#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nm6 n GLY 2 N 0.95 0.34 3.24 0.00 0.00 -0.23 -4.66 105.19 104.83 1nm6 n GLY 2 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 1nm6 n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nm6 s LEU 3 N 0.00 3.83 0.00 0.99 1.43 -1.19 -1.13 118.68 122.61 1nm6 s LEU 3 Ca 0.00 -1.04 -0.29 0.00 -1.03 0.00 0.00 54.13 51.77 1nm6 s LEU 3 Cb 0.00 -1.77 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 1nm6 s LEU 3 CO 0.00 -0.23 0.93 -0.13 0.23 0.00 0.00 176.35 177.15 1nm6 s ARG 4 N 1.35 4.56 0.24 1.70 0.52 -1.26 -4.79 118.95 121.27 1nm6 s ARG 4 Ca -0.02 1.34 -0.05 0.00 -0.52 0.00 0.00 55.73 56.48 1nm6 s ARG 4 Cb -0.18 -3.45 0.44 0.00 0.52 0.00 0.00 34.95 32.28 1nm6 s ARG 4 CO -0.00 0.00 1.73 -1.35 0.02 0.00 0.00 175.30 175.70 1nm6 h PRO 5 N 6.63 0.42 -0.01 3.54 0.11 -1.87 -0.78 132.00 140.04 1nm6 h PRO 5 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1nm6 h PRO 5 Cb 1.22 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1nm6 h PRO 5 CO 0.75 0.28 -0.02 1.28 -0.21 0.00 0.00 178.00 180.07 1nm6 n LEU 6 N -5.01 0.81 0.00 2.35 4.77 -1.26 -3.92 117.00 114.74 1nm6 n LEU 6 Ca 0.14 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 1nm6 n LEU 6 Cb 0.40 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1nm6 n LEU 6 CO 0.18 0.14 0.00 0.49 -1.33 0.00 0.00 177.39 176.87 1nm6 n PHE 7 N -0.42 0.00 -0.33 -1.77 3.01 -0.75 -4.73 117.46 112.46 1nm6 n PHE 7 Ca 0.20 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.77 1nm6 n PHE 7 Cb 0.26 0.00 0.29 0.00 -0.01 0.00 0.00 39.48 40.01 1nm6 n PHE 7 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1nm6 h GLU 8 N 0.00 0.69 -0.25 -1.08 3.07 -1.54 0.06 114.58 115.52 1nm6 h GLU 8 Ca 0.00 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1nm6 h GLU 8 Cb 0.00 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.74 1nm6 h GLU 8 CO 0.00 0.46 0.14 0.87 -1.40 0.00 0.00 179.01 179.08 1nm6 h LYS 9 N 0.71 0.34 -0.20 2.33 6.56 -1.34 -2.55 116.57 122.42 1nm6 h LYS 9 Ca 0.54 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 60.10 1nm6 h LYS 9 Cb 0.82 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.40 1nm6 h LYS 9 CO -0.38 0.25 0.00 0.36 -2.06 0.00 0.00 179.45 177.62 1nm6 n LYS 10 N -4.47 2.58 -3.79 3.15 2.85 -0.65 -4.99 118.16 112.84 1nm6 n LYS 10 Ca 0.01 -2.63 -0.24 0.00 -1.05 0.00 0.00 58.31 54.40 1nm6 n LYS 10 Cb 0.09 -1.67 0.02 0.00 -0.65 0.00 0.00 35.03 32.83 1nm6 n LYS 10 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1nm6 n SER 11 N -0.58 -1.62 -4.37 -5.58 2.88 -0.19 -5.00 113.62 99.17 1nm6 n SER 11 Ca 0.18 -0.85 -0.31 0.00 -1.33 0.00 0.00 58.87 56.56 1nm6 n SER 11 Cb 0.76 -3.82 -0.15 0.00 -0.75 0.00 0.00 64.21 60.25 1nm6 n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1nm6 s LEU 12 N -6.84 2.29 0.04 2.46 1.43 -0.17 -5.00 118.68 112.89 1nm6 s LEU 12 Ca 0.12 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.82 1nm6 s LEU 12 Cb -0.06 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 1nm6 s LEU 12 CO 0.83 0.31 0.07 -1.61 0.23 0.00 0.00 176.35 176.18 1nm6 s GLU 13 N -0.81 2.93 0.71 1.70 2.02 -1.26 -3.75 118.70 120.23 1nm6 s GLU 13 Ca 0.11 -0.61 -0.08 0.00 0.02 0.00 0.00 54.97 54.40 1nm6 s GLU 13 Cb -0.10 -2.76 0.05 0.00 0.10 0.00 0.00 34.13 31.41 1nm6 s GLU 13 CO 0.00 0.60 1.04 0.16 0.02 0.00 0.00 175.26 177.09 1nm6 s ASP 14 N -2.07 5.00 0.55 -0.19 3.84 -1.26 -4.98 116.67 117.56 1nm6 s ASP 14 Ca 0.26 0.69 0.26 0.00 -0.00 0.00 0.00 52.55 53.76 1nm6 s ASP 14 Cb -0.12 -1.39 1.45 0.00 -1.38 0.00 0.00 42.92 41.48 1nm6 s ASP 14 CO 0.18 -1.52 2.00 0.11 -0.00 0.00 0.00 175.17 175.94 1nm6 h LYS 14 N -0.63 0.00 0.00 2.11 1.79 -2.02 -3.28 116.57 114.54 1nm6 h LYS 14 Ca -0.45 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 1nm6 h LYS 14 Cb 1.30 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.95 1nm6 h LYS 14 CO 0.62 0.00 0.00 0.25 -1.08 0.00 0.00 179.45 179.24 1nm6 n THR 14 N -4.18 0.30 0.27 -0.16 -2.24 -1.26 -4.75 114.28 102.26 1nm6 n THR 14 Ca 0.08 -0.50 0.13 0.00 -2.27 0.00 0.00 64.05 61.49 1nm6 n THR 14 Cb 0.56 1.02 0.77 0.00 -2.10 0.00 0.00 70.33 70.58 1nm6 n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1nm6 h GLU 14 N 0.00 0.00 -0.57 -0.78 4.11 -1.97 -1.73 114.58 113.65 1nm6 h GLU 14 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1nm6 h GLU 14 Cb 0.37 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1nm6 h GLU 14 CO 0.00 0.09 0.32 -0.09 0.07 0.00 0.00 179.01 179.40 1nm6 h ARG 14 N 0.00 0.77 -0.65 1.06 9.65 -1.85 -2.26 114.38 121.10 1nm6 h ARG 14 Ca -0.00 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 1nm6 h ARG 14 Cb 0.24 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 1nm6 h ARG 14 CO 0.01 0.56 0.00 -1.91 2.80 0.00 0.00 179.97 181.43 1nm6 n GLU 14 N -4.40 0.00 0.00 0.20 2.13 -0.65 -0.94 120.64 116.97 1nm6 n GLU 14 Ca 0.05 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.87 1nm6 n GLU 14 Cb 0.09 -1.14 0.00 0.00 0.27 0.00 0.00 31.44 30.66 1nm6 n GLU 14 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1nm6 n LEU 14 N 0.65 0.00 0.29 4.31 7.94 -0.85 -2.58 117.00 126.76 1nm6 n LEU 14 Ca 0.00 0.00 0.17 0.00 -1.11 0.00 0.00 56.01 55.07 1nm6 n LEU 14 Cb 0.00 0.00 0.88 0.00 0.53 0.00 0.00 43.42 44.83 1nm6 n LEU 14 CO 0.00 0.00 1.05 -0.33 -1.11 0.00 0.00 177.39 177.00 1nm6 h GLU 14 N 0.00 0.00 0.00 1.96 5.08 -1.33 -2.05 114.58 118.24 1nm6 h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nm6 h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1nm6 h GLU 14 CO 0.00 0.05 -0.24 -1.13 -1.00 0.00 0.00 179.01 176.70 1nm6 n SER 14 N -3.37 0.56 -3.89 1.42 3.41 -1.07 -4.32 113.62 106.38 1nm6 n SER 14 Ca -0.02 0.33 -0.43 0.00 -0.26 0.00 0.00 58.87 58.50 1nm6 n SER 14 Cb 0.19 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1nm6 n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1nm6 n TYR 14 N -1.95 2.95 0.07 7.33 4.01 -0.77 -4.16 117.16 124.63 1nm6 n TYR 14 Ca 0.05 -2.79 0.11 0.00 -0.16 0.00 0.00 57.90 55.11 1nm6 n TYR 14 Cb 0.40 -1.91 -0.05 0.00 -0.31 0.00 0.00 39.34 37.47 1nm6 n TYR 14 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1nm6 n ILE 14 N 3.24 0.49 0.00 -0.72 5.41 -1.26 -5.05 119.36 121.47 1nm6 n ILE 14 Ca 0.39 -0.55 0.00 0.00 1.00 0.00 0.00 62.75 63.59 1nm6 n ILE 14 Cb 0.36 -0.27 0.00 0.00 -0.71 0.00 0.00 39.64 39.02 1nm6 n ILE 14 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1nm6 n ILE 16 N -2.58 0.00 -3.68 1.39 5.41 -0.32 -5.11 119.36 114.47 1nm6 n ILE 16 Ca -0.02 0.00 -0.37 0.00 1.00 0.00 0.00 62.75 63.36 1nm6 n ILE 16 Cb 0.57 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 39.44 1nm6 n ILE 16 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1nm6 s VAL 17 N 0.00 5.32 -1.45 1.39 1.01 0.16 -4.20 120.40 122.63 1nm6 s VAL 17 Ca 0.00 0.46 -0.09 0.00 0.00 0.00 0.00 61.98 62.35 1nm6 s VAL 17 Cb 0.00 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.86 1nm6 s VAL 17 CO 0.00 0.53 0.93 -0.62 0.00 0.00 0.00 175.10 175.95 1nm6 n GLU 18 N 2.50 -6.32 0.00 2.72 -0.58 -1.26 -2.55 120.64 115.15 1nm6 n GLU 18 Ca -0.16 0.79 0.00 0.00 -0.42 0.00 0.00 57.16 57.37 1nm6 n GLU 18 Cb 0.53 -5.74 0.00 0.00 -0.57 0.00 0.00 31.44 25.67 1nm6 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nm6 n GLY 19 N -1.76 3.56 3.28 0.62 0.00 -1.26 -4.54 105.19 105.10 1nm6 n GLY 19 Ca -0.02 -1.99 -0.10 0.00 0.00 0.00 0.00 46.02 43.91 1nm6 n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nm6 s SER 20 N -0.37 0.13 0.25 1.61 1.04 -0.47 -4.92 113.70 110.98 1nm6 s SER 20 Ca 0.00 -1.02 -0.30 0.00 0.48 0.00 0.00 55.95 55.11 1nm6 s SER 20 Cb 0.00 0.39 -0.10 0.00 0.10 0.00 0.00 66.02 66.41 1nm6 s SER 20 CO 0.00 -0.85 1.39 -1.81 0.98 0.00 0.00 173.24 172.95 1nm6 s ASP 21 N -3.01 6.72 0.61 7.02 1.01 -1.26 -0.77 116.67 127.00 1nm6 s ASP 21 Ca 0.21 2.62 -0.15 0.00 0.71 0.00 0.00 52.55 55.94 1nm6 s ASP 21 Cb 0.05 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 1nm6 s ASP 21 CO 0.02 -0.63 1.05 0.00 0.21 0.00 0.00 175.17 175.82 1nm6 s ALA 22 N -0.20 2.75 0.56 5.23 0.00 -0.19 -4.80 121.76 125.11 1nm6 s ALA 22 Ca 0.57 0.31 -0.08 0.00 0.00 0.00 0.00 51.96 52.76 1nm6 s ALA 22 Cb -0.40 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 19.47 1nm6 s ALA 22 CO 0.44 -0.86 0.91 -1.21 0.00 0.00 0.00 175.76 175.04 1nm6 s GLU 23 N -4.30 3.49 0.17 0.00 2.02 -1.26 -4.93 118.70 113.90 1nm6 s GLU 23 Ca 0.62 0.43 -0.31 0.00 0.02 0.00 0.00 54.97 55.72 1nm6 s GLU 23 Cb -0.15 -2.23 -0.10 0.00 0.10 0.00 0.00 34.13 31.75 1nm6 s GLU 23 CO 0.41 -0.43 1.56 0.42 0.02 0.00 0.00 175.26 177.24 1nm6 s ILE 24 N -2.97 2.62 -0.11 -1.63 1.01 -1.26 -1.98 121.20 116.88 1nm6 s ILE 24 Ca 0.51 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.61 1nm6 s ILE 24 Cb -0.11 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.08 1nm6 s ILE 24 CO 0.49 0.04 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1nm6 n GLY 25 N 3.57 0.39 0.20 6.18 0.00 -1.26 -4.90 105.19 109.37 1nm6 n GLY 25 Ca 0.13 -0.08 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 1nm6 