#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hmw s ILE 2 N 0.00 4.91 -0.17 2.12 1.01 -1.26 -5.02 121.20 122.78 3hmw s ILE 2 Ca 0.00 1.64 -0.23 0.00 0.00 0.00 0.00 60.65 62.06 3hmw s ILE 2 Cb 0.00 -4.14 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 3hmw s ILE 2 CO 0.00 0.08 0.71 -1.10 0.00 0.00 0.00 174.94 174.63 3hmw s GLN 3 N 1.80 4.27 -0.25 2.79 -1.52 -1.26 -4.76 119.66 120.72 3hmw s GLN 3 Ca 0.39 0.79 -0.10 0.00 -1.95 0.00 0.00 55.36 54.50 3hmw s GLN 3 Cb -0.17 -3.56 -0.05 0.00 -0.22 0.00 0.00 33.01 29.01 3hmw s GLN 3 CO 0.15 -0.24 0.16 -1.64 -0.25 0.00 0.00 175.29 173.47 3hmw s MET 4 N 1.87 3.98 -0.29 2.91 -1.94 -1.26 -1.44 119.30 123.12 3hmw s MET 4 Ca 0.33 -0.31 0.03 0.00 -1.71 0.00 0.00 55.69 54.03 3hmw s MET 4 Cb -0.16 -3.55 0.08 0.00 2.01 0.00 0.00 34.83 33.21 3hmw s MET 4 CO 0.12 -0.04 -0.02 0.99 -0.01 0.00 0.00 175.02 176.05 3hmw s THR 5 N 1.34 2.08 0.64 2.05 2.01 -0.37 -4.22 115.64 119.18 3hmw s THR 5 Ca 0.07 -1.89 -0.08 0.00 0.31 0.00 0.00 61.69 60.10 3hmw s THR 5 Cb -0.15 -2.37 0.01 0.00 0.01 0.00 0.00 72.50 70.00 3hmw s THR 5 CO 0.07 -0.32 0.99 -1.10 -0.69 0.00 0.00 174.62 173.56 3hmw s GLN 6 N 1.07 2.86 -0.25 4.92 -0.21 -1.26 -2.17 119.66 124.63 3hmw s GLN 6 Ca 0.01 0.17 -0.26 0.00 0.02 0.00 0.00 55.36 55.30 3hmw s GLN 6 Cb -0.19 -2.17 0.12 0.00 1.00 0.00 0.00 33.01 31.77 3hmw s GLN 6 CO -0.07 -0.86 0.98 -1.54 -2.12 0.00 0.00 175.29 171.68 3hmw s SER 7 N -4.34 -0.47 1.19 5.90 1.04 -0.69 -4.67 113.70 111.67 3hmw s SER 7 Ca 0.56 0.82 -0.19 0.00 0.48 0.00 0.00 55.95 57.62 3hmw s SER 7 Cb -0.11 0.81 0.28 0.00 0.10 0.00 0.00 66.02 67.10 3hmw s SER 7 CO 0.48 -0.21 1.11 -2.16 0.98 0.00 0.00 173.24 173.44 3hmw s PRO 8 N -0.07 -1.15 0.39 4.02 0.04 -1.26 -1.62 135.00 135.35 3hmw s PRO 8 Ca 0.01 -0.06 0.21 0.00 0.04 0.00 0.00 61.00 61.21 3hmw s PRO 8 Cb -0.04 -1.60 0.65 0.00 0.04 0.00 0.00 34.50 33.55 3hmw s PRO 8 CO -0.03 -3.67 1.71 0.77 0.04 0.00 0.00 177.00 175.82 3hmw h SER 9 N -2.55 0.00 -4.49 6.66 0.02 -1.87 -3.42 113.55 107.90 3hmw h SER 9 Ca -0.45 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.53 3hmw h SER 9 Cb 1.29 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.62 3hmw h SER 9 CO 0.35 0.30 0.40 -0.94 -1.14 0.00 0.00 176.83 175.80 3hmw s SER 10 N -6.29 -0.48 0.01 3.07 1.04 -1.26 -1.88 113.70 107.91 3hmw s SER 10 Ca 0.02 0.50 -0.15 0.00 0.48 0.00 0.00 55.95 56.80 3hmw s SER 10 Cb 0.09 0.40 0.02 0.00 0.10 0.00 0.00 66.02 66.64 3hmw s SER 10 CO 0.67 -0.46 0.32 -1.48 0.98 0.00 0.00 173.24 173.26 3hmw s LEU 11 N -1.22 0.82 -0.07 2.42 2.34 -0.18 -4.93 118.68 117.86 3hmw s LEU 11 Ca -0.05 -0.02 0.04 0.00 0.06 0.00 0.00 54.13 54.16 3hmw s LEU 11 Cb -0.00 1.34 -0.02 0.00 -0.56 0.00 0.00 46.19 46.95 3hmw s LEU 11 CO 0.04 -0.53 -0.18 -0.55 -1.06 0.00 0.00 176.35 174.07 3hmw s SER 12 N -1.66 3.64 -0.06 1.48 0.15 -1.26 -1.99 113.70 114.00 3hmw s SER 12 Ca -0.10 -0.35 -0.06 0.00 0.70 0.00 0.00 55.95 56.14 3hmw s SER 12 Cb -0.03 -1.01 0.02 0.00 -1.71 0.00 0.00 66.02 63.29 3hmw s SER 12 CO 0.01 0.26 0.17 0.00 1.20 0.00 0.00 173.24 174.88 3hmw s ALA 13 N -0.26 -0.41 0.61 5.45 0.00 -0.90 -4.88 121.76 121.36 3hmw s ALA 13 Ca 0.01 0.42 -0.16 0.00 0.00 0.00 0.00 51.96 52.22 3hmw s ALA 13 Cb -0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 3hmw s ALA 13 CO 0.03 -0.09 1.09 -1.12 0.00 0.00 0.00 175.76 175.66 3hmw s SER 14 N -0.06 5.54 0.33 0.00 0.01 -1.26 -0.83 113.70 117.43 3hmw s SER 14 Ca -0.02 1.94 -0.29 0.00 1.31 0.00 0.00 55.95 58.89 3hmw s SER 14 Cb -0.02 -2.55 -0.11 0.00 0.21 0.00 0.00 66.02 63.55 3hmw s SER 14 CO 0.00 -1.33 1.53 -0.69 0.41 0.00 0.00 173.24 173.16 3hmw s VAL 15 N -2.30 2.09 0.00 3.43 1.01 -1.25 -2.43 120.40 120.96 3hmw s VAL 15 Ca 0.66 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.73 3hmw s VAL 15 Cb -0.19 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.14 3hmw s VAL 15 CO 0.36 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.09 3hmw n GLY 16 N 1.30 0.94 3.90 4.51 0.00 0.86 -4.91 105.19 111.78 3hmw n GLY 16 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 3hmw n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hmw s ASP 17 N -2.92 5.51 -0.11 1.61 -0.00 -1.02 -4.51 116.67 115.23 3hmw s ASP 17 Ca 0.00 0.93 -0.10 0.00 -0.00 0.00 0.00 52.55 53.38 3hmw s ASP 17 Cb 0.00 -1.82 -0.05 0.00 -0.00 0.00 0.00 42.92 41.05 3hmw s ASP 17 CO 0.00 -1.21 0.23 0.00 -0.00 0.00 0.00 175.17 174.19 3hmw s ARG 18 N -5.19 3.78 0.12 8.23 1.70 -1.16 -0.33 118.95 126.10 3hmw s ARG 18 Ca 0.56 0.03 0.10 0.00 -0.47 0.00 0.00 55.73 55.96 3hmw s ARG 18 Cb -0.11 -3.26 -0.04 0.00 -0.57 0.00 0.00 34.95 30.97 3hmw s ARG 18 CO 0.49 0.61 -0.26 0.14 -1.08 0.00 0.00 175.30 175.20 3hmw s VAL 19 N -0.63 2.18 -0.14 4.99 -7.23 0.18 -4.98 120.40 114.77 3hmw s VAL 19 Ca 0.17 -1.70 -0.04 0.00 -1.81 0.00 0.00 61.98 58.59 3hmw s VAL 19 Cb -0.13 -1.93 0.05 0.00 0.56 0.00 0.00 36.38 34.93 3hmw s VAL 19 CO 0.06 0.09 0.09 -0.89 -0.31 0.00 0.00 175.10 174.13 3hmw s THR 20 N -1.05 -0.10 -0.05 5.32 2.01 -1.26 -1.29 115.64 119.22 3hmw s THR 20 Ca 0.13 -0.01 -0.07 0.00 0.31 0.00 0.00 61.69 62.04 3hmw s THR 20 Cb -0.10 -0.47 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 3hmw s THR 20 CO 0.05 -0.17 0.21 -0.63 -0.69 0.00 0.00 174.62 173.40 3hmw s ILE 21 N 2.15 5.39 0.25 1.82 1.01 -0.51 -4.84 121.20 126.47 3hmw s ILE 21 Ca 0.03 0.22 0.10 0.00 0.00 0.00 0.00 60.65 60.99 3hmw s ILE 21 Cb -0.15 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 3hmw s ILE 21 CO -0.08 0.50 -0.04 0.42 0.00 0.00 0.00 174.94 175.74 3hmw s THR 22 N -1.15 3.29 -0.17 2.92 -4.23 -0.64 -0.64 115.64 115.02 3hmw s THR 22 Ca 0.21 -1.92 -0.06 0.00 -1.18 0.00 0.00 61.69 58.74 3hmw s THR 22 Cb -0.13 -2.73 0.08 0.00 1.34 0.00 0.00 72.50 71.06 3hmw s THR 22 CO 0.11 -0.33 0.36 0.00 -0.54 0.00 0.00 174.62 174.22 3hmw s ARG 24 N 2.50 1.95 -0.13 0.00 1.70 -0.92 -0.43 118.95 123.61 3hmw s ARG 24 Ca -0.01 -0.79 -0.06 0.00 -0.47 0.00 0.00 55.73 54.40 3hmw s ARG 24 Cb -0.12 -1.80 -0.04 0.00 -0.57 0.00 0.00 34.95 32.42 3hmw s ARG 24 CO -0.11 0.43 0.08 0.00 -1.08 0.00 0.00 175.30 174.62 3hmw s ALA 25 N -0.37 3.60 0.50 7.88 0.00 -0.10 -1.23 121.76 132.03 3hmw s ALA 25 Ca 0.04 -0.71 0.29 0.00 0.00 0.00 0.00 51.96 51.58 3hmw s ALA 25 Cb -0.10 -1.84 1.66 0.00 0.00 0.00 0.00 23.12 22.84 3hmw s ALA 25 CO 0.00 0.48 2.17 0.66 0.00 0.00 0.00 175.76 179.07 3hmw h SER 26 N 5.54 0.00 -4.19 0.00 4.64 -1.58 -3.43 113.55 114.53 3hmw h SER 26 Ca -0.49 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.53 3hmw h SER 26 Cb 1.20 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.14 3hmw h SER 26 CO 0.61 0.06 -0.70 -1.10 -0.87 0.00 0.00 176.83 174.83 3hmw s GLN 27 N -4.38 1.03 0.22 4.77 -0.21 -1.26 -4.98 119.66 114.85 3hmw s GLN 27 Ca -0.04 -1.45 -0.32 0.00 0.02 0.00 0.00 55.36 53.57 3hmw s GLN 27 Cb 0.14 -0.47 -0.12 0.00 1.00 0.00 0.00 33.01 33.56 3hmw s GLN 27 CO 0.56 0.01 1.68 0.41 -2.12 0.00 0.00 175.29 175.83 3hmw n GLY 28 N -0.18 1.45 0.04 3.09 0.00 -1.26 -4.82 105.19 103.51 3hmw n GLY 28 Ca -0.10 0.59 0.01 0.00 0.00 0.00 0.00 46.02 46.52 3hmw n GLY 28 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3hmw n ILE 29 N 3.50 0.81 0.00 -0.61 -5.35 -0.29 -5.00 119.36 112.41 3hmw n ILE 29 Ca 0.14 -0.86 0.00 0.00 -0.27 0.00 0.00 62.75 61.77 3hmw n ILE 29 Cb 0.35 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 38.77 3hmw n ILE 29 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 3hmw n SER 30 N -0.47 0.00 -0.07 7.28 2.88 -1.19 -1.89 113.62 120.16 3hmw n SER 30 Ca 0.02 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.58 3hmw n SER 30 Cb 0.39 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.87 3hmw n SER 30 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3hmw n SER 31 N 10.43 1.19 -3.45 -3.46 7.64 -1.26 0.72 113.62 125.42 3hmw n SER 31 Ca 0.00 -1.84 -0.40 0.00 1.01 0.00 0.00 58.87 57.64 3hmw n SER 31 Cb 0.00 -0.09 -0.02 0.00 -1.01 0.00 0.00 64.21 63.09 3hmw n SER 31 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 3hmw n TRP 32 N -0.42 2.79 -4.72 1.43 5.03 -0.79 -1.63 117.44 119.13 3hmw n TRP 32 Ca 0.02 -3.05 -0.25 0.00 3.03 0.00 0.00 57.50 57.26 3hmw n TRP 32 Cb 0.44 -2.51 -0.15 0.00 -1.03 0.00 0.00 31.31 28.06 3hmw n TRP 32 CO 0.00 0.00 0.00 -1.17 -0.03 0.00 0.00 177.69 176.49 3hmw s LEU 33 N 0.87 2.12 0.15 -0.99 2.96 -1.26 -1.13 118.68 121.40 3hmw s LEU 33 Ca 0.62 -0.45 0.08 0.00 -0.22 0.00 0.00 54.13 54.16 3hmw s LEU 33 Cb 0.17 -0.94 -0.04 0.00 0.50 0.00 0.00 46.19 45.87 3hmw s LEU 33 CO -0.07 0.18 -0.17 0.00 -1.32 0.00 0.00 176.35 174.97 3hmw s ALA 34 N -0.67 1.84 -0.07 5.97 0.00 0.70 -1.22 121.76 128.30 3hmw s ALA 34 Ca 0.07 -1.42 0.05 0.00 0.00 0.00 0.00 51.96 50.66 3hmw s ALA 34 Cb -0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 3hmw s ALA 34 CO 0.01 0.19 -0.23 -1.58 0.00 0.00 0.00 175.76 174.15 3hmw s TRP 35 N -2.06 2.50 0.16 0.00 0.52 0.32 0.43 118.94 120.82 3hmw s TRP 35 Ca 0.13 -0.69 0.10 0.00 0.02 0.00 0.00 56.10 55.66 3hmw s TRP 35 Cb -0.05 -1.63 -0.04 0.00 -1.15 0.00 0.00 33.47 30.59 3hmw s TRP 35 CO 0.05 -0.20 -0.22 0.71 0.02 0.00 0.00 176.95 177.32 3hmw s TYR 36 N -0.13 2.39 -0.15 -1.98 2.02 0.25 -1.50 117.35 118.26 3hmw s TYR 36 Ca -0.04 -0.33 -0.01 0.00 -0.37 0.00 0.00 57.07 56.32 3hmw s TYR 36 Cb -0.14 -1.23 -0.01 0.00 -0.40 0.00 0.00 41.96 40.18 3hmw s TYR 36 CO 0.04 0.43 -0.12 -1.14 -1.57 0.00 0.00 175.55 173.19 3hmw s GLN 37 N -2.40 3.34 -0.22 -0.62 0.74 0.13 -1.82 119.66 118.82 3hmw s GLN 37 Ca 0.19 -0.69 0.01 0.00 0.05 0.00 0.00 55.36 54.91 3hmw s GLN 37 Cb -0.09 -2.69 0.05 0.00 1.10 0.00 0.00 33.01 31.38 3hmw s GLN 37 CO 0.09 0.10 -0.07 -1.14 -0.55 0.00 0.00 175.29 173.73 3hmw s GLN 38 N 0.64 1.72 0.17 1.67 0.74 -0.81 0.75 119.66 124.54 3hmw s GLN 38 Ca -0.07 -0.89 -0.14 0.00 0.05 0.00 0.00 55.36 54.31 3hmw s GLN 38 Cb -0.15 -2.47 -0.07 0.00 1.10 0.00 0.00 33.01 31.41 3hmw s GLN 38 CO 0.03 -0.53 0.57 0.15 -0.55 0.00 0.00 175.29 174.95 3hmw s LYS 39 N 1.42 3.97 0.18 1.67 1.02 -1.26 -1.85 119.74 124.88 3hmw s LYS 39 Ca -0.04 0.49 -0.32 0.00 0.02 0.00 0.00 55.97 56.12 3hmw s LYS 39 Cb -0.18 -2.87 -0.16 0.00 -0.52 0.00 0.00 37.83 34.10 3hmw s LYS 39 CO -0.07 0.44 1.00 -0.35 -0.92 0.00 0.00 175.35 175.45 3hmw n PRO 40 N 0.61 0.83 -0.92 -1.68 -0.04 -1.26 -0.69 135.00 131.85 3hmw n PRO 40 Ca -0.04 0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 3hmw n PRO 40 Cb 0.52 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 3hmw n PRO 40 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3hmw n GLU 41 N 1.41 -0.59 -4.49 0.54 -0.58 -1.26 -4.98 120.64 110.68 3hmw n GLU 41 Ca 0.15 0.15 -0.24 0.00 -0.42 0.00 0.00 57.16 56.80 3hmw n GLU 41 Cb 0.24 -3.74 -0.10 0.00 -0.57 0.00 0.00 31.44 27.26 3hmw n GLU 41 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3hmw s LYS 42 N -0.76 1.72 0.53 3.49 -0.14 0.13 -5.14 119.74 119.57 3hmw s LYS 42 Ca 0.00 -1.83 -0.11 0.00 -1.36 0.00 0.00 55.97 52.66 3hmw s LYS 42 Cb 0.00 -1.69 -0.05 0.00 -1.68 0.00 0.00 37.83 34.41 3hmw s LYS 42 CO 0.00 0.23 0.92 0.00 -0.76 0.00 0.00 175.35 175.75 3hmw s ALA 43 N -2.59 3.20 0.51 5.17 0.00 -1.26 -4.62 121.76 122.16 3hmw s ALA 43 Ca 0.31 -0.12 -0.23 0.00 0.00 0.00 0.00 51.96 51.92 3hmw s ALA 43 Cb -0.01 -2.92 -0.06 0.00 0.00 0.00 0.00 23.12 20.12 3hmw s ALA 43 CO 0.15 -0.38 1.32 -2.14 0.00 0.00 0.00 175.76 174.71 3hmw s PRO 44 N -4.57 3.38 -0.04 0.00 0.02 -1.26 -4.62 135.00 127.91 3hmw s PRO 44 Ca 0.54 2.16 0.05 0.00 0.02 0.00 0.00 61.00 63.77 3hmw s PRO 44 Cb -0.10 -2.36 -0.02 0.00 0.02 0.00 0.00 34.50 32.03 3hmw s PRO 44 CO 0.42 -0.97 -0.19 0.21 -0.33 0.00 0.00 177.00 176.14 3hmw s LYS 45 N -2.77 2.42 -0.06 5.54 2.20 0.23 -4.92 119.74 122.38 3hmw s LYS 45 Ca 0.68 -0.78 -0.26 0.00 -0.36 0.00 0.00 55.97 55.24 3hmw s LYS 45 Cb -0.38 -2.27 -0.03 0.00 -1.51 0.00 0.00 37.83 33.64 3hmw s LYS 45 CO 0.46 0.57 0.82 -1.12 -0.36 0.00 0.00 175.35 175.73 3hmw s SER 46 N -0.61 7.12 -0.14 1.43 0.01 -1.26 0.21 113.70 120.47 3hmw s SER 46 Ca 0.09 1.36 -0.10 0.00 1.31 0.00 0.00 55.95 58.61 3hmw s SER 46 Cb -0.11 -2.48 -0.06 0.00 0.21 0.00 0.00 66.02 63.58 3hmw s SER 46 CO 0.00 -0.21 -0.23 0.18 0.41 0.00 0.00 173.24 173.39 3hmw n LEU 47 N 4.06 1.41 -3.98 2.44 4.77 -0.56 -4.80 117.00 120.34 3hmw n LEU 47 Ca 0.02 0.24 -0.12 0.00 -0.03 0.00 0.00 56.01 56.12 3hmw n LEU 47 Cb 0.51 -0.55 -0.12 0.00 -2.33 0.00 0.00 43.42 40.92 3hmw n LEU 47 CO 0.49 0.03 -0.38 -0.63 -1.33 0.00 0.00 177.39 175.57 3hmw s ILE 48 N -2.43 0.26 0.16 -0.08 1.01 -1.12 -0.67 121.20 118.33 3hmw s ILE 48 Ca -0.22 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 59.71 3hmw s ILE 48 Cb 0.07 -0.33 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 3hmw s ILE 48 CO 0.30 -0.29 0.09 -0.72 0.00 0.00 0.00 174.94 174.32 3hmw s TYR 49 N -0.99 0.97 -1.60 3.97 1.13 -0.89 -0.52 117.35 119.42 3hmw s TYR 49 Ca -0.09 -1.28 -0.13 0.00 -1.41 0.00 0.00 57.07 54.16 3hmw s TYR 49 Cb -0.07 -0.50 0.11 0.00 -1.10 0.00 0.00 41.96 40.39 3hmw s TYR 49 CO -0.00 -0.57 0.70 0.00 -2.51 0.00 0.00 175.55 173.16 3hmw n ALA 50 N -0.16 -1.48 0.00 9.51 0.00 -0.79 -1.91 120.51 125.68 3hmw n ALA 50 Ca -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3hmw n ALA 50 Cb 0.65 -3.02 0.00 0.00 0.00 0.00 0.00 19.45 17.08 3hmw n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hmw n ALA 51 N -4.43 0.00 0.00 0.00 0.00 -0.36 -4.12 120.51 111.60 3hmw n ALA 51 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3hmw n ALA 51 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 3hmw n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hmw n SER 52 N 1.90 0.55 -4.71 0.00 3.41 -1.12 -4.04 113.62 109.61 3hmw n SER 52 Ca 0.00 -0.10 -0.41 0.00 -0.26 0.00 0.00 58.87 58.10 3hmw n SER 52 Cb 0.00 0.31 -0.03 0.00 -0.26 0.00 0.00 64.21 64.22 3hmw n SER 52 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3hmw s SER 53 N -0.42 7.23 0.10 4.04 1.04 -0.80 -4.50 113.70 120.40 3hmw s SER 53 Ca 0.00 1.50 -0.30 0.00 0.48 0.00 0.00 55.95 57.62 3hmw s SER 53 Cb 0.00 -2.52 -0.06 0.00 0.10 0.00 0.00 66.02 63.54 3hmw s SER 53 CO 0.00 -0.24 1.10 -0.22 0.98 0.00 0.00 173.24 174.85 3hmw s LEU 54 N 1.10 4.43 0.27 2.42 2.96 -1.26 -2.09 118.68 126.50 3hmw s LEU 54 Ca 0.47 1.96 -0.30 0.00 -0.22 0.00 0.00 54.13 56.04 3hmw s LEU 54 Cb -0.20 -3.59 -0.10 0.00 0.50 0.00 0.00 46.19 42.81 3hmw s LEU 54 CO 0.24 -0.29 1.34 -1.10 -1.32 0.00 