#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h7t s LYS 2 N 0.00 4.63 -0.02 -1.46 2.20 -1.26 -4.95 119.74 118.88 1h7t s LYS 2 Ca 0.00 1.54 0.04 0.00 -0.36 0.00 0.00 55.97 57.19 1h7t s LYS 2 Cb 0.00 -3.36 -0.00 0.00 -1.51 0.00 0.00 37.83 32.95 1h7t s LYS 2 CO 0.00 0.09 -0.13 0.00 -0.36 0.00 0.00 175.35 174.95 1h7t s ALA 3 N 0.21 1.15 0.08 3.13 0.00 -1.26 -0.61 121.76 124.46 1h7t s ALA 3 Ca 0.49 -0.54 0.06 0.00 0.00 0.00 0.00 51.96 51.97 1h7t s ALA 3 Cb -0.25 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 1h7t s ALA 3 CO 0.31 0.24 -0.15 0.14 0.00 0.00 0.00 175.76 176.30 1h7t s VAL 4 N -0.09 1.22 -0.18 0.00 -7.23 -0.78 -1.04 120.40 112.31 1h7t s VAL 4 Ca 0.01 -1.42 -0.06 0.00 -1.81 0.00 0.00 61.98 58.70 1h7t s VAL 4 Cb -0.08 -1.22 -0.03 0.00 0.56 0.00 0.00 36.38 35.61 1h7t s VAL 4 CO 0.00 -0.24 0.02 -0.63 -0.31 0.00 0.00 175.10 173.94 1h7t s ILE 5 N -1.44 4.39 -0.09 -0.62 1.01 -0.73 -1.44 121.20 122.29 1h7t s ILE 5 Ca 0.01 -0.17 0.02 0.00 0.00 0.00 0.00 60.65 60.51 1h7t s ILE 5 Cb -0.09 -2.97 -0.02 0.00 0.01 0.00 0.00 42.46 39.40 1h7t s ILE 5 CO 0.03 0.46 -0.15 -0.69 0.00 0.00 0.00 174.94 174.59 1h7t s VAL 6 N 0.46 2.97 -0.32 2.92 1.01 0.41 -0.82 120.40 127.05 1h7t s VAL 6 Ca 0.00 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.30 1h7t s VAL 6 Cb -0.13 -2.20 0.09 0.00 0.00 0.00 0.00 36.38 34.13 1h7t s VAL 6 CO 0.02 0.56 0.01 -0.63 0.00 0.00 0.00 175.10 175.05 1h7t s ILE 7 N -0.14 2.18 0.06 2.22 1.01 0.89 -1.85 121.20 125.57 1h7t s ILE 7 Ca -0.01 -2.11 -0.31 0.00 0.00 0.00 0.00 60.65 58.22 1h7t s ILE 7 Cb -0.14 -2.53 -0.07 0.00 0.01 0.00 0.00 42.46 39.74 1h7t s ILE 7 CO 0.03 -0.45 1.43 -2.84 0.00 0.00 0.00 174.94 173.11 1h7t s PRO 8 N 0.99 4.29 -0.34 2.79 0.02 -1.24 -0.86 135.00 140.65 1h7t s PRO 8 Ca 0.06 2.05 -0.00 0.00 0.02 0.00 0.00 61.00 63.12 1h7t s PRO 8 Cb -0.19 -3.44 0.14 0.00 0.02 0.00 0.00 34.50 31.02 1h7t s PRO 8 CO -0.08 -0.54 0.20 0.00 -0.33 0.00 0.00 177.00 176.26 1h7t s ALA 9 N 1.90 0.87 -0.19 -1.55 0.00 0.59 -3.11 121.76 120.27 1h7t s ALA 9 Ca 0.65 -1.76 -0.10 0.00 0.00 0.00 0.00 51.96 50.76 1h7t s ALA 9 Cb -0.35 -1.58 -0.05 0.00 0.00 0.00 0.00 23.12 21.15 1h7t s ALA 9 CO 0.29 -2.06 0.13 -0.98 0.00 0.00 0.00 175.76 173.14 1h7t s ARG 10 N 1.20 4.08 0.05 0.00 1.70 -1.26 -4.36 118.95 120.35 1h7t s ARG 10 Ca 0.17 -0.21 -0.31 0.00 -0.47 0.00 0.00 55.73 54.91 1h7t s ARG 10 Cb -0.22 -3.38 -0.17 0.00 -0.57 0.00 0.00 34.95 30.60 1h7t s ARG 10 CO -0.03 0.37 1.42 -0.92 -1.08 0.00 0.00 175.30 175.05 1h7t h TYR 11 N 6.43 -1.04 -0.95 5.89 3.20 -1.95 -3.44 116.97 125.11 1h7t h TYR 11 Ca -0.43 -0.02 -0.70 0.00 3.14 0.00 0.00 58.73 60.72 1h7t h TYR 11 Cb 1.16 0.34 -0.02 0.00 1.54 0.00 0.00 36.73 39.76 1h7t h TYR 11 CO 0.60 -0.65 1.34 0.41 -1.64 0.00 0.00 178.16 178.22 1h7t n GLY 12 N -1.43 0.43 2.95 1.82 0.00 -1.26 -2.94 105.19 104.76 1h7t n GLY 12 Ca -0.14 0.97 -0.12 0.00 0.00 0.00 0.00 46.02 46.73 1h7t n GLY 12 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1h7t s SER 13 N 6.59 -0.06 0.02 1.61 0.15 -1.26 -4.97 113.70 115.78 1h7t s SER 13 Ca 1.10 0.10 -0.19 0.00 0.70 0.00 0.00 55.95 57.66 1h7t s SER 13 Cb -1.00 0.14 -0.10 0.00 -1.71 0.00 0.00 66.02 63.35 1h7t s SER 13 CO 0.54 -0.04 1.09 0.77 1.20 0.00 0.00 173.24 176.79 1h7t h SER 14 N 5.94 -0.58 -0.36 5.45 4.64 -2.00 -3.19 113.55 123.44 1h7t h SER 14 Ca -0.25 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1h7t h SER 14 Cb 1.21 0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1h7t h SER 14 CO 0.46 -0.35 0.00 0.54 -0.87 0.00 0.00 176.83 176.61 1h7t n ARG 15 N -4.18 2.16 -2.74 4.77 1.74 -1.26 -4.48 116.66 112.66 1h7t n ARG 15 Ca -0.08 -1.42 -0.05 0.00 -0.77 0.00 0.00 57.85 55.52 1h7t n ARG 15 Cb 0.27 -1.45 0.03 0.00 -1.02 0.00 0.00 32.46 30.29 1h7t n ARG 15 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1h7t n LEU 16 N 0.53 -2.90 -4.69 0.55 4.77 -1.25 -4.88 117.00 109.13 1h7t n LEU 16 Ca 0.13 -2.71 -0.42 0.00 -0.03 0.00 0.00 56.01 52.98 1h7t n LEU 16 Cb 0.42 0.74 -0.03 0.00 -2.33 0.00 0.00 43.42 42.23 1h7t n LEU 16 CO 0.11 1.84 1.46 -2.16 -1.33 0.00 0.00 177.39 177.30 1h7t s PRO 17 N 0.78 4.15 -0.53 3.23 0.04 -1.21 -2.42 135.00 139.05 1h7t s PRO 17 Ca 0.30 2.53 -0.00 0.00 0.04 0.00 0.00 61.00 63.86 1h7t s PRO 17 Cb 0.10 -3.67 -0.00 0.00 0.04 0.00 0.00 34.50 30.96 1h7t s PRO 17 CO -0.12 -0.83 0.44 0.41 0.04 0.00 0.00 177.00 176.94 1h7t n GLY 18 N 4.22 0.07 0.17 0.56 0.00 -1.15 -4.98 105.19 104.09 1h7t n GLY 18 Ca 0.18 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1h7t n GLY 18 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1h7t h LYS 19 N -0.80 0.51 0.00 1.61 3.64 -1.57 -3.04 116.57 116.92 1h7t h LYS 19 Ca -0.26 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1h7t h LYS 19 Cb 1.15 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1h7t h LYS 19 CO 0.22 0.52 0.00 -1.00 -2.27 0.00 0.00 179.45 176.92 1h7t h PRO 20 N 0.40 0.00 -0.01 1.90 0.13 -1.86 -2.71 132.00 129.85 1h7t h PRO 20 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1h7t h PRO 20 Cb 0.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.33 1h7t h PRO 20 CO -0.01 0.00 -0.18 1.28 -0.23 0.00 0.00 178.00 178.86 1h7t n LEU 21 N -2.92 1.60 -4.76 1.56 4.77 -1.15 -0.71 117.00 115.38 1h7t n LEU 21 Ca -0.01 -0.52 -0.41 0.00 -0.03 0.00 0.00 56.01 55.04 1h7t n LEU 21 Cb 0.20 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1h7t n LEU 21 CO 0.23 0.28 1.21 -0.76 -1.33 0.00 0.00 177.39 177.01 1h7t s LEU 22 N -2.27 4.33 0.24 2.23 1.43 -1.02 -4.51 118.68 119.10 1h7t s LEU 22 Ca 0.28 3.02 -0.30 0.00 -1.03 0.00 0.00 54.13 56.11 1h7t s LEU 22 Cb 0.20 -3.65 -0.09 0.00 0.03 0.00 0.00 46.19 42.68 1h7t s LEU 22 CO 0.44 -0.91 1.11 -0.62 0.23 0.00 0.00 176.35 176.60 1h7t s ASP 23 N 0.21 7.25 -0.17 2.29 -1.08 -1.26 -0.79 116.67 123.11 1h7t s ASP 23 Ca 0.59 2.21 -0.04 0.00 -0.52 0.00 0.00 52.55 54.79 1h7t s ASP 23 Cb -0.48 -2.62 0.08 0.00 -1.46 0.00 0.00 42.92 38.44 1h7t s ASP 23 CO 0.56 -0.19 0.17 -0.63 0.52 0.00 0.00 175.17 175.60 1h7t s ILE 24 N -0.77 -0.25 -1.64 4.11 1.01 -0.16 -4.87 121.20 118.63 1h7t s ILE 24 Ca 0.47 -0.05 -0.13 0.00 0.00 0.00 0.00 60.65 60.94 1h7t s ILE 24 Cb -0.31 -0.58 0.11 0.00 0.01 0.00 0.00 42.46 41.68 1h7t s ILE 24 CO 0.39 -0.17 0.59 1.33 0.00 0.00 0.00 174.94 177.08 1h7t n VAL 25 N 5.31 -1.42 -0.25 2.92 0.24 -1.26 -1.60 118.33 122.27 1h7t n VAL 25 Ca -0.06 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 1h7t n VAL 25 Cb 0.49 -1.72 0.00 0.00 -1.47 0.00 0.00 33.84 31.14 1h7t n VAL 25 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1h7t n GLY 26 N -1.64 1.16 3.27 7.63 0.00 -1.26 -5.05 105.19 109.29 1h7t n GLY 26 Ca -0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 1h7t n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h7t s LYS 27 N -0.49 1.09 0.48 1.61 1.02 -0.63 -5.08 119.74 117.74 1h7t s LYS 27 Ca 0.00 -1.16 -0.23 0.00 0.02 0.00 0.00 55.97 54.60 1h7t s LYS 27 Cb 0.00 -1.27 -0.07 0.00 -0.52 0.00 0.00 37.83 35.97 1h7t s LYS 27 CO 0.00 0.29 1.26 -2.14 -0.92 0.00 0.00 175.35 173.84 1h7t s PRO 28 N -2.01 3.58 0.29 -1.68 0.02 -1.26 -0.99 135.00 132.94 1h7t s PRO 28 Ca 0.06 2.02 0.02 0.00 0.02 0.00 0.00 61.00 63.12 1h7t s PRO 28 Cb -0.09 -2.42 0.59 0.00 0.02 0.00 0.00 34.50 32.59 1h7t s PRO 28 CO 0.04 -0.77 1.82 1.98 -0.33 0.00 0.00 177.00 179.75 1h7t h MET 29 N 1.97 0.92 -0.34 5.54 1.85 -0.31 -0.24 114.93 124.32 1h7t h MET 29 Ca -0.50 -0.06 0.03 0.00 -0.61 0.00 0.00 59.70 58.56 1h7t h MET 29 Cb 1.27 -0.21 -0.02 0.00 0.43 0.00 0.00 31.60 33.07 1h7t h MET 29 CO 0.60 0.61 0.23 0.97 -0.40 0.00 0.00 176.91 178.91 1h7t h ILE 30 N 0.94 1.02 -0.52 1.77 6.09 -1.15 -1.92 117.51 123.76 1h7t h ILE 30 Ca 0.51 -0.12 -0.08 0.00 -1.37 0.00 0.00 64.86 63.81 1h7t h ILE 30 Cb 0.57 0.64 -0.02 0.00 0.47 0.00 0.00 36.82 38.48 1h7t h ILE 30 CO -0.29 0.06 0.03 -0.61 -3.07 0.00 0.00 178.15 174.27 1h7t h GLN 31 N 0.36 0.89 -0.78 2.19 4.15 -1.30 -1.81 115.11 118.80 1h7t h GLN 31 Ca 0.14 -0.27 0.03 0.00 0.77 0.00 0.00 58.65 59.31 1h7t h GLN 31 Cb 0.11 -0.09 -0.05 0.00 0.21 0.00 0.00 27.48 27.66 1h7t h GLN 31 CO -0.03 0.91 0.50 0.45 -1.93 0.00 0.00 178.83 178.73 1h7t h HIS 32 N 0.77 0.94 -0.37 3.99 3.86 -1.25 0.21 115.15 123.30 1h7t h HIS 32 Ca 0.15 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.33 1h7t h HIS 32 Cb 0.48 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 1h7t h HIS 32 CO 0.04 0.55 0.03 0.28 0.86 0.00 0.00 177.93 179.69 1h7t