 105.19 105.93 1v61 n GLY 67 Ca -0.05 -1.50 -0.22 0.00 0.00 0.00 0.00 46.02 44.26 1v61 n GLY 67 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1v61 s PHE 68 N -0.74 1.99 -0.11 1.61 0.08 -1.26 -4.76 117.98 114.78 1v61 s PHE 68 Ca 0.00 -0.94 -0.01 0.00 0.12 0.00 0.00 56.93 56.10 1v61 s PHE 68 Cb 0.00 -1.30 0.03 0.00 -0.57 0.00 0.00 43.02 41.18 1v61 s PHE 68 CO 0.00 0.03 -0.04 1.41 -0.10 0.00 0.00 175.22 176.52 1v61 s MET 69 N -3.88 1.10 0.40 0.44 -2.45 -0.09 -1.86 119.30 112.95 1v61 s MET 69 Ca 0.36 -0.14 -0.27 0.00 -1.25 0.00 0.00 55.69 54.40 1v61 s MET 69 Cb 0.09 -1.41 -0.09 0.00 1.25 0.00 0.00 34.83 34.67 1v61 s MET 69 CO 0.16 -0.32 1.39 -0.47 1.05 0.00 0.00 175.02 176.83 1v61 s TYR 70 N 1.82 2.68 -0.41 4.11 5.04 0.32 -0.99 117.35 129.91 1v61 s TYR 70 Ca 0.04 1.30 0.09 0.00 -2.44 0.00 0.00 57.07 56.07 1v61 s TYR 70 Cb -0.13 -3.84 0.29 0.00 0.35 0.00 0.00 41.96 38.63 1v61 s TYR 70 CO -0.07 -2.55 0.63 1.04 -1.34 0.00 0.00 175.55 173.25 1v61 n GLN 71 N 0.21 1.05 -0.53 4.97 1.13 0.43 -4.78 117.38 119.86 1v61 n GLN 71 Ca 0.03 -3.46 0.07 0.00 -1.94 0.00 0.00 57.00 51.70 1v61 n GLN 71 Cb 0.42 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.24 1v61 n GLN 71 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1v61 n GLY 72 N 0.92 -2.11 3.22 1.08 0.00 -1.26 -4.64 105.19 102.41 1v61 n GLY 72 Ca 0.23 -1.36 -0.09 0.00 0.00 0.00 0.00 46.02 44.80 1v61 n GLY 72 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v61 s LYS 73 N -2.33 0.98 -0.04 1.61 0.00 -1.26 -3.02 119.74 115.69 1v61 s LYS 73 Ca 0.00 -1.30 0.01 0.00 0.00 0.00 0.00 55.97 54.68 1v61 s LYS 73 Cb 0.00 0.30 0.02 0.00 0.00 0.00 0.00 37.83 38.15 1v61 s LYS 73 CO 0.00 -0.31 -0.04 0.42 0.00 0.00 0.00 175.35 175.42 1v61 s ILE 74 N -4.00 0.46 0.19 3.79 1.01 -1.00 -4.91 121.20 116.74 1v61 s ILE 74 Ca 0.19 -0.08 -0.30 0.00 0.00 0.00 0.00 60.65 60.46 1v61 s ILE 74 Cb 0.06 -0.49 -0.08 0.00 0.01 0.00 0.00 42.46 41.96 1v61 s ILE 74 CO -0.00 0.20 1.11 -2.16 0.00 0.00 0.00 174.94 174.09 1v61 s PRO 75 N 0.90 4.58 0.63 2.79 0.04 -1.26 0.22 135.00 142.90 1v61 s PRO 75 Ca -0.11 1.75 0.39 0.00 0.04 0.00 0.00 61.00 63.07 1v61 s PRO 75 Cb -0.14 -3.26 2.15 0.00 0.04 0.00 0.00 34.50 33.29 1v61 s PRO 75 CO -0.00 0.06 2.30 0.82 0.04 0.00 0.00 177.00 180.22 1v61 h ILE 76 N 3.67 0.17 0.00 0.56 1.08 0.68 -0.98 117.51 122.68 1v61 h ILE 76 Ca -0.45 -0.08 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 1v61 h ILE 76 Cb 1.21 1.06 0.00 0.00 -3.07 0.00 0.00 36.82 36.02 1v61 h ILE 76 CO 0.72 0.01 0.00 0.00 -0.69 0.00 0.00 178.15 178.19 1v61 n ALA 77 N -2.15 0.00 0.32 1.87 0.00 -1.26 -3.22 120.51 116.07 1v61 n ALA 77 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.55 1v61 n ALA 77 Cb 0.10 0.00 0.69 0.00 0.00 0.00 0.00 19.45 20.24 1v61 n ALA 77 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1v61 h GLY 78 N 0.00 0.00 -3.00 0.00 0.00 -1.92 -3.43 103.07 94.73 1v61 h GLY 78 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 1v61 h GLY 78 CO 0.00 0.00 -0.83 -0.13 0.00 0.00 0.00 176.54 175.58 1v61 n MET 79 N -2.87 0.16 -3.52 4.80 0.00 -0.38 -4.02 117.12 111.30 1v61 n MET 79 Ca -0.01 0.08 -0.23 0.00 0.00 0.00 0.00 57.70 57.54 1v61 n MET 79 Cb 0.50 -1.49 -0.14 0.00 0.00 0.00 0.00 33.22 32.09 1v61 n MET 79 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1v61 s VAL 80 N -1.96 -0.21 -0.05 1.12 1.01 -0.31 -4.86 120.40 115.14 1v61 s VAL 80 Ca 0.59 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.19 1v61 s VAL 80 Cb -0.36 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 1v61 s VAL 80 CO 0.64 -0.43 -0.08 -0.69 0.00 0.00 0.00 175.10 174.54 1v61 s VAL 81 N 2.22 3.60 -0.30 2.92 1.01 -1.26 -3.40 120.40 125.19 1v61 s VAL 81 Ca 0.07 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.32 1v61 s VAL 81 Cb -0.16 -2.48 0.21 0.00 0.00 0.00 0.00 36.38 33.95 1v61 s VAL 81 CO -0.23 0.56 1.24 0.54 0.00 0.00 0.00 175.10 177.21 1v61 s ASN 82 N -0.91 -0.09 -0.45 3.32 2.20 -1.26 -5.06 114.94 112.68 1v61 s ASN 82 Ca 0.13 0.15 -0.45 0.00 -0.94 0.00 0.00 52.86 51.75 1v61 s ASN 82 Cb -0.11 1.04 -0.19 0.00 -2.00 0.00 0.00 41.25 39.99 1v61 s ASN 82 CO 0.02 -0.02 1.73 -1.14 -2.94 0.00 0.00 177.10 174.75 1v61 n ARG 83 N 3.14 0.29 -0.73 3.55 0.63 -1.26 -4.23 116.66 118.04 1v61 n ARG 83 Ca -0.17 0.10 -0.25 0.00 -0.92 0.00 0.00 57.85 56.61 1v61 n ARG 83 Cb 0.56 -1.67 -0.03 0.00 0.45 0.00 0.00 32.46 31.78 1v61 n ARG 83 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1v61 n LEU 84 N 4.99 4.05 -1.02 6.15 4.77 -0.21 -4.34 117.00 131.40 1v61 n LEU 84 Ca 0.34 -2.63 0.07 0.00 -0.03 0.00 0.00 56.01 53.76 1v61 n LEU 84 Cb -0.01 -1.01 0.23 0.00 -2.33 0.00 0.00 43.42 40.30 1v61 n LEU 84 CO 0.87 0.11 0.69 -0.67 -1.33 0.00 0.00 177.39 177.05 1v61 n ASP 85 N 5.16 2.95 0.00 -1.43 2.03 -1.26 -4.07 116.55 119.93 1v61 n ASP 85 Ca 0.40 -2.11 0.06 0.00 0.52 0.00 0.00 54.79 53.66 1v61 n ASP 85 Cb 0.18 -0.39 0.26 0.00 -0.72 0.00 0.00 41.12 40.45 1v61 n ASP 85 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1v61 n GLU 86 N 0.88 0.05 0.00 -0.67 1.02 -1.26 -4.62 120.64 116.04 1v61 n GLU 86 Ca 0.17 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 1v61 n GLU 86 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1v61 n GLU 86 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1v61 n ILE 87 N -1.43 0.00 -3.53 -3.67 2.08 -1.26 -5.14 119.36 106.40 1v61 n ILE 87 Ca 0.04 0.00 -0.00 0.00 0.56 0.00 0.00 62.75 63.34 1v61 n ILE 87 Cb 0.12 0.00 -0.05 0.00 -0.75 0.00 0.00 39.64 38.96 1v61 n ILE 87 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 1v61 s GLU 88 N 3.47 0.30 -0.59 0.38 -1.05 -1.26 -5.03 118.70 114.92 1v61 s GLU 88 Ca 0.00 0.62 -0.20 0.00 -0.15 0.00 0.00 54.97 55.24 1v61 s GLU 88 Cb 0.00 0.22 0.03 0.00 -0.44 0.00 0.00 34.13 33.94 1v61 s GLU 88 CO 0.00 -0.08 0.64 0.41 0.95 0.00 0.00 175.26 177.18 1v61 n GLY 89 N 4.20 -0.63 2.19 -3.83 0.00 -1.26 -4.87 105.19 100.98 1v61 n GLY 89 Ca -0.14 0.94 0.00 0.00 0.00 0.00 0.00 46.02 46.82 1v61 n GLY 89 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v61 n SER 90 N -1.12 -3.45 0.00 1.61 2.88 -1.26 -5.17 113.62 107.11 1v61 n SER 90 Ca -0.13 0.77 0.00 0.00 -1.33 0.00 0.00 58.87 58.18 1v61 n SER 90 Cb 0.64 3.28 0.00 0.00 -0.75 0.00 0.00 64.21 67.38 1v61 n SER 90 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1v61 n ASP 91 N -3.33 0.00 0.00 -3.46 2.03 -1.26 -5.10 116.55 105.43 1v61 n ASP 91 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1v61 n ASP 91 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1v61 n ASP 91 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1v61 n MET 93 N -0.40 -3.04 -3.69 0.00 1.56 -1.26 -3.47 117.12 106.82 1v61 n MET 93 Ca 0.00 2.13 -0.12 0.00 -0.27 0.00 0.00 57.70 59.44 1v61 n MET 93 Cb 0.00 -3.68 -0.06 0.00 2.15 0.00 0.00 33.22 31.63 1v61 n MET 93 CO 0.00 0.00 0.00 -0.59 -0.73 0.00 0.00 175.97 174.65 1v61 s PHE 94 N -2.70 -0.22 0.21 1.12 -0.71 -1.26 -1.04 117.98 113.37 1v61 s PHE 94 Ca 0.00 0.13 0.08 0.00 -1.04 0.00 0.00 56.93 56.10 1v61 s PHE 94 Cb 0.00 0.19 -0.04 0.00 -1.21 0.00 0.00 43.02 41.96 1v61 s PHE 94 CO 0.00 -0.56 -0.02 -1.83 -1.34 0.00 0.00 175.22 171.47 1v61 s GLU 95 N -2.61 2.30 -0.43 1.99 -1.05 -1.26 -3.28 118.70 114.36 1v61 s GLU 95 Ca -0.04 -1.24 0.02 0.00 -0.15 0.00 0.00 54.97 53.56 1v61 s GLU 95 Cb -0.01 -2.26 0.13 0.00 -0.44 0.00 0.00 34.13 31.56 1v61 s GLU 95 CO -0.03 0.42 0.22 0.42 0.95 0.00 0.00 175.26 177.24 1v61 s ILE 96 N -1.92 1.58 0.34 1.83 1.01 -0.20 -4.34 121.20 119.50 1v61 s ILE 96 Ca 0.28 -2.55 0.03 0.00 0.00 0.00 0.00 60.65 58.40 1v61 s ILE 96 Cb -0.08 -2.11 0.03 0.00 0.01 0.00 0.00 42.46 40.30 1v61 s ILE 96 CO 0.18 -0.85 0.22 0.35 0.00 0.00 0.00 174.94 174.85 1v61 n THR 97 N 3.63 0.00 0.00 2.92 -2.24 -1.22 -2.88 114.28 114.50 1v61 n THR 97 Ca 0.07 -1.37 0.00 0.00 -2.27 0.00 0.00 64.05 60.48 1v61 n THR 97 Cb 0.35 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 1v61 n THR 97 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1v61 n GLY 98 N 0.94 3.85 0.27 3.38 0.00 -1.26 -1.16 105.19 111.20 1v61 n GLY 98 Ca -0.03 -0.82 -0.07 0.00 0.00 0.00 0.00 46.02 45.10 1v61 n GLY 98 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v61 n SER 99 N 0.00 -0.67 0.00 1.61 2.88 -1.26 -4.78 113.62 111.39 1v61 n SER 99 Ca 0.00 1.46 0.00 0.00 -1.33 0.00 0.00 58.87 59.00 1v61 n SER 99 Cb 0.00 -0.31 0.00 0.00 -0.75 0.00 0.00 64.21 63.15 1v61 n SER 99 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1v61 n THR 100 N -4.44 0.00 0.00 2.46 -1.04 -1.26 -5.05 114.28 104.94 1v61 n THR 100 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1v61 n THR 100 Cb 