#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g9m s VAL 2 N 0.00 4.53 -0.10 5.09 -7.23 -1.26 -4.58 120.40 116.85 1g9m s VAL 2 Ca 0.00 1.21 -0.00 0.00 -1.81 0.00 0.00 61.98 61.37 1g9m s VAL 2 Cb 0.00 -3.63 -0.03 0.00 0.56 0.00 0.00 36.38 33.28 1g9m s VAL 2 CO 0.00 -0.35 -0.08 -1.10 -0.31 0.00 0.00 175.10 173.26 1g9m s GLN 3 N -3.30 3.13 -0.54 4.82 1.11 0.23 -4.90 119.66 120.21 1g9m s GLN 3 Ca 0.58 -0.58 -0.10 0.00 0.01 0.00 0.00 55.36 55.27 1g9m s GLN 3 Cb -0.10 -2.67 0.14 0.00 -1.01 0.00 0.00 33.01 29.37 1g9m s GLN 3 CO 0.18 0.45 0.42 -0.51 0.01 0.00 0.00 175.29 175.84 1g9m s LEU 4 N -0.23 5.82 -0.34 2.90 1.43 -1.26 -2.22 118.68 124.79 1g9m s LEU 4 Ca 0.03 -2.09 -0.18 0.00 -1.03 0.00 0.00 54.13 50.85 1g9m s LEU 4 Cb -0.13 -2.04 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1g9m s LEU 4 CO 0.03 -0.66 0.52 -0.76 0.23 0.00 0.00 176.35 175.71 1g9m s LEU 5 N 1.09 4.29 0.36 1.79 1.43 -0.84 -3.79 118.68 123.01 1g9m s LEU 5 Ca 0.08 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.26 1g9m s LEU 5 Cb -0.24 -2.62 -0.03 0.00 0.03 0.00 0.00 46.19 43.33 1g9m s LEU 5 CO -0.02 -0.46 0.57 -1.61 0.23 0.00 0.00 176.35 175.06 1g9m s GLU 6 N 2.41 3.42 0.65 1.70 2.02 -1.26 -0.87 118.70 126.77 1g9m s GLU 6 Ca 0.20 -0.36 -0.11 0.00 0.02 0.00 0.00 54.97 54.71 1g9m s GLU 6 Cb -0.15 -2.65 -0.02 0.00 0.10 0.00 0.00 34.13 31.41 1g9m s GLU 6 CO 0.13 0.09 1.04 -1.54 0.02 0.00 0.00 175.26 175.00 1g9m s SER 7 N -4.06 5.90 0.94 -0.19 1.04 -0.95 -4.98 113.70 111.40 1g9m s SER 7 Ca 0.41 1.50 -0.11 0.00 0.48 0.00 0.00 55.95 58.23 1g9m s SER 7 Cb -0.10 -2.48 0.14 0.00 0.10 0.00 0.00 66.02 63.69 1g9m s SER 7 CO 0.36 -1.09 1.02 0.61 0.98 0.00 0.00 173.24 175.13 1g9m n GLY 8 N -2.46 -0.73 3.41 7.32 0.00 -1.26 -4.66 105.19 106.82 1g9m n GLY 8 Ca 0.07 -0.75 -0.37 0.00 0.00 0.00 0.00 46.02 44.97 1g9m n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g9m n ALA 9 N -4.22 -1.85 -2.75 4.61 0.00 -1.26 -4.83 120.51 110.22 1g9m n ALA 9 Ca 0.11 -0.20 -0.26 0.00 0.00 0.00 0.00 53.44 53.08 1g9m n ALA 9 Cb 0.52 -1.76 -0.16 0.00 0.00 0.00 0.00 19.45 18.06 1g9m n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1g9m s GLU 10 N -2.38 1.74 -0.26 0.00 0.41 0.14 -4.97 118.70 113.37 1g9m s GLU 10 Ca 0.64 -0.65 0.00 0.00 -0.41 0.00 0.00 54.97 54.55 1g9m s GLU 10 Cb -0.37 -1.56 0.07 0.00 -1.78 0.00 0.00 34.13 30.49 1g9m s GLU 10 CO 0.60 0.30 0.01 0.08 -0.49 0.00 0.00 175.26 175.76 1g9m s VAL 11 N -0.13 1.35 0.11 2.63 1.01 -1.26 -0.24 120.40 123.86 1g9m s VAL 11 Ca -0.00 -1.32 0.06 0.00 0.00 0.00 0.00 61.98 60.72 1g9m s VAL 11 Cb -0.10 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1g9m s VAL 11 CO 0.01 -0.31 -0.15 -0.54 0.00 0.00 0.00 175.10 174.11 1g9m s LYS 12 N 1.44 1.00 0.44 2.72 -0.14 -0.51 -5.01 119.74 119.68 1g9m s LYS 12 Ca 0.01 -1.17 -0.14 0.00 -1.36 0.00 0.00 55.97 53.31 1g9m s LYS 12 Cb -0.18 -0.97 -0.07 0.00 -1.68 0.00 0.00 37.83 34.92 1g9m s LYS 12 CO -0.11 0.20 0.86 0.15 -0.76 0.00 0.00 175.35 175.70 1g9m s LYS 13 N -2.35 3.89 0.46 1.68 -0.14 -1.25 -1.47 119.74 120.56 1g9m s LYS 13 Ca 0.06 0.72 -0.25 0.00 -1.36 0.00 0.00 55.97 55.14 1g9m s LYS 13 Cb -0.07 -2.28 -0.08 0.00 -1.68 0.00 0.00 37.83 33.72 1g9m s LYS 13 CO 0.03 -0.11 1.39 -2.30 -0.76 0.00 0.00 175.35 173.59 1g9m n PRO 14 N -1.29 2.11 0.00 -1.68 -0.02 -1.23 -1.83 135.00 131.05 1g9m n PRO 14 Ca 0.04 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1g9m n PRO 14 Cb 0.54 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1g9m n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1g9m n GLY 15 N 0.66 3.07 3.79 -1.23 0.00 0.12 -4.90 105.19 106.70 1g9m n GLY 15 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 1g9m n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1g9m s SER 16 N -1.15 2.67 0.09 1.61 0.01 -0.76 -4.07 113.70 112.10 1g9m s SER 16 Ca 0.00 0.59 0.07 0.00 1.31 0.00 0.00 55.95 57.92 1g9m s SER 16 Cb 0.00 -0.85 -0.04 0.00 0.21 0.00 0.00 66.02 65.34 1g9m s SER 16 CO 0.00 -3.04 -0.12 -0.44 0.41 0.00 0.00 173.24 170.05 1g9m s SER 17 N -4.36 4.28 0.03 2.44 0.01 -1.26 -0.82 113.70 114.02 1g9m s SER 17 Ca 0.70 -0.40 0.03 0.00 1.31 0.00 0.00 55.95 57.59 1g9m s SER 17 Cb -0.09 -0.79 -0.02 0.00 0.21 0.00 0.00 66.02 65.34 1g9m s SER 17 CO 0.54 0.19 -0.10 0.54 0.41 0.00 0.00 173.24 174.82 1g9m s VAL 18 N -1.17 0.76 -0.32 3.43 0.11 -0.49 -5.00 120.40 117.72 1g9m s VAL 18 Ca 0.20 -0.86 -0.02 0.00 -2.93 0.00 0.00 61.98 58.37 1g9m s VAL 18 Cb -0.11 -0.73 0.11 0.00 -1.53 0.00 0.00 36.38 34.13 1g9m s VAL 18 CO 0.12 -0.11 0.15 -0.75 -3.33 0.00 0.00 175.10 171.18 1g9m s LYS 19 N -1.08 0.48 0.11 1.54 2.20 -1.26 -1.53 119.74 120.20 1g9m s LYS 19 Ca -0.02 -0.96 -0.10 0.00 -0.36 0.00 0.00 55.97 54.52 1g9m s LYS 19 Cb -0.07 -1.47 -0.06 0.00 -1.51 0.00 0.00 37.83 34.72 1g9m s LYS 19 CO 0.01 -1.07 0.44 0.14 -0.36 0.00 0.00 175.35 174.51 1g9m s VAL 20 N 1.60 5.03 0.37 4.02 -7.23 -0.48 -4.90 120.40 118.82 1g9m s VAL 20 Ca 0.12 0.49 0.08 0.00 -1.81 0.00 0.00 61.98 60.86 1g9m s VAL 20 Cb -0.19 -3.66 -0.05 0.00 0.56 0.00 0.00 36.38 33.04 1g9m s VAL 20 CO -0.22 0.22 0.09 -0.94 -0.31 0.00 0.00 175.10 173.94 1g9m s SER 21 N -1.88 4.31 -0.23 4.85 1.04 -1.26 -0.82 113.70 119.71 1g9m s SER 21 Ca 0.36 -1.03 -0.04 0.00 0.48 0.00 0.00 55.95 55.73 1g9m s SER 21 Cb -0.14 -0.53 0.12 0.00 0.10 0.00 0.00 66.02 65.58 1g9m s SER 21 CO 0.19 -0.37 0.39 0.00 0.98 0.00 0.00 173.24 174.43 1g9m s LYS 23 N 2.57 3.46 -0.07 0.00 2.47 -0.05 -0.43 119.74 127.69 1g9m s LYS 23 Ca 0.09 -0.36 -0.11 0.00 -1.56 0.00 0.00 55.97 54.04 1g9m s LYS 23 Cb -0.15 -3.86 -0.05 0.00 -1.46 0.00 0.00 37.83 32.32 1g9m s LYS 23 CO -0.15 -0.71 0.27 0.00 0.16 0.00 0.00 175.35 174.92 1g9m s ALA 24 N 2.33 3.78 -0.02 3.13 0.00 -0.36 -1.98 121.76 128.64 1g9m s ALA 24 Ca 0.17 -0.44 -0.18 0.00 0.00 0.00 0.00 51.96 51.50 1g9m s ALA 24 Cb -0.16 -2.18 0.03 0.00 0.00 0.00 0.00 23.12 20.81 1g9m s ALA 24 CO 0.14 0.52 0.39 -1.54 0.00 0.00 0.00 175.76 175.27 1g9m s SER 25 N -0.95 -0.30 0.00 0.00 1.04 -0.94 -4.80 113.70 107.75 1g9m s SER 25 Ca 0.19 0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1g9m s SER 25 Cb -0.14 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1g9m s SER 25 CO 0.08 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.43 1g9m n GLY 26 N 1.20 1.53 0.00 7.32 0.00 -1.26 0.77 105.19 114.75 1g9m n GLY 26 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1g9m n GLY 26 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1g9m n ASP 27 N 0.00 0.00 -4.57 1.61 2.03 -1.26 -4.31 116.55 110.05 1g9m n ASP 27 Ca 0.00 -0.08 -0.43 0.00 0.52 0.00 0.00 54.79 54.80 1g9m n ASP 27 Cb 0.00 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 1g9m n ASP 27 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1g9m s THR 28 N -2.92 4.25 0.26 5.18 2.01 -1.26 -4.93 115.64 118.23 1g9m s THR 28 Ca 0.00 0.85 -0.02 0.00 0.31 0.00 0.00 61.69 62.83 1g9m s THR 28 Cb 0.00 -4.58 0.25 0.00 0.01 0.00 0.00 72.50 68.18 1g9m s THR 28 CO 0.00 -1.07 1.69 0.15 -0.69 0.00 0.00 174.62 174.70 1g9m h PHE 29 N 9.29 0.40 0.00 4.92 3.57 -1.95 -0.33 116.94 132.83 1g9m h PHE 29 Ca -0.24 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.30 1g9m h PHE 29 Cb 1.07 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.75 1g9m h PHE 29 CO 0.95 -0.07 0.00 0.44 -2.23 0.00 0.00 178.31 177.41 1g9m n ILE 30 N -5.11 0.54 0.32 1.41 -5.35 -1.26 -2.56 119.36 107.34 1g9m n ILE 30 Ca 0.17 0.14 0.07 0.00 -0.27 0.00 0.00 62.75 62.85 1g9m n ILE 30 Cb 0.52 -0.82 0.22 0.00 -1.74 0.00 0.00 39.64 37.82 1g9m n ILE 30 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1g9m n ARG 31 N -1.38 2.44 -4.36 6.28 1.74 -0.14 -4.22 116.66 