h VAL 33 N 0.98 1.25 -0.43 2.45 2.07 -1.35 -1.71 116.25 119.52 1h7t h VAL 33 Ca 0.31 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 1h7t h VAL 33 Cb -0.00 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1h7t h VAL 33 CO -0.11 0.31 0.23 0.22 0.02 0.00 0.00 177.57 178.25 1h7t h TYR 34 N 0.46 0.59 -0.87 1.57 5.03 -0.70 0.22 116.97 123.27 1h7t h TYR 34 Ca 0.11 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.39 1h7t h TYR 34 Cb 0.41 -0.19 -0.04 0.00 1.55 0.00 0.00 36.73 38.46 1h7t h TYR 34 CO 0.03 0.45 0.50 0.93 -1.32 0.00 0.00 178.16 178.75 1h7t h GLU 35 N 0.56 1.21 -0.07 1.82 5.08 -0.52 -1.32 114.58 121.34 1h7t h GLU 35 Ca 0.15 -0.13 -0.18 0.00 -1.00 0.00 0.00 59.36 58.20 1h7t h GLU 35 Cb 0.05 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1h7t h GLU 35 CO -0.02 0.87 -0.73 0.00 -1.00 0.00 0.00 179.01 178.13 1h7t h ARG 36 N 1.21 0.37 -0.42 2.33 3.08 -0.95 -3.03 114.38 116.97 1h7t h ARG 36 Ca 0.31 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1h7t h ARG 36 Cb -0.00 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 1h7t h ARG 36 CO -0.05 0.95 0.15 0.00 -1.07 0.00 0.00 179.97 179.95 1h7t h ALA 37 N 0.97 1.48 0.00 0.04 0.00 -0.05 -1.71 119.26 119.99 1h7t h ALA 37 Ca -0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1h7t h ALA 37 Cb 1.30 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1h7t h ALA 37 CO 0.12 0.40 -0.05 -0.07 0.00 0.00 0.00 179.25 179.66 1h7t h LEU 38 N 0.60 0.00 -0.21 0.00 3.38 -1.13 -2.57 115.31 115.39 1h7t h LEU 38 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1h7t h LEU 38 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1h7t h LEU 38 CO -0.01 0.05 -0.14 0.00 0.09 0.00 0.00 178.44 178.42 1h7t n GLN 39 N -3.25 0.58 -2.49 1.13 6.02 -0.64 -4.81 117.38 113.92 1h7t n GLN 39 Ca -0.01 -0.21 -0.43 0.00 -0.01 0.00 0.00 57.00 56.34 1h7t n GLN 39 Cb 0.23 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.97 1h7t n GLN 39 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1h7t s VAL 40 N -2.56 4.19 0.29 5.09 1.01 -0.97 -4.97 120.40 122.48 1h7t s VAL 40 Ca 0.26 1.31 -0.29 0.00 0.00 0.00 0.00 61.98 63.26 1h7t s VAL 40 Cb 0.20 -4.31 -0.10 0.00 0.00 0.00 0.00 36.38 32.17 1h7t s VAL 40 CO 0.50 -0.63 1.33 0.00 0.00 0.00 0.00 175.10 176.30 1h7t s ALA 41 N 4.41 3.53 0.00 5.51 0.00 -1.26 -3.43 121.76 130.52 1h7t s ALA 41 Ca 0.53 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.72 1h7t s ALA 41 Cb -0.13 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1h7t s ALA 41 CO 0.25 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.80 1h7t n GLY 42 N 1.43 0.62 3.69 0.00 0.00 -1.26 -4.92 105.19 104.74 1h7t n GLY 42 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1h7t n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h7t s VAL 43 N -2.32 5.10 -0.06 1.61 1.01 -1.22 -4.45 120.40 120.07 1h7t s VAL 43 Ca 0.00 0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.92 1h7t s VAL 43 Cb 0.00 -3.31 -0.09 0.00 0.00 0.00 0.00 36.38 32.98 1h7t s VAL 43 CO 0.00 0.46 0.54 0.00 0.00 0.00 0.00 175.10 176.10 1h7t h ALA 44 N 6.63 -0.29 -2.23 5.51 0.00 -1.45 -3.48 119.26 123.95 1h7t h ALA 44 Ca -0.39 -0.14 -0.34 0.00 0.00 0.00 0.00 54.91 54.03 1h7t h ALA 44 Cb 1.16 0.11 -0.14 0.00 0.00 0.00 0.00 17.79 18.92 1h7t h ALA 44 CO 0.73 -0.30 -0.67 -1.21 0.00 0.00 0.00 179.25 177.80 1h7t s GLU 45 N -2.84 1.21 -0.09 0.00 2.02 -1.26 -5.08 118.70 112.67 1h7t s GLU 45 Ca -0.08 -1.58 -0.00 0.00 0.02 0.00 0.00 54.97 53.33 1h7t s GLU 45 Cb 0.00 -0.54 0.02 0.00 0.10 0.00 0.00 34.13 33.72 1h7t s GLU 45 CO 0.27 -0.06 -0.05 0.08 0.02 0.00 0.00 175.26 175.52 1h7t s VAL 46 N -3.45 0.78 0.15 2.63 1.01 -1.26 -1.77 120.40 118.49 1h7t s VAL 46 Ca 0.24 -0.15 0.10 0.00 0.00 0.00 0.00 61.98 62.17 1h7t s VAL 46 Cb 0.05 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 1h7t s VAL 46 CO 0.05 0.32 -0.23 0.26 0.00 0.00 0.00 175.10 175.50 1h7t s TRP 47 N 1.62 2.10 -0.23 5.22 0.52 -0.00 -4.28 118.94 123.90 1h7t s TRP 47 Ca 0.02 -0.40 -0.02 0.00 0.02 0.00 0.00 56.10 55.72 1h7t s TRP 47 Cb -0.13 -1.09 0.01 0.00 -1.15 0.00 0.00 33.47 31.11 1h7t s TRP 47 CO -0.05 0.36 -0.07 0.08 0.02 0.00 0.00 176.95 177.29 1h7t s VAL 48 N -1.47 2.98 -0.25 4.03 1.01 -0.20 -0.08 120.40 126.42 1h7t s VAL 48 Ca 0.15 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 61.17 1h7t s VAL 48 Cb -0.08 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 1h7t s VAL 48 CO 0.07 0.33 0.43 0.00 0.00 0.00 0.00 175.10 175.93 1h7t s ALA 49 N 1.38 3.57 0.05 5.51 0.00 -0.04 -1.81 121.76 130.43 1h7t s ALA 49 Ca 0.03 -0.66 -0.01 0.00 0.00 0.00 0.00 51.96 51.32 1h7t s ALA 49 Cb -0.15 -2.75 -0.04 0.00 0.00 0.00 0.00 23.12 20.18 1h7t s ALA 49 CO -0.05 -0.59 -0.02 -0.08 0.00 0.00 0.00 175.76 175.02 1h7t s THR 50 N 1.95 0.21 0.00 0.00 -1.32 -0.90 -0.30 115.64 115.28 1h7t s THR 50 Ca 0.18 -1.79 0.00 0.00 -1.21 0.00 0.00 61.69 58.88 1h7t s THR 50 Cb -0.15 -1.52 0.00 0.00 -1.51 0.00 0.00 72.50 69.31 1h7t s THR 50 CO 0.09 -0.97 0.93 -0.90 -2.21 0.00 0.00 174.62 171.56 1h7t n ASP 51 N 0.10 1.86 -4.02 8.08 5.75 -1.26 -0.17 116.55 126.89 1h7t n ASP 51 Ca -0.14 -1.86 -0.28 0.00 -0.01 0.00 0.00 54.79 52.50 1h7t n ASP 51 Cb 0.61 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.53 1h7t n ASP 51 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1h7t s ASP 52 N -0.86 2.29 0.46 -1.12 -1.08 -1.26 -4.83 116.67 110.26 1h7t s ASP 52 Ca 0.00 -0.38 0.16 0.00 -0.52 0.00 0.00 52.55 51.81 1h7t s ASP 52 Cb 0.00 -1.00 1.12 0.00 -1.46 0.00 0.00 42.92 41.58 1h7t s ASP 52 CO 0.00 -0.01 1.99 1.55 0.52 0.00 0.00 175.17 179.21 1h7t h PRO 53 N 7.54 0.30 -0.63 4.34 0.13 -1.99 -1.60 132.00 140.09 1h7t h PRO 53 Ca -0.32 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.71 1h7t h PRO 53 Cb 1.16 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 1h7t h PRO 53 CO 0.48 0.20 0.06 0.00 -0.23 0.00 0.00 178.00 178.50 1h7t h ARG 54 N 0.30 1.07 -0.40 0.86 3.08 -1.99 -0.16 114.38 117.15 1h7t h ARG 54 Ca 0.27 -0.31 -0.14 0.00 0.07 0.00 0.00 59.98 59.86 1h7t h ARG 54 Cb 0.64 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1h7t h ARG 54 CO -0.06 1.01 -0.31 0.28 -1.07 0.00 0.00 179.97 179.82 1h7t h VAL 55 N 0.99 1.27 -0.78 2.04 2.07 -1.69 -1.90 116.25 118.26 1h7t h VAL 55 Ca 0.19 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.21 1h7t h VAL 55 Cb 0.49 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 1h7t h VAL 55 CO 0.02 0.50 0.45 -0.08 0.02 0.00 0.00 177.57 178.47 1h7t h GLU 56 N 0.74 1.08 -0.04 1.57 4.81 -1.13 -1.73 114.58 119.88 1h7t h GLU 56 Ca 0.07 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1h7t h GLU 56 Cb 0.90 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.06 1h7t h GLU 56 CO 0.08 0.78 0.02 1.96 -0.73 0.00 0.00 179.01 181.12 1h7t h GLN 57 N 1.08 0.05 -0.32 1.92 1.08 -0.89 -2.01 115.11 116.02 1h7t h GLN 57 Ca 0.28 -0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.50 1h7t h GLN 57 Cb 0.00 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 1h7t h GLN 57 CO -0.05 0.15 0.22 0.00 -0.95 0.00 0.00 178.83 178.20 1h7t h ALA 58 N 0.90 1.89 -0.02 3.87 0.00 -1.04 0.19 119.26 125.06 1h7t h ALA 58 Ca 0.01 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 1h7t h ALA 58 Cb 0.12 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1h7t h ALA 58 CO -0.00 0.07 -0.59 0.28 0.00 0.00 0.00 179.25 179.01 1h7t h VAL 59 N 0.34 1.42 -0.24 0.00 2.07 -1.15 -3.22 116.25 115.46 1h7t h VAL 59 Ca 0.13 -2.04 -0.09 0.00 0.82 0.00 0.00 66.70 65.52 1h7t h VAL 59 Cb 0.11 2.