#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gnm s VAL 2 N 0.00 4.41 0.03 0.00 1.01 -1.26 -3.72 120.40 120.87 3gnm s VAL 2 Ca 0.00 1.71 -0.02 0.00 0.00 0.00 0.00 61.98 63.67 3gnm s VAL 2 Cb 0.00 -4.10 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 3gnm s VAL 2 CO 0.00 -0.09 0.01 -1.10 0.00 0.00 0.00 175.10 173.92 3gnm s GLN 3 N 2.90 0.47 -0.09 2.72 -0.21 -0.75 -4.99 119.66 119.71 3gnm s GLN 3 Ca 0.52 -0.80 0.01 0.00 0.02 0.00 0.00 55.36 55.11 3gnm s GLN 3 Cb -0.21 0.17 0.02 0.00 1.00 0.00 0.00 33.01 34.00 3gnm s GLN 3 CO 0.15 -0.09 -0.09 -0.06 -2.12 0.00 0.00 175.29 173.08 3gnm s PHE 4 N -2.41 1.43 -0.35 0.91 0.08 -1.26 -1.87 117.98 114.51 3gnm s PHE 4 Ca -0.07 -0.64 -0.14 0.00 0.12 0.00 0.00 56.93 56.20 3gnm s PHE 4 Cb -0.03 -1.14 -0.01 0.00 -0.57 0.00 0.00 43.02 41.27 3gnm s PHE 4 CO -0.04 -0.41 0.29 -1.17 -0.10 0.00 0.00 175.22 173.78 3gnm s LEU 5 N 1.29 4.55 0.02 -0.37 2.96 -0.38 -4.30 118.68 122.44 3gnm s LEU 5 Ca -0.03 -0.40 0.03 0.00 -0.22 0.00 0.00 54.13 53.50 3gnm s LEU 5 Cb -0.14 -2.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.31 3gnm s LEU 5 CO -0.03 -0.29 -0.02 -1.61 -1.32 0.00 0.00 176.35 173.07 3gnm s GLU 6 N 1.82 2.66 0.58 1.98 2.02 -1.26 -1.02 118.70 125.47 3gnm s GLU 6 Ca 0.08 -0.69 0.39 0.00 0.02 0.00 0.00 54.97 54.77 3gnm s GLU 6 Cb -0.17 -2.59 1.43 0.00 0.10 0.00 0.00 34.13 32.90 3gnm s GLU 6 CO 0.11 0.60 1.55 0.66 0.02 0.00 0.00 175.26 178.20 3gnm h SER 7 N 4.26 0.00 0.00 -0.19 4.64 -1.86 -3.47 113.55 116.93 3gnm h SER 7 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3gnm h SER 7 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3gnm h SER 7 CO 0.56 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.13 3gnm n GLY 8 N -1.80 2.05 3.01 -0.77 0.00 -1.26 -4.89 105.19 101.53 3gnm n GLY 8 Ca 0.32 -0.68 -0.13 0.00 0.00 0.00 0.00 46.02 45.53 3gnm n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnm s ALA 9 N -0.39 -0.35 -0.00 4.61 0.00 -1.26 -1.75 121.76 122.62 3gnm s ALA 9 Ca 0.00 0.47 0.04 0.00 0.00 0.00 0.00 51.96 52.46 3gnm s ALA 9 Cb 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 3gnm s ALA 9 CO 0.00 -0.09 -0.12 -1.21 0.00 0.00 0.00 175.76 174.34 3gnm s GLU 10 N 0.28 0.95 -0.13 0.00 2.02 0.20 -4.49 118.70 117.53 3gnm s GLU 10 Ca -0.02 -0.46 -0.01 0.00 0.02 0.00 0.00 54.97 54.50 3gnm s GLU 10 Cb -0.03 -0.92 -0.02 0.00 0.10 0.00 0.00 34.13 33.26 3gnm s GLU 10 CO -0.01 0.25 -0.08 -1.17 0.02 0.00 0.00 175.26 174.27 3gnm s LEU 11 N -0.39 3.02 0.04 1.80 2.96 -1.26 -0.24 118.68 124.60 3gnm s LEU 11 Ca 0.04 -0.19 0.00 0.00 -0.22 0.00 0.00 54.13 53.76 3gnm s LEU 11 Cb -0.05 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.92 3gnm s LEU 11 CO -0.00 0.21 -0.04 0.00 -1.32 0.00 0.00 176.35 175.20 3gnm s ALA 12 N 0.11 0.34 0.31 5.97 0.00 0.08 -4.97 121.76 123.60 3gnm s ALA 12 Ca -0.03 -0.83 -0.28 0.00 0.00 0.00 0.00 51.96 50.82 3gnm s ALA 12 Cb -0.14 0.17 -0.09 0.00 0.00 0.00 0.00 23.12 23.05 3gnm s ALA 12 CO 0.04 -0.20 1.02 0.15 0.00 0.00 0.00 175.76 176.76 3gnm s LYS 13 N -2.30 4.57 0.16 0.00 -0.14 -1.25 -0.05 119.74 120.74 3gnm s LYS 13 Ca -0.07 1.56 -0.33 0.00 -1.36 0.00 0.00 55.97 55.77 3gnm s LYS 13 Cb -0.04 -2.98 -0.16 0.00 -1.68 0.00 0.00 37.83 32.97 3gnm s LYS 13 CO -0.04 0.22 1.23 -2.30 -0.76 0.00 0.00 175.35 173.71 3gnm n PRO 14 N 0.84 1.27 0.00 -1.68 -0.02 -1.26 -1.10 135.00 133.05 3gnm n PRO 14 Ca 0.01 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 3gnm n PRO 14 Cb 0.47 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 3gnm n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gnm n GLY 15 N 2.16 2.21 3.97 -1.23 0.00 0.58 -4.87 105.19 108.01 3gnm n GLY 15 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 3gnm n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnm s ALA 16 N -2.61 2.91 0.16 4.61 0.00 -0.26 -4.33 121.76 122.25 3gnm s ALA 16 Ca 0.00 -1.61 0.10 0.00 0.00 0.00 0.00 51.96 50.45 3gnm s ALA 16 Cb 0.00 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 20.74 3gnm s ALA 16 CO 0.00 -2.13 -0.19 -1.12 0.00 0.00 0.00 175.76 172.32 3gnm s SER 17 N -4.89 3.76 0.02 0.00 0.01 -1.26 -1.42 113.70 109.92 3gnm s SER 17 Ca 0.73 -0.70 0.01 0.00 1.31 0.00 0.00 55.95 57.30 3gnm s SER 17 Cb -0.03 -0.45 -0.02 0.00 0.21 0.00 0.00 66.02 65.73 3gnm s SER 17 CO 0.50 0.14 -0.05 0.54 0.41 0.00 0.00 173.24 174.77 3gnm s VAL 18 N -1.48 0.35 -0.05 3.43 0.11 0.06 -4.97 120.40 117.84 3gnm s VAL 18 Ca 0.20 -0.79 0.05 0.00 -2.93 0.00 0.00 61.98 58.52 3gnm s VAL 18 Cb -0.09 -0.41 -0.02 0.00 -1.53 0.00 0.00 36.38 34.33 3gnm s VAL 18 CO 0.11 -0.30 -0.18 -0.75 -3.33 0.00 0.00 175.10 170.65 3gnm s LYS 19 N -1.15 2.47 0.11 1.54 2.20 -1.26 -0.39 119.74 123.25 3gnm s LYS 19 Ca -0.09 -0.78 0.03 0.00 -0.36 0.00 0.00 55.97 54.78 3gnm s LYS 19 Cb -0.08 -2.29 -0.04 0.00 -1.51 0.00 0.00 37.83 33.92 3gnm s LYS 19 CO -0.00 0.55 -0.09 0.00 -0.36 0.00 0.00 175.35 175.45 3gnm s MET 20 N -0.56 0.88 0.12 4.03 0.23 0.29 -4.98 119.30 119.29 3gnm s MET 20 Ca 0.08 -1.26 0.04 0.00 -1.03 0.00 0.00 55.69 53.52 3gnm s MET 20 Cb -0.11 -0.45 -0.04 0.00 -1.53 0.00 0.00 34.83 32.70 3gnm s MET 20 CO 0.01 0.05 -0.11 -1.54 -2.03 0.00 0.00 175.02 171.40 3gnm s SER 21 N -2.75 1.65 -0.26 -1.18 1.04 -1.26 -0.87 113.70 110.06 3gnm s SER 21 Ca 0.09 -0.88 -0.04 0.00 0.48 0.00 0.00 55.95 55.61 3gnm s SER 21 Cb 0.00 -0.01 0.09 0.00 0.10 0.00 0.00 66.02 66.21 3gnm s SER 21 CO -0.01 -0.27 0.14 0.00 0.98 0.00 0.00 173.24 174.08 3gnm s LYS 23 N 2.14 4.18 -0.06 0.00 2.20 -0.19 0.23 119.74 128.24 3gnm s LYS 23 Ca 0.07 0.46 -0.07 0.00 -0.36 0.00 0.00 55.97 56.08 3gnm s LYS 23 Cb -0.16 -3.58 -0.04 0.00 -1.51 0.00 0.00 37.83 32.54 3gnm s LYS 23 CO -0.30 -0.20 0.20 0.00 -0.36 0.00 0.00 175.35 174.69 3gnm s ALA 24 N 1.79 3.88 0.18 3.13 0.00 -0.12 -1.25 121.76 129.37 3gnm s ALA 24 Ca 0.25 -0.62 -0.05 0.00 0.00 0.00 0.00 51.96 51.54 3gnm s ALA 24 Cb -0.16 -2.00 -0.03 0.00 0.00 0.00 0.00 23.12 20.94 3gnm s ALA 24 CO 0.10 0.64 0.21 -1.54 0.00 0.00 0.00 175.76 175.17 3gnm s SER 25 N -1.38 0.12 0.00 0.00 1.04 -0.78 -4.82 113.70 107.88 3gnm s SER 25 Ca 0.21 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 55.50 3gnm s SER 25 Cb -0.13 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.40 3gnm s SER 25 CO 0.11 -0.87 0.00 0.61 0.98 0.00 0.00 173.24 174.06 3gnm n GLY 26 N -0.23 0.63 3.70 7.32 0.00 -1.24 -1.82 105.19 113.54 3gnm n GLY 26 Ca -0.03 -0.41 -0.05 0.00 0.00 0.00 0.00 46.02 45.53 3gnm n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3gnm s TYR 27 N -2.00 -0.18 -0.44 1.61 1.13 -1.26 -4.23 117.35 111.98 3gnm s TYR 27 Ca 0.00 -0.08 -0.27 0.00 -1.41 0.00 0.00 57.07 55.30 3gnm s TYR 27 Cb 0.00 0.62 -0.03 0.00 -1.10 0.00 0.00 41.96 41.44 3gnm s TYR 27 CO 0.00 -0.77 2.01 0.99 -2.51 0.00 0.00 175.55 175.27 3gnm s THR 28 N -3.26 3.27 0.36 -3.49 2.01 -1.26 -4.91 115.64 108.37 3gnm s THR 28 Ca 0.10 0.23 0.11 0.00 0.31 0.00 0.00 61.69 62.44 3gnm s THR 28 Cb -0.01 -3.51 0.34 0.00 0.01 0.00 0.00 72.50 69.32 3gnm s THR 28 CO -0.00 -0.42 1.84 0.15 -0.69 0.00 0.00 174.62 175.49 3gnm h PHE 29 N 15.29 0.79 -0.03 4.92 3.57 -1.96 -1.11 116.94 138.42 3gnm h PHE 29 Ca -0.30 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.22 3gnm h PHE 29 Cb 1.20 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.69 3gnm h PHE 