117.03 1g9m n ARG 31 Ca 0.07 -1.79 -0.19 0.00 -0.77 0.00 0.00 57.85 55.18 1g9m n ARG 31 Cb 0.18 -1.52 -0.10 0.00 -1.02 0.00 0.00 32.46 30.00 1g9m n ARG 31 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1g9m s TYR 32 N -1.55 1.71 0.02 -1.55 1.51 -1.06 -2.23 117.35 114.20 1g9m s TYR 32 Ca 0.33 -0.70 0.08 0.00 -1.01 0.00 0.00 57.07 55.77 1g9m s TYR 32 Cb 0.19 -0.90 -0.02 0.00 -0.11 0.00 0.00 41.96 41.12 1g9m s TYR 32 CO 0.19 0.23 -0.24 -1.54 -1.11 0.00 0.00 175.55 173.08 1g9m s SER 33 N -3.34 2.84 0.17 2.29 1.04 -0.55 -4.01 113.70 112.14 1g9m s SER 33 Ca 0.25 -0.51 0.10 0.00 0.48 0.00 0.00 55.95 56.27 1g9m s SER 33 Cb 0.02 -0.28 -0.04 0.00 0.10 0.00 0.00 66.02 65.82 1g9m s SER 33 CO 0.08 0.25 -0.18 -0.36 0.98 0.00 0.00 173.24 174.01 1g9m s PHE 34 N -0.70 2.48 0.05 5.02 0.40 -0.72 -2.00 117.98 122.50 1g9m s PHE 34 Ca 0.10 -0.29 0.02 0.00 -0.60 0.00 0.00 56.93 56.15 1g9m s PHE 34 Cb -0.09 -1.25 -0.03 0.00 0.51 0.00 0.00 43.02 42.16 1g9m s PHE 34 CO 0.01 0.47 -0.07 0.99 0.70 0.00 0.00 175.22 177.32 1g9m s THR 35 N -1.52 0.47 -0.05 0.64 2.01 0.16 -0.37 115.64 116.98 1g9m s THR 35 Ca 0.21 -1.22 0.05 0.00 0.31 0.00 0.00 61.69 61.04 1g9m s THR 35 Cb -0.09 -0.77 -0.02 0.00 0.01 0.00 0.00 72.50 71.64 1g9m s THR 35 CO 0.12 -0.51 -0.21 0.26 -0.69 0.00 0.00 174.62 173.58 1g9m s TRP 36 N -1.88 2.51 -0.05 4.92 0.52 -0.58 -0.48 118.94 123.90 1g9m s TRP 36 Ca -0.07 -0.48 -0.02 0.00 0.02 0.00 0.00 56.10 55.55 1g9m s TRP 36 Cb -0.07 -1.60 0.03 0.00 -1.15 0.00 0.00 33.47 30.68 1g9m s TRP 36 CO -0.01 -0.06 0.05 0.08 0.02 0.00 0.00 176.95 177.03 1g9m s VAL 37 N -0.40 -0.01 0.29 4.03 1.01 0.11 -1.58 120.40 123.85 1g9m s VAL 37 Ca 0.04 0.35 0.05 0.00 0.00 0.00 0.00 61.98 62.42 1g9m s VAL 37 Cb -0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 36.38 36.00 1g9m s VAL 37 CO 0.02 0.18 0.43 0.00 0.00 0.00 0.00 175.10 175.73 1g9m s ARG 38 N 2.13 3.30 -0.24 2.72 1.70 -0.47 -0.06 118.95 128.03 1g9m s ARG 38 Ca 0.05 -0.83 -0.06 0.00 -0.47 0.00 0.00 55.73 54.41 1g9m s ARG 38 Cb -0.12 -2.84 0.12 0.00 -0.57 0.00 0.00 34.95 31.54 1g9m s ARG 38 CO -0.04 0.24 0.49 -1.14 -1.08 0.00 0.00 175.30 173.77 1g9m s GLN 39 N -4.10 0.41 0.29 3.89 0.74 0.38 -0.74 119.66 120.53 1g9m s GLN 39 Ca 0.39 1.06 -0.28 0.00 0.05 0.00 0.00 55.36 56.59 1g9m s GLN 39 Cb -0.09 0.37 -0.09 0.00 1.10 0.00 0.00 33.01 34.29 1g9m s GLN 39 CO 0.31 -0.34 0.95 0.00 -0.55 0.00 0.00 175.29 175.66 1g9m s ALA 40 N 2.70 3.27 -0.07 1.58 0.00 -1.26 -0.14 121.76 127.83 1g9m s ALA 40 Ca 0.02 0.58 -0.38 0.00 0.00 0.00 0.00 51.96 52.18 1g9m s ALA 40 Cb -0.13 -3.20 -0.16 0.00 0.00 0.00 0.00 23.12 19.63 1g9m s ALA 40 CO -0.16 0.17 1.57 -0.35 0.00 0.00 0.00 175.76 176.99 1g9m n PRO 41 N 0.98 1.31 -0.76 0.00 -0.04 -1.26 -0.64 135.00 134.58 1g9m n PRO 41 Ca 0.00 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.94 1g9m n PRO 41 Cb 0.49 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.78 1g9m n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1g9m n GLY 42 N 3.43 0.83 3.77 0.55 0.00 -1.26 -5.03 105.19 107.49 1g9m n GLY 42 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 1g9m n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1g9m s GLN 43 N -0.24 2.19 0.00 1.61 -1.52 0.19 -5.15 119.66 116.73 1g9m s GLN 43 Ca 0.00 -2.35 0.00 0.00 -1.95 0.00 0.00 55.36 51.06 1g9m s GLN 43 Cb 0.00 -1.60 0.00 0.00 -0.22 0.00 0.00 33.01 31.19 1g9m s GLN 43 CO 0.00 -0.38 0.00 0.41 -0.25 0.00 0.00 175.29 175.07 1g9m n GLY 44 N -1.31 -0.84 3.83 3.09 0.00 -1.26 -4.66 105.19 104.04 1g9m n GLY 44 Ca -0.17 -1.70 -0.36 0.00 0.00 0.00 0.00 46.02 43.79 1g9m n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g9m s LEU 45 N 0.00 4.38 -0.12 0.99 1.43 -1.26 -4.24 118.68 119.87 1g9m s LEU 45 Ca 0.00 1.19 -0.01 0.00 -1.03 0.00 0.00 54.13 54.28 1g9m s LEU 45 Cb 0.00 -3.24 0.03 0.00 0.03 0.00 0.00 46.19 43.01 1g9m s LEU 45 CO 0.00 0.13 -0.03 -0.70 0.23 0.00 0.00 176.35 175.98 1g9m s GLU 46 N -1.76 1.11 0.14 1.70 2.12 0.08 -4.99 118.70 117.11 1g9m s GLU 46 Ca 0.37 -0.20 -0.31 0.00 0.36 0.00 0.00 54.97 55.18 1g9m s GLU 46 Cb -0.16 -1.52 -0.09 0.00 0.26 0.00 0.00 34.13 32.61 1g9m s GLU 46 CO 0.19 -0.35 1.51 -0.46 -0.54 0.00 0.00 175.26 175.61 1g9m s TRP 47 N 1.80 3.09 -0.20 5.30 -0.00 -1.26 -1.36 118.94 126.31 1g9m s TRP 47 Ca 0.04 0.73 -0.02 0.00 -0.00 0.00 0.00 56.10 56.85 1g9m s TRP 47 Cb -0.13 -3.84 -0.12 0.00 -0.00 0.00 0.00 33.47 29.38 1g9m s TRP 47 CO -0.07 -3.06 -0.20 -1.33 -0.00 0.00 0.00 176.95 172.29 1g9m n MET 48 N 4.06 0.47 0.00 5.86 2.81 -0.62 -4.75 117.12 124.95 1g9m n MET 48 Ca 0.13 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.15 1g9m n MET 48 Cb 0.40 -1.34 0.00 0.00 -0.71 0.00 0.00 33.22 31.57 1g9m n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1g9m n GLY 49 N 2.35 1.33 3.11 3.03 0.00 -1.22 -0.81 105.19 112.98 1g9m n GLY 49 Ca -0.36 -0.97 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 1g9m n GLY 49 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1g9m s ARG 50 N -2.00 0.33 -0.05 1.61 3.52 -0.54 -1.52 118.95 120.29 1g9m s ARG 50 Ca 0.00 0.11 0.04 0.00 -0.13 0.00 0.00 55.73 55.75 1g9m s ARG 50 Cb 0.00 0.15 -0.02 0.00 -1.56 0.00 0.00 34.95 33.52 1g9m s ARG 50 CO 0.00 -0.06 -0.18 -1.50 -0.81 0.00 0.00 175.30 172.75 1g9m s ILE 51 N -0.32 2.73 -1.11 4.11 2.07 0.50 -1.17 121.20 128.01 1g9m s ILE 51 Ca -0.04 -0.84 -0.13 0.00 -1.41 0.00 0.00 60.65 58.23 1g9m s ILE 51 Cb -0.03 -2.05 0.20 0.00 0.13 0.00 0.00 42.46 40.71 1g9m s ILE 51 CO 0.01 0.58 1.24 -0.63 -1.91 0.00 0.00 174.94 174.23 1g9m s ILE 52 N -0.54 5.34 0.27 2.00 1.01 -0.42 -1.76 121.20 127.10 1g9m s ILE 52 Ca 0.07 -2.74 0.13 0.00 0.00 0.00 0.00 60.65 58.12 1g9m s ILE 52 Cb -0.11 -4.77 0.27 0.00 0.01 0.00 0.00 42.46 37.86 1g9m s ILE 52 CO 0.01 -1.43 1.19 0.41 0.00 0.00 0.00 174.94 175.12 1g9m n THR 53 N 4.08 -0.32 -0.07 2.92 -1.04 -1.26 -0.64 114.28 117.96 1g9m n THR 53 Ca 0.29 1.55 -0.11 0.00 -2.04 0.00 0.00 64.05 63.75 1g9m n THR 53 Cb 0.43 -2.48 -0.04 0.00 -1.82 0.00 0.00 70.33 66.42 1g9m n THR 53 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 1g9m h ILE 54 N 0.00 1.19 0.00 12.58 6.09 -1.80 -3.08 117.51 132.49 1g9m h ILE 54 Ca 0.61 -0.60 -0.01 0.00 -1.37 0.00 0.00 64.86 63.49 1g9m h ILE 54 Cb 1.57 1.17 -0.00 0.00 0.47 0.00 0.00 36.82 40.03 1g9m h ILE 54 CO -0.60 0.19 -0.40 -0.07 -3.07 0.00 0.00 178.15 174.20 1g9m h LEU 55 N 0.19 0.00 0.33 2.19 4.07 -1.31 -3.48 115.31 117.30 1g9m h LEU 55 Ca 0.07 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 57.83 1g9m h LEU 55 Cb 0.23 0.00 0.03 0.00 1.08 0.00 0.00 40.66 42.00 1g9m h LEU 55 CO -0.00 0.05 -0.30 -0.67 -1.08 0.00 0.00 178.44 176.44 1g9m n ASP 56 N -2.97 -3.83 -4.30 -0.43 4.64 0.19 -5.02 116.55 104.83 1g9m n ASP 56 Ca 0.02 -0.14 -0.32 0.00 -1.38 0.00 0.00 54.79 52.98 1g9m n ASP 56 Cb 0.56 -2.75 -0.16 0.00 -1.04 0.00 0.00 41.12 37.73 1g9m n ASP 56 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1g9m s VAL 57 N -2.83 2.34 0.20 5.18 1.01 -1.24 -4.97 120.40 120.08 1g9m s VAL 57 Ca 0.14 -0.95 0.11 0.00 0.00 0.00 0.00 61.98 61.28 1g9m s VAL 57 Cb -0.06 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1g9m s VAL 57 CO 0.18 0.56 -0.21 0.00 0.00 0.00 0.00 175.10 175.63 1g9m s ALA 58 N -0.01 2.62 -0.04 5.51 0.00 -1.26 -1.30 121.76 127.27 1g9m s ALA 58 Ca -0.07 -1.62 0.02 0.00 0.00 0.00 0.00 51.96 50.28 1g9m s ALA 58 Cb -0.15 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.59 1g9m s ALA 58 CO 0.05 0.43 -0.08 -1.01 0.00 0.00 0.00 175.76 175.15 1g9m s HIS 59 N -1.72 0.99 0.33 0.00 3.76 -0.32 -4.99 115.29 113.33 1g9m s HIS 59 Ca 0.22 -0.30 0.09 0.00 -0.15 0.00 0.00 55.06 54.92 1g9m s HIS 59 Cb -0.08 -0.77 -0.05 0.00 1.11 0.00 0.00 32.58 32.79 1g9m s HIS 59 CO 0.11 -0.18 0.01 0.71 -0.85 0.00 0.00 174.74 174.54 1g9m s TYR 60 N 0.63 2.57 0.41 1.40 1.51 -1.26 -1.47 117.35 121.14 1g9m s TYR 60 Ca -0.10 -0.39 -0.24 0.00 -1.01 0.00 0.00 57.07 55.32 1g9m s TYR 60 Cb -0.13 -1.43 -0.08 0.00 -0.11 0.00 0.00 41.96 40.21 1g9m s TYR 60 CO 0.01 0.50 1.15 0.00 -1.11 0.00 0.00 175.55 176.10 1g9m s ALA 61 N -2.48 3.10 0.08 3.71 0.00 0.01 -4.73 121.76 121.46 1g9m s ALA 61 Ca 0.34 0.91 -0.24 0.00 0.00 0.00 0.00 51.96 52.98 1g9m s ALA 61 Cb -0.02 -3.36 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 1g9m s ALA 61 CO 0.19 -0.51 1.39 -1.35 0.00 0.00 0.00 175.76 175.49 1g9m h PRO 62 N 2.48 -0.40 0.00 0.00 0.11 -1.93 0.80 132.00 133.06 1g9m h PRO 62 Ca -0.49 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1g9m h PRO 62 Cb 1.23 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1g9m h PRO 62 CO 0.62 -0.26 0.14 -2.39 -0.21 0.00 0.00 178.00 175.90 1g9m n HIS 63 N -4.57 0.00 -0.02 0.65 1.44 -1.26 -1.83 115.22 109.63 1g9m n HIS 63 Ca -0.04 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.65 1g9m n HIS 63 Cb 0.27 -0.34 -0.03 0.00 0.12 0.00 0.00 29.99 30.01 1g9m n HIS 63 CO 0.00 0.00 0.00 -0.11 -2.81 0.00 0.00 176.34 173.42 1g9m n LEU 64 N -1.33 0.59 -4.51 2.39 7.94 -0.46 -4.99 117.00 116.63 1g9m n LEU 64 Ca 0.00 -0.01 -0.54 0.00 -1.11 0.00 0.00 56.01 54.36 1g9m n LEU 64 Cb 0.14 0.04 -0.08 0.00 0.53 0.00 0.00 43.42 44.06 1g9m n LEU 64 CO 0.00 0.19 1.63 1.67 -1.11 0.00 0.00 177.39 179.77 1g9m n GLN 65 N -2.24 1.02 0.00 1.96 0.00 0.27 -1.64 117.38 116.75 1g9m n GLN 65 Ca -0.07 0.32 0.00 0.00 -0.00 0.00 0.00 57.00 57.25 1g9m n GLN 65 Cb 0.62 -2.24 0.00 0.00 0.00 0.00 0.00 30.24 28.62 1g9m n GLN 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1g9m n GLY 66 N 5.84 3.92 0.19 1.69 0.00 -1.26 -4.89 105.19 110.69 1g9m n GLY 66 Ca 0.38 -0.97 0.08 0.00 0.00 0.00 0.00 46.02 45.51 1g9m n GLY 66 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1g9m n ARG 67 N 0.00 1.88 -4.51 1.61 1.85 -0.65 -4.99 116.66 111.86 1g9m n ARG 67 Ca 0.00 -2.40 -0.20 0.00 -1.00 0.00 0.00 57.85 54.25 1g9m n ARG 67 Cb 0.00 -1.45 -0.15 0.00 -1.05 0.00 0.00 32.46 29.81 1g9m n ARG 67 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1g9m s VAL 68 N -2.46 0.92 -0.05 8.89 0.11 -1.20 -1.58 120.40 125.04 1g9m s VAL 68 Ca 0.27 -0.52 -0.03 0.00 -2.93 0.00 0.00 61.98 58.77 1g9m s VAL 68 Cb 0.23 -0.78 0.03 0.00 -1.53 0.00 0.00 36.38 34.33 1g9m s VAL 68 CO 0.04 0.25 0.12 -0.89 -3.33 0.00 0.00 175.10 171.29 1g9m s THR 69 N -0.30 -0.03 -0.06 5.04 2.01 -0.35 -4.90 115.64 117.04 1g9m s THR 69 Ca 0.04 0.12 0.06 0.00 0.31 0.00 0.00 61.69 62.22 1g9m s THR 69 Cb -0.05 -0.20 -0.01 0.00 0.01 0.00 0.00 72.50 72.25 1g9m s THR 69 CO -0.00 0.05 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.10 1g9m s ILE 70 N 0.77 2.05 0.22 1.82 1.01 -1.26 0.21 121.20 126.01 1g9m s ILE 70 Ca -0.06 -1.06 -0.04 0.00 0.00 0.00 0.00 60.65 59.50 1g9m s ILE 70 Cb -0.08 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.63 1g9m s ILE 70 CO -0.04 0.57 0.22 0.42 0.00 0.00 0.00 174.94 176.12 1g9m s THR 71 N -0.12 0.00 -0.11 2.92 -4.23 -0.81 -4.86 115.64 108.43 1g9m s THR 71 Ca -0.05 -1.85 -0.09 0.00 -1.18 0.00 0.00 61.69 58.52 1g9m s THR 71 Cb -0.14 -2.43 0.03 0.00 1.34 0.00 0.00 72.50 71.30 1g9m s THR 71 CO 0.04 0.00 0.29 0.00 -0.54 0.00 0.00 174.62 174.41 1g9m s ALA 72 N -4.09 -0.71 -0.55 3.99 0.00 -1.26 0.00 121.76 119.15 1g9m s ALA 72 Ca 0.35 0.88 -0.09 0.00 0.00 0.00 0.00 51.96 53.10 1g9m s ALA 72 Cb 0.05 -0.52 0.14 0.00 0.00 0.00 0.00 23.12 22.79 1g9m s ALA 72 CO 0.12 -0.15 0.42 0.34 0.00 0.00 0.00 175.76 176.49 1g9m s ASP 73 N 0.38 5.76 0.63 0.00 3.68 -0.39 -4.93 116.67 121.80 1g9m s ASP 73 Ca -0.02 -2.21 0.27 0.00 2.13 0.00 0.00 52.55 52.72 1g9m s ASP 73 Cb -0.04 -2.01 1.41 0.00 -1.45 0.00 0.00 42.92 40.84 1g9m s ASP 73 CO -0.02 -0.61 1.82 0.11 0.13 0.00 0.00 175.17 176.60 1g9m h LYS 74 N 8.08 0.00 -0.37 4.34 6.56 -1.96 -0.41 116.57 132.80 1g9m h LYS 74 Ca -0.13 0.00 -0.16 0.00 -1.06 0.00 0.00 60.65 59.31 1g9m h LYS 74 Cb 1.04 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.70 1g9m h LYS 74 CO 0.82 0.00 -0.39 0.66 -2.06 0.00 0.00 179.45 178.48 1g9m h SER 75 N 0.00 0.97 -0.36 0.86 4.64 -1.96 -3.25 113.55 114.44 1g9m h SER 75 Ca 0.13 -0.44 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1g9m h SER 75 Cb 1.12 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1g9m h SER 75 CO -0.00 1.23 0.00 0.35 -0.87 0.00 0.00 176.83 177.54 1g9m n THR 76 N -4.05 0.75 -3.80 2.95 -2.24 -0.30 -4.98 114.28 102.61 1g9m n THR 76 Ca -0.02 -0.87 -0.24 0.00 -2.27 0.00 0.00 64.05 60.64 1g9m n THR 76 Cb 0.54 0.71 0.01 0.00 -2.10 0.00 0.00 70.33 69.49 1g9m n THR 76 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1g9m n SER 77 N 0.88 -1.38 -4.18 3.42 7.64 -0.42 -4.77 113.62 114.81 1g9m n SER 77 Ca 0.14 -0.93 -0.22 0.00 1.01 0.00 0.00 58.87 58.87 1g9m n SER 77 Cb 0.46 -3.54 -0.14 0.00 -1.01 0.00 0.00 64.21 59.99 1g9m n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1g9m s THR 78 N -3.77 1.32 0.09 0.44 2.01 -1.20 -1.23 115.64 113.30 1g9m s THR 78 Ca 0.07 -1.05 0.08 0.00 0.31 0.00 0.00 61.69 61.10 1g9m s THR 78 Cb -0.02 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.28 1g9m s THR 78 CO 0.85 0.10 -0.17 -0.69 -0.69 0.00 0.00 174.62 174.02 1g9m s VAL 79 N -0.80 2.92 0.06 3.82 1.01 0.43 -1.26 120.40 126.59 1g9m s VAL 79 Ca 0.04 -1.36 0.06 0.00 0.00 0.00 0.00 61.98 60.72 1g9m s VAL 79 Cb -0.08 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 1g9m s VAL 79 CO 0.01 0.18 -0.16 -0.31 0.00 0.00 0.00 175.10 174.82 1g9m s TYR 80 N -1.09 1.41 -0.05 5.22 2.02 0.10 -0.55 117.35 124.41 1g9m s TYR 80 Ca 0.17 -0.41 0.04 0.00 -0.37 0.00 0.00 57.07 56.51 1g9m s TYR 80 Cb -0.11 -0.80 -0.00 0.00 -0.40 0.00 0.00 41.96 40.65 1g9m s TYR 80 CO 0.09 0.09 -0.17 -1.17 -1.57 0.00 0.00 175.55 172.81 1g9m s LEU 81 N -1.52 1.92 -0.08 -1.29 0.20 0.00 -1.93 118.68 115.98 1g9m s LEU 81 Ca 0.02 -0.36 0.02 0.00 0.69 0.00 0.00 54.13 54.49 1g9m s LEU 81 Cb -0.09 -0.99 0.02 0.00 -0.43 0.00 0.00 46.19 44.69 1g9m s LEU 81 CO 0.02 0.15 -0.11 -0.70 -0.29 0.00 0.00 176.35 175.42 1g9m s GLU 82 N 0.05 1.69 -0.14 1.98 2.12 0.13 -1.38 118.70 123.15 1g9m s GLU 82 Ca -0.04 -0.39 0.02 0.00 0.36 0.00 0.00 54.97 54.92 1g9m s GLU 82 Cb -0.12 -1.46 0.01 0.00 0.26 0.00 0.00 34.13 32.82 1g9m s GLU 82 CO 0.02 -0.03 -0.22 -0.51 -0.54 0.00 0.00 175.26 173.98 1g9m s LEU 83 N 0.87 2.11 0.38 2.70 1.43 -0.58 -1.21 118.68 124.37 1g9m s LEU 83 Ca -0.11 -0.61 0.08 0.00 -1.03 0.00 0.00 54.13 52.46 1g9m s LEU 83 Cb -0.15 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.60 1g9m s LEU 83 CO 0.01 0.08 0.38 0.00 0.23 0.00 0.00 176.35 177.04 1g9m s ARG 84 N 0.84 2.71 -1.18 1.70 1.70 -0.61 -1.40 118.95 122.71 1g9m s ARG 84 Ca -0.06 -1.35 -0.22 0.00 -0.47 0.00 0.00 55.73 53.63 1g9m s ARG 84 Cb -0.15 -2.51 0.00 0.00 -0.57 0.00 0.00 34.95 31.72 1g9m s ARG 84 CO -0.03 -0.06 0.73 0.09 -1.08 0.00 0.00 175.30 174.96 1g9m n ASN 85 N -1.52 -4.57 -4.66 -2.89 5.03 -1.21 -4.81 115.26 100.62 1g9m n ASN 85 Ca 0.02 -1.08 -0.42 0.00 0.87 0.00 0.00 54.58 53.97 1g9m n ASN 85 Cb 0.60 -2.99 0.01 0.00 -1.02 0.00 0.00 39.78 36.38 1g9m n ASN 85 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1g9m n LEU 86 N -4.39 3.25 -4.33 3.41 4.77 -0.00 -4.63 117.00 115.09 1g9m n LEU 86 Ca -0.12 1.09 -0.23 0.00 -0.03 0.00 0.00 56.01 56.72 1g9m n LEU 86 Cb 0.59 -1.42 -0.12 0.00 -2.33 0.00 0.00 43.42 40.14 1g9m n LEU 86 CO 0.69 -1.02 -0.50 -0.13 -1.33 0.00 0.00 177.39 175.10 1g9m s ARG 87 N -2.05 1.25 0.30 3.23 1.81 -1.26 0.11 118.95 122.34 1g9m