n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1nm6 h MET 26 N 0.54 0.25 -2.15 1.61 -1.53 -1.77 -3.35 114.93 108.51 1nm6 h MET 26 Ca -0.02 -0.12 -0.58 0.00 -3.44 0.00 0.00 59.70 55.55 1nm6 h MET 26 Cb 0.41 -0.00 -0.40 0.00 -0.55 0.00 0.00 31.60 31.06 1nm6 h MET 26 CO 0.03 0.62 -0.96 0.45 0.14 0.00 0.00 176.91 177.19 1nm6 n SER 27 N -4.03 0.90 0.14 1.39 2.88 -1.26 -4.97 113.62 108.67 1nm6 n SER 27 Ca -0.01 -2.81 0.10 0.00 -1.33 0.00 0.00 58.87 54.82 1nm6 n SER 27 Cb 0.48 -0.64 0.52 0.00 -0.75 0.00 0.00 64.21 63.82 1nm6 n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1nm6 n PRO 28 N 1.57 0.14 0.00 -1.46 -0.04 -1.26 -1.32 135.00 132.63 1nm6 n PRO 28 Ca 0.24 0.57 0.13 0.00 -0.04 0.00 0.00 63.50 64.41 1nm6 n PRO 28 Cb 0.49 -1.90 0.34 0.00 -0.04 0.00 0.00 33.50 32.40 1nm6 n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1nm6 n TRP 29 N -2.18 0.00 -1.93 0.54 2.14 -0.92 -1.51 117.44 113.59 1nm6 n TRP 29 Ca -0.00 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.15 1nm6 n TRP 29 Cb 0.08 -0.02 -0.03 0.00 -0.81 0.00 0.00 31.31 30.53 1nm6 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1nm6 s GLN 30 N -2.11 4.21 -0.01 -2.67 2.00 -0.43 -0.45 119.66 120.20 1nm6 s GLN 30 Ca 0.32 2.39 0.05 0.00 -2.00 0.00 0.00 55.36 56.11 1nm6 s GLN 30 Cb 0.20 -3.11 -0.01 0.00 0.80 0.00 0.00 33.01 30.89 1nm6 s GLN 30 CO 0.37 -0.55 -0.16 0.08 -0.50 0.00 0.00 175.29 174.53 1nm6 s VAL 31 N 0.54 1.25 -0.20 1.34 1.01 -0.23 -3.94 120.40 120.17 1nm6 s VAL 31 Ca 0.65 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.90 1nm6 s VAL 31 Cb -0.44 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 1nm6 s VAL 31 CO 0.38 0.35 0.02 -0.32 0.00 0.00 0.00 175.10 175.54 1nm6 s MET 32 N -0.37 3.70 -0.26 2.72 1.75 -0.37 -0.99 119.30 125.49 1nm6 s MET 32 Ca 0.06 -0.48 -0.21 0.00 -1.25 0.00 0.00 55.69 53.81 1nm6 s MET 32 Cb -0.06 -3.14 -0.02 0.00 2.84 0.00 0.00 34.83 34.45 1nm6 s MET 32 CO -0.01 0.04 0.66 -0.51 -0.65 0.00 0.00 175.02 174.56 1nm6 s LEU 33 N 0.95 4.07 -0.15 4.11 1.43 0.23 -1.12 118.68 128.21 1nm6 s LEU 33 Ca 0.02 0.72 0.00 0.00 -1.03 0.00 0.00 54.13 53.84 1nm6 s LEU 33 Cb -0.14 -2.90 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 1nm6 s LEU 33 CO 0.02 -0.41 -0.15 0.12 0.23 0.00 0.00 176.35 176.16 1nm6 s PHE 34 N 2.57 2.78 0.17 0.29 5.36 -0.16 -0.75 117.98 128.24 1nm6 s PHE 34 Ca 0.27 -0.93 -0.30 0.00 -0.96 0.00 0.00 56.93 55.02 1nm6 s PHE 34 Cb -0.15 -1.87 -0.07 0.00 -0.34 0.00 0.00 43.02 40.59 1nm6 s PHE 34 CO 0.09 -0.40 0.95 0.50 -1.46 0.00 0.00 175.22 174.90 1nm6 s ARG 35 N 0.67 4.77 -0.06 10.12 3.52 -0.40 -1.18 118.95 136.38 1nm6 s ARG 35 Ca -0.08 1.46 -0.25 0.00 -0.13 0.00 0.00 55.73 56.74 1nm6 s ARG 35 Cb -0.16 -3.33 -0.20 0.00 -1.56 0.00 0.00 34.95 29.70 1nm6 s ARG 35 CO 0.02 0.35 1.00 0.87 -0.81 0.00 0.00 175.30 176.73 1nm6 h LYS 36 N 4.95 -0.05 -3.12 5.12 1.57 -1.74 -2.99 116.57 120.31 1nm6 h LYS 36 Ca -0.44 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 57.94 1nm6 h LYS 36 Cb 1.21 0.01 -0.39 0.00 0.08 0.00 0.00 32.23 33.13 1nm6 h LYS 36 CO 0.70 0.56 -0.73 -1.54 -0.57 0.00 0.00 179.45 177.87 1nm6 s SER 36 N -5.78 1.70 0.50 0.86 1.04 -1.26 -2.44 113.70 108.32 1nm6 s SER 36 Ca -0.16 -0.25 -0.18 0.00 0.48 0.00 0.00 55.95 55.84 1nm6 s SER 36 Cb -0.00 -0.12 -0.08 0.00 0.10 0.00 0.00 66.02 65.92 1nm6 s SER 36 CO 0.62 -0.30 1.00 -2.16 0.98 0.00 0.00 173.24 173.37 1nm6 s PRO 37 N 2.18 3.88 -0.19 4.02 0.04 -1.26 -5.06 135.00 138.60 1nm6 s PRO 37 Ca 0.04 1.12 -0.29 0.00 0.04 0.00 0.00 61.00 61.91 1nm6 s PRO 37 Cb -0.14 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 1nm6 s PRO 37 CO -0.07 -0.33 1.92 -0.65 0.04 0.00 0.00 177.00 177.91 1nm6 s GLN 38 N -3.67 3.56 0.23 4.56 -0.21 -1.02 -4.66 119.66 118.44 1nm6 s GLN 38 Ca 0.62 1.92 -0.21 0.00 0.02 0.00 0.00 55.36 57.71 1nm6 s GLN 38 Cb -0.12 -4.20 0.04 0.00 1.00 0.00 0.00 33.01 29.73 1nm6 s GLN 38 CO 0.25 -1.60 0.65 -1.83 -2.12 0.00 0.00 175.29 170.64 1nm6 s GLU 39 N 5.37 1.55 0.03 2.91 -1.05 -1.13 -4.99 118.70 121.40 1nm6 s GLU 39 Ca 0.86 -0.79 -0.30 0.00 -0.15 0.00 0.00 54.97 54.58 1nm6 s GLU 39 Cb -0.30 0.59 -0.05 0.00 -0.44 0.00 0.00 34.13 33.92 1nm6 s GLU 39 CO 0.34 -0.70 1.24 -1.17 0.95 0.00 0.00 175.26 175.93 1nm6 s LEU 40 N -2.86 4.34 -0.21 1.83 2.96 -1.26 -1.27 118.68 122.21 1nm6 s LEU 40 Ca 0.07 2.01 -0.16 0.00 -0.22 0.00 0.00 54.13 55.83 1nm6 s LEU 40 Cb -0.04 -3.57 -0.08 0.00 0.50 0.00 0.00 46.19 43.00 1nm6 s LEU 40 CO -0.01 -0.55 -0.35 -0.11 -1.32 0.00 0.00 176.35 174.01 1nm6 n LEU 41 N 4.45 1.93 -3.84 -0.68 -0.00 0.07 -4.87 117.00 114.07 1nm6 n LEU 41 Ca 0.10 0.33 -0.07 0.00 -0.00 0.00 0.00 56.01 56.37 1nm6 n LEU 41 Cb 0.46 -0.76 0.02 0.00 -0.00 0.00 0.00 43.42 43.14 1nm6 n LEU 41 CO 0.56 0.01 0.64 0.00 -0.00 0.00 0.00 177.39 178.60 1nm6 s GLY 43 N -3.21 1.88 0.07 0.00 0.00 0.71 -0.60 107.32 106.18 1nm6 s GLY 43 Ca 0.18 -1.91 -0.23 0.00 0.00 0.00 0.00 44.72 42.76 1nm6 s GLY 43 CO 0.09 -1.65 1.08 0.00 0.00 0.00 0.00 173.10 172.62 1nm6 n ALA 44 N -2.03 -2.94 -2.96 3.20 0.00 -0.16 -3.67 120.51 111.95 1nm6 n ALA 44 Ca 0.11 -0.84 -0.10 0.00 0.00 0.00 0.00 53.44 52.61 1nm6 n ALA 44 Cb 0.61 0.33 -0.10 0.00 0.00 0.00 0.00 19.45 20.28 1nm6 n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nm6 s SER 45 N -3.46 0.17 -0.28 0.00 1.04 -0.03 -1.06 113.70 110.08 1nm6 s SER 45 Ca 0.25 -0.42 -0.17 0.00 0.48 0.00 0.00 55.95 56.09 1nm6 s SER 45 Cb -0.02 0.16 -0.03 0.00 0.10 0.00 0.00 66.02 66.23 1nm6 s SER 45 CO 0.02 -0.36 0.47 -0.22 0.98 0.00 0.00 173.24 174.12 1nm6 s LEU 46 N -1.58 4.10 0.00 2.42 2.96 0.41 -0.56 118.68 126.43 1nm6 s LEU 46 Ca -0.13 0.35 0.11 0.00 -0.22 0.00 0.00 54.13 54.24 1nm6 s LEU 46 Cb -0.07 -2.57 -0.02 0.00 0.50 0.00 0.00 46.19 44.03 1nm6 s LEU 46 CO -0.01 -0.29 0.65 2.30 -1.32 0.00 0.00 176.35 177.68 1nm6 n ILE 47 N 5.19 0.00 -3.89 6.68 -5.35 -0.79 -1.51 119.36 119.69 1nm6 n ILE 47 Ca -0.06 -0.36 -0.03 0.00 -0.27 0.00 0.00 62.75 62.03 1nm6 n ILE 47 Cb 0.50 1.11 0.02 0.00 -1.74 0.00 0.00 39.64 39.53 1nm6 n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1nm6 n SER 48 N -0.37 -1.67 0.00 7.28 3.41 -1.21 -4.75 113.62 116.31 1nm6 n SER 48 Ca 0.04 -1.86 0.09 0.00 -0.26 0.00 0.00 58.87 56.88 1nm6 n SER 48 Cb 0.23 2.71 0.38 0.00 -0.26 0.00 0.00 64.21 67.26 1nm6 n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1nm6 n ASP 49 N -1.27 0.00 0.00 4.04 5.68 -1.26 -3.63 116.55 120.11 1nm6 n ASP 49 Ca -0.02 0.50 0.00 0.00 -0.50 0.00 0.00 54.79 54.77 1nm6 n ASP 49 Cb 0.57 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1nm6 n ASP 49 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1nm6 n ARG 50 N -1.50 -0.02 -5.28 0.11 1.74 -1.26 -1.05 116.66 109.40 1nm6 n ARG 50 Ca 0.04 -0.17 -0.31 0.00 -0.77 0.00 0.00 57.85 56.64 1nm6 n ARG 50 Cb 0.21 -0.63 -0.16 0.00 -1.02 0.00 0.00 32.46 30.85 1nm6 n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1nm6 s TRP 51 N -0.05 2.41 -0.06 -1.55 0.52 -1.24 -0.62 118.94 118.36 1nm6 s TRP 51 Ca 0.00 -0.65 0.04 0.00 0.02 0.00 0.00 56.10 55.50 1nm6 s TRP 51 Cb 0.00 -1.57 0.00 0.00 -1.15 0.00 0.00 33.47 30.75 1nm6 s TRP 51 CO 0.00 -0.17 -0.17 0.08 0.02 0.00 0.00 176.95 176.71 1nm6 s VAL 52 N -0.28 1.48 -0.07 4.03 1.01 -0.37 -1.88 120.40 124.32 1nm6 s VAL 52 Ca -0.00 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 1nm6 s VAL 52 Cb -0.13 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 1nm6 s VAL 52 CO 0.03 0.43 0.10 -0.22 0.00 0.00 0.00 175.10 175.43 1nm6 s LEU 53 N 0.29 4.09 0.00 3.92 2.96 0.28 -0.93 118.68 129.29 1nm6 s LEU 53 Ca -0.10 0.31 -0.03 0.00 -0.22 0.00 0.00 54.13 54.08 1nm6 s LEU 53 Cb -0.14 -2.12 0.01 0.00 0.50 0.00 0.00 46.19 44.44 1nm6 s LEU 53 CO 0.04 0.36 0.23 1.07 -1.32 0.00 0.00 176.35 176.73 1nm6 n THR 54 N 1.73 0.00 -3.35 3.68 5.66 -0.49 -0.85 114.28 120.66 1nm6 n THR 54 Ca -0.17 -0.45 -0.38 0.00 -3.05 0.00 0.00 64.05 60.00 1nm6 n THR 54 Cb 0.54 0.36 -0.06 0.00 -1.55 0.00 0.00 70.33 69.62 1nm6 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nm6 s ALA 55 N -1.61 3.57 0.30 1.79 0.00 -1.26 -1.33 121.76 123.22 1nm6 s ALA 55 Ca 0.07 -0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.93 1nm6 s ALA 55 Cb -0.01 -2.57 0.56 0.00 0.00 0.00 0.00 23.12 21.10 1nm6 s ALA 55 CO 0.05 0.27 1.88 0.00 0.00 0.00 0.00 175.76 177.96 1nm6 h ALA 56 N 5.44 1.54 0.00 0.00 0.00 -1.69 -1.73 119.26 122.82 1nm6 h ALA 56 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1nm6 h ALA 56 Cb 1.20 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1nm6 h ALA 56 CO 0.67 0.27 0.00 1.12 0.00 0.00 0.00 179.25 181.31 1nm6 h HIS 57 N 1.00 0.00 0.00 0.00 2.07 -1.89 0.86 115.15 117.18 1nm6 h HIS 57 Ca 0.44 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.88 1nm6 h HIS 57 Cb 0.36 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.33 1nm6 h HIS 57 CO -0.00 0.00 -0.39 0.00 -3.07 0.00 0.00 177.93 174.47 1nm6 n LEU 59 N -3.69 0.93 -3.74 0.00 4.77 -0.29 -4.89 117.00 110.08 1nm6 n LEU 59 Ca -0.01 -0.03 -0.25 0.00 -0.03 0.00 0.00 56.01 55.69 1nm6 n LEU 59 Cb 0.48 0.04 -0.17 0.00 -2.33 0.00 0.00 43.42 41.44 