29 CO 0.98 0.24 0.00 0.25 -2.23 0.00 0.00 178.31 177.55 3gnm n THR 30 N -4.59 0.03 0.35 4.41 -2.24 -1.26 -3.68 114.28 107.30 3gnm n THR 30 Ca 0.19 -0.07 0.12 0.00 -2.27 0.00 0.00 64.05 62.02 3gnm n THR 30 Cb 0.57 -0.18 0.05 0.00 -2.10 0.00 0.00 70.33 68.67 3gnm n THR 30 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3gnm n THR 31 N -0.60 0.41 -4.10 4.28 -1.04 -0.42 -4.25 114.28 108.56 3gnm n THR 31 Ca 0.16 -0.39 -0.15 0.00 -2.04 0.00 0.00 64.05 61.63 3gnm n THR 31 Cb 0.13 -0.13 -0.12 0.00 -1.82 0.00 0.00 70.33 68.39 3gnm n THR 31 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3gnm s TYR 32 N -3.27 0.84 0.43 -1.42 1.51 -1.24 -5.07 117.35 109.12 3gnm s TYR 32 Ca 0.02 -0.50 -0.22 0.00 -1.01 0.00 0.00 57.07 55.37 3gnm s TYR 32 Cb 0.12 -0.49 -0.10 0.00 -0.11 0.00 0.00 41.96 41.39 3gnm s TYR 32 CO 0.78 -0.04 1.00 -1.58 -1.11 0.00 0.00 175.55 174.60 3gnm s TRP 33 N -1.39 3.24 -0.20 2.71 0.51 -1.24 -4.50 118.94 118.07 3gnm s TRP 33 Ca -0.07 1.63 -0.05 0.00 -2.12 0.00 0.00 56.10 55.48 3gnm s TRP 33 Cb -0.10 -2.99 -0.03 0.00 -0.81 0.00 0.00 33.47 29.54 3gnm s TRP 33 CO 0.01 -0.42 0.01 -1.64 -0.51 0.00 0.00 176.95 174.40 3gnm s MET 34 N -2.91 3.67 0.20 4.98 -1.94 -0.17 -1.25 119.30 121.88 3gnm s MET 34 Ca 0.61 -0.50 0.08 0.00 -1.71 0.00 0.00 55.69 54.18 3gnm s MET 34 Cb -0.15 -3.11 -0.04 0.00 2.01 0.00 0.00 34.83 33.53 3gnm s MET 34 CO 0.20 0.04 0.01 -1.01 -0.01 0.00 0.00 175.02 174.24 3gnm s HIS 35 N 0.95 2.82 0.01 -0.03 3.76 0.46 -1.21 115.29 122.05 3gnm s HIS 35 Ca 0.02 -0.16 0.07 0.00 -0.15 0.00 0.00 55.06 54.85 3gnm s HIS 35 Cb -0.14 -1.34 -0.02 0.00 1.11 0.00 0.00 32.58 32.19 3gnm s HIS 35 CO 0.02 0.54 -0.23 -1.58 -0.85 0.00 0.00 174.74 172.64 3gnm s TRP 36 N -1.86 2.03 -0.02 1.40 0.52 -0.83 -1.28 118.94 118.90 3gnm s TRP 36 Ca 0.28 -0.39 0.03 0.00 0.02 0.00 0.00 56.10 56.05 3gnm s TRP 36 Cb -0.09 -1.27 -0.01 0.00 -1.15 0.00 0.00 33.47 30.96 3gnm s TRP 36 CO 0.19 0.02 -0.12 0.08 0.02 0.00 0.00 176.95 177.15 3gnm s VAL 37 N -0.64 0.93 -0.09 4.03 1.01 -0.06 -0.62 120.40 124.96 3gnm s VAL 37 Ca 0.09 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.55 3gnm s VAL 37 Cb -0.09 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 3gnm s VAL 37 CO 0.00 0.27 0.05 -0.75 0.00 0.00 0.00 175.10 174.68 3gnm s LYS 38 N -0.13 3.14 -0.18 2.72 2.20 0.36 -0.65 119.74 127.20 3gnm s LYS 38 Ca 0.02 -0.32 -0.04 0.00 -0.36 0.00 0.00 55.97 55.27 3gnm s LYS 38 Cb -0.06 -2.93 0.06 0.00 -1.51 0.00 0.00 37.83 33.39 3gnm s LYS 38 CO -0.00 0.73 0.07 -1.14 -0.36 0.00 0.00 175.35 174.65 3gnm s GLN 39 N -0.98 0.24 0.41 4.03 0.74 0.15 -0.65 119.66 123.60 3gnm s GLN 39 Ca 0.14 -0.19 -0.22 0.00 0.05 0.00 0.00 55.36 55.13 3gnm s GLN 39 Cb -0.12 -1.90 -0.10 0.00 1.10 0.00 0.00 33.01 31.99 3gnm s GLN 39 CO 0.03 -0.67 0.97 1.03 -0.55 0.00 0.00 175.29 176.10 3gnm s ARG 40 N 2.05 4.27 -0.08 1.67 0.52 -1.26 -0.53 118.95 125.59 3gnm s ARG 40 Ca 0.01 1.23 -0.39 0.00 -0.52 0.00 0.00 55.73 56.07 3gnm s ARG 40 Cb -0.16 -2.36 -0.17 0.00 0.52 0.00 0.00 34.95 32.78 3gnm s ARG 40 CO -0.09 -0.00 1.49 -2.30 0.02 0.00 0.00 175.30 174.41 3gnm n PRO 41 N -0.32 1.03 -0.87 3.54 -0.02 -1.26 0.41 135.00 137.52 3gnm n PRO 41 Ca 0.06 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 3gnm n PRO 41 Cb 0.52 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 3gnm n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gnm n GLY 42 N 3.14 0.21 3.44 -1.23 0.00 -1.26 -4.98 105.19 104.51 3gnm n GLY 42 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 3gnm n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3gnm n GLN 43 N -0.88 0.75 0.00 1.61 1.13 0.17 -5.15 117.38 115.02 3gnm n GLN 43 Ca 0.00 -3.11 0.00 0.00 -1.94 0.00 0.00 57.00 51.95 3gnm n GLN 43 Cb 0.22 0.33 0.00 0.00 0.11 0.00 0.00 30.24 30.90 3gnm n GLN 43 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3gnm n GLY 44 N -1.00 0.00 3.57 1.08 0.00 -1.26 -4.62 105.19 102.96 3gnm n GLY 44 Ca -0.02 -1.72 -0.34 0.00 0.00 0.00 0.00 46.02 43.95 3gnm n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gnm s LEU 45 N 0.00 3.13 -0.08 0.99 1.43 -1.26 -4.10 118.68 118.79 3gnm s LEU 45 Ca 0.00 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 3gnm s LEU 45 Cb 0.00 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.56 3gnm s LEU 45 CO 0.00 0.36 -0.07 -0.70 0.23 0.00 0.00 176.35 176.17 3gnm s GLU 46 N -0.83 1.31 0.09 1.70 2.12 0.18 -4.95 118.70 118.31 3gnm s GLU 46 Ca 0.13 -0.22 -0.30 0.00 0.36 0.00 0.00 54.97 54.94 3gnm s GLU 46 Cb -0.11 -1.31 -0.05 0.00 0.26 0.00 0.00 34.13 32.92 3gnm s GLU 46 CO 0.02 -0.16 0.96 -0.46 -0.54 0.00 0.00 175.26 175.08 3gnm s TRP 47 N 1.32 3.78 -0.25 5.30 -0.00 -1.26 -0.49 118.94 127.34 3gnm s TRP 47 Ca -0.03 1.78 -0.10 0.00 -0.00 0.00 0.00 56.10 57.75 3gnm s TRP 47 Cb -0.14 -3.07 -0.16 0.00 -0.00 0.00 0.00 33.47 30.10 3gnm s TRP 47 CO -0.03 0.16 -0.15 -0.89 -0.00 0.00 0.00 176.95 176.03 3gnm n ILE 48 N 3.03 1.55 0.00 5.86 5.41 0.21 -4.60 119.36 130.82 3gnm n ILE 48 Ca 0.03 -0.42 0.00 0.00 1.00 0.00 0.00 62.75 63.36 3gnm n ILE 48 Cb 0.50 -1.75 0.00 0.00 -0.71 0.00 0.00 39.64 37.67 3gnm n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3gnm n GLY 49 N 1.66 -0.22 3.18 7.39 0.00 -1.24 0.20 105.19 116.16 3gnm n GLY 49 Ca -0.46 -1.14 -0.08 0.00 0.00 0.00 0.00 46.02 44.33 3gnm n GLY 49 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3gnm s PHE 50 N -2.00 0.24 -0.01 1.61 -0.12 -0.07 -1.97 117.98 115.67 3gnm s PHE 50 Ca 0.00 -0.70 0.03 0.00 -0.05 0.00 0.00 56.93 56.21 3gnm s PHE 50 Cb 0.00 -0.13 -0.01 0.00 -0.63 0.00 0.00 43.02 42.25 3gnm s PHE 50 CO 0.00 -0.51 -0.09 -1.50 -0.05 0.00 0.00 175.22 173.07 3gnm s ILE 51 N -3.88 0.69 -0.43 -4.49 2.07 -0.35 -1.70 121.20 113.12 3gnm s ILE 51 Ca 0.06 -0.37 -0.19 0.00 -1.41 0.00 0.00 60.65 58.74 3gnm s ILE 51 Cb 0.06 -0.59 0.02 0.00 0.13 0.00 0.00 42.46 42.08 3gnm s ILE 51 CO -0.11 0.20 0.52 -0.55 -1.91 0.00 0.00 174.94 173.09 3gnm s SER 52 N -0.16 6.24 0.44 4.50 0.15 0.93 -1.00 113.70 124.80 3gnm s SER 52 Ca 0.03 -0.57 0.13 0.00 0.70 0.00 0.00 55.95 56.24 3gnm s SER 52 Cb -0.04 -2.26 1.03 0.00 -1.71 0.00 0.00 66.02 63.04 3gnm s SER 52 CO -0.00 -0.66 2.02 -0.65 1.20 0.00 0.00 173.24 175.14 3gnm h PRO 53 N 8.79 0.37 0.00 5.44 0.11 -1.85 0.49 132.00 145.35 3gnm h PRO 53 Ca -0.26 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.79 3gnm h PRO 53 Cb 1.10 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3gnm h PRO 53 CO 0.83 0.25 -0.20 -0.97 -0.21 0.00 0.00 178.00 177.70 3gnm h ASN 54 N 0.38 0.00 0.00 -2.05 -0.00 -1.88 -3.25 115.58 108.79 3gnm h ASN 54 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.52 3gnm h ASN 54 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.69 3gnm h ASN 54 CO -0.05 0.20 -0.00 0.35 -0.00 0.00 0.00 177.43 177.92 3gnm n THR 55 N -3.89 0.00 -1.20 -3.57 -2.24 -1.13 -5.00 114.28 97.25 3gnm n THR 55 Ca -0.02 -0.33 -0.07 0.00 -2.27 0.00 0.00 64.05 61.36 3gnm n THR 55 Cb 0.29 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.49 3gnm n THR 55 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3gnm n ASP 56 N -0.67 -4.72 -4.72 3.42 10.43 0.17 -4.98 116.55 115.47 3gnm n ASP 56 Ca 0.00 0.17 -0.42 0.00 2.57 0.00 0.00 54.79 57.11 3gnm n ASP 56 Cb 0.00 -2.83 -0.02 0.00 1.84 0.00 0.00 41.12 40.11 3gnm n ASP 