#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b5g s VAL 17 N 0.00 5.12 -1.04 1.39 1.01 0.14 -4.23 120.40 122.80 1b5g s VAL 17 Ca 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 1b5g s VAL 17 Cb 0.00 -3.37 0.01 0.00 0.00 0.00 0.00 36.38 33.01 1b5g s VAL 17 CO 0.00 0.37 0.90 -0.62 0.00 0.00 0.00 175.10 175.75 1b5g n GLU 18 N 4.21 -6.03 -0.88 2.72 -0.58 -1.26 -2.37 120.64 116.46 1b5g n GLU 18 Ca -0.15 0.67 0.00 0.00 -0.42 0.00 0.00 57.16 57.25 1b5g n GLU 18 Cb 0.52 -5.20 0.00 0.00 -0.57 0.00 0.00 31.44 26.19 1b5g n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1b5g n GLY 19 N -1.51 3.60 3.17 0.62 0.00 -1.26 -4.61 105.19 105.20 1b5g n GLY 19 Ca -0.07 -2.11 -0.09 0.00 0.00 0.00 0.00 46.02 43.75 1b5g n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b5g s SER 20 N -0.64 0.30 0.45 1.61 1.04 -0.34 -4.90 113.70 111.21 1b5g s SER 20 Ca 0.00 -1.00 -0.25 0.00 0.48 0.00 0.00 55.95 55.17 1b5g s SER 20 Cb 0.00 0.29 -0.09 0.00 0.10 0.00 0.00 66.02 66.33 1b5g s SER 20 CO 0.00 -0.71 1.43 0.47 0.98 0.00 0.00 173.24 175.41 1b5g n ASP 21 N -0.04 3.32 -4.86 7.02 8.00 -1.26 -0.60 116.55 128.12 1b5g n ASP 21 Ca -0.10 1.13 -0.31 0.00 0.71 0.00 0.00 54.79 56.22 1b5g n ASP 21 Cb 0.62 -1.60 0.02 0.00 -0.02 0.00 0.00 41.12 40.14 1b5g n ASP 21 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1b5g s ALA 22 N -1.19 3.03 0.45 2.24 0.00 0.13 -4.74 121.76 121.68 1b5g s ALA 22 Ca 0.61 -0.09 -0.12 0.00 0.00 0.00 0.00 51.96 52.36 1b5g s ALA 22 Cb -0.45 -3.09 -0.07 0.00 0.00 0.00 0.00 23.12 19.51 1b5g s ALA 22 CO 0.58 -0.79 0.85 -1.21 0.00 0.00 0.00 175.76 175.19 1b5g s GLU 23 N -5.18 3.81 0.31 0.00 2.02 -1.26 -4.91 118.70 113.49 1b5g s GLU 23 Ca 0.56 0.62 -0.29 0.00 0.02 0.00 0.00 54.97 55.88 1b5g s GLU 23 Cb -0.11 -2.29 -0.10 0.00 0.10 0.00 0.00 34.13 31.72 1b5g s GLU 23 CO 0.54 -0.14 1.37 0.42 0.02 0.00 0.00 175.26 177.47 1b5g s ILE 24 N -2.51 2.63 0.00 -1.63 -1.09 -1.26 -2.43 121.20 114.90 1b5g s ILE 24 Ca 0.54 0.59 0.00 0.00 -2.23 0.00 0.00 60.65 59.55 1b5g s ILE 24 Cb -0.10 -3.38 0.00 0.00 -1.58 0.00 0.00 42.46 37.40 1b5g s ILE 24 CO 0.33 0.12 0.00 0.61 -1.23 0.00 0.00 174.94 174.78 1b5g n GLY 25 N 1.25 0.30 0.25 6.18 0.00 -1.26 -4.95 105.19 106.95 1b5g n GLY 25 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 1b5g n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1b5g h MET 26 N 0.66 0.85 -2.56 1.61 -1.53 -1.85 -3.36 114.93 108.75 1b5g h MET 26 Ca 0.00 -0.19 -0.60 0.00 -3.44 0.00 0.00 59.70 55.47 1b5g h MET 26 Cb 0.41 -0.12 -0.39 0.00 -0.55 0.00 0.00 31.60 30.95 1b5g h MET 26 CO 0.00 0.79 -0.85 0.43 0.14 0.00 0.00 176.91 177.42 1b5g n SER 27 N -4.44 0.80 0.00 1.39 7.64 -1.26 -4.97 113.62 112.77 1b5g n SER 27 Ca 0.02 -2.69 0.05 0.00 1.01 0.00 0.00 58.87 57.26 1b5g n SER 27 Cb 0.21 -0.63 0.23 0.00 -1.01 0.00 0.00 64.21 63.01 1b5g n SER 27 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1b5g n PRO 28 N 2.40 0.05 0.00 1.43 -0.04 -1.26 -0.63 135.00 136.95 1b5g n PRO 28 Ca 0.26 0.28 0.12 0.00 -0.04 0.00 0.00 63.50 64.12 1b5g n PRO 28 Cb 0.44 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.59 1b5g n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1b5g n TRP 29 N -1.43 0.00 -1.90 0.54 2.14 -1.02 -1.24 117.44 114.53 1b5g n TRP 29 Ca 0.03 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.18 1b5g n TRP 29 Cb 0.10 -0.10 -0.03 0.00 -0.81 0.00 0.00 31.31 30.47 1b5g n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1b5g s GLN 30 N -2.68 4.18 0.02 -2.67 2.00 0.20 -0.76 119.66 119.95 1b5g s GLN 30 Ca 0.17 2.36 0.06 0.00 -2.00 0.00 0.00 55.36 55.96 1b5g s GLN 30 Cb 0.18 -3.73 -0.03 0.00 0.80 0.00 0.00 33.01 30.23 1b5g s GLN 30 CO 0.63 -0.79 -0.17 0.08 -0.50 0.00 0.00 175.29 174.54 1b5g s VAL 31 N 3.10 2.83 -0.19 1.34 1.01 -0.77 -3.97 120.40 123.75 1b5g s VAL 31 Ca 0.76 -1.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 1b5g s VAL 31 Cb -0.39 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 1b5g s VAL 31 CO 0.33 0.39 0.01 -0.32 0.00 0.00 0.00 175.10 175.51 1b5g s MET 32 N -1.29 3.69 -0.39 2.72 1.75 0.11 -2.14 119.30 123.75 1b5g s MET 32 Ca 0.14 -0.49 -0.24 0.00 -1.25 0.00 0.00 55.69 53.85 1b5g s MET 32 Cb -0.11 -3.08 0.01 0.00 2.84 0.00 0.00 34.83 34.50 1b5g s MET 32 CO 0.04 0.09 0.83 -1.17 -0.65 0.00 0.00 175.02 174.16 1b5g s LEU 33 N 0.81 4.11 -0.11 4.11 0.20 0.23 -0.99 118.68 127.03 1b5g s LEU 33 Ca 0.01 0.31 0.03 0.00 0.69 0.00 0.00 54.13 55.17 1b5g s LEU 33 Cb -0.14 -3.08 0.01 0.00 -0.43 0.00 0.00 46.19 42.55 1b5g s LEU 33 CO 0.02 -0.82 -0.22 0.12 -0.29 0.00 0.00 176.35 175.17 1b5g s PHE 34 N 3.27 2.48 -0.16 5.38 5.36 0.33 -0.08 117.98 134.56 1b5g s PHE 34 Ca 0.33 -1.12 -0.27 0.00 -0.96 0.00 0.00 56.93 54.91 1b5g s PHE 34 Cb -0.12 -1.68 -0.01 0.00 -0.34 0.00 0.00 43.02 40.86 1b5g s PHE 34 CO 0.19 -0.49 0.91 0.50 -1.46 0.00 0.00 175.22 174.88 1b5g s ARG 35 N 0.59 4.33 0.04 10.12 3.52 -0.93 0.99 118.95 137.60 1b5g s ARG 35 Ca -0.13 1.17 -0.22 0.00 -0.13 0.00 0.00 55.73 56.42 1b5g s ARG 35 Cb -0.17 -3.57 -0.15 0.00 -1.56 0.00 0.00 34.95 29.50 1b5g s ARG 35 CO 0.04 -0.36 1.41 0.87 -0.81 0.00 0.00 175.30 176.44 1b5g h LYS 36 N 7.28 0.22 -3.03 5.12 1.57 -1.89 -2.36 116.57 123.48 1b5g h LYS 36 Ca -0.28 -0.09 -0.42 0.00 -1.87 0.00 0.00 60.65 57.99 1b5g h LYS 36 Cb 1.13 -0.01 -0.40 0.00 0.08 0.00 0.00 32.23 33.03 1b5g h LYS 36 CO 0.86 0.54 -0.73 -1.12 -0.57 0.00 0.00 179.45 178.44 1b5g s SER 36 N -5.83 1.94 0.67 0.86 0.01 -1.26 -2.86 113.70 107.22 1b5g s SER 36 Ca -0.14 -0.40 -0.14 0.00 1.31 0.00 0.00 55.95 56.58 1b5g s SER 36 Cb 0.05 -0.12 0.01 0.00 0.21 0.00 0.00 66.02 66.16 1b5g s SER 36 CO 0.71 -0.32 1.10 -2.16 0.41 0.00 0.00 173.24 172.98 1b5g s PRO 37 N 2.18 2.77 -0.34 12.44 0.04 -1.26 -5.06 135.00 145.77 1b5g s PRO 37 Ca 0.03 1.33 -0.29 0.00 0.04 0.00 0.00 61.00 62.11 1b5g s PRO 37 Cb -0.15 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1b5g s PRO 37 CO -0.08 -1.27 1.33 -0.65 0.04 0.00 0.00 177.00 176.37 1b5g s GLN 38 N -4.24 3.81 -0.17 4.56 -0.21 -1.14 -4.63 119.66 117.64 1b5g s GLN 38 Ca 0.66 1.13 -0.28 0.00 0.02 0.00 0.00 55.36 56.88 1b5g s GLN 38 Cb -0.19 -3.92 0.10 0.00 1.00 0.00 0.00 33.01 29.99 1b5g s GLN 38 CO 0.44 -1.26 0.86 -1.83 -2.12 0.00 0.00 175.29 171.38 1b5g s GLU 39 N 4.40 0.76 0.18 2.91 -1.05 -0.89 -4.97 118.70 120.03 1b5g s GLU 39 Ca 0.57 0.43 -0.32 0.00 -0.15 0.00 0.00 54.97 55.51 1b5g s GLU 39 Cb -0.15 0.36 -0.11 0.00 -0.44 0.00 0.00 34.13 33.79 1b5g s GLU 39 CO 0.26 -0.19 1.68 -1.17 0.95 0.00 0.00 175.26 176.80 1b5g s LEU 40 N -0.58 4.37 -0.21 1.83 2.96 -1.26 -2.19 118.68 123.60 1b5g s LEU 40 Ca -0.03 2.76 -0.17 0.00 -0.22 0.00 0.00 54.13 56.47 1b5g s LEU 40 Cb -0.02 -3.59 -0.13 0.00 0.50 0.00 0.00 46.19 42.95 1b5g s LEU 40 CO 0.02 -0.92 -0.09 -0.11 -1.32 0.00 0.00 176.35 173.93 1b5g n LEU 41 N 4.26 1.89 -3.82 -0.68 7.94 0.89 -4.94 117.00 122.54 1b5g n LEU 41 Ca 0.15 0.43 -0.04 0.00 -1.11 0.00 0.00 56.01 55.44 1b5g n LEU 41 Cb 0.37 -0.88 0.01 0.00 0.53 0.00 0.00 43.42 43.44 1b5g n LEU 41 CO 0.63 0.15 0.71 0.00 -1.11 0.00 0.00 177.39 177.78 1b5g n GLY 43 N -0.57 0.99 3.89 0.00 0.00 0.33 -0.60 105.19 109.23 1b5g n GLY 43 Ca -0.05 -2.07 0.01 0.00 0.00 0.00 0.00 46.02 43.91 1b5g n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b5g s ALA 44 N -3.00 -2.23 0.02 4.61 0.00 -0.91 -3.81 121.76 116.44 1b5g s ALA 44 Ca 0.58 0.08 -0.07 0.00 0.00 0.00 0.00 51.96 52.55 1b5g s ALA 44 Cb -0.04 0.76 -0.00 0.00 0.00 0.00 0.00 23.12 23.84 1b5g s ALA 44 CO 0.38 -1.11 0.13 -1.54 0.00 0.00 0.00 175.76 173.61 1b5g s SER 45 N -3.55 0.08 -0.17 0.00 1.04 -0.20 -1.84 113.70 109.06 1b5g s SER 45 Ca 0.25 -0.35 -0.23 0.00 0.48 0.00 0.00 55.95 56.10 1b5g s SER 45 Cb 0.00 0.22 -0.02 0.00 0.10 0.00 0.00 66.02 66.32 1b5g s SER 45 CO 0.00 -0.44 0.71 -0.22 0.98 0.00 0.00 173.24 174.27 1b5g s LEU 46 N -1.73 4.18 -0.02 2.42 0.20 0.06 -0.84 118.68 122.96 1b5g s LEU 46 Ca -0.10 1.00 0.14 0.00 0.69 0.00 0.00 54.13 55.85 1b5g s LEU 46 Cb -0.05 -3.03 -0.20 0.00 -0.43 0.00 0.00 46.19 42.48 1b5g s LEU 46 CO -0.01 -0.29 0.32 2.30 -0.29 0.00 0.00 176.35 178.38 1b5g n ILE 47 N 4.56 0.00 -3.63 6.68 -5.35 -0.84 -1.61 119.36 119.17 1b5g n ILE 47 Ca 0.01 -0.30 -0.04 0.00 -0.27 0.00 0.00 62.75 62.14 1b5g n ILE 47 Cb 0.50 0.27 0.02 0.00 -1.74 0.00 0.00 39.64 38.68 1b5g n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1b5g n SER 48 N -1.91 -1.41 0.00 7.28 3.41 -1.22 -4.63 113.62 115.15 1b5g n SER 48 Ca -0.02 -1.89 0.08 0.00 -0.26 0.00 0.00 58.87 56.78 1b5g n SER 48 Cb 0.34 2.33 0.37 0.00 -0.26 0.00 0.00 64.21 66.99 1b5g n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1b5g n ASP 49 N -1.24 0.00 0.00 4.04 5.75 -1.26 -3.35 116.55 120.48 1b5g n ASP 49 Ca -0.04 0.49 0.00 0.00 -0.01 0.00 0.00 54.79 55.23 1b5g n ASP 49 Cb 0.40 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1b5g n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1b5g n ARG 50 N -1.50 0.23 -4.64 0.11 5.12 -1.26 -0.54 116.66 114.19 1b5g n ARG 50 Ca 0.04 -0.54 -0.25 0.00 -1.93 0.00 0.00 57.85 55.18 1b5g n ARG 50 Cb 0.20 -0.77 -0.16 0.00 -1.16 0.00 0.00 32.46 30.57 1b5g n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1b5g s TRP 51 N -0.19 1.48 -0.00 -1.55 0.52 -1.21 0.08 118.94 118.07 1b5g s TRP 51 Ca 0.00 -0.49 0.08 0.00 0.02 0.00 0.00 56.10 55.71 1b5g s TRP 51 Cb 0.00 -1.05 -0.02 0.00 -1.15 0.00 0.00 33.47 31.25 1b5g s TRP 51 CO 0.00 -0.22 -0.24 0.08 0.02 0.00 0.00 176.95 176.59 1b5g s VAL 52 N 0.41 2.28 -0.11 4.03 1.01 -0.51 -1.98 120.40 125.53 1b5g s VAL 52 Ca -0.10 -1.14 -0.01 0.00 0.00 0.00 0.00 61.98 60.73 1b5g s VAL 52 Cb -0.14 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 1b5g s VAL 52 CO 0.03 0.50 -0.08 -0.22 0.00 0.00 0.00 175.10 175.33 1b5g s LEU 53 N -0.87 3.06 0.00 3.92 2.96 -0.02 -0.80 118.68 126.92 1b5g s LEU 53 Ca 0.11 -0.15 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 1b5g s LEU 53 Cb -0.10 -1.70 0.00 0.00 0.50 0.00 0.00 46.19 44.90 1b5g s LEU 53 CO 0.01 0.24 0.18 1.07 -1.32 0.00 0.00 176.35 176.53 1b5g n THR 54 N 3.04 0.00 -3.05 3.68 5.66 -0.63 -1.04 114.28 121.95 1b5g n THR 54 Ca -0.18 -0.66 -0.40 0.00 -3.05 0.00 0.00 64.05 59.76 1b5g n THR 54 Cb 0.53 0.41 -0.05 0.00 -1.55 0.00 0.00 70.33 69.66 1b5g n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1b5g s ALA 55 N -2.02 3.41 0.50 1.79 0.00 -1.26 -1.67 121.76 122.51 1b5g s ALA 55 Ca 0.11 0.21 0.15 0.00 0.00 0.00 0.00 51.96 52.42 1b5g s ALA 55 Cb -0.00 -2.91 1.20 0.00 0.00 0.00 0.00 23.12 21.40 1b5g s ALA 55 CO 0.08 0.11 2.13 0.00 0.00 0.00 0.00 175.76 178.08 1b5g h ALA 56 N 5.55 1.95 0.00 0.00 0.00 -1.70 -1.91 119.26 123.15 1b5g h ALA 56 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1b5g h ALA 56 Cb 1.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1b5g h ALA 56 CO 0.70 0.05 0.00 -2.39 0.00 0.00 0.00 179.25 177.61 1b5g n HIS 57 N -4.52 0.05 0.16 0.00 1.44 -1.26 -0.64 115.22 110.45 1b5g n HIS 57 Ca -0.02 0.02 0.05 0.00 -2.01 0.00 0.00 57.72 55.76 1b5g n HIS 57 Cb 0.09 -0.53 0.09 0.00 0.12 0.00 0.00 29.99 29.76 1b5g n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1b5g n LEU 59 N -3.22 2.80 -3.82 0.00 4.77 0.19 -4.86 117.00 112.85 1b5g n LEU 59 Ca 0.02 -0.06 -0.27 0.00 -0.03 0.00 0.00 56.01 55.67 1b5g n LEU 59 Cb 0.67 -0.80 -0.17 0.00 -2.33 0.00 0.00 43.42 40.80 1b5g n LEU 59 CO 0.39 0.84 -0.40 -0.22 -1.33 0.00 0.00 177.39 176.67 1b5g s LEU 60 N -6.49 1.41 0.07 2.23 2.96 -0.61 -0.55 118.68 117.69 1b5g s LEU 60 Ca -0.32 -0.68 -0.10 0.00 -0.22 0.00 0.00 54.13 52.81 1b5g s LEU 60 Cb 0.09 -0.76 0.01 0.00 0.50 0.00 0.00 46.19 46.02 1b5g s LEU 60 CO 0.52 -0.23 0.22 -0.47 -1.32 0.00 0.00 176.35 175.07 1b5g s TYR 60 N 1.74 0.06 0.00 5.38 5.04 -0.71 -4.11 117.35 124.75 1b5g s TYR 60 Ca 0.00 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.25 1b5g s TYR 60 Cb -0.16 -0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.15 1b5g s TYR 60 CO -0.07 -0.52 0.00 -2.30 -1.34 0.00 0.00 175.55 171.32 1b5g n PRO 60 N 0.22 0.00 -0.03 4.97 -0.02 -1.26 -1.77 135.00 137.11 1b5g n PRO 60 Ca -0.17 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.35 1b5g n PRO 60 Cb 0.61 0.00 0.05 0.00 -0.02 0.00 0.00 33.50 34.14 1b5g n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1b5g n TRP 60 N 0.00 0.00 -3.65 6.00 8.01 -1.26 -4.98 117.44 121.56 1b5g n TRP 60 Ca 0.00 -0.64 -0.24 0.00 -1.31 0.00 0.00 57.50 55.31 1b5g n TRP 60 Cb 0.00 -0.08 0.07 0.00 -2.01 0.00 0.00 31.31 29.28 1b5g n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1b5g n ASP 60 N -0.79 -4.99 -4.68 -0.99 8.00 -1.13 -4.99 116.55 106.98 1b5g n ASP 60 Ca 0.05 -0.63 -0.36 0.00 0.71 0.00 0.00 54.79 54.57 1b5g n ASP 60 Cb 0.40 -4.72 -0.09 0.00 -0.02 0.00 0.00 41.12 36.69 1b5g n ASP 60 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1b5g s LYS 60 N -6.21 4.10 -0.46 -1.24 3.01 -0.73 -5.01 119.74 113.20 1b5g s LYS 60 Ca 0.47 -0.24 0.06 0.00 -1.01 0.00 0.00 55.97 55.26 1b5g s LYS 60 Cb -0.22 -3.51 0.31 0.00 -1.01 0.00 0.00 37.83 33.40 1b5g s LYS 60 CO 0.76 0.11 1.08 -1.71 0.51 0.00 0.00 175.35 176.11 1b5g n ASN 60 N 4.11 -2.44 -4.75 2.83 5.15 -1.14 -1.74 115.26 117.27 1b5g n ASN 60 Ca -0.15 -3.63 -0.37 0.00 -0.60 0.00 0.00 54.58 49.83 1b5g n ASN 60 Cb 0.52 1.92 0.03 0.00 -0.53 0.00 0.00 39.78 41.72 1b5g n ASN 60 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1b5g s PHE 60 N 0.34 2.43 0.28 1.20 0.08 0.29 -4.96 117.98 117.64 1b5g s PHE 60 Ca 0.24 1.47 0.08 0.00 0.12 0.00 0.00 56.93 58.84 1b5g s PHE 60 Cb 0.28 -3.58 -0.06 0.00 -0.57 0.00 0.00 43.02 39.10 1b5g s PHE 60 CO -0.08 -2.34 -0.10 0.95 -0.10 0.00 0.00 175.22 173.54 1b5g s THR 60 N -1.48 1.92 0.24 0.64 -4.23 -1.26 -4.84 115.64 106.64 1b5g s THR 60 Ca 0.73 -2.20 -0.14 0.00 -1.18 0.00 0.00 61.69 58.90 1b5g s THR 60 Cb -0.34 -2.39 0.31 0.00 1.34 0.00 0.00 72.50 71.42 1b5g s THR 60 CO 0.38 -0.35 1.56 -0.33 -0.54 0.00 0.00 174.62 175.35 1b5g h GLU 61 N 2.27 -0.02 0.00 3.99 4.39 -1.94 0.11 114.58 123.39 1b5g h GLU 61 Ca -0.40 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.27 1b5g h GLU 61 Cb 1.24 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1b5g h GLU 61 CO 0.66 -0.01 -0.14 -0.97 -1.16 0.00 0.00 179.01 177.39 1b5g h ASN 62 N -0.02 0.00 0.37 1.42 -1.24 -1.97 -2.74 115.58 111.41 1b5g h ASN 62 Ca 0.38 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 57.30 1b5g h ASN 62 Cb 0.63 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.67 1b5g h ASN 62 CO -0.95 0.14 -0.43 0.44 -1.29 0.00 0.00 177.43 175.34 1b5g h ASP 63 N 0.00 0.08 -2.09 1.15 3.32 -1.18 -3.47 116.42 114.24 1b5g h ASP 63 Ca -0.00 -0.03 -0.57 0.00 0.02 0.00 0.00 57.03 56.44 1b5g h ASP 63 Cb 0.30 -0.02 -0.10 0.00 0.22 0.00 0.00 39.33 39.72 1b5g h ASP 63 CO 0.02 0.51 -0.64 -0.76 -1.72 0.00 0.00 179.24 176.65 1b5g s LEU 64 N -8.11 3.06 0.01 1.55 1.43 -1.03 -3.48 118.68 112.12 1b5g s LEU 64 Ca -0.03 -0.81 0.03 0.00 -1.03 0.00 0.00 54.13 52.29 1b5g s LEU 64 Cb 0.14 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.81 1b5g s LEU 64 CO 0.75 -0.09 -0.09 -0.22 0.23 0.00 0.00 176.35 176.93 1b5g s LEU 65 N -3.68 2.09 -0.28 1.79 2.96 0.28 -4.55 118.68 117.29 1b5g s LEU 65 Ca 0.33 -0.28 -0.07 0.00 -0.22 0.00 0.00 54.13 53.89 1b5g s LEU 65 Cb -0.04 -0.39 -0.00 0.00 0.50 0.00 0.00 46.19 46.26 1b5g s LEU 65 CO 0.19 0.02 0.08 -0.69 -1.32 0.00 0.00 176.35 174.64 1b5g s VAL 66 N -0.55 4.12 -0.30 1.68 1.01 -0.97 0.12 120.40 125.51 1b5g s VAL 66 Ca 0.00 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 1b5g s VAL 66 Cb -0.05 -3.05 0.02 0.00 0.00 0.00 0.00 36.38 33.29 1b5g s VAL 66 CO 0.00 0.17 0.06 -0.13 0.00 0.00 0.00 175.10 175.20 1b5g s ARG 67 N 1.55 2.90 -0.10 2.72 0.52 -0.16 -0.81 118.95 125.56 1b5g s ARG 67 Ca 0.04 -0.98 -0.01 0.00 -0.52 0.00 0.00 55.73 54.26 1b5g s ARG 67 Cb -0.16 -3.33 -0.03 0.00 0.52 0.00 0.00 34.95 31.95 1b5g s ARG 67 CO 0.03 -0.50 -0.04 0.42 0.02 0.00 0.00 175.30 175.23 1b5g s ILE 68 N 1.44 3.92 0.00 1.52 1.01 0.40 0.07 121.20 129.56 1b5g s ILE 68 Ca 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.28 1b5g s ILE 68 Cb -0.18 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.64 1b5g s ILE 68 CO 0.01 0.57 0.00 0.61 0.00 0.00 0.00 174.94 176.13 1b5g n GLY 69 N 2.64 0.70 3.85 6.18 0.00 -1.25 -0.48 105.19 116.82 1b5g n GLY 69 Ca -0.18 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 44.95 1b5g n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b5g s LYS 70 N -1.12 