s ARG 87 Ca 0.61 -1.33 0.01 0.00 -1.72 0.00 0.00 55.73 53.30 1g9m s ARG 87 Cb -0.55 -1.42 0.54 0.00 -0.45 0.00 0.00 34.95 33.08 1g9m s ARG 87 CO 0.58 0.31 1.90 0.66 -0.68 0.00 0.00 175.30 178.07 1g9m h SER 88 N 3.56 0.90 0.32 0.23 4.64 -1.95 0.62 113.55 121.86 1g9m h SER 88 Ca -0.44 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1g9m h SER 88 Cb 1.20 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1g9m h SER 88 CO 0.46 0.56 0.00 -0.90 -0.87 0.00 0.00 176.83 176.09 1g9m n ASP 89 N -4.50 0.32 0.10 4.97 5.75 -1.26 -1.65 116.55 120.27 1g9m n ASP 89 Ca 0.14 0.61 0.13 0.00 -0.01 0.00 0.00 54.79 55.66 1g9m n ASP 89 Cb 0.22 -0.67 0.44 0.00 -1.03 0.00 0.00 41.12 40.09 1g9m n ASP 89 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1g9m n ASP 90 N -1.89 0.68 -4.68 -1.12 10.43 0.21 -4.80 116.55 115.39 1g9m n ASP 90 Ca 0.01 0.59 -0.45 0.00 2.57 0.00 0.00 54.79 57.51 1g9m n ASP 90 Cb 0.11 -0.76 -0.04 0.00 1.84 0.00 0.00 41.12 42.27 1g9m n ASP 90 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 1g9m n THR 91 N -2.17 0.19 0.00 -3.53 -1.04 -0.66 -4.87 114.28 102.21 1g9m n THR 91 Ca 0.05 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1g9m n THR 91 Cb 0.37 -1.79 0.00 0.00 -1.82 0.00 0.00 70.33 67.09 1g9m n THR 91 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1g9m n ALA 92 N 4.60 0.00 -2.53 2.41 0.00 -0.32 -4.57 120.51 120.11 1g9m n ALA 92 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.24 1g9m n ALA 92 Cb 0.32 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.71 1g9m n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1g9m s VAL 93 N -2.00 5.00 -0.23 0.00 1.01 0.80 -1.19 120.40 123.78 1g9m s VAL 93 Ca 0.00 1.05 -0.06 0.00 0.00 0.00 0.00 61.98 62.97 1g9m s VAL 93 Cb 0.00 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 1g9m s VAL 93 CO 0.00 0.45 0.01 -0.31 0.00 0.00 0.00 175.10 175.25 1g9m s TYR 94 N -0.30 3.03 -0.13 5.22 2.02 0.11 -0.47 117.35 126.83 1g9m s TYR 94 Ca 0.27 -0.63 -0.05 0.00 -0.37 0.00 0.00 57.07 56.29 1g9m s TYR 94 Cb -0.17 -2.16 -0.04 0.00 -0.40 0.00 0.00 41.96 39.19 1g9m s TYR 94 CO 0.14 -0.42 0.06 -0.06 -1.57 0.00 0.00 175.55 173.71 1g9m s PHE 95 N 1.47 3.31 -0.12 2.71 0.08 0.92 0.19 117.98 126.53 1g9m s PHE 95 Ca 0.05 0.23 -0.03 0.00 0.12 0.00 0.00 56.93 57.30 1g9m s PHE 95 Cb -0.15 -1.94 -0.03 0.00 -0.57 0.00 0.00 43.02 40.33 1g9m s PHE 95 CO 0.01 0.41 -0.02 0.00 -0.10 0.00 0.00 175.22 175.52 1g9m s ALA 97 N -0.23 -0.42 0.24 0.00 0.00 0.37 -0.95 121.76 120.77 1g9m s ALA 97 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1g9m s ALA 97 Cb -0.13 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 1g9m s ALA 97 CO 0.02 -0.37 0.20 0.20 0.00 0.00 0.00 175.76 175.81 1g9m s GLY 98 N -2.09 1.62 -0.08 0.00 0.00 0.17 0.39 107.32 107.33 1g9m s GLY 98 Ca -0.05 -1.74 -0.19 0.00 0.00 0.00 0.00 44.72 42.74 1g9m s GLY 98 CO -0.04 -1.36 0.45 -1.34 0.00 0.00 0.00 173.10 170.81 1g9m s VAL 99 N -3.93 0.02 0.26 1.40 -7.23 -0.85 -1.20 120.40 108.88 1g9m s VAL 99 Ca 0.38 -0.20 -0.29 0.00 -1.81 0.00 0.00 61.98 60.06 1g9m s VAL 99 Cb 0.05 -0.71 -0.09 0.00 0.56 0.00 0.00 36.38 36.19 1g9m s VAL 99 CO 0.16 -0.11 1.18 -0.47 -0.31 0.00 0.00 175.10 175.56 1g9m s TYR 100 N -0.71 3.40 -0.20 2.82 5.04 -1.26 -1.49 117.35 124.95 1g9m s TYR 100 Ca -0.08 1.53 0.07 0.00 -2.44 0.00 0.00 57.07 56.15 1g9m s TYR 100 Cb -0.03 -3.43 -0.08 0.00 0.35 0.00 0.00 41.96 38.76 1g9m s TYR 100 CO 0.04 -1.10 0.23 0.39 -1.34 0.00 0.00 175.55 173.77 1g9m n GLU 101 N 1.53 3.19 0.00 4.97 -0.58 -0.95 -4.74 120.64 124.07 1g9m n GLU 101 Ca 0.01 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1g9m n GLU 101 Cb 0.44 -0.93 0.00 0.00 -0.57 0.00 0.00 31.44 30.38 1g9m n GLU 101 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1g9m n GLY 102 N 1.50 0.46 2.99 0.62 0.00 -1.26 -1.00 105.19 108.50 1g9m n GLY 102 Ca 0.00 -2.25 -0.43 0.00 0.00 0.00 0.00 46.02 43.35 1g9m n GLY 102 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1g9m n GLU 103 N 0.00 3.44 -0.35 1.61 1.02 -1.20 -4.74 120.64 120.42 1g9m n GLU 103 Ca 0.00 -3.44 0.12 0.00 -0.02 0.00 0.00 57.16 53.83 1g9m n GLU 103 Cb 0.00 -3.03 0.32 0.00 -0.02 0.00 0.00 31.44 28.71 1g9m n GLU 103 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1g9m h ALA 104 N 6.13 1.68 0.00 0.62 0.00 -1.45 0.46 119.26 126.70 1g9m h ALA 104 Ca 0.41 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1g9m h ALA 104 Cb 0.69 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1g9m h ALA 104 CO 1.59 -0.03 0.00 0.38 0.00 0.00 0.00 179.25 181.19 1g9m h ASP 105 N 0.78 0.00 -0.27 0.00 2.03 -1.84 -0.12 116.42 117.01 1g9m h ASP 105 Ca 0.56 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.86 1g9m h ASP 105 Cb 0.85 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.35 1g9m h ASP 105 CO -0.35 0.00 0.00 -0.62 -1.03 0.00 0.00 179.24 177.24 1g9m n GLU 106 N -2.76 2.09 -0.25 4.15 -0.58 0.15 -4.97 120.64 118.47 1g9m n GLU 106 Ca -0.01 -1.86 0.00 0.00 -0.42 0.00 0.00 57.16 54.87 1g9m n GLU 106 Cb 0.12 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.67 1g9m n GLU 106 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1g9m n GLY 107 N 0.79 0.70 3.60 0.62 0.00 -0.06 -5.05 105.19 105.79 1g9m n GLY 107 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1g9m n GLY 107 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1g9m s GLU 108 N -0.75 3.97 -0.20 1.61 2.12 -0.58 -4.94 118.70 119.93 1g9m s GLU 108 Ca 0.00 -0.08 -0.04 0.00 0.36 0.00 0.00 54.97 55.22 1g9m s GLU 108 Cb 0.00 -3.67 0.10 0.00 0.26 0.00 0.00 34.13 30.82 1g9m s GLU 108 CO 0.00 -0.27 0.27 -0.47 -0.54 0.00 0.00 175.26 174.25 1g9m s TYR 109 N 1.99 -0.43 -0.42 5.30 6.14 -1.26 -1.28 117.35 127.40 1g9m s TYR 109 Ca 0.13 0.49 0.23 0.00 0.64 0.00 0.00 57.07 58.56 1g9m s TYR 109 Cb -0.16 -0.22 0.31 0.00 0.42 0.00 0.00 41.96 42.32 1g9m s TYR 109 CO 0.10 -0.59 1.57 0.00 0.64 0.00 0.00 175.55 177.27 1g9m h ARG 110 N 8.28 0.00 -5.64 4.97 2.47 -1.44 -3.48 114.38 119.54 1g9m h ARG 110 Ca -0.17 0.00 -0.32 0.00 -1.26 0.00 0.00 59.98 58.23 1g9m h ARG 110 Cb 1.15 0.00 0.17 0.00 -1.65 0.00 0.00 29.97 29.64 1g9m h ARG 110 CO 0.25 0.01 -0.80 -1.71 0.56 0.00 0.00 179.97 178.29 1g9m n ASN 111 N -3.08 -3.20 -4.74 7.04 5.15 -1.26 -4.93 115.26 110.25 1g9m n ASN 111 Ca 0.04 -0.66 -0.41 0.00 -0.60 0.00 0.00 54.58 52.94 1g9m n ASN 111 Cb 0.54 -5.06 -0.03 0.00 -0.53 0.00 0.00 39.78 34.70 1g9m n ASN 111 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1g9m s ASN 112 N -4.10 6.98 -0.15 1.20 0.01 -1.26 -4.96 114.94 112.65 1g9m s ASN 112 Ca 0.12 2.32 -0.04 0.00 -0.71 0.00 0.00 52.86 54.55 1g9m s ASN 112 Cb -0.02 -2.61 -0.24 0.00 0.41 0.00 0.00 41.25 38.80 1g9m s ASN 112 CO 0.74 -0.46 0.23 0.61 -1.51 0.00 0.00 177.10 176.71 1g9m n GLY 113 N 2.32 -0.53 3.45 0.66 0.00 -1.26 -4.97 105.19 104.86 1g9m n GLY 113 Ca 0.05 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 1g9m n GLY 113 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1g9m n PHE 114 N -3.41 -0.97 -4.03 1.61 -1.74 -1.26 -5.02 117.46 102.64 1g9m n PHE 114 Ca -0.35 0.04 -0.31 0.00 -0.56 0.00 0.00 57.45 56.28 1g9m n PHE 114 Cb 1.04 -1.73 -0.16 0.00 1.52 0.00 0.00 39.48 40.15 1g9m n PHE 114 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1g9m s LEU 115 N -5.12 2.25 -0.20 5.98 1.43 -1.26 -4.70 118.68 117.06 1g9m s LEU 115 Ca 0.64 -0.82 0.11 0.00 -1.03 0.00 0.00 54.13 53.03 1g9m s LEU 115 Cb -0.21 -1.29 -0.22 0.00 0.03 0.00 0.00 46.19 44.49 1g9m s LEU 115 CO 0.64 -0.11 0.07 1.17 0.23 0.00 0.00 176.35 178.35 1g9m n LYS 116 N 4.67 0.68 -4.46 1.70 3.00 -0.91 -4.90 118.16 117.93 1g9m n LYS 116 Ca -0.16 0.09 -0.33 0.00 -0.00 0.00 0.00 58.31 57.91 