56 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3gnm n TYR 57 N -2.50 2.72 -4.48 1.24 9.36 -1.16 -4.76 117.16 117.56 3gnm n TYR 57 Ca -0.07 0.18 -0.22 0.00 3.32 0.00 0.00 57.90 61.12 3gnm n TYR 57 Cb 0.37 -2.61 -0.14 0.00 -0.63 0.00 0.00 39.34 36.33 3gnm n TYR 57 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 3gnm s THR 58 N 0.54 1.24 -0.03 2.97 -4.23 -1.26 -0.05 115.64 114.81 3gnm s THR 58 Ca 0.70 -0.97 0.04 0.00 -1.18 0.00 0.00 61.69 60.28 3gnm s THR 58 Cb -0.53 -1.09 -0.00 0.00 1.34 0.00 0.00 72.50 72.22 3gnm s THR 58 CO 0.41 0.11 -0.14 -0.70 -0.54 0.00 0.00 174.62 173.77 3gnm s GLU 59 N -0.98 1.42 0.16 3.99 2.12 -0.69 -5.00 118.70 119.72 3gnm s GLU 59 Ca 0.04 -0.49 0.11 0.00 0.36 0.00 0.00 54.97 54.99 3gnm s GLU 59 Cb -0.08 -1.27 -0.04 0.00 0.26 0.00 0.00 34.13 33.00 3gnm s GLU 59 CO 0.01 0.20 -0.23 0.71 -0.54 0.00 0.00 175.26 175.41 3gnm s TYR 60 N 0.06 2.37 0.01 5.30 1.51 -1.26 -0.89 117.35 124.45 3gnm s TYR 60 Ca -0.03 -0.34 -0.30 0.00 -1.01 0.00 0.00 57.07 55.39 3gnm s TYR 60 Cb -0.10 -1.22 -0.06 0.00 -0.11 0.00 0.00 41.96 40.48 3gnm s TYR 60 CO 0.01 0.43 1.38 1.21 -1.11 0.00 0.00 175.55 177.48 3gnm s ASN 61 N -2.41 6.87 0.63 2.29 3.84 0.13 -4.89 114.94 121.39 3gnm s ASN 61 Ca 0.19 2.12 0.36 0.00 0.21 0.00 0.00 52.86 55.74 3gnm s ASN 61 Cb -0.09 -2.56 2.07 0.00 -0.55 0.00 0.00 41.25 40.12 3gnm s ASN 61 CO 0.09 -0.70 2.28 1.56 -2.79 0.00 0.00 177.10 177.55 3gnm h GLN 62 N 7.66 0.00 -0.09 0.43 1.08 -1.95 0.18 115.11 122.43 3gnm h GLN 62 Ca -0.38 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 56.84 3gnm h GLN 62 Cb 1.18 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.61 3gnm h GLN 62 CO 0.89 0.00 0.11 0.87 -0.95 0.00 0.00 178.83 179.75 3gnm h LYS 63 N 0.00 0.00 -0.38 1.46 1.57 -1.94 -2.39 116.57 114.88 3gnm h LYS 63 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3gnm h LYS 63 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3gnm h LYS 63 CO -0.00 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.07 3gnm n PHE 64 N -3.76 0.51 -0.35 -1.35 3.72 0.63 -4.74 117.46 112.12 3gnm n PHE 64 Ca -0.01 -0.48 -0.09 0.00 -0.05 0.00 0.00 57.45 56.82 3gnm n PHE 64 Cb 0.20 -0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 38.64 3gnm n PHE 64 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 3gnm n ARG 65 N 0.66 -0.36 -0.14 -1.08 0.63 -0.90 -1.25 116.66 114.22 3gnm n ARG 65 Ca 0.13 1.25 0.11 0.00 -0.92 0.00 0.00 57.85 58.42 3gnm n ARG 65 Cb 0.45 -1.83 0.18 0.00 0.45 0.00 0.00 32.46 31.70 3gnm n ARG 65 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3gnm n ASP 66 N -5.04 3.27 -0.00 6.15 8.00 -1.26 -4.41 116.55 123.25 3gnm n ASP 66 Ca 0.02 -1.96 -0.22 0.00 0.71 0.00 0.00 54.79 53.34 3gnm n ASP 66 Cb 0.22 -0.18 -0.14 0.00 -0.02 0.00 0.00 41.12 41.00 3gnm n ASP 66 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 3gnm h LYS 67 N 4.30 0.23 -6.53 -1.24 1.63 -1.56 -3.44 116.57 109.96 3gnm h LYS 67 Ca 0.00 -0.39 -0.69 0.00 -0.85 0.00 0.00 60.65 58.73 3gnm h LYS 67 Cb 0.95 0.14 -0.22 0.00 -0.60 0.00 0.00 32.23 32.50 3gnm h LYS 67 CO 0.00 1.19 -0.80 0.00 -3.45 0.00 0.00 179.45 176.39 3gnm s ALA 68 N -2.49 2.61 -0.08 5.00 0.00 -0.38 -1.64 121.76 124.78 3gnm s ALA 68 Ca -0.22 -1.15 -0.00 0.00 0.00 0.00 0.00 51.96 50.59 3gnm s ALA 68 Cb 0.05 -0.78 0.02 0.00 0.00 0.00 0.00 23.12 22.41 3gnm s ALA 68 CO 0.75 0.57 -0.04 0.99 0.00 0.00 0.00 175.76 178.03 3gnm s THR 69 N -0.89 0.63 -0.18 0.00 2.01 -0.32 -4.84 115.64 112.05 3gnm s THR 69 Ca 0.14 -0.07 -0.08 0.00 0.31 0.00 0.00 61.69 61.99 3gnm s THR 69 Cb -0.11 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.65 3gnm s THR 69 CO 0.04 0.29 0.09 -0.76 -0.69 0.00 0.00 174.62 173.59 3gnm s LEU 70 N 1.62 4.00 0.28 4.42 1.43 -1.26 -0.67 118.68 128.50 3gnm s LEU 70 Ca 0.01 0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.31 3gnm s LEU 70 Cb -0.13 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 3gnm s LEU 70 CO -0.05 0.21 0.15 0.42 0.23 0.00 0.00 176.35 177.31 3gnm s THR 71 N 0.14 0.33 0.09 5.49 -4.23 -0.53 -5.00 115.64 111.93 3gnm s THR 71 Ca 0.07 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.39 3gnm s THR 71 Cb -0.12 -2.54 0.04 0.00 1.34 0.00 0.00 72.50 71.23 3gnm s THR 71 CO -0.00 0.00 0.45 0.00 -0.54 0.00 0.00 174.62 174.53 3gnm s ALA 72 N -3.70 -1.12 -0.23 3.99 0.00 -1.26 -0.92 121.76 118.52 3gnm s ALA 72 Ca 0.37 0.24 -0.02 0.00 0.00 0.00 0.00 51.96 52.55 3gnm s ALA 72 Cb 0.06 0.57 0.07 0.00 0.00 0.00 0.00 23.12 23.82 3gnm s ALA 72 CO 0.16 -0.59 0.04 0.34 0.00 0.00 0.00 175.76 175.71 3gnm s ASP 73 N -2.43 3.31 0.10 0.00 -1.08 0.59 -4.98 116.67 112.18 3gnm s ASP 73 Ca -0.01 -1.06 -0.27 0.00 -0.52 0.00 0.00 52.55 50.69 3gnm s ASP 73 Cb 0.00 -0.74 -0.10 0.00 -1.46 0.00 0.00 42.92 40.62 3gnm s ASP 73 CO -0.08 -0.32 1.65 0.11 0.52 0.00 0.00 175.17 177.05 3gnm h LYS 74 N 8.17 -0.44 -0.42 4.34 1.57 -1.89 -0.53 116.57 127.37 3gnm h LYS 74 Ca -0.16 0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 3gnm h LYS 74 Cb 1.09 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.48 3gnm h LYS 74 CO 0.38 -0.29 0.24 0.66 -0.57 0.00 0.00 179.45 179.87 3gnm h SER 75 N -0.46 0.50 -0.64 0.86 4.64 -1.97 -1.66 113.55 114.82 3gnm h SER 75 Ca 0.01 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3gnm h SER 75 Cb 0.46 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3gnm h SER 75 CO -0.10 0.39 0.00 -1.54 -0.87 0.00 0.00 176.83 174.71 3gnm n SER 76 N -4.44 3.83 -4.02 4.97 3.41 -1.15 -4.97 113.62 111.24 3gnm n SER 76 Ca 0.03 -2.06 -0.28 0.00 -0.26 0.00 0.00 58.87 56.30 3gnm n SER 76 Cb 0.08 -0.45 -0.07 0.00 -0.26 0.00 0.00 64.21 63.52 3gnm n SER 76 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3gnm n THR 77 N 1.33 -1.04 -5.08 6.66 -2.24 -0.33 -4.78 114.28 108.80 3gnm n THR 77 Ca 0.22 -0.43 -0.30 0.00 -2.27 0.00 0.00 64.05 61.27 3gnm n THR 77 Cb 0.61 -0.99 -0.17 0.00 -2.10 0.00 0.00 70.33 67.69 3gnm n THR 77 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3gnm s THR 78 N -4.10 1.82 0.06 4.28 2.01 -0.48 -0.95 115.64 118.28 3gnm s THR 78 Ca 0.06 -0.90 -0.02 0.00 0.31 0.00 0.00 61.69 61.14 3gnm s THR 78 Cb -0.04 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 3gnm s THR 78 CO 0.83 0.51 0.24 0.00 -0.69 0.00 0.00 174.62 175.51 3gnm s ALA 79 N 0.20 3.94 0.02 7.40 0.00 0.14 -0.30 121.76 133.15 3gnm s ALA 79 Ca -0.12 -0.74 0.06 0.00 0.00 0.00 0.00 51.96 51.17 3gnm s ALA 79 Cb -0.15 -1.93 -0.02 0.00 0.00 0.00 0.00 23.12 21.02 3gnm s ALA 79 CO 0.06 0.76 -0.18 0.71 0.00 0.00 0.00 175.76 177.11 3gnm s TYR 80 N -1.47 1.60 -0.06 0.00 1.51 -0.10 0.02 117.35 118.85 3gnm s TYR 80 Ca 0.34 -0.33 0.03 0.00 -1.01 0.00 0.00 57.07 56.09 3gnm s TYR 80 Cb -0.13 -0.99 0.01 0.00 -0.11 0.00 0.00 41.96 40.75 3gnm s TYR 80 CO 0.24 0.03 -0.12 1.41 -1.11 0.00 0.00 175.55 175.99 3gnm s MET 81 N -0.82 1.58 -0.10 -0.62 1.75 -0.05 -1.46 119.30 119.58 3gnm s MET 81 Ca 0.06 -0.42 -0.02 0.00 -1.25 0.00 0.00 55.69 54.06 3gnm s MET 81 Cb -0.08 -1.34 -0.03 0.00 2.84 0.00 0.00 34.83 36.22 3gnm s MET 81 CO 0.01 0.07 -0.02 -1.14 -0.65 0.00 0.00 175.02 173.29 3gnm s GLN 82 N 0.51 3.12 -0.08 4.11 0.74 0.15 -0.55 119.66 127.65 3gnm s GLN 82 Ca -0.11 -0.46 0.04 0.00 0.05 0.00 0.00 55.36 54.88 3gnm s GLN 82 Cb -0.14 -2.79 -0.01 0.00 1.10 0.00 0.00 33.01 31.17 3gnm