3.89 0.21 1.61 1.02 -1.26 -4.34 119.74 119.75 1b5g s LYS 70 Ca 0.00 0.87 0.00 0.00 0.02 0.00 0.00 55.97 56.86 1b5g s LYS 70 Cb 0.00 -2.16 0.00 0.00 -0.52 0.00 0.00 37.83 35.15 1b5g s LYS 70 CO 0.00 -0.27 0.00 1.58 -0.92 0.00 0.00 175.35 175.74 1b5g n HIS 71 N -1.66 -1.53 -2.35 3.18 -0.00 -1.26 -4.94 115.22 106.66 1b5g n HIS 71 Ca 0.06 0.27 -0.40 0.00 -0.00 0.00 0.00 57.72 57.65 1b5g n HIS 71 Cb 0.54 0.36 -0.04 0.00 -0.00 0.00 0.00 29.99 30.86 1b5g n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1b5g s SER 72 N -5.36 7.09 -0.00 0.26 0.15 -1.26 -0.91 113.70 113.67 1b5g s SER 72 Ca 0.00 2.41 -0.23 0.00 0.70 0.00 0.00 55.95 58.83 1b5g s SER 72 Cb 0.00 -2.63 -0.13 0.00 -1.71 0.00 0.00 66.02 61.55 1b5g s SER 72 CO 0.00 -0.29 0.98 -0.09 1.20 0.00 0.00 173.24 175.04 1b5g h ARG 73 N 3.74 -0.77 0.06 5.44 2.43 -1.68 -3.40 114.38 120.20 1b5g h ARG 73 Ca -0.47 0.05 -0.31 0.00 -0.81 0.00 0.00 59.98 58.44 1b5g h ARG 73 Cb 1.22 0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.91 1b5g h ARG 73 CO 0.67 -0.50 -1.72 1.79 -1.51 0.00 0.00 179.97 178.70 1b5g h THR 74 N -1.19 0.89 -4.09 0.20 1.35 -1.90 -3.48 112.91 104.70 1b5g h THR 74 Ca -0.08 -2.65 -0.56 0.00 -0.55 0.00 0.00 66.41 62.57 1b5g h THR 74 Cb 0.63 2.55 0.15 0.00 -1.73 0.00 0.00 68.15 69.75 1b5g h THR 74 CO 0.13 0.71 0.55 -0.13 -0.25 0.00 0.00 175.52 176.53 1b5g s ARG 75 N -2.60 2.73 -0.31 4.72 1.81 -1.26 -4.98 118.95 119.07 1b5g s ARG 75 Ca -0.11 2.14 -0.16 0.00 -1.72 0.00 0.00 55.73 55.88 1b5g s ARG 75 Cb 0.07 -1.98 -0.02 0.00 -0.45 0.00 0.00 34.95 32.57 1b5g s ARG 75 CO 0.82 -1.48 0.42 -0.47 -0.68 0.00 0.00 175.30 173.91 1b5g s TYR 76 N -1.35 3.22 -1.18 -0.53 5.04 -1.26 -4.86 117.35 116.42 1b5g s TYR 76 Ca 0.79 0.27 -0.13 0.00 -2.44 0.00 0.00 57.07 55.56 1b5g s TYR 76 Cb -0.39 -2.71 0.20 0.00 0.35 0.00 0.00 41.96 39.41 1b5g s TYR 76 CO 0.43 -0.37 1.36 -1.21 -1.34 0.00 0.00 175.55 174.42 1b5g s GLU 77 N 2.17 4.11 0.10 4.97 2.02 -1.26 -4.98 118.70 125.83 1b5g s GLU 77 Ca 0.16 -2.73 -0.34 0.00 0.02 0.00 0.00 54.97 52.08 1b5g s GLU 77 Cb -0.16 -4.94 -0.13 0.00 0.10 0.00 0.00 34.13 28.99 1b5g s GLU 77 CO 0.11 -1.65 1.64 -2.13 0.02 0.00 0.00 175.26 173.26 1b5g n ARG 77 N 4.97 2.15 -0.39 1.61 0.63 -1.26 -0.58 116.66 123.78 1b5g n ARG 77 Ca 0.34 0.78 0.00 0.00 -0.92 0.00 0.00 57.85 58.04 1b5g n ARG 77 Cb 0.42 -2.56 0.00 0.00 0.45 0.00 0.00 32.46 30.77 1b5g n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1b5g n ASN 78 N 4.13 0.00 -0.03 6.15 5.03 -1.26 -4.78 115.26 124.51 1b5g n ASN 78 Ca 0.18 0.00 -0.04 0.00 0.87 0.00 0.00 54.58 55.59 1b5g n ASN 78 Cb 0.29 -0.47 -0.01 0.00 -1.02 0.00 0.00 39.78 38.56 1b5g n ASN 78 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1b5g n ILE 79 N -2.00 0.94 -2.42 2.41 5.41 0.25 -5.04 119.36 118.91 1b5g n ILE 79 Ca 0.00 0.26 -0.33 0.00 1.00 0.00 0.00 62.75 63.68 1b5g n ILE 79 Cb 0.00 -1.83 -0.03 0.00 -0.71 0.00 0.00 39.64 37.07 1b5g n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1b5g s GLU 80 N -2.06 3.75 -0.04 0.38 -1.05 -0.38 -4.80 118.70 114.51 1b5g s GLU 80 Ca -0.12 1.22 0.04 0.00 -0.15 0.00 0.00 54.97 55.95 1b5g s GLU 80 Cb 0.02 -2.10 -0.00 0.00 -0.44 0.00 0.00 34.13 31.61 1b5g s GLU 80 CO 0.19 -0.45 -0.16 0.15 0.95 0.00 0.00 175.26 175.93 1b5g s LYS 81 N -3.60 1.68 -0.12 -4.83 1.02 0.37 -4.89 119.74 109.37 1b5g s LYS 81 Ca 0.64 -0.58 -0.01 0.00 0.02 0.00 0.00 55.97 56.05 1b5g s LYS 81 Cb -0.14 -1.47 -0.02 0.00 -0.52 0.00 0.00 37.83 35.67 1b5g s LYS 81 CO 0.25 0.24 -0.09 0.42 -0.92 0.00 0.00 175.35 175.25 1b5g s ILE 82 N 0.03 3.45 0.31 2.17 1.01 -1.26 -0.45 121.20 126.46 1b5g s ILE 82 Ca -0.03 -0.53 0.03 0.00 0.00 0.00 0.00 60.65 60.11 1b5g s ILE 82 Cb -0.11 -2.46 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 1b5g s ILE 82 CO 0.02 0.53 0.10 -0.44 0.00 0.00 0.00 174.94 175.15 1b5g s SER 83 N 0.05 1.83 0.03 3.58 0.01 0.01 -5.00 113.70 114.20 1b5g s SER 83 Ca -0.03 -1.46 0.05 0.00 1.31 0.00 0.00 55.95 55.83 1b5g s SER 83 Cb -0.14 0.18 -0.03 0.00 0.21 0.00 0.00 66.02 66.24 1b5g s SER 83 CO 0.04 -0.75 -0.11 -0.04 0.41 0.00 0.00 173.24 172.78 1b5g s MET 84 N -3.91 2.34 0.17 12.44 -1.94 -1.26 -2.29 119.30 124.85 1b5g s MET 84 Ca 0.35 -0.85 -0.18 0.00 -1.71 0.00 0.00 55.69 53.30 1b5g s MET 84 Cb 0.07 -2.37 -0.08 0.00 2.01 0.00 0.00 34.83 34.47 1b5g s MET 84 CO 0.15 0.57 0.65 -0.51 -0.01 0.00 0.00 175.02 175.87 1b5g s LEU 85 N -1.50 4.39 -0.22 -0.03 1.43 -1.26 0.22 118.68 121.72 1b5g s LEU 85 Ca 0.17 1.30 0.09 0.00 -1.03 0.00 0.00 54.13 54.66 1b5g s LEU 85 Cb -0.11 -3.35 -0.21 0.00 0.03 0.00 0.00 46.19 42.55 1b5g s LEU 85 CO 0.07 0.11 -0.03 1.21 0.23 0.00 0.00 176.35 177.94 1b5g n GLU 86 N 0.98 0.67 -3.61 1.70 2.13 0.11 -4.60 120.64 118.03 1b5g n GLU 86 Ca -0.05 0.09 -0.11 0.00 0.66 0.00 0.00 57.16 57.75 1b5g n GLU 86 Cb 0.51 -1.54 -0.07 0.00 0.27 0.00 0.00 31.44 30.61 1b5g n GLU 86 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1b5g s LYS 87 N -2.51 0.63 -0.09 5.31 2.36 -1.03 -4.98 119.74 119.42 1b5g s LYS 87 Ca -0.22 0.55 -0.01 0.00 -2.55 0.00 0.00 55.97 53.74 1b5g s LYS 87 Cb 0.08 0.30 -0.03 0.00 -1.05 0.00 0.00 37.83 37.13 1b5g s LYS 87 CO 0.72 -0.11 -0.04 0.42 1.55 0.00 0.00 175.35 177.88 1b5g s ILE 88 N -0.13 3.94 -0.09 5.43 1.01 -1.26 0.95 121.20 131.05 1b5g s ILE 88 Ca 0.00 -0.38 0.01 0.00 0.00 0.00 0.00 60.65 60.28 1b5g s ILE 88 Cb -0.04 -2.65 0.02 0.00 0.01 0.00 0.00 42.46 39.80 1b5g s ILE 88 CO -0.02 0.58 -0.10 -0.31 0.00 0.00 0.00 174.94 175.09 1b5g s TYR 89 N -0.60 1.43 0.03 3.97 1.51 0.81 -4.98 117.35 119.53 1b5g s TYR 89 Ca 0.09 -0.61 0.05 0.00 -1.01 0.00 0.00 57.07 55.58 1b5g s TYR 89 Cb -0.12 -1.12 -0.03 0.00 -0.11 0.00 0.00 41.96 40.58 1b5g s TYR 89 CO 0.02 -0.38 -0.09 0.42 -1.11 0.00 0.00 175.55 174.41 1b5g s ILE 90 N 1.17 3.48 0.05 2.71 1.01 -1.26 -0.04 121.20 128.32 1b5g s ILE 90 Ca -0.05 -0.93 -0.34 0.00 0.00 0.00 0.00 60.65 59.33 1b5g s ILE 90 Cb -0.14 -2.53 -0.13 0.00 0.01 0.00 0.00 42.46 39.67 1b5g s ILE 90 CO -0.02 0.33 1.73 1.57 0.00 0.00 0.00 174.94 178.55 1b5g n HIS 91 N 1.37 2.32 -0.28 3.97 -0.00 -1.05 -4.82 115.22 116.73 1b5g n HIS 91 Ca -0.15 0.11 0.24 0.00 -0.00 0.00 0.00 57.72 57.92 1b5g n HIS 91 Cb 0.52 -2.61 0.56 0.00 -0.00 0.00 0.00 29.99 28.46 1b5g n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1b5g h PRO 92 N 7.57 0.30 -0.47 1.57 0.13 -1.95 -1.09 132.00 138.07 1b5g h PRO 92 Ca -0.47 -0.02 -0.20 0.00 -0.87 0.00 0.00 66.00 64.45 1b5g h PRO 92 Cb 1.26 -0.07 -0.12 0.00 0.13 0.00 0.00 31.00 32.20 1b5g h PRO 92 CO 0.92 0.20 0.08 0.54 -0.23 0.00 0.00 178.00 179.51 1b5g n ARG 93 N -4.50 2.28 -1.67 0.86 1.74 -1.26 -5.00 116.66 109.11 1b5g n ARG 93 Ca 0.23 -3.08 -0.47 0.00 -0.77 0.00 0.00 57.85 53.75 1b5g n ARG 93 Cb 0.87 -1.91 -0.04 0.00 -1.02 0.00 0.00 32.46 30.36 1b5g n ARG 93 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1b5g n TYR 94 N -0.93 2.25 -3.57 -1.55 9.36 -0.41 -4.72 117.16 117.59 1b5g n TYR 94 Ca 0.36 0.21 -0.39 0.00 3.32 0.00 0.00 57.90 61.40 1b5g n TYR 94 Cb 1.14 -2.57 -0.06 0.00 -0.63 0.00 0.00 39.34 37.23 1b5g n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1b5g s ASN 95 N 1.77 6.06 0.38 2.98 3.84 0.47 -4.86 114.94 125.58 1b5g s ASN 95 Ca 0.83 -3.27 0.23 0.00 0.21 0.00 0.00 52.86 50.86 1b5g s ASN 95 Cb -0.70 -1.98 0.36 0.00 -0.55 0.00 0.00 41.25 38.38 1b5g s ASN 95 CO 0.42 -0.32 1.56 4.11 -2.79 0.00 0.00 177.10 180.08 1b5g h TRP 96 N 6.70 0.00 -0.25 0.43 5.08 -1.93 -1.17 115.95 124.81 1b5g h TRP 96 Ca 0.10 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.88 1b5g h TRP 96 Cb 0.90 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.06 1b5g h TRP 96 CO 0.78 0.00 -0.58 0.00 -1.28 0.00 0.00 178.44 177.36 1b5g h ARG 97 N 0.00 0.81 0.00 0.12 3.08 -1.99 -3.44 114.38 112.95 1b5g h ARG 97 Ca 0.00 -0.53 0.00 0.00 0.07 0.00 0.00 59.98 59.52 1b5g h ARG 97 Cb 0.96 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.08 1b5g h ARG 97 CO 0.00 1.16 -0.17 -1.91 -1.07 0.00 0.00 179.97 177.98 1b5g n GLU 97 N -3.99 0.09 -0.71 0.04 2.13 -1.24 -5.01 120.64 111.95 1b5g n GLU 97 Ca -0.04 0.03 0.03 0.00 0.66 0.00 0.00 57.16 57.84 1b5g n GLU 97 Cb 0.64 -0.48 0.05 0.00 0.27 0.00 0.00 31.44 31.92 1b5g