#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3l5x s THR 3 N 0.00 0.59 0.01 2.52 -4.23 -0.26 -4.98 115.64 109.29 3l5x s THR 3 Ca 0.00 -1.38 0.02 0.00 -1.18 0.00 0.00 61.69 59.15 3l5x s THR 3 Cb 0.00 -0.99 -0.01 0.00 1.34 0.00 0.00 72.50 72.84 3l5x s THR 3 CO 0.00 -0.56 -0.07 -0.76 -0.54 0.00 0.00 174.62 172.69 3l5x s LEU 4 N -2.10 2.07 -0.04 4.79 1.02 -1.26 -1.12 118.68 122.03 3l5x s LEU 4 Ca -0.02 -0.21 -0.01 0.00 0.02 0.00 0.00 54.13 53.91 3l5x s LEU 4 Cb -0.04 -0.29 0.03 0.00 0.02 0.00 0.00 46.19 45.90 3l5x s LEU 4 CO -0.02 0.02 0.02 -0.75 0.02 0.00 0.00 176.35 175.64 3l5x s LYS 5 N -0.47 0.23 0.34 1.70 2.20 0.42 -4.13 119.74 120.04 3l5x s LYS 5 Ca -0.00 0.19 -0.25 0.00 -0.36 0.00 0.00 55.97 55.55 3l5x s LYS 5 Cb -0.04 -0.60 -0.10 0.00 -1.51 0.00 0.00 37.83 35.58 3l5x s LYS 5 CO -0.00 -0.24 0.95 -1.21 -0.36 0.00 0.00 175.35 174.48 3l5x s GLU 6 N 1.64 4.51 1.02 4.03 8.01 -1.26 -0.49 118.70 136.16 3l5x s GLU 6 Ca -0.01 1.29 -0.11 0.00 0.01 0.00 0.00 54.97 56.14 3l5x s GLU 6 Cb -0.13 -2.68 0.20 0.00 -4.31 0.00 0.00 34.13 27.22 3l5x s GLU 6 CO -0.03 0.22 1.10 -1.54 0.01 0.00 0.00 175.26 175.01 3l5x s SER 7 N -1.73 2.14 1.05 -0.19 1.04 0.15 -4.91 113.70 111.25 3l5x s SER 7 Ca 0.53 1.90 -0.12 0.00 0.48 0.00 0.00 55.95 58.73 3l5x s SER 7 Cb -0.17 -2.46 0.19 0.00 0.10 0.00 0.00 66.02 63.69 3l5x s SER 7 CO 0.22 -3.54 0.92 0.61 0.98 0.00 0.00 173.24 172.43 3l5x n GLY 8 N 0.40 -1.40 3.76 7.32 0.00 -1.26 -4.80 105.19 109.21 3l5x n GLY 8 Ca 0.08 -0.92 -0.38 0.00 0.00 0.00 0.00 46.02 44.81 3l5x n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3l5x s PRO 9 N -4.34 3.35 0.06 1.61 0.04 -1.26 -4.88 135.00 129.58 3l5x s PRO 9 Ca 0.66 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.77 3l5x s PRO 9 Cb -0.23 -2.29 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 3l5x s PRO 9 CO 0.63 -0.96 -0.09 0.14 0.04 0.00 0.00 177.00 176.75 3l5x s VAL 10 N -1.41 0.72 -0.15 -0.36 -7.23 -0.92 -5.00 120.40 106.05 3l5x s VAL 10 Ca 0.69 -1.30 -0.05 0.00 -1.81 0.00 0.00 61.98 59.51 3l5x s VAL 10 Cb -0.36 -0.92 -0.03 0.00 0.56 0.00 0.00 36.38 35.63 3l5x s VAL 10 CO 0.42 -0.44 0.01 -0.22 -0.31 0.00 0.00 175.10 174.57 3l5x s LEU 11 N -1.90 3.55 -0.04 1.32 2.96 -1.26 -1.41 118.68 121.90 3l5x s LEU 11 Ca -0.04 0.01 0.05 0.00 -0.22 0.00 0.00 54.13 53.94 3l5x s LEU 11 Cb -0.07 -1.87 -0.01 0.00 0.50 0.00 0.00 46.19 44.74 3l5x s LEU 11 CO 0.00 0.21 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.34 3l5x s VAL 12 N 0.13 1.72 0.35 1.68 1.01 -0.30 -4.97 120.40 120.02 3l5x s VAL 12 Ca 0.02 -0.89 -0.24 0.00 0.00 0.00 0.00 61.98 60.87 3l5x s VAL 12 Cb -0.13 -1.45 -0.10 0.00 0.00 0.00 0.00 36.38 34.70 3l5x s VAL 12 CO 0.02 0.48 0.94 -0.54 0.00 0.00 0.00 175.10 176.00 3l5x s LYS 13 N -0.16 4.46 0.26 2.72 1.02 -1.26 -2.31 119.74 124.48 3l5x s LYS 13 Ca -0.01 1.25 -0.29 0.00 0.02 0.00 0.00 55.97 56.93 3l5x s LYS 13 Cb -0.12 -2.61 -0.14 0.00 -0.52 0.00 0.00 37.83 34.44 3l5x s LYS 13 CO 0.02 0.19 1.10 -2.30 -0.92 0.00 0.00 175.35 173.44 3l5x n PRO 14 N 0.19 1.43 0.00 -1.68 -0.02 -1.26 -1.12 135.00 132.54 3l5x n PRO 14 Ca 0.03 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3l5x n PRO 14 Cb 0.51 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 3l5x n PRO 14 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3l5x n THR 15 N 0.68 0.00 -1.50 3.45 -2.24 0.86 -4.92 114.28 110.60 3l5x n THR 15 Ca 0.11 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.59 3l5x n THR 15 Cb 0.31 0.00 0.17 0.00 -2.10 0.00 0.00 70.33 68.71 3l5x n THR 15 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3l5x s GLU 16 N -0.27 0.43 -0.15 -0.78 2.02 -0.28 -3.43 118.70 116.25 3l5x s GLU 16 Ca 0.00 0.05 -0.06 0.00 0.02 0.00 0.00 54.97 54.98 3l5x s GLU 16 Cb 0.00 -1.78 -0.04 0.00 0.10 0.00 0.00 34.13 32.41 3l5x s GLU 16 CO 0.00 -2.63 0.07 0.99 0.02 0.00 0.00 175.26 173.70 3l5x s THR 17 N -3.34 4.85 -0.15 3.63 2.01 -1.26 -1.00 115.64 120.37 3l5x s THR 17 Ca 0.68 -0.02 -0.13 0.00 0.31 0.00 0.00 61.69 62.52 3l5x s THR 17 Cb -0.11 -3.14 -0.05 0.00 0.01 0.00 0.00 72.50 69.21 3l5x s THR 17 CO 0.54 0.53 0.29 -0.22 -0.69 0.00 0.00 174.62 175.07 3l5x s LEU 18 N -0.23 4.26 -0.15 4.42 2.96 0.73 -4.97 118.68 125.70 3l5x s LEU 18 Ca 0.08 0.52 0.01 0.00 -0.22 0.00 0.00 54.13 54.52 3l5x s LEU 18 Cb -0.12 -2.36 0.02 0.00 0.50 0.00 0.00 46.19 44.23 3l5x s LEU 18 CO 0.01 0.12 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.11 3l5x s THR 19 N 0.34 1.72 -0.02 3.68 2.01 -1.26 -0.77 115.64 121.34 3l5x s THR 19 Ca 0.16 -0.74 0.07 0.00 0.31 0.00 0.00 61.69 61.50 3l5x s THR 19 Cb -0.13 -1.58 -0.02 0.00 0.01 0.00 0.00 72.50 70.78 3l5x s THR 19 CO 0.04 0.48 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.45 3l5x s LEU 20 N 1.29 2.05 -0.08 4.42 1.43 0.26 -5.00 118.68 123.05 3l5x s LEU 20 Ca 0.02 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 3l5x s LEU 20 Cb -0.13 -1.27 -0.02 0.00 0.03 0.00 0.00 46.19 44.80 3l5x s LEU 20 CO -0.09 0.29 -0.13 -0.89 0.23 0.00 0.00 176.35 175.77 3l5x s THR 21 N -0.52 3.16 -0.20 5.49 2.01 -1.26 -0.30 115.64 124.02 3l5x s THR 21 Ca 0.08 -0.66 -0.03 0.00 0.31 0.00 0.00 61.69 61.39 3l5x s THR 21 Cb -0.10 -2.28 -0.00 0.00 0.01 0.00 0.00 72.50 70.13 3l5x s THR 21 CO -0.00 0.57 -0.08 0.00 -0.69 0.00 0.00 174.62 174.41 3l5x s THR 23 N 1.33 4.57 0.09 0.00 2.01 0.35 -1.09 115.64 122.90 3l5x s THR 23 Ca 0.04 -0.11 0.08 0.00 0.31 0.00 0.00 61.69 62.01 3l5x s THR 23 Cb -0.14 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.28 3l5x s THR 23 CO -0.04 0.46 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.51 3l5x s VAL 24 N 0.40 3.02 0.04 3.82 1.01 -0.47 -0.43 120.40 127.79 3l5x s VAL 24 Ca 0.01 -1.32 -0.03 0.00 0.00 0.00 0.00 61.98 60.65 3l5x s VAL 24 Cb -0.13 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 3l5x s VAL 24 CO 0.01 0.18 0.02 -0.55 0.00 0.00 0.00 175.10 174.76 3l5x s SER 25 N -1.94 0.30 0.00 3.32 0.15 -0.27 -4.86 113.70 110.39 3l5x s SER 25 Ca 0.18 -0.69 0.00 0.00 0.70 0.00 0.00 55.95 56.14 3l5x s SER 25 Cb -0.11 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 3l5x s SER 25 CO 0.10 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.65 3l5x n GLY 26 N 0.71 0.83 3.40 9.45 0.00 -1.26 -1.11 105.19 117.22 3l5x n GLY 26 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 3l5x n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3l5x s PHE 27 N -3.29 -0.37 -0.12 1.61 -0.71 -1.26 -4.59 117.98 109.24 3l5x s PHE 27 Ca 0.00 0.11 -0.05 0.00 -1.04 0.00 0.00 56.93 55.95 3l5x s PHE 27 Cb 0.00 0.44 -0.04 0.00 -1.21 0.00 0.00 43.02 42.21 3l5x s PHE 27 CO 0.00 -0.81 0.06 0.45 -1.34 0.00 0.00 175.22 173.58 3l5x s SER 28 N -2.78 5.69 0.00 1.98 0.15 -1.26 -5.00 113.70 112.47 3l5x s SER 28 Ca 0.03 0.23 0.13 0.00 0.70 0.00 0.00 55.95 57.04 3l5x s SER 28 Cb -0.00 -1.78 0.80 0.00 -1.71 0.00 0.00 66.02 63.33 3l5x s SER 28 CO -0.11 0.34 1.41 0.18 1.20 0.00 0.00 173.24 176.26 3l5x n LEU 29 N 2.42 0.00 -0.41 3.45 4.77 -1.26 -2.32 117.00 123.65 3l5x n LEU 29 Ca -0.19 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.84 3l5x n LEU 29 Cb 0.54 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.71 3l5x n LEU 29 CO 0.31 0.00 0.50 -1.20 -1.33 0.00 0.00 177.39 175.67 3l5x n SER 30 N -0.74 2.25 -4.74 -1.43 7.64 -1.26 -4.31 113.62 111.03 3l5x n SER 30 Ca 0.10 -1.71 -0.40 0.00 1.01 0.00 0.00 58.87 57.87 3l5x n SER 30 Cb 0.05 -0.10 -0.05 0.00 -1.01 0.00 0.00 64.21 63.10 3l5x n SER 30 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3l5x