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 1h7t h VAL 59 CO -0.03 0.60 -0.25 1.56 0.02 0.00 0.00 177.57 179.47 1h7t h GLN 60 N -0.06 0.46 -0.35 1.57 4.20 -0.95 0.23 115.11 120.21 1h7t h GLN 60 Ca -0.07 -0.17 0.10 0.00 0.06 0.00 0.00 58.65 58.57 1h7t h GLN 60 Cb 1.29 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 1h7t h GLN 60 CO 0.12 0.67 0.28 0.00 -0.67 0.00 0.00 178.83 179.23 1h7t h ALA 61 N 1.33 2.23 -0.47 3.87 0.00 -0.64 0.19 119.26 125.78 1h7t h ALA 61 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1h7t h ALA 61 Cb 0.65 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1h7t h ALA 61 CO 0.05 -0.46 0.00 1.97 0.00 0.00 0.00 179.25 180.81 1h7t n PHE 62 N -4.24 0.74 -0.93 0.00 1.16 -1.01 -4.96 117.46 108.22 1h7t n PHE 62 Ca 0.05 -0.54 0.00 0.00 -1.87 0.00 0.00 57.45 55.09 1h7t n PHE 62 Cb 0.45 -0.07 0.00 0.00 -1.61 0.00 0.00 39.48 38.26 1h7t n PHE 62 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1h7t n GLY 63 N 0.78 0.50 3.92 4.97 0.00 0.68 -5.07 105.19 110.97 1h7t n GLY 63 Ca 0.17 -0.90 -0.26 0.00 0.00 0.00 0.00 46.02 45.03 1h7t n GLY 63 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h7t s GLY 64 N -2.83 1.53 -0.24 -0.02 0.00 0.79 -4.97 107.32 101.58 1h7t s GLY 64 Ca 0.00 -0.67 -0.22 0.00 0.00 0.00 0.00 44.72 43.83 1h7t s GLY 64 CO 0.00 -0.56 0.69 0.54 0.00 0.00 0.00 173.10 173.77 1h7t s LYS 65 N -4.27 4.16 0.17 2.90 1.02 -1.26 -3.98 119.74 118.48 1h7t s LYS 65 Ca 0.44 0.68 0.09 0.00 0.02 0.00 0.00 55.97 57.20 1h7t s LYS 65 Cb -0.10 -3.63 -0.04 0.00 -0.52 0.00 0.00 37.83 33.54 1h7t s LYS 65 CO 0.37 -0.40 -0.13 0.00 -0.92 0.00 0.00 175.35 174.28 1h7t s ALA 66 N 2.45 2.85 -0.12 5.17 0.00 -1.26 -1.03 121.76 129.81 1h7t s ALA 66 Ca 0.29 -1.47 -0.04 0.00 0.00 0.00 0.00 51.96 50.74 1h7t s ALA 66 Cb -0.16 -0.67 0.06 0.00 0.00 0.00 0.00 23.12 22.35 1h7t s ALA 66 CO 0.09 0.49 0.24 -1.50 0.00 0.00 0.00 175.76 175.07 1h7t s ILE 67 N -1.59 -0.38 0.29 0.00 2.07 -0.75 -4.91 121.20 115.94 1h7t s ILE 67 Ca 0.23 0.29 -0.29 0.00 -1.41 0.00 0.00 60.65 59.47 1h7t s ILE 67 Cb -0.09 -0.41 -0.10 0.00 0.13 0.00 0.00 42.46 41.99 1h7t s ILE 67 CO 0.14 0.12 1.14 -0.04 -1.91 0.00 0.00 174.94 174.39 1h7t s MET 68 N 2.39 4.56 0.24 3.50 -1.94 -1.26 -2.11 119.30 124.68 1h7t s MET 68 Ca 0.02 1.89 0.03 0.00 -1.71 0.00 0.00 55.69 55.92 1h7t s MET 68 Cb -0.12 -3.15 -0.05 0.00 2.01 0.00 0.00 34.83 33.52 1h7t s MET 68 CO -0.08 0.11 0.03 0.95 -0.01 0.00 0.00 175.02 176.02 1h7t s THR 69 N -1.17 0.89 0.66 2.05 -4.23 0.76 -4.89 115.64 109.71 1h7t s THR 69 Ca 0.46 -2.01 -0.16 0.00 -1.18 0.00 0.00 61.69 58.79 1h7t s THR 69 Cb -0.33 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.06 1h7t s THR 69 CO 0.43 -0.22 1.18 -0.13 -0.54 0.00 0.00 174.62 175.35 1h7t s ARG 70 N -3.92 2.60 0.03 3.99 0.52 -1.26 -4.37 118.95 116.55 1h7t s ARG 70 Ca 0.31 1.69 0.23 0.00 -0.52 0.00 0.00 55.73 57.44 1h7t s ARG 70 Cb 0.07 -1.90 0.04 0.00 0.52 0.00 0.00 34.95 33.68 1h7t s ARG 70 CO 0.10 -1.46 1.03 0.27 0.02 0.00 0.00 175.30 175.26 1h7t n ASN 71 N -2.23 0.64 -0.21 0.23 6.94 -1.26 -4.13 115.26 115.24 1h7t n ASN 71 Ca 0.13 -0.34 0.05 0.00 -0.02 0.00 0.00 54.58 54.40 1h7t n ASN 71 Cb 0.50 0.81 0.25 0.00 -2.36 0.00 0.00 39.78 38.98 1h7t n ASN 71 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1h7t n ASP 72 N -1.84 0.61 -4.65 0.53 5.68 -1.26 -4.87 116.55 110.76 1h7t n ASP 72 Ca 0.02 -1.79 -0.42 0.00 -0.50 0.00 0.00 54.79 52.10 1h7t n ASP 72 Cb 0.41 -0.06 -0.03 0.00 -1.14 0.00 0.00 41.12 40.30 1h7t n ASP 72 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 1h7t s HIS 73 N -1.88 1.95 0.12 2.11 3.76 -1.26 -4.91 115.29 115.18 1h7t s HIS 73 Ca 0.17 0.29 -0.12 0.00 -0.15 0.00 0.00 55.06 55.25 1h7t s HIS 73 Cb 0.09 -3.95 -0.07 0.00 1.11 0.00 0.00 32.58 29.76 1h7t s HIS 73 CO 0.13 -3.65 1.44 1.05 -0.85 0.00 0.00 174.74 172.86 1h7t h GLU 74 N 10.23 0.85 -6.14 1.40 4.11 -1.97 -3.46 114.58 119.60 1h7t h GLU 74 Ca -0.38 -0.46 -0.56 0.00 0.07 0.00 0.00 59.36 58.03 1h7t h GLU 74 Cb 1.18 0.02 -0.22 0.00 0.50 0.00 0.00 28.75 30.23 1h7t h GLU 74 CO 0.97 1.10 -0.83 -1.54 0.07 0.00 0.00 179.01 178.79 1h7t s SER 75 N -6.76 2.52 0.25 3.06 1.04 -1.26 -5.02 113.70 107.52 1h7t s SER 75 Ca -0.11 -0.68 0.19 0.00 0.48 0.00 0.00 55.95 55.83 1h7t s SER 75 Cb 0.10 -0.14 0.94 0.00 0.10 0.00 0.00 66.02 67.02 1h7t s SER 75 CO 0.87 0.06 1.58 0.61 0.98 0.00 0.00 173.24 177.33 1h7t n GLY 76 N 1.13 -0.93 0.08 7.32 0.00 -1.26 -1.57 105.19 109.96 1h7t n GLY 76 Ca -0.19 0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 1h7t n GLY 76 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1h7t h THR 77 N 0.00 1.11 -0.38 2.61 2.02 -1.99 -3.17 112.91 113.11 1h7t h THR 77 Ca 0.00 -2.84 -0.10 0.00 0.77 0.00 0.00 66.41 64.24 1h7t h THR 77 Cb 0.10 2.52 -0.02 0.00 -1.74 0.00 0.00 68.15 69.02 1h7t h THR 77 CO 0.00 0.63 -0.17 0.44 0.37 0.00 0.00 175.52 176.80 1h7t h ASP 78 N 0.00 0.71 -0.84 4.18 3.32 -1.71 -2.02 116.42 120.06 1h7t h ASP 78 Ca -0.15 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 56.66 1h7t h ASP 78 Cb 1.83 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 41.14 1h7t h ASP 78 CO 0.09 0.89 0.51 -0.09 -1.72 0.00 0.00 179.24 178.92 1h7t h ARG 79 N 0.64 1.15 0.00 3.56 2.43 -1.57 -1.53 114.38 119.04 1h7t h ARG 79 Ca 0.10 -0.10 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1h7t h ARG 79 Cb 0.64 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 1h7t h ARG 79 CO 0.05 0.80 -0.41 1.25 -1.51 0.00 0.00 179.97 180.15 1h7t h LEU 80 N 1.17 0.00 -0.50 3.80 5.85 -1.39 -2.63 115.31 121.61 1h7t h LEU 80 Ca 0.30 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.88 1h7t h LEU 80 Cb -0.05 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1h7t h LEU 80 CO -0.06 0.41 -0.31 0.58 -0.34 0.00 0.00 178.44 178.72 1h7t h VAL 81 N 0.00 1.27 -0.46 1.05 2.07 -0.60 -1.27 116.25 118.31 1h7t h VAL 81 Ca -0.00 -1.48 -0.11 0.00 0.82 0.00 0.00 66.70 65.93 1h7t h VAL 81 Cb 0.88 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 1h7t h VAL 81 CO 0.05 0.50 -0.12 -0.08 0.02 0.00 0.00 177.57 177.94 1h7t h GLU 82 N 0.75 0.90 -0.32 1.57 4.81 -1.22 -2.83 114.58 118.25 1h7t h GLU 82 Ca 0.08 -0.35 -0.07 0.00 -0.13 0.00 0.00 59.36 58.89 1h7t h GLU 82 Cb 0.88 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 1h7t h GLU 82 CO 0.08 1.00 -0.11 0.28 -0.73 0.00 0.00 179.01 179.52 1h7t h VAL 83 N 0.74 1.23 -0.77 0.32 2.07 -1.40 -3.02 116.25 115.43 1h7t h VAL 83 Ca 0.12 -1.03 0.04 0.00 0.82 0.00 0.00 66.70 66.65 1h7t h VAL 83 Cb 0.67 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 1h7t h VAL 83 CO 0.05 0.34 0.50 -0.03 0.02 0.00 0.00 177.57 178.45 1h7t h MET 84 N 0.50 0.90 -0.24 1.57 1.85 -0.98 0.24 114.93 118.77 1h7t h MET 84 Ca 0.09 -0.05 -0.07 0.00 -0.61 0.00 0.00 59.70 59.06 1h7t h MET 84 Cb 0.50 -0.20 -0.01 0.00 0.43 0.00 0.00 31.60 32.31 1h7t h MET 84 CO 0.03 0.60 -0.16 0.45 -0.40 0.00 0.00 176.91 177.42 1h7t h HIS 85 N 0.93 0.45 0.01 1.39 -0.00 -1.42 -3.32 115.15 113.19 1h7t h HIS 85 Ca 0.31 -0.07 -0.26 0.00 -0.00 0.00 0.00 60.37 60.34 1h7t h HIS 85 Cb 0.06 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 27.32 1h7t h HIS 85 CO -0.00 0.57 -1.42 1.63 -0.00 0.00 0.00 177.93 178.70 1h7t n LYS 86 N -4.19 0.58 -3.18 2.45 5.02 -0.88 -4.83 118.16 113.13 1h7t n LYS 86 Ca 0.00 0.53 -0.42 0.00 -2.02 0.00 0.00 58.31 56.40 1h7t n LYS 86 Cb 0.33 -1.72 -0.07 0.00 -0.02 0.00 0.00 35.03 33.55 1h7t n LYS 86 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1h7t s VAL 87 N -2.39 4.96 0.06 -0.18 1.01 0.81 -5.05 120.40 119.62 1h7t s VAL 87 Ca -0.29 0.44 -0.25 0.00 0.00 0.00 0.00 61.98 61.88 1h7t s VAL 87 Cb 0.07 -4.02 -0.06 0.00 0.00 0.00 0.00 36.38 32.37 1h7t s VAL 87 CO 0.60 -0.27 0.77 -0.70 0.00 0.00 0.00 175.10 175.50 1h7t s GLU 88 N 2.54 4.51 0.07 2.72 2.12 -1.26 -4.47 118.70 124.93 1h7t s GLU 88 Ca 0.21 1.09 -0.27 0.00 0.36 0.00 0.00 54.97 56.36 1h7t s GLU 88 Cb -0.15 -3.35 0.08 0.00 0.26 0.00 0.00 34.13 30.97 1h7t s GLU 88 CO 0.14 0.31 0.91 0.00 -0.54 0.00 0.00 175.26 176.08 1h7t s ALA 89 N -0.18 -1.74 -0.13 6.30 0.00 -1.26 -4.95 121.76 119.80 1h7t s ALA 89 Ca 0.39 0.59 0.16 0.00 0.00 0.00 0.00 51.96 53.09 1h7t s ALA 89 Cb -0.21 0.54 -0.24 0.00 0.00 0.00 0.00 23.12 23.21 1h7t s ALA 89 CO 0.24 -0.85 0.34 -0.25 0.00 0.00 0.00 175.76 175.23 1h7t n ASP 90 N -0.35 0.38 -3.90 0.00 8.00 0.22 -4.69 116.55 116.21 1h7t n ASP 90 Ca -0.08 0.18 -0.23 0.00 0.71 0.00 0.00 54.79 55.37 1h7t n ASP 90 Cb 0.61 0.56 -0.17 0.00 -0.02 0.00 0.00 41.12 42.11 1h7t n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1h7t s ILE 91 N -2.56 0.74 -0.17 0.53 1.01 -0.96 -1.18 121.20 118.62 1h7t s ILE 91 Ca -0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 60.65 60.36 1h7t s ILE 91 Cb 0.07 -0.76 -0.02 0.00 0.01 0.00 0.00 42.46 41.76 1h7t s ILE 91 CO 0.83 0.29 -0.07 -0.31 0.00 0.00 0.00 174.94 175.68 1h7t s TYR 92 N 1.22 2.92 -0.18 3.97 1.51 0.07 -1.86 117.35 124.99 1h7t s TYR 92 Ca -0.06 -0.63 -0.06 0.00 -1.01 0.00 0.00 57.07 55.31 1h7t s TYR 92 Cb -0.14 -1.96 -0.03 0.00 -0.11 0.00 0.00 41.96 39.71 1h7t s TYR 92 CO -0.02 -0.27 0.02 0.42 -1.11 0.00 0.00 175.55 174.60 1h7t s ILE 93 N 0.72 4.36 -0.45 2.71 1.01 -0.52 -0.13 121.20 128.90 1h7t s ILE 93 Ca -0.03 -0.18 -0.11 0.00 0.00 0.00 0.00 60.65 60.32 1h7t s ILE 93 Cb -0.15 -2.96 0.09 0.00 0.01 0.00 0.00 42.46 39.45 1h7t s ILE 93 CO 0.02 0.45 0.32 0.21 