n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1b5g n ASN 98 N -3.07 0.86 -2.61 4.31 0.23 -1.22 -5.01 115.26 108.76 1b5g n ASN 98 Ca -0.02 -2.39 -0.20 0.00 -0.53 0.00 0.00 54.58 51.44 1b5g n ASN 98 Cb 0.09 -0.30 0.03 0.00 -2.08 0.00 0.00 39.78 37.51 1b5g n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1b5g n LEU 99 N -0.23 -2.47 -4.73 -4.53 4.77 -0.44 -4.95 117.00 104.42 1b5g n LEU 99 Ca 0.06 -0.22 -0.42 0.00 -0.03 0.00 0.00 56.01 55.40 1b5g n LEU 99 Cb 0.81 -2.69 -0.03 0.00 -2.33 0.00 0.00 43.42 39.19 1b5g n LEU 99 CO -0.01 0.16 1.01 -0.62 -1.33 0.00 0.00 177.39 176.59 1b5g s ASP 100 N -2.67 6.89 -0.98 -1.43 2.15 -1.22 -2.89 116.67 116.51 1b5g s ASP 100 Ca 0.23 2.32 -0.04 0.00 0.43 0.00 0.00 52.55 55.50 1b5g s ASP 100 Cb -0.10 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 1b5g s ASP 100 CO 0.29 -0.57 0.84 0.54 -0.17 0.00 0.00 175.17 176.10 1b5g n ARG 101 N 3.34 -5.63 -2.45 4.34 1.74 -1.26 -0.39 116.66 116.34 1b5g n ARG 101 Ca 0.09 0.64 -0.39 0.00 -0.77 0.00 0.00 57.85 57.42 1b5g n ARG 101 Cb 0.43 -5.07 -0.02 0.00 -1.02 0.00 0.00 32.46 26.78 1b5g n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1b5g s ASP 102 N -3.58 6.32 -0.09 0.55 2.15 -1.14 -4.31 116.67 116.56 1b5g s ASP 102 Ca 0.26 -1.92 -0.22 0.00 0.43 0.00 0.00 52.55 51.10 1b5g s ASP 102 Cb -0.11 -2.58 0.05 0.00 -0.30 0.00 0.00 42.92 39.98 1b5g s ASP 102 CO 0.55 -1.70 0.53 -0.51 -0.17 0.00 0.00 175.17 173.87 1b5g s ILE 103 N 6.01 0.02 -0.05 4.11 2.07 -1.26 -4.03 121.20 128.07 1b5g s ILE 103 Ca 0.56 -0.14 -0.20 0.00 -1.41 0.00 0.00 60.65 59.45 1b5g s ILE 103 Cb 0.01 -0.81 0.04 0.00 0.13 0.00 0.00 42.46 41.84 1b5g s ILE 103 CO 0.03 -0.08 0.46 0.00 -1.91 0.00 0.00 174.94 173.45 1b5g s ALA 104 N -0.71 -1.18 0.05 1.50 0.00 -0.67 -2.53 121.76 118.22 1b5g s ALA 104 Ca -0.08 0.83 0.04 0.00 0.00 0.00 0.00 51.96 52.75 1b5g s ALA 104 Cb -0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 1b5g s ALA 104 CO 0.05 -0.29 -0.02 -0.51 0.00 0.00 0.00 175.76 174.99 1b5g s LEU 105 N -1.01 3.40 -0.11 0.00 1.43 0.94 -1.60 118.68 121.74 1b5g s LEU 105 Ca -0.10 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 1b5g s LEU 105 Cb -0.03 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 44.14 1b5g s LEU 105 CO 0.06 0.22 -0.15 -0.04 0.23 0.00 0.00 176.35 176.66 1b5g s MET 106 N -1.97 2.23 -0.24 1.70 -1.94 0.02 -0.13 119.30 118.96 1b5g s MET 106 Ca 0.23 -0.56 -0.13 0.00 -1.71 0.00 0.00 55.69 53.51 1b5g s MET 106 Cb -0.12 -1.90 -0.04 0.00 2.01 0.00 0.00 34.83 34.78 1b5g s MET 106 CO 0.14 -0.07 0.29 0.21 -0.01 0.00 0.00 175.02 175.58 1b5g s LYS 107 N 1.00 4.06 0.37 2.03 2.20 0.27 -1.43 119.74 128.25 1b5g s LYS 107 Ca -0.06 -0.06 -0.25 0.00 -0.36 0.00 0.00 55.97 55.24 1b5g s LYS 107 Cb -0.15 -3.59 -0.09 0.00 -1.51 0.00 0.00 37.83 32.49 1b5g s LYS 107 CO -0.02 -0.10 1.03 -0.51 -0.36 0.00 0.00 175.35 175.39 1b5g s LEU 108 N 1.52 4.21 0.26 5.43 1.43 0.11 0.10 118.68 131.75 1b5g s LEU 108 Ca 0.13 2.01 -0.02 0.00 -1.03 0.00 0.00 54.13 55.22 1b5g s LEU 108 Cb -0.15 -4.11 0.44 0.00 0.03 0.00 0.00 46.19 42.40 1b5g s LEU 108 CO 0.08 -0.37 1.86 0.50 0.23 0.00 0.00 176.35 178.64 1b5g h LYS 109 N 2.74 1.02 -4.18 1.70 1.63 0.25 -3.41 116.57 116.31 1b5g h LYS 109 Ca -0.48 -0.06 -0.15 0.00 -0.85 0.00 0.00 60.65 59.11 1b5g h LYS 109 Cb 1.21 -0.23 -0.17 0.00 -0.60 0.00 0.00 32.23 32.43 1b5g h LYS 109 CO 0.63 0.68 -0.69 0.15 -3.45 0.00 0.00 179.45 176.77 1b5g s LYS 110 N -6.02 0.51 0.21 1.90 1.02 -1.26 -4.96 119.74 111.14 1b5g s LYS 110 Ca -0.12 -0.99 -0.30 0.00 0.02 0.00 0.00 55.97 54.58 1b5g s LYS 110 Cb 0.20 0.13 -0.09 0.00 -0.52 0.00 0.00 37.83 37.56 1b5g s LYS 110 CO 0.81 -0.08 1.22 -2.14 -0.92 0.00 0.00 175.35 174.24 1b5g s PRO 111 N -2.95 4.47 0.43 -1.68 0.02 -1.26 -4.85 135.00 129.18 1b5g s PRO 111 Ca -0.02 1.94 -0.06 0.00 0.02 0.00 0.00 61.00 62.88 1b5g s PRO 111 Cb 0.01 -3.21 -0.05 0.00 0.02 0.00 0.00 34.50 31.27 1b5g s PRO 111 CO -0.06 -0.11 0.75 0.54 -0.33 0.00 0.00 177.00 177.79 1b5g s VAL 112 N -0.20 4.90 -0.14 3.83 0.11 0.30 -5.01 120.40 124.20 1b5g s VAL 112 Ca 0.53 0.27 -0.06 0.00 -2.93 0.00 0.00 61.98 59.78 1b5g s VAL 112 Cb -0.34 -3.81 -0.04 0.00 -1.53 0.00 0.00 36.38 30.66 1b5g s VAL 112 CO 0.39 -0.69 0.09 0.00 -3.33 0.00 0.00 175.10 171.56 1b5g s ALA 113 N -2.55 3.61 0.60 1.54 0.00 -1.26 -4.79 121.76 118.92 1b5g s ALA 113 Ca 0.48 -0.71 -0.15 0.00 0.00 0.00 0.00 51.96 51.58 1b5g s ALA 113 Cb -0.10 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.11 1b5g s ALA 113 CO 0.39 0.46 1.05 -0.06 0.00 0.00 0.00 175.76 177.60 1b5g s PHE 114 N -0.51 3.04 0.13 0.00 0.08 -1.26 -4.91 117.98 114.55 1b5g s PHE 114 Ca 0.11 1.50 -0.05 0.00 0.12 0.00 0.00 56.93 58.61 1b5g s PHE 114 Cb -0.12 -2.98 0.02 0.00 -0.57 0.00 0.00 43.02 39.38 1b5g s PHE 114 CO 0.02 -1.06 0.27 -1.13 -0.10 0.00 0.00 175.22 173.22 1b5g n SER 115 N -2.10 -0.77 0.26 1.36 3.41 -0.60 -4.94 113.62 110.24 1b5g n SER 115 Ca 0.08 -1.53 0.09 0.00 -0.26 0.00 0.00 58.87 57.26 1b5g n SER 115 Cb 0.53 1.28 0.68 0.00 -0.26 0.00 0.00 64.21 66.44 1b5g n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1b5g h ASP 116 N 0.66 0.00 -0.04 4.04 5.19 -1.99 -3.05 116.42 121.23 1b5g h ASP 116 Ca -0.11 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.30 1b5g h ASP 116 Cb 0.42 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.93 1b5g h ASP 116 CO 0.14 0.00 0.00 -1.22 -3.12 0.00 0.00 179.24 175.04 1b5g n TYR 117 N -4.43 0.03 -3.85 4.55 4.01 -1.26 -4.70 117.16 111.50 1b5g n TYR 117 Ca -0.03 -0.03 -0.27 0.00 -0.16 0.00 0.00 57.90 57.41 1b5g n TYR 117 Cb 0.10 -0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 38.97 1b5g n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1b5g s ILE 118 N -1.05 0.92 -0.28 -0.72 1.01 -1.15 -4.05 121.20 115.87 1b5g s ILE 118 Ca 0.15 -0.49 -0.20 0.00 0.00 0.00 0.00 60.65 60.11 1b5g s ILE 118 Cb 0.11 -1.13 0.12 0.00 0.01 0.00 0.00 42.46 41.57 1b5g s ILE 118 CO 0.16 0.11 0.95 -2.28 0.00 0.00 0.00 174.94 173.88 1b5g s HIS 119 N 1.72 -0.60 0.62 3.97 2.46 -0.37 -1.56 115.29 121.52 1b5g s HIS 119 Ca 0.01 1.31 -0.15 0.00 0.47 0.00 0.00 55.06 56.71 1b5g s HIS 119 Cb -0.15 0.38 -0.02 0.00 -0.13 0.00 0.00 32.58 32.66 1b5g s HIS 119 CO -0.07 -0.30 1.06 -1.25 -2.47 0.00 0.00 174.74 171.71 1b5g s PRO 120 N 0.87 3.20 0.30 2.88 0.04 -1.26 -2.45 135.00 138.58 1b5g s PRO 120 Ca -0.04 1.17 0.04 0.00 0.04 0.00 0.00 61.00 62.21 1b5g s PRO 120 Cb -0.04 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.45 1b5g s PRO 120 CO -0.11 -0.90 0.44 0.54 0.04 0.00 0.00 177.00 177.01 1b5g s VAL 121 N -2.57 4.86 0.31 -0.36 0.11 -0.63 -4.88 120.40 117.24 1b5g s VAL 121 Ca 0.63 -0.86 -0.06 0.00 -2.93 0.00 0.00 61.98 58.76 1b5g s VAL 121 Cb -0.16 -3.73 -0.05 0.00 -1.53 0.00 0.00 36.38 30.91 1b5g s VAL 121 CO 0.41 -0.33 0.59 0.00 -3.33 0.00 0.00 175.10 172.44 1b5g s LEU 123 N -3.56 4.17 0.65 0.00 1.43 -1.26 -0.59 118.68 119.51 1b5g s LEU 123 Ca 0.45 0.35 -0.14 0.00 -1.03 0.00 0.00 54.13 53.76 1b5g s LEU 123 Cb -0.11 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 1b5g s LEU 123 CO 0.30 0.37 1.09 -2.16 0.23 0.00 0.00 176.35 176.17 1b5g s PRO 124 N -0.77 2.95 0.29 1.29 0.04 -1.26 -4.93 135.00 132.60 1b5g s PRO 124 Ca 0.13 1.27 0.07 0.00 0.04 0.00 0.00 61.00 62.51 1b5g s PRO 124 Cb -0.12 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 1b5g s PRO 124 CO 0.03 -1.12 0.23 0.16 0.04 0.00 0.00 177.00 176.34 1b5g s ASP 125 N -2.84 5.36 0.32 6.66 1.47 -1.26 -4.93 116.67 121.45 1b5g s ASP 125 Ca 0.64 -0.39 0.09 0.00 1.18 0.00 0.00 52.55 54.08 1b5g s ASP 125 Cb -0.18 -1.17 0.90 0.00 -0.34 0.00 0.00 42.92 42.13 1b5g s ASP 125 CO 0.42 -0.18 1.69 -0.09 0.68 0.00 0.00 175.17 177.69 1b5g h ARG 126 N 1.40 0.41 -0.24 2.11 2.43 -1.97 -0.55 114.38 117.98 1b5g h ARG 126 Ca -0.47 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 58.65 1b5g h ARG 126 Cb 1.25 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 1b5g h ARG 126 CO 0.60 0.27 0.03 0.93 -1.51 0.00 0.00 179.97 180.29 1b5g h GLU 127 N 0.42 0.40 -1.67 0.20 3.07 -2.03 -2.84 114.58 112.13 1b5g h GLU 127 Ca 0.65 -0.11 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 1b5g h GLU 127 Cb 1.32 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 