1g9m n LYS 116 Cb 0.47 -1.56 -0.15 0.00 0.00 0.00 0.00 35.03 33.79 1g9m n LYS 116 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1g9m s HIS 117 N -2.52 2.83 0.29 5.64 3.76 -0.34 -4.98 115.29 119.97 1g9m s HIS 117 Ca -0.18 -0.92 0.10 0.00 -0.15 0.00 0.00 55.06 53.92 1g9m s HIS 117 Cb 0.07 -1.92 -0.05 0.00 1.11 0.00 0.00 32.58 31.79 1g9m s HIS 117 CO 0.76 -0.42 -0.16 -1.58 -0.85 0.00 0.00 174.74 172.49 1g9m s TRP 118 N 0.82 2.22 0.42 1.40 0.52 -1.26 0.46 118.94 123.51 1g9m s TRP 118 Ca -0.04 -0.43 0.08 0.00 0.02 0.00 0.00 56.10 55.72 1g9m s TRP 118 Cb -0.15 -1.07 -0.02 0.00 -1.15 0.00 0.00 33.47 31.08 1g9m s TRP 118 CO 0.00 0.61 0.38 0.20 0.02 0.00 0.00 176.95 178.16 1g9m s GLY 119 N -3.50 2.14 0.64 0.98 0.00 -0.12 -4.42 107.32 103.04 1g9m s GLY 119 Ca 0.30 -1.89 0.38 0.00 0.00 0.00 0.00 44.72 43.50 1g9m s GLY 119 CO 0.14 -1.70 2.26 0.06 0.00 0.00 0.00 173.10 173.86 1g9m h GLN 120 N 1.03 0.00 0.00 2.90 -0.00 -1.90 -3.44 115.11 113.69 1g9m h GLN 120 Ca -0.41 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.24 1g9m h GLN 120 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.75 1g9m h GLN 120 CO 0.57 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.81 1g9m n GLY 121 N -1.19 -0.63 3.11 0.06 0.00 -1.26 -5.01 105.19 100.27 1g9m n GLY 121 Ca -0.02 -1.51 -0.32 0.00 0.00 0.00 0.00 46.02 44.17 1g9m n GLY 121 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g9m s THR 122 N -3.12 1.95 0.20 2.61 2.01 0.13 -4.89 115.64 114.52 1g9m s THR 122 Ca 0.00 -0.88 -0.30 0.00 0.31 0.00 0.00 61.69 60.82 1g9m s THR 122 Cb 0.00 -1.76 -0.08 0.00 0.01 0.00 0.00 72.50 70.67 1g9m s THR 122 CO 0.00 0.52 1.14 -0.22 -0.69 0.00 0.00 174.62 175.37 1g9m s LEU 123 N 1.20 4.48 -0.26 4.42 2.96 -1.26 0.07 118.68 130.30 1g9m s LEU 123 Ca 0.02 2.18 -0.03 0.00 -0.22 0.00 0.00 54.13 56.08 1g9m s LEU 123 Cb -0.14 -3.61 0.09 0.00 0.50 0.00 0.00 46.19 43.03 1g9m s LEU 123 CO -0.10 -0.27 0.10 -0.69 -1.32 0.00 0.00 176.35 174.07 1g9m s VAL 124 N -0.33 0.29 -0.21 1.68 1.01 -0.34 0.26 120.40 122.75 1g9m s VAL 124 Ca 0.50 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 61.54 1g9m s VAL 124 Cb -0.31 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 1g9m s VAL 124 CO 0.37 -0.55 0.32 -0.89 0.00 0.00 0.00 175.10 174.35 1g9m s THR 125 N 1.93 5.25 -0.29 3.92 2.01 0.66 -1.17 115.64 127.96 1g9m s THR 125 Ca 0.06 0.53 -0.02 0.00 0.31 0.00 0.00 61.69 62.57 1g9m s THR 125 Cb -0.17 -3.65 0.04 0.00 0.01 0.00 0.00 72.50 68.73 1g9m s THR 125 CO -0.24 0.28 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.28 1g9m s VAL 126 N 1.23 3.09 0.23 3.82 1.01 -1.26 -1.43 120.40 127.09 1g9m s VAL 126 Ca 0.15 -1.19 -0.08 0.00 0.00 0.00 0.00 61.98 60.86 1g9m s VAL 126 Cb -0.14 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1g9m s VAL 126 CO 0.07 0.00 0.33 -0.89 0.00 0.00 0.00 175.10 174.61 1g9m s THR 127 N 1.31 0.00 -0.61 3.92 2.01 -0.54 -4.52 115.64 117.20 1g9m s THR 127 Ca -0.03 -1.65 0.23 0.00 0.31 0.00 0.00 61.69 60.55 1g9m s THR 127 Cb -0.19 -2.32 -0.13 0.00 0.01 0.00 0.00 72.50 69.87 1g9m s THR 127 CO -0.02 -0.01 0.99 -1.54 -0.69 0.00 0.00 174.62 173.36 1g9m n SER 128 N -0.33 0.61 -4.78 3.53 3.41 -1.26 -3.54 113.62 111.25 1g9m n SER 128 Ca -0.00 -0.26 -0.31 0.00 -0.26 0.00 0.00 58.87 58.04 1g9m n SER 128 Cb 0.64 0.87 0.07 0.00 -0.26 0.00 0.00 64.21 65.53 1g9m n SER 128 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1g9m s ALA 129 N -3.20 2.40 0.32 7.33 0.00 -1.26 -5.06 121.76 122.29 1g9m s ALA 129 Ca 0.03 0.25 0.08 0.00 0.00 0.00 0.00 51.96 52.32 1g9m s ALA 129 Cb 0.14 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 1g9m s ALA 129 CO 0.81 -1.56 0.24 -1.12 0.00 0.00 0.00 175.76 174.13 1g9m s SER 130 N -3.41 5.18 0.40 0.00 0.01 -1.26 -5.01 113.70 109.60 1g9m s SER 130 Ca 0.61 -0.52 -0.26 0.00 1.31 0.00 0.00 55.95 57.08 1g9m s SER 130 Cb -0.17 -0.98 -0.09 0.00 0.21 0.00 0.00 66.02 65.00 1g9m s SER 130 CO 0.54 -0.29 1.32 -0.89 0.41 0.00 0.00 173.24 174.33 1g9m s THR 131 N -2.31 2.57 -0.30 1.44 2.01 -1.26 -4.67 115.64 113.13 1g9m s THR 131 Ca 0.39 0.52 -0.17 0.00 0.31 0.00 0.00 61.69 62.74 1g9m s THR 131 Cb -0.05 -3.31 0.19 0.00 0.01 0.00 0.00 72.50 69.33 1g9m s THR 131 CO 0.25 0.08 1.19 -1.59 -0.69 0.00 0.00 174.62 173.87 1g9m s LYS 132 N -2.20 0.15 0.95 4.92 -2.85 0.73 -4.93 119.74 116.51 1g9m s LYS 132 Ca 0.56 0.25 -0.11 0.00 -1.00 0.00 0.00 55.97 55.67 1g9m s LYS 132 Cb -0.39 0.03 0.16 0.00 -2.06 0.00 0.00 37.83 35.58 1g9m s LYS 132 CO 0.50 -0.03 1.09 0.20 0.10 0.00 0.00 175.35 177.21 1g9m s GLY 133 N 1.03 1.62 0.57 0.59 0.00 -1.26 -0.53 107.32 109.33 1g9m s GLY 133 Ca -0.07 0.05 -0.03 0.00 0.00 0.00 0.00 44.72 44.67 1g9m s GLY 133 CO -0.11 0.57 0.84 2.56 0.00 0.00 0.00 173.10 176.96 1g9m s PRO 134 N -4.78 2.75 -0.36 2.90 0.04 -1.26 -4.49 135.00 129.79 1g9m s PRO 134 Ca 0.65 -0.31 -0.02 0.00 0.04 0.00 0.00 61.00 61.36 1g9m s PRO 134 Cb -0.20 -2.36 0.08 0.00 0.04 0.00 0.00 34.50 32.06 1g9m s PRO 134 CO 0.59 -0.70 0.11 -1.12 0.04 0.00 0.00 177.00 175.91 1g9m s SER 135 N -4.35 5.06 0.01 6.66 0.01 -1.01 -4.95 113.70 115.13 1g9m s SER 135 Ca 0.54 -1.75 -0.30 0.00 1.31 0.00 0.00 55.95 55.76 1g9m s SER 135 Cb -0.10 -1.76 -0.05 0.00 0.21 0.00 0.00 66.02 64.32 1g9m s SER 135 CO 0.42 -0.41 1.22 -0.69 0.41 0.00 0.00 173.24 174.19 1g9m s VAL 136 N 1.16 4.08 0.03 3.43 1.01 -1.26 -3.62 120.40 125.24 1g9m s VAL 136 Ca 0.03 1.47 0.07 0.00 0.00 0.00 0.00 61.98 63.55 1g9m s VAL 136 Cb -0.21 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 1g9m s VAL 136 CO -0.03 0.06 -0.20 -0.36 0.00 0.00 0.00 175.10 174.57 1g9m s PHE 137 N 1.64 2.51 0.37 5.22 0.08 0.12 -4.94 117.98 122.99 1g9m s PHE 137 Ca 0.58 -0.29 -0.24 0.00 0.12 0.00 0.00 56.93 57.11 1g9m s PHE 137 Cb -0.28 -1.47 -0.10 0.00 -0.57 0.00 0.00 43.02 40.60 1g9m s PHE 137 CO 0.26 0.21 0.96 -1.25 -0.10 0.00 0.00 175.22 175.30 1g9m s PRO 138 N -1.30 4.39 -0.64 0.24 0.04 -1.26 0.12 135.00 136.60 1g9m s PRO 138 Ca 0.14 1.28 0.06 0.00 0.04 0.00 0.00 61.00 62.52 1g9m s PRO 138 Cb -0.10 -2.54 0.26 0.00 0.04 0.00 0.00 34.50 32.16 1g9m s PRO 138 CO 0.04 0.10 0.77 1.28 0.04 0.00 0.00 177.00 179.23 1g9m n LEU 139 N 0.03 3.84 -4.36 -3.56 4.32 -0.84 -4.83 117.00 111.59 1g9m n LEU 139 Ca 0.04 -5.47 -0.44 0.00 -0.02 0.00 0.00 56.01 50.12 1g9m n LEU 139 Cb 0.51 -0.66 -0.01 0.00 -1.62 0.00 0.00 43.42 41.64 1g9m n LEU 139 CO 0.42 2.08 -0.20 0.00 -1.22 0.00 0.00 177.39 178.47 1g9m n ALA 140 N 0.76 -2.75 -1.15 -1.18 0.00 -1.26 -3.03 120.51 111.90 1g9m n ALA 140 Ca 0.30 0.25 -0.36 0.00 0.00 0.00 0.00 53.44 53.63 1g9m n ALA 140 Cb 0.41 -1.57 0.07 0.00 0.00 0.00 0.00 19.45 18.36 1g9m n ALA 140 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1g9m n PRO 141 N 1.13 0.14 -0.37 0.00 -0.02 -1.25 -4.82 135.00 129.81 1g9m n PRO 141 Ca 0.14 0.09 0.01 0.00 -2.02 0.00 0.00 63.50 61.71 1g9m n PRO 141 Cb 0.34 -1.70 0.14 0.00 -0.02 0.00 0.00 33.50 32.26 1g9m n PRO 141 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1g9m n SER 142 N 0.04 2.89 -2.82 2.55 7.64 -1.18 -4.60 113.62 118.15 1g9m n SER 142 Ca 0.08 -2.40 -0.27 0.00 1.01 0.00 0.00 58.87 57.30 1g9m n SER 142 Cb 0.51 -0.58 -0.08 0.00 -1.01 0.00 0.00 64.21 63.05 1g9m n SER 142 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1g9m n SER 143 N 0.18 6.88 0.02 6.43 7.64 -1.26 -3.75 113.62 129.75 1g9m n SER 143 Ca 0.13 -2.48 0.00 0.00 1.01 0.00 0.00 58.87 57.53 1g9m n SER 143 Cb 0.67 -1.41 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 1g9m n SER 143 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1g9m n LYS 144 N 3.26 0.00 0.00 1.43 5.02 -1.26 -4.97 118.16 121.64 1g9m n LYS 144 Ca 0.60 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 1g9m n LYS 144 Cb 0.45 -0.