0.00 176.35 175.21 3hmw s GLN 55 N 0.39 4.35 -0.37 1.98 -1.52 0.15 -4.89 119.66 119.75 3hmw s GLN 55 Ca 0.53 2.18 -0.37 0.00 -1.95 0.00 0.00 55.36 55.74 3hmw s GLN 55 Cb -0.27 -3.12 -0.13 0.00 -0.22 0.00 0.00 33.01 29.26 3hmw s GLN 55 CO 0.31 -0.26 2.17 0.45 -0.25 0.00 0.00 175.29 177.71 3hmw n SER 56 N 1.80 1.87 0.00 5.90 2.88 -1.26 -2.11 113.62 122.70 3hmw n SER 56 Ca 0.04 0.48 0.00 0.00 -1.33 0.00 0.00 58.87 58.06 3hmw n SER 56 Cb 0.42 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 3hmw n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hmw n GLY 57 N 6.67 1.33 3.84 0.46 0.00 -1.26 -5.11 105.19 111.12 3hmw n GLY 57 Ca 0.44 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.08 3hmw n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hmw s VAL 58 N -2.01 5.34 0.41 1.61 0.11 -0.90 -5.06 120.40 119.91 3hmw s VAL 58 Ca 0.00 0.42 -0.24 0.00 -2.93 0.00 0.00 61.98 59.24 3hmw s VAL 58 Cb 0.00 -3.52 -0.12 0.00 -1.53 0.00 0.00 36.38 31.22 3hmw s VAL 58 CO 0.00 0.57 0.78 -0.81 -3.33 0.00 0.00 175.10 172.31 3hmw n PRO 59 N 2.22 0.93 0.06 1.54 -0.04 -1.26 -4.86 135.00 133.59 3hmw n PRO 59 Ca -0.17 0.34 0.06 0.00 -0.04 0.00 0.00 63.50 63.69 3hmw n PRO 59 Cb 0.54 -1.75 0.29 0.00 -0.04 0.00 0.00 33.50 32.53 3hmw n PRO 59 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3hmw n SER 60 N 0.91 0.23 0.03 3.54 3.41 -1.26 -2.51 113.62 117.97 3hmw n SER 60 Ca 0.11 0.58 0.10 0.00 -0.26 0.00 0.00 58.87 59.40 3hmw n SER 60 Cb 0.39 -0.62 0.42 0.00 -0.26 0.00 0.00 64.21 64.13 3hmw n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3hmw n ARG 61 N -1.78 0.05 -3.58 4.33 1.85 -1.26 -4.64 116.66 111.62 3hmw n ARG 61 Ca 0.01 0.21 -0.38 0.00 -1.00 0.00 0.00 57.85 56.69 3hmw n ARG 61 Cb 0.09 -1.57 -0.06 0.00 -1.05 0.00 0.00 32.46 29.87 3hmw n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3hmw s PHE 62 N -3.05 3.69 0.17 2.89 0.08 -1.04 -1.53 117.98 119.18 3hmw s PHE 62 Ca 0.09 0.88 -0.15 0.00 0.12 0.00 0.00 56.93 57.87 3hmw s PHE 62 Cb 0.12 -2.22 0.02 0.00 -0.57 0.00 0.00 43.02 40.36 3hmw s PHE 62 CO 0.37 0.64 0.43 -1.54 -0.10 0.00 0.00 175.22 175.02 3hmw s SER 63 N -0.98 -0.16 -0.21 1.36 1.04 -0.31 -4.98 113.70 109.45 3hmw s SER 63 Ca 0.22 -0.56 -0.06 0.00 0.48 0.00 0.00 55.95 56.03 3hmw s SER 63 Cb -0.16 0.51 0.10 0.00 0.10 0.00 0.00 66.02 66.58 3hmw s SER 63 CO 0.11 -0.97 0.42 -0.83 0.98 0.00 0.00 173.24 172.96 3hmw s GLY 64 N -2.88 -0.40 0.00 7.32 0.00 -1.26 0.13 107.32 110.22 3hmw s GLY 64 Ca 0.10 1.43 0.00 0.00 0.00 0.00 0.00 44.72 46.25 3hmw s GLY 64 CO -0.04 2.51 0.00 -1.14 0.00 0.00 0.00 173.10 174.43 3hmw n SER 65 N 5.39 0.45 0.00 1.64 3.41 -0.46 -3.38 113.62 120.66 3hmw n SER 65 Ca -0.07 -0.97 0.00 0.00 -0.26 0.00 0.00 58.87 57.56 3hmw n SER 65 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 3hmw n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hmw n GLY 66 N 5.00 1.43 3.57 5.00 0.00 -1.26 -2.65 105.19 116.27 3hmw n GLY 66 Ca 0.00 -1.68 -0.09 0.00 0.00 0.00 0.00 46.02 44.25 3hmw n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hmw s SER 67 N -0.47 -0.13 0.00 1.61 1.04 -1.10 -4.87 113.70 109.78 3hmw s SER 67 Ca 0.00 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.65 3hmw s SER 67 Cb 0.00 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.70 3hmw s SER 67 CO 0.00 -1.11 0.00 0.61 0.98 0.00 0.00 173.24 173.72 3hmw n GLY 68 N -0.36 1.28 0.00 7.32 0.00 0.22 -3.25 105.19 110.40 3hmw n GLY 68 Ca -0.05 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.29 3hmw n GLY 68 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3hmw n THR 69 N 0.00 0.00 -4.80 2.61 5.66 -1.26 -1.14 114.28 115.35 3hmw n THR 69 Ca 0.00 -0.05 -0.31 0.00 -3.05 0.00 0.00 64.05 60.64 3hmw n THR 69 Cb 0.00 0.40 -0.17 0.00 -1.55 0.00 0.00 70.33 69.02 3hmw n THR 69 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 3hmw s ASP 70 N -0.92 2.86 0.09 1.09 1.11 -1.20 -0.92 116.67 118.78 3hmw s ASP 70 Ca 0.00 -0.53 0.04 0.00 0.18 0.00 0.00 52.55 52.24 3hmw s ASP 70 Cb 0.00 -1.31 -0.03 0.00 1.07 0.00 0.00 42.92 42.64 3hmw s ASP 70 CO 0.00 0.09 -0.12 -0.36 1.18 0.00 0.00 175.17 175.96 3hmw s PHE 71 N 0.68 1.14 -0.02 4.23 0.40 0.42 -2.72 117.98 122.11 3hmw s PHE 71 Ca -0.12 -0.57 -0.01 0.00 -0.60 0.00 0.00 56.93 55.63 3hmw s PHE 71 Cb -0.16 -0.62 0.02 0.00 0.51 0.00 0.00 43.02 42.76 3hmw s PHE 71 CO 0.02 0.04 0.05 -0.08 0.70 0.00 0.00 175.22 175.95 3hmw s THR 72 N -2.01 -0.04 -0.18 0.64 -1.32 -1.08 -0.14 115.64 111.50 3hmw s THR 72 Ca 0.03 0.13 -0.09 0.00 -1.21 0.00 0.00 61.69 60.55 3hmw s THR 72 Cb -0.06 -0.09 -0.05 0.00 -1.51 0.00 0.00 72.50 70.80 3hmw s THR 72 CO 0.01 0.05 0.12 -0.22 -2.21 0.00 0.00 174.62 172.37 3hmw s LEU 73 N 0.70 4.15 -0.01 9.08 2.96 0.18 -1.35 118.68 134.38 3hmw s LEU 73 Ca -0.06 0.23 0.08 0.00 -0.22 0.00 0.00 54.13 54.16 3hmw s LEU 73 Cb -0.08 -2.06 -0.02 0.00 0.50 0.00 0.00 46.19 44.53 3hmw s LEU 73 CO -0.02 0.21 -0.25 -0.89 -1.32 0.00 0.00 176.35 174.08 3hmw s THR 74 N 0.16 1.99 -0.24 3.68 2.01 0.12 -1.42 115.64 121.94 3hmw s THR 74 Ca 0.08 -1.10 0.02 0.00 0.31 0.00 0.00 61.69 61.00 3hmw s THR 74 Cb -0.11 -1.65 0.05 0.00 0.01 0.00 0.00 72.50 70.79 3hmw s THR 74 CO -0.01 0.54 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.70 3hmw s ILE 75 N -0.61 2.08 -0.00 1.82 1.01 -0.41 -1.16 121.20 123.93 3hmw s ILE 75 Ca 0.10 -1.42 -0.24 0.00 0.00 0.00 0.00 60.65 59.09 3hmw s ILE 75 Cb -0.10 -2.12 -0.17 0.00 0.01 0.00 0.00 42.46 40.09 3hmw s ILE 75 CO -0.01 0.11 1.17 0.77 0.00 0.00 0.00 174.94 176.99 3hmw h SER 76 N 7.83 -0.29 -4.33 3.58 4.64 -1.55 0.53 113.55 123.96 3hmw h SER 76 Ca -0.26 -0.23 -0.64 0.00 -0.47 0.00 0.00 61.79 60.19 3hmw h SER 76 Cb 1.07 0.07 -0.41 0.00 -0.31 0.00 0.00 62.40 62.82 3hmw h SER 76 CO 0.50 0.12 -0.64 -0.55 -0.87 0.00 0.00 176.83 175.39 3hmw s SER 77 N -5.20 4.32 0.18 4.97 0.15 -1.25 -2.99 113.70 113.89 3hmw s SER 77 Ca -0.14 -2.97 -0.33 0.00 0.70 0.00 0.00 55.95 53.21 3hmw s SER 77 Cb 0.02 -1.63 -0.14 0.00 -1.71 0.00 0.00 66.02 62.56 3hmw s SER 77 CO 0.54 -0.24 1.56 -0.11 1.20 0.00 0.00 173.24 176.19 3hmw n LEU 78 N 3.17 3.19 -4.46 3.45 7.94 0.55 -4.66 117.00 126.18 3hmw n LEU 78 Ca 0.05 1.09 -0.24 0.00 -1.11 0.00 0.00 56.01 55.80 3hmw n LEU 78 Cb 0.33 -1.44 -0.10 0.00 0.53 0.00 0.00 43.42 42.73 3hmw n LEU 78 CO 0.33 -0.28 -0.49 -1.10 -1.11 0.00 0.00 177.39 174.75 3hmw s GLN 79 N 0.64 1.64 0.30 1.96 -0.21 -1.26 -0.10 119.66 122.63 3hmw s GLN 79 Ca 0.76 -1.73 0.01 0.00 0.02 0.00 0.00 55.36 54.42 3hmw s GLN 79 Cb -0.66 -1.76 0.53 0.00 1.00 0.00 0.00 33.01 32.12 3hmw s GLN 79 CO 0.40 0.34 1.90 -1.00 -2.12 0.00 0.00 175.29 174.80 3hmw h PRO 80 N 2.42 1.00 0.00 2.91 0.13 -1.91 -1.00 132.00 135.55 3hmw h PRO 80 Ca -0.41 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3hmw h PRO 80 Cb 1.25 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.15 3hmw h PRO 80 CO 0.58 0.66 0.00 0.93 -0.23 0.00 0.00 178.00 179.95 3hmw h GLU 81 N 1.04 0.00 0.00 0.86 3.07 -1.88 -2.04 114.58 115.62 3hmw h GLU 81 Ca 0.41 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 3hmw h GLU 81 Cb 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 3hmw h GLU 81 CO -0.16 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.20 