0.17 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.68 1v61 n THR 100 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1v61 n VAL 101 N -2.28 0.00 -1.25 12.58 0.31 -1.26 -5.10 118.33 121.32 1v61 n VAL 101 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.88 1v61 n VAL 101 Cb 0.00 -0.27 -0.04 0.00 -0.91 0.00 0.00 33.84 32.62 1v61 n VAL 101 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1v61 n GLU 102 N -2.09 0.00 -4.02 5.55 2.13 -1.26 -4.88 120.64 116.07 1v61 n GLU 102 Ca 0.00 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.47 1v61 n GLU 102 Cb 0.00 -1.03 -0.14 0.00 0.27 0.00 0.00 31.44 30.53 1v61 n GLU 102 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1v61 s ARG 103 N -0.55 3.34 -0.55 5.31 3.52 -1.26 -4.58 118.95 124.18 1v61 s ARG 103 Ca 0.65 -0.65 -0.25 0.00 -0.13 0.00 0.00 55.73 55.35 1v61 s ARG 103 Cb -0.92 -2.93 0.04 0.00 -1.56 0.00 0.00 34.95 29.58 1v61 s ARG 103 CO 0.49 -0.15 0.99 0.42 -0.81 0.00 0.00 175.30 176.24 1v61 s ILE 104 N 1.33 4.32 -0.62 4.11 1.01 -1.14 -4.78 121.20 125.43 1v61 s ILE 104 Ca 0.04 0.43 -0.17 0.00 0.00 0.00 0.00 60.65 60.95 1v61 s ILE 104 Cb -0.14 -4.57 0.13 0.00 0.01 0.00 0.00 42.46 37.88 1v61 s ILE 104 CO -0.03 -1.14 0.68 -0.69 0.00 0.00 0.00 174.94 173.75 1v61 s VAL 105 N 4.13 5.02 -0.29 2.92 1.01 -1.26 -1.03 120.40 130.90 1v61 s VAL 105 Ca 0.33 -1.35 -0.26 0.00 0.00 0.00 0.00 61.98 60.70 1v61 s VAL 105 Cb -0.11 -4.46 0.01 0.00 0.00 0.00 0.00 36.38 31.81 1v61 s VAL 105 CO 0.21 -1.06 0.91 -0.69 0.00 0.00 0.00 175.10 174.46 1v61 s VAL 106 N 2.08 4.70 0.33 2.92 1.01 -1.20 -3.82 120.40 126.42 1v61 s VAL 106 Ca 0.11 1.51 -0.28 0.00 0.00 0.00 0.00 61.98 63.31 1v61 s VAL 106 Cb -0.23 -4.24 -0.10 0.00 0.00 0.00 0.00 36.38 31.81 1v61 s VAL 106 CO 0.03 -0.29 1.21 -1.00 0.00 0.00 0.00 175.10 175.05 1v61 s HIS 107 N 3.18 3.21 0.00 5.22 3.76 0.04 -4.40 115.29 126.30 1v61 s HIS 107 Ca 0.38 1.54 0.00 0.00 -0.15 0.00 0.00 55.06 56.83 1v61 s HIS 107 Cb -0.14 -3.48 0.00 0.00 1.11 0.00 0.00 32.58 30.07 1v61 s HIS 107 CO 0.12 -1.32 0.00 0.00 -0.85 0.00 0.00 174.74 172.69 1v61 h ASN 109 N 0.00 -0.98 0.00 0.00 -0.73 -2.00 -3.38 115.58 108.50 1v61 h ASN 109 Ca 0.00 0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.33 1v61 h ASN 109 Cb 0.00 0.44 0.00 0.00 0.27 0.00 0.00 38.32 39.03 1v61 h ASN 109 CO 0.00 -0.33 0.00 -3.20 -0.37 0.00 0.00 177.43 173.53 1v61 n ASN 110 N -5.40 -1.25 -0.62 1.15 5.15 -1.26 -4.34 115.26 108.68 1v61 n ASN 110 Ca -0.01 0.29 0.07 0.00 -0.60 0.00 0.00 54.58 54.33 1v61 n ASN 110 Cb 0.32 1.46 -0.02 0.00 -0.53 0.00 0.00 39.78 41.02 1v61 n ASN 110 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1v61 n ASN 111 N -2.70 -3.69 -0.12 1.20 4.13 -1.26 -4.08 115.26 108.74 1v61 n ASN 111 Ca 0.00 0.56 -0.24 0.00 1.68 0.00 0.00 54.58 56.59 1v61 n ASN 111 Cb 0.00 -1.80 -0.11 0.00 -1.54 0.00 0.00 39.78 