s GLN 82 CO 0.03 0.58 -0.21 -0.51 -0.55 0.00 0.00 175.29 174.63 3gnm s LEU 83 N -0.56 2.26 0.34 3.68 1.43 0.47 -1.18 118.68 125.13 3gnm s LEU 83 Ca 0.09 -0.46 0.09 0.00 -1.03 0.00 0.00 54.13 52.82 3gnm s LEU 83 Cb -0.12 -1.45 -0.06 0.00 0.03 0.00 0.00 46.19 44.59 3gnm s LEU 83 CO 0.02 0.21 -0.06 -0.94 0.23 0.00 0.00 176.35 175.81 3gnm s SER 84 N 0.05 3.88 -1.19 2.29 1.04 -0.65 -0.76 113.70 118.35 3gnm s SER 84 Ca -0.09 -1.14 -0.23 0.00 0.48 0.00 0.00 55.95 54.98 3gnm s SER 84 Cb -0.15 -0.41 0.01 0.00 0.10 0.00 0.00 66.02 65.57 3gnm s SER 84 CO 0.05 -0.22 0.72 -1.20 0.98 0.00 0.00 173.24 173.57 3gnm n SER 85 N -0.85 -4.46 -4.75 7.02 7.64 -1.02 -4.80 113.62 112.39 3gnm n SER 85 Ca -0.05 -1.10 -0.41 0.00 1.01 0.00 0.00 58.87 58.32 3gnm n SER 85 Cb 0.63 -2.83 -0.03 0.00 -1.01 0.00 0.00 64.21 60.97 3gnm n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3gnm s LEU 86 N -6.82 4.47 0.33 -3.43 1.43 -0.51 -4.63 118.68 109.54 3gnm s LEU 86 Ca 0.44 2.39 0.03 0.00 -1.03 0.00 0.00 54.13 55.96 3gnm s LEU 86 Cb -0.18 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.36 3gnm s LEU 86 CO 0.90 -0.36 0.07 0.42 0.23 0.00 0.00 176.35 177.61 3gnm s THR 87 N -0.68 1.01 0.56 5.49 -4.23 -1.26 -0.31 115.64 116.22 3gnm s THR 87 Ca 0.50 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 59.26 3gnm s THR 87 Cb -0.35 -2.69 0.36 0.00 1.34 0.00 0.00 72.50 71.16 3gnm s THR 87 CO 0.43 0.00 2.06 0.77 -0.54 0.00 0.00 174.62 177.34 3gnm h SER 88 N 2.08 0.00 0.04 3.99 4.64 -1.97 0.16 113.55 122.49 3gnm h SER 88 Ca -0.40 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 3gnm h SER 88 Cb 1.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3gnm h SER 88 CO 0.66 0.00 -0.00 -0.33 -0.87 0.00 0.00 176.83 176.29 3gnm h GLU 89 N 0.00 0.00 0.00 4.77 4.39 -1.95 -1.69 114.58 120.10 3gnm h GLU 89 Ca 0.14 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.84 3gnm h GLU 89 Cb 0.64 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 3gnm h GLU 89 CO -0.00 0.00 -0.24 -0.25 -1.16 0.00 0.00 179.01 177.36 3gnm n ASP 90 N -3.40 0.43 -4.66 1.42 8.00 0.56 -4.86 116.55 114.05 3gnm n ASP 90 Ca -0.03 0.26 -0.42 0.00 0.71 0.00 0.00 54.79 55.31 3gnm n ASP 90 Cb 0.09 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 40.91 3gnm n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3gnm s SER 91 N -3.57 6.50 0.01 -2.24 0.01 -0.64 -4.86 113.70 108.92 3gnm s SER 91 Ca 0.11 2.44 -0.29 0.00 1.31 0.00 0.00 55.95 59.51 3gnm s SER 91 Cb 0.16 -2.53 0.11 0.00 0.21 0.00 0.00 66.02 63.97 3gnm s SER 91 CO 0.62 -1.04 1.23 0.00 0.41 0.00 0.00 173.24 174.47 3gnm s ALA 92 N 4.44 -2.15 -0.11 1.44 0.00 -0.84 -4.67 121.76 119.87 3gnm s ALA 92 Ca 0.82 0.57 -0.16 0.00 0.00 0.00 0.00 51.96 53.19 3gnm s ALA 92 Cb -0.38 0.43 -0.05 0.00 0.00 0.00 0.00 23.12 23.12 3gnm s ALA 92 CO 0.36 -1.06 0.40 0.08 0.00 0.00 0.00 175.76 175.55 3gnm s VAL 93 N -2.54 5.20 -0.23 0.00 1.01 0.31 -1.17 120.40 122.98 3gnm s VAL 93 Ca 0.14 0.80 -0.05 0.00 0.00 0.00 0.00 61.98 62.88 3gnm s VAL 93 Cb 0.04 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 3gnm s VAL 93 CO -0.03 0.39 -0.01 -0.31 0.00 0.00 0.00 175.10 175.14 3gnm s TYR 94 N 0.28 2.99 -0.09 5.22 1.51 -0.29 0.35 117.35 127.33 3gnm s TYR 94 Ca 0.22 -0.82 -0.04 0.00 -1.01 0.00 0.00 57.07 55.43 3gnm s TYR 94 Cb -0.15 -2.14 -0.04 0.00 -0.11 0.00 0.00 41.96 39.53 3gnm s TYR 94 CO 0.09 -0.50 0.08 0.71 -1.11 0.00 0.00 175.55 174.82 3gnm s TYR 95 N 1.51 3.39 0.19 2.71 1.51 0.18 -1.04 117.35 125.80 3gnm s TYR 95 Ca 0.06 0.35 0.04 0.00 -1.01 0.00 0.00 57.07 56.52 3gnm s TYR 95 Cb -0.15 -1.85 -0.03 0.00 -0.11 0.00 0.00 41.96 39.82 3gnm s TYR 95 CO -0.01 0.61 0.25 0.00 -1.11 0.00 0.00 175.55 175.29 3gnm s ALA 97 N -1.86 -1.53 0.47 0.00 0.00 -0.41 -0.30 121.76 118.12 3gnm s ALA 97 Ca 0.33 1.53 -0.07 0.00 0.00 0.00 0.00 51.96 53.75 3gnm s ALA 97 Cb -0.10 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 3gnm s ALA 97 CO 0.27 -0.31 0.79 -0.98 0.00 0.00 0.00 175.76 175.53 3gnm s ARG 98 N -0.18 3.60 -0.08 0.00 1.70 -0.95 -0.41 118.95 122.63 3gnm s ARG 98 Ca -0.04 0.28 0.01 0.00 -0.47 0.00 0.00 55.73 55.51 3gnm s ARG 98 Cb -0.03 -2.37 -0.03 0.00 -0.57 0.00 0.00 34.95 31.95 3gnm s ARG 98 CO 0.03 -0.17 -0.08 -1.54 -1.08 0.00 0.00 175.30 172.46 3gnm s SER 99 N -3.87 4.54 0.00 -2.89 1.04 -0.38 -3.97 113.70 108.17 3gnm s SER 99 Ca 0.49 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.84 3gnm s SER 99 Cb -0.10 -1.21 0.00 0.00 0.10 0.00 0.00 66.02 64.80 3gnm s SER 99 CO 0.42 0.33 0.00 0.33 0.98 0.00 0.00 173.24 175.30 3gnm n PHE 100 N 2.44 0.00 -4.85 5.02 7.35 -0.45 -3.66 117.46 123.31 3gnm n PHE 100 Ca -0.18 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.19 3gnm n PHE 100 Cb 0.53 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 40.21 3gnm n PHE 100 CO 0.00 0.00 0.00 -1.50 -0.76 0.00 0.00 176.76 174.50 3gnm s ILE 101 N 2.31 2.72 0.00 -2.13 2.07 -1.26 -4.47 121.20 120.44 3gnm s ILE 101 Ca 0.00 -0.78 0.00 0.00 -1.41 0.00 0.00 60.65 58.46 3gnm s ILE 101 Cb 0.00 -2.12 0.00 0.00 0.13 0.00 0.00 42.46 40.47 3gnm s ILE 101 CO 0.00 0.53 0.00 0.61 -1.91 0.00 0.00 174.94 174.17 3gnm n GLY 102 N 3.62 1.46 3.23 1.50 0.00 -1.26 -4.95 105.19 108.79 3gnm n GLY 102 Ca -0.19 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 3gnm n GLY 102 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3gnm s TYR 103 N -0.20 1.19 0.00 1.61 -0.85 -1.26 -5.11 117.35 112.72 3gnm s TYR 103 Ca 0.00 -0.84 0.00 0.00 -0.52 0.00 0.00 57.07 55.71 3gnm s TYR 103 Cb 0.00 -0.64 0.00 0.00 0.38 0.00 0.00 41.96 41.70 3gnm s TYR 103 CO 0.00 -0.02 0.00 0.09 -1.52 0.00 0.00 175.55 174.10 3gnm n ASN 104 N -0.18 0.00 -3.69 -0.18 3.02 -1.26 -1.34 115.26 111.63 3gnm n ASN 104 Ca -0.10 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.04 3gnm n ASN 104 Cb 0.61 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.79 3gnm n ASN 104 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3gnm n PHE 105 N 0.00 2.64 0.24 3.10 3.72 -1.26 -2.82 117.46 123.09 3gnm n PHE 105 Ca 0.00 -2.70 0.07 0.00 -0.05 0.00 0.00 57.45 54.78 3gnm n PHE 105 Cb 0.00 -1.58 0.59 0.00 -0.94 0.00 0.00 39.48 37.56 3gnm n PHE 105 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 3gnm h ASP 106 N 4.85 0.00 -3.53 4.37 2.03 -1.87 -3.41 116.42 118.86 3gnm h ASP 106 Ca 0.51 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 56.55 3gnm h ASP 106 Cb 0.42 0.00 -0.32 0.00 -0.83 0.00 0.00 39.33 38.61 3gnm h ASP 106 CO 1.40 0.11 -0.65 -0.36 -1.03 0.00 0.00 179.24 178.71 3gnm s PHE 107 N -4.71 -0.08 0.06 4.15 0.40 -1.26 -5.09 117.98 111.45 3gnm s PHE 107 Ca -0.04 0.30 0.08 0.00 -0.60 0.00 0.00 56.93 56.67 3gnm s PHE 107 Cb 0.16 -0.11 -0.03 0.00 0.51 0.00 0.00 43.02 43.54 3gnm s PHE 107 CO 0.67 -0.11 -0.22 -1.58 0.70 0.00 0.00 175.22 174.67 3gnm s TRP 108 N 0.91 1.94 0.88 0.36 0.52 -1.26 -2.25 118.94 120.04 3gnm s TRP 108 Ca -0.07 -0.39 -0.15 0.00 0.02 0.00 0.00 56.10 55.51 3gnm s TRP 108 Cb -0.10 -1.13 0.22 0.00 -1.15 0.00 0.00 33.47 31.31 3gnm s TRP 108 CO -0.04 0.14 0.82 0.41 0.02 0.00 0.00 176.95 178.30 3gnm n GLY 109 N 1.64 -2.56 0.06 0.98 0.00 0.58 -4.71 105.19 101.18 3gnm n GLY 109 Ca -0.18 -1.50 0.13 0.00 0.00 0.00 0.00 46.02 44.47 3gnm n GLY 109 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3gnm n GLN 110 N -3.87 