1nm6 n LEU 59 CO 0.37 0.45 -0.37 -0.22 -1.33 0.00 0.00 177.39 176.29 1nm6 s LEU 60 N -5.23 0.86 0.20 2.23 2.96 0.14 -1.27 118.68 118.57 1nm6 s LEU 60 Ca -0.11 -0.49 -0.19 0.00 -0.22 0.00 0.00 54.13 53.12 1nm6 s LEU 60 Cb 0.04 -0.50 0.04 0.00 0.50 0.00 0.00 46.19 46.27 1nm6 s LEU 60 CO 0.47 -0.26 0.57 -0.47 -1.32 0.00 0.00 176.35 175.33 1nm6 s TYR 60 N 1.93 -0.22 0.00 5.38 5.04 0.40 -4.05 117.35 125.82 1nm6 s TYR 60 Ca 0.02 -0.11 0.00 0.00 -2.44 0.00 0.00 57.07 54.54 1nm6 s TYR 60 Cb -0.15 0.47 0.00 0.00 0.35 0.00 0.00 41.96 42.63 1nm6 s TYR 60 CO -0.07 -0.95 0.00 -2.30 -1.34 0.00 0.00 175.55 170.89 1nm6 n PRO 60 N -0.36 0.00 -0.57 4.97 -0.02 -1.26 -2.41 135.00 135.34 1nm6 n PRO 60 Ca -0.11 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.41 1nm6 n PRO 60 Cb 0.62 0.00 0.23 0.00 -0.02 0.00 0.00 33.50 34.34 1nm6 n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1nm6 n TRP 60 N 0.00 1.00 -3.97 6.00 8.01 -1.26 -4.97 117.44 122.24 1nm6 n TRP 60 Ca 0.00 -1.16 -0.28 0.00 -1.31 0.00 0.00 57.50 54.75 1nm6 n TRP 60 Cb 0.00 -0.38 -0.01 0.00 -2.01 0.00 0.00 31.31 28.91 1nm6 n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1nm6 n ASP 60 N -0.79 -1.85 -4.42 -0.99 9.92 -1.16 -4.97 116.55 112.28 1nm6 n ASP 60 Ca 0.26 -0.94 -0.35 0.00 -0.53 0.00 0.00 54.79 53.22 1nm6 n ASP 60 Cb 0.95 -3.26 -0.13 0.00 -0.64 0.00 0.00 41.12 38.04 1nm6 n ASP 60 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1nm6 s LYS 60 N -6.57 3.58 -0.48 -1.24 1.02 -1.01 -4.98 119.74 110.06 1nm6 s LYS 60 Ca 0.28 -0.53 0.06 0.00 0.02 0.00 0.00 55.97 55.81 1nm6 s LYS 60 Cb -0.15 -3.14 0.25 0.00 -0.52 0.00 0.00 37.83 34.27 1nm6 s LYS 60 CO 0.88 -0.09 0.88 -1.71 -0.92 0.00 0.00 175.35 174.39 1nm6 n ASN 60 N 4.56 -2.58 -4.79 2.83 4.05 -1.22 -0.46 115.26 117.65 1nm6 n ASN 60 Ca -0.17 -3.30 -0.35 0.00 0.45 0.00 0.00 54.58 51.21 1nm6 n ASN 60 Cb 0.51 1.63 -0.04 0.00 1.23 0.00 0.00 39.78 43.12 1nm6 n ASN 60 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 1nm6 s PHE 60 N 0.48 3.06 0.43 1.20 0.08 -0.40 -5.02 117.98 117.81 1nm6 s PHE 60 Ca 0.31 1.59 0.06 0.00 0.12 0.00 0.00 56.93 59.02 1nm6 s PHE 60 Cb 0.23 -3.09 -0.06 0.00 -0.57 0.00 0.00 43.02 39.53 1nm6 s PHE 60 CO -0.22 -0.80 0.04 0.95 -0.10 0.00 0.00 175.22 175.09 1nm6 s THR 60 N -1.88 1.91 0.20 0.64 -4.23 -1.26 -4.88 115.64 106.14 1nm6 s THR 60 Ca 0.65 -1.94 -0.21 0.00 -1.18 0.00 0.00 61.69 59.00 1nm6 s THR 60 Cb -0.18 -2.86 0.15 0.00 1.34 0.00 0.00 72.50 70.95 1nm6 s THR 60 CO 0.22 0.00 1.56 -0.33 -0.54 0.00 0.00 174.62 175.53 1nm6 h GLU 61 N 1.64 -0.07 0.00 3.99 3.07 -1.93 -1.66 114.58 119.62 1nm6 h GLU 61 Ca -0.44 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.43 1nm6 h GLU 61 Cb 1.25 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.18 1nm6 h GLU 61 CO 0.78 -0.05 0.00 0.09 -1.40 0.00 0.00 179.01 178.43 1nm6 n ASN 62 N -5.43 0.00 0.12 1.42 4.13 -1.26 -2.80 115.26 111.44 1nm6 n ASN 62 Ca 0.07 -0.07 0.12 0.00 1.68 0.00 0.00 54.58 56.38 1nm6 n ASN 62 Cb 0.37 -0.22 0.19 0.00 -1.54 0.00 0.00 39.78 38.57 1nm6 n ASN 62 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 1nm6 h ASP 63 N 0.00 0.00 -3.12 6.41 3.32 -1.70 -3.48 116.42 117.85 1nm6 h ASP 63 Ca 0.00 -0.07 -0.48 0.00 0.02 0.00 0.00 57.03 56.50 1nm6 h ASP 63 Cb 0.12 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.53 1nm6 h ASP 63 CO 0.00 0.03 -0.64 -0.76 -1.72 0.00 0.00 179.24 176.16 1nm6 s LEU 64 N -4.99 2.33 0.04 1.55 1.43 -1.12 -2.05 118.68 115.86 1nm6 s LEU 64 Ca 0.06 -1.29 0.00 0.00 -1.03 0.00 0.00 54.13 51.87 1nm6 s LEU 64 Cb 0.10 -0.49 -0.03 0.00 0.03 0.00 0.00 46.19 45.81 1nm6 s LEU 64 CO 0.69 -0.49 -0.04 -0.76 0.23 0.00 0.00 176.35 175.98 1nm6 s LEU 65 N -3.46 2.31 -0.14 1.79 1.43 -0.33 -4.41 118.68 115.86 1nm6 s LEU 65 Ca 0.33 -0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 52.78 1nm6 s LEU 65 Cb 0.07 0.05 -0.01 0.00 0.03 0.00 0.00 46.19 46.33 1nm6 s LEU 65 CO 0.14 -0.35 -0.12 0.68 0.23 0.00 0.00 176.35 176.93 1nm6 s VAL 66 N -2.05 3.12 -0.26 -1.59 -7.23 -0.40 -0.99 120.40 111.00 1nm6 s VAL 66 Ca -0.09 -0.63 -0.04 0.00 -1.81 0.00 0.00 61.98 59.41 1nm6 s VAL 66 Cb -0.06 -2.33 0.01 0.00 0.56 0.00 0.00 36.38 34.57 1nm6 s VAL 66 CO -0.03 0.51 0.01 -0.13 -0.31 0.00 0.00 175.10 175.15 1nm6 s ARG 67 N 0.48 3.06 0.04 4.82 0.52 -0.27 -0.83 118.95 126.78 1nm6 s ARG 67 Ca -0.08 -0.85 0.04 0.00 -0.52 0.00 0.00 55.73 54.32 1nm6 s ARG 67 Cb -0.16 -3.17 -0.04 0.00 0.52 0.00 0.00 34.95 32.11 1nm6 s ARG 67 CO 0.04 -0.38 -0.06 0.42 0.02 0.00 0.00 175.30 175.35 1nm6 s ILE 68 N 1.44 3.68 0.00 1.52 1.01 -0.10 -1.24 121.20 127.51 1nm6 s ILE 68 Ca 0.02 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.76 1nm6 s ILE 68 Cb -0.16 -2.66 0.00 0.00 0.01 0.00 0.00 42.46 39.65 1nm6 s ILE 68 CO -0.01 0.28 0.00 0.61 0.00 0.00 0.00 174.94 175.82 1nm6 n GLY 69 N 1.18 0.50 3.89 6.18 0.00 -1.25 -0.76 105.19 114.93 1nm6 n GLY 69 Ca -0.14 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 1nm6 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nm6 s LYS 70 N -1.32 3.59 0.20 1.61 1.02 -1.26 -4.23 119.74 119.35 1nm6 s LYS 70 Ca 0.00 0.39 0.00 0.00 0.02 0.00 0.00 55.97 56.38 1nm6 s LYS 70 Cb 0.00 -2.29 0.00 0.00 -0.52 0.00 0.00 37.83 35.02 1nm6 s LYS 70 CO 0.00 -0.29 0.00 1.58 -0.92 0.00 0.00 175.35 175.72 1nm6 n HIS 71 N -2.27 -1.44 -2.15 3.18 -0.00 -1.26 -4.94 115.22 106.34 1nm6 n HIS 71 Ca 0.02 0.25 -0.40 0.00 -0.00 0.00 0.00 57.72 57.60 1nm6 n HIS 71 Cb 0.55 0.35 -0.02 0.00 -0.00 0.00 0.00 29.99 30.88 1nm6 n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1nm6 s SER 72 N -5.30 6.58 -0.06 0.26 0.15 -1.26 -0.70 113.70 113.37 1nm6 s SER 72 Ca 0.00 2.59 -0.21 0.00 0.70 0.00 0.00 55.95 59.02 1nm6 s SER 72 Cb 0.00 -2.64 -0.16 0.00 -1.71 0.00 0.00 66.02 61.51 1nm6 s SER 72 CO 0.00 -0.66 0.87 -0.09 1.20 0.00 0.00 173.24 174.56 1nm6 h ARG 73 N 3.00 -0.18 0.00 5.44 2.43 -1.53 -3.40 114.38 120.14 1nm6 h ARG 73 Ca -0.49 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 58.57 1nm6 h ARG 73 Cb 1.23 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.80 1nm6 h ARG 73 CO 0.64 0.28 -1.51 0.25 -1.51 0.00 0.00 179.97 178.12 1nm6 n THR 74 N -4.90 0.87 -2.82 0.20 -2.24 -1.26 -4.99 114.28 99.14 1nm6 n THR 74 Ca -0.08 -0.64 -0.30 0.00 -2.27 0.00 0.00 64.05 60.76 1nm6 n THR 74 Cb 0.27 -0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 67.98 1nm6 n THR 74 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1nm6 s ARG 75 N -3.09 3.78 -0.54 -0.78 1.81 -1.26 -5.01 118.95 113.86 1nm6 s ARG 75 Ca -0.04 0.48 -0.25 0.00 -1.72 0.00 0.00 55.73 54.21 1nm6 s ARG 75 Cb 0.09 -2.38 0.04 0.00 -0.45 0.00 0.00 34.95 32.26 1nm6 s ARG 75 CO 0.82 -0.06 0.96 -0.47 -0.68 0.00 0.00 175.30 175.88 1nm6 s TYR 76 N -2.40 2.80 -1.30 -0.53 5.04 -1.26 -4.88 117.35 114.81 1nm6 s TYR 76 Ca 0.51 0.08 -0.16 0.00 -2.44 0.00 0.00 57.07 55.06 1nm6 s TYR 76 Cb -0.10 -4.09 0.09 0.00 0.35 0.00 0.00 41.96 38.20 1nm6 s TYR 76 CO 0.32 -1.33 1.76 0.39 -1.34 0.00 0.00 175.55 175.34 1nm6 n GLU 77 N 7.50 3.20 -1.62 4.97 1.02 -1.26 -4.96 120.64 129.48 1nm6 n GLU 77 Ca 0.03 -3.31 -0.47 0.00 -0.02 0.00 0.00 57.16 53.39 1nm6 n GLU 77 Cb 0.48 -3.35 -0.04 0.00 -0.02 0.00 0.00 31.44 28.51 1nm6 n GLU 77 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1nm6 n ARG 77 N 7.27 1.60 -0.91 3.49 0.63 -1.26 -1.52 116.66 125.96 1nm6 n ARG 77 Ca 0.47 0.57 0.00 0.00 -0.92 0.00 0.00 57.85 57.97 1nm6 n ARG 77 Cb 0.44 -2.18 0.00 0.00 0.45 0.00 0.00 32.46 31.17 1nm6 n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1nm6 n ASN 78 N 2.27 -1.58 0.08 6.15 5.03 -1.26 -4.76 115.26 121.18 1nm6 n ASN 78 Ca 0.14 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.59 1nm6 n ASN 78 Cb 0.27 -1.05 0.00 0.00 -1.02 0.00 0.00 39.78 37.98 1nm6 n ASN 78 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1nm6 n ILE 79 N -2.27 0.86 -2.27 2.41 5.41 -0.59 -5.08 119.36 117.82 1nm6 n ILE 79 Ca 0.00 0.28 -0.32 0.00 1.00 0.00 0.00 62.75 63.72 1nm6 n ILE 79 Cb 0.06 -1.26 -0.02 0.00 -0.71 0.00 0.00 39.64 37.71 1nm6 n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1nm6 s GLU 80 N -1.97 3.85 -0.04 0.38 -1.05 -0.58 -4.79 118.70 114.51 1nm6 s GLU 80 Ca 0.00 0.88 0.04 0.00 -0.15 0.00 0.00 54.97 55.74 1nm6 s GLU 80 Cb 0.00 -2.13 -0.00 0.00 -0.44 0.00 0.00 34.13 31.56 1nm6 s GLU 80 CO 0.00 -0.35 -0.15 0.15 0.95 0.00 0.00 175.26 175.87 1nm6 s LYS 81 N -4.37 1.55 -0.18 -4.83 -0.14 0.06 -4.89 119.74 106.93 1nm6 s LYS 81 Ca 0.58 -0.52 -0.05 0.00 -1.36 0.00 0.00 55.97 54.62 1nm6 s LYS 81 Cb -0.10 -1.36 -0.03 0.00 -1.68 0.00 0.00 37.83 34.66 1nm6 s LYS 81 CO 0.38 0.20 0.00 0.42 -0.76 0.00 0.00 175.35 175.59 1nm6 s ILE 82 N 0.10 4.15 0.10 2.17 1.01 -1.26 -0.93 121.20 126.54 1nm6 s ILE 82 Ca -0.04 -0.26 0.10 0.00 0.00 0.00 0.00 60.65 60.45 1nm6 s ILE 82 Cb -0.11 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.47 1nm6 s ILE 82 CO 0.02 0.46 -0.26 -0.44 0.00 0.00 0.00 174.94 174.72 1nm6 s SER 83 N 0.61 3.11 0.22 3.58 0.01 -0.01 -4.97 113.70 116.24 1nm6 s SER 83 Ca -0.00 -0.68 -0.03 0.00 1.31 0.00 0.00 55.95 56.54 1nm6 