1b5g h GLU 127 CO -0.55 0.54 0.00 2.41 -1.40 0.00 0.00 179.01 180.01 1b5g n THR 128 N -4.69 0.46 0.00 1.13 -1.04 -0.21 -2.78 114.28 107.15 1b5g n THR 128 Ca -0.04 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 1b5g n THR 128 Cb 0.21 -0.78 0.00 0.00 -1.82 0.00 0.00 70.33 67.93 1b5g n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1b5g n ALA 129 N 0.97 0.00 0.18 2.41 0.00 -1.07 -2.37 120.51 120.63 1b5g n ALA 129 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1b5g n ALA 129 Cb 0.20 0.00 0.30 0.00 0.00 0.00 0.00 19.45 19.95 1b5g n ALA 129 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1b5g h SER 129 N 0.00 0.00 0.00 0.00 0.02 -1.82 -3.36 113.55 108.39 1b5g h SER 129 Ca 0.00 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.58 1b5g h SER 129 Cb 0.00 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.47 1b5g h SER 129 CO 0.00 0.42 -2.40 0.18 -1.14 0.00 0.00 176.83 173.89 1b5g n LEU 129 N -3.58 0.94 -4.58 5.07 4.77 -1.00 -4.74 117.00 113.88 1b5g n LEU 129 Ca -0.00 -0.04 -0.43 0.00 -0.03 0.00 0.00 56.01 55.51 1b5g n LEU 129 Cb 0.53 0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1b5g n LEU 129 CO 0.38 0.63 1.96 -0.76 -1.33 0.00 0.00 177.39 178.27 1b5g s LEU 130 N -5.79 3.81 -0.02 2.23 1.43 -1.26 -4.85 118.68 114.23 1b5g s LEU 130 Ca -0.18 -2.40 0.01 0.00 -1.03 0.00 0.00 54.13 50.53 1b5g s LEU 130 Cb 0.07 -2.58 0.01 0.00 0.03 0.00 0.00 46.19 43.72 1b5g s LEU 130 CO 0.75 -1.22 -0.03 -1.10 0.23 0.00 0.00 176.35 174.97 1b5g s GLN 131 N 4.30 0.39 0.13 1.70 -0.21 -1.26 -4.94 119.66 119.78 1b5g s GLN 131 Ca 0.54 -0.08 -0.35 0.00 0.02 0.00 0.00 55.36 55.49 1b5g s GLN 131 Cb 0.04 -0.44 -0.16 0.00 1.00 0.00 0.00 33.01 33.45 1b5g s GLN 131 CO 0.08 0.01 1.24 0.00 -2.12 0.00 0.00 175.29 174.49 1b5g n ALA 132 N 3.44 -0.89 0.00 6.09 0.00 -1.26 -1.31 120.51 126.57 1b5g n ALA 132 Ca -0.18 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1b5g n ALA 132 Cb 0.55 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.96 1b5g n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b5g n GLY 133 N 2.24 2.66 3.77 0.00 0.00 0.16 -4.94 105.19 109.07 1b5g n GLY 133 Ca 0.17 -0.25 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 1b5g n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b5g s TYR 134 N -1.44 2.63 0.02 1.61 1.51 -0.43 -4.62 117.35 116.64 1b5g s TYR 134 Ca 0.00 1.28 -0.03 0.00 -1.01 0.00 0.00 57.07 57.31 1b5g s TYR 134 Cb 0.00 -3.88 -0.04 0.00 -0.11 0.00 0.00 41.96 37.93 1b5g s TYR 134 CO 0.00 -2.67 0.21 0.15 -1.11 0.00 0.00 175.55 172.13 1b5g s LYS 135 N -2.22 3.47 0.48 -0.62 1.02 -1.26 -0.87 119.74 119.74 1b5g s LYS 135 Ca 0.56 -0.31 0.02 0.00 0.02 0.00 0.00 55.97 56.26 1b5g s LYS 135 Cb -0.43 -3.06 -0.01 0.00 -0.52 0.00 0.00 37.83 33.81 1b5g s LYS 135 CO 0.57 0.64 0.06 0.41 -0.92 0.00 0.00 175.35 176.11 1b5g n GLY 136 N 0.73 3.42 2.97 -3.33 0.00 -0.38 -4.86 105.19 103.73 1b5g n GLY 136 Ca -0.09 -2.28 -0.19 0.00 0.00 0.00 0.00 46.02 43.47 1b5g n GLY 136 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1b5g s ARG 137 N -3.76 0.74 0.04 1.61 3.52 -0.38 -1.25 118.95 119.46 1b5g s ARG 137 Ca 0.08 -0.23 0.09 0.00 -0.13 0.00 0.00 55.73 55.55 1b5g s ARG 137 Cb 0.00 -0.71 -0.03 0.00 -1.56 0.00 0.00 34.95 32.65 1b5g s ARG 137 CO 0.06 0.08 -0.26 0.08 -0.81 0.00 0.00 175.30 174.45 1b5g s VAL 138 N 0.21 2.08 0.10 7.11 1.01 -0.28 -0.41 120.40 130.21 1b5g s VAL 138 Ca -0.03 -1.34 0.03 0.00 0.00 0.00 0.00 61.98 60.64 1b5g s VAL 138 Cb -0.07 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 1b5g s VAL 138 CO 0.00 0.37 -0.09 0.42 0.00 0.00 0.00 175.10 175.80 1b5g s THR 139 N -0.78 0.90 0.00 3.92 -4.23 -1.24 -1.88 115.64 112.33 1b5g s THR 139 Ca 0.11 -1.75 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 1b5g s THR 139 Cb -0.10 -1.48 0.00 0.00 1.34 0.00 0.00 72.50 72.26 1b5g s THR 139 CO 0.02 -0.66 0.00 0.61 -0.54 0.00 0.00 174.62 174.05 1b5g n GLY 140 N 0.33 1.41 1.21 3.99 0.00 -1.00 -4.57 105.19 106.57 1b5g n GLY 140 Ca -0.14 -0.92 0.11 0.00 0.00 0.00 0.00 46.02 45.07 1b5g n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1b5g n TRP 141 N -0.52 0.79 -0.75 1.61 8.01 -1.26 -2.01 117.44 123.30 1b5g n TRP 141 Ca 0.00 -0.43 -0.30 0.00 -1.31 0.00 0.00 57.50 55.47 1b5g n TRP 141 Cb 0.00 -0.00 0.25 0.00 -2.01 0.00 0.00 31.31 29.55 1b5g n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1b5g s GLY 142 N -1.12 1.51 0.38 6.99 0.00 -1.26 -4.21 107.32 109.62 1b5g s GLY 142 Ca 0.43 -0.64 -0.26 0.00 0.00 0.00 0.00 44.72 44.25 1b5g s GLY 142 CO 0.31 0.21 1.09 0.70 0.00 0.00 0.00 173.10 175.41 1b5g n ASN 143 N -5.00 1.71 0.08 1.64 3.02 0.35 -2.92 115.26 114.15 1b5g n ASN 143 Ca 0.09 1.11 0.12 0.00 -0.03 0.00 0.00 54.58 55.87 1b5g n ASN 143 Cb 0.58 -1.38 0.16 0.00 -0.61 0.00 0.00 39.78 38.53 1b5g n ASN 143 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1b5g h LEU 144 N 1.90 0.00 -7.60 3.41 3.38 -1.36 0.83 115.31 115.87 1b5g h LEU 144 Ca -0.44 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.27 1b5g h LEU 144 Cb 1.32 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.87 1b5g h LEU 144 CO 0.59 0.07 -0.35 -0.54 0.09 0.00 0.00 178.44 178.30 1b5g s LYS 145 N -3.20 0.62 0.00 1.13 1.02 -1.26 -4.38 119.74 113.67 1b5g s LYS 145 Ca 0.05 -0.30 0.00 0.00 0.02 0.00 0.00 55.97 55.74 1b5g s LYS 145 Cb 0.12 0.27 0.00 0.00 -0.52 0.00 0.00 37.83 37.70 1b5g s LYS 145 CO 0.72 -0.17 0.00 -1.91 -0.92 0.00 0.00 175.35 173.07 1b5g n GLU 146 N 1.26 0.00 0.00 1.68 2.13 -1.26 -4.95 120.64 119.49 1b5g n GLU 146 Ca -0.22 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.60 1b5g n GLU 146 Cb 0.56 -0.79 0.00 0.00 0.27 0.00 0.00 31.44 31.48 1b5g n GLU 146 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1b5g n GLY 150 N 0.32 0.00 3.25 8.31 0.00 -1.26 -5.03 105.19 110.78 1b5g n GLY 150 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1b5g n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b5g s GLN 151 N -1.86 1.79 0.85 1.61 1.11 -1.26 -1.27 119.66 120.63 1b5g s GLN 151 Ca 0.00 -0.82 -0.12 0.00 0.01 0.00 0.00 55.36 54.44 1b5g s GLN 151 Cb 0.00 -1.75 0.10 0.00 -1.01 0.00 0.00 33.01 30.36 1b5g s GLN 151 CO 0.00 0.48 1.10 -1.25 0.01 0.00 0.00 175.29 175.62 1b5g s PRO 152 N -0.59 1.62 0.12 2.91 0.04 -1.26 -4.96 135.00 132.88 1b5g s PRO 152 Ca 0.09 0.67 0.22 0.00 0.04 0.00 0.00 61.00 62.02 1b5g s PRO 152 Cb -0.09 -1.86 -0.10 0.00 0.04 0.00 0.00 34.50 32.50 1b5g s PRO 152 CO -0.01 -1.96 0.87 0.45 0.04 0.00 0.00 177.00 176.40 1b5g n SER 153 N -3.67 0.57 -4.19 6.66 2.88 -1.26 -4.73 113.62 109.89 1b5g n SER 153 Ca 0.07 0.18 -0.11 0.00 -1.33 0.00 0.00 58.87 57.67 1b5g n SER 153 Cb 0.56 0.95 -0.10 0.00 -0.75 0.00 0.00 64.21 64.87 1b5g n SER 153 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1b5g s VAL 154 N -3.40 0.28 0.33 2.46 0.11 -1.26 -1.97 120.40 116.95 1b5g s VAL 154 Ca -0.02 -1.94 -0.28 0.00 -2.93 0.00 0.00 61.98 56.80 1b5g s VAL 154 Cb 0.11 -2.14 -0.12 0.00 -1.53 0.00 0.00 36.38 32.70 1b5g s VAL 154 CO 0.83 -0.40 1.31 -0.11 -3.33 0.00 0.00 175.10 173.40 1b5g n LEU 155 N -0.17 3.58 -4.80 2.54 7.94 -0.09 -4.83 117.00 121.17 1b5g n LEU 155 Ca -0.05 1.20 -0.26 0.00 -1.11 0.00 0.00 56.01 55.80 1b5g n LEU 155 Cb 0.64 -1.49 -0.05 0.00 0.53 0.00 0.00 43.42 43.05 1b5g n LEU 155 CO 0.32 -0.44 -0.21 -1.10 -1.11 0.00 0.00 177.39 174.84 1b5g s GLN 156 N -1.74 2.90 0.06 1.96 -1.52 -0.85 -0.70 119.66 119.77 1b5g s GLN 156 Ca 0.56 -0.88 0.02 0.00 -1.95 0.00 0.00 55.36 53.11 1b5g s GLN 156 Cb -0.57 -2.64 -0.03 0.00 -0.22 0.00 0.00 33.01 29.55 1b5g s GLN 156 CO 0.61 0.48 -0.07 0.08 -0.25 0.00 0.00 175.29 176.14 1b5g s VAL 157 N -1.77 0.56 -0.13 1.09 1.01 0.23 -2.38 120.40 119.00 1b5g s VAL 157 Ca 0.31 -1.32 -0.16 0.00 0.00 0.00 0.00 61.98 60.81 1b5g s VAL 157 Cb -0.10 -0.91 0.04 0.00 0.00 0.00 0.00 36.38 35.42 1b5g s VAL 157 CO 0.23 -0.53 0.42 0.54 0.00 0.00 0.00 175.10 175.76 1b5g s VAL 158 N -2.05 0.01 -0.18 2.92 0.11 -0.79 -1.20 120.40 119.22 1b5g s VAL 158 Ca -0.04 -0.09 -0.08 0.00 -2.93 0.00 0.00 61.98 58.84 1b5g s VAL 158 Cb -0.05 -0.63 -0.04 0.00 -1.53 0.00 0.00 36.38 34.13 1b5g s VAL 158 CO -0.01 -0.05 0.10 0.20 -3.33 0.00 0.00 175.10 172.01 1b5g s ASN 159 N -0.14 5.95 0.00 