s THR 31 N -0.86 4.68 0.10 0.44 2.01 -0.98 -4.94 115.64 116.08 3l5x s THR 31 Ca 0.14 1.74 -0.35 0.00 0.31 0.00 0.00 61.69 63.53 3l5x s THR 31 Cb 0.08 -4.17 -0.18 0.00 0.01 0.00 0.00 72.50 68.25 3l5x s THR 31 CO 0.11 0.35 1.04 0.00 -0.69 0.00 0.00 174.62 175.43 3l5x n TYR 32 N 2.83 0.75 -0.22 4.92 4.19 -1.26 -2.00 117.16 126.36 3l5x n TYR 32 Ca -0.01 0.88 0.00 0.00 3.31 0.00 0.00 57.90 62.08 3l5x n TYR 32 Cb 0.50 -2.15 0.00 0.00 0.49 0.00 0.00 39.34 38.17 3l5x n TYR 32 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3l5x n GLY 33 N 1.87 1.88 3.75 2.98 0.00 -1.26 -5.02 105.19 109.39 3l5x n GLY 33 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 3l5x n GLY 33 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3l5x s MET 34 N -0.23 4.66 0.02 1.61 -1.94 -0.85 -4.24 119.30 118.33 3l5x s MET 34 Ca 0.00 1.30 -0.17 0.00 -1.71 0.00 0.00 55.69 55.11 3l5x s MET 34 Cb 0.00 -3.32 0.03 0.00 2.01 0.00 0.00 34.83 33.55 3l5x s MET 34 CO 0.00 0.40 0.37 0.20 -0.01 0.00 0.00 175.02 175.98 3l5x s GLY 35 N -0.60 -0.22 -0.02 -0.03 0.00 -1.26 -0.60 107.32 104.59 3l5x s GLY 35 Ca 0.41 0.31 0.01 0.00 0.00 0.00 0.00 44.72 45.45 3l5x s GLY 35 CO 0.28 0.07 -0.05 0.14 0.00 0.00 0.00 173.10 173.54 3l5x s VAL 36 N -2.06 0.44 0.33 1.40 1.01 -0.54 -1.89 120.40 119.10 3l5x s VAL 36 Ca -0.08 -0.16 0.08 0.00 0.00 0.00 0.00 61.98 61.83 3l5x s VAL 36 Cb -0.02 -0.43 -0.06 0.00 0.00 0.00 0.00 36.38 35.87 3l5x s VAL 36 CO 0.00 0.16 -0.07 -0.83 0.00 0.00 0.00 175.10 174.36 3l5x s GLY 37 N 0.38 2.14 -0.08 4.51 0.00 0.49 -1.29 107.32 113.46 3l5x s GLY 37 Ca -0.04 -2.07 0.04 0.00 0.00 0.00 0.00 44.72 42.65 3l5x s GLY 37 CO -0.00 -1.99 -0.19 -0.98 0.00 0.00 0.00 173.10 169.93 3l5x s TRP 38 N -2.73 2.61 -0.03 1.90 0.52 0.27 -1.06 118.94 120.42 3l5x s TRP 38 Ca 0.32 -0.61 0.01 0.00 0.02 0.00 0.00 56.10 55.84 3l5x s TRP 38 Cb 0.04 -1.68 0.02 0.00 -1.15 0.00 0.00 33.47 30.70 3l5x s TRP 38 CO 0.16 -0.15 -0.02 0.42 0.02 0.00 0.00 176.95 177.38 3l5x s ILE 39 N -0.10 0.27 0.31 2.03 1.09 -0.29 -1.21 121.20 123.29 3l5x s ILE 39 Ca -0.04 -0.00 0.10 0.00 -1.10 0.00 0.00 60.65 59.61 3l5x s ILE 39 Cb -0.14 -0.32 -0.05 0.00 -1.06 0.00 0.00 42.46 40.88 3l5x s ILE 39 CO 0.04 0.15 -0.04 0.00 -0.10 0.00 0.00 174.94 174.99 3l5x s ARG 40 N 0.79 2.04 -0.27 2.79 1.70 -0.33 -0.23 118.95 125.43 3l5x s ARG 40 Ca -0.08 -1.69 -0.00 0.00 -0.47 0.00 0.00 55.73 53.48 3l5x s ARG 40 Cb -0.12 -1.94 0.14 0.00 -0.57 0.00 0.00 34.95 32.46 3l5x s ARG 40 CO -0.01 0.22 0.34 -1.14 -1.08 0.00 0.00 175.30 173.63 3l5x s GLN 41 N -3.66 0.34 0.78 3.89 0.74 -0.30 -0.33 119.66 121.12 3l5x s GLN 41 Ca 0.33 0.09 -0.14 0.00 0.05 0.00 0.00 55.36 55.68 3l5x s GLN 41 Cb -0.02 -0.56 0.06 0.00 1.10 0.00 0.00 33.01 33.58 3l5x s GLN 41 CO 0.18 -0.93 1.16 -2.30 -0.55 0.00 0.00 175.29 172.85 3l5x n PRO 42 N 5.33 0.36 -1.69 1.67 -0.02 -1.26 -1.91 135.00 137.49 3l5x n PRO 42 Ca -0.02 0.19 -0.45 0.00 -2.02 0.00 0.00 63.50 61.21 3l5x n PRO 42 Cb 0.48 -2.41 -0.04 0.00 -0.02 0.00 0.00 33.50 31.52 3l5x n PRO 42 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3l5x n PRO 43 N -2.82 2.40 -1.09 0.52 -0.02 -1.26 -0.90 135.00 131.81 3l5x n PRO 43 Ca 0.14 0.87 -0.03 0.00 -2.02 0.00 0.00 63.50 62.45 3l5x n PRO 43 Cb 0.50 -2.68 -0.01 0.00 -0.02 0.00 0.00 33.50 31.29 3l5x n PRO 43 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3l5x n GLY 44 N 3.76 0.51 3.09 -1.23 0.00 -1.26 -5.00 105.19 105.05 3l5x n GLY 44 Ca 0.17 -0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 3l5x n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3l5x n LYS 45 N -1.21 0.90 -2.20 1.61 5.02 -0.08 -5.15 118.16 117.05 3l5x n LYS 45 Ca -0.03 -3.15 -0.27 0.00 -2.02 0.00 0.00 58.31 52.83 3l5x n LYS 45 Cb 0.32 0.97 0.05 0.00 -0.02 0.00 0.00 35.03 36.35 3l5x n LYS 45 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3l5x s ALA 46 N -2.78 3.13 0.38 7.82 0.00 -1.26 -4.63 121.76 124.41 3l5x s ALA 46 Ca 0.03 -0.70 -0.26 0.00 0.00 0.00 0.00 51.96 51.03 3l5x s ALA 46 Cb 0.00 -2.71 -0.09 0.00 0.00 0.00 0.00 23.12 20.32 3l5x s ALA 46 CO 0.02 -1.09 1.13 -0.51 0.00 0.00 0.00 175.76 175.31 3l5x s LEU 47 N -5.19 4.25 -0.06 0.00 1.43 -1.26 -4.24 118.68 113.61 3l5x s LEU 47 Ca 0.57 2.26 -0.01 0.00 -1.03 0.00 0.00 54.13 55.93 3l5x s LEU 47 Cb -0.11 -3.98 0.03 0.00 0.03 0.00 0.00 46.19 42.16 3l5x s LEU 47 CO 0.47 -0.53 -0.01 -0.70 0.23 0.00 0.00 176.35 175.81 3l5x s GLU 48 N -2.17 0.63 0.18 1.70 2.12 0.55 -4.97 118.70 116.74 3l5x s GLU 48 Ca 0.55 0.07 -0.30 0.00 0.36 0.00 0.00 54.97 55.65 3l5x s GLU 48 Cb -0.29 -0.92 -0.08 0.00 0.26 0.00 0.00 34.13 33.10 3l5x s GLU 48 CO 0.37 -0.25 1.20 -0.46 -0.54 0.00 0.00 175.26 175.57 3l5x s TRP 49 N 1.73 3.42 -0.22 5.30 -0.00 -1.26 -1.19 118.94 126.72 3l5x s TRP 49 Ca 0.01 1.41 -0.12 0.00 -0.00 0.00 0.00 56.10 57.40 3l5x s TRP 49 Cb -0.13 -3.44 -0.09 0.00 -0.00 0.00 0.00 33.47 29.81 3l5x s TRP 49 CO -0.04 -1.24 -0.30 1.28 -0.00 0.00 0.00 176.95 176.65 3l5x n LEU 50 N 2.53 1.65 -3.60 5.86 4.77 -0.35 -4.68 117.00 123.18 3l5x n LEU 50 Ca 0.04 0.28 -0.04 0.00 -0.03 0.00 0.00 56.01 56.26 3l5x n LEU 50 Cb 0.45 -0.68 -0.02 0.00 -2.33 0.00 0.00 43.42 40.84 3l5x n LEU 50 CO 0.56 0.35 1.01 0.00 -1.33 0.00 0.00 177.39 177.97 3l5x s ALA 51 N -2.48 -2.07 0.17 -1.18 0.00 -1.22 -0.24 121.76 114.75 3l5x s ALA 51 Ca -0.31 1.61 -0.10 0.00 0.00 0.00 0.00 51.96 53.15 3l5x s ALA 51 Cb 0.11 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 23.07 3l5x s ALA 51 CO 0.40 -0.58 0.32 -3.38 0.00 0.00 0.00 175.76 172.51 3l5x s HIS 52 N -2.37 0.33 -0.00 0.00 -3.43 -0.43 -0.56 115.29 108.82 3l5x s HIS 52 Ca 0.09 -0.70 -0.01 0.00 -0.80 0.00 0.00 55.06 53.64 3l5x s HIS 52 Cb -0.01 0.00 -0.00 0.00 -1.43 0.00 0.00 32.58 31.14 3l5x s HIS 52 CO -0.05 -0.75 0.03 -1.50 -2.00 0.00 0.00 174.74 170.47 3l5x s ILE 53 N -3.96 0.03 0.38 -5.38 2.07 -0.41 -1.61 121.20 112.32 3l5x s ILE 53 Ca 0.16 -0.29 0.07 0.00 -1.41 0.00 0.00 60.65 59.19 3l5x s ILE 53 Cb 0.03 -0.14 -0.01 0.00 0.13 0.00 0.00 42.46 42.47 3l5x s ILE 53 CO -0.00 -0.16 0.46 0.26 -1.91 0.00 0.00 174.94 173.60 3l5x s TRP 54 N -0.47 2.90 0.59 3.50 0.52 0.27 -1.46 118.94 124.79 3l5x s TRP 54 Ca -0.05 -0.35 0.29 0.00 0.02 0.00 0.00 56.10 56.01 3l5x s TRP 54 Cb -0.03 -2.14 1.61 0.00 -1.15 0.00 0.00 33.47 31.76 3l5x s TRP 54 CO -0.00 -0.15 2.04 0.11 0.02 0.00 0.00 176.95 178.96 3l5x h TRP 55 N 0.87 0.00 -0.69 -1.98 0.09 -1.04 0.13 115.95 113.33 3l5x h TRP 55 Ca -0.43 0.00 -0.28 0.00 0.09 0.00 0.00 58.89 58.27 3l5x h TRP 55 Cb 1.27 0.00 -0.17 0.00 0.08 0.00 0.00 29.16 30.34 3l5x h TRP 55 CO 0.45 0.00 0.29 -0.40 0.09 0.00 0.00 178.44 178.87 3l5x n ASP 56 N -3.73 3.90 0.00 0.11 5.75 -1.26 -4.55 116.55 116.77 3l5x n ASP 56 Ca 0.03 -3.45 0.00 0.00 -0.01 0.00 0.00 54.79 51.37 3l5x n ASP 56 Cb 0.42 -0.73 0.00 0.00 -1.03 0.00 0.00 41.12 39.78 3l5x n ASP 56 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3l5x n ASP 57 N -0.71 -4.35 -4.73 -1.12 8.00 0.46 -4.97 116.55 109.13 3l5x n ASP 57 Ca 0.43 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.52 3l5x n ASP 57 Cb 1.36 -2.52 -0.03 0.00 -0.02 0.00 0.00 41.12 39.91 3l5x n ASP 57 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3l5x s VAL 58 N -1.37 2.82 0.07 2.53 1.01 -1.26 -4.78 120.40 119.42 3l5x s VAL 58 Ca 0.00 0.62 0.07 0.00 0.00 0.00 0.00 61.98 62.66 3l5x s VAL 58 Cb 0.00 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 3l5x s VAL 58 CO 0.00 0.06 -0.18 -0.54 0.00 0.00 0.00 175.10 174.45 3l5x s LYS 59 N 0.65 1.06 0.01 2.72 1.02 -1.26 -0.57 119.74 123.37 3l5x s LYS 59 Ca 0.65 -0.99 0.01 0.00 0.02 0.00 0.00 55.97 55.66 3l5x s LYS 59 Cb -0.41 -1.18 -0.01 0.00 -0.52 0.00 0.00 37.83 35.71 3l5x s LYS 59 CO 0.35 0.28 -0.04 1.03 -0.92 0.00 0.00 175.35 176.05 3l5x s ARG 60 N -1.58 0.31 0.05 1.68 1.81 -0.64 -5.01 118.95 115.57 3l5x s ARG 60 Ca 0.04 -0.33 0.06 0.00 -1.72 0.00 0.00 55.73 53.78 3l5x s ARG 60 Cb -0.09 -0.19 -0.02 0.00 -0.45 0.00 0.00 34.95 34.19 3l5x s ARG 60 CO 0.03 0.04 -0.17 0.71 -0.68 0.00 0.00 175.30 175.23 3l5x s TYR 61 N -0.57 1.49 0.01 -0.53 1.51 -1.26 -1.32 117.35 116.67 3l5x s TYR 61 Ca -0.04 -0.37 -0.30 0.00 -1.01 0.00 0.00 57.07 55.35 3l5x s TYR 61 Cb -0.04 -0.87 -0.08 0.00 -0.11 0.00 0.00 41.96 40.85 3l5x s TYR 61 CO -0.00 0.08 1.91 1.21 -1.11 0.00 0.00 175.55 177.64 3l5x s ASN 62 N -1.28 6.46 0.53 2.29 3.84 0.67 -4.86 114.94 122.58 3l5x s ASN 62 Ca 0.04 2.55 0.19 0.00 0.21 0.00 0.00 52.86 55.84 3l5x s ASN 62 Cb -0.09 -2.53 1.37 0.00 -0.55 0.00 0.00 41.25 39.46 3l5x s ASN 62 CO 0.02 -1.06 2.16 1.55 -2.79 0.00 0.00 177.10 176.98 3l5x h PRO 63 N 10.55 0.00 0.00 0.43 0.13 -1.96 0.19 132.00 141.34 3l5x h PRO 63 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3l5x h PRO 63 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3l5x h PRO 63 CO 0.94 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.71 3l5x h ALA 64 N 1.99 1.00 0.00 -0.56 0.00 -1.99 -3.23 119.26 116.47 3l5x h ALA 64 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3l5x h ALA 64 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3l5x h ALA 64 CO -0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 3l5x n LEU 65 N -2.91 0.79 -0.31 0.00 4.77 -0.12 -4.87 117.00 114.35 3l5x n LEU 65 Ca 0.01 -0.79 0.14 0.00 -0.03 0.00 0.00 56.01 55.34 3l5x n LEU 65 Cb 0.27 0.00 0.32 0.00 -2.33 0.00 0.00 43.42 41.68 3l5x n LEU 65 CO 0.25 0.20 1.05 0.50 -1.33 0.00 0.00 177.39 178.06 3l5x h LYS 66 N 0.00 0.38 0.00 3.23 1.63 -1.10 0.10 116.57 120.81 3l5x h LYS 66 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 3l5x h LYS 66 Cb 0.14 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.69 3l5x h LYS 66 CO 0.00 0.25 0.00 0.66 -3.45 0.00 0.00 179.45 176.91 3l5x h SER 67 N 0.39 0.00 0.00 4.20 4.64 -1.89 -2.92 113.55 117.97 3l5x h SER 67 Ca 0.58 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.90 3l5x h SER 67 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3l5x h SER 67 CO -0.54 0.00 -1.72 0.54 -0.87 0.00 0.00 176.83 174.24 3l5x n ARG 68 N -2.83 0.49 -4.25 4.77 1.74 0.33 -4.95 116.66 111.96 3l5x n ARG 68 Ca -0.01 -0.14 -0.34 0.00 -0.77 0.00 0.00 57.85 56.59 3l5x n ARG 68 Cb 0.18 -1.51 -0.08 0.00 -1.02 0.00 0.00 32.46 30.03 3l5x n ARG 68 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3l5x s LEU 69 N -4.09 3.68 -0.01 0.55 1.43 -1.09 -1.42 118.68 117.74 3l5x s LEU 69 Ca -0.04 0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.20 3l5x s LEU 69 Cb 0.14 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 3l5x s LEU 69 CO 0.89 0.32 -0.07 -0.89 0.23 0.00 0.00 176.35 176.84 3l5x s THR 70 N -1.04 0.54 0.02 5.49 2.01 -0.09 -4.95 115.64 117.62 3l5x s THR 70 Ca 0.18 -0.29 0.05 0.00 0.31 0.00 0.00 61.69 61.94 3l5x s THR 70 Cb -0.12 -0.45 -0.02 0.00 0.01 0.00 0.00 72.50 71.92 3l5x s THR 70 CO 0.08 0.15 -0.14 -0.51 -0.69 0.00 0.00 174.62 173.51 3l5x s ILE 71 N -0.16 1.14 0.16 1.82 2.07 -1.26 -0.73 121.20 124.24 3l5x s ILE 71 Ca 0.03 -0.87 -0.11 0.00 -1.41 0.00 0.00 60.65 58.29 3l5x s ILE 71 Cb -0.03 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.57 3l5x s ILE 71 CO -0.00 0.12 0.32 -0.94 -1.91 0.00 0.00 174.94 172.53 3l5x s SER 72 N -0.85 -0.02 0.04 4.50 1.04 -0.63 -5.00 113.70 112.78 3l5x s SER 72 Ca 0.03 -0.75 -0.01 0.00 0.48 0.00 0.00 55.95 55.70 3l5x s SER 72 Cb -0.07 0.45 -0.03 0.00 0.10 0.00 0.00 66.02 66.47 3l5x s SER 72 CO 0.01 -0.90 -0.01 -1.59 0.98 0.00 0.00 173.24 171.72 3l5x s LYS 73 N -3.93 0.50 -0.27 4.02 0.00 -1.26 -0.49 119.74 118.31 3l5x s LYS 73 Ca 0.14 -0.95 -0.04 0.00 0.00 0.00 0.00 55.97 55.12 3l5x s LYS 73 Cb 0.03 0.18 0.09 0.00 0.00 0.00 0.00 37.83 38.12 3l5x s LYS 73 CO -0.02 -0.09 0.11 0.34 0.00 0.00 0.00 175.35 175.68 3l5x s ASP 74 N -2.31 3.36 0.23 0.03 -1.08 0.13 -5.01 116.67 112.02 3l5x s ASP 74 Ca -0.03 -1.19 -0.07 0.00 -0.52 0.00 0.00 52.55 50.74 3l5x s ASP 74 Cb 0.00 -0.42 0.27 0.00 -1.46 0.00 0.00 42.92 41.31 3l5x s ASP 74 CO -0.06 -0.41 1.86 0.74 0.52 0.00 0.00 175.17 177.81 3l5x h THR 75 N 6.43 1.08 -0.28 1.71 2.02 -1.88 -0.99 112.91 121.01 3l5x h THR 75 Ca -0.18 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.66 3l5x h THR 75 Cb 1.04 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 3l5x h THR 75 CO 0.41 0.17 0.11 0.77 0.37 0.00 0.00 175.52 177.35 3l5x h SER 76 N 0.95 0.34 0.13 4.18 4.64 -1.96 -1.86 113.55 119.97 3l5x h SER 76 Ca 0.33 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3l5x h SER 76 Cb 0.08 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3l5x h SER 76 CO -0.14 0.32 -0.21 0.29 -0.87 0.00 0.00 176.83 176.21 3l5x n LYS 77 N -4.42 1.16 -3.92 4.77 5.02 -0.75 -4.96 118.16 115.06 3l5x n LYS 77 Ca 0.01 -0.75 -0.28 0.00 -2.02 0.00 0.00 58.31 55.27 3l5x n LYS 77 Cb 0.13 -1.48 0.01 0.00 -0.02 0.00 0.00 35.03 33.66 3l5x n LYS 77 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3l5x n SER 78 N -0.26 -2.75 -4.05 4.39 7.64 -0.45 -4.85 113.62 113.29 3l5x n SER 78 Ca 0.13 -0.87 -0.19 0.00 1.01 0.00 0.00 58.87 58.95 3l5x n SER 78 Cb 0.38 -3.58 -0.15 0.00 -1.01 0.00 0.00 64.21 59.85 3l5x n SER 78 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3l5x s GLN 79 N -6.50 0.83 -0.08 1.43 -0.21 -1.02 -1.36 119.66 112.75 3l5x s GLN 79 Ca 0.38 -0.38 0.03 0.00 0.02 0.00 0.00 55.36 55.41 3l5x s GLN 79 Cb -0.19 -0.81 -0.02 0.00 1.00 0.00 0.00 33.01 32.99 3l5x s GLN 79 CO 0.85 0.22 -0.17 0.08 -2.12 0.00 0.00 175.29 174.15 3l5x s VAL 80 N -0.26 2.73 -0.14 1.09 1.01 -0.25 -0.70 120.40 123.88 3l5x s VAL 80 Ca 0.04 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.22 3l5x s VAL 80 Cb -0.04 -2.08 -0.00 0.00 0.00 0.00 0.00 36.38 34.26 3l5x s VAL 80 CO -0.00 0.56 -0.18 -0.69 0.00 0.00 0.00 175.10 174.79 3l5x s VAL 81 N -0.11 2.48 -0.15 2.92 1.01 0.35 -0.13 120.40 126.77 3l5x s VAL 81 Ca -0.03 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.08 3l5x s VAL 81 Cb -0.14 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 3l5x s VAL 81 CO 0.04 0.53 -0.04 -0.22 0.00 0.00 0.00 175.10 175.41 3l5x s LEU 82 N 0.70 3.23 -0.09 3.92 2.96 0.60 -1.61 118.68 128.39 3l5x s LEU 82 Ca -0.08 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 53.74 3l5x s LEU 82 Cb -0.16 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 44.76 3l5x s LEU 82 CO 0.01 0.18 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.11 3l5x s THR 83 N 0.29 1.93 -0.10 3.68 2.01 0.10 -0.58 115.64 122.97 3l5x s THR 83 Ca -0.04 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 61.00 3l5x s THR 83 Cb -0.14 -1.68 0.04 0.00 0.01 0.00 0.00 72.50 70.73 3l5x s THR 83 CO 0.03 0.53 0.00 -0.32 -0.69 0.00 0.00 174.62 174.18 3l5x s MET 84 N 0.34 0.70 0.51 4.92 1.75 0.05 -0.92 119.30 126.66 3l5x s MET 84 Ca -0.17 -0.05 -0.01 0.00 -1.25 0.00 0.00 55.69 54.21 3l5x s MET 84 Cb -0.17 -1.30 0.01 0.00 2.84 0.00 0.00 34.83 36.21 3l5x s MET 84 CO 0.08 -0.38 0.76 0.95 -0.65 0.00 0.00 175.02 175.77 3l5x s THR 85 N 1.92 3.51 -1.30 10.11 -4.23 -0.50 -0.19 115.64 124.96 3l5x s THR 85 Ca 0.04 -0.44 -0.01 0.00 -1.18 0.00 0.00 61.69 60.10 3l5x s THR 85 Cb -0.13 -3.33 -0.00 0.00 