0.00 0.00 0.00 174.94 175.95 1h7t s ASN 94 N 0.56 5.82 0.08 3.58 2.47 0.37 -0.44 114.94 127.38 1h7t s ASN 94 Ca 0.01 -1.53 -0.03 0.00 0.42 0.00 0.00 52.86 51.72 1h7t s ASN 94 Cb -0.13 -2.06 -0.05 0.00 -1.45 0.00 0.00 41.25 37.56 1h7t s ASN 94 CO 0.02 -0.61 0.29 -0.76 -3.72 0.00 0.00 177.10 172.32 1h7t s LEU 95 N 1.48 4.32 -0.09 3.21 1.43 -0.77 -3.04 118.68 125.23 1h7t s LEU 95 Ca 0.04 0.46 -0.21 0.00 -1.03 0.00 0.00 54.13 53.39 1h7t s LEU 95 Cb -0.24 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.89 1h7t s LEU 95 CO 0.03 0.14 0.60 -1.10 0.23 0.00 0.00 176.35 176.25 1h7t s GLN 96 N -2.42 4.39 0.00 1.70 -1.52 -1.26 -3.65 119.66 116.90 1h7t s GLN 96 Ca 0.36 0.69 0.08 0.00 -1.95 0.00 0.00 55.36 54.54 1h7t s GLN 96 Cb -0.13 -3.44 0.44 0.00 -0.22 0.00 0.00 33.01 29.66 1h7t s GLN 96 CO 0.24 0.10 1.12 0.41 -0.25 0.00 0.00 175.29 176.91 1h7t n GLY 97 N 3.18 -0.53 0.80 3.09 0.00 -1.18 -2.81 105.19 107.74 1h7t n GLY 97 Ca -0.04 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.02 1h7t n GLY 97 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1h7t n ASP 98 N -1.25 3.62 -3.74 1.61 5.75 -1.26 -4.49 116.55 116.79 1h7t n ASP 98 Ca 0.04 -2.84 -0.28 0.00 -0.01 0.00 0.00 54.79 51.70 1h7t n ASP 98 Cb 0.06 -0.48 -0.11 0.00 -1.03 0.00 0.00 41.12 39.56 1h7t n ASP 98 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1h7t n GLU 99 N -0.40 1.83 0.16 0.11 1.02 -1.12 -2.41 120.64 119.83 1h7t n GLU 99 Ca 0.19 -4.40 0.12 0.00 -0.02 0.00 0.00 57.16 53.06 1h7t n GLU 99 Cb 0.80 -2.21 0.58 0.00 -0.02 0.00 0.00 31.44 30.59 1h7t n GLU 99 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1h7t h PRO 100 N 5.11 0.00 -0.65 3.49 0.13 -1.86 -3.03 132.00 135.19 1h7t h PRO 100 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1h7t h PRO 100 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1h7t h PRO 100 CO 0.71 0.00 0.00 -1.33 -0.23 0.00 0.00 178.00 177.15 1h7t n MET 101 N -2.34 4.10 -1.72 0.86 2.81 -1.26 -4.63 117.12 114.94 1h7t n MET 101 Ca 0.00 -2.60 -0.42 0.00 -1.81 0.00 0.00 57.70 52.86 1h7t n MET 101 Cb 0.14 -2.08 -0.02 0.00 -0.71 0.00 0.00 33.22 30.54 1h7t n MET 101 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99 1h7t n ILE 102 N 0.60 0.69 -3.23 2.02 0.13 -1.15 -4.55 119.36 113.87 1h7t n ILE 102 Ca 0.23 -0.17 -0.40 0.00 -1.10 0.00 0.00 62.75 61.31 1h7t n ILE 102 Cb 1.00 -1.88 -0.07 0.00 -0.84 0.00 0.00 39.64 37.85 1h7t n ILE 102 CO 0.00 0.00 0.00 -0.13 2.80 0.00 0.00 176.55 179.22 1h7t s ARG 103 N 0.01 4.12 0.51 9.51 0.52 -1.26 -4.96 118.95 127.41 1h7t s ARG 103 Ca 0.68 0.37 0.27 0.00 -0.52 0.00 0.00 55.73 56.54 1h7t s ARG 103 Cb -0.53 -3.62 1.38 0.00 0.52 0.00 0.00 34.95 32.70 1h7t s ARG 103 CO 0.44 -0.28 1.92 -1.35 0.02 0.00 0.00 175.30 176.05 1h7t h PRO 104 N 7.79 0.07 -0.31 3.54 0.11 -1.93 -1.22 132.00 140.05 1h7t h PRO 104 Ca -0.31 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.71 1h7t h PRO 104 Cb 1.14 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1h7t h PRO 104 CO 0.73 0.05 -0.19 -0.09 -0.21 0.00 0.00 178.00 178.28 1h7t h ARG 105 N 0.07 0.58 -0.42 1.05 9.65 -1.93 -2.64 114.38 120.74 1h7t h ARG 105 Ca 0.37 -0.20 -0.07 0.00 -1.10 0.00 0.00 59.98 58.97 1h7t h ARG 105 Cb 1.37 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.89 1h7t h ARG 105 CO -0.03 0.74 -0.04 -0.44 2.80 0.00 0.00 179.97 182.99 1h7t h ASP 106 N 0.52 0.69 0.50 -3.80 3.32 -1.64 -1.25 116.42 114.76 1h7t h ASP 106 Ca 0.08 -0.17 -0.12 0.00 0.02 0.00 0.00 57.03 56.84 1h7t h ASP 106 Cb 0.62 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1h7t h ASP 106 CO 0.04 0.79 -0.56 0.58 -1.72 0.00 0.00 179.24 178.37 1h7t h VAL 107 N 0.66 1.40 -0.08 -1.35 2.07 -1.53 -2.49 116.25 114.93 1h7t h VAL 107 Ca 0.13 -1.91 -0.14 0.00 0.82 0.00 0.00 66.70 65.59 1h7t h VAL 107 Cb 0.48 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1h7t h VAL 107 CO 0.02 0.55 -0.58 -0.33 0.02 0.00 0.00 177.57 177.25 1h7t h GLU 108 N 0.05 0.25 -0.45 1.57 5.08 -1.04 -0.63 114.58 119.40 1h7t h GLU 108 Ca -0.00 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 1h7t h GLU 108 Cb 1.01 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 1h7t h GLU 108 CO 0.08 0.76 0.19 1.15 -1.00 0.00 0.00 179.01 180.19 1h7t h THR 109 N 0.19 1.20 0.28 1.13 2.02 -0.99 0.10 112.91 116.84 1h7t h THR 109 Ca -0.00 -0.61 -0.01 0.00 0.77 0.00 0.00 66.41 66.56 1h7t h THR 109 Cb 1.08 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1h7t h THR 109 CO 0.09 0.23 -0.14 0.25 0.37 0.00 0.00 175.52 176.32 1h7t h LEU 110 N 0.59 -0.32 -0.98 2.58 5.85 -1.21 -1.58 115.31 120.24 1h7t h LEU 110 Ca 0.15 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1h7t h LEU 110 Cb 0.18 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1h7t h LEU 110 CO -0.01 -0.18 0.64 0.25 -0.34 0.00 0.00 178.44 178.79 1h7t h LEU 111 N -0.43 1.14 -0.85 2.25 6.46 -1.00 -2.10 115.31 120.78 1h7t h LEU 111 Ca -0.04 -0.04 -0.09 0.00 -0.12 0.00 0.00 57.88 57.59 1h7t h LEU 111 Cb 0.33 -0.29 -0.02 0.00 -0.73 0.00 0.00 40.66 39.96 1h7t h LEU 111 CO 0.06 0.84 -0.14 -0.61 -0.62 0.00 0.00 178.44 177.97 1h7t h GLN 112 N 1.34 0.70 -0.66 1.25 5.75 -0.85 -2.09 115.11 120.55 1h7t h GLN 112 Ca 0.36 -0.24 -0.02 0.00 -0.15 0.00 0.00 58.65 58.60 1h7t h GLN 112 Cb -0.13 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.33 1h7t h GLN 112 CO -0.08 0.81 0.35 0.78 -2.65 0.00 0.00 178.83 178.04 1h7t h GLY 113 N 0.98 0.99 1.29 2.39 0.00 -0.66 0.16 103.07 108.22 1h7t h GLY 113 Ca 0.11 -0.46 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1h7t h GLY 113 CO 0.04 0.44 0.12 -0.33 0.00 0.00 0.00 176.54 176.81 1h7t h MET 114 N 0.90 0.88 0.00 4.80 2.86 -1.12 -3.02 114.93 120.24 1h7t h MET 114 Ca 0.23 -0.19 -0.18 0.00 -2.06 0.00 0.00 59.70 57.49 1h7t h MET 114 Cb 0.07 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 1h7t h MET 114 CO -0.03 0.80 -0.87 0.00 1.06 0.00 0.00 176.91 177.87 1h7t h ARG 115 N 0.84 0.03 0.00 1.72 3.08 -0.92 -3.24 114.38 115.89 1h7t h ARG 115 Ca 0.18 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1h7t h ARG 115 Cb 0.33 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.39 1h7t h ARG 115 CO 0.00 0.88 -0.11 -0.44 -1.07 0.00 0.00 179.97 179.23 1h7t h ASP 116 N 0.01 0.00 -2.99 7.04 3.32 -0.86 -3.38 116.42 119.56 1h7t h ASP 116 Ca -0.02 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.47 1h7t h ASP 116 Cb 1.52 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.67 1h7t h ASP 116 CO 0.12 0.11 -0.77 -0.62 -1.72 0.00 0.00 179.24 176.36 1h7t s ASP 117 N -5.97 3.75 0.53 6.45 2.15 -1.16 -5.01 116.67 117.41 1h7t s ASP 117 Ca 0.01 -1.60 0.35 0.00 0.43 0.00 0.00 52.55 51.75 1h7t s ASP 117 Cb 0.09 -0.65 1.81 0.00 -0.30 0.00 0.00 42.92 43.87 1h7t s ASP 117 CO 0.60 -0.41 2.07 -0.65 -0.17 0.00 0.00 175.17 176.61 1h7t h PRO 118 N 8.06 0.00 -0.01 4.34 0.11 -1.76 -2.62 132.00 140.13 1h7t h PRO 118 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1h7t h PRO 118 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1h7t h PRO 118 CO 0.45 0.00 -0.40 0.00 -0.21 0.00 0.00 178.00 177.83 1h7t n ALA 119 N -1.98 3.38 -2.49 -0.75 0.00 -1.26 -4.88 120.51 112.52 1h7t n ALA 119 Ca -0.01 -0.41 -0.43 0.00 0.00 0.00 0.00 53.44 52.59 1h7t n ALA 119 Cb 0.12 -1.09 -0.02 0.00 0.00 0.00 0.00 19.45 18.46 1h7t n ALA 119 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1h7t s LEU 120 N -2.71 4.18 -0.08 0.00 2.96 -0.99 -4.95 118.68 117.09 1h7t s LEU 120 Ca 0.18 1.63 -0.25 0.00 -0.22 0.00 0.00 54.13 55.47 1h7t s LEU 120 Cb 0.18 -3.54 -0.27 0.00 0.50 0.00 0.00 46.19 43.07 1h7t s LEU 120 CO 0.61 -0.71 0.90 -0.65 -1.32 0.00 0.00 176.35 175.18 1h7t h PRO 121 N 7.89 0.15 -4.59 0.98 0.11 -1.90 -3.44 132.00 131.20 1h7t h PRO 121 Ca -0.26 -0.21 -0.29 0.00 0.11 0.00 0.00 66.00 65.35 1h7t h PRO 121 Cb 1.10 0.07 -0.23 0.00 0.11 0.00 0.00 31.00 32.06 1h7t h PRO 121 CO 0.96 1.04 -0.74 0.08 -0.21 0.00 0.00 178.00 179.12 1h7t s VAL 122 N -2.62 0.57 0.01 3.15 1.01 -1.19 -1.53 120.40 119.80 1h7t s VAL 122 Ca -0.16 -0.95 -0.00 0.00 0.00 0.00 0.00 61.98 60.87 1h7t s VAL 122 Cb -0.01 -0.60 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 1h7t s VAL 122 CO 0.75 -0.28 -0.02 0.00 0.00 0.00 0.00 175.10 175.55 1h7t s ALA 123 N -1.15 0.07 0.33 5.51 0.00 -0.76 -1.94 121.76 123.82 1h7t s ALA 123 Ca -0.07 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.52 1h7t s ALA 123 Cb -0.09 0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.13 1h7t s ALA 123 CO 0.00 -0.10 0.43 -2.37 0.00 0.00 0.00 175.76 173.72 1h7t n THR 124 N 2.13 0.00 -4.50 0.00 5.66 -0.16 -1.23 114.28 116.17 1h7t n THR 124 Ca -0.20 -1.84 -0.25 0.00 -3.05 0.00 0.00 64.05 58.72 1h7t n THR 124 Cb 0.57 1.07 -0.10 0.00 -1.55 0.00 0.00 70.33 70.32 1h7t n THR 124 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1h7t s LEU 125 N 0.00 2.65 0.19 1.09 1.43 -1.23 -1.03 118.68 121.79 1h7t s LEU 125 Ca 0.30 -1.11 -0.22 0.00 -1.03 0.00 0.00 54.13 52.07 1h7t s LEU 125 Cb -0.00 -1.04 0.06 0.00 0.03 0.00 0.00 46.19 45.23 1h7t s LEU 125 CO 0.21 -0.08 0.62 0.00 0.23 0.00 0.00 176.35 177.34 1h7t s HIS 127 N -3.79 0.01 0.37 0.00 -3.43 -0.37 -1.07 115.29 107.00 1h7t s HIS 127 Ca 0.04 -0.29 -0.27 0.00 -0.80 0.00 0.00 55.06 53.73 1h7t s HIS 127 Cb -0.02 0.04 -0.09 0.00 -1.43 0.00 0.00 32.58 31.07 1h7t s HIS 127 CO -0.08 -0.53 1.29 0.00 -2.00 0.00 0.00 174.74 173.42 1h7t s ALA 128 N -3.20 3.36 0.04 -1.38 0.00 -1.26 -0.01 121.76 119.32 1h7t s ALA 128 Ca -0.00 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1h7t s ALA 128 Cb 0.02 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 1h7t s ALA 128 CO -0.07 -0.70 -0.04 0.96 0.00 0.00 0.00 175.76 175.90 1h7t s ILE 129 N -1.22 0.31 1.01 0.00 -4.36 -0.90 -4.79 121.20 111.25 1h7t s ILE 129 Ca 0.53 -1.37 -0.14 0.00 -0.26 0.00 0.00 60.65 59.41 1h7t s ILE 129 Cb -0.38 -0.92 0.19 0.00 1.25 0.00 0.00 42.46 42.60 1h7t s ILE 129 CO 0.50 -0.69 1.14 -0.94 0.24 0.00 0.00 174.94 175.19 1h7t s SER 130 N -2.16 2.60 0.28 4.36 1.04 -1.26 -3.94 113.70 114.61 1h7t s SER 130 Ca -0.04 0.88 0.03 0.00 0.48 0.00 0.00 55.95 57.30 1h7t s SER 130 Cb -0.02 -1.36 0.42 0.00 0.10 0.00 0.00 66.02 65.16 1h7t s SER 130 CO -0.04 -3.11 1.72 0.00 0.98 0.00 0.00 173.24 172.79 1h7t h ALA 131 N -1.88 1.10 -0.69 5.32 0.00 -1.97 -2.50 119.26 118.64 1h7t h ALA 131 Ca -0.50 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.01 1h7t h ALA 131 Cb 1.32 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1h7t h ALA 131 CO 0.52 0.56 0.24 0.00 0.00 0.00 0.00 179.25 180.57 1h7t h ALA 132 N 1.32 0.90 -0.24 0.00 0.00 -2.01 -2.67 119.26 116.56 1h7t h ALA 132 Ca 0.06 -0.21 -0.17 0.00 0.00 0.00 0.00 54.91 54.59 1h7t h ALA 132 Cb 0.69 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1h7t h ALA 132 CO 0.05 0.56 -0.54 0.93 0.00 0.00 0.00 179.25 180.25 1h7t h GLU 133 N 1.00 0.72 0.00 0.00 5.08 -1.90 -3.13 114.58 116.35 1h7t h GLU 133 Ca 0.23 -0.45 -0.01 0.00 -1.00 0.00 0.00 59.36 58.13 1h7t h GLU 133 Cb 0.27 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1h7t h GLU 133 CO -0.01 1.07 -0.03 0.00 -1.00 0.00 0.00 179.01 179.04 1h7t h ALA 134 N 0.84 1.30 0.00 3.43 0.00 -1.22 -2.43 119.26 121.17 1h7t h ALA 134 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1h7t h ALA 134 Cb 1.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1h7t h ALA 134 CO 0.11 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1h7t h ALA 135 N 1.97 1.00 -2.21 0.00 0.00 -1.42 -3.40 119.26 115.20 1h7t h ALA 135 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 1h7t h ALA 135 Cb 0.10 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1h7t h ALA 135 CO 0.00 0.00 0.75 -1.21 0.00 0.00 0.00 179.25 178.80 1h7t s GLU 136 N -3.38 4.31 0.41 0.00 0.41 -0.92 -4.91 118.70 114.63 1h7t s GLU 136 Ca 0.04 1.56 0.09 0.00 -0.41 0.00 0.00 54.97 56.25 1h7t s GLU 136 Cb 0.09 -3.63 0.85 0.00 -1.78 0.00 0.00 34.13 29.66 1h7t s GLU 136 CO 0.42 -0.53 1.98 -1.00 -0.49 0.00 0.00 175.26 175.64 1h7t h PRO 137 N 7.60 0.31 0.00 0.39 0.13 -1.85 -1.69 132.00 136.89 1h7t h PRO 137 Ca -0.28 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1h7t h PRO 137 Cb 1.12 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 1h7t h PRO 137 CO 0.92 0.34 -0.00 0.66 -0.23 0.00 0.00 178.00 179.69 1h7t h SER 138 N 0.31 0.00 -3.09 1.44 4.64 -1.91 -3.40 113.55 111.53 1h7t h SER 138 Ca 0.07 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.77 1h7t h SER 138 Cb 0.21 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.19 1h7t h SER 138 CO 0.00 0.00 -0.46 -0.89 -0.87 0.00 0.00 176.83 174.61 1h7t s THR 139 N -4.04 5.42 -0.26 2.95 2.01 -0.64 -5.08 115.64 116.01 1h7t s THR 139 Ca -0.04 0.25 -0.13 0.00 0.31 0.00 0.00 61.69 62.08 1h7t s THR 139 Cb 0.12 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 1h7t s THR 139 CO 0.44 0.49 0.29 -0.69 -0.69 0.00 0.00 174.62 174.46 1h7t s VAL 140 N -0.06 5.24 0.28 3.82 1.01 -1.26 -4.59 120.40 124.85 1h7t s VAL 140 Ca 0.11 0.42 0.02 0.00 0.00 0.00 0.00 61.98 62.53 1h7t s VAL 140 Cb -0.12 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1h7t s VAL 140 CO 0.01 0.22 0.45 -0.54 0.00 0.00 0.00 175.10 175.24 1h7t s LYS 141 N 1.74 3.47 -0.04 2.72 3.01 0.49 -0.57 119.74 130.56 1h7t s LYS 141 Ca 0.12 -0.50 -0.08 0.00 -1.01 0.00 0.00 55.97 54.50 1h7t s LYS 141 Cb -0.15 -2.78 0.01 0.00 -1.01 0.00 0.00 37.83 33.90 1h7t s LYS 141 CO 0.09 0.30 0.19 0.54 0.51 0.00 0.00 175.35 176.98 1h7t s VAL 142 N -2.11 0.03 -0.08 3.17 0.11 -0.80 -1.16 120.40 119.57 1h7t s VAL 142 Ca 0.37 -0.28 0.05 0.00 -2.93 0.00 0.00 61.98 59.19 1h7t s VAL 142 Cb -0.10 -0.36 -0.01 0.00 -1.53 0.00 0.00 36.38 34.38 1h7t s VAL 142 CO 0.32 -0.16 -0.24 -0.69 -3.33 0.00 0.00 175.10 171.00 1h7t s VAL 143 N -0.54 2.07 0.33 2.04 1.01 -1.06 -4.26 120.40 119.99 1h7t s VAL 143 Ca -0.06 -1.04 0.10 0.00 0.00 0.00 0.00 61.98 60.98 1h7t s VAL 143 Cb -0.04 -1.76 -0.06 0.00 0.00 0.00 0.00 36.38 34.52 1h7t s VAL 143 CO 0.01 0.57 -0.12 0.68 0.00 0.00 0.00 175.10 176.24 1h7t s VAL 144 N 0.06 2.27 0.00 2.92 -7.23 -1.26 0.24 120.40 117.39 1h7t s VAL 144 Ca -0.10 -2.25 0.00 0.00 -1.81 0.00 0.00 61.98 57.82 1h7t s VAL 144 Cb -0.16 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.23 1h7t s VAL 144 CO 0.06 -0.25 0.00 -0.46 -0.31 0.00 0.00 175.10 174.14 1h7t n ASN 145 N -0.74 0.05 -0.12 4.85 0.23 -0.53 -4.88 115.26 114.13 1h7t n ASN 145 Ca -0.05 -0.96 0.02 0.00 -0.53 0.00 0.00 54.58 53.06 1h7t n ASN 145 Cb 0.63 0.00 0.33 0.00 -2.08 0.00 0.00 39.78 38.66 1h7t n ASN 145 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1h7t h THR 146 N 0.03 1.15 -0.04 5.53 1.35 -2.02 -0.77 112.91 118.14 1h7t h THR 146 Ca 0.00 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1h7t h THR 146 Cb 0.00 0.28 0.00 0.00 -1.73 0.00 0.00 68.15 66.70 1h7t h THR 146 CO 0.00 0.15 0.00 0.54 -0.25 0.00 0.00 175.52 175.96 1h7t n ARG 147 N -4.45 1.12 -1.35 4.72 1.74 -1.26 -4.86 116.66 112.33 1h7t n ARG 147 Ca 0.06 -0.19 -0.12 0.00 -0.77 0.00 0.00 57.85 56.83 1h7t n ARG 147 Cb 0.05 -1.20 -0.05 0.00 -1.02 0.00 0.00 32.46 30.23 1h7t n ARG 147 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1h7t n GLN 148 N -0.50 -0.90 -2.72 5.56 6.02 -0.29 -4.88 117.38 119.66 1h7t n GLN 148 Ca 0.09 0.91 -0.39 0.00 -0.01 0.00 0.00 57.00 57.60 1h7t n GLN 148 Cb 0.08 -4.94 -0.06 0.00 1.02 0.00 0.00 30.24 26.35 1h7t n GLN 148 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1h7t s ASP 149 N -2.82 7.54 0.13 1.08 1.01 -1.26 -0.92 116.67 121.43 1h7t s ASP 149 Ca 0.00 1.97 -0.30 0.00 0.71 0.00 0.00 52.55 54.92 1h7t s ASP 149 Cb 0.00 -2.61 -0.07 0.00 1.01 0.00 0.00 42.92 41.25 1h7t s ASP 149 CO 0.00 0.08 1.24 0.00 0.21 0.00 0.00 175.17 176.70 1h7t s ALA 150 N -1.26 3.46 -0.12 5.23 0.00 -0.34 -1.45 121.76 127.28 1h7t s ALA 150 Ca 0.43 0.96 -0.12 0.00 0.00 0.00 0.00 51.96 53.23 1h7t s ALA 150 Cb -0.25 -3.45 -0.26 0.00 0.00 0.00 0.00 23.12 19.15 1h7t s ALA 150 CO 0.32 -0.45 0.45 -0.07 0.00 0.00 0.00 175.76 176.00 1h7t h LEU 151 N 6.12 0.38 -7.00 0.00 3.38 -0.55 -3.45 115.31 114.18 1h7t h LEU 151 Ca -0.43 -0.86 0.11 0.00 0.09 0.00 0.00 57.88 56.79 1h7t h LEU 151 Cb 1.21 -0.12 -0.17 0.00 0.09 0.00 0.00 40.66 41.67 1h7t h LEU 151 CO 0.79 1.72 0.51 -0.47 0.09 0.00 0.00 178.44 181.09 1h7t s TYR 152 N -2.51 -0.35 -0.05 1.13 5.04 -1.23 -5.03 117.35 114.36 1h7t s TYR 152 Ca -0.22 0.30 0.06 0.00 -2.44 0.00 0.00 57.07 54.78 1h7t s TYR 152 Cb 0.06 0.52 -0.01 0.00 0.35 0.00 0.00 41.96 42.87 1h7t s TYR 152 CO 0.76 -0.49 -0.23 -0.06 -1.34 0.00 0.00 175.55 174.19 1h7t s PHE 153 N -2.68 2.19 0.05 4.97 0.40 -1.26 -2.57 117.98 119.09 1h7t s PHE 153 Ca 0.04 -0.61 -0.23 0.00 -0.60 0.00 0.00 56.93 55.53 1h7t s PHE 153 Cb -0.01 -1.44 0.05 0.00 0.51 0.00 0.00 43.02 42.14 1h7t s PHE 153 CO -0.06 -0.18 0.53 0.45 0.70 0.00 0.00 175.22 176.66 1h7t s SER 154 N -0.17 -0.46 0.30 1.36 0.15 -0.31 -4.97 113.70 109.60 1h7t s SER 154 Ca -0.02 0.18 0.23 0.00 0.70 0.00 0.00 55.95 57.05 1h7t s SER 154 Cb -0.12 0.50 0.29 0.00 -1.71 0.00 0.00 66.02 64.98 1h7t s SER 154 CO 0.03 -0.74 1.42 0.03 1.20 0.00 0.00 173.24 175.18 1h7t h ARG 155 N 2.72 0.00 -7.01 5.44 3.08 -1.84 0.14 114.38 116.91 1h7t h ARG 155 Ca -0.31 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.28 1h7t h ARG 155 Cb 1.22 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 1h7t h ARG 155 CO 0.41 0.00 0.36 -1.12 -1.07 0.00 0.00 179.97 178.55 1h7t s SER 156 N -5.50 6.93 -0.20 7.04 0.01 -1.26 -4.23 113.70 116.48 1h7t s SER 156 Ca 0.05 1.80 -0.29 0.00 1.31 0.00 0.00 55.95 58.82 1h7t s SER 156 Cb 0.08 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 1h7t s SER 156 CO 0.71 -0.37 1.69 -2.84 0.41 0.00 0.00 173.24 172.84 1h7t s PRO 157 N -2.83 3.77 -0.02 12.44 0.02 -1.26 -4.74 135.00 142.37 1h7t s PRO 157 Ca 0.59 1.76 0.02 0.00 0.02 0.00 0.00 61.00 63.39 1h7t s PRO 157 Cb -0.14 -4.07 0.00 0.00 0.02 0.00 0.00 34.50 30.31 1h7t s PRO 157 CO 0.18 -1.33 -0.07 0.96 -0.33 0.00 0.00 177.00 176.40 1h7t s ILE 158 N 5.39 0.64 0.66 2.83 -4.36 -1.26 -3.79 121.20 121.32 1h7t s ILE 158 Ca 0.75 -0.29 -0.14 0.00 -0.26 0.00 0.00 60.65 60.70 1h7t s ILE 158 Cb -0.27 -0.58 -0.00 0.00 1.25 0.00 0.00 42.46 42.87 1h7t s ILE 158 CO 0.31 0.20 1.09 -2.16 0.24 0.00 0.00 174.94 174.62 1h7t s PRO 159 N 0.16 2.85 0.33 0.37 0.04 -1.26 -4.68 135.00 132.81 1h7t s PRO 159 Ca -0.02 1.29 -0.29 0.00 0.04 0.00 0.00 61.00 62.02 1h7t s PRO 159 Cb -0.07 -1.96 -0.11 0.00 0.04 0.00 0.00 34.50 32.40 1h7t s PRO 159 CO 0.00 -1.20 1.45 -0.47 0.04 0.00 0.00 177.00 176.83 1h7t s TYR 160 N -2.48 2.80 -1.55 0.56 5.04 -1.25 -4.89 117.35 115.58 1h7t s TYR 160 Ca 0.65 1.14 -0.11 0.00 -2.44 0.00 0.00 57.07 56.31 1h7t s TYR 160 Cb -0.19 -3.91 -0.03 0.00 0.35 0.00 0.00 41.96 38.18 1h7t s TYR 160 CO 0.43 -2.77 2.69 -0.35 -1.34 0.00 0.00 175.55 174.22 1h7t n PRO 161 N 1.17 3.54 0.14 4.97 -0.04 -1.26 -4.62 135.00 138.90 1h7t n PRO 161 Ca 0.03 -2.45 -0.13 0.00 -0.04 0.00 0.00 63.50 60.92 1h7t n PRO 161 Cb 0.40 -2.92 -0.08 0.00 -0.04 0.00 0.00 33.50 30.86 1h7t n PRO 161 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1h7t h ARG 162 N 5.26 -0.36 -3.40 0.54 9.65 -2.02 -3.27 114.38 120.78 1h7t h ARG 162 Ca 0.77 0.02 -0.74 0.00 -1.10 0.00 0.00 59.98 58.94 1h7t h ARG 162 Cb 0.39 0.08 -0.33 0.00 -1.39 0.00 0.00 29.97 28.72 1h7t h ARG 162 CO 1.79 -0.02 0.08 -0.80 2.80 0.00 0.00 179.97 183.82 1h7t s ASN 163 N -5.15 6.42 0.31 -3.80 0.01 -1.26 -4.96 114.94 106.51 1h7t s ASN 163 Ca -0.14 -3.68 0.03 0.00 -0.71 0.00 0.00 52.86 48.37 1h7t s ASN 163 Cb 0.02 -2.01 0.79 0.00 0.41 0.00 0.00 41.25 40.46 1h7t s ASN 163 CO 0.53 -0.22 1.52 0.00 -1.51 0.00 0.00 177.10 177.42 1h7t n ALA 164 N 2.45 0.54 0.30 0.60 0.00 -1.24 -1.19 120.51 121.97 1h7t n ALA 164 Ca 0.22 1.04 0.18 0.00 0.00 0.00 0.00 53.44 54.88 1h7t n ALA 164 Cb 0.38 -0.78 0.86 0.00 0.00 0.00 0.00 19.45 19.91 1h7t n ALA 164 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1h7t h GLU 165 N 0.00 0.00 0.00 0.00 3.07 -1.93 -2.66 114.58 113.06 1h7t h GLU 165 Ca 0.61 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.47 1h7t h GLU 165 Cb 1.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.20 1h7t h GLU 165 CO -0.90 0.00 -0.85 1.63 -1.40 0.00 0.00 179.01 177.48 1h7t n LYS 166 N -2.85 0.32 -2.48 2.33 4.76 -0.34 -4.94 118.16 114.96 1h7t n LYS 166 Ca -0.01 0.05 -0.40 0.00 -2.87 0.00 0.00 58.31 55.07 1h7t n LYS 166 Cb 0.16 -1.65 -0.04 0.00 -1.84 0.00 0.00 35.03 31.65 1h7t n LYS 166 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1h7t s ALA 167 N -3.20 3.40 -0.07 7.82 0.00 -1.00 -5.05 121.76 123.65 1h7t s ALA 167 Ca 0.04 0.88 -0.02 0.00 0.00 0.00 0.00 51.96 52.87 1h7t s ALA 167 Cb 0.13 -3.33 0.03 0.00 0.00 0.00 0.00 23.12 19.95 1h7t s ALA 167 CO 0.76 -0.17 0.01 0.50 0.00 0.00 0.00 175.76 176.87 1h7t s ARG 168 N -1.20 0.53 0.07 0.00 3.52 -1.26 -5.01 118.95 115.59 1h7t s ARG 168 Ca 0.46 0.12 -0.07 0.00 -0.13 0.00 0.00 55.73 56.11 1h7t s ARG 168 Cb -0.31 -0.97 -0.05 0.00 -1.56 0.00 0.00 34.95 32.05 1h7t s ARG 168 CO 0.40 -0.32 0.34 0.71 -0.81 0.00 0.00 175.30 175.61 1h7t s TYR 169 N 1.99 3.55 -0.14 5.12 2.02 -1.25 -4.72 117.35 123.91 1h7t s TYR 169 Ca 0.05 0.62 0.00 0.00 -0.37 0.00 0.00 57.07 57.36 1h7t s TYR 169 Cb -0.12 -2.03 0.02 0.00 -0.40 0.00 0.00 41.96 39.43 1h7t s TYR 169 CO -0.05 0.53 -0.12 -0.51 -1.57 0.00 0.00 175.55 173.83 1h7t s LEU 170 N -2.10 1.54 0.03 -1.29 1.43 -1.26 -2.12 118.68 114.90 1h7t s LEU 170 Ca 0.33 -0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 52.77 1h7t s LEU 170 Cb -0.13 -1.07 -0.06 0.00 0.03 0.00 0.00 46.19 44.96 1h7t s LEU 170 CO 0.20 -0.08 0.67 -0.75 0.23 0.00 0.00 176.35 176.62 1h7t s LYS 171 N 1.56 4.39 -0.11 1.70 2.20 0.98 -1.90 119.74 128.57 1h7t s LYS 171 Ca 0.05 0.89 -0.28 0.00 -0.36 0.00 0.00 55.97 56.27 1h7t s LYS 171 Cb -0.13 -3.34 -0.02 0.00 -1.51 0.00 0.00 37.83 32.84 1h7t s LYS 171 CO -0.10 0.37 0.93 -1.58 -0.36 0.00 0.00 175.35 174.61 1h7t s HIS 172 N -0.29 3.50 -0.38 4.03 5.65 0.26 -1.23 115.29 126.84 1h7t s HIS 172 Ca 0.34 1.47 -0.16 0.00 0.25 0.00 0.00 55.06 56.97 1h7t s HIS 172 Cb -0.20 -3.10 0.00 0.00 -1.18 0.00 0.00 32.58 28.11 1h7t s HIS 172 CO 0.20 -0.18 0.37 0.08 -0.65 0.00 0.00 174.74 174.55 1h7t s VAL 173 N 1.86 5.16 0.00 0.89 1.01 0.41 -4.76 120.40 124.98 1h7t s VAL 173 Ca 0.45 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.21 1h7t s VAL 173 Cb -0.18 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1h7t s VAL 173 CO 0.17 -0.23 0.11 0.61 0.00 0.00 0.00 175.10 175.76 1h7t n GLY 174 N 5.05 0.60 3.41 4.51 0.00 -1.26 -3.60 105.19 113.90 1h7t n GLY 174 Ca -0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 1h7t n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h7t s ILE 175 N 2.19 3.39 0.17 -0.61 1.01 -1.26 -4.70 121.20 121.38 1h7t s ILE 175 Ca 0.00 -0.53 0.09 0.00 0.00 0.00 0.00 60.65 60.21 1h7t s ILE 175 Cb 0.00 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 1h7t s ILE 175 CO 0.00 0.50 -0.19 -0.31 0.00 0.00 0.00 174.94 174.94 1h7t s TYR 176 N 0.52 1.87 -0.11 3.97 1.51 -1.17 -3.47 117.35 120.48 1h7t s TYR 176 Ca -0.06 -0.45 0.01 0.00 -1.01 0.00 0.00 57.07 55.56 1h7t s TYR 176 Cb -0.15 -0.93 0.02 0.00 -0.11 0.00 0.00 41.96 40.78 1h7t s TYR 176 CO 0.03 0.34 -0.13 0.00 -1.11 0.00 0.00 175.55 174.69 1h7t s ALA 177 N -1.97 1.55 -0.04 3.71 0.00 -0.36 -0.48 121.76 124.17 1h7t s ALA 177 Ca 0.16 -0.65 0.07 0.00 0.00 0.00 0.00 51.96 51.53 1h7t s ALA 177 Cb -0.06 -0.83 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 1h7t s ALA 177 CO 0.07 -0.15 -0.25 0.71 0.00 0.00 0.00 175.76 176.13 1h7t s TYR 178 N 1.15 2.40 0.63 0.00 2.02 0.81 -1.83 117.35 122.53 1h7t s TYR 178 Ca -0.04 -0.61 -0.15 0.00 -0.37 0.00 0.00 57.07 55.90 1h7t s TYR 178 Cb -0.14 -1.56 -0.02 0.00 -0.40 0.00 0.00 41.96 39.84 1h7t s TYR 178 CO -0.03 -0.14 1.08 0.50 -1.57 0.00 0.00 175.55 175.39 1h7t s ARG 179 N -0.34 3.06 0.22 -0.62 6.06 -0.58 -0.75 118.95 125.99 1h7t s ARG 179 Ca 0.02 1.30 -0.09 0.00 -2.50 0.00 0.00 55.73 54.46 1h7t s ARG 179 Cb -0.12 -1.99 0.22 0.00 0.06 0.00 0.00 34.95 33.12 1h7t s ARG 179 CO 0.02 -1.03 1.86 -0.09 -2.50 0.00 0.00 175.30 173.56 1h7t h ARG 180 N 0.23 0.94 0.00 5.12 2.43 -1.42 -2.80 114.38 118.88 1h7t h ARG 180 Ca -0.47 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 58.62 1h7t h ARG 180 Cb 1.23 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.57 1h7t h ARG 180 CO 0.56 0.62 -0.14 0.38 -1.51 0.00 0.00 179.97 179.88 1h7t h ASP 181 N 0.97 0.00 -0.44 -3.80 2.03 -1.92 -2.43 116.42 110.83 1h7t h ASP 181 Ca 0.31 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 56.48 1h7t h ASP 181 Cb 0.01 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.50 1h7t h ASP 181 CO -0.11 0.14 -0.22 0.58 -1.03 0.00 0.00 179.24 178.60 1h7t h VAL 182 N 0.00 1.27 -0.14 4.15 2.07 -1.85 -2.40 116.25 119.36 1h7t h VAL 182 Ca -0.00 -1.38 -0.14 0.00 0.82 0.00 0.00 66.70 66.00 1h7t h VAL 182 Cb 0.36 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1h7t h VAL 182 CO 0.02 0.47 -0.50 -0.07 0.02 0.00 0.00 177.57 177.50 1h7t h LEU 183 N 0.76 0.40 -0.93 2.57 3.38 -1.53 -0.57 115.31 119.39 1h7t h LEU 183 Ca 0.10 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1h7t h LEU 183 Cb 0.80 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1h7t h LEU 183 CO 0.07 0.84 -0.06 1.56 0.09 0.00 0.00 178.44 180.93 1h7t h GLN 184 N 0.29 0.71 -0.00 1.13 4.20 -1.29 -3.07 115.11 117.08 1h7t h GLN 184 Ca 0.01 