s SER 83 Cb -0.14 -0.23 -0.05 0.00 0.21 0.00 0.00 66.02 65.82 1nm6 s SER 83 CO 0.02 0.18 0.45 -0.04 0.41 0.00 0.00 173.24 174.26 1nm6 s MET 84 N -1.75 3.59 -0.05 12.44 -1.94 -1.26 -1.27 119.30 129.06 1nm6 s MET 84 Ca 0.12 -0.15 -0.18 0.00 -1.71 0.00 0.00 55.69 53.77 1nm6 s MET 84 Cb -0.10 -2.77 -0.05 0.00 2.01 0.00 0.00 34.83 33.92 1nm6 s MET 84 CO 0.04 0.35 0.51 -0.51 -0.01 0.00 0.00 175.02 175.40 1nm6 s LEU 85 N -3.22 4.37 -0.19 -0.03 1.43 -1.26 -1.94 118.68 117.83 1nm6 s LEU 85 Ca 0.41 0.98 -0.22 0.00 -1.03 0.00 0.00 54.13 54.27 1nm6 s LEU 85 Cb -0.11 -2.76 -0.21 0.00 0.03 0.00 0.00 46.19 43.14 1nm6 s LEU 85 CO 0.28 0.10 0.30 -0.08 0.23 0.00 0.00 176.35 177.19 1nm6 h GLU 86 N 5.91 0.02 -2.67 1.70 4.81 -1.08 -3.44 114.58 119.82 1nm6 h GLU 86 Ca -0.45 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 58.65 1nm6 h GLU 86 Cb 1.20 0.01 -0.20 0.00 0.63 0.00 0.00 28.75 30.38 1nm6 h GLU 86 CO 0.70 1.02 -0.13 0.15 -0.73 0.00 0.00 179.01 180.02 1nm6 s LYS 87 N -2.36 0.75 -0.06 1.92 -0.14 -1.18 -4.96 119.74 113.72 1nm6 s LYS 87 Ca -0.27 0.11 0.02 0.00 -1.36 0.00 0.00 55.97 54.46 1nm6 s LYS 87 Cb 0.05 0.34 -0.03 0.00 -1.68 0.00 0.00 37.83 36.51 1nm6 s LYS 87 CO 0.62 -0.20 -0.09 0.42 -0.76 0.00 0.00 175.35 175.34 1nm6 s ILE 88 N -0.96 3.54 -0.17 2.17 1.01 -1.26 -0.91 121.20 124.63 1nm6 s ILE 88 Ca -0.10 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 59.98 1nm6 s ILE 88 Cb -0.03 -2.44 0.05 0.00 0.01 0.00 0.00 42.46 40.04 1nm6 s ILE 88 CO 0.05 0.59 -0.02 -0.31 0.00 0.00 0.00 174.94 175.25 1nm6 s TYR 89 N -0.80 1.43 -0.11 3.97 1.51 0.64 -5.00 117.35 118.99 1nm6 s TYR 89 Ca 0.12 -0.96 -0.05 0.00 -1.01 0.00 0.00 57.07 55.17 1nm6 s TYR 89 Cb -0.11 -1.19 -0.04 0.00 -0.11 0.00 0.00 41.96 40.51 1nm6 s TYR 89 CO 0.01 -0.59 0.09 0.42 -1.11 0.00 0.00 175.55 174.37 1nm6 s ILE 90 N 1.72 5.04 0.14 2.71 1.01 -1.26 -0.49 121.20 130.06 1nm6 s ILE 90 Ca 0.00 0.03 -0.35 0.00 0.00 0.00 0.00 60.65 60.34 1nm6 s ILE 90 Cb -0.16 -3.18 -0.15 0.00 0.01 0.00 0.00 42.46 38.99 1nm6 s ILE 90 CO -0.07 0.61 1.49 1.57 0.00 0.00 0.00 174.94 178.53 1nm6 n HIS 91 N 2.13 2.00 0.27 3.97 -0.00 -1.06 -4.83 115.22 117.69 1nm6 n HIS 91 Ca -0.19 0.40 0.13 0.00 -0.00 0.00 0.00 57.72 58.06 1nm6 n HIS 91 Cb 0.54 -2.47 0.81 0.00 -0.00 0.00 0.00 29.99 28.87 1nm6 n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1nm6 h PRO 92 N 5.41 0.00 -0.45 1.57 0.13 -1.95 -2.14 132.00 134.58 1nm6 h PRO 92 Ca -0.46 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 1nm6 h PRO 92 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1nm6 h PRO 92 CO 0.85 0.00 0.02 0.54 -0.23 0.00 0.00 178.00 179.18 1nm6 n ARG 93 N -4.10 3.88 -1.78 0.86 1.74 -1.26 -4.97 116.66 111.03 1nm6 n ARG 93 Ca -0.02 -3.03 -0.42 0.00 -0.77 0.00 0.00 57.85 53.61 1nm6 n ARG 93 Cb 0.12 -2.07 -0.03 0.00 -1.02 0.00 0.00 32.46 29.46 1nm6 n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1nm6 s TYR 94 N -2.83 1.88 -1.04 -1.55 5.04 -0.81 -4.73 117.35 113.32 1nm6 s TYR 94 Ca 0.49 -0.08 -0.13 0.00 -2.44 0.00 0.00 57.07 54.92 1nm6 s TYR 94 Cb 0.39 -4.13 0.22 0.00 0.35 0.00 0.00 41.96 38.79 1nm6 s TYR 94 CO 0.12 -4.78 1.09 1.21 -1.34 0.00 0.00 175.55 171.85 1nm6 s ASN 95 N 3.32 7.04 0.44 4.32 3.84 0.15 -4.83 114.94 129.24 1nm6 s ASN 95 Ca 0.81 -3.05 0.24 0.00 0.21 0.00 0.00 52.86 51.07 1nm6 s ASN 95 Cb -0.42 -2.27 0.43 0.00 -0.55 0.00 0.00 41.25 38.44 1nm6 s ASN 95 CO 0.36 -0.55 1.64 4.11 -2.79 0.00 0.00 177.10 179.88 1nm6 h TRP 96 N 7.32 0.00 -0.24 0.43 5.08 -1.91 0.15 115.95 126.78 1nm6 h TRP 96 Ca 0.19 0.00 -0.13 0.00 1.08 0.00 0.00 58.89 60.02 1nm6 h TRP 96 Cb 0.94 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.09 1nm6 h TRP 96 CO 0.95 0.00 -0.41 0.00 -1.28 0.00 0.00 178.44 177.70 1nm6 h ARG 97 N 0.00 0.57 0.00 0.12 3.08 -2.00 -3.44 114.38 112.72 1nm6 h ARG 97 Ca 0.00 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1nm6 h ARG 97 Cb 0.95 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.01 1nm6 h ARG 97 CO 0.00 0.88 0.00 -1.91 -1.07 0.00 0.00 179.97 177.87 1nm6 n GLU 97 N -4.03 0.00 -0.37 0.04 2.13 -1.25 -4.99 120.64 112.17 1nm6 n GLU 97 Ca -0.02 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.86 1nm6 n GLU 97 Cb 0.52 -0.11 0.09 0.00 0.27 0.00 0.00 31.44 32.21 1nm6 n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1nm6 n ASN 98 N -1.89 1.35 -2.60 4.31 0.23 -1.25 -5.00 115.26 110.41 1nm6 n ASN 98 Ca 0.00 -2.69 -0.21 0.00 -0.53 0.00 0.00 54.58 51.15 1nm6 n ASN 98 Cb 0.00 -0.35 0.00 0.00 -2.08 0.00 0.00 39.78 37.36 1nm6 n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1nm6 n LEU 99 N -0.76 -2.10 -4.76 -4.53 4.77 0.04 -4.93 117.00 104.73 1nm6 n LEU 99 Ca 0.10 -0.09 -0.41 0.00 -0.03 0.00 0.00 56.01 55.58 1nm6 n LEU 99 Cb 0.70 -2.89 -0.02 0.00 -2.33 0.00 0.00 43.42 38.89 1nm6 n LEU 99 CO -0.00 -0.08 1.13 -0.62 -1.33 0.00 0.00 177.39 176.49 1nm6 s ASP 100 N -2.25 6.53 -1.07 -1.43 2.15 -1.22 -2.65 116.67 116.74 1nm6 s ASP 100 Ca 0.10 2.83 -0.01 0.00 0.43 0.00 0.00 52.55 55.90 1nm6 s ASP 100 Cb -0.04 -2.64 -0.01 0.00 -0.30 0.00 0.00 42.92 39.93 1nm6 s ASP 100 CO 0.12 -0.77 0.89 0.54 -0.17 0.00 0.00 175.17 175.78 1nm6 n ARG 101 N 1.65 -5.58 -2.60 4.34 1.74 -1.26 -0.67 116.66 114.29 1nm6 n ARG 101 Ca 0.05 0.77 -0.43 0.00 -0.77 0.00 0.00 57.85 57.47 1nm6 n ARG 101 Cb 0.39 -5.52 0.00 0.00 -1.02 0.00 0.00 32.46 26.31 1nm6 n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1nm6 n ASP 102 N -2.93 4.95 -3.77 0.55 2.03 -1.09 -4.35 116.55 111.94 1nm6 n ASP 102 Ca -0.24 -2.92 -0.13 0.00 0.52 0.00 0.00 54.79 52.01 1nm6 n ASP 102 Cb 0.65 -1.73 -0.10 0.00 -0.72 0.00 0.00 41.12 39.22 1nm6 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1nm6 s ILE 103 N 3.99 0.03 -0.02 5.18 2.07 -1.26 -3.76 121.20 127.43 1nm6 s ILE 103 Ca 0.53 -0.28 -0.20 0.00 -1.41 0.00 0.00 60.65 59.29 1nm6 s ILE 103 Cb 0.04 -0.53 0.04 0.00 0.13 0.00 0.00 42.46 42.13 1nm6 s ILE 103 CO 0.07 -0.15 0.42 0.00 -1.91 0.00 0.00 174.94 173.37 1nm6 s ALA 104 N -0.67 -1.08 0.09 1.50 0.00 -0.45 -2.57 121.76 118.58 1nm6 s ALA 104 Ca -0.08 0.61 0.09 0.00 0.00 0.00 0.00 51.96 52.58 1nm6 s ALA 104 Cb -0.04 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 1nm6 s ALA 104 CO 0.02 -0.30 -0.22 -0.51 0.00 0.00 0.00 175.76 174.75 1nm6 s LEU 105 N -1.33 2.47 -0.07 0.00 1.43 0.35 -1.40 118.68 120.13 1nm6 s LEU 105 Ca -0.12 -0.59 -0.00 0.00 -1.03 0.00 0.00 54.13 52.39 1nm6 s LEU 105 Cb -0.03 -1.40 0.02 0.00 0.03 0.00 0.00 46.19 44.81 1nm6 s LEU 105 CO 0.06 0.21 -0.05 -0.04 0.23 0.00 0.00 176.35 176.76 1nm6 s MET 106 N -1.80 1.04 -0.09 1.70 -1.94 -0.10 -0.26 119.30 117.84 1nm6 s MET 106 Ca 0.15 -0.11 -0.15 0.00 -1.71 0.00 0.00 55.69 53.87 1nm6 s MET 106 Cb -0.10 -1.15 -0.05 0.00 2.01 0.00 0.00 34.83 35.54 1nm6 s MET 106 CO 0.06 -0.20 0.37 0.21 -0.01 0.00 0.00 175.02 175.45 1nm6 s LYS 107 N 1.46 4.10 0.41 2.03 2.20 -0.08 -1.23 119.74 128.62 1nm6 s LYS 107 Ca -0.02 0.28 -0.14 0.00 -0.36 0.00 0.00 55.97 55.73 1nm6 s LYS 107 Cb -0.13 -3.34 -0.08 0.00 -1.51 0.00 0.00 37.83 32.77 1nm6 s LYS 107 CO -0.04 0.42 0.82 -0.51 -0.36 0.00 0.00 175.35 175.69 1nm6 s LEU 108 N -0.16 3.86 0.20 5.43 1.43 0.21 -0.57 118.68 129.08 1nm6 s LEU 108 Ca 0.21 1.32 -0.07 0.00 -1.03 0.00 0.00 54.13 54.55 1nm6 s LEU 108 Cb -0.15 -4.18 0.14 0.00 0.03 0.00 0.00 46.19 42.02 1nm6 s LEU 108 CO 0.09 -0.38 1.68 0.11 0.23 0.00 0.00 176.35 178.07 1nm6 h LYS 109 N 1.51 1.03 -4.77 1.70 1.57 -1.69 -3.42 116.57 112.51 1nm6 h LYS 109 Ca -0.47 -0.30 -0.31 0.00 -1.87 0.00 0.00 60.65 57.69 1nm6 h LYS 109 Cb 1.18 -0.11 -0.22 0.00 0.08 0.00 0.00 32.23 33.17 1nm6 h LYS 109 CO 0.63 0.99 -0.75 0.15 -0.57 0.00 0.00 179.45 179.91 1nm6 s LYS 110 N -5.06 0.61 0.50 3.15 1.02 -1.26 -5.01 119.74 113.68 1nm6 s LYS 110 Ca -0.11 -0.79 -0.23 0.00 0.02 0.00 0.00 55.97 54.86 1nm6 s LYS 110 Cb 0.14 -0.44 -0.06 0.00 -0.52 0.00 0.00 37.83 36.95 1nm6 s LYS 110 CO 0.85 0.09 1.33 -2.14 -0.92 0.00 0.00 175.35 174.56 1nm6 s PRO 111 N -1.57 3.43 -0.04 -1.68 0.02 -1.26 -4.86 135.00 129.04 1nm6 s PRO 111 Ca -0.07 2.19 -0.11 0.00 0.02 0.00 0.00 61.00 63.03 1nm6 s PRO 111 Cb -0.10 -2.41 -0.05 0.00 0.02 0.00 0.00 34.50 31.96 1nm6 s PRO 111 CO 0.01 -0.94 0.29 0.14 -0.33 0.00 0.00 177.00 176.17 1nm6 s VAL 112 N -1.32 5.25 -0.00 3.83 -7.23 -0.21 -5.02 120.40 115.70 1nm6 s VAL 112 Ca 0.67 0.50 -0.30 0.00 -1.81 0.00 0.00 61.98 61.04 1nm6 s VAL 112 Cb -0.39 -3.57 -0.03 0.00 0.56 0.00 0.00 36.38 32.95 1nm6 s VAL 112 CO 0.47 0.56 1.05 0.00 -0.31 0.00 0.00 175.10 176.87 1nm6 s ALA 113 N -1.10 3.27 0.65 1.32 0.00 -1.26 -4.82 121.76 119.82 1nm6 s ALA 113 Ca 0.21 0.59 -0.14 0.00 0.00 0.00 0.00 51.96 52.63 1nm6 s ALA 113 Cb -0.14 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.58 1nm6 s ALA 113 CO 0.10 -0.37 1.08 -0.06 0.00 0.00 0.00 175.76 176.51 1nm6 s PHE 114 N 1.24 2.86 0.00 0.00 0.08 -1.26 -4.88 117.98 116.02 1nm6 s PHE 114 Ca 0.53 1.51 0.00 0.00 0.12 0.00 0.00 56.93 59.09 1nm6 s PHE 114 Cb -0.23 -3.03 0.00 0.00 -0.57 0.00 0.00 43.02 39.19 1nm6 s PHE 114 CO 0.26 -1.38 0.00 -1.13 -0.10 0.00 0.00 175.22 