3hmw n ASP 82 N -2.58 0.00 -4.61 1.42 10.43 -0.38 -4.73 116.55 116.10 3hmw n ASP 82 Ca -0.00 -1.12 -0.43 0.00 2.57 0.00 0.00 54.79 55.80 3hmw n ASP 82 Cb 0.15 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.08 3hmw n ASP 82 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 3hmw s PHE 83 N -2.00 1.36 -0.05 1.24 2.19 -0.77 -4.87 117.98 115.09 3hmw s PHE 83 Ca 0.25 0.37 -0.30 0.00 0.33 0.00 0.00 56.93 57.59 3hmw s PHE 83 Cb 0.12 -4.02 0.11 0.00 -1.31 0.00 0.00 43.02 37.92 3hmw s PHE 83 CO 0.20 -4.09 1.33 0.00 1.83 0.00 0.00 175.22 174.49 3hmw s ALA 84 N 7.13 -2.50 -0.10 11.12 0.00 -1.02 -4.75 121.76 131.65 3hmw s ALA 84 Ca 0.93 0.36 0.01 0.00 0.00 0.00 0.00 51.96 53.25 3hmw s ALA 84 Cb -0.32 0.68 -0.02 0.00 0.00 0.00 0.00 23.12 23.46 3hmw s ALA 84 CO 0.35 -1.12 -0.12 -0.08 0.00 0.00 0.00 175.76 174.80 3hmw s THR 85 N -2.10 3.24 -0.12 0.00 -1.32 -0.77 -0.25 115.64 114.31 3hmw s THR 85 Ca 0.24 -0.62 -0.01 0.00 -1.21 0.00 0.00 61.69 60.09 3hmw s THR 85 Cb 0.02 -2.34 -0.02 0.00 -1.51 0.00 0.00 72.50 68.65 3hmw s THR 85 CO -0.03 0.55 -0.08 -0.31 -2.21 0.00 0.00 174.62 172.54 3hmw s TYR 86 N -0.10 2.91 -0.06 9.09 1.51 -0.58 -1.93 117.35 128.18 3hmw s TYR 86 Ca -0.01 -0.35 0.03 0.00 -1.01 0.00 0.00 57.07 55.73 3hmw s TYR 86 Cb -0.14 -1.85 -0.02 0.00 -0.11 0.00 0.00 41.96 39.84 3hmw s TYR 86 CO 0.03 -0.02 -0.15 0.71 -1.11 0.00 0.00 175.55 175.02 3hmw s TYR 87 N 0.07 2.70 0.21 2.71 2.02 -0.75 -1.73 117.35 122.58 3hmw s TYR 87 Ca -0.03 -0.27 0.04 0.00 -0.37 0.00 0.00 57.07 56.44 3hmw s TYR 87 Cb -0.14 -1.66 -0.03 0.00 -0.40 0.00 0.00 41.96 39.73 3hmw s TYR 87 CO 0.04 0.09 0.33 0.00 -1.57 0.00 0.00 175.55 174.44 3hmw s GLN 89 N -3.76 0.12 0.00 0.00 0.74 0.17 -1.75 119.66 115.18 3hmw s GLN 89 Ca 0.34 0.31 -0.12 0.00 0.05 0.00 0.00 55.36 55.94 3hmw s GLN 89 Cb -0.09 -0.09 -0.05 0.00 1.10 0.00 0.00 33.01 33.87 3hmw s GLN 89 CO 0.29 -0.11 0.35 -1.14 -0.55 0.00 0.00 175.29 174.12 3hmw s GLN 90 N 0.78 3.77 -0.21 1.67 -0.44 -0.07 -0.22 119.66 124.95 3hmw s GLN 90 Ca -0.06 0.22 0.23 0.00 -2.50 0.00 0.00 55.36 53.26 3hmw s GLN 90 Cb -0.08 -3.15 0.49 0.00 -1.64 0.00 0.00 33.01 28.64 3hmw s GLN 90 CO -0.04 0.67 1.12 2.48 0.50 0.00 0.00 175.29 180.03 3hmw n TYR 91 N 1.56 1.01 0.11 1.67 4.11 -0.28 -2.49 117.16 122.86 3hmw n TYR 91 Ca -0.13 -1.81 0.08 0.00 -0.00 0.00 0.00 57.90 56.05 3hmw n TYR 91 Cb 0.53 -0.21 0.01 0.00 -0.00 0.00 0.00 39.34 39.66 3hmw n TYR 91 CO 0.00 0.00 0.00 -0.97 -0.00 0.00 0.00 176.86 175.89 3hmw h ASN 92 N 2.28 0.00 -3.51 9.48 -1.24 -1.83 -3.47 115.58 117.29 3hmw h ASN 92 Ca -0.15 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.78 3hmw h ASN 92 Cb 1.40 0.00 -0.24 0.00 0.73 0.00 0.00 38.32 40.21 3hmw h ASN 92 CO 0.17 0.17 -0.13 -0.63 -1.29 0.00 0.00 177.43 175.72 3hmw s ILE 93 N -3.21 -0.01 0.40 2.57 1.01 -1.26 -5.08 121.20 115.62 3hmw s ILE 93 Ca 0.01 0.03 -0.26 0.00 0.00 0.00 0.00 60.65 60.42 3hmw s ILE 93 Cb 0.08 -0.76 -0.09 0.00 0.01 0.00 0.00 42.46 41.70 3hmw s ILE 93 CO 0.77 0.01 1.29 -0.31 0.00 0.00 0.00 174.94 176.70 3hmw s TYR 94 N 0.92 2.86 0.36 3.97 1.51 -1.26 -3.76 117.35 121.95 3hmw s TYR 94 Ca -0.05 1.43 -0.21 0.00 -1.01 0.00 0.00 57.07 57.22 3hmw s TYR 94 Cb -0.05 -3.64 -0.10 0.00 -0.11 0.00 0.00 41.96 38.06 3hmw s TYR 94 CO -0.08 -1.98 0.88 -2.14 -1.11 0.00 0.00 175.55 171.12 3hmw s PRO 95 N -2.21 4.29 0.49 -1.71 0.02 -1.26 -4.89 135.00 129.73 3hmw s PRO 95 Ca 0.56 1.07 -0.23 0.00 0.02 0.00 0.00 61.00 62.43 3hmw s PRO 95 Cb -0.37 -2.48 -0.06 0.00 0.02 0.00 0.00 34.50 31.60 3hmw s PRO 95 CO 0.48 0.14 1.26 0.71 -0.33 0.00 0.00 177.00 179.26 3hmw s TYR 96 N -1.91 2.61 -0.00 6.54 4.12 -1.25 -4.62 117.35 122.85 3hmw s TYR 96 Ca 0.55 1.45 -0.02 0.00 0.02 0.00 0.00 57.07 59.08 3hmw s TYR 96 Cb -0.13 -3.59 -0.00 0.00 -1.52 0.00 0.00 41.96 36.72 3hmw s TYR 96 CO 0.18 -2.16 0.03 0.95 0.02 0.00 0.00 175.55 174.56 3hmw s THR 97 N -1.42 0.05 0.31 -0.71 -4.23 -1.04 -4.99 115.64 103.62 3hmw s THR 97 Ca 0.66 -0.40 0.07 0.00 -1.18 0.00 0.00 61.69 60.84 3hmw s THR 97 Cb -0.34 -0.18 -0.02 0.00 1.34 0.00 0.00 72.50 73.30 3hmw s THR 97 CO 0.42 -0.22 0.38 -0.36 -0.54 0.00 0.00 174.62 174.29 3hmw s PHE 98 N -0.67 3.13 0.26 3.99 0.40 -1.26 -0.89 117.98 122.94 3hmw s PHE 98 Ca -0.07 -0.19 -0.04 0.00 -0.60 0.00 0.00 56.93 56.02 3hmw s PHE 98 Cb -0.05 -1.80 0.06 0.00 0.51 0.00 0.00 43.02 41.74 3hmw s PHE 98 CO -0.00 0.18 0.36 0.41 0.70 0.00 0.00 175.22 176.87 3hmw n GLY 99 N -1.48 -1.24 0.00 4.36 0.00 -0.72 -4.35 105.19 101.76 3hmw n GLY 99 Ca -0.03 -1.68 0.13 0.00 0.00 0.00 0.00 46.02 44.44 3hmw n GLY 99 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hmw n GLN 100 N -1.76 0.01 0.00 1.61 3.00 -1.26 -4.84 117.38 114.14 3hmw n GLN 100 Ca 0.04 -0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 3hmw n GLN 100 Cb 0.15 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 28.89 3hmw n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hmw n GLY 101 N 1.50 -2.65 3.00 1.08 0.00 -1.26 -5.00 105.19 101.85 3hmw n GLY 101 Ca 0.06 -1.41 -0.23 0.00 0.00 0.00 0.00 46.02 44.44 3hmw n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hmw s THR 102 N -3.25 0.97 -0.18 2.61 -4.23 -0.70 -4.81 115.64 106.04 3hmw s THR 102 Ca 0.00 -0.40 -0.29 0.00 -1.18 0.00 0.00 61.69 59.82 3hmw s THR 102 Cb 0.00 -0.89 0.00 0.00 1.34 0.00 0.00 72.50 72.95 3hmw s THR 102 CO 0.00 0.31 1.03 -0.54 -0.54 0.00 0.00 174.62 174.89 3hmw s LYS 103 N 0.60 4.32 -0.33 3.99 -0.14 -0.79 -1.53 119.74 125.87 3hmw s LYS 103 Ca -0.12 1.38 -0.10 0.00 -1.36 0.00 0.00 55.97 55.78 3hmw s LYS 103 Cb -0.14 -3.60 0.01 0.00 -1.68 0.00 0.00 37.83 32.41 3hmw s LYS 103 CO 0.02 -0.50 0.16 -1.17 -0.76 0.00 0.00 175.35 173.10 3hmw s LEU 104 N 2.72 4.29 0.19 3.17 0.20 0.66 -1.01 118.68 128.90 3hmw s LEU 104 Ca 0.46 -0.73 0.07 0.00 0.69 0.00 0.00 54.13 54.62 3hmw s LEU 104 Cb -0.17 -1.99 -0.04 0.00 -0.43 0.00 0.00 46.19 43.57 3hmw s LEU 104 CO 0.11 -0.26 0.04 -1.83 -0.29 0.00 0.00 176.35 174.12 3hmw s GLU 105 N 1.57 2.52 -0.14 1.98 1.03 -0.84 -2.43 118.70 122.39 3hmw s GLU 105 Ca 0.03 -1.10 -0.14 0.00 0.03 0.00 0.00 54.97 53.79 3hmw s GLU 105 Cb -0.18 -2.40 -0.05 0.00 -0.80 0.00 0.00 34.13 30.70 3hmw s GLU 105 CO 0.06 0.44 0.31 0.42 -1.33 0.00 0.00 175.26 175.16 3hmw s ILE 106 N -1.85 5.28 -0.11 1.83 -1.09 -1.26 -2.12 121.20 121.89 3hmw s ILE 106 Ca 0.29 0.59 -0.14 0.00 -2.23 0.00 0.00 60.65 59.15 3hmw s ILE 106 Cb -0.09 -3.64 -0.05 0.00 -1.58 0.00 0.00 42.46 37.10 3hmw s ILE 106 CO 0.20 0.41 0.35 -0.75 -1.23 0.00 0.00 174.94 173.92 3hmw s LYS 107 N 0.29 4.12 0.32 2.79 2.20 -0.01 -4.85 119.74 124.60 3hmw s LYS 107 Ca 0.18 0.23 -0.02 0.00 -0.36 0.00 0.00 55.97 56.00 3hmw s LYS 107 Cb -0.13 -3.36 -0.01 0.00 -1.51 0.00 0.00 37.83 32.82 3hmw s LYS 107 CO 0.05 0.38 0.42 -0.98 -0.36 0.00 0.00 175.35 174.86 3hmw s ARG 108 N -0.01 1.79 0.76 4.03 1.70 -1.26 -3.80 118.95 122.15 3hmw s ARG 108 Ca 0.20 -1.73 -0.13 0.00 -0.47 0.00 0.00 55.73 53.60 3hmw s ARG 108 Cb -0.14 0.41 0.05 0.00 -0.57 0.00 0.00 34.95 34.70 3hmw s ARG 108 CO 0.08 -0.72 1.13 0.95 -1.08 0.00 0.00 175.30 175.66 3hmw s THR 109 N -3.30 2.85 0.29 4.99 -4.23 -1.26 -4.96 115.64 110.02 3hmw s