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1h7t h GLN 184 Cb 0.99 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.70 1h7t h GLN 184 CO 0.09 0.77 -0.58 0.09 -0.67 0.00 0.00 178.83 178.53 1h7t n ASN 185 N -4.20 0.92 -0.11 1.46 3.02 -0.92 -4.58 115.26 110.86 1h7t n ASN 185 Ca 0.02 -0.72 -0.05 0.00 -0.03 0.00 0.00 54.58 53.79 1h7t n ASN 185 Cb 0.32 0.45 0.02 0.00 -0.61 0.00 0.00 39.78 39.96 1h7t n ASN 185 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1h7t h TYR 186 N 0.54 -0.06 0.00 3.10 3.20 -1.00 -2.73 116.97 120.02 1h7t h TYR 186 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1h7t h TYR 186 Cb 0.53 0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.88 1h7t h TYR 186 CO 0.00 -0.09 0.00 -1.13 -1.64 0.00 0.00 178.16 175.30 1h7t n SER 187 N -5.21 0.41 0.11 -2.11 3.41 -1.26 -1.87 113.62 107.10 1h7t n SER 187 Ca 0.02 0.65 0.07 0.00 -0.26 0.00 0.00 58.87 59.35 1h7t n SER 187 Cb 0.19 -0.72 0.01 0.00 -0.26 0.00 0.00 64.21 63.43 1h7t n SER 187 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1h7t h GLN 188 N 0.00 0.00 -6.83 4.33 1.08 -1.81 -3.46 115.11 108.42 1h7t h GLN 188 Ca 0.00 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.68 1h7t h GLN 188 Cb 0.12 0.00 0.06 0.00 -0.05 0.00 0.00 27.48 27.61 1h7t h GLN 188 CO 0.00 0.16 0.67 -0.51 -0.95 0.00 0.00 178.83 178.20 1h7t s LEU 189 N -5.79 4.42 0.48 1.46 1.43 -0.78 -5.02 118.68 114.87 1h7t s LEU 189 Ca 0.01 2.66 -0.04 0.00 -1.03 0.00 0.00 54.13 55.72 1h7t s LEU 189 Cb 0.08 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.64 1h7t s LEU 189 CO 0.77 -0.58 0.77 -2.16 0.23 0.00 0.00 176.35 175.38 1h7t s PRO 190 N -1.27 3.40 0.10 1.29 0.04 -1.26 -5.04 135.00 132.26 1h7t s PRO 190 Ca 0.52 0.06 -0.30 0.00 0.04 0.00 0.00 61.00 61.31 1h7t s PRO 190 Cb -0.40 -2.41 -0.06 0.00 0.04 0.00 0.00 34.50 31.67 1h7t s PRO 190 CO 0.49 -0.25 1.20 -1.21 0.04 0.00 0.00 177.00 177.27 1h7t s GLU 191 N -4.72 4.45 0.55 4.56 2.02 -1.26 -4.94 118.70 119.36 1h7t s GLU 191 Ca 0.48 1.80 -0.06 0.00 0.02 0.00 0.00 54.97 57.21 1h7t s GLU 191 Cb -0.10 -3.31 -0.01 0.00 0.10 0.00 0.00 34.13 30.80 1h7t s GLU 191 CO 0.43 -0.20 0.86 -1.54 0.02 0.00 0.00 175.26 174.83 1h7t s SER 192 N 0.78 5.87 0.12 -0.19 1.04 -1.26 -4.98 113.70 115.07 1h7t s SER 192 Ca 0.57 0.82 -0.14 0.00 0.48 0.00 0.00 55.95 57.68 1h7t s SER 192 Cb -0.30 -1.93 -0.05 0.00 0.10 0.00 0.00 66.02 63.84 1h7t s SER 192 CO 0.31 -0.88 1.49 -0.03 0.98 0.00 0.00 173.24 175.11 1h7t h MET 193 N -0.03 0.76 -0.40 4.02 4.05 -1.95 -2.26 114.93 119.11 1h7t h MET 193 Ca -0.46 -0.33 -0.06 0.00 -0.28 0.00 0.00 59.70 58.56 1h7t h MET 193 Cb 1.23 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 32.00 1h7t h MET 193 CO 0.61 0.95 -0.01 -1.35 0.23 0.00 0.00 176.91 177.34 1h7t h PRO 194 N 0.55 0.64 0.21 0.39 0.11 -1.94 -0.60 132.00 131.36 1h7t h PRO 194 Ca 0.08 -0.16 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1h7t h PRO 194 Cb 0.73 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1h7t h PRO 194 CO 0.05 0.67 -0.10 1.49 -0.21 0.00 0.00 178.00 179.90 1h7t h GLU 195 N 0.61 -0.28 -0.16 1.05 4.81 -1.78 0.14 114.58 118.98 1h7t h GLU 195 Ca 0.12 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1h7t h GLU 195 Cb 0.40 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1h7t h GLU 195 CO 0.02 -0.17 -0.15 1.96 -0.73 0.00 0.00 179.01 179.94 1h7t h GLN 196 N -0.31 0.25 0.09 1.92 4.20 -1.20 0.70 115.11 120.76 1h7t h GLN 196 Ca -0.03 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1h7t h GLN 196 Cb 0.23 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1h7t h GLN 196 CO 0.05 0.40 -0.04 0.00 -0.67 0.00 0.00 178.83 178.57 1h7t h ALA 197 N 1.62 -0.12 0.00 3.87 0.00 -0.82 -3.33 119.26 120.48 1h7t h ALA 197 Ca 0.05 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1h7t h ALA 197 Cb 0.41 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1h7t h ALA 197 CO 0.02 -0.22 -0.06 0.93 0.00 0.00 0.00 179.25 179.92 1h7t h GLU 198 N -0.81 0.00 -4.13 0.00 4.39 -0.71 -3.48 114.58 109.85 1h7t h GLU 198 Ca -0.01 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.38 1h7t h GLU 198 Cb 0.59 0.00 0.08 0.00 -0.10 0.00 0.00 28.75 29.32 1h7t h GLU 198 CO 0.02 0.00 -0.49 0.45 -1.16 0.00 0.00 179.01 177.83 1h7t n SER 199 N -3.01 -5.23 -4.13 1.42 2.88 0.24 -4.93 113.62 100.87 1h7t n SER 199 Ca 0.04 -0.32 -0.34 0.00 -1.33 0.00 0.00 58.87 56.92 1h7t n SER 199 Cb 0.52 -3.95 -0.14 0.00 -0.75 0.00 0.00 64.21 59.90 1h7t n SER 199 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1h7t s LEU 200 N -5.53 4.02 0.38 2.46 1.43 -1.06 -5.01 118.68 115.38 1h7t s LEU 200 Ca 0.34 -1.48 0.08 0.00 -1.03 0.00 0.00 54.13 52.05 1h7t s LEU 200 Cb -0.15 -1.68 0.83 0.00 0.03 0.00 0.00 46.19 45.22 1h7t s LEU 200 CO 0.42 -0.29 1.96 -0.08 0.23 0.00 0.00 176.35 178.60 1h7t h GLU 201 N 7.91 0.63 0.00 1.70 4.81 -1.94 -2.52 114.58 125.17 1h7t h GLU 201 Ca -0.18 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 1h7t h GLU 201 Cb 1.05 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.29 1h7t h GLU 201 CO 0.53 0.42 0.00 -0.56 -0.73 0.00 0.00 179.01 178.67 1h7t h GLN 202 N 0.65 0.00 0.00 1.92 -0.00 -1.98 -1.05 115.11 114.65 1h7t h GLN 202 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.96 1h7t h GLN 202 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.84 1h7t h GLN 202 CO -0.10 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.01 1h7t n LEU 203 N -2.93 0.00 0.05 0.06 4.77 -0.95 -2.51 117.00 115.49 1h7t n LEU 203 Ca -0.02 0.50 -0.07 0.00 -0.03 0.00 0.00 56.01 56.38 1h7t n LEU 203 Cb 0.08 -0.50 0.09 0.00 -2.33 0.00 0.00 43.42 40.76 1h7t n LEU 203 CO 0.19 -0.15 0.47 -0.09 -1.33 0.00 0.00 177.39 176.48 1h7t h ARG 204 N 0.00 0.38 -0.22 3.23 2.43 -1.38 -2.46 114.38 116.36 1h7t h ARG 204 Ca 0.00 -0.25 -0.14 0.00 -0.81 0.00 0.00 59.98 58.77 1h7t h ARG 204 Cb 0.35 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1h7t h ARG 204 CO 0.00 0.86 -0.43 -0.07 -1.51 0.00 0.00 179.97 178.82 1h7t h LEU 205 N 0.28 0.75 -1.38 3.80 3.38 -1.67 -3.15 115.31 117.33 1h7t h LEU 205 Ca -0.00 -0.54 -0.06 0.00 0.09 0.00 0.00 57.88 57.36 1h7t h LEU 205 Cb 1.12 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1h7t h LEU 205 CO 0.10 1.16 -0.22 0.24 0.09 0.00 0.00 178.44 179.80 1h7t h MET 206 N 0.38 0.13 -0.76 1.13 2.86 -1.54 -1.72 114.93 115.40 1h7t h MET 206 Ca 0.01 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 1h7t h MET 206 Cb 1.03 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.64 1h7t h MET 206 CO 0.10 0.35 0.29 -0.97 1.06 0.00 0.00 176.91 177.74 1h7t h ASN 207 N 0.12 1.06 0.15 1.22 -1.24 -1.42 -2.26 115.58 113.21 1h7t h ASN 207 Ca 0.02 -0.17 0.00 0.00 0.71 0.00 0.00 56.30 56.86 1h7t h ASN 207 Cb 0.47 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.24 1h7t h ASN 207 CO 0.03 0.95 -0.00 0.00 -1.29 0.00 0.00 177.43 177.13 1h7t n ALA 208 N -2.44 2.64 -0.81 1.57 0.00 -0.78 -4.89 120.51 115.78 1h7t n ALA 208 Ca 0.07 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1h7t n ALA 208 Cb 0.20 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1h7t n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h7t n GLY 209 N 1.08 0.54 3.63 0.00 0.00 -0.85 -5.02 105.19 104.57 1h7t n GLY 209 Ca 0.21 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 1h7t n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h7t s ILE 210 N -2.00 4.72 0.21 -0.61 1.01 -0.72 -5.01 121.20 118.80 1h7t s ILE 210 Ca 0.00 1.49 -0.30 0.00 0.00 0.00 0.00 60.65 61.84 1h7t s ILE 210 Cb 0.00 -4.22 -0.09 0.00 0.01 0.00 0.00 42.46 38.16 1h7t s ILE 210 CO 0.00 -0.26 1.31 0.21 0.00 0.00 0.00 174.94 176.19 1h7t s ASN 211 N 1.53 6.89 -0.26 3.58 2.47 -1.26 -4.22 114.94 123.67 1h7t s ASN 211 Ca 0.37 2.42 0.02 0.00 0.42 0.00 0.00 52.86 56.09 1h7t s ASN 211 Cb -0.14 -2.61 0.07 0.00 -1.45 0.00 0.00 41.25 37.12 1h7t s ASN 211 CO 0.11 -0.52 -0.04 -0.63 -3.72 0.00 0.00 177.10 172.30 1h7t s ILE 212 N 0.01 1.75 0.05 -5.21 1.01 -1.26 -3.20 121.20 114.35 1h7t s ILE 212 Ca 0.56 -1.51 -0.24 0.00 0.00 0.00 0.00 60.65 59.45 1h7t s ILE 212 Cb -0.37 -2.04 -0.06 0.00 0.01 0.00 0.00 42.46 40.00 1h7t s ILE 212 CO 0.39 -0.21 0.74 -0.60 0.00 0.00 0.00 174.94 175.26 1h7t s ARG 213 N 1.26 4.47 -0.28 2.79 3.52 -0.82 -1.20 118.95 128.69 1h7t s ARG 213 Ca -0.03 1.02 -0.03 0.00 -0.13 0.00 0.00 55.73 56.56 1h7t s ARG 213 Cb -0.19 -3.35 0.03 0.00 -1.56 0.00 0.00 34.95 29.88 1h7t s ARG 213 CO -0.08 0.32 -0.00 0.99 -0.81 0.00 0.00 175.30 175.73 1h7t