172.88 1nm6 n SER 115 N -2.53 0.00 0.27 1.36 3.41 -0.42 -4.94 113.62 110.77 1nm6 n SER 115 Ca 0.09 -0.92 0.14 0.00 -0.26 0.00 0.00 58.87 57.92 1nm6 n SER 115 Cb 0.53 0.00 0.79 0.00 -0.26 0.00 0.00 64.21 65.27 1nm6 n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1nm6 h ASP 116 N 0.00 0.00 -0.01 4.04 3.45 -1.98 -2.98 116.42 118.95 1nm6 h ASP 116 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1nm6 h ASP 116 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 1nm6 h ASP 116 CO 0.00 0.09 -0.17 -1.22 -1.57 0.00 0.00 179.24 176.36 1nm6 n TYR 117 N -3.55 0.00 -3.86 4.55 4.02 -1.26 -4.36 117.16 112.70 1nm6 n TYR 117 Ca -0.02 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.59 1nm6 n TYR 117 Cb 0.21 0.00 -0.16 0.00 -0.02 0.00 0.00 39.34 39.37 1nm6 n TYR 117 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1nm6 s ILE 118 N -1.32 1.04 -0.24 -0.72 1.01 -1.12 -4.07 121.20 115.78 1nm6 s ILE 118 Ca 0.10 -0.70 -0.22 0.00 0.00 0.00 0.00 60.65 59.83 1nm6 s ILE 118 Cb 0.09 -1.30 0.06 0.00 0.01 0.00 0.00 42.46 41.32 1nm6 s ILE 118 CO 0.24 0.02 0.65 -2.28 0.00 0.00 0.00 174.94 173.57 1nm6 s HIS 119 N 1.65 -0.71 0.48 3.97 2.46 -0.57 -1.30 115.29 121.26 1nm6 s HIS 119 Ca -0.01 1.74 -0.21 0.00 0.47 0.00 0.00 55.06 57.05 1nm6 s HIS 119 Cb -0.16 0.25 -0.08 0.00 -0.13 0.00 0.00 32.58 32.45 1nm6 s HIS 119 CO -0.07 -0.34 1.06 -1.25 -2.47 0.00 0.00 174.74 171.66 1nm6 s PRO 120 N 0.35 3.78 0.30 2.88 0.04 -1.26 -2.16 135.00 138.93 1nm6 s PRO 120 Ca -0.00 1.43 0.01 0.00 0.04 0.00 0.00 61.00 62.49 1nm6 s PRO 120 Cb -0.05 -2.15 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 1nm6 s PRO 120 CO 0.01 -0.46 0.48 0.54 0.04 0.00 0.00 177.00 177.61 1nm6 s VAL 121 N -1.89 5.16 0.35 -0.36 0.11 -0.57 -1.06 120.40 122.13 1nm6 s VAL 121 Ca 0.67 -0.58 -0.08 0.00 -2.93 0.00 0.00 61.98 59.06 1nm6 s VAL 121 Cb -0.19 -3.84 -0.06 0.00 -1.53 0.00 0.00 36.38 30.76 1nm6 s VAL 121 CO 0.22 -0.44 0.67 0.00 -3.33 0.00 0.00 175.10 172.22 1nm6 s LEU 123 N -3.66 3.97 0.39 0.00 1.43 -1.26 -0.80 118.68 118.75 1nm6 s LEU 123 Ca 0.48 0.29 -0.25 0.00 -1.03 0.00 0.00 54.13 53.63 1nm6 s LEU 123 Cb -0.10 -1.94 -0.09 0.00 0.03 0.00 0.00 46.19 44.08 1nm6 s LEU 123 CO 0.30 0.38 1.10 -2.16 0.23 0.00 0.00 176.35 176.20 1nm6 s PRO 124 N -0.89 4.15 0.56 1.29 0.04 -1.26 -4.94 135.00 133.95 1nm6 s PRO 124 Ca 0.14 1.66 0.09 0.00 0.04 0.00 0.00 61.00 62.93 1nm6 s PRO 124 Cb -0.12 -2.64 0.08 0.00 0.04 0.00 0.00 34.50 31.86 1nm6 s PRO 124 CO 0.03 -0.19 0.74 0.16 0.04 0.00 0.00 177.00 177.79 1nm6 s ASP 125 N -1.35 5.10 0.23 6.66 3.84 -1.26 -4.79 116.67 125.10 1nm6 s ASP 125 Ca 0.57 -0.85 -0.06 0.00 -0.00 0.00 0.00 52.55 52.21 1nm6 s ASP 125 Cb -0.26 0.24 0.38 0.00 -1.38 0.00 0.00 42.92 41.90 1nm6 s ASP 125 CO 0.33 -1.28 1.77 -0.09 -0.00 0.00 0.00 175.17 175.90 1nm6 h ARG 126 N 0.26 0.57 -0.05 2.11 2.43 -1.98 -2.84 114.38 114.89 1nm6 h ARG 126 Ca -0.31 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 58.82 1nm6 h ARG 126 Cb 1.29 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1nm6 h ARG 126 CO 0.42 0.38 0.03 0.93 -1.51 0.00 0.00 179.97 180.22 1nm6 h GLU 127 N 0.59 0.06 -0.49 0.20 3.07 -2.04 -1.06 114.58 114.92 1nm6 h GLU 127 Ca 0.38 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 1nm6 h GLU 127 Cb 0.44 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 1nm6 h GLU 127 CO -0.30 0.09 0.00 2.41 -1.40 0.00 0.00 179.01 179.81 1nm6 n THR 128 N -5.03 0.00 0.00 1.13 -1.04 -1.07 -1.45 114.28 106.81 1nm6 n THR 128 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1nm6 n THR 128 Cb 0.05 -0.12 0.00 0.00 -1.82 0.00 0.00 70.33 68.44 1nm6 n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nm6 n ALA 129 N 0.62 0.00 0.10 2.41 0.00 -0.40 -1.34 120.51 121.89 1nm6 n ALA 129 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1nm6 n ALA 129 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 1nm6 n ALA 129 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1nm6 h SER 129 N 0.00 0.05 0.00 0.00 4.64 -1.51 -3.38 113.55 113.35 1nm6 h SER 129 Ca 0.00 -0.04 -0.21 0.00 -0.47 0.00 0.00 61.79 61.07 1nm6 h SER 129 Cb 0.00 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 62.04 1nm6 h SER 129 CO 0.00 0.83 -2.11 0.18 -0.87 0.00 0.00 176.83 174.87 1nm6 n LEU 129 N -3.61 0.00 -3.64 5.97 4.77 -0.45 -4.68 117.00 115.36 1nm6 n LEU 129 Ca -0.01 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.56 1nm6 n LEU 129 Cb 0.77 0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 42.14 1nm6 n LEU 129 CO 0.45 0.29 2.83 -0.11 -1.33 0.00 0.00 177.39 179.51 1nm6 n LEU 130 N -2.49 7.30 -4.25 2.23 -0.00 -1.26 -4.80 117.00 113.73 1nm6 n LEU 130 Ca -0.20 -4.21 -0.26 0.00 -0.00 0.00 0.00 56.01 51.34 1nm6 n LEU 130 Cb 0.88 -1.63 -0.14 0.00 -0.00 0.00 0.00 43.42 42.53 1nm6 n LEU 130 CO 0.39 1.34 -0.52 -1.10 -0.00 0.00 0.00 177.39 177.50 1nm6 s GLN 131 N 2.84 1.44 0.24 1.96 -0.21 -1.26 -4.95 119.66 119.72 1nm6 s GLN 131 Ca 0.52 -0.93 -0.31 0.00 0.02 0.00 0.00 55.36 54.65 1nm6 s GLN 131 Cb 0.15 -1.54 -0.13 0.00 1.00 0.00 0.00 33.01 32.48 1nm6 s GLN 131 CO -0.08 0.40 1.46 0.00 -2.12 0.00 0.00 175.29 174.94 1nm6 n ALA 132 N 1.91 1.36 0.00 6.09 0.00 -1.26 -1.61 120.51 127.00 1nm6 n ALA 132 Ca -0.17 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1nm6 n ALA 132 Cb 0.53 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.67 1nm6 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nm6 n GLY 133 N 2.32 3.01 3.73 0.00 0.00 0.04 -4.94 105.19 109.36 1nm6 n GLY 133 Ca 0.12 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1nm6 n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nm6 s TYR 134 N -2.30 3.22 0.10 1.61 1.51 -0.63 -4.57 117.35 116.29 1nm6 s TYR 134 Ca 0.00 1.14 -0.10 0.00 -1.01 0.00 0.00 57.07 57.11 1nm6 s TYR 134 Cb 0.00 -3.65 -0.06 0.00 -0.11 0.00 0.00 41.96 38.14 1nm6 s TYR 134 CO 0.00 -2.08 0.42 0.15 -1.11 0.00 0.00 175.55 172.93 1nm6 s LYS 135 N 0.09 3.77 0.48 -0.62 1.02 -1.26 -0.72 119.74 122.50 1nm6 s LYS 135 Ca 0.59 0.19 0.02 0.00 0.02 0.00 0.00 55.97 56.78 1nm6 s LYS 135 Cb -0.37 -2.95 -0.01 0.00 -0.52 0.00 0.00 37.83 33.97 1nm6 s LYS 135 CO 0.37 0.53 0.06 0.20 -0.92 0.00 0.00 175.35 175.59 1nm6 s GLY 136 N -1.86 2.92 -0.05 -3.33 0.00 0.07 -4.84 107.32 100.23 1nm6 s GLY 136 Ca 0.35 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.52 1nm6 s GLY 136 CO 0.19 -2.05 -0.13 -1.60 0.00 0.00 0.00 173.10 169.51 1nm6 s ARG 137 N -3.80 1.58 -0.04 2.90 3.52 0.12 -1.16 118.95 122.06 1nm6 s ARG 137 Ca 0.11 -0.43 0.05 0.00 -0.13 0.00 0.00 55.73 55.33 1nm6 s ARG 137 Cb 0.01 -1.34 -0.02 0.00 -1.56 0.00 0.00 34.95 32.04 1nm6 s ARG 137 CO 0.07 0.08 -0.20 0.08 -0.81 0.00 0.00 175.30 174.53 1nm6 s VAL 138 N 0.46 2.60 0.05 7.11 1.01 -0.27 -0.47 120.40 130.89 1nm6 s VAL 138 Ca -0.10 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.01 1nm6 s VAL 138 Cb -0.14 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1nm6 s VAL 138 CO 0.03 0.58 -0.10 0.42 0.00 0.00 0.00 175.10 176.03 1nm6 s THR 139 N -0.62 0.73 0.00 3.92 -4.23 -1.23 -1.66 115.64 112.54 1nm6 s THR 139 Ca 0.09 -1.18 0.00 0.00 -1.18 0.00 0.00 61.69 59.43 1nm6 s THR 139 Cb -0.11 -0.79 0.00 0.00 1.34 0.00 0.00 72.50 72.94 1nm6 s THR 139 CO 0.00 -0.35 0.00 0.61 -0.54 0.00 0.00 174.62 174.34 1nm6 n GLY 140 N 1.35 0.84 1.22 3.99 0.00 -0.84 -4.51 105.19 107.25 1nm6 n GLY 140 Ca -0.22 -0.85 0.08 0.00 0.00 0.00 0.00 46.02 45.03 1nm6 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1nm6 n TRP 141 N -0.24 1.27 -1.06 1.61 8.01 -1.26 -1.70 117.44 124.07 1nm6 n TRP 141 Ca 0.00 -0.78 -0.30 0.00 -1.31 0.00 0.00 57.50 55.11 1nm6 n TRP 141 Cb 0.00 -0.34 0.24 0.00 -2.01 0.00 0.00 31.31 29.20 1nm6 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1nm6 s GLY 142 N -1.44 1.58 0.45 6.99 0.00 -1.26 -4.61 107.32 109.03 1nm6 s GLY 142 Ca 0.45 -0.94 -0.24 0.00 0.00 0.00 0.00 44.72 43.99 1nm6 s GLY 142 CO 0.13 -0.05 1.14 0.70 0.00 0.00 0.00 173.10 175.02 1nm6 n ASN 143 N -4.79 1.86 0.09 1.64 3.02 0.17 -2.94 115.26 114.31 1nm6 n ASN 143 Ca 0.13 1.04 0.13 0.00 -0.03 0.00 0.00 54.58 55.85 1nm6 n ASN 143 Cb 0.59 -1.43 0.35 0.00 -0.61 0.00 0.00 39.78 38.68 1nm6 n ASN 143 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1nm6 n LEU 144 N 0.14 0.78 -3.83 3.41 4.77 -0.55 -1.17 117.00 120.54 1nm6 n LEU 144 Ca 0.09 0.48 -0.11 0.00 -0.03 0.00 0.00 56.01 56.44 1nm6 n LEU 144 Cb 0.41 -0.28 -0.08 0.00 -2.33 0.00 0.00 43.42 41.13 1nm6 n LEU 144 CO 0.57 -0.14 -0.07 -0.54 -1.33 0.00 0.00 177.39 175.87 1nm6 s LYS 145 N -3.12 0.71 0.00 3.23 1.02 -1.26 -4.26 119.74 116.06 1nm6 s LYS 145 Ca 0.10 -0.60 0.00 0.00 0.02 0.00 0.00 55.97 55.48 1nm6 s LYS 145 Cb 0.13 0.30 0.00 0.00 -0.52 0.00 0.00 37.83 37.74 1nm6 s LYS 145 CO 0.63 -0.21 0.09 -1.91 -0.92 0.00 0.00 175.35 173.03 1nm6 n GLU 146 N 0.67 0.13 0.00 1.68 2.13 -1.26 -4.93 120.64 119.06 1nm6 n GLU 146 Ca -0.19 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.63 1nm6 n GLU 146 Cb 0.59 -1.21 0.00 0.00 0.27 0.00 0.00 31.44 31.09 1nm6 n GLU 146 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nm6 