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.96 1g9m n LYS 144 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1g9m n SER 145 N -3.16 3.45 -4.75 4.39 7.64 -1.25 -5.06 113.62 114.89 1g9m n SER 145 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 1g9m n SER 145 Cb 0.33 0.04 -0.02 0.00 -1.01 0.00 0.00 64.21 63.55 1g9m n SER 145 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1g9m s THR 146 N -1.84 2.77 -0.26 0.44 2.01 -1.25 -5.01 115.64 112.50 1g9m s THR 146 Ca 0.00 0.66 -0.02 0.00 0.31 0.00 0.00 61.69 62.64 1g9m s THR 146 Cb 0.00 -3.42 0.03 0.00 0.01 0.00 0.00 72.50 69.12 1g9m s THR 146 CO 0.00 0.11 -0.05 -0.55 -0.69 0.00 0.00 174.62 173.44 1g9m s SER 147 N 0.25 4.41 0.00 3.53 0.15 -1.26 -4.76 113.70 116.03 1g9m s SER 147 Ca 0.57 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 56.32 1g9m s SER 147 Cb -0.41 -1.68 0.00 0.00 -1.71 0.00 0.00 66.02 62.22 1g9m s SER 147 CO 0.44 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.34 1g9m n GLY 148 N 4.67 3.34 0.00 9.45 0.00 -1.26 -5.06 105.19 116.33 1g9m n GLY 148 Ca -0.16 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1g9m n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g9m n GLY 149 N 0.00 0.79 2.82 -0.02 0.00 -1.26 -4.97 105.19 102.55 1g9m n GLY 149 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1g9m n GLY 149 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1g9m s THR 150 N -0.06 0.82 0.52 2.61 -4.23 -1.26 -1.62 115.64 112.42 1g9m s THR 150 Ca 0.00 -0.55 -0.03 0.00 -1.18 0.00 0.00 61.69 59.92 1g9m s THR 150 Cb 0.00 -1.13 -0.00 0.00 1.34 0.00 0.00 72.50 72.70 1g9m s THR 150 CO 0.00 -0.01 0.79 0.00 -0.54 0.00 0.00 174.62 174.87 1g9m s ALA 151 N 1.74 3.48 -0.04 3.99 0.00 0.19 -4.80 121.76 126.32 1g9m s ALA 151 Ca 0.00 -0.79 0.07 0.00 0.00 0.00 0.00 51.96 51.24 1g9m s ALA 151 Cb -0.16 -2.43 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 1g9m s ALA 151 CO -0.07 -0.55 -0.25 0.00 0.00 0.00 0.00 175.76 174.88 1g9m s ALA 152 N -2.78 2.13 0.15 0.00 0.00 -1.26 -1.11 121.76 118.90 1g9m s ALA 152 Ca 0.50 -1.06 -0.21 0.00 0.00 0.00 0.00 51.96 51.19 1g9m s ALA 152 Cb -0.10 -0.62 0.06 0.00 0.00 0.00 0.00 23.12 22.46 1g9m s ALA 152 CO 0.42 0.45 0.56 -0.48 0.00 0.00 0.00 175.76 176.72 1g9m s LEU 153 N -0.33 -0.35 0.00 0.00 0.05 -0.74 -3.08 118.68 114.23 1g9m s LEU 153 Ca 0.02 -0.08 0.00 0.00 0.05 0.00 0.00 54.13 54.12 1g9m s LEU 153 Cb -0.12 2.43 0.00 0.00 -2.05 0.00 0.00 46.19 46.45 1g9m s LEU 153 CO 0.02 -0.95 0.00 0.61 -0.55 0.00 0.00 176.35 175.48 1g9m n GLY 154 N -0.35 1.41 2.95 -3.48 0.00 -1.17 -0.53 105.19 104.02 1g9m n GLY 154 Ca -0.17 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.44 1g9m n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g9m s LEU 156 N -0.95 4.64 -0.45 0.00 2.96 0.12 -1.40 118.68 123.59 1g9m s LEU 156 Ca -0.10 -1.40 -0.17 0.00 -0.22 0.00 0.00 54.13 52.23 1g9m s LEU 156 Cb -0.07 -1.87 0.04 0.00 0.50 0.00 0.00 46.19 44.79 1g9m s LEU 156 CO -0.01 -0.41 0.46 -0.69 -1.32 0.00 0.00 176.35 174.38 1g9m s VAL 157 N 1.34 5.09 0.12 1.68 1.01 -0.36 -0.70 120.40 128.58 1g9m s VAL 157 Ca 0.01 -0.56 0.10 0.00 0.00 0.00 0.00 61.98 61.52 1g9m s VAL 157 Cb -0.21 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 1g9m s VAL 157 CO 0.01 -0.53 -0.24 -0.75 0.00 0.00 0.00 175.10 173.59 1g9m s LYS 158 N 2.10 1.26 -1.06 2.72 2.20 -1.24 -0.95 119.74 124.77 1g9m s LYS 158 Ca 0.10 -1.26 -0.11 0.00 -0.36 0.00 0.00 55.97 54.34 1g9m s LYS 158 Cb -0.19 -1.64 -0.04 0.00 -1.51 0.00 0.00 37.83 34.45 1g9m s LYS 158 CO 0.11 0.38 0.86 -0.25 -0.36 0.00 0.00 175.35 176.10 1g9m n ASP 159 N 0.98 -6.23 -4.39 1.43 8.00 -0.75 -2.42 116.55 113.17 1g9m n ASP 159 Ca -0.19 -0.79 -0.20 0.00 0.71 0.00 0.00 54.79 54.33 1g9m n ASP 159 Cb 0.53 -4.51 -0.10 0.00 -0.02 0.00 0.00 41.12 37.02 1g9m n ASP 159 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1g9m s TYR 160 N -3.39 1.85 -0.28 1.24 -0.85 -1.10 -4.41 117.35 110.41 1g9m s TYR 160 Ca 0.43 -0.60 -0.22 0.00 -0.52 0.00 0.00 57.07 56.17 1g9m s TYR 160 Cb -0.10 -0.93 0.11 0.00 0.38 0.00 0.00 41.96 41.42 1g9m s TYR 160 CO 0.79 0.36 0.88 0.12 -1.52 0.00 0.00 175.55 176.18 1g9m s PHE 161 N -2.95 -0.67 0.00 -3.49 5.36 0.31 -0.71 117.98 115.83 1g9m s PHE 161 Ca 0.26 1.52 0.00 0.00 -0.96 0.00 0.00 56.93 57.74 1g9m s PHE 161 Cb 0.01 0.38 0.00 0.00 -0.34 0.00 0.00 43.02 43.06 1g9m s PHE 161 CO 0.09 -0.33 0.00 -0.35 -1.46 0.00 0.00 175.22 173.18 1g9m n PRO 162 N 2.94 1.48 -1.08 10.12 -0.04 -1.26 -0.19 135.00 146.96 1g9m n PRO 162 Ca -0.15 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.00 1g9m n PRO 162 Cb 0.56 0.00 0.12 0.00 -0.04 0.00 0.00 33.50 34.14 1g9m n PRO 162 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1g9m s GLN 163 N -1.27 1.79 0.51 0.54 -1.52 -1.26 -4.77 119.66 113.67 1g9m s GLN 163 Ca 0.00 1.25 0.07 0.00 -1.95 0.00 0.00 55.36 54.73 1g9m s GLN 163 Cb 0.00 -1.84 0.02 0.00 -0.22 0.00 0.00 33.01 30.98 1g9m s GLN 163 CO 0.00 -2.00 0.42 -1.25 -0.25 0.00 0.00 175.29 172.21 1g9m s PRO 164 N -4.83 2.33 0.01 2.91 0.04 -1.26 -4.97 135.00 129.23 1g9m s PRO 164 Ca 0.63 -1.85 0.02 0.00 0.04 0.00 0.00 61.00 59.84 1g9m s PRO 164 Cb -0.19 -2.22 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 1g9m s PRO 164 CO 0.57 -0.50 -0.06 0.54 0.04 0.00 0.00 177.00 177.59 1g9m s VAL 165 N -2.68 0.44 -0.09 -0.36 0.11 -1.26 -4.62 120.40 111.94 1g9m s VAL 165 Ca 0.41 -0.53 0.01 0.00 -2.93 0.00 0.00 61.98 58.94 1g9m s VAL 165 Cb -0.02 -0.43 -0.02 0.00 -1.53 0.00 0.00 36.38 34.38 1g9m s VAL 165 CO 0.25 -0.07 -0.11 0.42 -3.33 0.00 0.00 175.10 172.26 1g9m s THR 166 N -0.58 3.33 0.12 5.04 -4.23 -0.60 -4.97 115.64 113.75 1g9m s THR 166 Ca -0.03 -0.59 0.07 0.00 -1.18 0.00 0.00 61.69 59.96 1g9m s THR 166 Cb -0.05 -2.37 -0.04 0.00 1.34 0.00 0.00 72.50 71.38 1g9m s THR 166 CO 0.00 0.56 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.78 1g9m s VAL 167 N -0.28 1.54 0.19 2.29 1.01 -1.26 -0.82 120.40 123.06 1g9m s VAL 167 Ca 0.03 -1.65 -0.23 0.00 0.00 0.00 0.00 61.98 60.12 1g9m s VAL 167 Cb -0.13 -1.55 0.06 0.00 0.00 0.00 0.00 36.38 34.77 1g9m s VAL 167 CO 0.03 -0.25 0.95 -0.94 0.00 0.00 0.00 175.10 174.88 1g9m s SER 168 N -2.23 -0.13 0.05 3.32 1.04 -0.77 -4.97 113.70 110.01 1g9m s SER 168 Ca 0.08 -0.53 0.08 0.00 0.48 0.00 0.00 55.95 56.06 1g9m s SER 168 Cb -0.07 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.56 1g9m s SER 168 CO 0.04 -1.01 -0.22 0.26 0.98 0.00 0.00 173.24 173.29 1g9m s TRP 169 N -3.04 1.89 -1.36 5.02 0.52 -1.25 0.34 118.94 121.05 1g9m s TRP 169 Ca 0.14 -0.38 -0.09 0.00 0.02 0.00 0.00 56.10 55.79 1g9m s TRP 169 Cb -0.02 -1.12 0.01 0.00 -1.15 0.00 0.00 33.47 31.19 1g9m s TRP 169 CO 0.04 0.11 0.43 0.09 0.02 0.00 0.00 176.95 177.64 1g9m n ASN 170 N 1.75 -1.44 -1.60 2.95 3.02 0.15 0.03 115.26 120.12 1g9m n ASN 170 Ca -0.17 -1.11 -0.15 0.00 -0.03 0.00 0.00 54.58 53.11 1g9m n ASN 170 Cb 0.53 -2.58 -0.06 0.00 -0.61 0.00 0.00 39.78 37.07 1g9m n ASN 170 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1g9m n SER 171 N -2.79 -4.14 0.00 6.41 7.64 -1.26 -0.06 113.62 119.42 1g9m n SER 171 Ca -0.25 0.34 0.00 0.00 1.01 0.00 0.00 58.87 59.97 1g9m n SER 171 Cb 0.66 -3.74 0.00 0.00 -1.01 0.00 0.00 64.21 60.12 1g9m n SER 171 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1g9m n GLY 172 N -0.38 0.82 0.11 0.23 0.00 0.10 -4.95 105.19 101.12 1g9m n GLY 172 Ca -0.16 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1g9m n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g9m h ALA 173 N 0.00 0.64 -3.21 4.61 0.00 -0.09 -3.44 119.26 117.77 1g9m h ALA 173 Ca 0.00 -0.73 -0.64 0.00 0.00 