s THR 214 N -0.17 3.21 -0.03 4.11 2.01 -0.10 -0.99 115.64 123.68 1h7t s THR 214 Ca 0.37 -1.07 -0.19 0.00 0.31 0.00 0.00 61.69 61.12 1h7t s THR 214 Cb -0.20 -2.71 -0.05 0.00 0.01 0.00 0.00 72.50 69.54 1h7t s THR 214 CO 0.22 0.05 0.53 -0.36 -0.69 0.00 0.00 174.62 174.37 1h7t s PHE 215 N 1.35 3.66 0.01 4.92 0.08 -0.20 -4.84 117.98 122.96 1h7t s PHE 215 Ca -0.01 1.09 -0.20 0.00 0.12 0.00 0.00 56.93 57.92 1h7t s PHE 215 Cb -0.18 -2.53 -0.06 0.00 -0.57 0.00 0.00 43.02 39.69 1h7t s PHE 215 CO -0.01 0.37 0.60 -2.00 -0.10 0.00 0.00 175.22 174.08 1h7t s GLU 216 N -0.21 4.31 0.33 0.44 2.12 -1.26 -1.64 118.70 122.79 1h7t s GLU 216 Ca 0.28 0.74 0.04 0.00 0.36 0.00 0.00 54.97 56.39 1h7t s GLU 216 Cb -0.17 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 30.85 1h7t s GLU 216 CO 0.15 0.40 0.16 0.14 -0.54 0.00 0.00 175.26 175.57 1h7t s VAL 217 N -0.31 0.41 0.96 3.70 -7.23 -0.23 -4.95 120.40 112.74 1h7t s VAL 217 Ca 0.31 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.36 1h7t s VAL 217 Cb -0.18 -2.49 0.16 0.00 0.56 0.00 0.00 36.38 34.43 1h7t s VAL 217 CO 0.18 0.00 1.11 0.00 -0.31 0.00 0.00 175.10 176.07 1h7t s ALA 218 N -3.50 1.29 0.13 1.32 0.00 -1.26 -4.34 121.76 115.40 1h7t s ALA 218 Ca 0.34 -0.38 -0.34 0.00 0.00 0.00 0.00 51.96 51.57 1h7t s ALA 218 Cb 0.05 -3.10 -0.14 0.00 0.00 0.00 0.00 23.12 19.93 1h7t s ALA 218 CO 0.17 -2.59 1.58 0.00 0.00 0.00 0.00 175.76 174.92 1h7t n ALA 219 N -4.00 1.10 -1.98 0.00 0.00 -1.26 -4.83 120.51 109.53 1h7t n ALA 219 Ca 0.06 0.44 -0.29 0.00 0.00 0.00 0.00 53.44 53.64 1h7t n ALA 219 Cb 0.58 -2.34 0.02 0.00 0.00 0.00 0.00 19.45 17.71 1h7t n ALA 219 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1h7t s THR 220 N 1.17 4.25 0.79 0.00 -4.23 -1.26 -5.06 115.64 111.31 1h7t s THR 220 Ca 0.81 0.51 -0.11 0.00 -1.18 0.00 0.00 61.69 61.72 1h7t s THR 220 Cb -0.71 -3.70 0.07 0.00 1.34 0.00 0.00 72.50 69.51 1h7t s THR 220 CO 0.40 -0.85 1.11 -0.83 -0.54 0.00 0.00 174.62 173.92 1h7t s GLY 221 N -4.23 1.76 -0.02 3.99 0.00 -1.26 -4.93 107.32 102.62 1h7t s GLY 221 Ca 0.54 0.40 -0.30 0.00 0.00 0.00 0.00 44.72 45.37 1h7t s GLY 221 CO 0.50 0.77 1.53 2.56 0.00 0.00 0.00 173.10 178.47 1h7t s PRO 222 N -4.72 4.22 0.28 2.90 0.04 -1.26 -4.98 135.00 131.49 1h7t s PRO 222 Ca 0.64 2.09 -0.29 0.00 0.04 0.00 0.00 61.00 63.48 1h7t s PRO 222 Cb -0.19 -3.76 -0.09 0.00 0.04 0.00 0.00 34.50 30.50 1h7t s PRO 222 CO 0.55 -0.72 1.06 0.20 0.04 0.00 0.00 177.00 178.12 1h7t s GLY 223 N 2.56 3.06 -0.27 0.56 0.00 -1.26 -4.84 107.32 107.12 1h7t s GLY 223 Ca 0.69 0.82 -0.29 0.00 0.00 0.00 0.00 44.72 45.93 1h7t s GLY 223 CO 0.28 1.40 1.34 0.14 0.00 0.00 0.00 173.10 176.26 1h7t s VAL 224 N -1.20 4.09 0.00 1.40 1.01 -1.01 -4.72 120.40 119.98 1h7t s VAL 224 Ca 0.44 1.25 0.00 0.00 0.00 0.00 0.00 61.98 63.67 1h7t s VAL 224 Cb -0.30 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.01 1h7t s VAL 224 CO 0.38 -0.41 0.00 0.47 0.00 0.00 0.00 175.10 175.54 1h7t n ASP 225 N 7.62 0.20 -4.34 3.32 8.00 -1.26 -4.88 116.55 125.20 1h7t n ASP 225 Ca 0.15 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.39 1h7t n ASP 225 Cb 0.46 0.01 -0.13 0.00 -0.02 0.00 0.00 41.12 41.44 1h7t n ASP 225 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1h7t s THR 226 N -1.04 1.98 0.12 -3.53 -1.32 -1.26 -4.85 115.64 105.73 1h7t s THR 226 Ca 0.00 -1.65 0.31 0.00 -1.21 0.00 0.00 61.69 59.14 1h7t s THR 226 Cb 0.00 -1.77 0.32 0.00 -1.51 0.00 0.00 72.50 69.54 1h7t s THR 226 CO 0.00 0.01 1.96 1.55 -2.21 0.00 0.00 174.62 175.93 1h7t h PRO 227 N 3.97 0.00 -0.05 7.08 0.13 -1.98 0.24 132.00 141.39 1h7t h PRO 227 Ca -0.48 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.43 1h7t h PRO 227 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1h7t h PRO 227 CO 0.39 0.00 -0.87 0.00 -0.23 0.00 0.00 178.00 177.30 1h7t h ALA 228 N 2.02 0.38 0.00 -0.56 0.00 -2.01 -2.97 119.26 116.12 1h7t h ALA 228 Ca 0.00 -0.66 -0.09 0.00 0.00 0.00 0.00 54.91 54.17 1h7t h ALA 228 Cb 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1h7t h ALA 228 CO 0.00 0.75 -0.68 0.00 0.00 0.00 0.00 179.25 179.32 1h7t h LEU 230 N 0.00 0.91 -0.71 0.00 5.85 -0.97 -1.60 115.31 118.78 1h7t h LEU 230 Ca -0.04 -0.26 -0.12 0.00 0.84 0.00 0.00 57.88 58.30 1h7t h LEU 230 Cb 1.31 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1h7t h LEU 230 CO 0.04 0.94 -0.31 -0.33 -0.34 0.00 0.00 178.44 178.44 1h7t h GLU 231 N 0.84 0.65 -0.36 1.25 4.39 -1.63 -0.67 114.58 119.04 1h7t h GLU 231 Ca 0.17 -0.29 -0.10 0.00 0.34 0.00 0.00 59.36 59.49 1h7t h GLU 231 Cb 0.42 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.04 1h7t h GLU 231 CO 0.01 0.88 -0.17 -0.22 -1.16 0.00 0.00 179.01 178.35 1h7t h LYS 232 N 0.55 0.67 -0.23 2.33 3.64 -1.59 -1.43 116.57 120.51 1h7t h LYS 232 Ca 0.06 -0.24 -0.14 0.00 -1.27 0.00 0.00 60.65 59.07 1h7t h LYS 232 Cb 0.81 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.58 1h7t h LYS 232 CO 0.07 0.80 -0.38 0.28 -2.27 0.00 0.00 179.45 177.95 1h7t h VAL 233 N 0.60 1.31 -0.35 2.00 2.07 -1.04 0.34 116.25 121.19 1h7t h VAL 233 Ca 0.10 -1.59 0.01 0.00 0.82 0.00 0.00 66.70 66.04 1h7t h VAL 233 Cb 0.63 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1h7t h VAL 233 CO 0.04 0.50 0.22 0.03 0.02 0.00 0.00 177.57 178.38 1h7t h ARG 234 N 0.38 0.43 -0.10 1.57 3.08 -0.90 0.35 114.38 119.18 1h7t h ARG 234 Ca 0.02 -0.03 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 1h7t h ARG 234 Cb 0.98 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 1h7t h ARG 234 CO 0.09 0.28 -0.59 0.00 -1.07 0.00 0.00 179.97 178.68 1h7t h ALA 235 N 1.14 0.81 0.00 0.04 0.00 -1.27 -0.77 119.26 119.21 1h7t h ALA 235 Ca 0.13 -0.53 -0.15 0.00 0.00 0.00 0.00 54.91 54.36 1h7t h ALA 235 Cb -0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1h7t h ALA 235 CO -0.05 0.71 -0.72 1.25 0.00 0.00 0.00 179.25 180.45 1h7t h LEU 236 N 0.24 0.00 0.05 0.00 5.85 -0.62 -0.28 115.31 120.55 1h7t h LEU 236 Ca -0.00 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.55 1h7t h LEU 236 Cb 1.10 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.15 1h7t h LEU 236 CO 0.10 0.72 -0.70 -0.03 -0.34 0.00 0.00 178.44 178.19 1h7t h MET 237 N 0.00 0.37 -0.33 1.25 4.05 -0.21 -3.02 114.93 117.05 1h7t h MET 237 Ca -0.01 -0.48 -0.09 0.00 -0.28 0.00 0.00 59.70 58.85 1h7t h MET 237 Cb 1.29 0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 32.22 1h7t h MET 237 CO 0.09 1.16 -0.17 0.00 0.23 0.00 0.00 176.91 178.22 1h7t h ALA 238 N 0.23 1.08 0.00 0.39 0.00 -1.14 -2.23 119.26 117.60 1h7t h ALA 238 Ca -0.10 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1h7t h ALA 238 Cb 1.45 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1h7t h ALA 238 CO 0.13 0.56 -0.24 0.37 0.00 0.00 0.00 179.25 180.07 1h7t h GLN 239 N 0.54 0.00 -0.03 0.00 -0.00 -1.11 -2.57 115.11 111.94 1h7t h GLN 239 Ca 0.09 0.00 -0.19 0.00 -0.00 0.00 0.00 58.65 58.54 1h7t h GLN 239 Cb 0.61 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.08 1h7t h GLN 239 CO 0.04 0.24 -0.82 1.49 0.00 0.00 0.00 178.83 179.79 1h7t h GLU 240 N 0.00 0.32 -0.35 1.69 4.81 -1.27 -3.03 114.58 116.75 1h7t h GLU 240 Ca -0.00 -0.30 -0.03 0.00 -0.13 0.00 0.00 59.36 58.89 1h7t h GLU 240 Cb 0.45 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 1h7t h GLU 240 CO 0.03 0.98 0.10 -0.07 -0.73 0.00 0.00 179.01 179.32 1h7t h LEU 241 N 0.20 0.52 -0.99 1.64 3.38 -1.07 -2.81 115.31 116.18 1h7t h LEU 241 Ca -0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1h7t h LEU 241 Cb 1.42 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 1h7t h LEU 241 CO 0.13 0.61 -0.06 0.00 0.09 0.00 0.00 178.44 179.21 1h7t h ALA 242 N 0.94 0.99 0.00 1.53 0.00 -1.61 -3.13 119.26 117.98 1h7t h ALA 242 Ca 0.11 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 1h7t h ALA 242 Cb 0.28 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1h7t h ALA 242 CO -0.00 0.08 -0.85 1.49 0.00 0.00 0.00 179.25 179.97 1h7t h GLU 243 N 0.00 0.00 -1.69 0.00 4.81 -1.40 -3.32 114.58 112.98 1h7t h GLU 243 Ca -0.00 0.00 -0.68 0.00 -0.13 0.00 0.00 59.36 58.55 1h7t h GLU 243 Cb 0.71 0.00 -0.34 0.00 0.63 0.00 0.00 28.75 29.75 1h7t h GLU 243 CO 0.01 0.75 0.25 0.09 -0.73 0.00 0.00 179.01 179.37 1h7t n ASN 244 N -3.26 6.29 -0.38 1.04 3.02 -1.07 -5.11 115.26 115.79 1h7t n ASN 244 Ca -0.00 -3.78 0.05 0.00 -0.03 0.00 0.00 54.58 50.81 1h7t n ASN 244 Cb 0.86 -0.78 0.04 0.00 -0.61 0.00 0.00 39.78 39.28 1h7t n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64