THR 109 Ca 0.32 0.34 -0.29 0.00 -1.18 0.00 0.00 61.69 60.88 3hmw s THR 109 Cb 0.01 -2.76 -0.10 0.00 1.34 0.00 0.00 72.50 70.98 3hmw s THR 109 CO 0.19 -0.30 1.25 -0.69 -0.54 0.00 0.00 174.62 174.54 3hmw s VAL 110 N -2.50 3.03 -0.05 2.29 1.01 -1.26 -4.83 120.40 118.09 3hmw s VAL 110 Ca 0.67 0.99 0.01 0.00 0.00 0.00 0.00 61.98 63.64 3hmw s VAL 110 Cb -0.22 -3.63 0.02 0.00 0.00 0.00 0.00 36.38 32.56 3hmw s VAL 110 CO 0.50 0.22 -0.04 0.00 0.00 0.00 0.00 175.10 175.77 3hmw s ALA 111 N -0.85 0.68 0.53 5.51 0.00 -0.26 -4.93 121.76 122.44 3hmw s ALA 111 Ca 0.50 -0.07 -0.18 0.00 0.00 0.00 0.00 51.96 52.21 3hmw s ALA 111 Cb -0.37 -0.46 -0.06 0.00 0.00 0.00 0.00 23.12 22.22 3hmw s ALA 111 CO 0.46 -0.07 1.04 0.00 0.00 0.00 0.00 175.76 177.20 3hmw s ALA 112 N 1.04 2.83 0.39 0.00 0.00 -1.26 -0.98 121.76 123.78 3hmw s ALA 112 Ca -0.09 0.49 -0.24 0.00 0.00 0.00 0.00 51.96 52.12 3hmw s ALA 112 Cb -0.14 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 3hmw s ALA 112 CO -0.01 -0.52 1.01 -2.14 0.00 0.00 0.00 175.76 174.10 3hmw s PRO 113 N -3.65 4.25 -0.26 0.00 0.02 -1.26 -4.51 135.00 129.59 3hmw s PRO 113 Ca 0.65 1.39 -0.11 0.00 0.02 0.00 0.00 61.00 62.96 3hmw s PRO 113 Cb -0.16 -2.51 -0.05 0.00 0.02 0.00 0.00 34.50 31.80 3hmw s PRO 113 CO 0.28 -0.04 0.17 -1.12 -0.33 0.00 0.00 177.00 175.96 3hmw s SER 114 N -1.71 6.03 -0.15 2.53 0.01 -0.74 -4.86 113.70 114.81 3hmw s SER 114 Ca 0.57 0.03 -0.06 0.00 1.31 0.00 0.00 55.95 57.81 3hmw s SER 114 Cb -0.19 -2.11 -0.04 0.00 0.21 0.00 0.00 66.02 63.90 3hmw s SER 114 CO 0.24 -0.00 0.06 -0.69 0.41 0.00 0.00 173.24 173.25 3hmw s VAL 115 N 1.48 4.78 0.05 3.43 1.01 -1.26 -0.64 120.40 129.25 3hmw s VAL 115 Ca 0.07 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.04 3hmw s VAL 115 Cb -0.15 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 3hmw s VAL 115 CO 0.08 0.52 -0.11 -0.36 0.00 0.00 0.00 175.10 175.24 3hmw s PHE 116 N -0.15 0.90 -0.02 5.22 0.08 -0.15 -4.96 117.98 118.91 3hmw s PHE 116 Ca 0.07 -0.47 0.03 0.00 0.12 0.00 0.00 56.93 56.68 3hmw s PHE 116 Cb -0.12 -0.52 -0.00 0.00 -0.57 0.00 0.00 43.02 41.80 3hmw s PHE 116 CO 0.01 -0.02 -0.12 -1.50 -0.10 0.00 0.00 175.22 173.49 3hmw s ILE 117 N -1.30 0.95 -0.16 0.64 2.07 -1.26 0.10 121.20 122.24 3hmw s ILE 117 Ca -0.06 -0.49 0.01 0.00 -1.41 0.00 0.00 60.65 58.70 3hmw s ILE 117 Cb -0.10 -0.81 0.01 0.00 0.13 0.00 0.00 42.46 41.69 3hmw s ILE 117 CO 0.01 0.28 -0.19 -0.36 -1.91 0.00 0.00 174.94 172.77 3hmw s PHE 118 N -0.09 2.75 1.23 3.50 0.08 -0.42 -5.02 117.98 120.01 3hmw s PHE 118 Ca 0.01 -1.40 -0.16 0.00 0.12 0.00 0.00 56.93 55.51 3hmw s PHE 118 Cb -0.07 -1.89 0.30 0.00 -0.57 0.00 0.00 43.02 40.80 3hmw s PHE 118 CO 0.00 -0.67 1.01 -2.14 -0.10 0.00 0.00 175.22 173.32 3hmw s PRO 119 N 1.06 -1.42 0.43 0.24 0.02 -1.26 -2.72 135.00 131.35 3hmw s PRO 119 Ca -0.01 0.56 -0.25 0.00 0.02 0.00 0.00 61.00 61.33 3hmw s PRO 119 Cb -0.14 -1.52 -0.08 0.00 0.02 0.00 0.00 34.50 32.78 3hmw s PRO 119 CO -0.06 -3.98 1.26 -2.14 -0.33 0.00 0.00 177.00 171.74 3hmw s PRO 120 N -4.69 3.83 0.53 5.54 0.02 -1.24 -4.77 135.00 134.22 3hmw s PRO 120 Ca 0.68 2.03 -0.19 0.00 0.02 0.00 0.00 61.00 63.55 3hmw s PRO 120 Cb -0.21 -2.61 -0.06 0.00 0.02 0.00 0.00 34.50 31.64 3hmw s PRO 120 CO 0.62 -0.57 1.09 -1.54 -0.33 0.00 0.00 177.00 176.28 3hmw s SER 121 N -0.96 5.90 0.20 2.53 1.04 -1.26 -4.95 113.70 116.20 3hmw s SER 121 Ca 0.60 2.06 -0.12 0.00 0.48 0.00 0.00 55.95 58.98 3hmw s SER 121 Cb -0.35 -2.57 0.13 0.00 0.10 0.00 0.00 66.02 63.33 3hmw s SER 121 CO 0.44 -1.09 1.86 0.44 0.98 0.00 0.00 173.24 175.87 3hmw h ASP 122 N 1.21 0.74 -0.33 7.02 3.45 -2.00 -2.61 116.42 123.90 3hmw h ASP 122 Ca -0.49 -0.01 -0.00 0.00 0.43 0.00 0.00 57.03 56.95 3hmw h ASP 122 Cb 1.24 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.82 3hmw h ASP 122 CO 0.57 0.53 0.20 1.05 -1.57 0.00 0.00 179.24 180.02 3hmw h GLU 123 N 0.87 0.45 -0.56 3.56 9.09 -1.99 -2.94 114.58 123.06 3hmw h GLU 123 Ca 0.25 -0.04 0.04 0.00 0.05 0.00 0.00 59.36 59.66 3hmw h GLU 123 Cb -0.07 -0.09 -0.04 0.00 -1.65 0.00 0.00 28.75 26.89 3hmw h GLU 123 CO -0.07 0.35 0.31 0.37 0.05 0.00 0.00 179.01 180.02 3hmw h GLN 124 N 0.42 0.59 -0.44 1.06 4.15 -1.83 -2.13 115.11 116.94 3hmw h GLN 124 Ca 0.12 -0.04 0.11 0.00 0.77 0.00 0.00 58.65 59.61 3hmw h GLN 124 Cb 0.02 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 3hmw h GLN 124 CO -0.02 0.39 0.31 -0.07 -1.93 0.00 0.00 178.83 177.51 3hmw h LEU 125 N 0.61 0.10 -1.76 -2.39 3.38 -1.29 0.56 115.31 114.52 3hmw h LEU 125 Ca 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 3hmw h LEU 125 Cb 0.10 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3hmw h LEU 125 CO -0.14 0.06 -0.05 0.11 0.09 0.00 0.00 178.44 178.51 3hmw h LYS 126 N 0.11 0.00 -0.25 1.13 1.57 -1.30 -2.40 116.57 115.43 3hmw h LYS 126 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3hmw h LYS 126 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3hmw h LYS 126 CO -0.02 0.05 0.00 -1.13 -0.57 0.00 0.00 179.45 177.78 3hmw n SER 127 N -3.21 1.96 0.00 0.86 3.41 0.19 -4.92 113.62 111.92 3hmw n SER 127 Ca -0.00 -1.81 0.00 0.00 -0.26 0.00 0.00 58.87 56.79 3hmw n SER 127 Cb 0.27 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 3hmw n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hmw n GLY 128 N 1.17 0.76 3.29 5.00 0.00 -0.90 -5.04 105.19 109.46 3hmw n GLY 128 Ca 0.16 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 3hmw n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hmw s THR 129 N -2.78 1.45 -0.11 2.61 -4.23 -1.24 -1.72 115.64 109.62 3hmw s THR 129 Ca 0.00 -2.02 -0.03 0.00 -1.18 0.00 0.00 61.69 58.45 3hmw s THR 129 Cb 0.00 -1.84 0.05 0.00 1.34 0.00 0.00 72.50 72.05 3hmw s THR 129 CO 0.00 -0.58 0.07 0.00 -0.54 0.00 0.00 174.62 173.56 3hmw s ALA 130 N -2.83 0.40 -0.19 3.99 0.00 -0.68 -3.16 121.76 119.30 3hmw s ALA 130 Ca 0.17 -0.12 -0.03 0.00 0.00 0.00 0.00 51.96 51.98 3hmw s ALA 130 Cb -0.01 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.24 3hmw s ALA 130 CO 0.04 -0.85 -0.06 -1.12 0.00 0.00 0.00 175.76 173.77 3hmw s SER 131 N 2.12 4.28 -0.25 0.00 0.01 -1.26 -1.09 113.70 117.50 3hmw s SER 131 Ca 0.03 -0.35 -0.05 0.00 1.31 0.00 0.00 55.95 56.89 3hmw s SER 131 Cb -0.14 -1.71 -0.00 0.00 0.21 0.00 0.00 66.02 64.37 3hmw s SER 131 CO -0.06 0.04 0.01 0.54 0.41 0.00 0.00 173.24 174.18 3hmw s VAL 132 N 1.11 3.65 -0.12 3.43 0.11 -0.56 -3.69 120.40 124.33 3hmw s VAL 132 Ca 0.01 -0.58 -0.03 0.00 -2.93 0.00 0.00 61.98 58.45 3hmw s VAL 132 Cb -0.15 -2.77 -0.03 0.00 -1.53 0.00 0.00 36.38 31.90 3hmw s VAL 132 CO -0.01 0.26 -0.02 0.54 -3.33 0.00 0.00 175.10 172.54 3hmw s VAL 133 N 1.49 4.05 -0.18 2.04 0.11 -1.10 -1.08 120.40 125.72 3hmw s VAL 133 Ca 0.04 -0.32 -0.06 0.00 -2.93 0.00 0.00 61.98 58.71 3hmw s VAL 133 Cb -0.16 -2.73 -0.03 0.00 -1.53 0.00 0.00 36.38 31.93 3hmw s VAL 133 CO -0.00 0.54 0.02 0.00 -3.33 0.00 0.00 175.10 172.33 3hmw s LEU 135 N 0.51 3.38 -0.36 0.00 2.96 0.28 -1.40 118.68 124.06 3hmw s LEU 135 Ca 0.01 -0.20 -0.12 0.00 -0.22 0.00 0.00 54.13 53.59 3hmw s LEU 135 Cb -0.13 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.67 3hmw s LEU 135 CO 0.02 -0.00 0.23 -0.76 -1.32 0.00 0.00 