36.33 1v61 n ASN 111 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1v61 n GLN 112 N -1.94 0.63 -0.08 3.52 6.02 -1.26 -4.19 117.38 120.07 1v61 n GLN 112 Ca 0.00 0.25 -0.08 0.00 -0.01 0.00 0.00 57.00 57.17 1v61 n GLN 112 Cb 0.24 -1.55 -0.06 0.00 1.02 0.00 0.00 30.24 29.89 1v61 n GLN 112 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1v61 h ASP 113 N -0.52 -1.06 -0.90 1.08 3.32 -2.02 -0.77 116.42 115.56 1v61 h ASP 113 Ca -0.59 0.14 0.15 0.00 0.02 0.00 0.00 57.03 56.75 1v61 h ASP 113 Cb 1.73 0.43 -0.16 0.00 0.22 0.00 0.00 39.33 41.56 1v61 h ASP 113 CO -0.22 -0.23 -0.33 0.15 -1.72 0.00 0.00 179.24 176.89 1v61 h PHE 114 N -0.22 -0.88 -0.89 4.55 3.57 -1.80 0.67 116.94 121.93 1v61 h PHE 114 Ca 0.04 0.09 0.34 0.00 3.53 0.00 0.00 57.97 61.98 1v61 h PHE 114 Cb 0.33 0.52 -0.16 0.00 2.79 0.00 0.00 35.95 39.43 1v61 h PHE 114 CO -0.68 -0.40 0.36 0.94 -2.23 0.00 0.00 178.31 176.31 1v61 n GLN 115 N -5.50 -0.06 -0.03 1.11 7.27 -0.31 0.19 117.38 120.05 1v61 n GLN 115 Ca 0.10 1.26 -0.12 0.00 0.07 0.00 0.00 57.00 58.31 1v61 n GLN 115 Cb 0.41 -2.19 -0.08 0.00 2.41 0.00 0.00 30.24 30.79 1v61 n GLN 115 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1v61 h GLU 116 N 0.00 0.19 -0.76 3.69 4.39 0.53 -1.64 114.58 120.97 1v61 h GLU 116 Ca 0.70 -0.07 0.17 0.00 0.34 0.00 0.00 59.36 60.50 1v61 h GLU 116 Cb 1.78 -0.01 -0.14 0.00 -0.10 0.00 0.00 28.75 30.29 1v61 h GLU 116 CO -0.73 0.52 -0.04 -1.49 -1.16 0.00 0.00 179.01 176.11 1v61 h TRP 117 N -0.15 -0.13 0.00 4.33 4.06 0.24 1.62 115.95 125.91 1v61 h TRP 117 Ca 0.02 0.06 -0.07 0.00 2.06 0.00 0.00 58.89 60.96 1v61 h TRP 117 Cb 0.45 0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 28.78 1v61 h TRP 117 CO 0.06 -0.27 -0.32 0.52 -3.56 0.00 0.00 178.44 174.87 1v61 h MET 118 N 0.07 0.00 0.08 0.49 2.86 -1.07 0.32 114.93 117.68 1v61 h MET 118 Ca 0.41 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 58.05 1v61 h MET 118 Cb 0.71 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.37 1v61 h MET 118 CO -0.70 0.32 -0.04 1.49 1.06 0.00 0.00 176.91 179.04 1v61 h GLU 119 N 0.00 -0.10 0.32 1.72 4.81 0.30 -2.36 114.58 119.26 1v61 h GLU 119 Ca -0.00 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1v61 h GLU 119 Cb 0.61 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.01 1v61 h GLU 119 CO 0.04 0.37 -0.15 -0.56 -0.73 0.00 0.00 179.01 177.98 1v61 h GLN 120 N -0.64 -0.41 -0.54 1.92 3.07 0.28 -2.81 115.11 115.99 1v61 h GLN 120 Ca -0.01 0.03 0.16 0.00 0.09 0.00 0.00 58.65 58.91 1v61 h GLN 120 Cb 0.52 0.09 -0.02 0.00 0.08 0.00 0.00 27.48 28.16 1v61 h GLN 120 CO 0.02 -0.08 0.67 -0.07 0.09 0.00 0.00 178.83 179.46 1v61 h LEU 121 N -0.86 0.00 -1.52 0.06 3.38 -0.49 2.56 115.31 118.43 1v61 h LEU 121 Ca -0.04 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1v61 h LEU 121 Cb 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1v61 