n GLY 150 N 0.63 -0.07 3.72 8.31 0.00 -1.26 -4.96 105.19 111.56 1nm6 n GLY 150 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1nm6 n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nm6 s GLN 151 N 0.00 2.70 0.35 1.61 -1.52 -1.26 -1.49 119.66 120.05 1nm6 s GLN 151 Ca 0.00 -0.75 -0.15 0.00 -1.95 0.00 0.00 55.36 52.52 1nm6 s GLN 151 Cb 0.00 -2.63 -0.09 0.00 -0.22 0.00 0.00 33.01 30.08 1nm6 s GLN 151 CO 0.00 0.57 0.76 -1.25 -0.25 0.00 0.00 175.29 175.12 1nm6 s PRO 152 N -2.19 3.98 0.09 2.91 0.04 -1.26 -4.93 135.00 133.63 1nm6 s PRO 152 Ca 0.26 0.67 -0.09 0.00 0.04 0.00 0.00 61.00 61.88 1nm6 s PRO 152 Cb -0.12 -2.40 -0.22 0.00 0.04 0.00 0.00 34.50 31.81 1nm6 s PRO 152 CO 0.18 0.10 1.18 0.77 0.04 0.00 0.00 177.00 179.27 1nm6 h SER 153 N 2.03 0.68 -3.99 6.66 0.02 -1.97 -3.43 113.55 113.55 1nm6 h SER 153 Ca -0.48 -0.61 -0.40 0.00 -0.84 0.00 0.00 61.79 59.46 1nm6 h SER 153 Cb 1.18 -0.21 -0.14 0.00 0.14 0.00 0.00 62.40 63.36 1nm6 h SER 153 CO 0.65 1.43 -0.61 0.68 -1.14 0.00 0.00 176.83 177.84 1nm6 s VAL 154 N -3.04 0.82 0.19 2.27 -7.23 -1.26 -1.51 120.40 110.64 1nm6 s VAL 154 Ca -0.07 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 57.77 1nm6 s VAL 154 Cb 0.07 -2.69 -0.15 0.00 0.56 0.00 0.00 36.38 34.17 1nm6 s VAL 154 CO 0.90 -0.01 1.25 -0.11 -0.31 0.00 0.00 175.10 176.82 1nm6 n LEU 155 N -0.55 2.03 -4.81 1.32 7.94 0.13 -4.83 117.00 118.23 1nm6 n LEU 155 Ca -0.01 1.14 -0.30 0.00 -1.11 0.00 0.00 56.01 55.73 1nm6 n LEU 155 Cb 0.66 -1.28 -0.06 0.00 0.53 0.00 0.00 43.42 43.27 1nm6 n LEU 155 CO 0.39 -1.03 -0.23 -1.10 -1.11 0.00 0.00 177.39 174.31 1nm6 s GLN 156 N -0.33 2.99 0.00 1.96 -1.52 -0.69 -1.02 119.66 121.05 1nm6 s GLN 156 Ca 0.72 -0.68 -0.01 0.00 -1.95 0.00 0.00 55.36 53.45 1nm6 s GLN 156 Cb -0.79 -2.77 -0.00 0.00 -0.22 0.00 0.00 33.01 29.22 1nm6 s GLN 156 CO 0.51 0.56 0.01 0.54 -0.25 0.00 0.00 175.29 176.65 1nm6 s VAL 157 N -1.47 0.04 -0.15 1.09 0.11 0.05 -1.98 120.40 118.09 1nm6 s VAL 157 Ca 0.31 -0.29 -0.12 0.00 -2.93 0.00 0.00 61.98 58.94 1nm6 s VAL 157 Cb -0.12 -0.11 0.04 0.00 -1.53 0.00 0.00 36.38 34.66 1nm6 s VAL 157 CO 0.23 -0.16 0.39 0.54 -3.33 0.00 0.00 175.10 172.77 1nm6 s VAL 158 N -0.47 -0.01 -0.18 2.04 0.11 -0.66 -1.37 120.40 119.86 1nm6 s VAL 158 Ca -0.05 0.02 -0.11 0.00 -2.93 0.00 0.00 61.98 58.90 1nm6 s VAL 158 Cb -0.03 -0.55 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 1nm6 s VAL 158 CO -0.00 0.01 0.19 0.20 -3.33 0.00 0.00 175.10 172.16 1nm6 s ASN 159 N 0.43 6.29 0.01 3.54 0.01 -1.26 -1.12 114.94 122.84 1nm6 s ASN 159 Ca -0.02 0.33 0.02 0.00 -0.71 0.00 0.00 52.86 52.49 1nm6 s ASN 159 Cb -0.04 -2.12 -0.01 0.00 0.41 0.00 0.00 41.25 39.49 1nm6 s ASN 159 CO -0.02 0.16 -0.07 -0.76 -1.51 0.00 0.00 177.10 174.89 1nm6 s LEU 160 N 0.37 2.08 0.20 0.60 1.43 -0.31 -4.95 118.68 118.10 1nm6 s LEU 160 Ca 0.11 -0.24 -0.26 0.00 -1.03 0.00 0.00 54.13 52.72 1nm6 s LEU 160 Cb -0.12 -0.33 -0.08 0.00 0.03 0.00 0.00 46.19 45.69 1nm6 s LEU 160 CO 0.00 0.02 0.83 -2.16 0.23 0.00 0.00 176.35 175.27 1nm6 s PRO 161 N -0.53 4.61 0.35 1.29 0.04 -1.26 -0.75 135.00 138.74 1nm6 s PRO 161 Ca -0.00 1.22 -0.28 0.00 0.04 0.00 0.00 61.00 61.98 1nm6 s PRO 161 Cb -0.05 -3.18 -0.10 0.00 0.04 0.00 0.00 34.50 31.22 1nm6 s PRO 161 CO 0.00 0.51 1.27 0.42 0.04 0.00 0.00 177.00 179.25 1nm6 s ILE 162 N -1.24 2.81 -0.00 0.56 1.01 0.10 -1.23 121.20 123.21 1nm6 s ILE 162 Ca 0.39 0.78 0.01 0.00 0.00 0.00 0.00 60.65 61.83 1nm6 s ILE 162 Cb -0.23 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 1nm6 s ILE 162 CO 0.27 0.16 0.03 -0.69 0.00 0.00 0.00 174.94 174.71 1nm6 s VAL 163 N -1.19 4.39 0.37 2.92 1.01 -0.25 -0.78 120.40 126.86 1nm6 s VAL 163 Ca 0.51 -0.53 -0.27 0.00 0.00 0.00 0.00 61.98 61.69 1nm6 s VAL 163 Cb -0.38 -2.98 -0.11 0.00 0.00 0.00 0.00 36.38 32.91 1nm6 s VAL 163 CO 0.50 0.36 1.26 -0.62 0.00 0.00 0.00 175.10 176.60 1nm6 n GLU 164 N 1.30 2.01 -0.17 2.72 4.71 -1.26 -4.62 120.64 125.33 1nm6 n GLU 164 Ca -0.14 0.71 -0.03 0.00 -0.01 0.00 0.00 57.16 57.69 1nm6 n GLU 164 Cb 0.53 -2.32 0.04 0.00 -1.01 0.00 0.00 31.44 28.67 1nm6 n GLU 164 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1nm6 h ARG 165 N 2.33 0.00 -0.81 3.49 2.47 -1.98 -1.93 114.38 117.95 1nm6 h ARG 165 Ca -0.46 -0.00 0.08 0.00 -1.26 0.00 0.00 59.98 58.34 1nm6 h ARG 165 Cb 1.29 -0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 29.54 1nm6 h ARG 165 CO 0.61 0.00 0.47 -1.35 0.56 0.00 0.00 179.97 180.26 1nm6 h PRO 166 N 0.00 0.78 -0.47 0.04 0.11 -1.99 -0.77 132.00 129.70 1nm6 h PRO 166 Ca 0.25 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.27 1nm6 h PRO 166 Cb 0.38 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.29 1nm6 h PRO 166 CO -0.53 0.52 0.11 0.28 -0.21 0.00 0.00 178.00 178.17 1nm6 h VAL 167 N 0.81 1.24 -0.28 3.15 2.07 -1.77 -0.29 116.25 121.17 1nm6 h VAL 167 Ca 0.38 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 67.08 1nm6 h VAL 167 Cb 0.31 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1nm6 h VAL 167 CO -0.23 0.30 0.14 0.00 0.02 0.00 0.00 177.57 177.80 1nm6 h LYS 169 N 0.30 0.10 0.00 0.00 1.63 -0.92 -2.65 116.57 115.03 1nm6 h LYS 169 Ca 0.12 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 1nm6 h LYS 169 Cb 0.03 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.64 1nm6 h LYS 169 CO -0.08 0.07 0.00 -0.25 -3.45 0.00 0.00 179.45 175.74 1nm6 n ASP 170 N -5.07 0.00 -0.20 4.20 10.43 -0.14 -2.98 116.55 122.79 1nm6 n ASP 170 Ca -0.04 0.08 0.12 0.00 2.57 0.00 0.00 54.79 57.52 1nm6 n ASP 170 Cb 0.07 -0.30 0.25 0.00 1.84 0.00 0.00 41.12 42.97 1nm6 n ASP 170 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 1nm6 n SER 171 N -1.30 1.05 -3.93 -2.24 3.41 -0.89 -4.97 113.62 104.75 1nm6 n SER 171 Ca 0.08 -0.84 -0.10 0.00 -0.26 0.00 0.00 58.87 57.75 1nm6 n SER 171 Cb 0.14 0.29 -0.06 0.00 -0.26 0.00 0.00 64.21 64.31 1nm6 n SER 171 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1nm6 s THR 172 N -2.66 0.06 -0.88 6.66 -4.23 -1.16 -4.82 115.64 108.61 1nm6 s THR 172 Ca 0.19 -1.29 0.23 0.00 -1.18 0.00 0.00 61.69 59.63 1nm6 s THR 172 Cb 0.18 -1.80 -0.13 0.00 1.34 0.00 0.00 72.50 72.10 1nm6 s THR 172 CO 0.60 -0.27 1.09 0.54 -0.54 0.00 0.00 174.62 176.04 1nm6 n ARG 173 N -0.23 0.08 -2.31 3.99 1.74 -1.26 -4.92 116.66 113.76 1nm6 n ARG 173 Ca -0.08 -0.01 -0.41 0.00 -0.77 0.00 0.00 57.85 56.59 1nm6 n ARG 173 Cb 0.63 -1.52 -0.03 0.00 -1.02 0.00 0.00 32.46 30.51 1nm6 n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1nm6 s ILE 174 N -3.06 3.19 -0.09 0.55 -1.09 -1.26 -4.97 121.20 114.47 1nm6 s ILE 174 Ca 0.08 1.14 -0.30 0.00 -2.23 0.00 0.00 60.65 59.34 1nm6 s ILE 174 Cb 0.16 -3.73 -0.03 0.00 -1.58 0.00 0.00 42.46 37.28 1nm6 s ILE 174 CO 0.80 0.25 1.36 -0.60 -1.23 0.00 0.00 174.94 175.52 1nm6 s ARG 175 N -1.26 4.25 0.06 2.79 3.52 -1.26 -5.01 118.95 122.04 1nm6 s ARG 175 Ca 0.48 1.84 -0.14 0.00 -0.13 0.00 0.00 55.73 57.79 1nm6 s ARG 175 Cb -0.35 -3.73 -0.06 0.00 -1.56 0.00 0.00 34.95 29.24 1nm6 s ARG 175 CO 0.44 -0.67 0.45 0.42 -0.81 0.00 0.00 175.30 175.14 1nm6 s ILE 176 N 3.17 4.97 0.43 4.11 -1.09 -1.26 -4.90 121.20 126.63 1nm6 s ILE 176 Ca 0.61 0.78 0.06 0.00 -2.23 0.00 0.00 60.65 59.87 1nm6 s ILE 176 Cb -0.27 -3.72 -0.06 0.00 -1.58 0.00 0.00 42.46 36.83 1nm6 s ILE 176 CO 0.21 0.43 0.05 0.42 -1.23 0.00 0.00 174.94 174.82 1nm6 s THR 177 N -1.25 1.94 -0.89 2.92 -4.23 -1.26 -5.01 115.64 107.85 1nm6 s THR 177 Ca 0.30 -1.93 0.16 0.00 -1.18 0.00 0.00 61.69 59.03 1nm6 s THR 177 Cb -0.16 -2.87 0.14 0.00 1.34 0.00 0.00 72.50 70.95 1nm6 s THR 177 CO 0.16 0.00 1.49 0.47 -0.54 0.00 0.00 174.62 176.20 1nm6 n ASP 178 N -1.08 0.13 -1.03 3.99 8.00 -1.26 -2.21 116.55 123.09 1nm6 n ASP 178 Ca -0.06 0.53 0.05 0.00 0.71 0.00 0.00 54.79 56.03 1nm6 n ASP 178 Cb 0.66 -0.56 0.21 0.00 -0.02 0.00 0.00 41.12 41.41 1nm6 n ASP 178 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1nm6 n ASN 179 N -1.65 2.97 -4.12 -2.24 3.02 -1.26 -4.87 115.26 107.11 1nm6 n ASN 179 Ca 0.03 -2.26 -0.10 0.00 -0.03 0.00 0.00 54.58 52.22 1nm6 n ASN 179 Cb 0.17 -0.44 -0.10 0.00 -0.61 0.00 0.00 39.78 38.80 1nm6 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1nm6 s MET 180 N -1.72 0.68 0.04 3.52 -1.94 -0.94 -0.88 119.30 118.07 1nm6 s MET 180 Ca 0.30 -1.17 -0.13 0.00 -1.71 0.00 0.00 55.69 52.97 1nm6 s MET 180 Cb 0.19 -0.06 0.02 0.00 2.01 0.00 0.00 34.83 36.99 1nm6 s MET 180 CO 0.14 -0.04 0.29 -0.59 -0.01 0.00 0.00 175.02 174.81 1nm6 s PHE 181 N -3.26 -0.09 0.25 -0.03 -0.12 -0.80 -4.82 117.98 109.09 1nm6 s PHE 181 Ca 0.05 -0.04 0.11 0.00 -0.05 0.00 0.00 56.93 57.01 1nm6 s PHE 181 Cb 0.03 0.08 -0.05 0.00 -0.63 0.00 0.00 43.02 42.46 1nm6 s PHE 181 CO -0.05 -0.49 -0.21 0.00 -0.05 0.00 0.00 175.22 174.42 1nm6 s ALA 183 N -2.28 -0.20 0.00 0.00 0.00 -0.58 -1.09 121.76 117.62 1nm6 s ALA 183 Ca 0.26 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.71 1nm6 s ALA 183 Cb -0.06 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.40 1nm6 s ALA 183 CO 0.13 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1nm6 n GLY 184 N 0.42 3.82 3.84 0.00 0.00 -0.36 -2.42 105.19 110.49 1nm6 n GLY 184 Ca -0.17 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 1nm6 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nm6 s TYR 184 N -2.00 3.37 0.65 1.61 1.51 -1.26 -4.55 117.35 116.67 1nm6 s TYR 184 Ca 0.00 1.30 -0.11 0.00 -1.01 0.00 0.00 57.07 57.25 1nm6 s TYR 184 Cb 0.00 -2.61 -0.02 0.00 -0.11 0.00 0.00 41.96 39.22 1nm6 s TYR 184 CO 0.00 0.02 1.05 0.15 -1.11 0.00 0.00 175.55 175.66 1nm6 s LYS 185 N -3.12 3.37 0.26 -0.62 -0.14 -1.26 -4.81 119.74 113.42 1nm6 s LYS 185 Ca 0.56 0.71 -0.03 0.00 -1.36 0.00 0.00 55.97 55.84 1nm6 s LYS 185 Cb -0.10 -2.06 0.39 0.00 -1.68 0.00 0.00 37.83 34.38 1nm6 s LYS 185 CO 0.18 -0.72 1.88 -1.35 -0.76 0.00 0.00 175.35 174.58 1nm6 h PRO 186 N -0.43 1.13 0.00 -1.68 0.11 -1.96 -1.91 132.00 127.25 1nm6 h PRO 186 Ca -0.44 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1nm6 h PRO 186 Cb 1.21 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1nm6 h PRO 186 CO 0.62 0.75 0.00 -0.40 -0.21 0.00 0.00 178.00 178.75 1nm6 n ASP 186 N -4.51 0.00 0.03 -2.05 5.75 -1.26 -3.37 116.55 111.13 1nm6 n ASP 186 Ca 0.15 -0.76 0.13 0.00 -0.01 0.00 0.00 54.79 54.30 1nm6 n ASP 186 Cb 0.17 -0.07 0.33 0.00 -1.03 0.00 0.00 41.12 40.52 1nm6 n ASP 186 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1nm6 n GLU 186 N -1.07 0.11 0.00 0.11 1.02 -0.72 -4.97 120.64 115.12 1nm6 n GLU 186 Ca 0.21 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 1nm6 n GLU 186 Cb 0.14 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 1nm6 n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nm6 n GLY 186 N 1.43 1.65 3.74 0.62 0.00 -1.22 -4.97 105.19 106.44 1nm6 n GLY 186 Ca 0.05 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1nm6 n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nm6 s LYS 186 N 0.00 2.18 0.24 1.61 1.02 -1.26 -5.06 119.74 118.48 1nm6 s LYS 186 Ca 0.00 1.43 0.02 0.00 0.02 0.00 0.00 55.97 57.45 1nm6 s LYS 186 Cb 0.00 -1.87 -0.01 0.00 -0.52 0.00 0.00 37.83 35.43 1nm6 s LYS 186 CO 0.00 -1.74 0.08 0.54 -0.92 0.00 0.00 175.35 173.31 1nm6 n ARG 187 N -3.13 0.77 0.00 1.68 1.74 -1.26 -4.69 116.66 111.77 1nm6 n ARG 187 Ca 0.11 -2.04 0.00 0.00 -0.77 0.00 0.00 57.85 55.15 1nm6 n ARG 187 Cb 0.52 1.07 0.00 0.00 -1.02 0.00 0.00 32.46 33.03 1nm6 n ARG 187 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nm6 n GLY 188 N 0.56 4.47 3.61 -0.13 0.00 -1.26 -4.91 105.19 107.53 1nm6 n GLY 188 Ca -0.04 -1.21 -0.02 0.00 0.00 0.00 0.00 46.02 44.75 1nm6 n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nm6 s ASP 189 N 0.00 -0.13 0.66 1.61 3.68 -1.06 -4.65 116.67 116.78 1nm6 s ASP 189 Ca 0.00 -0.10 -0.04 0.00 2.13 0.00 0.00 52.55 54.54 1nm6 s ASP 189 Cb 0.00 0.21 0.05 0.00 -1.45 0.00 0.00 42.92 41.73 1nm6 s ASP 189 CO 0.00 -0.36 0.94 0.00 0.13 0.00 0.00 175.17 175.88 1nm6 s ALA 190 N -2.57 3.36 0.20 3.66 0.00 -1.26 -0.67 121.76 124.49 1nm6 s ALA 190 Ca 0.11 -1.02 -0.04 0.00 0.00 0.00 0.00 51.96 51.01 1nm6 s ALA 190 Cb 0.01 -2.46 0.02 0.00 0.00 0.00 0.00 23.12 20.69 1nm6 s ALA 190 CO -0.04 -1.12 0.34 0.00 0.00 0.00 0.00 175.76 174.94 1nm6 n GLU 192 N -0.30 1.57 0.00 0.00 2.13 -1.26 -1.36 120.64 121.41 1nm6 n GLU 192 Ca -0.02 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.36 1nm6 n GLU 192 Cb 0.32 -2.21 0.00 0.00 0.27 0.00 0.00 31.44 29.82 1nm6 n GLU 192 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nm6 n GLY 193 N 2.58 3.46 0.12 8.31 0.00 -1.26 -0.65 105.19 117.74 1nm6 n GLY 193 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1nm6 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1nm6 h ASP 194 N 0.00 0.00 -1.63 1.61 3.45 -1.57 -3.31 116.42 114.96 1nm6 h ASP 194 Ca 0.00 -0.07 -0.64 0.00 0.43 0.00 0.00 57.03 56.74 1nm6 h ASP 194 Cb 0.00 0.00 0.11 0.00 -0.56 0.00 0.00 39.33 38.88 1nm6 h ASP 194 CO 0.00 0.04 -0.28 -1.20 -1.57 0.00 0.00 179.24 176.22 1nm6 n SER 195 N -2.53 -0.30 0.00 6.45 7.64 -1.26 -1.50 113.62 122.12 1nm6 n SER 195 Ca 0.02 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1nm6 n SER 195 Cb 0.50 -1.08 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1nm6 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nm6 n GLY 196 N 1.70 2.75 3.75 0.23 0.00 -0.23 -0.21 105.19 113.19 1nm6 n GLY 196 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 1nm6 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nm6 s GLY 197 N -1.73 1.60 0.27 -0.02 0.00 -0.56 -3.09 107.32 103.77 1nm6 s GLY 197 Ca 0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 44.72 44.34 1nm6 s GLY 197 CO 0.00 0.24 0.61 2.56 0.00 0.00 0.00 173.10 176.51 1nm6 s PRO 198 N -5.08 3.84 -0.33 2.90 0.04 -1.26 -0.71 135.00 134.40 1nm6 s PRO 198 Ca 0.63 0.36 -0.01 0.00 0.04 0.00 0.00 61.00 62.02 1nm6 s PRO 198 Cb -0.16 -2.58 0.07 0.00 0.04 0.00 0.00 34.50 31.86 1nm6 s PRO 198 CO 0.56 0.25 0.05 0.12 0.04 0.00 0.00 177.00 178.02 1nm6 s PHE 199 N -1.91 3.38 0.22 0.56 5.36 -0.18 -3.55 117.98 121.88 1nm6 s PHE 199 Ca 0.49 -2.10 0.09 0.00 -0.96 0.00 0.00 56.93 54.45 1nm6 s PHE 199 Cb -0.11 -2.44 -0.04 0.00 -0.34 0.00 0.00 43.02 40.09 1nm6 s PHE 199 CO 0.21 -0.86 -0.04 0.14 -1.46 0.00 0.00 175.22 173.22 1nm6 s VAL 200 N 1.20 3.37 0.02 3.12 -7.23 0.38 -1.03 120.40 120.23 1nm6 s VAL 200 Ca -0.01 -1.77 0.02 0.00 -1.81 0.00 0.00 61.98 58.41 1nm6 s VAL 200 Cb -0.20 -2.74 -0.01 0.00 0.56 0.00 0.00 36.38 33.98 1nm6 s VAL 200 CO -0.02 -0.25 -0.06 -0.04 -0.31 0.00 0.00 175.10 174.42 1nm6 s MET 201 N -3.28 0.45 -0.34 4.82 -1.94 -0.14 0.10 119.30 118.97 1nm6 s MET 201 Ca 0.29 -0.42 -0.15 0.00 -1.71 0.00 0.00 55.69 53.69 1nm6 s MET 201 Cb -0.08 -0.34 -0.01 0.00 2.01 0.00 0.00 34.83 36.41 1nm6 s MET 201 CO 0.18 0.08 0.34 0.21 -0.01 0.00 0.00 175.02 175.82 1nm6 s LYS 202 N -0.74 3.56 0.16 2.03 2.20 -1.26 -0.45 119.74 125.24 1nm6 s LYS 202 Ca -0.03 -0.45 -0.31 0.00 -0.36 0.00 0.00 55.97 54.81 1nm6 s LYS 202 Cb -0.05 -3.80 -0.10 0.00 -1.51 0.00 0.00 37.83 32.36 1nm6 s LYS 202 CO 0.00 -0.50 1.64 0.45 -0.36 0.00 0.00 175.35 176.58 1nm6 s SER 203 N 1.73 6.53 0.00 1.43 0.15 -0.24 -4.87 113.70 118.43 1nm6 s SER 203 Ca 0.11 2.67 0.27 0.00 0.70 0.00 0.00 55.95 59.70 1nm6 s SER 203 Cb -0.17 -2.59 1.17 0.00 -1.71 0.00 0.00 66.02 62.72 1nm6 s SER 203 CO 0.11 -0.88 1.87 -0.81 1.20 0.00 0.00 173.24 174.73 1nm6 n PRO 204 N 4.36 0.03 -0.09 5.44 -0.04 -1.26 -1.10 135.00 142.34 1nm6 n PRO 204 Ca 0.15 0.03 -0.17 0.00 -0.04 0.00 0.00 63.50 63.47 1nm6 n PRO 204 Cb 0.38 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.22 1nm6 n PRO 204 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1nm6 h PHE 204 N 0.00 0.00 -0.03 0.54 0.04 -1.97 -3.41 116.94 112.12 1nm6 h PHE 204 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1nm6 h PHE 204 Cb 0.45 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.60 1nm6 h PHE 204 CO 0.00 1.20 0.00 0.27 -0.60 0.00 0.00 178.31 179.18 1nm6 n ASN 204 N -4.53 1.95 -2.39 2.17 0.23 -1.25 -5.01 115.26 106.43 1nm6 n ASN 204 Ca -0.20 -1.87 -0.16 0.00 -0.53 0.00 0.00 54.58 51.82 1nm6 n ASN 204 Cb 0.56 -0.02 -0.01 0.00 -2.08 0.00 0.00 39.78 38.23 1nm6 n ASN 204 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1nm6 n ASN 205 N -0.34 -4.72 -4.70 0.53 3.02 -0.26 -4.99 115.26 103.81 1nm6 n ASN 205 Ca 0.01 0.12 -0.31 0.00 -0.03 0.00 0.00 54.58 54.37 1nm6 n ASN 205 Cb 0.23 -3.98 -0.08 0.00 -0.61 0.00 0.00 39.78 35.34 1nm6 n ASN 205 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1nm6 s ARG 206 N -4.98 2.68 0.01 3.52 0.52 -1.25 -4.84 118.95 114.61 1nm6 s ARG 206 Ca 0.00 -0.74 -0.24 0.00 -0.52 0.00 0.00 55.73 54.23 1nm6 s ARG 206 Cb 0.00 -2.61 -0.05 0.00 0.52 0.00 0.00 34.95 32.81 1nm6 s ARG 206 CO 0.00 0.57 0.74 -1.58 0.02 0.00 0.00 175.30 175.05 1nm6 s TRP 207 N -1.25 3.69 -0.03 -0.53 0.52 -0.29 -1.08 118.94 119.97 1nm6 s TRP 207 Ca 0.24 1.40 0.07 0.00 0.02 0.00 0.00 56.10 57.83 1nm6 s TRP 207 Cb -0.12 -2.81 -0.02 0.00 -1.15 0.00 0.00 33.47 29.38 1nm6 s TRP 207 CO 0.16 0.22 -0.25 0.71 0.02 0.00 0.00 176.95 177.81 1nm6 s TYR 208 N 0.21 2.35 -0.50 -1.98 2.02 0.41 -2.18 117.35 117.68 1nm6 s TYR 208 Ca 0.38 -0.54 -0.22 0.00 -0.37 0.00 0.00 57.07 56.32 1nm6 s TYR 208 Cb -0.20 -1.52 0.04 0.00 -0.40 0.00 0.00 41.96 39.88 1nm6 s TYR 208 CO 0.21 -0.10 0.78 -1.14 -1.57 0.00 0.00 175.55 173.73 1nm6 s GLN 209 N -0.45 3.29 0.06 -0.62 0.74 0.02 -0.97 119.66 121.73 1nm6 s GLN 209 Ca 0.05 -0.40 0.17 0.00 0.05 0.00 0.00 55.36 55.24 1nm6 s GLN 209 Cb -0.11 -4.02 -0.14 0.00 1.10 0.00 0.00 33.01 29.84 1nm6 s GLN 209 CO 0.01 -1.26 0.79 -1.33 -0.55 0.00 0.00 175.29 172.94 1nm6 n MET 210 N 6.79 0.62 -4.08 1.67 2.81 -0.20 -4.36 117.12 120.38 1nm6 n MET 210 Ca -0.01 0.19 -0.10 0.00 -1.81 0.00 0.00 57.70 55.97 1nm6 n MET 210 Cb 0.47 -1.78 -0.08 0.00 -0.71 0.00 0.00 33.22 31.12 1nm6 n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1nm6 s GLY 211 N -4.78 0.90 -0.09 3.03 0.00 -0.82 -1.68 107.32 103.88 1nm6 s GLY 211 Ca -0.03 -1.23 0.03 0.00 0.00 0.00 0.00 44.72 43.49 1nm6 s GLY 211 CO 0.81 -1.00 -0.16 -0.42 0.00 0.00 0.00 173.10 172.33 1nm6 s ILE 212 N -4.07 1.47 -0.11 0.90 1.01 -0.88 -1.01 121.20 118.52 