0.21 0.00 1.61 6.02 -1.26 -4.81 117.38 115.28 3gnm n GLN 110 Ca 0.11 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 57.21 3gnm n GLN 110 Cb 0.43 -1.68 0.00 0.00 1.02 0.00 0.00 30.24 30.01 3gnm n GLN 110 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3gnm n GLY 111 N 1.37 1.16 3.57 1.08 0.00 -1.26 -5.00 105.19 106.11 3gnm n GLY 111 Ca 0.05 -1.45 -0.37 0.00 0.00 0.00 0.00 46.02 44.25 3gnm n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gnm s THR 112 N -0.86 4.97 -0.34 2.61 2.01 -0.21 -4.31 115.64 119.51 3gnm s THR 112 Ca 0.00 0.05 -0.27 0.00 0.31 0.00 0.00 61.69 61.78 3gnm s THR 112 Cb 0.00 -3.33 0.01 0.00 0.01 0.00 0.00 72.50 69.19 3gnm s THR 112 CO 0.00 0.33 0.96 -0.89 -0.69 0.00 0.00 174.62 174.33 3gnm s THR 113 N 1.36 4.58 -0.17 -0.82 2.01 -0.72 -1.13 115.64 120.75 3gnm s THR 113 Ca 0.06 1.38 -0.06 0.00 0.31 0.00 0.00 61.69 63.39 3gnm s THR 113 Cb -0.15 -4.34 -0.03 0.00 0.01 0.00 0.00 72.50 67.99 3gnm s THR 113 CO 0.06 -0.48 0.02 -0.22 -0.69 0.00 0.00 174.62 173.31 3gnm s LEU 114 N 3.47 3.56 -0.12 4.42 2.96 -0.32 -0.63 118.68 132.02 3gnm s LEU 114 Ca 0.40 -0.01 0.01 0.00 -0.22 0.00 0.00 54.13 54.31 3gnm s LEU 114 Cb -0.12 -1.88 -0.01 0.00 0.50 0.00 0.00 46.19 44.68 3gnm s LEU 114 CO 0.17 0.17 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.31 3gnm s THR 115 N 0.36 2.67 -0.36 3.68 2.01 0.67 -1.99 115.64 122.67 3gnm s THR 115 Ca -0.00 -0.80 -0.12 0.00 0.31 0.00 0.00 61.69 61.08 3gnm s THR 115 Cb -0.13 -2.09 0.01 0.00 0.01 0.00 0.00 72.50 70.30 3gnm s THR 115 CO 0.01 0.54 0.22 -0.69 -0.69 0.00 0.00 174.62 174.01 3gnm s VAL 116 N 0.39 4.92 -0.02 3.82 1.01 -1.26 -0.74 120.40 128.52 3gnm s VAL 116 Ca -0.13 -0.55 -0.28 0.00 0.00 0.00 0.00 61.98 61.01 3gnm s VAL 116 Cb -0.17 -3.63 0.10 0.00 0.00 0.00 0.00 36.38 32.68 3gnm s VAL 116 CO 0.06 -0.13 0.82 -0.55 0.00 0.00 0.00 175.10 175.30 3gnm s SER 117 N 1.64 -0.46 0.43 3.32 0.15 0.93 -4.63 113.70 115.07 3gnm s SER 117 Ca 0.04 0.24 0.25 0.00 0.70 0.00 0.00 55.95 57.18 3gnm s SER 117 Cb -0.18 0.44 0.57 0.00 -1.71 0.00 0.00 66.02 65.14 3gnm s SER 117 CO 0.08 -0.62 1.69 0.28 1.20 0.00 0.00 173.24 175.87 3gnm h SER 118 N 2.33 0.00 -4.27 5.45 0.02 -1.95 -3.31 113.55 111.81 3gnm h SER 118 Ca -0.24 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.19 3gnm h SER 118 Cb 1.22 0.00 0.11 0.00 0.14 0.00 0.00 62.40 63.87 3gnm h SER 118 CO 0.34 0.00 0.35 0.00 -1.14 0.00 0.00 176.83 176.37 3gnm s ALA 119 N -3.27 2.41 0.28 3.77 0.00 -1.26 -5.04 121.76 118.64 3gnm s ALA 119 Ca 0.06 0.34 0.07 0.00 0.00 0.00 0.00 51.96 52.44 3gnm s ALA 119 Cb 0.07 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 3gnm s ALA 119 CO 0.64 -1.48 0.26 0.95 0.00 0.00 0.00 175.76 176.13 3gnm s THR 120 N -2.71 4.33 0.25 0.00 -4.23 -1.26 -4.98 115.64 107.04 3gnm s THR 120 Ca 0.63 -1.30 -0.31 0.00 -1.18 0.00 0.00 61.69 59.53 3gnm s THR 120 Cb -0.18 -3.42 -0.11 0.00 1.34 0.00 0.00 72.50 70.13 3gnm s THR 120 CO 0.50 -0.29 1.61 -0.89 -0.54 0.00 0.00 174.62 175.01 3gnm s THR 121 N -2.15 2.18 -0.13 3.99 2.01 -1.26 -4.77 115.64 115.50 3gnm s THR 121 Ca 0.36 0.14 -0.01 0.00 0.31 0.00 0.00 61.69 62.49 3gnm s THR 121 Cb -0.08 -3.09 0.03 0.00 0.01 0.00 0.00 72.50 69.38 3gnm s THR 121 CO 0.26 0.02 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.27 3gnm s THR 122 N 0.45 0.97 0.60 -0.82 2.01 0.90 -4.96 115.64 114.80 3gnm s THR 122 Ca 0.67 -0.39 -0.19 0.00 0.31 0.00 0.00 61.69 62.09 3gnm s THR 122 Cb -0.47 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 70.92 3gnm s THR 122 CO 0.41 0.24 1.21 0.00 -0.69 0.00 0.00 174.62 175.79 3gnm s ALA 123 N 1.71 2.52 0.39 7.40 0.00 -1.26 -1.32 121.76 131.20 3gnm s ALA 123 Ca 0.03 1.02 -0.24 0.00 0.00 0.00 0.00 51.96 52.77 3gnm s ALA 123 Cb -0.14 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.43 3gnm s ALA 123 CO -0.08 -1.21 1.01 -1.25 0.00 0.00 0.00 175.76 174.23 3gnm s PRO 124 N -3.36 4.27 0.44 0.00 0.04 -1.26 -4.64 135.00 130.50 3gnm s PRO 124 Ca 0.78 1.40 -0.21 0.00 0.04 0.00 0.00 61.00 63.00 3gnm s PRO 124 Cb -0.31 -2.54 -0.10 0.00 0.04 0.00 0.00 34.50 31.60 3gnm s PRO 124 CO 0.34 -0.03 1.00 -1.12 0.04 0.00 0.00 177.00 177.23 3gnm s SER 125 N -1.69 6.68 -0.09 6.66 0.01 -0.18 -4.91 113.70 120.17 3gnm s SER 125 Ca 0.57 1.85 0.01 0.00 1.31 0.00 0.00 55.95 59.69 3gnm s SER 125 Cb -0.19 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.50 3gnm s SER 125 CO 0.24 -0.54 -0.08 -0.69 0.41 0.00 0.00 173.24 172.57 3gnm s VAL 126 N -1.98 0.96 0.06 3.43 1.01 -1.26 -1.24 120.40 121.37 3gnm s VAL 126 Ca 0.63 -0.30 0.09 0.00 0.00 0.00 0.00 61.98 62.40 3gnm s VAL 126 Cb -0.15 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 3gnm s VAL 126 CO 0.19 0.34 -0.25 -0.31 0.00 0.00 0.00 175.10 175.06 3gnm s TYR 127 N 1.30 2.36 0.39 5.22 2.02 0.13 -4.95 117.35 123.82 3gnm s TYR 127 Ca -0.03 -0.38 -0.24 0.00 -0.37 0.00 0.00 57.07 56.04 3gnm s TYR 127 Cb -0.14 -1.38 -0.09 0.00 -0.40 0.00 0.00 41.96 39.95 3gnm s TYR 127 CO -0.03 0.18 1.06 -1.25 -1.57 0.00 0.00 175.55 173.94 3gnm s PRO 128 N -1.40 4.17 -0.37 -1.71 0.04 -1.26 -0.34 135.00 134.13 3gnm s PRO 128 Ca 0.13 1.55 -0.07 0.00 0.04 0.00 0.00 61.00 62.64 3gnm s PRO 128 Cb -0.10 -2.57 0.05 0.00 0.04 0.00 0.00 34.50 31.92 3gnm s PRO 128 CO 0.03 -0.14 0.16 -0.51 0.04 0.00 0.00 177.00 176.58 3gnm s LEU 129 N -2.59 4.64 0.02 -3.56 1.43 0.14 -4.78 118.68 113.98 3gnm s LEU 129 Ca 0.57 -1.30 0.00 0.00 -1.03 0.00 0.00 54.13 52.38 3gnm s LEU 129 Cb -0.23 -1.91 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 3gnm s LEU 129 CO 0.29 -0.40 -0.04 0.68 0.23 0.00 0.00 176.35 177.11 3gnm s VAL 130 N 1.40 0.19 0.48 -1.59 -7.23 -1.26 -0.89 120.40 111.49 3gnm s VAL 130 Ca 0.01 -0.80 -0.24 0.00 -1.81 0.00 0.00 61.98 59.14 3gnm s VAL 130 Cb -0.21 -0.30 -0.08 0.00 0.56 0.00 0.00 36.38 36.36 3gnm s VAL 130 CO 0.02 -0.39 1.25 -0.81 -0.31 0.00 0.00 175.10 174.87 3gnm n PRO 131 N 1.82 1.73 -0.94 4.82 -0.04 -1.26 -4.94 135.00 136.19 3gnm n PRO 131 Ca -0.22 0.62 -0.34 0.00 -0.04 0.00 0.00 63.50 63.53 3gnm n PRO 131 Cb 0.56 -2.40 0.10 0.00 -0.04 0.00 0.00 33.50 31.72 3gnm n PRO 131 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3gnm n GLY 132 N 0.86 -2.09 0.37 0.55 0.00 -1.26 -4.65 105.19 98.97 3gnm n GLY 132 Ca 0.08 -0.65 0.01 0.00 0.00 0.00 0.00 46.02 45.46 3gnm n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnm n SER 134 N -4.44 1.57 -4.72 0.00 3.41 -1.26 -4.95 113.62 103.23 3gnm n SER 134 Ca 0.13 -1.59 -0.43 0.00 -0.26 0.00 0.00 58.87 56.73 3gnm n SER 134 Cb 0.10 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 63.97 3gnm n SER 134 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3gnm n ASP 135 N 0.24 3.81 -4.18 4.04 -0.08 -0.87 -4.95 116.55 114.55 3gnm n ASP 135 Ca 0.18 1.09 -0.39 0.00 -1.51 0.00 0.00 54.79 54.16 3gnm n ASP 135 Cb 0.34 -1.56 -0.10 0.00 2.34 0.00 0.00 41.12 42.15 3gnm n ASP 135 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 3gnm s THR 136 N 0.77 3.88 0.30 5.18 2.01 -1.26 -4.99 115.64 121.53 3gnm s THR 136 Ca 0.72 -1.92 -0.19 0.00 0.31 0.00 0.00 61.69 60.62 3gnm s THR 136 Cb -0.53 -3.59 -0.09 0.00 0.01 0.00 0.00 72.50 68.30 3gnm s THR 136 CO 0.38 -0.75 0.78 -0.55 -0.69 0.00 0.00 174.62 173.79 3gnm s SER 137 N 2.33 6.96 0.00 3.53 0.15 -1.26 -5.09 113.70 120.32 3gnm s SER 137 Ca 0.07 1.44 