176.35 174.51 3hmw s LEU 136 N 1.41 4.59 -0.20 -0.68 1.02 -0.43 -0.97 118.68 123.43 3hmw s LEU 136 Ca 0.05 -0.67 -0.06 0.00 0.02 0.00 0.00 54.13 53.48 3hmw s LEU 136 Cb -0.15 -2.09 -0.03 0.00 0.02 0.00 0.00 46.19 43.95 3hmw s LEU 136 CO 0.03 -0.30 0.02 0.21 0.02 0.00 0.00 176.35 176.32 3hmw s ASN 137 N 1.65 5.02 -0.73 2.29 2.47 0.18 -1.48 114.94 124.35 3hmw s ASN 137 Ca 0.05 -0.14 -0.02 0.00 0.42 0.00 0.00 52.86 53.17 3hmw s ASN 137 Cb -0.18 -1.86 0.00 0.00 -1.45 0.00 0.00 41.25 37.76 3hmw s ASN 137 CO 0.09 0.09 0.68 0.59 -3.72 0.00 0.00 177.10 174.82 3hmw n ASN 138 N 4.08 -7.34 -4.33 -4.21 3.02 -0.32 -1.80 115.26 104.37 3hmw n ASN 138 Ca -0.17 -0.17 -0.18 0.00 -0.03 0.00 0.00 54.58 54.03 3hmw n ASN 138 Cb 0.52 -4.73 -0.10 0.00 -0.61 0.00 0.00 39.78 34.86 3hmw n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3hmw s PHE 139 N -2.95 1.66 -0.17 3.10 -0.12 0.23 -4.52 117.98 115.19 3hmw s PHE 139 Ca 0.02 -0.57 -0.15 0.00 -0.05 0.00 0.00 56.93 56.17 3hmw s PHE 139 Cb -0.01 -0.79 0.05 0.00 -0.63 0.00 0.00 43.02 41.64 3hmw s PHE 139 CO 0.78 0.32 0.46 -0.47 -0.05 0.00 0.00 175.22 176.25 3hmw s TYR 140 N -2.82 -0.52 0.00 3.49 6.14 -0.15 -1.33 117.35 122.16 3hmw s TYR 140 Ca 0.20 1.24 0.00 0.00 0.64 0.00 0.00 57.07 59.15 3hmw s TYR 140 Cb -0.01 0.19 0.00 0.00 0.42 0.00 0.00 41.96 42.55 3hmw s TYR 140 CO 0.06 -0.25 0.00 -0.35 0.64 0.00 0.00 175.55 175.65 3hmw n PRO 141 N 2.97 -0.26 0.09 4.97 -0.04 -1.26 -1.10 135.00 140.37 3hmw n PRO 141 Ca -0.14 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.26 3hmw n PRO 141 Cb 0.57 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 34.10 3hmw n PRO 141 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 3hmw h ARG 142 N 0.00 0.15 -5.78 0.54 9.65 -1.99 -3.44 114.38 113.52 3hmw h ARG 142 Ca 0.00 -0.13 -0.50 0.00 -1.10 0.00 0.00 59.98 58.25 3hmw h ARG 142 Cb 0.00 0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 28.61 3hmw h ARG 142 CO 0.00 0.82 1.55 -1.83 2.80 0.00 0.00 179.97 183.30 3hmw s GLU 143 N -3.46 2.44 0.04 0.20 1.03 -1.26 -4.94 118.70 112.76 3hmw s GLU 143 Ca -0.03 1.42 0.03 0.00 0.03 0.00 0.00 54.97 56.42 3hmw s GLU 143 Cb 0.11 -4.49 -0.02 0.00 -0.80 0.00 0.00 34.13 28.93 3hmw s GLU 143 CO 0.80 -2.89 -0.09 0.00 -1.33 0.00 0.00 175.26 171.75 3hmw s ALA 144 N 10.71 0.68 -0.19 -0.84 0.00 -1.26 -4.63 121.76 126.22 3hmw s ALA 144 Ca 0.93 -0.74 -0.01 0.00 0.00 0.00 0.00 51.96 52.15 3hmw s ALA 144 Cb -0.20 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 22.92 3hmw s ALA 144 CO 0.27 0.04 -0.14 0.21 0.00 0.00 0.00 175.76 176.14 3hmw s LYS 145 N -1.39 3.12 -0.11 0.00 2.20 -0.77 -5.00 119.74 117.78 3hmw s LYS 145 Ca -0.07 -0.76 -0.04 0.00 -0.36 0.00 0.00 55.97 54.74 3hmw s LYS 145 Cb -0.09 -2.73 -0.03 0.00 -1.51 0.00 0.00 37.83 33.47 3hmw s LYS 145 CO 0.01 -0.21 0.03 0.08 -0.36 0.00 0.00 175.35 174.90 3hmw s VAL 146 N 1.36 4.54 -0.06 4.02 1.01 -1.26 -0.98 120.40 129.02 3hmw s VAL 146 Ca 0.05 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 61.89 3hmw s VAL 146 Cb -0.13 -2.95 0.02 0.00 0.00 0.00 0.00 36.38 33.31 3hmw s VAL 146 CO -0.10 0.57 -0.08 -1.10 0.00 0.00 0.00 175.10 174.40 3hmw s GLN 147 N -0.56 1.29 -0.17 2.72 -0.21 -0.22 -4.94 119.66 117.56 3hmw s GLN 147 Ca 0.10 -0.25 -0.15 0.00 0.02 0.00 0.00 55.36 55.08 3hmw s GLN 147 Cb -0.12 -1.18 -0.04 0.00 1.00 0.00 0.00 33.01 32.66 3hmw s GLN 147 CO 0.02 -0.06 0.34 -1.58 -2.12 0.00 0.00 175.29 171.88 3hmw s TRP 148 N 0.94 3.44 -0.05 0.91 0.52 -1.26 0.46 118.94 123.91 3hmw s TRP 148 Ca -0.10 0.63 0.05 0.00 0.02 0.00 0.00 56.10 56.70 3hmw s TRP 148 Cb -0.15 -2.41 -0.02 0.00 -1.15 0.00 0.00 33.47 29.75 3hmw s TRP 148 CO 0.00 0.17 -0.21 0.15 0.02 0.00 0.00 176.95 177.08 3hmw s LYS 149 N 0.70 2.48 -0.08 4.98 1.02 0.25 -1.29 119.74 127.80 3hmw s LYS 149 Ca 0.18 -0.84 0.02 0.00 0.02 0.00 0.00 55.97 55.35 3hmw s LYS 149 Cb -0.14 -2.22 0.01 0.00 -0.52 0.00 0.00 37.83 34.96 3hmw s LYS 149 CO 0.06 0.49 -0.13 0.54 -0.92 0.00 0.00 175.35 175.39 3hmw s VAL 150 N -0.40 1.20 -1.54 3.17 0.11 -0.90 -1.59 120.40 120.45 3hmw s VAL 150 Ca 0.04 -0.50 -0.15 0.00 -2.93 0.00 0.00 61.98 58.43 3hmw s VAL 150 Cb -0.12 -1.11 0.13 0.00 -1.53 0.00 0.00 36.38 33.75 3hmw s VAL 150 CO 0.02 0.37 0.71 0.47 -3.33 0.00 0.00 175.10 173.34 3hmw n ASP 151 N 3.96 -3.56 0.00 3.54 8.00 0.02 -1.28 116.55 127.22 3hmw n ASP 151 Ca -0.21 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.51 3hmw n ASP 151 Cb 0.52 -2.92 0.00 0.00 -0.02 0.00 0.00 41.12 38.70 3hmw n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3hmw n ASN 152 N -2.54 0.00 -4.69 -2.24 5.15 -1.26 -4.98 115.26 104.70 3hmw n ASN 152 Ca 0.05 0.00 -0.39 0.00 -0.60 0.00 0.00 54.58 53.64 3hmw n ASN 152 Cb 0.51 -0.58 -0.06 0.00 -0.53 0.00 0.00 39.78 39.12 3hmw n ASN 152 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hmw s ALA 153 N -2.85 3.48 0.53 5.20 0.00 -0.41 -4.99 121.76 122.72 3hmw s ALA 153 Ca 0.00 -0.16 -0.22 0.00 0.00 0.00 0.00 51.96 51.58 3hmw s ALA 153 Cb 0.00 -2.88 -0.05 0.00 0.00 0.00 0.00 23.12 20.19 3hmw s ALA 153 CO 0.00 -0.30 1.34 -1.17 0.00 0.00 0.00 175.76 175.62 3hmw s LEU 154 N 1.31 3.88 -0.00 0.00 1.98 -1.26 -2.12 118.68 122.46 3hmw s LEU 154 Ca 0.30 2.71 0.01 0.00 -2.89 0.00 0.00 54.13 54.26 3hmw s LEU 154 Cb -0.16 -4.26 -0.04 0.00 0.66 0.00 0.00 46.19 42.39 3hmw s LEU 154 CO 0.12 -1.48 0.02 -1.10 -1.89 0.00 0.00 176.35 172.02 3hmw s GLN 155 N -2.87 2.85 -0.30 1.98 -1.52 -0.41 -4.92 119.66 114.48 3hmw s GLN 155 Ca 0.70 -0.58 0.02 0.00 -1.95 0.00 0.00 55.36 53.56 3hmw s GLN 155 Cb -0.39 -2.72 0.08 0.00 -0.22 0.00 0.00 33.01 29.77 3hmw s GLN 155 CO 0.46 0.63 0.01 -1.12 -0.25 0.00 0.00 175.29 175.02 3hmw s SER 156 N -1.58 4.38 -1.13 5.90 0.01 -1.26 -4.77 113.70 115.25 3hmw s SER 156 Ca 0.20 -1.71 -0.03 0.00 1.31 0.00 0.00 55.95 55.71 3hmw s SER 156 Cb -0.12 -1.38 0.00 0.00 0.21 0.00 0.00 66.02 64.74 3hmw s SER 156 CO 0.11 -0.32 0.96 0.61 0.41 0.00 0.00 173.24 175.01 3hmw n GLY 157 N 4.48 -0.32 0.36 3.44 0.00 -1.26 -4.91 105.19 106.98 3hmw n GLY 157 Ca -0.04 0.09 0.03 0.00 0.00 0.00 0.00 46.02 46.10 3hmw n GLY 157 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hmw n ASN 158 N -2.75 2.31 -3.89 1.61 2.85 -1.26 -4.99 115.26 109.14 3hmw n ASN 158 Ca -0.15 -1.81 -0.17 0.00 -0.11 0.00 0.00 54.58 52.34 3hmw n ASN 158 Cb 0.61 -0.11 -0.15 0.00 1.24 0.00 0.00 39.78 41.37 3hmw n ASN 158 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 3hmw s SER 159 N -0.89 0.59 0.05 1.20 1.04 -1.26 -3.13 113.70 111.29 3hmw s SER 159 Ca 0.13 -0.08 -0.03 0.00 0.48 0.00 0.00 55.95 56.45 3hmw s SER 159 Cb 0.07 -0.20 -0.05 0.00 0.10 0.00 0.00 66.02 65.94 3hmw s SER 159 CO 0.09 -0.02 0.26 0.00 0.98 0.00 0.00 173.24 174.55 3hmw s GLN 160 N 0.48 3.52 0.01 4.02 0.00 -0.62 -4.88 119.66 122.19 3hmw s GLN 160 Ca -0.05 -0.24 0.05 0.00 -0.00 0.00 0.00 55.36 55.12 3hmw s GLN 160 Cb -0.09 -3.02 -0.02 0.00 0.00 0.00 0.00 33.01 29.89 3hmw s GLN 160 CO -0.01 0.60 -0.16 -2.00 0.00 0.00 0.00 175.29 173.73 3hmw s GLU 161 N -2.22 1.18 0.00 9.60 2.12 -1.26 -0.41 118.70 127.72 3hmw s GLU 161 Ca 0.33 -0.68 0.00 0.00 0.36 0.00 0.00 54.97 54.98 3hmw s GLU 161 Cb -0.13 -1.18 -0.00 0.00 0.26 0.00 0.00 34.13 