1nm6 s ILE 212 Ca 0.28 -0.66 -0.33 0.00 0.00 0.00 0.00 60.65 59.94 1nm6 s ILE 212 Cb 0.03 -1.32 -0.10 0.00 0.01 0.00 0.00 42.46 41.08 1nm6 s ILE 212 CO 0.08 0.43 1.97 0.52 0.00 0.00 0.00 174.94 177.95 1nm6 n VAL 213 N 3.84 0.56 0.00 2.92 0.31 0.11 -0.80 118.33 125.26 1nm6 n VAL 213 Ca -0.21 -0.17 -0.01 0.00 -0.01 0.00 0.00 64.34 63.94 1nm6 n VAL 213 Cb 0.52 -2.03 -0.00 0.00 -0.91 0.00 0.00 33.84 31.42 1nm6 n VAL 213 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1nm6 n SER 214 N 7.77 0.29 -3.97 4.52 7.64 -0.56 -1.06 113.62 128.25 1nm6 n SER 214 Ca 0.25 0.04 -0.10 0.00 1.01 0.00 0.00 58.87 60.08 1nm6 n SER 214 Cb 0.33 -0.23 -0.06 0.00 -1.01 0.00 0.00 64.21 63.24 1nm6 n SER 214 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 1nm6 s TRP 215 N -1.28 0.38 0.12 1.43 1.48 -0.88 -4.90 118.94 115.28 1nm6 s TRP 215 Ca -0.02 -0.72 -0.26 0.00 -1.06 0.00 0.00 56.10 54.04 1nm6 s TRP 215 Cb 0.00 0.07 0.08 0.00 -1.16 0.00 0.00 33.47 32.46 1nm6 s TRP 215 CO 0.03 -0.86 1.05 0.20 -4.06 0.00 0.00 176.95 173.31 1nm6 s GLY 216 N -2.99 -0.22 -0.33 3.67 0.00 -1.26 -0.30 107.32 105.88 1nm6 s GLY 216 Ca 0.20 0.19 0.01 0.00 0.00 0.00 0.00 44.72 45.12 1nm6 s GLY 216 CO 0.05 0.44 0.05 -0.54 0.00 0.00 0.00 173.10 173.10 1nm6 s GLU 217 N -2.92 1.98 0.93 2.90 2.02 -1.26 -5.00 118.70 117.36 1nm6 s GLU 217 Ca 0.14 -1.62 0.00 0.00 0.02 0.00 0.00 54.97 53.51 1nm6 s GLU 217 Cb -0.00 -3.25 0.00 0.00 0.10 0.00 0.00 34.13 30.98 1nm6 s GLU 217 CO 0.01 -0.83 0.00 0.41 0.02 0.00 0.00 175.26 174.87 1nm6 n GLY 219 N 4.46 -2.02 2.89 -1.39 0.00 -1.26 -4.77 105.19 103.10 1nm6 n GLY 219 Ca -0.05 -1.40 -0.22 0.00 0.00 0.00 0.00 46.02 44.35 1nm6 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nm6 n ASP 221 N 4.25 -3.62 -4.85 0.00 2.03 -1.26 -4.59 116.55 108.50 1nm6 n ASP 221 Ca -0.21 -0.84 -0.34 0.00 0.52 0.00 0.00 54.79 53.92 1nm6 n ASP 221 Cb 0.51 -3.68 -0.06 0.00 -0.72 0.00 0.00 41.12 37.17 1nm6 n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1nm6 s ARG 221 N -6.56 4.00 0.22 -0.67 0.52 -1.26 -4.95 118.95 110.25 1nm6 s ARG 221 Ca 0.51 0.56 -0.31 0.00 -0.52 0.00 0.00 55.73 55.98 1nm6 s ARG 221 Cb -0.26 -2.73 -0.10 0.00 0.52 0.00 0.00 34.95 32.38 1nm6 s ARG 221 CO 0.85 0.35 1.48 -0.51 0.02 0.00 0.00 175.30 177.48 1nm6 s ASP 222 N -1.99 6.63 0.00 0.23 1.11 -1.26 -2.34 116.67 119.05 1nm6 s ASP 222 Ca 0.45 2.64 0.00 0.00 0.18 0.00 0.00 52.55 55.82 1nm6 s ASP 222 Cb -0.13 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 41.24 1nm6 s ASP 222 CO 0.20 -0.74 0.00 0.61 1.18 0.00 0.00 175.17 176.41 1nm6 n GLY 223 N 2.73 1.39 3.67 0.21 0.00 -1.26 -5.02 105.19 106.90 1nm6 n GLY 223 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1nm6 n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nm6 s LYS 224 N -0.14 2.33 0.01 1.61 -0.14 -0.99 -4.75 119.74 117.68 1nm6 s LYS 224 Ca 0.00 -1.43 -0.03 0.00 -1.36 0.00 0.00 55.97 53.16 1nm6 s LYS 224 Cb 0.00 -2.18 -0.01 0.00 -1.68 0.00 0.00 37.83 33.96 1nm6 s LYS 224 CO 0.00 0.32 0.03 0.71 -0.76 0.00 0.00 175.35 175.65 1nm6 s TYR 225 N -2.33 0.18 0.40 3.18 1.51 -1.26 -4.73 117.35 114.30 1nm6 s TYR 225 Ca 0.32 -0.40 -0.23 0.00 -1.01 0.00 0.00 57.07 55.76 1nm6 s TYR 225 Cb -0.06 -0.14 -0.10 0.00 -0.11 0.00 0.00 41.96 41.55 1nm6 s TYR 225 CO 0.21 -0.23 0.98 0.20 -1.11 0.00 0.00 175.55 175.60 1nm6 s GLY 226 N -1.45 2.60 -0.05 0.71 0.00 -1.02 -4.70 107.32 103.42 1nm6 s GLY 226 Ca -0.15 0.54 0.03 0.00 0.00 0.00 0.00 44.72 45.13 1nm6 s GLY 226 CO -0.00 0.90 -0.12 -1.36 0.00 0.00 0.00 173.10 172.52 1nm6 s PHE 227 N -1.87 2.76 0.07 1.90 0.40 0.59 -1.52 117.98 120.31 1nm6 s PHE 227 Ca 0.58 -0.11 0.07 0.00 -0.60 0.00 0.00 56.93 56.88 1nm6 s PHE 227 Cb -0.16 -1.64 -0.03 0.00 0.51 0.00 0.00 43.02 41.70 1nm6 s PHE 227 CO 0.20 0.23 -0.20 0.71 0.70 0.00 0.00 175.22 176.87 1nm6 s TYR 228 N -0.77 1.73 0.06 0.36 1.51 0.31 -1.50 117.35 119.05 1nm6 s TYR 228 Ca 0.12 -0.39 -0.31 0.00 -1.01 0.00 0.00 57.07 55.48 1nm6 s TYR 228 Cb -0.11 -1.00 -0.06 0.00 -0.11 0.00 0.00 41.96 40.69 1nm6 s TYR 228 CO 0.01 0.13 1.26 0.99 -1.11 0.00 0.00 175.55 176.83 1nm6 s THR 229 N -0.96 3.85 -0.82 -0.71 2.01 0.01 -1.91 115.64 117.11 1nm6 s THR 229 Ca 0.06 1.31 -0.25 0.00 0.31 0.00 0.00 61.69 63.12 1nm6 s THR 229 Cb -0.09 -3.84 0.01 0.00 0.01 0.00 0.00 72.50 68.59 1nm6 s THR 229 CO 0.03 0.09 1.54 -2.28 -0.69 0.00 0.00 174.62 173.30 1nm6 s HIS 230 N 1.27 2.17 0.16 4.92 2.46 -0.06 -2.08 115.29 124.14 1nm6 s HIS 230 Ca 0.60 -0.03 -0.16 0.00 0.47 0.00 0.00 55.06 55.94 1nm6 s HIS 230 Cb -0.31 -4.46 0.09 0.00 -0.13 0.00 0.00 32.58 27.77 1nm6 s HIS 230 CO 0.29 -2.03 1.71 0.28 -2.47 0.00 0.00 174.74 172.52 1nm6 h VAL 231 N 6.60 0.76 -0.90 0.89 2.07 -1.63 -2.76 116.25 121.27 1nm6 h VAL 231 Ca -0.08 -0.05 0.04 0.00 0.82 0.00 0.00 66.70 67.43 1nm6 h VAL 231 Cb 1.05 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 31.36 1nm6 h VAL 231 CO 1.30 0.03 0.58 0.15 0.02 0.00 0.00 177.57 179.65 1nm6 h PHE 232 N 0.15 1.09 -0.26 1.57 3.57 -1.87 -1.62 116.94 119.57 1nm6 h PHE 232 Ca 0.18 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.79 1nm6 h PHE 232 Cb 0.24 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 1nm6 h PHE 232 CO -0.23 0.61 0.20 0.00 -2.23 0.00 0.00 178.31 176.66 1nm6 h ARG 233 N 1.11 0.00 -0.52 1.11 2.47 -1.87 -1.55 114.38 115.14 1nm6 h ARG 233 Ca 0.37 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.09 1nm6 h ARG 233 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1nm6 h ARG 233 CO -0.13 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.68 1nm6 n LEU 234 N -4.35 3.70 0.02 3.04 4.77 -0.67 -4.58 117.00 118.93 1nm6 n LEU 234 Ca 0.03 -2.18 0.03 0.00 -0.03 0.00 0.00 56.01 53.86 1nm6 n LEU 234 Cb 0.35 -0.41 0.40 0.00 -2.33 0.00 0.00 43.42 41.43 1nm6 n LEU 234 CO 0.34 0.82 1.07 0.50 -1.33 0.00 0.00 177.39 178.80 1nm6 h LYS 235 N 3.10 0.48 -0.29 3.23 3.64 -0.59 -2.40 116.57 123.74 1nm6 h LYS 235 Ca 0.00 -0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.39 1nm6 h LYS 235 Cb 1.02 -0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 32.67 1nm6 h LYS 235 CO 0.07 0.39 -0.23 0.87 -2.27 0.00 0.00 179.45 178.28 1nm6 h LYS 236 N 0.48 -0.20 -0.38 1.90 1.57 -1.81 0.28 116.57 118.41 1nm6 h LYS 236 Ca 0.12 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1nm6 h LYS 236 Cb 0.08 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 1nm6 h LYS 236 CO -0.01 -0.14 0.25 2.35 -0.57 0.00 0.00 179.45 181.33 1nm6 h TRP 237 N -0.21 0.48 -0.34 -1.35 7.01 -1.79 -1.41 115.95 118.34 1nm6 h TRP 237 Ca 0.15 0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.22 1nm6 h TRP 237 Cb 0.45 -0.16 -0.05 0.00 -2.10 0.00 0.00 29.16 27.29 1nm6 h TRP 237 CO -0.41 0.31 0.01 0.82 -2.79 0.00 0.00 178.44 176.38 1nm6 h ILE 238 N 0.51 0.76 -0.70 2.65 2.04 -0.94 -1.24 117.51 120.60 1nm6 h ILE 238 Ca 0.14 -0.04 -0.07 0.00 1.00 0.00 0.00 64.86 65.89 1nm6 h ILE 238 Cb -0.05 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 1nm6 h ILE 238 CO -0.03 0.02 0.15 -0.61 0.00 0.00 0.00 178.15 177.68 1nm6 h GLN 239 N 0.10 1.13 -0.40 2.37 5.75 -0.80 -1.94 115.11 121.31 1nm6 h GLN 239 Ca 0.16 -0.29 0.00 0.00 -0.15 0.00 0.00 58.65 58.38 1nm6 h GLN 239 Cb 0.22 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 1nm6 h GLN 239 CO -0.27 1.01 0.27 -0.22 -2.65 0.00 0.00 178.83 176.97 1nm6 h LYS 240 N 1.06 0.53 -0.11 1.69 3.64 -0.80 -2.18 116.57 120.40 1nm6 h LYS 240 Ca 0.22 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1nm6 h LYS 240 Cb 0.40 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1nm6 h LYS 240 CO 0.01 0.35 0.04 0.28 -2.27 0.00 0.00 179.45 177.86 1nm6 h VAL 241 N 0.54 1.16 0.29 2.00 2.07 -1.06 -2.49 116.25 118.75 1nm6 h VAL 241 Ca 0.15 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 1nm6 h VAL 241 Cb -0.06 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1nm6 h VAL 241 CO -0.03 0.14 -0.14 0.40 0.02 0.00 0.00 177.57 177.96 1nm6 h ILE 242 N 0.02 0.73 0.00 4.57 2.04 -1.22 -1.20 117.51 122.45 1nm6 h ILE 242 Ca 0.04 -0.07 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 1nm6 h ILE 242 Cb 0.18 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 1nm6 h ILE 242 CO -0.00 0.02 -0.44 -2.24 0.00 0.00 0.00 178.15 175.48 1nm6 h ASP 243 N -0.43 0.00 -0.16 1.72 3.04 -1.49 -2.65 116.42 116.45 1nm6 h ASP 243 Ca -0.04 0.00 -0.14 0.00 -3.24 0.00 0.00 57.03 53.61 1nm6 h ASP 243 Cb 0.32 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.62 1nm6 h ASP 243 CO 0.07 0.44 -0.44 -0.61 -2.04 0.00 0.00 179.24 176.66 1nm6 h GLN 244 N 0.00 0.58 -0.95 4.15 4.15 -1.37 -3.29 115.11 118.37 1nm6 h GLN 244 Ca -0.00 -0.41 -0.64 0.00 0.77 0.00 0.00 58.65 58.36 1nm6 h GLN 244 Cb 0.87 0.07 -0.31 0.00 0.21 0.00 0.00 27.48 28.32 1nm6 h GLN 244 CO 0.06 1.03 0.59 1.19 -1.93 0.00 0.00 178.83 179.76 1nm6 n PHE 245 N -4.24 3.12 -0.91 3.99 3.01 -0.46 -5.10 117.46 116.87 1nm6 n PHE 245 Ca -0.07 -2.83 0.00 0.00 1.01 0.00 0.00 57.45 55.56 1nm6 n PHE 245 Cb 0.56 -1.24 0.00 0.00 -0.01 0.00 0.00 39.48 38.79 1nm6 n PHE 245 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18