0.00 0.00 0.70 0.00 0.00 55.95 58.16 3gnm s SER 137 Cb -0.25 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 3gnm s SER 137 CO -0.02 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.91 3gnm n GLY 138 N 0.11 0.89 0.22 9.45 0.00 -1.26 -4.93 105.19 109.66 3gnm n GLY 138 Ca 0.02 -0.72 0.15 0.00 0.00 0.00 0.00 46.02 45.46 3gnm n GLY 138 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3gnm h SER 139 N 0.00 0.00 -3.02 1.61 0.87 -1.98 -3.43 113.55 107.61 3gnm h SER 139 Ca 0.00 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.06 3gnm h SER 139 Cb 0.00 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 61.81 3gnm h SER 139 CO 0.00 0.00 -0.75 -0.44 -0.53 0.00 0.00 176.83 175.11 3gnm s SER 140 N -5.05 2.82 -0.02 6.23 0.01 -1.26 -1.26 113.70 115.17 3gnm s SER 140 Ca 0.02 -1.00 0.02 0.00 1.31 0.00 0.00 55.95 56.30 3gnm s SER 140 Cb 0.09 -0.18 -0.00 0.00 0.21 0.00 0.00 66.02 66.14 3gnm s SER 140 CO 0.48 -0.11 -0.08 0.54 0.41 0.00 0.00 173.24 174.48 3gnm s VAL 141 N -2.76 0.65 -0.20 3.43 0.11 0.56 -4.65 120.40 117.55 3gnm s VAL 141 Ca 0.23 -0.32 -0.08 0.00 -2.93 0.00 0.00 61.98 58.89 3gnm s VAL 141 Cb -0.02 -0.57 -0.04 0.00 -1.53 0.00 0.00 36.38 34.21 3gnm s VAL 141 CO 0.09 0.20 0.08 -0.89 -3.33 0.00 0.00 175.10 171.25 3gnm s THR 142 N 0.04 4.84 0.28 5.04 2.01 -1.26 -1.64 115.64 124.95 3gnm s THR 142 Ca -0.00 -0.01 0.05 0.00 0.31 0.00 0.00 61.69 62.04 3gnm s THR 142 Cb -0.06 -3.21 -0.06 0.00 0.01 0.00 0.00 72.50 69.19 3gnm s THR 142 CO -0.00 0.42 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.57 3gnm s LEU 143 N 0.70 2.38 0.00 4.42 1.43 -0.31 -4.63 118.68 122.66 3gnm s LEU 143 Ca 0.04 -1.24 -0.18 0.00 -1.03 0.00 0.00 54.13 51.72 3gnm s LEU 143 Cb -0.13 -0.52 0.07 0.00 0.03 0.00 0.00 46.19 45.64 3gnm s LEU 143 CO 0.02 -0.43 0.91 0.61 0.23 0.00 0.00 176.35 177.68 3gnm n GLY 144 N -0.58 0.79 2.98 -3.19 0.00 -0.07 -0.01 105.19 105.10 3gnm n GLY 144 Ca -0.05 -1.20 -0.26 0.00 0.00 0.00 0.00 46.02 44.52 3gnm n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnm s LEU 146 N 1.09 4.13 -0.30 0.00 2.96 0.54 -1.60 118.68 125.50 3gnm s LEU 146 Ca -0.06 0.34 -0.08 0.00 -0.22 0.00 0.00 54.13 54.10 3gnm s LEU 146 Cb -0.14 -2.62 0.00 0.00 0.50 0.00 0.00 46.19 43.93 3gnm s LEU 146 CO -0.01 -0.33 0.11 -0.69 -1.32 0.00 0.00 176.35 174.10 3gnm s VAL 147 N 2.31 4.24 0.08 1.68 1.01 0.29 -0.69 120.40 129.33 3gnm s VAL 147 Ca 0.20 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.67 3gnm s VAL 147 Cb -0.16 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 3gnm s VAL 147 CO 0.11 0.07 -0.17 -0.75 0.00 0.00 0.00 175.10 174.36 3gnm s LYS 148 N 1.55 0.94 -0.12 2.72 2.20 -0.37 -1.09 119.74 125.57 3gnm s LYS 148 Ca 0.03 -1.03 -0.00 0.00 -0.36 0.00 0.00 55.97 54.61 3gnm s LYS 148 Cb -0.17 -1.05 0.00 0.00 -1.51 0.00 0.00 37.83 35.10 3gnm s LYS 148 CO 0.04 0.24 0.06 0.41 -0.36 0.00 0.00 175.35 175.73 3gnm n GLY 149 N 1.22 0.62 3.70 5.54 0.00 -0.39 -1.01 105.19 114.87 3gnm n GLY 149 Ca -0.20 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 44.89 3gnm n GLY 149 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3gnm s TYR 150 N -2.65 2.72 -0.28 1.61 1.13 -0.30 -4.53 117.35 115.06 3gnm s TYR 150 Ca 0.03 -0.30 -0.24 0.00 -1.41 0.00 0.00 57.07 55.15 3gnm s TYR 150 Cb -0.01 -1.42 0.11 0.00 -1.10 0.00 0.00 41.96 39.54 3gnm s TYR 150 CO 0.03 0.48 0.95 0.12 -2.51 0.00 0.00 175.55 174.63 3gnm s PHE 151 N -2.37 -0.57 0.30 -3.49 2.19 -0.43 -1.12 117.98 112.49 3gnm s PHE 151 Ca 0.34 1.36 -0.04 0.00 0.33 0.00 0.00 56.93 58.92 3gnm s PHE 151 Cb -0.04 0.35 0.07 0.00 -1.31 0.00 0.00 43.02 42.08 3gnm s PHE 151 CO 0.21 -0.27 0.41 -0.35 1.83 0.00 0.00 175.22 177.05 3gnm n PRO 152 N 2.46 -0.22 -1.22 10.12 -0.04 -1.26 -0.07 135.00 144.76 3gnm n PRO 152 Ca -0.13 -0.73 -0.33 0.00 -0.04 0.00 0.00 63.50 62.27 3gnm n PRO 152 Cb 0.56 -0.39 0.11 0.00 -0.04 0.00 0.00 33.50 33.74 3gnm n PRO 152 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3gnm s GLU 153 N -3.78 1.87 0.48 0.54 0.41 -1.26 -4.78 118.70 112.18 3gnm s GLU 153 Ca 0.24 1.60 0.08 0.00 -0.41 0.00 0.00 54.97 56.48 3gnm s GLU 153 Cb -0.01 -1.82 0.03 0.00 -1.78 0.00 0.00 34.13 30.56 3gnm s GLU 153 CO 0.17 -2.00 0.61 -1.25 -0.49 0.00 0.00 175.26 172.29 3gnm s PRO 154 N -4.26 2.58 0.02 0.39 0.04 -1.26 -4.85 135.00 127.67 3gnm s PRO 154 Ca 0.70 -1.46 0.08 0.00 0.04 0.00 0.00 61.00 60.36 3gnm s PRO 154 Cb -0.25 -2.63 -0.02 0.00 0.04 0.00 0.00 34.50 31.63 3gnm s PRO 154 CO 0.50 -0.48 -0.24 0.08 0.04 0.00 0.00 177.00 176.90 3gnm s VAL 155 N -2.50 1.90 0.18 -0.36 1.01 -1.26 -4.20 120.40 115.17 3gnm s VAL 155 Ca 0.55 -1.21 0.11 0.00 0.00 0.00 0.00 61.98 61.43 3gnm s VAL 155 Cb -0.07 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 3gnm s VAL 155 CO 0.34 0.37 -0.24 0.42 0.00 0.00 0.00 175.10 175.99 3gnm s THR 156 N -0.72 2.27 -0.06 3.92 -4.23 -0.65 -4.98 115.64 111.19 3gnm s THR 156 Ca 0.10 -1.98 0.02 0.00 -1.18 0.00 0.00 61.69 58.65 3gnm s THR 156 Cb -0.09 -2.07 0.01 0.00 1.34 0.00 0.00 72.50 71.69 3gnm s THR 156 CO 0.01 -0.11 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.17 3gnm s VAL 157 N -1.62 1.11 0.28 2.29 1.01 -1.26 -0.41 120.40 121.79 3gnm s VAL 157 Ca 0.19 -0.48 0.11 0.00 0.00 0.00 0.00 61.98 61.80 3gnm s VAL 157 Cb -0.08 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.25 3gnm s VAL 157 CO 0.09 0.34 -0.15 -0.54 0.00 0.00 0.00 175.10 174.85 3gnm s LYS 158 N 0.54 1.84 -0.07 2.72 -0.14 -0.07 -4.96 119.74 119.61 3gnm s LYS 158 Ca -0.12 -1.68 0.05 0.00 -1.36 0.00 0.00 55.97 52.86 3gnm s LYS 158 Cb -0.14 -1.87 -0.01 0.00 -1.68 0.00 0.00 37.83 34.12 3gnm s LYS 158 CO 0.03 0.33 -0.24 -1.58 -0.76 0.00 0.00 175.35 173.14 3gnm s TRP 159 N -2.46 2.49 -1.33 3.18 0.52 -1.26 -0.12 118.94 119.97 3gnm s TRP 159 Ca 0.30 -0.73 -0.18 0.00 0.02 0.00 0.00 56.10 55.51 3gnm s TRP 159 Cb -0.05 -1.63 0.02 0.00 -1.15 0.00 0.00 33.47 30.66 3gnm s TRP 159 CO 0.16 -0.22 0.47 0.09 0.02 0.00 0.00 176.95 177.47 3gnm n ASN 160 N 3.03 -2.32 -0.66 2.95 3.02 0.14 -1.39 115.26 120.03 3gnm n ASN 160 Ca -0.18 -1.21 -0.09 0.00 -0.03 0.00 0.00 54.58 53.08 3gnm n ASN 160 Cb 0.52 -2.13 -0.04 0.00 -0.61 0.00 0.00 39.78 37.53 3gnm n ASN 160 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3gnm n TYR 161 N -4.70 -0.00 0.00 3.10 4.01 -1.26 -0.98 117.16 117.33 3gnm n TYR 161 Ca -0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 3gnm n TYR 161 Cb 0.62 -2.60 0.00 0.00 -0.31 0.00 0.00 39.34 37.05 3gnm n TYR 161 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3gnm n GLY 162 N 0.43 0.83 0.12 2.72 0.00 -0.49 -4.99 105.19 103.81 3gnm n GLY 162 Ca -0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.95 3gnm n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnm h ALA 163 N 0.00 0.64 -2.28 4.61 0.00 -0.58 -3.39 119.26 118.26 3gnm h ALA 163 Ca 0.00 -0.59 -0.73 0.00 0.00 0.00 0.00 54.91 53.60 3gnm h ALA 163 Cb 0.00 0.01 -0.21 0.00 0.00 0.00 0.00 17.79 17.58 3gnm h ALA 163 CO 0.00 0.74 -0.26 -1.17 0.00 0.00 0.00 179.25 178.56 3gnm s LEU 164 N -6.30 5.43 0.00 0.00 0.20 -0.74 -4.82 118.68 112.45 3gnm s LEU 164 Ca 0.02 -1.19 0.00 0.00 0.69 0.00 0.00 54.13 53.65 3gnm s LEU 164 Cb 0.08 -2.24 0.00 0.00 -0.43 0.00 0.00 46.19 43.60 3gnm s LEU 164 CO 0.77 -0.67 0.00 -1.54 -0.29 0.00 0.00 176.35 174.61 3gnm n SER 