1.34 0.00 0.00 72.50 70.37 3l5x s THR 85 CO -0.06 -0.26 0.68 -3.20 -0.54 0.00 0.00 174.62 171.24 3l5x n ASN 86 N -2.28 -1.34 -4.76 3.99 5.15 -1.09 -4.89 115.26 110.04 3l5x n ASN 86 Ca 0.04 -0.84 -0.39 0.00 -0.60 0.00 0.00 54.58 52.79 3l5x n ASN 86 Cb 0.58 -3.97 0.01 0.00 -0.53 0.00 0.00 39.78 35.87 3l5x n ASN 86 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 3l5x s MET 87 N -5.99 3.69 0.11 1.20 -1.94 -0.17 -4.61 119.30 111.58 3l5x s MET 87 Ca 0.03 2.19 0.08 0.00 -1.71 0.00 0.00 55.69 56.27 3l5x s MET 87 Cb -0.01 -2.58 -0.03 0.00 2.01 0.00 0.00 34.83 34.22 3l5x s MET 87 CO 0.82 -0.73 -0.19 0.34 -0.01 0.00 0.00 175.02 175.25 3l5x s ASP 88 N -0.81 2.38 0.52 3.03 -1.08 -1.26 -0.10 116.67 119.35 3l5x s ASP 88 Ca 0.62 -0.70 0.37 0.00 -0.52 0.00 0.00 52.55 52.32 3l5x s ASP 88 Cb -0.39 -0.12 1.54 0.00 -1.46 0.00 0.00 42.92 42.49 3l5x s ASP 88 CO 0.49 0.01 1.72 -0.65 0.52 0.00 0.00 175.17 177.26 3l5x h PRO 89 N 3.99 0.05 0.00 4.34 0.11 -1.97 0.47 132.00 138.99 3l5x h PRO 89 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3l5x h PRO 89 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3l5x h PRO 89 CO 0.42 0.03 0.00 -0.24 -0.21 0.00 0.00 178.00 178.00 3l5x h VAL 90 N 0.05 0.00 -0.01 3.15 3.04 -1.96 -2.19 116.25 118.33 3l5x h VAL 90 Ca 0.69 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 66.17 3l5x h VAL 90 Cb 2.61 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 32.92 3l5x h VAL 90 CO -0.09 0.00 -0.05 0.47 -1.01 0.00 0.00 177.57 176.89 3l5x n ASP 91 N -2.68 0.70 -4.67 3.17 8.00 0.16 -4.84 116.55 116.39 3l5x n ASP 91 Ca -0.00 -1.01 -0.44 0.00 0.71 0.00 0.00 54.79 54.04 3l5x n ASP 91 Cb 0.18 -0.02 -0.04 0.00 -0.02 0.00 0.00 41.12 41.22 3l5x n ASP 91 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3l5x n THR 92 N -0.58 0.56 -3.61 -3.53 -1.04 -0.83 -4.84 114.28 100.40 3l5x n THR 92 Ca 0.18 -0.10 -0.02 0.00 -2.04 0.00 0.00 64.05 62.08 3l5x n THR 92 Cb 0.26 -2.08 -0.01 0.00 -1.82 0.00 0.00 70.33 66.68 3l5x n THR 92 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3l5x s ALA 93 N 3.66 -2.12 -0.08 2.41 0.00 -0.60 -4.38 121.76 120.65 3l5x s ALA 93 Ca 0.88 1.06 -0.26 0.00 0.00 0.00 0.00 51.96 53.65 3l5x s ALA 93 Cb -0.55 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 3l5x s ALA 93 CO 0.44 -0.84 0.81 0.99 0.00 0.00 0.00 175.76 177.16 3l5x s THR 94 N -2.50 4.95 -0.22 0.00 2.01 -0.80 -1.20 115.64 117.88 3l5x s THR 94 Ca 0.12 1.66 -0.07 0.00 0.31 0.00 0.00 61.69 63.71 3l5x s THR 94 Cb 0.02 -4.14 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 3l5x s THR 94 CO -0.04 0.16 0.06 -0.31 -0.69 0.00 0.00 174.62 173.80 3l5x s TYR 95 N 1.23 3.13 -0.06 4.92 1.51 0.37 -1.14 117.35 127.31 3l5x s TYR 95 Ca 0.42 -0.24 -0.00 0.00 -1.01 0.00 0.00 57.07 56.23 3l5x s TYR 95 Cb -0.18 -2.17 -0.03 0.00 -0.11 0.00 0.00 41.96 39.47 3l5x s TYR 95 CO 0.19 -0.16 -0.02 0.71 -1.11 0.00 0.00 175.55 175.15 3l5x s TYR 96 N 1.11 3.06 0.11 2.71 1.51 0.68 -1.02 117.35 125.52 3l5x s TYR 96 Ca 0.04 0.11 0.03 0.00 -1.01 0.00 0.00 57.07 56.24 3l5x s TYR 96 Cb -0.14 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 39.94 3l5x s TYR 96 CO 0.03 0.42 0.17 0.00 -1.11 0.00 0.00 175.55 175.06 3l5x s ALA 98 N -1.59 -1.25 0.12 0.00 0.00 -0.22 -0.09 121.76 118.73 3l5x s ALA 98 Ca 0.32 1.02 -0.23 0.00 0.00 0.00 0.00 51.96 53.07 3l5x s ALA 98 Cb -0.12 -0.27 -0.07 0.00 0.00 0.00 0.00 23.12 22.66 3l5x s ALA 98 CO 0.25 -0.29 0.71 0.50 0.00 0.00 0.00 175.76 176.93 3l5x s ARG 99 N -0.72 4.45 0.25 0.00 3.52 0.53 -0.38 118.95 126.60 3l5x s ARG 99 Ca -0.08 1.01 -0.30 0.00 -0.13 0.00 0.00 55.73 56.23 3l5x s ARG 99 Cb -0.03 -3.27 -0.10 0.00 -1.56 0.00 0.00 34.95 29.99 3l5x s ARG 99 CO 0.05 0.56 1.43 -1.64 -0.81 0.00 0.00 175.30 174.88 3l5x s MET 100 N -0.99 4.28 0.00 5.12 -1.94 -0.79 -1.61 119.30 123.36 3l5x s MET 100 Ca 0.34 2.29 0.23 0.00 -1.71 0.00 0.00 55.69 56.84 3l5x s MET 100 Cb -0.22 -3.11 1.10 0.00 2.01 0.00 0.00 34.83 34.62 3l5x s MET 100 CO 0.24 -0.40 1.74 0.41 -0.01 0.00 0.00 175.02 177.00 3l5x n GLY 101 N 2.10 -0.38 3.27 -0.03 0.00 0.86 -4.71 105.19 106.30 3l5x n GLY 101 Ca 0.06 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.63 3l5x n GLY 101 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3l5x s SER 102 N -1.72 2.01 0.00 1.61 0.15 -1.26 -4.97 113.70 109.52 3l5x s SER 102 Ca 0.34 -1.00 0.29 0.00 0.70 0.00 0.00 55.95 56.29 3l5x s SER 102 Cb 0.17 -0.05 1.30 0.00 -1.71 0.00 0.00 66.02 65.74 3l5x s SER 102 CO 0.28 -0.28 1.94 -0.90 1.20 0.00 0.00 173.24 175.48 3l5x n ASP 103 N -0.20 0.06 0.00 5.45 3.85 -1.26 -4.45 116.55 120.00 3l5x n ASP 103 Ca -0.10 0.16 0.00 0.00 -0.71 0.00 0.00 54.79 54.14 3l5x n ASP 103 Cb 0.60 -0.36 0.00 0.00 -1.35 0.00 0.00 41.12 40.02 3l5x n ASP 103 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3l5x n TYR 104 N -1.39 0.00 -3.09 2.11 0.18 -1.26 -4.67 117.16 109.04 3l5x n TYR 104 Ca 0.10 0.00 -0.18 0.00 1.88 0.00 0.00 57.90 59.70 3l5x n TYR 104 Cb 0.30 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.27 3l5x n TYR 104 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 3l5x s ASP 105 N 0.00 5.55 -0.54 9.48 -1.08 -1.26 -5.08 116.67 123.73 3l5x s ASP 105 Ca 0.00 -0.49 0.04 0.00 -0.52 0.00 0.00 52.55 51.58 3l5x s ASP 105 Cb 0.00 -0.60 0.14 0.00 -1.46 0.00 0.00 42.92 41.00 3l5x s ASP 105 CO 0.00 -0.77 0.30 -0.69 0.52 0.00 0.00 175.17 174.52 3l5x s VAL 106 N -2.38 2.57 0.13 1.11 1.01 -1.26 -4.31 120.40 117.26 3l5x s VAL 106 Ca 0.54 -3.44 -0.08 0.00 0.00 0.00 0.00 61.98 59.00 3l5x s VAL 106 Cb -0.09 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.52 3l5x s VAL 106 CO 0.33 -0.84 0.23 -1.66 0.00 0.00 0.00 175.10 173.15 3l5x s TRP 107 N -0.45 0.34 -0.16 5.22 1.48 -1.26 -5.05 118.94 119.06 3l5x s TRP 107 Ca 0.18 -0.73 0.01 0.00 -1.06 0.00 0.00 56.10 54.50 3l5x s TRP 107 Cb -0.22 -0.09 0.02 0.00 -1.16 0.00 0.00 33.47 32.02 3l5x s TRP 107 CO -0.03 -0.64 -0.18 -0.06 -4.06 0.00 0.00 176.95 171.99 3l5x s PHE 108 N -3.93 2.49 -0.20 1.66 0.40 -1.26 -0.10 117.98 117.04 3l5x s PHE 108 Ca 0.13 -1.43 0.06 0.00 -0.60 0.00 0.00 56.93 55.09 3l5x s PHE 108 Cb 0.04 -1.76 -0.21 0.00 0.51 0.00 0.00 43.02 41.60 3l5x s PHE 108 CO -0.04 -0.73 0.02 -0.40 0.70 0.00 0.00 175.22 174.78 3l5x n ASP 109 N 4.63 1.35 -4.29 1.36 5.75 -0.63 -4.83 116.55 119.89 3l5x n ASP 109 Ca -0.19 0.00 -0.31 0.00 -0.01 0.00 0.00 54.79 54.28 3l5x n ASP 109 Cb 0.50 -0.06 -0.16 0.00 -1.03 0.00 0.00 41.12 40.37 3l5x n ASP 109 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 3l5x s TYR 110 N -2.52 2.41 0.06 2.11 1.51 -1.25 -5.00 117.35 114.67 3l5x s TYR 110 Ca -0.23 -0.62 0.07 0.00 -1.01 0.00 0.00 57.07 55.28 3l5x s TYR 110 Cb 0.08 -1.57 -0.03 0.00 -0.11 0.00 0.00 41.96 40.33 3l5x s TYR 110 CO 0.71 -0.15 -0.20 -1.58 -1.11 0.00 0.00 175.55 173.22 3l5x s TRP 111 N -0.32 1.74 0.99 2.71 0.52 -1.26 -0.35 118.94 122.97 3l5x s TRP 111 Ca 0.01 -0.39 -0.13 0.00 0.02 0.00 0.00 56.10 55.61 3l5x s TRP 111 Cb -0.12 -1.01 0.18 0.00 -1.15 0.00 0.00 33.47 31.37 3l5x s TRP 111 CO 0.02 0.12 1.11 0.20 0.02 0.00 0.00 176.95 178.43 3l5x s GLY 112 N -1.42 1.57 0.18 0.98 0.00 0.87 -4.60 107.32 104.91 3l5x s GLY 112 Ca 0.06 -0.48 0.25 0.00 0.00 0.00 0.00 44.72 44.55 3l5x s GLY 112 CO 0.03 0.14 1.76 0.61 0.00 0.00 0.00 173.10 175.63 3l5x n GLN 113 N -4.08 0.19 0.00 2.90 10.64 -1.26 -4.82 117.38 120.96 3l5x n GLN 113 Ca 0.06 0.25 0.00 0.00 -1.83 0.00 0.00 57.00 55.48 3l5x n GLN 113 Cb 0.58 -1.77 0.00 0.00 -0.86 0.00 0.00 30.24 28.20 3l5x n GLN 113 