0.00 0.00 54.91 53.54 1g9m h ALA 173 Cb 0.00 0.13 -0.23 0.00 0.00 0.00 0.00 17.79 17.69 1g9m h ALA 173 CO 0.00 0.85 -0.68 -1.17 0.00 0.00 0.00 179.25 178.24 1g9m s LEU 174 N -6.07 3.14 0.00 0.00 2.96 -1.11 -4.91 118.68 112.68 1g9m s LEU 174 Ca -0.00 -0.21 0.00 0.00 -0.22 0.00 0.00 54.13 53.70 1g9m s LEU 174 Cb 0.08 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 45.01 1g9m s LEU 174 CO 0.79 0.11 0.00 0.35 -1.32 0.00 0.00 176.35 176.28 1g9m n THR 175 N 3.91 0.00 -2.60 3.68 -2.24 -1.26 -3.96 114.28 111.80 1g9m n THR 175 Ca -0.17 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 1g9m n THR 175 Cb 0.52 0.45 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 1g9m n THR 175 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1g9m s SER 176 N 0.00 7.24 -0.14 3.42 0.15 -1.26 -3.20 113.70 119.92 1g9m s SER 176 Ca 0.00 1.76 0.00 0.00 0.70 0.00 0.00 55.95 58.41 1g9m s SER 176 Cb 0.00 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1g9m s SER 176 CO 0.00 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.68 1g9m n GLY 177 N 3.05 0.50 3.79 9.45 0.00 -1.26 -4.81 105.19 115.90 1g9m n GLY 177 Ca 0.08 -0.28 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 1g9m n GLY 177 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1g9m s VAL 178 N -1.91 5.14 -0.17 1.61 -7.23 -1.19 -2.85 120.40 113.79 1g9m s VAL 178 Ca 0.00 0.80 -0.00 0.00 -1.81 0.00 0.00 61.98 60.96 1g9m s VAL 178 Cb 0.00 -3.72 0.04 0.00 0.56 0.00 0.00 36.38 33.26 1g9m s VAL 178 CO 0.00 0.48 -0.06 -1.00 -0.31 0.00 0.00 175.10 174.20 1g9m s HIS 179 N -0.34 1.81 -0.50 2.82 3.76 0.17 -4.97 115.29 118.04 1g9m s HIS 179 Ca 0.23 -1.14 -0.06 0.00 -0.15 0.00 0.00 55.06 53.94 1g9m s HIS 179 Cb -0.15 -1.37 0.13 0.00 1.11 0.00 0.00 32.58 32.30 1g9m s HIS 179 CO 0.10 -0.63 0.33 0.99 -0.85 0.00 0.00 174.74 174.69 1g9m s THR 180 N 1.60 3.83 0.74 1.30 2.01 -1.26 0.79 115.64 124.65 1g9m s THR 180 Ca 0.01 -2.17 -0.15 0.00 0.31 0.00 0.00 61.69 59.69 1g9m s THR 180 Cb -0.15 -3.54 0.04 0.00 0.01 0.00 0.00 72.50 68.86 1g9m s THR 180 CO -0.08 -0.78 1.24 -0.36 -0.69 0.00 0.00 174.62 173.95 1g9m s PHE 181 N 0.92 1.94 0.88 4.92 0.40 0.08 -4.97 117.98 122.15 1g9m s PHE 181 Ca 0.10 1.59 -0.10 0.00 -0.60 0.00 0.00 56.93 57.92 1g9m s PHE 181 Cb -0.23 -3.56 0.12 0.00 0.51 0.00 0.00 43.02 39.87 1g9m s PHE 181 CO -0.03 -2.83 1.12 -2.14 0.70 0.00 0.00 175.22 172.03 1g9m s PRO 182 N -3.83 1.36 0.18 0.24 0.02 -1.26 -4.49 135.00 127.22 1g9m s PRO 182 Ca 0.77 1.31 -0.25 0.00 0.02 0.00 0.00 61.00 62.85 1g9m s PRO 182 Cb -0.32 -1.78 -0.08 0.00 0.02 0.00 0.00 34.50 32.34 1g9m s PRO 182 CO 0.46 -2.32 0.79 0.00 -0.33 0.00 0.00 177.00 175.60 1g9m s ALA 183 N -2.75 3.43 0.19 -1.55 0.00 -1.26 -4.71 121.76 115.10 1g9m s ALA 183 Ca 0.65 0.37 0.07 0.00 0.00 0.00 0.00 51.96 53.05 1g9m s ALA 183 Cb -0.20 -2.97 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 1g9m s ALA 183 CO 0.58 0.29 0.03 0.08 0.00 0.00 0.00 175.76 176.74 1g9m s VAL 184 N -1.19 3.86 -0.28 0.00 1.01 0.73 -4.90 120.40 119.63 1g9m s VAL 184 Ca 0.37 -1.42 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 1g9m s VAL 184 Cb -0.23 -2.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1g9m s VAL 184 CO 0.26 -0.15 0.13 -0.22 0.00 0.00 0.00 175.10 175.12 1g9m s LEU 185 N -3.10 3.79 0.47 3.92 2.96 -1.26 -1.12 118.68 124.34 1g9m s LEU 185 Ca 0.29 -0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 53.86 1g9m s LEU 185 Cb -0.09 -2.00 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 1g9m s LEU 185 CO 0.20 -0.09 0.82 -1.10 -1.32 0.00 0.00 176.35 174.86 1g9m s GLN 186 N 1.65 3.66 0.41 1.98 -0.21 -0.30 -4.93 119.66 121.92 1g9m s GLN 186 Ca 0.06 0.41 0.22 0.00 0.02 0.00 0.00 55.36 56.07 1g9m s GLN 186 Cb -0.16 -2.34 1.21 0.00 1.00 0.00 0.00 33.01 32.73 1g9m s GLN 186 CO 0.06 -0.18 1.71 0.77 -2.12 0.00 0.00 175.29 175.53 1g9m h SER 187 N 0.62 0.38 0.31 5.90 0.02 -1.99 1.13 113.55 119.92 1g9m h SER 187 Ca -0.47 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1g9m h SER 187 Cb 1.19 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1g9m h SER 187 CO 0.63 -0.03 0.00 0.77 -1.14 0.00 0.00 176.83 177.06 1g9m h SER 188 N 0.28 0.00 0.00 3.07 4.64 -2.03 -3.45 113.55 116.06 1g9m h SER 188 Ca 0.69 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.01 1g9m h SER 188 Cb 1.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.98 1g9m h SER 188 CO -0.37 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.20 1g9m n GLY 189 N -0.77 0.69 3.82 -0.77 0.00 0.39 -5.00 105.19 103.55 1g9m n GLY 189 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1g9m n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g9m s LEU 190 N 0.00 4.03 0.82 0.99 1.43 -1.23 -4.85 118.68 119.87 1g9m s LEU 190 Ca 0.00 0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 53.14 1g9m s LEU 190 Cb 0.00 -2.50 0.09 0.00 0.03 0.00 0.00 46.19 43.81 1g9m s LEU 190 CO 0.00 0.23 1.19 -0.31 0.23 0.00 0.00 176.35 177.69 1g9m s TYR 191 N -1.32 2.80 -0.16 0.29 2.02 0.11 -1.15 117.35 119.93 1g9m s TYR 191 Ca 0.27 0.69 -0.31 0.00 -0.37 0.00 0.00 57.07 57.35 1g9m s TYR 191 Cb -0.12 -3.56 0.14 0.00 -0.40 0.00 0.00 41.96 38.01 1g9m s TYR 191 CO 0.19 -1.87 1.10 0.45 -1.57 0.00 0.00 175.55 173.85 1g9m s SER 192 N -4.61 -0.25 0.10 2.29 0.15 -0.27 -1.82 113.70 109.29 1g9m s SER 192 Ca 0.63 0.16 -0.26 0.00 0.70 0.00 0.00 55.95 57.18 1g9m s SER 192 Cb -0.10 0.23 0.08 0.00 -1.71 0.00 0.00 66.02 64.52 1g9m s SER 192 CO 0.49 -0.31 1.08 -1.48 1.20 0.00 0.00 173.24 174.23 1g9m s LEU 193 N -1.62 -0.11 0.06 3.45 0.05 -0.12 -0.19 118.68 120.19 1g9m s LEU 193 Ca 0.04 -0.35 0.05 0.00 0.05 0.00 0.00 54.13 53.92 1g9m s LEU 193 Cb -0.01 1.88 -0.03 0.00 -2.05 0.00 0.00 46.19 45.99 1g9m s LEU 193 CO -0.04 -0.71 -0.14 -0.44 -0.55 0.00 0.00 176.35 174.47 1g9m s SER 194 N -3.04 1.70 -0.12 1.48 0.01 -1.26 -1.22 113.70 111.24 1g9m s SER 194 Ca 0.15 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 56.84 1g9m s SER 194 Cb 0.00 -0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.19 1g9m s SER 194 CO 0.01 -0.04 -0.12 -0.55 0.41 0.00 0.00 173.24 172.95 1g9m s SER 195 N -1.58 2.41 0.37 2.44 0.15 -0.50 -0.74 113.70 116.26 1g9m s SER 195 Ca -0.01 -0.40 0.04 0.00 0.70 0.00 0.00 55.95 56.28 1g9m s SER 195 Cb -0.09 -1.02 -0.05 0.00 -1.71 0.00 0.00 66.02 63.14 1g9m s SER 195 CO 0.02 -0.06 0.07 0.68 1.20 0.00 0.00 173.24 175.14 1g9m s VAL 196 N 1.45 1.11 -0.29 4.45 -7.23 0.24 -0.16 120.40 119.97 1g9m s VAL 196 Ca 0.02 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.98 1g9m s VAL 196 Cb -0.13 -2.64 0.13 0.00 0.56 0.00 0.00 36.38 34.30 1g9m s VAL 196 CO -0.08 0.00 1.00 0.54 -0.31 0.00 0.00 175.10 176.26 1g9m s VAL 197 N -3.19 0.00 -0.47 1.32 0.11 0.31 0.43 120.40 118.92 1g9m s VAL 197 Ca 0.30 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 59.20 1g9m s VAL 197 Cb 0.07 -1.00 0.07 0.00 -1.53 0.00 0.00 36.38 33.99 1g9m s VAL 197 CO 0.14 0.00 0.39 0.42 -3.33 0.00 0.00 175.10 172.72 1g9m s THR 198 N 0.78 5.21 0.34 5.04 -4.23 -1.13 -1.79 115.64 119.85 1g9m s THR 198 Ca -0.03 -1.06 0.07 0.00 -1.18 0.00 0.00 61.69 59.49 1g9m s THR 198 Cb -0.04 -4.11 -0.03 0.00 1.34 0.00 0.00 72.50 69.66 1g9m s THR 198 CO -0.11 -0.57 0.30 0.68 -0.54 0.00 0.00 174.62 174.38 1g9m s VAL 199 N 1.64 3.55 0.12 2.29 -7.23 -0.27 -4.86 120.40 115.64 1g9m s VAL 199 Ca 0.04 -1.35 -0.31 0.00 -1.81 0.00 0.00 61.98 58.55 1g9m s VAL 199 Cb -0.24 -3.19 -0.08 0.00 0.56 0.00 0.00 36.38 33.42 1g9m s VAL 199 CO 0.07 -0.17 1.43 -2.16 -0.31 0.00 0.00 175.10 173.96 1g9m s PRO 200 N -4.00 4.29 0.56 4.82 0.04 -1.26 0.53 135.00 139.98 1g9m s PRO 200 Ca 0.41 2.13 0.29 0.00 0.04 0.00 0.00 61.00 