33.08 3hmw s GLU 161 CO 0.22 0.31 -0.01 0.45 -0.54 0.00 0.00 175.26 175.69 3hmw s SER 162 N -0.74 0.16 0.06 -1.70 0.15 -0.24 -4.98 113.70 106.42 3hmw s SER 162 Ca 0.05 -0.05 0.05 0.00 0.70 0.00 0.00 55.95 56.70 3hmw s SER 162 Cb -0.07 -0.01 -0.03 0.00 -1.71 0.00 0.00 66.02 64.20 3hmw s SER 162 CO 0.00 0.00 -0.15 0.54 1.20 0.00 0.00 173.24 174.84 3hmw s VAL 163 N -0.10 1.15 0.89 4.45 0.11 -1.26 0.23 120.40 125.87 3hmw s VAL 163 Ca -0.00 -1.17 -0.13 0.00 -2.93 0.00 0.00 61.98 57.75 3hmw s VAL 163 Cb -0.01 -1.07 0.16 0.00 -1.53 0.00 0.00 36.38 33.93 3hmw s VAL 163 CO -0.00 -0.10 1.24 0.42 -3.33 0.00 0.00 175.10 173.33 3hmw s THR 164 N -1.06 2.04 0.41 5.04 -4.23 0.05 -4.99 115.64 112.88 3hmw s THR 164 Ca 0.00 -0.09 -0.13 0.00 -1.18 0.00 0.00 61.69 60.29 3hmw s THR 164 Cb -0.09 -2.94 -0.07 0.00 1.34 0.00 0.00 72.50 70.73 3hmw s THR 164 CO 0.02 0.00 0.80 -1.61 -0.54 0.00 0.00 174.62 173.29 3hmw s GLU 165 N -5.71 3.87 0.16 3.99 0.41 -1.26 -4.73 118.70 115.43 3hmw s GLU 165 Ca 0.70 0.61 -0.33 0.00 -0.41 0.00 0.00 54.97 55.54 3hmw s GLU 165 Cb -0.06 -2.35 -0.16 0.00 -1.78 0.00 0.00 34.13 29.78 3hmw s GLU 165 CO 0.51 -0.04 1.07 1.04 -0.49 0.00 0.00 175.26 177.35 3hmw n GLN 166 N -1.14 0.90 -2.17 1.61 6.02 -1.26 -4.78 117.38 116.57 3hmw n GLN 166 Ca 0.03 0.32 -0.41 0.00 -0.01 0.00 0.00 57.00 56.93 3hmw n GLN 166 Cb 0.54 -1.75 -0.03 0.00 1.02 0.00 0.00 30.24 30.02 3hmw n GLN 166 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3hmw s ASP 167 N -0.15 6.84 0.12 1.08 2.15 0.01 -4.79 116.67 121.93 3hmw s ASP 167 Ca 0.73 2.51 0.15 0.00 0.43 0.00 0.00 52.55 56.36 3hmw s ASP 167 Cb -0.90 -2.62 0.66 0.00 -0.30 0.00 0.00 42.92 39.76 3hmw s ASP 167 CO 0.54 -0.55 1.45 -1.54 -0.17 0.00 0.00 175.17 174.90 3hmw n SER 168 N 2.17 0.27 -0.03 -0.34 3.41 -1.26 -0.87 113.62 116.97 3hmw n SER 168 Ca 0.05 0.59 -0.04 0.00 -0.26 0.00 0.00 58.87 59.21 3hmw n SER 168 Cb 0.42 -0.64 -0.04 0.00 -0.26 0.00 0.00 64.21 63.70 3hmw n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3hmw n LYS 169 N -1.83 1.23 -0.01 4.33 5.02 -1.26 -2.82 118.16 122.82 3hmw n LYS 169 Ca 0.01 0.02 0.01 0.00 -2.02 0.00 0.00 58.31 56.33 3hmw n LYS 169 Cb 0.12 -1.14 0.01 0.00 -0.02 0.00 0.00 35.03 34.01 3hmw n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3hmw n ASP 170 N -2.52 1.96 -3.46 4.39 3.85 -1.22 -4.92 116.55 114.64 3hmw n ASP 170 Ca -0.11 -1.88 -0.25 0.00 -0.71 0.00 0.00 54.79 51.83 3hmw n ASP 170 Cb 0.64 -0.02 0.02 0.00 -1.35 0.00 0.00 41.12 40.41 3hmw n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 3hmw n SER 171 N -0.35 -4.78 -4.67 -1.12 7.64 -0.05 -4.88 113.62 105.41 3hmw n SER 171 Ca 0.01 -0.49 -0.25 0.00 1.01 0.00 0.00 58.87 59.15 3hmw n SER 171 Cb 0.24 -3.87 -0.07 0.00 -1.01 0.00 0.00 64.21 59.49 3hmw n SER 171 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3hmw s THR 172 N -3.12 3.70 0.31 0.44 2.01 -1.26 -4.60 115.64 113.12 3hmw s THR 172 Ca 0.47 -1.58 0.08 0.00 0.31 0.00 0.00 61.69 60.97 3hmw s THR 172 Cb -0.23 -2.91 -0.04 0.00 0.01 0.00 0.00 72.50 69.33 3hmw s THR 172 CO 0.58 -0.22 0.19 -0.31 -0.69 0.00 0.00 174.62 174.17 3hmw s TYR 173 N -1.95 2.85 -0.11 4.92 2.02 -0.44 -0.81 117.35 123.83 3hmw s TYR 173 Ca 0.29 -0.28 -0.10 0.00 -0.37 0.00 0.00 57.07 56.61 3hmw s TYR 173 Cb -0.08 -1.60 0.03 0.00 -0.40 0.00 0.00 41.96 39.90 3hmw s TYR 173 CO 0.20 0.35 0.28 -1.12 -1.57 0.00 0.00 175.55 173.69 3hmw s SER 174 N -3.88 -0.30 0.03 2.29 0.01 -1.26 -0.61 113.70 109.99 3hmw s SER 174 Ca 0.37 0.57 0.02 0.00 1.31 0.00 0.00 55.95 58.22 3hmw s SER 174 Cb -0.05 0.57 -0.02 0.00 0.21 0.00 0.00 66.02 66.73 3hmw s SER 174 CO 0.24 -0.10 -0.06 -1.48 0.41 0.00 0.00 173.24 172.25 3hmw s LEU 175 N 0.20 2.22 -0.19 2.44 0.05 -0.55 -0.77 118.68 122.08 3hmw s LEU 175 Ca -0.00 -0.47 -0.02 0.00 0.05 0.00 0.00 54.13 53.68 3hmw s LEU 175 Cb -0.02 -0.12 -0.01 0.00 -2.05 0.00 0.00 46.19 43.99 3hmw s LEU 175 CO -0.00 -0.19 -0.09 -0.94 -0.55 0.00 0.00 176.35 174.58 3hmw s SER 176 N -1.35 4.03 -0.32 1.48 1.04 0.14 -1.31 113.70 117.41 3hmw s SER 176 Ca -0.09 -0.42 -0.10 0.00 0.48 0.00 0.00 55.95 55.82 3hmw s SER 176 Cb -0.09 -1.66 -0.01 0.00 0.10 0.00 0.00 66.02 64.36 3hmw s SER 176 CO 0.00 0.03 0.17 -0.55 0.98 0.00 0.00 173.24 173.87 3hmw s SER 177 N 1.16 5.65 -0.29 7.02 0.15 -0.49 -1.08 113.70 125.82 3hmw s SER 177 Ca 0.02 -0.52 -0.06 0.00 0.70 0.00 0.00 55.95 56.09 3hmw s SER 177 Cb -0.14 -2.03 0.01 0.00 -1.71 0.00 0.00 66.02 62.15 3hmw s SER 177 CO -0.03 -0.21 0.07 -0.89 1.20 0.00 0.00 173.24 173.38 3hmw s THR 178 N 1.63 3.83 -0.36 6.45 2.01 0.46 -0.59 115.64 129.06 3hmw s THR 178 Ca 0.05 -0.77 -0.18 0.00 0.31 0.00 0.00 61.69 61.09 3hmw s THR 178 Cb -0.17 -2.99 0.00 0.00 0.01 0.00 0.00 72.50 69.35 3hmw s THR 178 CO 0.07 0.07 0.53 -0.22 -0.69 0.00 0.00 174.62 174.38 3hmw s LEU 179 N 1.47 4.39 -0.17 4.42 2.96 -0.24 -1.59 118.68 129.92 3hmw s LEU 179 Ca 0.02 -0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 53.80 3hmw s LEU 179 Cb -0.17 -2.60 -0.02 0.00 0.50 0.00 0.00 46.19 43.90 3hmw s LEU 179 CO 0.02 -0.52 -0.04 0.28 -1.32 0.00 0.00 176.35 174.76 3hmw s THR 180 N 2.44 3.71 0.40 3.68 -1.32 -1.18 -1.50 115.64 121.86 3hmw s THR 180 Ca 0.19 -0.41 0.04 0.00 -1.21 0.00 0.00 61.69 60.29 3hmw s THR 180 Cb -0.15 -2.63 -0.03 0.00 -1.51 0.00 0.00 72.50 68.18 3hmw s THR 180 CO 0.14 0.48 0.12 -0.76 -2.21 0.00 0.00 174.62 172.38 3hmw s LEU 181 N 0.63 2.01 0.30 9.08 1.43 -0.25 -4.96 118.68 126.92 3hmw s LEU 181 Ca -0.03 -1.64 -0.07 0.00 -1.03 0.00 0.00 54.13 51.36 3hmw s LEU 181 Cb -0.15 -0.14 -0.06 0.00 0.03 0.00 0.00 46.19 45.87 3hmw s LEU 181 CO 0.02 -0.89 0.60 -0.94 0.23 0.00 0.00 176.35 175.37 3hmw s SER 182 N -3.60 6.51 0.48 2.29 1.04 -1.26 -1.69 113.70 117.48 3hmw s SER 182 Ca 0.25 0.86 0.26 0.00 0.48 0.00 0.00 55.95 57.80 3hmw s SER 182 Cb 0.03 -2.20 1.32 0.00 0.10 0.00 0.00 66.02 65.27 3hmw s SER 182 CO 0.14 -0.21 1.86 0.50 0.98 0.00 0.00 173.24 176.51 3hmw h LYS 183 N 1.79 0.17 0.43 4.02 3.64 -1.57 -0.24 116.57 124.81 3hmw h LYS 183 Ca -0.47 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 3hmw h LYS 183 Cb 1.18 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 3hmw h LYS 183 CO 0.66 0.11 -0.21 0.00 -2.27 0.00 0.00 179.45 177.74 3hmw h ALA 184 N 1.57 -1.16 0.00 5.00 0.00 -1.93 -1.96 119.26 120.78 3hmw h ALA 184 Ca 0.47 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 3hmw h ALA 184 Cb 1.58 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.59 3hmw h ALA 184 CO -0.10 -1.11 -0.04 0.22 0.00 0.00 0.00 179.25 178.22 3hmw h ASP 185 N -0.58 0.00 -0.51 0.00 3.58 -1.84 -2.44 116.42 114.63 3hmw h ASP 185 Ca -0.06 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.34 3hmw h ASP 185 Cb 0.45 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 3hmw h ASP 185 CO 0.10 0.04 0.12 0.22 -2.88 0.00 0.00 179.24 176.84 3hmw h TYR 186 N 0.00 0.86 -0.12 0.28 3.20 -0.94 -2.99 116.97 117.26 3hmw h TYR 186 Ca -0.00 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 61.72 3hmw h TYR 186 Cb 0.08 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 3hmw h TYR 186 CO 0.00 0.76 -0.15 0.93 -1.64 0.00 0.00 178.16 178.07 3hmw h GLU 187 N 0.71 0.19 -0.24 1.82 4.39 -0.84 -3.09 