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3l5x n GLY 114 N 0.89 0.19 3.07 2.61 0.00 -1.26 -5.03 105.19 105.65 3l5x n GLY 114 Ca 0.05 -1.54 -0.21 0.00 0.00 0.00 0.00 46.02 44.32 3l5x n GLY 114 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3l5x s THR 115 N -2.55 0.95 -0.15 2.61 -1.32 -0.19 -4.90 115.64 110.08 3l5x s THR 115 Ca 0.00 -0.50 -0.25 0.00 -1.21 0.00 0.00 61.69 59.73 3l5x s THR 115 Cb 0.00 -0.80 -0.02 0.00 -1.51 0.00 0.00 72.50 70.17 3l5x s THR 115 CO 0.00 0.27 0.82 -0.22 -2.21 0.00 0.00 174.62 173.28 3l5x s LEU 116 N -0.20 4.19 -0.19 9.08 2.96 -1.26 -0.48 118.68 132.78 3l5x s LEU 116 Ca 0.03 1.18 -0.03 0.00 -0.22 0.00 0.00 54.13 55.10 3l5x s LEU 116 Cb -0.06 -3.22 -0.01 0.00 0.50 0.00 0.00 46.19 43.41 3l5x s LEU 116 CO -0.00 -0.36 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.90 3l5x s VAL 117 N 1.97 3.20 -0.17 1.68 1.01 -0.34 -2.16 120.40 125.59 3l5x s VAL 117 Ca 0.38 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 3l5x s VAL 117 Cb -0.17 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 3l5x s VAL 117 CO 0.13 0.46 -0.07 -0.89 0.00 0.00 0.00 175.10 174.73 3l5x s THR 118 N 1.17 3.42 -0.27 3.92 2.01 -0.50 -1.56 115.64 123.83 3l5x s THR 118 Ca 0.02 -0.51 -0.06 0.00 0.31 0.00 0.00 61.69 61.45 3l5x s THR 118 Cb -0.14 -2.50 -0.00 0.00 0.01 0.00 0.00 72.50 69.87 3l5x s THR 118 CO -0.02 0.48 0.04 -0.69 -0.69 0.00 0.00 174.62 173.74 3l5x s VAL 119 N 0.72 3.83 -0.14 3.82 1.01 -1.26 -1.14 120.40 127.24 3l5x s VAL 119 Ca -0.03 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.08 3l5x s VAL 119 Cb -0.15 -2.89 0.11 0.00 0.00 0.00 0.00 36.38 33.46 3l5x s VAL 119 CO 0.02 0.22 0.91 -0.55 0.00 0.00 0.00 175.10 175.70 3l5x s SER 120 N 1.51 -0.45 0.44 3.32 0.15 -0.98 -4.06 113.70 113.63 3l5x s SER 120 Ca 0.04 0.51 0.24 0.00 0.70 0.00 0.00 55.95 57.44 3l5x s SER 120 Cb -0.16 0.40 0.88 0.00 -1.71 0.00 0.00 66.02 65.43 3l5x s SER 120 CO 0.01 -0.40 1.81 0.77 1.20 0.00 0.00 173.24 176.63 3l5x h SER 121 N 2.76 0.00 -3.35 5.45 4.64 -1.96 -3.40 113.55 117.69 3l5x h SER 121 Ca -0.21 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.55 3l5x h SER 121 Cb 1.16 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 63.43 3l5x h SER 121 CO 0.32 0.23 -0.23 0.00 -0.87 0.00 0.00 176.83 176.28 3l5x n ALA 122 N -2.22 -1.01 -2.88 5.18 0.00 -1.26 -5.01 120.51 113.30 3l5x n ALA 122 Ca 0.00 -0.18 -0.34 0.00 0.00 0.00 0.00 53.44 52.93 3l5x n ALA 122 Cb 0.44 -1.94 -0.05 0.00 0.00 0.00 0.00 19.45 17.90 3l5x n ALA 122 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3l5x s SER 123 N -1.46 6.27 -0.01 0.00 0.01 -1.26 -5.05 113.70 112.20 3l5x s SER 123 Ca 0.69 0.33 -0.38 0.00 1.31 0.00 0.00 55.95 57.90 3l5x s SER 123 Cb -0.36 -1.95 -0.17 0.00 0.21 0.00 0.00 66.02 63.75 3l5x s SER 123 CO 0.55 0.28 1.42 0.41 0.41 0.00 0.00 173.24 176.30 3l5x n THR 124 N 1.08 0.07 -3.75 1.44 -1.04 -1.26 -4.74 114.28 106.07 3l5x n THR 124 Ca -0.12 -0.01 -0.12 0.00 -2.04 0.00 0.00 64.05 61.75 3l5x n THR 124 Cb 0.53 -0.86 -0.12 0.00 -1.82 0.00 0.00 70.33 68.05 3l5x n THR 124 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3l5x s LYS 125 N 1.18 0.24 0.60 -2.82 2.20 0.44 -4.96 119.74 116.63 3l5x s LYS 125 Ca 0.88 0.45 -0.10 0.00 -0.36 0.00 0.00 55.97 56.84 3l5x s LYS 125 Cb -1.01 -0.01 -0.04 0.00 -1.51 0.00 0.00 37.83 35.26 3l5x s LYS 125 CO 0.52 -0.11 1.00 0.20 -0.36 0.00 0.00 175.35 176.60 3l5x s GLY 126 N 0.79 1.64 0.49 5.54 0.00 -1.26 -1.01 107.32 113.52 3l5x s GLY 126 Ca -0.05 -0.14 -0.16 0.00 0.00 0.00 0.00 44.72 44.37 3l5x s GLY 126 CO -0.05 0.12 0.95 2.56 0.00 0.00 0.00 173.10 176.68 3l5x s PRO 127 N -5.13 3.94 0.10 2.90 0.04 -1.26 -4.53 135.00 131.06 3l5x s PRO 127 Ca 0.54 0.90 -0.22 0.00 0.04 0.00 0.00 61.00 62.26 3l5x s PRO 127 Cb -0.11 -2.17 -0.07 0.00 0.04 0.00 0.00 34.50 32.19 3l5x s PRO 127 CO 0.53 -0.22 0.66 -1.12 0.04 0.00 0.00 177.00 176.89 3l5x s SER 128 N -3.03 7.19 -0.22 6.66 0.01 -0.02 -4.90 113.70 119.39 3l5x s SER 128 Ca 0.58 1.41 0.02 0.00 1.31 0.00 0.00 55.95 59.27 3l5x s SER 128 Cb -0.10 -2.42 0.04 0.00 0.21 0.00 0.00 66.02 63.75 3l5x s SER 128 CO 0.30 0.22 -0.14 -0.69 0.41 0.00 0.00 173.24 173.34 3l5x s VAL 129 N -0.96 2.03 0.01 3.43 1.01 -1.26 -0.43 120.40 124.23 3l5x s VAL 129 Ca 0.32 -1.29 0.02 0.00 0.00 0.00 0.00 61.98 61.03 3l5x s VAL 129 Cb -0.21 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3l5x s VAL 129 CO 0.22 0.20 -0.01 -0.36 0.00 0.00 0.00 175.10 175.15 3l5x s PHE 130 N 1.22 3.05 0.30 5.22 2.99 -0.11 -4.95 117.98 125.69 3l5x s PHE 130 Ca -0.03 0.06 -0.29 0.00 0.00 0.00 0.00 56.93 56.67 3l5x s PHE 130 Cb -0.17 -1.65 -0.09 0.00 0.00 0.00 0.00 43.02 41.11 3l5x s PHE 130 CO -0.08 0.45 1.08 -1.25 -0.00 0.00 0.00 175.22 175.42 3l5x s PRO 131 N -1.62 4.58 -0.52 0.24 0.04 -1.26 -0.51 135.00 135.95 3l5x s PRO 131 Ca 0.20 1.73 -0.16 0.00 0.04 0.00 0.00 61.00 62.81 3l5x s PRO 131 Cb -0.11 -3.09 0.11 0.00 0.04 0.00 0.00 34.50 31.45 3l5x s PRO 131 CO 0.11 0.18 0.47 -0.51 0.04 0.00 0.00 177.00 177.29 3l5x s LEU 132 N -1.63 5.94 0.35 -3.56 1.43 0.79 -4.79 118.68 117.21 3l5x s LEU 132 Ca 0.46 -1.60 -0.27 0.00 -1.03 0.00 0.00 54.13 51.69 3l5x s LEU 132 Cb -0.30 -2.21 -0.09 0.00 0.03 0.00 0.00 46.19 43.62 3l5x s LEU 132 CO 0.38 -0.80 1.16 0.00 0.23 0.00 0.00 176.35 177.32 3l5x s ALA 133 N 1.67 3.29 0.08 4.21 0.00 -1.26 -1.29 121.76 128.47 3l5x s ALA 133 Ca 0.04 0.97 -0.35 0.00 0.00 0.00 0.00 51.96 52.61 3l5x s ALA 133 Cb -0.28 -3.37 -0.19 0.00 0.00 0.00 0.00 23.12 19.29 3l5x s ALA 133 CO 0.05 -0.39 0.92 -2.30 0.00 0.00 0.00 175.76 174.03 3l5x n PRO 134 N 0.56 0.16 0.00 0.00 -0.02 -1.26 -4.75 135.00 129.68 3l5x n PRO 134 Ca 0.02 0.06 0.13 0.00 -2.02 0.00 0.00 63.50 61.69 3l5x n PRO 134 Cb 0.45 -1.41 0.58 0.00 -0.02 0.00 0.00 33.50 33.11 3l5x n PRO 134 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3l5x n SER 135 N 1.74 0.00 -3.84 2.55 3.41 -0.35 -4.75 113.62 112.38 3l5x n SER 135 Ca 0.19 0.48 -0.12 0.00 -0.26 0.00 0.00 58.87 59.16 3l5x n SER 135 Cb 0.15 -0.49 -0.06 0.00 -0.26 0.00 0.00 64.21 63.55 3l5x n SER 135 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3l5x s SER 136 N -2.99 0.29 0.54 4.04 1.04 -1.26 -4.96 113.70 110.39 3l5x s SER 136 Ca 0.13 -1.22 -0.16 0.00 0.48 0.00 0.00 55.95 55.18 3l5x s SER 136 Cb 0.18 0.55 -0.07 0.00 0.10 0.00 0.00 66.02 66.78 3l5x s SER 136 CO 0.49 -1.10 1.00 -0.54 0.98 0.00 0.00 173.24 174.07 3l5x s LYS 137 N -3.79 3.84 0.56 4.02 1.02 -1.26 -4.95 119.74 119.17 3l5x s LYS 137 Ca 0.30 0.95 0.25 0.00 0.02 0.00 0.00 55.97 57.49 3l5x s LYS 137 Cb 0.02 -2.12 1.49 0.00 -0.52 0.00 0.00 37.83 36.70 3l5x s LYS 137 CO 0.13 -0.37 2.07 0.66 -0.92 0.00 0.00 175.35 176.93 3l5x h SER 138 N 0.71 0.00 0.61 2.83 4.64 -1.95 -1.47 113.55 118.92 3l5x h SER 138 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3l5x h SER 138 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3l5x h SER 138 CO 0.61 0.00 -0.36 0.35 -0.87 0.00 0.00 176.83 176.56 3l5x n THR 139 N -4.14 0.00 -0.27 2.95 -2.24 -1.26 -3.06 114.28 106.26 3l5x n THR 139 Ca 0.04 -0.01 0.05 0.00 -2.27 0.00 0.00 64.05 61.87 3l5x n THR 139 Cb 0.38 0.06 0.19 0.00 -2.10 0.00 0.00 70.33 68.87 3l5x n THR 139 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3l5x h SER 140 N 0.05 0.37 0.00 3.42 0.87 -1.61 -3.46 113.55 113.19 3l5x h SER 140 Ca 0.00 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 3l5x h SER 140 Cb 0.50 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 3l5x h SER 140 CO 0.00 0.15 0.00 0.61 -0.53 0.00 0.00 176.83 177.06 3l5x n GLY 141 N -1.32 0.73 0.59 5.77 0.00 -1.26 -5.07 105.19 104.64 3l5x n GLY 141 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.14 3l5x n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3l5x n GLY 142 N -2.14 2.27 3.79 -0.02 0.00 -1.26 -4.91 105.19 102.92 3l5x n GLY 142 Ca 0.00 -2.16 -0.37 0.00 0.00 0.00 0.00 46.02 43.49 3l5x n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3l5x s THR 143 N 0.18 5.26 0.17 2.61 -4.23 -1.26 -1.02 115.64 117.35 3l5x s THR 143 Ca 0.08 0.58 0.06 0.00 -1.18 0.00 0.00 61.69 61.23 3l5x s THR 143 Cb -0.01 -3.