165 N 5.40 3.37 -4.69 3.68 3.41 -1.26 -4.02 113.62 119.51 3gnm n SER 165 Ca -0.11 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.07 3gnm n SER 165 Cb 0.44 0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 64.75 3gnm n SER 165 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3gnm n SER 166 N -1.43 3.98 0.00 4.04 2.88 -1.26 -2.91 113.62 118.92 3gnm n SER 166 Ca 0.00 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.54 3gnm n SER 166 Cb 0.29 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 62.21 3gnm n SER 166 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3gnm n GLY 167 N 4.18 0.40 3.72 0.46 0.00 -1.26 -4.70 105.19 107.99 3gnm n GLY 167 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3gnm n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gnm s VAL 168 N -1.90 3.60 -0.14 1.61 1.01 -1.14 -2.93 120.40 120.50 3gnm s VAL 168 Ca 0.00 1.21 -0.01 0.00 0.00 0.00 0.00 61.98 63.17 3gnm s VAL 168 Cb 0.00 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.65 3gnm s VAL 168 CO 0.00 0.12 -0.03 -0.13 0.00 0.00 0.00 175.10 175.07 3gnm s ARG 169 N 0.67 1.10 -0.26 2.72 1.81 0.21 -4.99 118.95 120.22 3gnm s ARG 169 Ca 0.59 -0.32 -0.02 0.00 -1.72 0.00 0.00 55.73 54.26 3gnm s ARG 169 Cb -0.33 -1.74 0.03 0.00 -0.45 0.00 0.00 34.95 32.46 3gnm s ARG 169 CO 0.32 -0.42 -0.05 0.99 -0.68 0.00 0.00 175.30 175.46 3gnm s THR 170 N 1.76 2.89 0.71 0.02 2.01 -1.26 -1.13 115.64 120.64 3gnm s THR 170 Ca 0.02 -1.09 -0.08 0.00 0.31 0.00 0.00 61.69 60.85 3gnm s THR 170 Cb -0.15 -2.50 0.06 0.00 0.01 0.00 0.00 72.50 69.92 3gnm s THR 170 CO -0.07 0.14 1.03 0.68 -0.69 0.00 0.00 174.62 175.72 3gnm s VAL 171 N 1.31 2.47 0.50 3.82 -7.23 -0.19 -4.99 120.40 116.09 3gnm s VAL 171 Ca -0.01 -0.15 -0.21 0.00 -1.81 0.00 0.00 61.98 59.80 3gnm s VAL 171 Cb -0.17 -3.08 -0.07 0.00 0.56 0.00 0.00 36.38 33.62 3gnm s VAL 171 CO -0.04 -0.09 1.13 -0.94 -0.31 0.00 0.00 175.10 174.85 3gnm s SER 172 N -4.49 5.98 0.73 4.85 1.04 -1.26 -4.53 113.70 116.02 3gnm s SER 172 Ca 0.60 2.19 -0.13 0.00 0.48 0.00 0.00 55.95 59.08 3gnm s SER 172 Cb -0.11 -2.59 0.04 0.00 0.10 0.00 0.00 66.02 63.47 3gnm s SER 172 CO 0.46 -1.04 1.13 -0.94 0.98 0.00 0.00 173.24 173.83 3gnm s SER 173 N -1.64 4.50 0.12 7.02 1.04 -1.26 -4.79 113.70 118.68 3gnm s SER 173 Ca 0.68 2.05 0.08 0.00 0.48 0.00 0.00 55.95 59.24 3gnm s SER 173 Cb -0.25 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.28 3gnm s SER 173 CO 0.29 -2.04 -0.19 0.68 0.98 0.00 0.00 173.24 172.96 3gnm s VAL 174 N -2.45 1.65 -0.10 5.02 -7.23 0.58 -4.93 120.40 112.93 3gnm s VAL 174 Ca 0.67 -1.63 0.01 0.00 -1.81 0.00 0.00 61.98 59.23 3gnm s VAL 174 Cb -0.22 -1.58 -0.02 0.00 0.56 0.00 0.00 36.38 35.13 3gnm s VAL 174 CO 0.48 -0.17 -0.14 -0.22 -0.31 0.00 0.00 175.10 174.74 3gnm s LEU 175 N -2.12 2.68 -0.12 1.32 2.96 -1.26 -1.43 118.68 120.70 3gnm s LEU 175 Ca 0.08 -0.30 -0.05 0.00 -0.22 0.00 0.00 54.13 53.64 3gnm s LEU 175 Cb -0.09 -1.58 0.06 0.00 0.50 0.00 0.00 46.19 45.09 3gnm s LEU 175 CO 0.05 0.22 0.26 -1.58 -1.32 0.00 0.00 176.35 173.98 3gnm s GLN 176 N -0.01 0.17 -1.74 1.98 0.74 0.14 -4.90 119.66 116.05 3gnm s GLN 176 Ca -0.04 0.68 -0.16 0.00 0.05 0.00 0.00 55.36 55.89 3gnm s GLN 176 Cb -0.14 -0.06 0.15 0.00 1.10 0.00 0.00 33.01 34.06 3gnm s GLN 176 CO 0.04 -0.24 0.51 0.43 -0.55 0.00 0.00 175.29 175.48 3gnm n SER 177 N 4.94 -1.51 0.00 6.67 7.64 -1.26 -0.76 113.62 129.33 3gnm n SER 177 Ca -0.13 -1.18 0.00 0.00 1.01 0.00 0.00 58.87 58.57 3gnm n SER 177 Cb 0.51 -2.01 0.00 0.00 -1.01 0.00 0.00 64.21 61.70 3gnm n SER 177 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gnm n GLY 178 N -1.53 1.13 3.33 0.23 0.00 -1.26 -5.04 105.19 102.05 3gnm n GLY 178 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 3gnm n GLY 178 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gnm s PHE 179 N -2.54 2.10 0.14 1.61 0.08 0.06 -4.82 117.98 114.60 3gnm s PHE 179 Ca 0.00 -0.40 0.03 0.00 0.12 0.00 0.00 56.93 56.68 3gnm s PHE 179 Cb 0.00 -1.18 -0.04 0.00 -0.57 0.00 0.00 43.02 41.23 3gnm s PHE 179 CO 0.00 0.23 0.22 0.71 -0.10 0.00 0.00 175.22 176.27 3gnm s TYR 180 N -1.00 3.36 0.07 0.36 2.02 -0.28 0.23 117.35 122.12 3gnm s TYR 180 Ca 0.11 0.09 -0.09 0.00 -0.37 0.00 0.00 57.07 56.80 3gnm s TYR 180 Cb -0.10 -1.63 0.00 0.00 -0.40 0.00 0.00 41.96 39.84 3gnm s TYR 180 CO 0.04 0.53 0.20 -1.12 -1.57 0.00 0.00 175.55 173.63 3gnm s SER 181 N -3.05 0.08 0.18 2.29 0.01 -0.51 -1.15 113.70 111.55 3gnm s SER 181 Ca 0.33 -0.53 -0.21 0.00 1.31 0.00 0.00 55.95 56.85 3gnm s SER 181 Cb -0.11 0.33 0.05 0.00 0.21 0.00 0.00 66.02 66.50 3gnm s SER 181 CO 0.26 -0.67 0.59 -1.48 0.41 0.00 0.00 173.24 172.36 3gnm s LEU 182 N -2.57 -0.33 0.07 2.44 0.05 -0.25 -0.31 118.68 117.79 3gnm s LEU 182 Ca 0.01 -0.21 0.08 0.00 0.05 0.00 0.00 54.13 54.06 3gnm s LEU 182 Cb 0.03 2.48 -0.04 0.00 -2.05 0.00 0.00 46.19 46.61 3gnm s LEU 182 CO -0.08 -1.04 -0.16 -0.44 -0.55 0.00 0.00 176.35 174.07 3gnm s SER 183 N -2.80 3.95 -0.08 1.48 0.01 -1.26 -0.55 113.70 114.44 3gnm s SER 183 Ca 0.04 -0.45 0.03 0.00 1.31 0.00 0.00 55.95 56.87 3gnm s SER 183 Cb -0.02 -0.64 0.01 0.00 0.21 0.00 0.00 66.02 65.58 3gnm s SER 183 CO -0.08 0.22 -0.16 -0.55 0.41 0.00 0.00 173.24 173.08 3gnm s SER 184 N -1.79 2.24 0.09 2.44 0.15 -0.62 -1.02 113.70 115.17 3gnm s SER 184 Ca 0.17 -0.39 0.07 0.00 0.70 0.00 0.00 55.95 56.50 3gnm s SER 184 Cb -0.11 -1.02 -0.03 0.00 -1.71 0.00 0.00 66.02 63.15 3gnm s SER 184 CO 0.08 0.06 -0.18 -0.76 1.20 0.00 0.00 173.24 173.64 3gnm s LEU 185 N 0.67 2.28 0.07 3.45 1.02 -0.29 -1.01 118.68 124.87 3gnm s LEU 185 Ca -0.14 -0.65 0.04 0.00 0.02 0.00 0.00 54.13 53.41 3gnm s LEU 185 Cb -0.16 -0.73 -0.03 0.00 0.02 0.00 0.00 46.19 45.29 3gnm s LEU 185 CO 0.04 0.01 -0.12 0.54 0.02 0.00 0.00 176.35 176.84 3gnm s VAL 186 N -1.19 0.91 -0.17 -1.59 0.11 0.98 -0.62 120.40 118.84 3gnm s VAL 186 Ca 0.03 -1.27 0.00 0.00 -2.93 0.00 0.00 61.98 57.81 3gnm s VAL 186 Cb -0.10 -0.96 0.00 0.00 -1.53 0.00 0.00 36.38 33.80 3gnm s VAL 186 CO 0.03 -0.32 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.43 3gnm s THR 187 N -1.45 2.49 0.28 5.04 2.01 -1.15 -1.17 115.64 121.70 3gnm s THR 187 Ca -0.04 -0.82 0.09 0.00 0.31 0.00 0.00 61.69 61.24 3gnm s THR 187 Cb -0.09 -2.05 -0.06 0.00 0.01 0.00 0.00 72.50 70.31 3gnm s THR 187 CO 0.01 0.52 -0.12 0.68 -0.69 0.00 0.00 174.62 175.02 3gnm s VAL 188 N 1.01 2.02 0.32 3.82 -7.23 -0.65 -4.76 120.40 114.93 3gnm s VAL 188 Ca -0.02 -2.23 -0.29 0.00 -1.81 0.00 0.00 61.98 57.63 3gnm s VAL 188 Cb -0.15 -2.38 -0.11 0.00 0.56 0.00 0.00 36.38 34.31 3gnm s VAL 188 CO -0.04 -0.36 1.54 -2.84 -0.31 0.00 0.00 175.10 173.09 3gnm s PRO 189 N -3.63 4.13 0.42 4.82 0.02 -1.26 -0.32 135.00 139.18 3gnm s PRO 189 Ca 0.29 2.56 0.14 0.00 0.02 0.00 0.00 61.00 64.00 3gnm s PRO 189 Cb 0.00 -3.01 1.00 0.00 0.02 0.00 0.00 34.50 32.52 3gnm s PRO 189 CO 0.13 -0.57 1.94 0.77 -0.33 0.00 0.00 177.00 178.93 3gnm h SER 190 N 4.10 0.43 0.27 2.53 0.02 -1.44 0.24 113.55 119.69 3gnm h SER 190 Ca -0.49 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 3gnm h SER 190 Cb 1.23 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.70 3gnm h SER 190 CO 0.73 0.24 0.00 0.77 -1.14 0.00 0.00 176.83 177.43 3gnm h SER 191 N 0.46 0.00 0.35 3.07 4.64 -1.90 -3.18 113.55 116.99 3gnm h SER 191 