3.54 0.01 -1.26 -1.13 114.94 121.92 1b5g s ASN 159 Ca -0.03 0.19 -0.02 0.00 -0.71 0.00 0.00 52.86 52.29 1b5g s ASN 159 Cb -0.03 -2.02 -0.01 0.00 0.41 0.00 0.00 41.25 39.60 1b5g s ASN 159 CO 0.02 0.20 0.03 -0.76 -1.51 0.00 0.00 177.10 175.08 1b5g s LEU 160 N 0.21 1.97 0.35 0.60 1.43 -0.38 -4.94 118.68 117.93 1b5g s LEU 160 Ca 0.07 -0.21 -0.17 0.00 -1.03 0.00 0.00 54.13 52.78 1b5g s LEU 160 Cb -0.12 0.20 -0.10 0.00 0.03 0.00 0.00 46.19 46.21 1b5g s LEU 160 CO -0.01 -0.19 0.81 -2.16 0.23 0.00 0.00 176.35 175.03 1b5g s PRO 161 N -0.82 4.10 0.26 1.29 0.04 -1.26 -1.25 135.00 137.36 1b5g s PRO 161 Ca -0.09 0.84 -0.30 0.00 0.04 0.00 0.00 61.00 61.49 1b5g s PRO 161 Cb -0.06 -2.38 -0.09 0.00 0.04 0.00 0.00 34.50 32.01 1b5g s PRO 161 CO -0.00 0.11 1.03 0.42 0.04 0.00 0.00 177.00 178.60 1b5g s ILE 162 N -2.01 3.75 0.04 0.56 1.01 -0.05 -1.53 121.20 122.96 1b5g s ILE 162 Ca 0.56 1.76 0.02 0.00 0.00 0.00 0.00 60.65 62.99 1b5g s ILE 162 Cb -0.10 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 1b5g s ILE 162 CO 0.16 0.42 0.02 -0.69 0.00 0.00 0.00 174.94 174.85 1b5g s VAL 163 N -1.16 4.22 0.34 2.92 1.01 -1.02 -0.66 120.40 126.05 1b5g s VAL 163 Ca 0.43 -0.72 -0.29 0.00 0.00 0.00 0.00 61.98 61.41 1b5g s VAL 163 Cb -0.29 -2.94 -0.11 0.00 0.00 0.00 0.00 36.38 33.04 1b5g s VAL 163 CO 0.37 0.27 1.43 -1.61 0.00 0.00 0.00 175.10 175.56 1b5g s GLU 164 N -1.90 4.20 0.33 2.72 8.01 -1.26 -4.63 118.70 126.18 1b5g s GLU 164 Ca 0.23 2.44 0.13 0.00 0.01 0.00 0.00 54.97 57.77 1b5g s GLU 164 Cb -0.12 -3.02 1.03 0.00 -4.31 0.00 0.00 34.13 27.71 1b5g s GLU 164 CO 0.14 -0.42 1.67 -0.09 0.01 0.00 0.00 175.26 176.57 1b5g h ARG 165 N 3.47 0.34 -0.26 1.61 2.43 -1.99 -1.75 114.38 118.22 1b5g h ARG 165 Ca -0.49 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 58.51 1b5g h ARG 165 Cb 1.23 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1b5g h ARG 165 CO 0.67 0.23 -0.41 -1.00 -1.51 0.00 0.00 179.97 177.94 1b5g h PRO 166 N 0.35 0.74 -0.74 0.20 0.13 -1.99 -1.91 132.00 128.78 1b5g h PRO 166 Ca 0.71 -0.45 -0.02 0.00 -0.87 0.00 0.00 66.00 65.37 1b5g h PRO 166 Cb 1.56 0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.70 1b5g h PRO 166 CO -0.59 1.07 0.39 0.28 -0.23 0.00 0.00 178.00 178.92 1b5g h VAL 167 N 0.48 1.23 0.58 1.56 2.07 -1.72 -2.06 116.25 118.39 1b5g h VAL 167 Ca 0.02 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 1b5g h VAL 167 Cb 1.01 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1b5g h VAL 167 CO 0.09 0.26 -0.50 0.00 0.02 0.00 0.00 177.57 177.45 1b5g h LYS 169 N -1.06 0.79 0.00 0.00 1.57 -1.23 -2.32 116.57 114.32 1b5g h LYS 169 Ca -0.07 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1b5g h LYS 169 Cb 0.90 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.03 1b5g h LYS 169 CO -0.02 0.52 0.00 -0.25 -0.57 0.00 0.00 179.45 179.13 1b5g n ASP 170 N -4.73 0.00 -0.11 0.86 8.00 -0.79 -2.72 116.55 117.06 1b5g n ASP 170 Ca 0.14 0.27 0.12 0.00 0.71 0.00 0.00 54.79 56.03 1b5g n ASP 170 Cb 0.28 -0.41 0.27 0.00 -0.02 0.00 0.00 41.12 41.24 1b5g n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1b5g n SER 171 N -1.41 0.78 -4.10 -2.24 3.41 -0.87 -4.98 113.62 104.21 1b5g n SER 171 Ca 0.08 -0.58 -0.11 0.00 -0.26 0.00 0.00 58.87 58.00 1b5g n SER 171 Cb 0.24 0.26 -0.08 0.00 -0.26 0.00 0.00 64.21 64.36 1b5g n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1b5g s THR 172 N -2.79 0.01 -1.01 6.66 -1.32 -1.10 -4.86 115.64 111.22 1b5g s THR 172 Ca 0.16 -1.72 0.21 0.00 -1.21 0.00 0.00 61.69 59.14 1b5g s THR 172 Cb 0.18 -2.32 -0.21 0.00 -1.51 0.00 0.00 72.50 68.64 1b5g s THR 172 CO 0.64 -0.04 0.95 0.54 -2.21 0.00 0.00 174.62 174.49 1b5g n ARG 173 N -0.31 0.01 -2.77 7.08 1.74 -1.26 -4.92 116.66 116.24 1b5g n ARG 173 Ca -0.00 -0.01 -0.41 0.00 -0.77 0.00 0.00 57.85 56.66 1b5g n ARG 173 Cb 0.64 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.53 1b5g n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1b5g s ILE 174 N -2.99 4.36 -0.04 0.55 1.01 -1.26 -5.01 121.20 117.82 1b5g s ILE 174 Ca 0.08 2.03 -0.30 0.00 0.00 0.00 0.00 60.65 62.46 1b5g s ILE 174 Cb 0.16 -4.30 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 1b5g s ILE 174 CO 0.85 0.39 1.44 -0.60 0.00 0.00 0.00 174.94 177.03 1b5g s ARG 175 N -0.47 4.25 0.07 2.79 3.52 -1.26 -5.00 118.95 122.85 1b5g s ARG 175 Ca 0.44 1.98 -0.20 0.00 -0.13 0.00 0.00 55.73 57.81 1b5g s ARG 175 Cb -0.24 -3.70 -0.07 0.00 -1.56 0.00 0.00 34.95 29.38 1b5g s ARG 175 CO 0.30 -0.66 0.60 0.42 -0.81 0.00 0.00 175.30 175.15 1b5g s ILE 176 N 2.96 4.71 0.36 4.11 -1.09 -1.26 -4.88 121.20 126.11 1b5g s ILE 176 Ca 0.65 1.29 0.09 0.00 -2.23 0.00 0.00 60.65 60.45 1b5g s ILE 176 Cb -0.30 -3.94 -0.06 0.00 -1.58 0.00 0.00 42.46 36.57 1b5g s ILE 176 CO 0.25 0.53 -0.01 0.42 -1.23 0.00 0.00 174.94 174.90 1b5g s THR 177 N -0.96 2.33 0.13 2.92 -4.23 -1.26 -5.02 115.64 109.54 1b5g s THR 177 Ca 0.30 -2.03 0.32 0.00 -1.18 0.00 0.00 61.69 59.09 1b5g s THR 177 Cb -0.20 -2.80 0.32 0.00 1.34 0.00 0.00 72.50 71.16 1b5g s THR 177 CO 0.20 -0.14 1.96 0.44 -0.54 0.00 0.00 174.62 176.54 1b5g h ASP 178 N 1.84 0.00 -0.25 3.99 3.32 -2.03 -2.62 116.42 120.67 1b5g h ASP 178 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1b5g h ASP 178 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1b5g h ASP 178 CO 0.71 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.82 1b5g n ASN 179 N -2.63 2.07 -4.26 6.45 3.02 -1.26 -4.85 115.26 113.79 1b5g n ASN 179 Ca -0.02 -2.16 -0.15 0.00 -0.03 0.00 0.00 54.58 52.23 1b5g n ASN 179 Cb 0.09 -0.36 -0.10 0.00 -0.61 0.00 0.00 39.78 38.80 1b5g n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1b5g s MET 180 N -1.64 1.09 0.08 3.52 -1.94 -0.99 -0.68 119.30 118.73 1b5g s MET 180 Ca 0.20 -1.45 -0.08 0.00 -1.71 0.00 0.00 55.69 52.65 1b5g s MET 180 Cb 0.12 -0.71 -0.01 0.00 2.01 0.00 0.00 34.83 36.25 1b5g s MET 180 CO 0.10 0.10 0.16 -0.59 -0.01 0.00 0.00 175.02 174.77 1b5g s PHE 181 N -3.17 0.19 0.18 -0.03 -0.12 -1.01 -4.80 117.98 109.22 1b5g s PHE 181 Ca 0.17 -0.62 0.09 0.00 -0.05 0.00 0.00 56.93 56.52 1b5g s PHE 181 Cb 0.01 -0.11 -0.04 0.00 -0.63 0.00 0.00 43.02 42.26 1b5g s PHE 181 CO 0.02 -0.50 -0.20 0.00 -0.05 0.00 0.00 175.22 174.49 1b5g s ALA 183 N -2.03 -0.33 0.00 0.00 0.00 0.33 -2.44 121.76 117.28 1b5g s ALA 183 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1b5g s ALA 183 Cb -0.06 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.08 1b5g s ALA 183 CO 0.08 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.08 1b5g n GLY 184 N 1.84 2.79 3.94 0.00 0.00 -0.58 -2.28 105.19 110.89 1b5g n GLY 184 Ca -0.20 -1.40 -0.25 0.00 0.00 0.00 0.00 46.02 44.17 1b5g n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b5g s TYR 184 N -2.00 3.13 0.32 1.61 2.02 -1.26 -4.42 117.35 116.75 1b5g s TYR 184 Ca 0.00 0.41 -0.01 0.00 -0.37 0.00 0.00 57.07 57.10 1b5g s TYR 184 Cb 0.00 -2.71 -0.04 0.00 -0.40 0.00 0.00 41.96 38.82 1b5g s TYR 184 CO 0.00 -0.81 0.54 0.15 -1.57 0.00 0.00 175.55 173.86 1b5g s LYS 185 N -4.89 3.52 0.67 -0.62 1.02 -1.26 -4.78 119.74 113.39 1b5g s LYS 185 Ca 0.54 -0.26 0.33 0.00 0.02 0.00 0.00 55.97 56.61 1b5g s LYS 185 Cb -0.10 -2.67 1.82 0.00 -0.52 0.00 0.00 37.83 36.36 1b5g s LYS 185 CO 0.42 0.18 2.03 -1.00 -0.92 0.00 0.00 175.35 176.06 1b5g h PRO 186 N 1.06 0.00 0.00 -1.68 0.13 -1.95 -2.44 132.00 127.12 1b5g h PRO 186 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1b5g h PRO 186 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1b5g h PRO 186 CO 0.63 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.15 1b5g n ASP 186 N -2.93 0.00 0.11 1.44 8.00 -1.26 -4.20 116.55 117.72 1b5g n ASP 186 Ca -0.02 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.87 1b5g n ASP 186 Cb 0.30 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.29 1b5g n ASP 186 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1b5g n GLU 186 N -0.83 0.01 -4.13 -1.24 1.02 -0.92 -4.72 120.64 109.83 1b5g n GLU 186 Ca 0.00 0.33 -0.42 0.00 -0.02 0.00 0.00 57.16 57.05 1b5g n GLU 186 Cb 0.00 -1.65 -0.01 0.00 -0.02 0.00 0.00 31.44 29.76 1b5g n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b5g n GLY 186 N -0.96 -0.62 3.40 0.62 0.00 -1.25 -4.96 105.19 101.42 