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.18 3l5x s THR 143 CO 0.05 0.49 0.10 0.00 -0.54 0.00 0.00 174.62 174.72 3l5x s ALA 144 N -0.29 3.48 0.04 3.99 0.00 0.97 -4.84 121.76 125.10 3l5x s ALA 144 Ca 0.19 -1.27 0.07 0.00 0.00 0.00 0.00 51.96 50.95 3l5x s ALA 144 Cb -0.14 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.68 3l5x s ALA 144 CO 0.07 0.49 -0.16 0.00 0.00 0.00 0.00 175.76 176.15 3l5x s ALA 145 N -1.77 2.66 0.23 0.00 0.00 -1.26 -0.96 121.76 120.66 3l5x s ALA 145 Ca 0.30 -1.17 -0.05 0.00 0.00 0.00 0.00 51.96 51.04 3l5x s ALA 145 Cb -0.10 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 3l5x s ALA 145 CO 0.22 0.58 0.29 -0.48 0.00 0.00 0.00 175.76 176.37 3l5x s LEU 146 N -1.45 0.85 0.00 0.00 0.05 -0.66 -1.21 118.68 116.26 3l5x s LEU 146 Ca 0.15 -1.24 -0.16 0.00 0.05 0.00 0.00 54.13 52.93 3l5x s LEU 146 Cb -0.11 0.99 0.05 0.00 -2.05 0.00 0.00 46.19 45.08 3l5x s LEU 146 CO 0.06 -1.00 0.72 0.61 -0.55 0.00 0.00 176.35 176.19 3l5x n GLY 147 N -0.35 0.39 3.11 -3.48 0.00 -0.41 -0.96 105.19 103.49 3l5x n GLY 147 Ca 0.01 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 44.84 3l5x n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3l5x s LEU 149 N -0.10 4.63 -0.61 0.00 2.96 0.34 -0.84 118.68 125.06 3l5x s LEU 149 Ca 0.00 -0.44 -0.15 0.00 -0.22 0.00 0.00 54.13 53.33 3l5x s LEU 149 Cb -0.09 -2.32 0.15 0.00 0.50 0.00 0.00 46.19 44.43 3l5x s LEU 149 CO 0.01 -0.42 0.56 -0.69 -1.32 0.00 0.00 176.35 174.49 3l5x s VAL 150 N 2.00 5.21 -0.03 1.68 1.01 0.15 -0.94 120.40 129.49 3l5x s VAL 150 Ca 0.11 -1.80 0.04 0.00 0.00 0.00 0.00 61.98 60.33 3l5x s VAL 150 Cb -0.17 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 31.87 3l5x s VAL 150 CO 0.12 -0.90 -0.15 -0.75 0.00 0.00 0.00 175.10 173.42 3l5x s LYS 151 N 1.18 2.43 -0.71 2.72 2.20 0.43 -1.20 119.74 126.79 3l5x s LYS 151 Ca 0.07 -0.75 -0.01 0.00 -0.36 0.00 0.00 55.97 54.92 3l5x s LYS 151 Cb -0.24 -2.35 -0.02 0.00 -1.51 0.00 0.00 37.83 33.71 3l5x s LYS 151 CO -0.00 0.61 0.60 -0.25 -0.36 0.00 0.00 175.35 175.94 3l5x n ASP 152 N 2.14 -3.08 -4.63 1.43 8.00 0.48 -0.84 116.55 120.05 3l5x n ASP 152 Ca -0.17 -0.40 -0.25 0.00 0.71 0.00 0.00 54.79 54.68 3l5x n ASP 152 Cb 0.52 -3.37 -0.09 0.00 -0.02 0.00 0.00 41.12 38.16 3l5x n ASP 152 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3l5x s TYR 153 N -3.23 2.53 -0.28 1.24 1.13 -0.76 -4.47 117.35 113.51 3l5x s TYR 153 Ca 0.10 -0.51 -0.23 0.00 -1.41 0.00 0.00 57.07 55.03 3l5x s TYR 153 Cb -0.01 -1.59 0.11 0.00 -1.10 0.00 0.00 41.96 39.37 3l5x s TYR 153 CO 0.45 0.45 0.91 0.12 -2.51 0.00 0.00 175.55 174.97 3l5x s PHE 154 N -2.58 -0.63 0.37 -3.49 2.19 -0.18 0.01 117.98 113.67 3l5x s PHE 154 Ca 0.35 1.44 -0.04 0.00 0.33 0.00 0.00 56.93 59.02 3l5x s PHE 154 Cb 0.03 0.37 0.08 0.00 -1.31 0.00 0.00 43.02 42.18 3l5x s PHE 154 CO 0.19 -0.30 0.50 -0.35 1.83 0.00 0.00 175.22 177.09 3l5x n PRO 155 N 2.76 -0.12 -0.99 10.12 -0.04 -1.26 -0.42 135.00 145.06 3l5x n PRO 155 Ca -0.14 -1.03 -0.33 0.00 -0.04 0.00 0.00 63.50 61.95 3l5x n PRO 155 Cb 0.56 -0.43 0.13 0.00 -0.04 0.00 0.00 33.50 33.72 3l5x n PRO 155 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3l5x n GLU 156 N -2.00 -0.01 -3.94 0.54 -0.58 -1.26 -4.76 120.64 108.64 3l5x n GLU 156 Ca 0.07 0.07 -0.22 0.00 -0.42 0.00 0.00 57.16 56.66 3l5x n GLU 156 Cb 0.25 -2.28 -0.05 0.00 -0.57 0.00 0.00 31.44 28.80 3l5x n GLU 156 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 3l5x s PRO 157 N -4.01 2.56 0.22 3.49 0.04 -1.26 -4.92 135.00 131.12 3l5x s PRO 157 Ca 0.69 -1.42 0.09 0.00 0.04 0.00 0.00 61.00 60.40 3l5x s PRO 157 Cb -0.27 -2.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.89 3l5x s PRO 157 CO 0.55 0.09 -0.06 0.14 0.04 0.00 0.00 177.00 177.77 3l5x s VAL 158 N -2.37 3.29 0.11 -0.36 -7.23 -1.26 -4.34 120.40 108.24 3l5x s VAL 158 Ca 0.40 -1.81 0.10 0.00 -1.81 0.00 0.00 61.98 58.86 3l5x s VAL 158 Cb -0.04 -2.70 -0.04 0.00 0.56 0.00 0.00 36.38 34.17 3l5x s VAL 158 CO 0.25 -0.25 -0.23 0.42 -0.31 0.00 0.00 175.10 174.98 3l5x s THR 159 N -2.04 2.52 -0.04 5.32 -4.23 -0.56 -4.99 115.64 111.62 3l5x s THR 159 Ca 0.28 -1.57 0.02 0.00 -1.18 0.00 0.00 61.69 59.24 3l5x s THR 159 Cb -0.07 -2.11 0.01 0.00 1.34 0.00 0.00 72.50 71.66 3l5x s THR 159 CO 0.17 0.15 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.62 3l5x s VAL 160 N -1.05 0.82 0.34 2.29 1.01 -1.26 -1.22 120.40 121.33 3l5x s VAL 160 Ca 0.15 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.85 3l5x s VAL 160 Cb -0.10 -0.76 -0.07 0.00 0.00 0.00 0.00 36.38 35.45 3l5x s VAL 160 CO 0.07 0.27 0.04 -0.94 0.00 0.00 0.00 175.10 174.54 3l5x s SER 161 N 0.52 2.73 -0.09 3.32 1.04 -0.44 -4.97 113.70 115.81 3l5x s SER 161 Ca -0.09 -1.36 0.03 0.00 0.48 0.00 0.00 55.95 55.01 3l5x s SER 161 Cb -0.12 -0.16 -0.01 0.00 0.10 0.00 0.00 66.02 65.83 3l5x s SER 161 CO 0.01 -0.55 -0.19 0.26 0.98 0.00 0.00 173.24 173.75 3l5x s TRP 162 N -3.15 2.63 -1.38 5.02 0.52 -1.26 0.01 118.94 121.34 3l5x s TRP 162 Ca 0.36 -0.70 -0.00 0.00 0.02 0.00 0.00 56.10 55.78 3l5x s TRP 162 Cb 0.09 -1.71 0.00 0.00 -1.15 0.00 0.00 33.47 30.69 3l5x s TRP 162 CO 0.16 -0.21 0.51 0.09 0.02 0.00 0.00 176.95 177.52 3l5x n ASN 163 N 3.19 -0.59 -2.76 2.95 3.02 0.31 -0.59 115.26 120.79 3l5x n ASN 163 Ca -0.18 -0.95 -0.16 0.00 -0.03 0.00 0.00 54.58 53.26 3l5x n ASN 163 Cb 0.52 -3.36 -0.00 0.00 -0.61 0.00 0.00 39.78 36.33 3l5x n ASN 163 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3l5x n SER 164 N -3.01 -3.89 0.00 6.41 7.64 -1.26 -1.48 113.62 118.03 3l5x n SER 164 Ca -0.30 -0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.57 3l5x n SER 164 Cb 0.68 -3.27 0.00 0.00 -1.01 0.00 0.00 64.21 60.61 3l5x n SER 164 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3l5x n GLY 165 N -0.95 0.76 0.24 0.23 0.00 0.24 -4.94 105.19 100.77 3l5x n GLY 165 Ca -0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.05 3l5x n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3l5x h ALA 166 N 0.00 0.98 -3.29 4.61 0.00 -1.07 -3.41 119.26 117.09 3l5x h ALA 166 Ca 0.00 -0.08 -0.68 0.00 0.00 0.00 0.00 54.91 54.15 3l5x h ALA 166 Cb 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 17.79 17.46 3l5x h ALA 166 CO 0.00 0.11 -0.71 -1.17 0.00 0.00 0.00 179.25 177.48 3l5x s LEU 167 N -6.36 3.50 0.00 0.00 2.96 -1.11 -4.89 118.68 112.78 3l5x s LEU 167 Ca 0.03 -0.96 0.00 0.00 -0.22 0.00 0.00 54.13 52.98 3l5x s LEU 167 Cb 0.08 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 45.06 3l5x s LEU 167 CO 0.61 -0.18 0.00 0.35 -1.32 0.00 0.00 176.35 175.81 3l5x n THR 168 N 4.69 0.00 -1.89 3.68 -2.24 -1.26 -4.13 114.28 113.13 3l5x n THR 168 Ca -0.15 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 3l5x n THR 168 Cb 0.46 -0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 68.24 3l5x n THR 168 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3l5x s SER 169 N -1.93 6.56 0.00 3.42 0.15 -1.26 -2.52 113.70 