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 3gnm h SER 191 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 3gnm h SER 191 CO -0.11 0.00 -1.19 0.35 -0.87 0.00 0.00 176.83 175.01 3gnm n THR 192 N -2.38 0.15 -3.86 2.95 -2.24 0.07 -4.70 114.28 104.28 3gnm n THR 192 Ca -0.00 -0.28 -0.15 0.00 -2.27 0.00 0.00 64.05 61.34 3gnm n THR 192 Cb 0.11 0.22 -0.16 0.00 -2.10 0.00 0.00 70.33 68.41 3gnm n THR 192 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3gnm s TRP 193 N -3.24 0.14 -0.99 4.78 -0.00 -1.20 0.01 118.94 118.44 3gnm s TRP 193 Ca 0.02 0.06 0.24 0.00 -0.00 0.00 0.00 56.10 56.42 3gnm s TRP 193 Cb 0.14 -0.27 1.04 0.00 -0.00 0.00 0.00 33.47 34.38 3gnm s TRP 193 CO 0.83 -0.09 1.78 -0.35 -0.00 0.00 0.00 176.95 179.12 3gnm n PRO 194 N 3.96 0.01 -0.07 5.86 -0.04 -1.26 -4.89 135.00 138.56 3gnm n PRO 194 Ca -0.25 0.09 0.25 0.00 -0.04 0.00 0.00 63.50 63.55 3gnm n PRO 194 Cb 0.52 -1.51 0.72 0.00 -0.04 0.00 0.00 33.50 33.19 3gnm n PRO 194 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3gnm h SER 195 N 0.00 0.00 -3.25 3.54 4.64 -1.84 -3.41 113.55 113.23 3gnm h SER 195 Ca 0.00 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.67 3gnm h SER 195 Cb 0.43 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.34 3gnm h SER 195 CO 0.00 0.00 -0.79 -1.10 -0.87 0.00 0.00 176.83 174.07 3gnm s GLN 196 N -4.85 1.72 0.11 4.77 -0.21 0.10 -5.10 119.66 116.20 3gnm s GLN 196 Ca -0.05 -1.38 -0.30 0.00 0.02 0.00 0.00 55.36 53.65 3gnm s GLN 196 Cb 0.19 -1.99 -0.06 0.00 1.00 0.00 0.00 33.01 32.15 3gnm s GLN 196 CO 0.69 0.43 1.12 0.99 -2.12 0.00 0.00 175.29 176.39 3gnm s THR 197 N -1.57 4.08 -0.12 -0.19 2.01 -1.26 -4.61 115.64 113.98 3gnm s THR 197 Ca 0.21 1.62 -0.00 0.00 0.31 0.00 0.00 61.69 63.83 3gnm s THR 197 Cb -0.09 -4.04 0.02 0.00 0.01 0.00 0.00 72.50 68.41 3gnm s THR 197 CO 0.11 0.20 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.46 3gnm s VAL 198 N 0.45 1.13 -0.07 3.82 1.01 -1.26 -5.00 120.40 120.47 3gnm s VAL 198 Ca 0.53 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 62.20 3gnm s VAL 198 Cb -0.28 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 34.98 3gnm s VAL 198 CO 0.32 0.38 -0.19 -0.63 0.00 0.00 0.00 175.10 174.98 3gnm s ILE 199 N 1.62 1.66 -0.14 2.22 1.01 -1.26 -0.58 121.20 125.73 3gnm s ILE 199 Ca 0.04 -0.81 -0.09 0.00 0.00 0.00 0.00 60.65 59.79 3gnm s ILE 199 Cb -0.13 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.86 3gnm s ILE 199 CO -0.08 0.47 0.18 0.00 0.00 0.00 0.00 174.94 175.50 3gnm s ASN 201 N -0.51 5.09 -0.30 0.00 -0.87 0.84 -1.21 114.94 117.98 3gnm s ASN 201 Ca 0.14 -1.32 -0.06 0.00 -1.57 0.00 0.00 52.86 50.04 3gnm s ASN 201 Cb -0.12 -1.78 0.01 0.00 -0.02 0.00 0.00 41.25 39.34 3gnm s ASN 201 CO 0.03 -0.32 0.08 -0.69 -2.57 0.00 0.00 177.10 173.63 3gnm s VAL 202 N 1.29 3.88 -0.15 1.60 1.01 0.32 -0.90 120.40 127.46 3gnm s VAL 202 Ca -0.02 -0.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.13 3gnm s VAL 202 Cb -0.20 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 3gnm s VAL 202 CO -0.00 0.05 0.02 0.00 0.00 0.00 0.00 175.10 175.17 3gnm s ALA 203 N 1.48 3.29 -0.41 5.51 0.00 0.45 -0.33 121.76 131.75 3gnm s ALA 203 Ca 0.02 -0.77 0.02 0.00 0.00 0.00 0.00 51.96 51.23 3gnm s ALA 203 Cb -0.17 -1.73 0.12 0.00 0.00 0.00 0.00 23.12 21.34 3gnm s ALA 203 CO 0.02 0.29 0.19 -1.58 0.00 0.00 0.00 175.76 174.68 3gnm s HIS 204 N 0.05 2.24 0.38 0.00 2.46 -0.31 -1.64 115.29 118.48 3gnm s HIS 204 Ca 0.03 -2.41 0.09 0.00 0.47 0.00 0.00 55.06 53.24 3gnm s HIS 204 Cb -0.13 -2.07 0.76 0.00 -0.13 0.00 0.00 32.58 31.02 3gnm s HIS 204 CO 0.01 -0.82 1.90 -1.00 -2.47 0.00 0.00 174.74 172.37 3gnm h PRO 205 N 7.12 0.24 -0.15 2.88 0.13 -1.81 -2.28 132.00 138.12 3gnm h PRO 205 Ca -0.05 -0.06 0.02 0.00 -0.87 0.00 0.00 66.00 65.05 3gnm h PRO 205 Cb 0.95 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 3gnm h PRO 205 CO 0.51 0.39 0.10 0.00 -0.23 0.00 0.00 178.00 178.77 3gnm h ALA 206 N 1.63 2.02 -0.45 -0.56 0.00 -1.86 -1.08 119.26 118.96 3gnm h ALA 206 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3gnm h ALA 206 Cb 0.40 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3gnm h ALA 206 CO 0.02 -0.05 0.00 -1.13 0.00 0.00 0.00 179.25 178.09 3gnm n SER 207 N -4.51 3.43 -3.60 0.00 3.41 -0.90 -4.98 113.62 106.47 3gnm n SER 207 Ca 0.00 -1.96 -0.23 0.00 -0.26 0.00 0.00 58.87 56.42 3gnm n SER 207 Cb 0.16 -0.30 0.07 0.00 -0.26 0.00 0.00 64.21 63.89 3gnm n SER 207 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3gnm n LYS 208 N 1.34 -7.40 -4.86 4.33 4.76 -0.41 -4.99 118.16 110.94 3gnm n LYS 208 Ca 0.19 0.80 -0.27 0.00 -2.87 0.00 0.00 58.31 56.16 3gnm n LYS 208 Cb 0.56 -5.82 -0.15 0.00 -1.84 0.00 0.00 35.03 27.78 3gnm n LYS 208 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3gnm s THR 209 N -3.34 1.70 -0.13 -0.18 -4.23 -1.10 -5.03 115.64 103.34 3gnm s THR 209 Ca 0.47 -1.06 0.03 0.00 -1.18 0.00 0.00 61.69 59.94 3gnm s THR 209 Cb -0.21 -1.44 0.01 0.00 1.34 0.00 0.00 72.50 72.19 3gnm s THR 209 CO 0.74 0.35 -0.21 -0.70 -0.54 0.00 0.00 174.62 174.26 3gnm s GLU 210 N -0.84 2.88 -0.29 3.99 2.12 -1.26 -1.16 118.70 124.15 3gnm s GLU 210 Ca 0.08 -0.81 -0.10 0.00 0.36 0.00 0.00 54.97 54.50 3gnm s GLU 210 Cb -0.09 -2.31 -0.03 0.00 0.26 0.00 0.00 34.13 31.96 3gnm s GLU 210 CO 0.00 0.02 0.16 -1.17 -0.54 0.00 0.00 175.26 173.74 3gnm s LEU 211 N 0.75 4.00 -0.29 2.70 1.98 0.56 -4.92 118.68 123.46 3gnm s LEU 211 Ca -0.09 -0.24 -0.08 0.00 -2.89 0.00 0.00 54.13 50.83 3gnm s LEU 211 Cb -0.16 -2.05 -0.01 0.00 0.66 0.00 0.00 46.19 44.63 3gnm s LEU 211 CO 0.00 -0.11 0.11 -0.63 -1.89 0.00 0.00 176.35 173.84 3gnm s ILE 212 N 1.69 4.39 -0.10 6.68 1.01 -1.26 -0.52 121.20 133.09 3gnm s ILE 212 Ca 0.06 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.33 3gnm s ILE 212 Cb -0.16 -3.18 0.02 0.00 0.01 0.00 0.00 42.46 39.14 3gnm s ILE 212 CO 0.08 0.16 -0.11 -0.75 0.00 0.00 0.00 174.94 174.32 3gnm s LYS 213 N 1.59 1.77 -0.13 2.79 2.20 -0.35 -5.01 119.74 122.61 3gnm s LYS 213 Ca 0.05 -0.39 -0.27 0.00 -0.36 0.00 0.00 55.97 55.00 3gnm s LYS 213 Cb -0.16 -1.61 -0.02 0.00 -1.51 0.00 0.00 37.83 34.53 3gnm s LYS 213 CO 0.05 -0.11 0.90 0.50 -0.36 0.00 0.00 175.35 176.32 3gnm s ARG 214 N 1.15 4.37 -0.22 4.03 3.52 -1.26 -1.58 118.95 128.96 3gnm s ARG 214 Ca -0.05 1.17 -0.18 0.00 -0.13 0.00 0.00 55.73 56.54 3gnm s ARG 214 Cb -0.14 -3.55 -0.03 0.00 -1.56 0.00 0.00 34.95 29.67 3gnm s ARG 214 CO -0.03 -0.28 0.49 0.42 -0.81 0.00 0.00 175.30 175.10 3gnm s ILE 215 N 1.95 5.11 0.09 4.11 -1.09 0.25 -5.00 121.20 126.62 3gnm s ILE 215 Ca 0.43 0.88 0.04 0.00 -2.23 0.00 0.00 60.65 59.77 3gnm s ILE 215 Cb -0.17 -3.81 -0.03 0.00 -1.58 0.00 0.00 42.46 36.86 3gnm s ILE 215 CO 0.15 0.16 -0.11 -1.61 -1.23 0.00 0.00 174.94 172.31 3gnm s GLU 216 N 1.77 0.84 0.68 2.79 0.41 -1.26 -4.51 118.70 119.42 3gnm s GLU 216 Ca 0.22 -1.11 -0.17 0.00 -0.41 0.00 0.00 54.97 53.51 3gnm s GLU 216 Cb -0.15 -0.60 0.01 0.00 -1.78 0.00 0.00 34.13 31.60 3gnm s GLU 216 CO 0.09 0.11 1.23 -1.25 -0.49 0.00 0.00 175.26 174.95 3gnm s PRO 217 N -2.52 2.42 0.00 0.39 0.04 -1.26 -4.92 135.00 129.14 3gnm s PRO 217 Ca 0.04 1.87 0.17 0.00 0.04 0.00 0.00 61.00 63.11 3gnm s PRO 217 Cb -0.05 -1.85 0.99 0.00 0.04 0.00 0.00 34.50 33.62 3gnm s PRO 217 CO 0.01 -1.65 1.39 2.89 0.04 0.00 0.00 177.00 179.68