1b5g n GLY 186 Ca 0.00 0.28 -0.14 0.00 0.00 0.00 0.00 46.02 46.16 1b5g n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b5g s LYS 186 N -7.38 0.65 0.35 1.61 1.02 -1.26 -5.18 119.74 109.55 1b5g s LYS 186 Ca 0.36 0.59 0.02 0.00 0.02 0.00 0.00 55.97 56.96 1b5g s LYS 186 Cb -0.20 0.31 -0.01 0.00 -0.52 0.00 0.00 37.83 37.41 1b5g s LYS 186 CO 0.95 -0.10 0.09 0.54 -0.92 0.00 0.00 175.35 175.90 1b5g n ARG 187 N 2.49 0.73 0.00 1.68 5.12 -1.26 -4.68 116.66 120.74 1b5g n ARG 187 Ca -0.15 -2.87 0.00 0.00 -1.93 0.00 0.00 57.85 52.91 1b5g n ARG 187 Cb 0.56 1.36 0.00 0.00 -1.16 0.00 0.00 32.46 33.22 1b5g n ARG 187 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1b5g n GLY 188 N -0.15 4.20 3.63 -0.13 0.00 -1.25 -4.92 105.19 106.57 1b5g n GLY 188 Ca -0.08 -1.43 -0.02 0.00 0.00 0.00 0.00 46.02 44.49 1b5g n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1b5g s ASP 189 N 0.00 -0.14 0.86 1.61 2.15 -1.00 -4.69 116.67 115.46 1b5g s ASP 189 Ca 0.00 -0.13 -0.13 0.00 0.43 0.00 0.00 52.55 52.72 1b5g s ASP 189 Cb 0.00 0.25 0.12 0.00 -0.30 0.00 0.00 42.92 42.99 1b5g s ASP 189 CO 0.00 -0.44 1.21 0.00 -0.17 0.00 0.00 175.17 175.78 1b5g s ALA 190 N -2.67 2.57 0.35 3.66 0.00 -1.26 0.28 121.76 124.68 1b5g s ALA 190 Ca 0.11 -0.91 -0.14 0.00 0.00 0.00 0.00 51.96 51.02 1b5g s ALA 190 Cb 0.01 -2.83 0.03 0.00 0.00 0.00 0.00 23.12 20.34 1b5g s ALA 190 CO -0.04 -1.93 0.70 0.00 0.00 0.00 0.00 175.76 174.50 1b5g n GLU 192 N -0.51 1.18 0.00 0.00 -0.58 -1.26 -1.22 120.64 118.26 1b5g n GLU 192 Ca -0.05 0.42 0.00 0.00 -0.42 0.00 0.00 57.16 57.11 1b5g n GLU 192 Cb 0.60 -1.93 0.00 0.00 -0.57 0.00 0.00 31.44 29.54 1b5g n GLU 192 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1b5g n GLY 193 N 2.04 2.32 0.19 0.62 0.00 -1.26 -0.49 105.19 108.60 1b5g n GLY 193 Ca 0.15 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.26 1b5g n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1b5g h ASP 194 N 0.00 0.00 -0.99 1.61 3.32 -1.52 -3.35 116.42 115.50 1b5g h ASP 194 Ca 0.00 0.00 -0.71 0.00 0.02 0.00 0.00 57.03 56.34 1b5g h ASP 194 Cb 0.00 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.63 1b5g h ASP 194 CO 0.00 0.17 -0.27 -1.20 -1.72 0.00 0.00 179.24 176.22 1b5g n SER 195 N -3.13 -0.70 0.00 6.45 7.64 -1.26 -1.72 113.62 120.90 1b5g n SER 195 Ca 0.03 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1b5g n SER 195 Cb 0.60 -0.93 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 1b5g n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1b5g n GLY 196 N 1.76 1.18 3.81 0.23 0.00 -0.69 0.12 105.19 111.61 1b5g n GLY 196 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 1b5g n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b5g s GLY 197 N -1.91 1.63 0.08 -0.02 0.00 -0.70 -2.81 107.32 103.59 1b5g s GLY 197 Ca 0.00 -0.14 -0.22 0.00 0.00 0.00 0.00 44.72 44.36 1b5g s GLY 197 CO 0.00 0.26 0.65 2.56 0.00 0.00 0.00 173.10 176.57 1b5g s PRO 198 N -5.14 4.36 -0.32 2.90 0.04 -1.26 -0.72 135.00 134.85 1b5g s PRO 198 Ca 0.60 0.89 -0.11 0.00 0.04 0.00 0.00 61.00 62.42 1b5g s PRO 198 Cb -0.14 -3.28 -0.01 0.00 0.04 0.00 0.00 34.50 31.11 1b5g s PRO 198 CO 0.54 0.54 0.20 0.12 0.04 0.00 0.00 177.00 178.43 1b5g s PHE 199 N -0.85 3.20 0.25 0.56 2.19 0.49 -3.62 117.98 120.21 1b5g s PHE 199 Ca 0.32 -0.37 0.11 0.00 0.33 0.00 0.00 56.93 57.32 1b5g s PHE 199 Cb -0.20 -2.41 -0.05 0.00 -1.31 0.00 0.00 43.02 39.04 1b5g s PHE 199 CO 0.21 -0.40 -0.19 0.14 1.83 0.00 0.00 175.22 176.81 1b5g s VAL 200 N 1.67 2.29 0.05 3.12 -7.23 0.45 -0.66 120.40 120.08 1b5g s VAL 200 Ca 0.05 -2.32 0.03 0.00 -1.81 0.00 0.00 61.98 57.94 1b5g s VAL 200 Cb -0.17 -2.21 -0.02 0.00 0.56 0.00 0.00 36.38 34.53 1b5g s VAL 200 CO 0.08 -0.42 -0.11 -0.04 -0.31 0.00 0.00 175.10 174.31 1b5g s MET 201 N -3.44 0.67 -0.29 4.82 -1.94 0.02 -1.25 119.30 117.89 1b5g s MET 201 Ca 0.27 -0.80 -0.12 0.00 -1.71 0.00 0.00 55.69 53.33 1b5g s MET 201 Cb -0.04 -0.55 -0.04 0.00 2.01 0.00 0.00 34.83 36.20 1b5g s MET 201 CO 0.12 0.12 0.25 0.21 -0.01 0.00 0.00 175.02 175.71 1b5g s LYS 202 N -1.52 3.90 0.16 2.03 2.20 -1.26 -0.67 119.74 124.58 1b5g s LYS 202 Ca -0.05 -0.27 -0.32 0.00 -0.36 0.00 0.00 55.97 54.97 1b5g s LYS 202 Cb -0.09 -3.68 -0.11 0.00 -1.51 0.00 0.00 37.83 32.44 1b5g s LYS 202 CO 0.01 -0.25 1.71 0.45 -0.36 0.00 0.00 175.35 176.91 1b5g s SER 203 N 1.73 6.46 0.35 1.43 0.15 0.84 -4.91 113.70 119.74 1b5g s SER 203 Ca 0.09 2.75 0.26 0.00 0.70 0.00 0.00 55.95 59.76 1b5g s SER 203 Cb -0.16 -2.59 0.89 0.00 -1.71 0.00 0.00 66.02 62.45 1b5g s SER 203 CO 0.11 -0.94 1.77 1.55 1.20 0.00 0.00 173.24 176.93 1b5g h PRO 204 N 7.41 0.00 0.00 5.44 0.13 -1.96 0.76 132.00 143.78 1b5g h PRO 204 Ca -0.44 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.68 1b5g h PRO 204 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1b5g h PRO 204 CO 0.94 0.00 -0.08 0.74 -0.23 0.00 0.00 178.00 179.37 1b5g h PHE 204 N 0.00 0.00 -0.00 1.56 0.04 -1.97 -3.40 116.94 113.17 1b5g h PHE 204 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1b5g h PHE 204 Cb 0.63 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.78 1b5g h PHE 204 CO 0.00 0.95 0.00 0.27 -0.60 0.00 0.00 178.31 178.93 1b5g n ASN 204 N -4.61 1.13 -0.81 2.17 2.04 -1.25 -5.02 115.26 108.91 1b5g n ASN 204 Ca -0.11 -1.09 -0.11 0.00 -0.44 0.00 0.00 54.58 52.84 1b5g n ASN 204 Cb 0.46 -0.00 -0.05 0.00 -2.53 0.00 0.00 39.78 37.66 1b5g n ASN 204 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1b5g n ASN 205 N 0.02 -4.68 -4.89 0.53 4.13 0.26 -5.01 115.26 105.62 1b5g n ASN 205 Ca 0.01 0.26 -0.31 0.00 1.68 0.00 0.00 54.58 56.22 1b5g n ASN 205 Cb 0.04 -3.11 -0.04 0.00 -1.54 0.00 0.00 39.78 35.12 1b5g n ASN 205 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1b5g s ARG 206 N -2.74 3.67 -0.11 3.52 0.52 -1.25 -4.80 118.95 117.76 1b5g s ARG 206 Ca 0.00 0.01 -0.19 0.00 -0.52 0.00 0.00 55.73 55.04 1b5g s ARG 206 Cb 0.00 -2.75 -0.04 0.00 0.52 0.00 0.00 34.95 32.68 1b5g s ARG 206 CO 0.00 0.37 0.49 -1.58 0.02 0.00 0.00 175.30 174.60 1b5g s TRP 207 N -1.80 3.53 -0.01 -0.53 0.52 -1.26 -0.11 118.94 119.27 1b5g s TRP 207 Ca 0.43 0.93 0.08 0.00 0.02 0.00 0.00 56.10 57.56 1b5g s TRP 207 Cb -0.11 -2.57 -0.02 0.00 -1.15 0.00 0.00 33.47 29.62 1b5g s TRP 207 CO 0.25 0.18 -0.25 0.71 0.02 0.00 0.00 176.95 177.86 1b5g s TYR 208 N 0.58 2.22 -0.30 -1.98 2.02 0.15 -2.54 117.35 117.51 1b5g s TYR 208 Ca 0.27 -0.42 -0.14 0.00 -0.37 0.00 0.00 57.07 56.41 1b5g s TYR 208 Cb -0.15 -1.42 -0.03 0.00 -0.40 0.00 0.00 41.96 39.95 1b5g s TYR 208 CO 0.11 -0.02 0.31 -1.14 -1.57 0.00 0.00 175.55 173.24 1b5g s GLN 209 N -0.67 3.84 -0.06 -0.62 0.74 0.24 -0.80 119.66 122.34 1b5g s GLN 209 Ca 0.10 -0.24 0.18 0.00 0.05 0.00 0.00 55.36 55.45 1b5g s GLN 209 Cb -0.10 -3.71 -0.28 0.00 1.10 0.00 0.00 33.01 30.03 1b5g s GLN 209 CO -0.01 -0.32 0.34 -1.33 -0.55 0.00 0.00 175.29 173.42 1b5g n MET 210 N 5.25 0.69 -4.10 1.67 2.81 0.16 -4.34 117.12 119.26 1b5g n MET 210 Ca -0.11 -0.14 -0.10 0.00 -1.81 0.00 0.00 57.70 55.54 1b5g n MET 210 Cb 0.51 -1.45 -0.08 0.00 -0.71 0.00 0.00 33.22 31.48 1b5g n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1b5g s GLY 211 N -4.39 0.97 -0.06 3.03 0.00 -1.11 -2.25 107.32 103.52 1b5g s GLY 211 Ca -0.07 -1.31 0.03 0.00 0.00 0.00 0.00 44.72 43.37 1b5g s GLY 211 CO 0.77 -1.11 -0.16 -0.42 0.00 0.00 0.00 173.10 172.19 1b5g s ILE 212 N -4.07 1.37 -0.17 0.90 1.01 -1.09 -0.38 121.20 118.77 1b5g s ILE 212 Ca 0.29 -0.65 -0.35 0.00 0.00 0.00 0.00 60.65 59.93 1b5g s ILE 212 Cb 0.05 -1.20 -0.12 0.00 0.01 0.00 0.00 42.46 41.19 1b5g s ILE 212 CO 0.07 0.40 1.91 0.52 0.00 0.00 0.00 174.94 177.84 1b5g n VAL 213 N 3.43 0.47 -0.00 2.92 0.31 0.10 -1.10 118.33 124.46 1b5g n VAL 213 Ca -0.20 -0.13 -0.01 0.00 -0.01 0.00 0.00 64.34 63.99 1b5g n VAL 213 Cb 0.53 -1.74 -0.00 0.00 -0.91 0.00 0.00 33.84 31.71 1b5g n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1b5g n SER 214 N 7.02 0.47 -3.51 4.52 2.88 -0.76 -1.70 113.62 122.54 1b5g n SER 214 Ca 0.26 0.07 -0.11 0.00 -1.33 0.00 0.00 58.87 57.76 1b5g n SER 214 Cb 0.26 -0.32 -0.02 0.00 -0.75 0.00 0.00 64.21 63.38 1b5g n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1b5g s TRP 215 N -1.45 -0.46 0.10 0.66 1.48 -0.87 -4.92 