118.12 3l5x s SER 169 Ca 0.00 2.60 0.00 0.00 0.70 0.00 0.00 55.95 59.25 3l5x s SER 169 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 3l5x s SER 169 CO 0.00 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.17 3l5x n GLY 170 N 3.92 0.58 3.73 9.45 0.00 -1.26 -4.72 105.19 116.89 3l5x n GLY 170 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3l5x n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3l5x s VAL 171 N -2.38 4.92 -0.12 1.61 1.01 -1.05 -2.79 120.40 121.61 3l5x s VAL 171 Ca 0.00 1.46 -0.00 0.00 0.00 0.00 0.00 61.98 63.43 3l5x s VAL 171 Cb 0.00 -4.04 0.02 0.00 0.00 0.00 0.00 36.38 32.37 3l5x s VAL 171 CO 0.00 0.32 -0.09 -1.00 0.00 0.00 0.00 175.10 174.34 3l5x s HIS 172 N 0.33 1.56 -0.23 5.22 3.76 0.07 -5.00 115.29 121.01 3l5x s HIS 172 Ca 0.36 -0.79 -0.05 0.00 -0.15 0.00 0.00 55.06 54.43 3l5x s HIS 172 Cb -0.19 -1.27 -0.02 0.00 1.11 0.00 0.00 32.58 32.22 3l5x s HIS 172 CO 0.19 -0.52 0.00 0.99 -0.85 0.00 0.00 174.74 174.55 3l5x s THR 173 N 1.65 3.72 0.40 1.30 2.01 -1.26 -0.96 115.64 122.49 3l5x s THR 173 Ca 0.04 -0.37 -0.19 0.00 0.31 0.00 0.00 61.69 61.48 3l5x s THR 173 Cb -0.13 -2.72 -0.10 0.00 0.01 0.00 0.00 72.50 69.56 3l5x s THR 173 CO -0.08 0.39 0.88 -0.36 -0.69 0.00 0.00 174.62 174.76 3l5x s PHE 174 N 1.53 3.33 0.45 4.92 0.40 -0.21 -5.00 117.98 123.40 3l5x s PHE 174 Ca 0.06 1.48 -0.25 0.00 -0.60 0.00 0.00 56.93 57.63 3l5x s PHE 174 Cb -0.15 -2.75 -0.09 0.00 0.51 0.00 0.00 43.02 40.55 3l5x s PHE 174 CO -0.01 -0.05 1.32 -2.30 0.70 0.00 0.00 175.22 174.87 3l5x n PRO 175 N -0.59 1.96 -2.05 0.24 -0.02 -1.26 -4.60 135.00 128.68 3l5x n PRO 175 Ca 0.06 0.70 -0.36 0.00 -2.02 0.00 0.00 63.50 61.88 3l5x n PRO 175 Cb 0.54 -2.47 0.02 0.00 -0.02 0.00 0.00 33.50 31.57 3l5x n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3l5x s ALA 176 N -1.22 2.65 0.04 3.55 0.00 -1.26 -4.82 121.76 120.70 3l5x s ALA 176 Ca 0.63 1.01 0.02 0.00 0.00 0.00 0.00 51.96 53.62 3l5x s ALA 176 Cb -0.48 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.16 3l5x s ALA 176 CO 0.56 -1.07 0.07 0.14 0.00 0.00 0.00 175.76 175.47 3l5x s VAL 177 N -1.57 4.57 -0.23 0.00 -7.23 -0.26 -4.95 120.40 110.73 3l5x s VAL 177 Ca 0.74 -0.62 -0.16 0.00 -1.81 0.00 0.00 61.98 60.13 3l5x s VAL 177 Cb -0.30 -3.15 -0.03 0.00 0.56 0.00 0.00 36.38 33.45 3l5x s VAL 177 CO 0.34 0.23 0.43 -0.22 -0.31 0.00 0.00 175.10 175.57 3l5x s LEU 178 N -2.09 4.10 0.43 1.32 2.96 -1.26 -1.76 118.68 122.38 3l5x s LEU 178 Ca 0.26 0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 54.63 3l5x s LEU 178 Cb -0.12 -2.55 -0.02 0.00 0.50 0.00 0.00 46.19 44.01 3l5x s LEU 178 CO 0.18 -0.17 0.66 -1.10 -1.32 0.00 0.00 176.35 174.61 3l5x s GLN 179 N 1.80 3.25 0.59 1.98 -0.21 -0.27 -4.95 119.66 121.85 3l5x s GLN 179 Ca 0.19 -0.32 0.29 0.00 0.02 0.00 0.00 55.36 55.54 3l5x s GLN 179 Cb -0.15 -2.55 1.52 0.00 1.00 0.00 0.00 33.01 32.83 3l5x s GLN 179 CO 0.09 -0.16 1.96 0.66 -2.12 0.00 0.00 175.29 175.72 3l5x h SER 180 N 0.45 0.00 0.48 5.90 4.64 -1.97 0.32 113.55 123.36 3l5x h SER 180 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3l5x h SER 180 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3l5x h SER 180 CO 0.59 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.01 3l5x n SER 181 N -3.78 0.00 0.00 4.97 3.41 -1.26 -4.86 113.62 112.10 3l5x n SER 181 Ca 0.07 0.46 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 3l5x n SER 181 Cb 0.57 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 3l5x n SER 181 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3l5x n GLY 182 N -0.01 0.81 3.85 5.00 0.00 0.10 -5.03 105.19 109.91 3l5x n GLY 182 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 3l5x n GLY 182 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3l5x s LEU 183 N 0.00 4.03 0.25 0.99 1.43 -1.25 -4.86 118.68 119.26 3l5x s LEU 183 Ca 0.00 0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.16 3l5x s LEU 183 Cb 0.00 -2.65 -0.04 0.00 0.03 0.00 0.00 46.19 43.54 3l5x s LEU 183 CO 0.00 0.11 0.42 -0.31 0.23 0.00 0.00 176.35 176.80 3l5x s TYR 184 N -1.60 3.48 -0.06 0.29 1.51 0.10 -1.11 117.35 119.96 3l5x s TYR 184 Ca 0.32 0.21 -0.06 0.00 -1.01 0.00 0.00 57.07 56.54 3l5x s TYR 184 Cb -0.11 -1.76 0.02 0.00 -0.11 0.00 0.00 41.96 39.99 3l5x s TYR 184 CO 0.25 0.33 0.16 0.45 -1.11 0.00 0.00 175.55 175.64 3l5x s SER 185 N -3.67 -0.17 0.09 2.29 0.15 -0.72 -0.39 113.70 111.28 3l5x s SER 185 Ca 0.37 0.33 -0.04 0.00 0.70 0.00 0.00 55.95 57.32 3l5x s SER 185 Cb -0.10 0.33 -0.03 0.00 -1.71 0.00 0.00 66.02 64.52 3l5x s SER 185 CO 0.31 -0.06 0.08 -1.48 1.20 0.00 0.00 173.24 173.29 3l5x s LEU 186 N 0.12 1.86 0.05 3.45 0.05 -0.34 -1.10 118.68 122.77 3l5x s LEU 186 Ca -0.00 -0.95 0.05 0.00 0.05 0.00 0.00 54.13 53.28 3l5x s LEU 186 Cb -0.01 0.55 -0.04 0.00 -2.05 0.00 0.00 46.19 44.64 3l5x s LEU 186 CO 0.00 -0.70 -0.09 -0.44 -0.55 0.00 0.00 176.35 174.57 3l5x s SER 187 N -2.94 4.43 -0.09 1.48 0.01 -1.26 0.34 113.70 115.66 3l5x s SER 187 Ca 0.12 -0.28 0.03 0.00 1.31 0.00 0.00 55.95 57.13 3l5x s SER 187 Cb 0.07 -0.92 0.01 0.00 0.21 0.00 0.00 66.02 65.38 3l5x s SER 187 CO -0.06 0.23 -0.19 -0.55 0.41 0.00 0.00 173.24 173.08 3l5x s SER 188 N -1.77 2.54 0.22 2.44 0.15 -0.02 -1.04 113.70 116.22 3l5x s SER 188 Ca 0.19 -0.45 0.05 0.00 0.70 0.00 0.00 55.95 56.44 3l5x s SER 188 Cb -0.11 -1.17 -0.05 0.00 -1.71 0.00 0.00 66.02 62.98 3l5x s SER 188 CO 0.10 0.11 -0.05 0.68 1.20 0.00 0.00 173.24 175.27 3l5x s VAL 189 N 0.48 1.28 -0.11 4.45 -7.23 -0.14 -0.24 120.40 118.90 3l5x s VAL 189 Ca -0.17 -2.08 -0.11 0.00 -1.81 0.00 0.00 61.98 57.81 3l5x s VAL 189 Cb -0.17 -2.23 0.03 0.00 0.56 0.00 0.00 36.38 34.57 3l5x s VAL 189 CO 0.07 -0.44 0.31 0.54 -0.31 0.00 0.00 175.10 175.27 3l5x s VAL 190 N -3.26 0.01 -0.08 1.32 0.11 -0.13 -0.75 120.40 117.61 3l5x s VAL 190 Ca 0.25 -0.05 -0.02 0.00 -2.93 0.00 0.00 61.98 59.23 3l5x s VAL 190 Cb 0.04 -0.46 -0.03 0.00 -1.53 0.00 0.00 36.38 34.39 3l5x s VAL 190 CO 0.07 -0.03 0.03 0.42 -3.33 0.00 0.00 175.10 172.26 3l5x s THR 191 N 0.02 4.51 0.05 5.04 -4.23 -1.12 -1.66 115.64 118.25 3l5x s THR 191 Ca -0.01 -0.20 -0.08 0.00 -1.18 0.00 0.00 61.69 60.21 3l5x s THR 191 Cb -0.03 -2.92 -0.00 0.00 1.34 0.00 0.00 72.50 70.89 3l5x s THR 191 CO 0.01 0.59 0.17 0.68 -0.54 0.00 0.00 174.62 175.52 3l5x s VAL 192 N -0.93 0.12 0.26 2.29 -7.23 -0.14 -4.74 120.40 110.03 3l5x s VAL 192 Ca 0.14 -1.00 -0.30 0.00 -1.81 0.00 0.00 61.98 59.01 3l5x s VAL 192 Cb -0.11 -0.98 -0.10 0.00 0.56 0.00 0.00 36.38 35.74 3l5x s VAL 192 CO 0.03 -0.55 1.42 -2.16 -0.31 0.00 0.00 175.10 173.53 3l5x s PRO 193 N -2.79 4.28 0.47 4.82 0.04 -1.26 -0.02 135.00 140.54 3l5x s PRO 193 Ca -0.03 2.29 0.19 0.00 0.04 0.00 0.00 61.00 63.49 3l5x s PRO 193 Cb -0.00 -3.11 1.19 0.00 0.04 0.00 0.00 34.50 32.63 3l5x s PRO 193 CO -0.05 -0.39 1.97 0.66 0.04 0.00 0.00 177.00 179.23 3l5x h SER 194 N 4.86 0.21 0.14 6.66 4.64 -1.37 0.68 113.55 129.37 3l5x h SER 194 Ca -0.46 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3l5x h SER 194 Cb 1.22 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3l5x h SER 194 CO 0.76 0.12 -0.02 0.77 -0.87 0.00 0.00 176.83 177.59 3l5x h SER 195 N 0.23 0.00 1.53 4.97 4.64 -1.78 -2.28 113.55 120.87 3l5x h SER 195 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3l5x h SER 195 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 3l5x h SER 195 CO -0.06 0.02 -0.09 0.77 -0.87 0.00 0.00 176.83 176.60 3l5x h SER 196 N 0.00 0.00 -0.31 4.97 4.64 -1.15 -3.33 113.55 118.37 3l5x h SER 196 Ca -0.00 -0.02 0.01 0.00 -0.47 0.00 0.00 61.79 61.30 3l5x h SER 196 Cb 0.