63.87 1g9m s PRO 200 Cb -0.06 -3.26 1.46 0.00 0.04 0.00 0.00 34.50 32.69 1g9m s PRO 200 CO 0.27 -0.49 1.93 0.66 0.04 0.00 0.00 177.00 179.41 1g9m h SER 201 N 6.90 0.00 0.50 6.66 4.64 -1.61 0.36 113.55 130.99 1g9m h SER 201 Ca -0.42 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.80 1g9m h SER 201 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 1g9m h SER 201 CO 0.88 0.00 -0.48 0.77 -0.87 0.00 0.00 176.83 177.12 1g9m h SER 202 N 0.00 0.00 0.62 4.97 4.64 -1.90 -2.63 113.55 119.25 1g9m h SER 202 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 1g9m h SER 202 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1g9m h SER 202 CO -0.00 0.48 0.00 -0.24 -0.87 0.00 0.00 176.83 176.20 1g9m n SER 203 N -3.95 0.27 -4.77 4.97 2.88 0.13 -4.71 113.62 108.43 1g9m n SER 203 Ca -0.02 0.56 -0.31 0.00 -1.33 0.00 0.00 58.87 57.78 1g9m n SER 203 Cb 0.50 -0.62 0.09 0.00 -0.75 0.00 0.00 64.21 63.43 1g9m n SER 203 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1g9m s LEU 204 N -3.59 2.92 0.00 2.46 1.43 -0.99 -0.75 118.68 120.16 1g9m s LEU 204 Ca 0.06 1.70 0.00 0.00 -1.03 0.00 0.00 54.13 54.86 1g9m s LEU 204 Cb 0.10 -4.40 0.00 0.00 0.03 0.00 0.00 46.19 41.92 1g9m s LEU 204 CO 0.33 -1.98 0.00 0.61 0.23 0.00 0.00 176.35 175.53 1g9m n GLY 205 N -1.42 1.74 0.60 -3.19 0.00 -1.26 -4.53 105.19 97.13 1g9m n GLY 205 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.08 1g9m n GLY 205 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1g9m n THR 206 N -1.43 0.65 -2.65 2.61 -2.24 -1.18 -4.97 114.28 105.07 1g9m n THR 206 Ca 0.00 0.25 -0.43 0.00 -2.27 0.00 0.00 64.05 61.60 1g9m n THR 206 Cb 0.00 -1.55 -0.02 0.00 -2.10 0.00 0.00 70.33 66.66 1g9m n THR 206 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1g9m s GLN 207 N -1.67 3.88 0.05 -0.78 2.00 0.07 -5.02 119.66 118.20 1g9m s GLN 207 Ca -0.06 0.77 -0.30 0.00 -2.00 0.00 0.00 55.36 53.77 1g9m s GLN 207 Cb 0.01 -3.82 -0.04 0.00 0.80 0.00 0.00 33.01 29.95 1g9m s GLN 207 CO 0.09 -1.12 0.97 0.95 -0.50 0.00 0.00 175.29 175.67 1g9m s THR 208 N 3.98 4.69 -0.17 -0.34 -4.23 -1.26 -4.70 115.64 113.61 1g9m s THR 208 Ca 0.45 2.06 -0.05 0.00 -1.18 0.00 0.00 61.69 62.98 1g9m s THR 208 Cb -0.10 -4.32 -0.03 0.00 1.34 0.00 0.00 72.50 69.39 1g9m s THR 208 CO 0.23 0.24 0.00 -0.31 -0.54 0.00 0.00 174.62 174.24 1g9m s TYR 209 N 0.51 3.11 -0.06 3.99 2.02 -1.26 -4.96 117.35 120.69 1g9m s TYR 209 Ca 0.49 -0.17 -0.00 0.00 -0.37 0.00 0.00 57.07 57.02 1g9m s TYR 209 Cb -0.22 -2.01 0.03 0.00 -0.40 0.00 0.00 41.96 39.36 1g9m s TYR 209 CO 0.29 0.02 -0.01 0.42 -1.57 0.00 0.00 175.55 174.70 1g9m s ILE 210 N 0.40 0.38 -0.08 2.71 1.01 -1.26 -1.29 121.20 123.06 1g9m s ILE 210 Ca -0.01 0.05 -0.15 0.00 0.00 0.00 0.00 60.65 60.54 1g9m s ILE 210 Cb -0.14 -0.49 -0.05 0.00 0.01 0.00 0.00 42.46 41.80 1g9m s ILE 210 CO 0.02 0.23 0.38 0.00 0.00 0.00 0.00 174.94 175.57 1g9m s ASN 212 N -0.20 5.23 -0.19 0.00 -0.87 0.15 -2.17 114.94 116.90 1g9m s ASN 212 Ca 0.22 -0.29 -0.03 0.00 -1.57 0.00 0.00 52.86 51.19 1g9m s ASN 212 Cb -0.15 -1.94 -0.01 0.00 -0.02 0.00 0.00 41.25 39.13 1g9m s ASN 212 CO 0.09 -0.07 -0.06 -0.69 -2.57 0.00 0.00 177.10 173.81 1g9m s VAL 213 N 1.61 3.46 -0.07 1.60 1.01 0.43 -1.85 120.40 126.59 1g9m s VAL 213 Ca 0.06 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.60 1g9m s VAL 213 Cb -0.16 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.67 1g9m s VAL 213 CO 0.04 0.46 -0.21 0.21 0.00 0.00 0.00 175.10 175.60 1g9m s ASN 214 N 1.00 3.43 -0.37 3.32 2.47 -0.00 0.13 114.94 124.91 1g9m s ASN 214 Ca 0.00 -0.42 0.01 0.00 0.42 0.00 0.00 52.86 52.88 1g9m s ASN 214 Cb -0.15 -0.99 0.15 0.00 -1.45 0.00 0.00 41.25 38.81 1g9m s ASN 214 CO 0.00 0.25 0.27 -2.28 -3.72 0.00 0.00 177.10 171.62 1g9m s HIS 215 N -0.18 0.66 0.22 0.43 5.65 0.58 -1.56 115.29 121.09 1g9m s HIS 215 Ca -0.02 -1.70 -0.08 0.00 0.25 0.00 0.00 55.06 53.51 1g9m s HIS 215 Cb -0.14 -0.83 0.32 0.00 -1.18 0.00 0.00 32.58 30.75 1g9m s HIS 215 CO 0.03 -0.85 1.74 -0.22 -0.65 0.00 0.00 174.74 174.79 1g9m h LYS 216 N 6.63 0.41 -0.72 2.88 3.11 -1.82 0.85 116.57 127.91 1g9m h LYS 216 Ca 0.11 -0.02 0.16 0.00 -2.81 0.00 0.00 60.65 58.09 1g9m h LYS 216 Cb 0.97 -0.09 -0.12 0.00 -1.00 0.00 0.00 32.23 31.98 1g9m h LYS 216 CO 0.28 0.27 0.02 -1.35 -2.81 0.00 0.00 179.45 175.86 1g9m h PRO 217 N 0.42 0.12 -0.08 1.90 0.11 -1.91 0.13 132.00 132.69 1g9m h PRO 217 Ca 0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.44 1g9m h PRO 217 Cb 0.43 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1g9m h PRO 217 CO -0.33 0.08 0.00 -1.13 -0.21 0.00 0.00 178.00 176.41 1g9m n SER 218 N -5.31 2.62 -3.72 -2.05 3.41 -0.97 -4.92 113.62 102.68 1g9m n SER 218 Ca 0.13 -1.86 -0.25 0.00 -0.26 0.00 0.00 58.87 56.63 1g9m n SER 218 Cb 0.45 -0.04 0.05 0.00 -0.26 0.00 0.00 64.21 64.41 1g9m n SER 218 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1g9m n ASN 219 N 1.02 -4.17 -4.37 4.04 5.15 0.45 -4.77 115.26 112.61 1g9m n ASN 219 Ca 0.16 -0.70 -0.35 0.00 -0.60 0.00 0.00 54.58 53.09 1g9m n ASN 219 Cb 0.53 -4.40 -0.13 0.00 -0.53 0.00 0.00 39.78 35.24 1g9m n ASN 219 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1g9m s THR 220 N -3.39 3.57 -0.24 -0.44 2.01 -0.43 -4.99 115.64 111.74 1g9m s THR 220 Ca 0.43 -0.44 0.02 0.00 0.31 0.00 0.00 61.69 62.01 1g9m s THR 220 Cb -0.20 -2.61 0.05 0.00 0.01 0.00 0.00 72.50 69.75 1g9m s THR 220 CO 0.79 0.43 -0.09 -0.75 -0.69 0.00 0.00 174.62 174.31 1g9m s LYS 221 N 1.19 2.02 0.11 4.92 2.36 -1.26 -0.31 119.74 128.78 1g9m s LYS 221 Ca 0.03 -1.10 0.08 0.00 -2.55 0.00 0.00 55.97 52.43 1g9m s LYS 221 Cb -0.14 -2.67 -0.04 0.00 -1.05 0.00 0.00 37.83 33.92 1g9m s LYS 221 CO -0.00 -0.53 -0.15 0.08 1.55 0.00 0.00 175.35 176.30 1g9m s VAL 222 N 1.27 3.07 -0.06 4.02 1.01 0.12 -4.98 120.40 124.84 1g9m s VAL 222 Ca -0.06 -1.40 -0.02 0.00 0.00 0.00 0.00 61.98 60.50 1g9m s VAL 222 Cb -0.19 -2.42 0.03 0.00 0.00 0.00 0.00 36.38 33.80 1g9m s VAL 222 CO -0.06 0.10 0.02 -1.81 0.00 0.00 0.00 175.10 173.35 1g9m s ASP 223 N -2.18 1.46 -0.05 3.32 -0.00 -1.26 -0.43 116.67 117.53 1g9m s ASP 223 Ca 0.19 -0.04 0.00 0.00 -0.00 0.00 0.00 52.55 52.71 1g9m s ASP 223 Cb -0.11 -0.35 0.02 0.00 -0.00 0.00 0.00 42.92 42.48 1g9m s ASP 223 CO 0.12 -0.21 -0.03 -0.75 -0.00 0.00 0.00 175.17 174.29 1g9m s LYS 224 N 2.03 0.77 0.26 8.23 2.47 -0.92 -5.00 119.74 127.58 1g9m s LYS 224 Ca 0.05 -0.06 -0.11 0.00 -1.56 0.00 0.00 55.97 54.30 1g9m s LYS 224 Cb -0.12 -0.86 -0.07 0.00 -1.46 0.00 0.00 37.83 35.31 1g9m s LYS 224 CO -0.05 -0.13 0.60 0.21 0.16 0.00 0.00 175.35 176.14 1g9m s LYS 225 N 1.15 3.83 -0.33 4.03 2.20 -1.26 -1.86 119.74 127.50 1g9m s LYS 225 Ca -0.07 0.35 0.01 0.00 -0.36 0.00 0.00 55.97 55.90 1g9m s LYS 225 Cb -0.14 -2.58 0.08 0.00 -1.51 0.00 0.00 37.83 33.68 1g9m s LYS 225 CO -0.01 0.25 0.03 0.08 -0.36 0.00 0.00 175.35 175.34 1g9m s VAL 226 N -1.90 2.63 0.34 4.02 1.01 -0.41 -4.93 120.40 121.16 1g9m s VAL 226 Ca 0.49 -1.89 -0.09 0.00 0.00 0.00 0.00 61.98 60.49 1g9m s VAL 226 Cb -0.11 -2.71 -0.06 0.00 0.00 0.00 0.00 36.38 33.49 1g9m s VAL 226 CO 0.21 -0.36 0.67 -1.61 0.00 0.00 0.00 175.10 174.02 1g9m s GLU 227 N 1.08 3.75 0.42 2.72 2.02 -1.26 -4.56 118.70 122.87 1g9m s GLU 227 Ca 0.02 0.32 0.11 0.00 0.02 0.00 0.00 54.97 55.43 1g9m s GLU 227 Cb -0.20 -2.50 0.95 0.00 0.10 0.00 0.00 34.13 32.47 1g9m s GLU 227 CO -0.05 0.10 1.99 -1.35 0.02 0.00 0.00 175.26 175.97 1g9m h PRO 228 N 1.61 0.48 0.00 0.39 0.11 -1.97 -3.40 132.00 129.22 1g9m h PRO 228 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1g9m h PRO 228 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1g9m h PRO 228 CO 0.65 0.32 0.00 1.17 -0.21 0.00 0.00 178.00 179.93