118.94 113.48 1b5g s TRP 215 Ca -0.04 0.20 -0.04 0.00 -1.06 0.00 0.00 56.10 55.16 1b5g s TRP 215 Cb 0.01 0.59 0.02 0.00 -1.16 0.00 0.00 33.47 32.92 1b5g s TRP 215 CO 0.06 -0.92 0.21 0.41 -4.06 0.00 0.00 176.95 172.65 1b5g n GLY 216 N -0.39 1.68 2.81 3.67 0.00 -1.26 -1.50 105.19 110.19 1b5g n GLY 216 Ca -0.14 -1.07 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 1b5g n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1b5g s GLU 217 N -2.02 0.96 1.45 1.61 2.02 -1.26 -5.00 118.70 116.46 1b5g s GLU 217 Ca 0.04 -1.09 0.00 0.00 0.02 0.00 0.00 54.97 53.94 1b5g s GLU 217 Cb -0.01 -2.28 0.00 0.00 0.10 0.00 0.00 34.13 31.94 1b5g s GLU 217 CO 0.03 -0.87 0.00 0.41 0.02 0.00 0.00 175.26 174.85 1b5g n GLY 219 N 4.76 -1.62 2.82 -1.39 0.00 -1.26 -4.72 105.19 103.77 1b5g n GLY 219 Ca -0.04 -1.29 -0.18 0.00 0.00 0.00 0.00 46.02 44.51 1b5g n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b5g n ASP 221 N 4.26 -5.69 -4.77 0.00 2.03 -1.26 -4.62 116.55 106.49 1b5g n ASP 221 Ca -0.24 -0.10 -0.38 0.00 0.52 0.00 0.00 54.79 54.59 1b5g n ASP 221 Cb 0.50 -4.69 -0.06 0.00 -0.72 0.00 0.00 41.12 36.15 1b5g n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1b5g s ARG 221 N -5.30 4.65 0.30 -0.67 1.81 -1.26 -4.94 118.95 113.53 1b5g s ARG 221 Ca 0.12 1.31 -0.29 0.00 -1.72 0.00 0.00 55.73 55.14 1b5g s ARG 221 Cb -0.05 -3.07 -0.11 0.00 -0.45 0.00 0.00 34.95 31.27 1b5g s ARG 221 CO 0.14 0.44 1.47 -0.51 -0.68 0.00 0.00 175.30 176.16 1b5g s ASP 222 N -1.37 6.53 0.00 0.23 1.01 -1.26 -2.47 116.67 119.34 1b5g s ASP 222 Ca 0.43 2.82 0.00 0.00 0.71 0.00 0.00 52.55 56.51 1b5g s ASP 222 Cb -0.22 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.07 1b5g s ASP 222 CO 0.27 -0.77 0.00 0.61 0.21 0.00 0.00 175.17 175.49 1b5g n GLY 223 N 1.66 0.79 3.33 0.21 0.00 -1.26 -5.01 105.19 104.91 1b5g n GLY 223 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 1b5g n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b5g s LYS 224 N -0.09 1.25 0.11 1.61 -0.14 -1.03 -4.71 119.74 116.74 1b5g s LYS 224 Ca 0.00 -1.29 0.05 0.00 -1.36 0.00 0.00 55.97 53.37 1b5g s LYS 224 Cb 0.00 -1.53 -0.04 0.00 -1.68 0.00 0.00 37.83 34.58 1b5g s LYS 224 CO 0.00 0.35 -0.12 0.71 -0.76 0.00 0.00 175.35 175.53 1b5g s TYR 225 N -1.36 1.23 0.21 3.18 1.51 -1.26 -4.66 117.35 116.20 1b5g s TYR 225 Ca 0.11 -0.63 -0.20 0.00 -1.01 0.00 0.00 57.07 55.35 1b5g s TYR 225 Cb -0.09 -0.65 -0.08 0.00 -0.11 0.00 0.00 41.96 41.03 1b5g s TYR 225 CO 0.06 0.07 0.71 0.20 -1.11 0.00 0.00 175.55 175.48 1b5g s GLY 226 N -2.56 2.62 -0.09 0.71 0.00 -0.97 -4.59 107.32 102.44 1b5g s GLY 226 Ca 0.09 0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.97 1b5g s GLY 226 CO 0.01 0.52 -0.11 -1.36 0.00 0.00 0.00 173.10 172.16 1b5g s PHE 227 N -1.49 2.82 0.04 1.90 0.40 -0.56 -0.52 117.98 120.58 1b5g s PHE 227 Ca 0.42 -0.30 0.09 0.00 -0.60 0.00 0.00 56.93 56.54 1b5g s PHE 227 Cb -0.17 -1.75 -0.03 0.00 0.51 0.00 0.00 43.02 41.58 1b5g s PHE 227 CO 0.21 0.06 -0.26 0.71 0.70 0.00 0.00 175.22 176.64 1b5g s TYR 228 N -0.26 2.27 0.16 0.36 2.02 -0.32 -1.83 117.35 119.74 1b5g s TYR 228 Ca 0.02 -0.41 -0.31 0.00 -0.37 0.00 0.00 57.07 56.00 1b5g s TYR 228 Cb -0.13 -1.36 -0.09 0.00 -0.40 0.00 0.00 41.96 39.98 1b5g s TYR 228 CO 0.03 0.12 1.47 0.99 -1.57 0.00 0.00 175.55 176.58 1b5g s THR 229 N -0.80 2.93 -0.76 -0.71 2.01 -0.26 -2.42 115.64 115.64 1b5g s THR 229 Ca 0.11 0.69 -0.24 0.00 0.31 0.00 0.00 61.69 62.56 1b5g s THR 229 Cb -0.10 -3.44 0.06 0.00 0.01 0.00 0.00 72.50 69.03 1b5g s THR 229 CO 0.02 0.06 1.16 -2.28 -0.69 0.00 0.00 174.62 172.89 1b5g s HIS 230 N 0.93 2.54 0.15 4.92 2.46 0.14 -2.68 115.29 123.75 1b5g s HIS 230 Ca 0.66 -0.47 -0.17 0.00 0.47 0.00 0.00 55.06 55.55 1b5g s HIS 230 Cb -0.40 -4.47 0.02 0.00 -0.13 0.00 0.00 32.58 27.59 1b5g s HIS 230 CO 0.33 -1.84 1.79 0.28 -2.47 0.00 0.00 174.74 172.83 1b5g h VAL 231 N 6.08 1.02 0.00 0.89 2.07 -1.77 -2.40 116.25 122.14 1b5g h VAL 231 Ca -0.19 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 1b5g h VAL 231 Cb 1.05 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.40 1b5g h VAL 231 CO 1.24 0.07 -0.13 0.15 0.02 0.00 0.00 177.57 178.93 1b5g h PHE 232 N 0.41 0.00 0.00 1.57 3.57 -1.88 -1.83 116.94 118.77 1b5g h PHE 232 Ca 0.14 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 1b5g h PHE 232 Cb 0.02 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 1b5g h PHE 232 CO -0.08 0.13 -0.12 0.00 -2.23 0.00 0.00 178.31 176.01 1b5g h ARG 233 N 0.00 0.00 -0.35 1.11 3.08 -1.81 -2.08 114.38 114.33 1b5g h ARG 233 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1b5g h ARG 233 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1b5g h ARG 233 CO 0.02 0.12 0.00 1.28 -1.07 0.00 0.00 179.97 180.32 1b5g n LEU 234 N -3.42 3.11 -0.35 3.04 4.77 -0.74 -4.61 117.00 118.79 1b5g n LEU 234 Ca -0.01 -1.61 0.15 0.00 -0.03 0.00 0.00 56.01 54.52 1b5g n LEU 234 Cb 0.30 -0.23 0.35 0.00 -2.33 0.00 0.00 43.42 41.51 1b5g n LEU 234 CO 0.30 0.70 1.18 0.50 -1.33 0.00 0.00 177.39 178.74 1b5g h LYS 235 N 3.38 0.67 -0.15 3.23 3.64 -0.77 -1.82 116.57 124.76 1b5g h LYS 235 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1b5g h LYS 235 Cb 0.83 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1b5g h LYS 235 CO 0.00 0.44 0.09 0.87 -2.27 0.00 0.00 179.45 178.58 1b5g h LYS 236 N 0.69 0.20 -0.81 1.90 6.56 -1.81 -1.92 116.57 121.38 1b5g h LYS 236 Ca 0.60 -0.01 0.04 0.00 -1.06 0.00 0.00 60.65 60.22 1b5g h LYS 236 Cb 1.04 -0.04 -0.05 0.00 -0.57 0.00 0.00 32.23 32.60 1b5g h LYS 236 CO -0.41 0.15 0.51 2.35 -2.06 0.00 0.00 179.45 179.99 1b5g h TRP 237 N 0.18 0.94 -0.52 -1.35 7.01 -1.69 -2.46 115.95 118.06 1b5g h TRP 237 Ca 0.05 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.05 1b5g h TRP 237 Cb 0.00 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 26.73 1b5g h TRP 237 CO -0.06 0.52 0.22 0.82 -2.79 0.00 0.00 178.44 177.14 1b5g h ILE 238 N 0.96 1.21 0.53 2.65 2.04 -1.28 -2.15 117.51 121.48 1b5g h ILE 238 Ca 0.33 -0.64 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 1b5g h ILE 238 Cb 0.07 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1b5g h ILE 238 CO -0.14 0.25 -0.50 1.56 0.00 0.00 0.00 178.15 179.32 1b5g h GLN 239 N 0.70 -0.99 -0.85 2.37 4.20 -0.97 -2.00 115.11 117.56 1b5g h GLN 239 Ca 0.18 0.07 0.11 0.00 0.06 0.00 0.00 58.65 59.06 1b5g h GLN 239 Cb 0.18 0.22 -0.13 0.00 0.30 0.00 0.00 27.48 28.05 1b5g h GLN 239 CO -0.02 -0.66 -0.48 -0.22 -0.67 0.00 0.00 178.83 176.78 1b5g h LYS 240 N -1.03 -0.08 -0.41 1.46 1.63 -1.48 -0.31 116.57 116.36 1b5g h LYS 240 Ca -0.07 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.78 1b5g h LYS 240 Cb 0.88 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.49 1b5g h LYS 240 CO -0.04 -0.05 0.19 0.28 -3.45 0.00 0.00 179.45 176.37 1b5g h VAL 241 N -0.08 0.95 -0.31 2.00 2.07 -1.17 -1.91 116.25 117.81 1b5g h VAL 241 Ca 0.22 -0.13 -0.18 0.00 0.82 0.00 0.00 66.70 67.43 1b5g h VAL 241 Cb 0.52 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1b5g h VAL 241 CO -0.87 0.07 -0.49 0.40 0.02 0.00 0.00 177.57 176.70 1b5g h ILE 242 N 0.39 1.28 -0.01 4.57 2.04 -0.51 -1.19 117.51 124.08 1b5g h ILE 242 Ca 0.18 -1.68 0.00 0.00 1.00 0.00 0.00 64.86 64.36 1b5g h ILE 242 Cb 0.10 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 1b5g h ILE 242 CO -0.14 0.55 -0.37 -0.90 0.00 0.00 0.00 178.15 177.29 1b5g n ASP 243 N -4.04 0.97 0.03 1.72 5.68 -0.23 -0.61 116.55 120.07 1b5g n ASP 243 Ca -0.04 -0.79 0.11 0.00 -0.50 0.00 0.00 54.79 53.58 1b5g n ASP 243 Cb 0.60 0.23 -0.10 0.00 -1.14 0.00 0.00 41.12 40.71 1b5g n ASP 243 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 1b5g n GLN 244 N -0.85 0.60 0.00 0.11 7.27 -0.72 -4.42 117.38 119.36 1b5g n GLN 244 Ca 0.10 -0.08 0.00 0.00 0.07 0.00 0.00 57.00 57.09 1b5g n GLN 244 Cb 0.35 -1.62 0.00 0.00 2.41 0.00 0.00 30.24 31.38 1b5g n GLN 244 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1b5g n PHE 245 N -2.34 0.00 0.00 3.69 3.72 -0.45 -5.07 117.46 117.00 1b5g n PHE 245 Ca -0.02 -0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.19 1b5g n PHE 245 Cb 0.55 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 1b5g n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12