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.17 3l5x h SER 196 CO 0.00 0.01 0.21 -0.07 -0.87 0.00 0.00 176.83 176.11 3l5x h LEU 197 N 0.00 0.35 0.30 5.97 3.38 -1.51 0.19 115.31 123.99 3l5x h LEU 197 Ca 0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3l5x h LEU 197 Cb 0.81 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.48 3l5x h LEU 197 CO 0.00 0.25 -0.14 1.23 0.09 0.00 0.00 178.44 179.87 3l5x h GLY 198 N 0.41 -0.42 0.84 0.83 0.00 -1.77 -3.40 103.07 99.57 3l5x h GLY 198 Ca 0.12 0.15 -0.32 0.00 0.00 0.00 0.00 47.33 47.28 3l5x h GLY 198 CO -0.03 -0.15 -1.82 2.41 0.00 0.00 0.00 176.54 176.96 3l5x n THR 199 N -5.22 1.69 -4.45 4.70 -1.04 -0.72 -4.95 114.28 104.28 3l5x n THR 199 Ca -0.10 -0.74 -0.34 0.00 -2.04 0.00 0.00 64.05 60.83 3l5x n THR 199 Cb 0.21 -1.34 -0.10 0.00 -1.82 0.00 0.00 70.33 67.28 3l5x n THR 199 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 3l5x s GLN 200 N -2.58 2.98 0.07 -2.82 2.00 -0.02 -5.10 119.66 114.19 3l5x s GLN 200 Ca -0.12 -0.46 -0.23 0.00 -2.00 0.00 0.00 55.36 52.56 3l5x s GLN 200 Cb 0.07 -2.75 -0.06 0.00 0.80 0.00 0.00 33.01 31.07 3l5x s GLN 200 CO 0.80 0.65 0.68 0.99 -0.50 0.00 0.00 175.29 177.91 3l5x s THR 201 N -0.73 4.67 -0.21 -0.34 2.01 -1.26 -4.77 115.64 115.01 3l5x s THR 201 Ca 0.11 1.46 0.01 0.00 0.31 0.00 0.00 61.69 63.58 3l5x s THR 201 Cb -0.11 -4.03 0.05 0.00 0.01 0.00 0.00 72.50 68.42 3l5x s THR 201 CO 0.02 0.47 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.03 3l5x s TYR 202 N -0.64 2.42 -0.08 4.92 1.51 -1.26 -4.95 117.35 119.26 3l5x s TYR 202 Ca 0.34 -1.67 0.02 0.00 -1.01 0.00 0.00 57.07 54.74 3l5x s TYR 202 Cb -0.20 -1.61 0.01 0.00 -0.11 0.00 0.00 41.96 40.05 3l5x s TYR 202 CO 0.22 -0.76 -0.12 0.42 -1.11 0.00 0.00 175.55 174.19 3l5x s ILE 203 N 1.39 1.21 -0.07 2.71 1.01 -1.26 -0.48 121.20 125.72 3l5x s ILE 203 Ca -0.03 -0.50 -0.14 0.00 0.00 0.00 0.00 60.65 59.97 3l5x s ILE 203 Cb -0.17 -1.11 -0.05 0.00 0.01 0.00 0.00 42.46 41.13 3l5x s ILE 203 CO -0.07 0.38 0.37 0.00 0.00 0.00 0.00 174.94 175.62 3l5x s ASN 205 N -0.44 5.27 -0.17 0.00 0.01 0.10 -0.98 114.94 118.73 3l5x s ASN 205 Ca 0.22 -0.97 -0.06 0.00 -0.71 0.00 0.00 52.86 51.34 3l5x s ASN 205 Cb -0.15 -1.88 -0.03 0.00 0.41 0.00 0.00 41.25 39.59 3l5x s ASN 205 CO 0.10 -0.28 0.01 -0.69 -1.51 0.00 0.00 177.10 174.73 3l5x s VAL 206 N 1.45 4.29 -0.12 1.60 1.01 0.60 -1.32 120.40 127.91 3l5x s VAL 206 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.78 3l5x s VAL 206 Cb -0.19 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.30 3l5x s VAL 206 CO 0.03 0.47 -0.13 0.21 0.00 0.00 0.00 175.10 175.67 3l5x s ASN 207 N 0.48 2.42 -0.57 3.32 2.47 -0.36 -0.52 114.94 122.17 3l5x s ASN 207 Ca -0.00 -0.41 0.03 0.00 0.42 0.00 0.00 52.86 52.90 3l5x s ASN 207 Cb -0.13 -1.05 0.14 0.00 -1.45 0.00 0.00 41.25 38.76 3l5x s ASN 207 CO 0.02 -0.03 0.33 -2.28 -3.72 0.00 0.00 177.10 171.42 3l5x s HIS 208 N 1.28 3.29 0.24 0.43 5.65 0.55 -1.49 115.29 125.23 3l5x s HIS 208 Ca -0.01 -3.16 -0.05 0.00 0.25 0.00 0.00 55.06 52.09 3l5x s HIS 208 Cb -0.14 -2.85 0.36 0.00 -1.18 0.00 0.00 32.58 28.77 3l5x s HIS 208 CO -0.06 -0.72 1.82 0.87 -0.65 0.00 0.00 174.74 176.01 3l5x h LYS 209 N 6.34 0.82 -0.84 2.88 1.57 -1.79 -2.21 116.57 123.34 3l5x h LYS 209 Ca -0.03 -0.05 0.22 0.00 -1.87 0.00 0.00 60.65 58.93 3l5x h LYS 209 Cb 0.87 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.95 3l5x h LYS 209 CO 0.70 0.54 0.58 -1.35 -0.57 0.00 0.00 179.45 179.36 3l5x h PRO 210 N 0.84 0.13 -0.25 3.15 0.11 -1.91 0.55 132.00 134.62 3l5x h PRO 210 Ca 0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.48 3l5x h PRO 210 Cb 0.28 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.36 3l5x h PRO 210 CO -0.21 0.08 0.00 -1.13 -0.21 0.00 0.00 178.00 176.53 3l5x n SER 211 N -4.36 2.69 -4.05 -2.05 3.41 -1.03 -4.98 113.62 103.25 3l5x n SER 211 Ca 0.17 -1.81 -0.32 0.00 -0.26 0.00 0.00 58.87 56.65 3l5x n SER 211 Cb 0.82 -0.16 -0.00 0.00 -0.26 0.00 0.00 64.21 64.61 3l5x n SER 211 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3l5x n ASN 212 N 0.74 -3.33 -4.56 4.04 5.03 0.18 -4.91 115.26 112.45 3l5x n ASN 212 Ca 0.11 -0.92 -0.35 0.00 0.87 0.00 0.00 54.58 54.30 3l5x n ASN 212 Cb 0.41 -3.28 -0.11 0.00 -1.02 0.00 0.00 39.78 35.78 3l5x n ASN 212 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3l5x s THR 213 N -3.41 4.42 -0.07 3.41 2.01 -0.88 -5.01 115.64 116.11 3l5x s THR 213 Ca 0.57 -0.16 0.05 0.00 0.31 0.00 0.00 61.69 62.46 3l5x s THR 213 Cb -0.30 -2.99 -0.01 0.00 0.01 0.00 0.00 72.50 69.22 3l5x s THR 213 CO 0.88 0.45 -0.23 -0.54 -0.69 0.00 0.00 174.62 174.49 3l5x s LYS 214 N 0.56 2.56 -0.05 4.92 1.02 -1.26 -0.33 119.74 127.16 3l5x s LYS 214 Ca 0.01 -0.85 0.02 0.00 0.02 0.00 0.00 55.97 55.18 3l5x s LYS 214 Cb -0.13 -2.10 0.01 0.00 -0.52 0.00 0.00 37.83 35.08 3l5x s LYS 214 CO 0.02 0.30 -0.11 0.08 -0.92 0.00 0.00 175.35 174.72 3l5x s VAL 215 N 0.01 0.97 -0.23 3.17 1.01 0.32 -4.99 120.40 120.66 3l5x s VAL 215 Ca -0.08 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.43 3l5x s VAL 215 Cb -0.15 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 3l5x s VAL 215 CO 0.05 0.31 0.02 -1.81 0.00 0.00 0.00 175.10 173.67 3l5x s ASP 216 N 0.51 4.77 -0.24 3.32 1.01 -1.26 -0.29 116.67 124.49 3l5x s ASP 216 Ca -0.10 -0.28 0.01 0.00 0.71 0.00 0.00 52.55 52.89 3l5x s ASP 216 Cb -0.13 -1.84 0.04 0.00 1.01 0.00 0.00 42.92 42.00 3l5x s ASP 216 CO 0.02 -0.02 -0.12 -0.75 0.21 0.00 0.00 175.17 174.52 3l5x s LYS 217 N 1.50 2.61 0.01 8.23 2.47 -0.15 -4.95 119.74 129.46 3l5x s LYS 217 Ca 0.06 -1.11 -0.28 0.00 -1.56 0.00 0.00 55.97 53.08 3l5x s LYS 217 Cb -0.15 -2.84 -0.04 0.00 -1.46 0.00 0.00 37.83 33.34 3l5x s LYS 217 CO 0.01 -0.43 0.90 0.21 0.16 0.00 0.00 175.35 176.20 3l5x s LYS 218 N 1.22 4.56 -0.28 4.03 2.20 -1.26 -0.93 119.74 129.27 3l5x s LYS 218 Ca -0.03 1.29 -0.02 0.00 -0.36 0.00 0.00 55.97 56.85 3l5x s LYS 218 Cb -0.17 -3.43 0.04 0.00 -1.51 0.00 0.00 37.83 32.76 3l5x s LYS 218 CO -0.07 0.05 -0.02 0.08 -0.36 0.00 0.00 175.35 175.03 3l5x s VAL 219 N 0.68 2.95 0.18 4.02 1.01 0.37 -4.97 120.40 124.64 3l5x s VAL 219 Ca 0.47 -1.23 0.08 0.00 0.00 0.00 0.00 61.98 61.30 3l5x s VAL 219 Cb -0.21 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 3l5x s VAL 219 CO 0.26 0.02 -0.07 -1.61 0.00 0.00 0.00 175.10 173.70 3l5x s GLU 220 N 1.28 2.15 0.16 2.72 2.02 -1.26 -4.41 118.70 121.36 3l5x s GLU 220 Ca -0.03 -1.22 -0.31 0.00 0.02 0.00 0.00 54.97 53.42 3l5x s GLU 220 Cb -0.18 -2.21 -0.17 0.00 0.10 0.00 0.00 34.13 31.66 3l5x s GLU 220 CO -0.02 0.44 0.79 -2.30 0.02 0.00 0.00 175.26 174.18 3l5x n PRO 221 N 0.01 0.33 -2.57 0.39 -0.02 -1.26 -4.44 135.00 127.44 3l5x n PRO 221 Ca -0.10 0.12 -0.43 0.00 -2.02 0.00 0.00 63.50 61.06 3l5x n PRO 221 Cb 0.55 -1.34 -0.02 0.00 -0.02 0.00 0.00 33.50 32.67 3l5x n PRO 221 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3l5x s LYS 222 N -0.76 3.60 -0.58 -0.52 2.20 -1.26 -4.93 119.74 117.49 3l5x s LYS 222 Ca 0.70 0.43 -0.26 0.00 -0.36 0.00 0.00 55.97 56.49 3l5x s LYS 222 Cb -0.96 -3.97 -0.10 0.00 -1.51 0.00 0.00 37.83 31.29 3l5x s LYS 222 CO 0.56 -1.56 2.45 0.45 -0.36 0.00 0.00 175.35 176.90 3l5x n SER 223 N 8.25 1.98 -0.68 1.43 2.88 -1.26 -5.11 113.62 121.10 3l5x n SER 223 Ca 0.11 -0.52 0.13 0.00 -1.33 0.00 0.00 58.87 57.26 3l5x n SER 223 Cb 0.49 -1.50 0.34 0.00 -0.75 0.00 0.00 64.21 62.79 3l5x n SER 223 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81