114.58 117.52 3hmw h GLU 187 Ca 0.16 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.78 3hmw h GLU 187 Cb 0.33 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 3hmw h GLU 187 CO 0.00 0.34 -0.02 0.87 -1.16 0.00 0.00 179.01 179.04 3hmw h LYS 188 N 0.18 0.36 -6.23 2.33 1.57 -1.52 -3.44 116.57 109.82 3hmw h LYS 188 Ca 0.04 -0.07 -0.55 0.00 -1.87 0.00 0.00 60.65 58.20 3hmw h LYS 188 Cb 0.37 -0.06 -0.08 0.00 0.08 0.00 0.00 32.23 32.55 3hmw h LYS 188 CO 0.02 0.41 -0.60 -1.01 -0.57 0.00 0.00 179.45 177.70 3hmw s HIS 189 N -4.93 2.92 -0.07 -1.35 3.76 -1.17 -5.09 115.29 109.37 3hmw s HIS 189 Ca -0.06 -0.14 -0.08 0.00 -0.15 0.00 0.00 55.06 54.62 3hmw s HIS 189 Cb 0.16 -1.34 -0.03 0.00 1.11 0.00 0.00 32.58 32.49 3hmw s HIS 189 CO 0.74 0.55 -0.15 1.17 -0.85 0.00 0.00 174.74 176.20 3hmw n LYS 190 N -0.79 0.23 -3.21 1.40 4.81 -1.26 -4.85 118.16 114.49 3hmw n LYS 190 Ca -0.08 0.09 -0.40 0.00 -0.87 0.00 0.00 58.31 57.06 3hmw n LYS 190 Cb 0.57 -0.86 -0.07 0.00 0.02 0.00 0.00 35.03 34.70 3hmw n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3hmw s VAL 191 N -1.94 5.06 -0.14 3.15 1.01 -1.26 -1.93 120.40 124.35 3hmw s VAL 191 Ca -0.13 0.96 -0.00 0.00 0.00 0.00 0.00 61.98 62.82 3hmw s VAL 191 Cb 0.02 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 3hmw s VAL 191 CO 0.19 0.11 -0.14 -0.31 0.00 0.00 0.00 175.10 174.95 3hmw s TYR 192 N 2.11 2.80 -0.08 5.22 2.02 -0.58 -0.80 117.35 128.04 3hmw s TYR 192 Ca 0.23 -0.83 -0.11 0.00 -0.37 0.00 0.00 57.07 56.00 3hmw s TYR 192 Cb -0.16 -1.87 0.02 0.00 -0.40 0.00 0.00 41.96 39.56 3hmw s TYR 192 CO 0.09 -0.34 0.27 0.00 -1.57 0.00 0.00 175.55 174.01 3hmw s ALA 193 N 0.60 -0.68 -0.09 3.71 0.00 -0.62 -0.67 121.76 124.01 3hmw s ALA 193 Ca -0.08 0.62 0.04 0.00 0.00 0.00 0.00 51.96 52.54 3hmw s ALA 193 Cb -0.16 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 3hmw s ALA 193 CO 0.03 -0.16 -0.22 0.00 0.00 0.00 0.00 175.76 175.41 3hmw s GLU 195 N 0.12 3.46 -0.22 0.00 2.12 0.17 -2.02 118.70 122.33 3hmw s GLU 195 Ca -0.11 -0.60 -0.08 0.00 0.36 0.00 0.00 54.97 54.55 3hmw s GLU 195 Cb -0.16 -3.26 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 3hmw s GLU 195 CO 0.06 -0.25 0.07 0.08 -0.54 0.00 0.00 175.26 174.69 3hmw s VAL 196 N 1.56 4.57 -0.11 3.70 1.01 0.41 -1.06 120.40 130.48 3hmw s VAL 196 Ca 0.05 -0.10 -0.02 0.00 0.00 0.00 0.00 61.98 61.92 3hmw s VAL 196 Cb -0.15 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 3hmw s VAL 196 CO 0.02 0.38 -0.04 -0.89 0.00 0.00 0.00 175.10 174.57 3hmw s THR 197 N 1.10 3.90 -0.04 3.92 2.01 -0.15 -2.05 115.64 124.32 3hmw s THR 197 Ca 0.04 -0.38 -0.25 0.00 0.31 0.00 0.00 61.69 61.41 3hmw s THR 197 Cb -0.14 -2.65 0.05 0.00 0.01 0.00 0.00 72.50 69.77 3hmw s THR 197 CO 0.03 0.56 0.55 -2.28 -0.69 0.00 0.00 174.62 172.79 3hmw s HIS 198 N -0.33 -0.49 0.35 4.92 2.46 -1.26 -1.84 115.29 119.09 3hmw s HIS 198 Ca 0.05 0.85 0.09 0.00 0.47 0.00 0.00 55.06 56.53 3hmw s HIS 198 Cb -0.12 0.30 0.83 0.00 -0.13 0.00 0.00 32.58 33.45 3hmw s HIS 198 CO 0.02 -0.52 1.84 0.37 -2.47 0.00 0.00 174.74 173.98 3hmw h GLN 199 N 3.39 0.66 0.00 2.88 4.15 -1.92 0.15 115.11 124.41 3hmw h GLN 199 Ca -0.28 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.10 3hmw h GLN 199 Cb 1.15 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.69 3hmw h GLN 199 CO 0.38 0.44 0.00 0.41 -1.93 0.00 0.00 178.83 178.13 3hmw n GLY 200 N -1.42 -0.94 3.61 2.39 0.00 -1.26 -4.69 105.19 102.88 3hmw n GLY 200 Ca 0.19 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 3hmw n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hmw s LEU 201 N -2.57 3.72 0.44 0.99 1.43 0.52 -4.57 118.68 118.63 3hmw s LEU 201 Ca 0.19 0.05 0.20 0.00 -1.03 0.00 0.00 54.13 53.53 3hmw s LEU 201 Cb 0.13 -1.93 1.00 0.00 0.03 0.00 0.00 46.19 45.42 3hmw s LEU 201 CO 0.30 0.17 1.90 0.77 0.23 0.00 0.00 176.35 179.73 3hmw h SER 202 N 6.70 0.00 -5.00 2.29 4.64 -1.84 -3.44 113.55 116.90 3hmw h SER 202 Ca -0.36 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.89 3hmw h SER 202 Cb 1.17 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.07 3hmw h SER 202 CO 0.69 0.26 0.12 -0.94 -0.87 0.00 0.00 176.83 176.09 3hmw s SER 203 N -6.49 -0.59 -0.08 4.97 1.04 -1.26 -5.13 113.70 106.16 3hmw s SER 203 Ca -0.02 0.62 -0.35 0.00 0.48 0.00 0.00 55.95 56.68 3hmw s SER 203 Cb 0.13 0.51 -0.13 0.00 0.10 0.00 0.00 66.02 66.63 3hmw s SER 203 CO 0.66 -0.59 1.81 -2.65 0.98 0.00 0.00 173.24 173.45 3hmw n PRO 204 N 0.95 2.00 -3.53 4.02 -0.02 -1.26 -4.95 135.00 132.21 3hmw n PRO 204 Ca -0.19 0.73 -0.37 0.00 -2.02 0.00 0.00 63.50 61.64 3hmw n PRO 204 Cb 0.57 -2.54 -0.06 0.00 -0.02 0.00 0.00 33.50 31.45 3hmw n PRO 204 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hmw s VAL 205 N 3.48 5.17 -0.07 -1.45 0.11 -0.87 -4.90 120.40 121.87 3hmw s VAL 205 Ca 0.91 0.71 0.02 0.00 -2.93 0.00 0.00 61.98 60.70 3hmw s VAL 205 Cb -0.75 -3.67 0.01 0.00 -1.53 0.00 0.00 36.38 30.44 3hmw s VAL 205 CO 0.52 0.51 -0.11 0.28 -3.33 0.00 0.00 175.10 172.96 3hmw s THR 206 N -0.48 1.08 -0.17 5.04 -1.32 -1.26 -0.44 115.64 118.08 3hmw s THR 206 Ca 0.21 -0.44 -0.05 0.00 -1.21 0.00 0.00 61.69 60.20 3hmw s THR 206 Cb -0.15 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.81 3hmw s THR 206 CO 0.10 0.34 -0.00 -0.54 -2.21 0.00 0.00 174.62 172.31 3hmw s LYS 207 N 0.73 3.74 0.04 7.08 -0.14 -0.86 -4.97 119.74 125.37 3hmw s LYS 207 Ca -0.13 -0.47 0.00 0.00 -1.36 0.00 0.00 55.97 54.01 3hmw s LYS 207 Cb -0.16 -3.03 -0.03 0.00 -1.68 0.00 0.00 37.83 32.93 3hmw s LYS 207 CO 0.03 0.20 -0.05 -1.54 -0.76 0.00 0.00 175.35 173.23 3hmw s SER 208 N 0.52 0.57 0.04 2.83 1.04 -1.26 -1.84 113.70 115.59 3hmw s SER 208 Ca -0.01 -0.72 -0.00 0.00 0.48 0.00 0.00 55.95 55.69 3hmw s SER 208 Cb -0.14 0.11 -0.03 0.00 0.10 0.00 0.00 66.02 66.06 3hmw s SER 208 CO 0.02 -0.39 -0.03 0.72 0.98 0.00 0.00 173.24 174.54 3hmw s PHE 209 N -2.44 0.45 -0.17 5.02 -0.71 0.15 -4.99 117.98 115.29 3hmw s PHE 209 Ca -0.04 -0.82 -0.08 0.00 -1.04 0.00 0.00 56.93 54.95 3hmw s PHE 209 Cb -0.03 -0.32 -0.04 0.00 -1.21 0.00 0.00 43.02 41.42 3hmw s PHE 209 CO -0.04 -0.28 0.09 -0.80 -1.34 0.00 0.00 175.22 172.86 3hmw s ASN 210 N -2.29 5.91 0.29 1.98 -0.87 -1.26 -1.53 114.94 117.17 3hmw s ASN 210 Ca -0.03 0.20 -0.30 0.00 -1.57 0.00 0.00 52.86 51.16 3hmw s ASN 210 Cb -0.00 -1.98 -0.12 0.00 -0.02 0.00 0.00 41.25 39.12 3hmw s ASN 210 CO -0.06 0.23 1.51 -1.14 -2.57 0.00 0.00 177.10 175.08 3hmw n ARG 211 N 3.16 2.47 -3.44 -0.60 0.63 -0.81 -3.32 116.66 114.75 3hmw n ARG 211 Ca -0.17 0.88 -0.19 0.00 -0.92 0.00 0.00 57.85 57.45 3hmw n ARG 211 Cb 0.53 -2.61 0.08 0.00 0.45 0.00 0.00 32.46 30.91 3hmw n ARG 211 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3hmw n GLY 212 N 1.92 -0.39 2.90 5.14 0.00 -1.26 -5.01 105.19 108.49 3hmw n GLY 212 Ca 0.08 0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 3hmw n GLY 212 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hmw s GLU 213 N -5.64 1.40 0.00 1.61 2.02 -1.21 -5.30 118.70 111.59 3hmw s GLU 213 Ca 0.19 -1.01 0.19 0.00 0.02 0.00 0.00 54.97 54.36 3hmw s GLU 213 Cb -0.08 -2.52 1.12 0.00 0.10 0.00 0.00 34.13 32.75 3hmw s GLU 213 CO 0.71 -0.67 1.52 0.00 0.02 0.00 0.00 175.26 176.83