h LEU 121 CO 0.07 0.00 -0.23 -1.13 0.09 0.00 0.00 178.44 177.24 1v61 h ASN 122 N 0.00 0.00 0.00 -0.43 -0.73 -1.14 -0.15 115.58 113.13 1v61 h ASN 122 Ca 0.25 0.00 -0.21 0.00 1.87 0.00 0.00 56.30 58.21 1v61 h ASN 122 Cb 1.60 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 40.15 1v61 h ASN 122 CO -0.00 0.23 -1.96 -2.11 -0.37 0.00 0.00 177.43 173.22 1v61 n ARG 123 N -3.76 1.33 0.10 6.67 1.85 0.80 -3.74 116.66 119.91 1v61 n ARG 123 Ca -0.01 -0.04 -0.04 0.00 -1.00 0.00 0.00 57.85 56.76 1v61 n ARG 123 Cb 0.33 -1.38 -0.02 0.00 -1.05 0.00 0.00 32.46 30.34 1v61 n ARG 123 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 1v61 h LEU 124 N 0.00 -0.23 0.68 2.89 3.38 0.37 -3.14 115.31 119.26 1v61 h LEU 124 Ca -0.32 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 1v61 h LEU 124 Cb 1.66 0.06 0.01 0.00 0.09 0.00 0.00 40.66 42.48 1v61 h LEU 124 CO 0.02 -0.06 -0.33 0.71 0.09 0.00 0.00 178.44 178.87 1v61 h THR 125 N -0.48 0.31 -0.50 0.22 1.35 -1.25 -3.18 112.91 109.38 1v61 h THR 125 Ca -0.03 -0.08 -0.72 0.00 -0.55 0.00 0.00 66.41 65.04 1v61 h THR 125 Cb 0.21 0.33 -0.06 0.00 -1.73 0.00 0.00 68.15 66.90 1v61 h THR 125 CO 0.05 0.01 2.97 0.29 -0.25 0.00 0.00 175.52 178.58 1v61 n LYS 126 N -5.46 3.54 0.03 4.72 5.02 -1.22 -4.75 118.16 120.03 1v61 n LYS 126 Ca -0.13 -2.84 -0.10 0.00 -2.02 0.00 0.00 58.31 53.22 1v61 n LYS 126 Cb 0.38 -2.97 -0.06 0.00 -0.02 0.00 0.00 35.03 32.36 1v61 n LYS 126 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1v61 h SER 127 N 5.44 -1.01 -1.90 4.39 0.87 -1.52 -3.41 113.55 116.42 1v61 h SER 127 Ca 0.63 0.11 -0.18 0.00 -1.23 0.00 0.00 61.79 61.13 1v61 h SER 127 Cb 0.49 0.38 0.11 0.00 -0.44 0.00 0.00 62.40 62.94 1v61 h SER 127 CO 1.74 -0.32 -0.09 0.61 -0.53 0.00 0.00 176.83 178.24 1v61 n GLY 128 N -1.28 -2.22 0.14 5.77 0.00 -1.26 -4.92 105.19 101.41 1v61 n GLY 128 Ca -0.04 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 45.09 1v61 n GLY 128 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v61 h PRO 129 N 0.00 0.38 0.00 1.61 0.13 -1.95 -3.46 132.00 128.71 1v61 h PRO 129 Ca -0.20 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 1v61 h PRO 129 Cb 0.66 0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1v61 h PRO 129 CO 0.12 1.03 0.00 0.45 -0.23 0.00 0.00 178.00 179.37 1v61 n SER 130 N -4.30 -1.10 -4.99 1.44 2.88 -1.26 -5.13 113.62 101.16 1v61 n SER 130 Ca -0.10 0.46 -0.18 0.00 -1.33 0.00 0.00 58.87 57.73 1v61 n SER 130 Cb 0.61 1.18 -0.00 0.00 -0.75 0.00 0.00 64.21 65.25 1v61 n SER 130 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1v61 s SER 131 N -4.05 5.79 0.00 -3.46 1.04 -1.26 -5.07 113.70 106.69 1v61 s SER 131 Ca 0.00 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.12 1v61 s SER 131 Cb 0.00 -0.97 0.00 0.00 0.10 0.00 0.00 66.02 65.15 1v61 s SER 131 CO 0.00 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.26