#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mlw n VAL 2 N 0.00 1.76 -3.93 5.09 0.24 -1.26 -4.76 118.33 115.48 3mlw n VAL 2 Ca 0.00 -0.44 -0.10 0.00 -2.04 0.00 0.00 64.34 61.76 3mlw n VAL 2 Cb 0.00 -1.09 -0.10 0.00 -1.47 0.00 0.00 33.84 31.18 3mlw n VAL 2 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 3mlw s GLN 3 N -1.34 0.49 -0.20 7.34 -0.21 -1.20 -5.01 119.66 119.53 3mlw s GLN 3 Ca 0.61 -0.63 0.01 0.00 0.02 0.00 0.00 55.36 55.38 3mlw s GLN 3 Cb -0.70 0.19 0.03 0.00 1.00 0.00 0.00 33.01 33.53 3mlw s GLN 3 CO 0.58 -0.11 -0.18 -0.51 -2.12 0.00 0.00 175.29 172.95 3mlw s LEU 4 N -1.76 2.42 -0.10 2.90 1.43 -1.26 -2.90 118.68 119.40 3mlw s LEU 4 Ca -0.10 -0.82 -0.01 0.00 -1.03 0.00 0.00 54.13 52.17 3mlw s LEU 4 Cb -0.05 -1.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.65 3mlw s LEU 4 CO -0.02 -0.04 -0.07 0.68 0.23 0.00 0.00 176.35 177.13 3mlw s VAL 5 N 1.25 3.65 0.18 -1.59 -7.23 -0.55 -4.19 120.40 111.90 3mlw s VAL 5 Ca 0.02 -0.48 0.06 0.00 -1.81 0.00 0.00 61.98 59.78 3mlw s VAL 5 Cb -0.15 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 3mlw s VAL 5 CO -0.11 0.55 0.06 -1.10 -0.31 0.00 0.00 175.10 174.20 3mlw s GLN 6 N -0.26 2.63 1.04 4.82 -0.21 -1.26 -0.32 119.66 126.10 3mlw s GLN 6 Ca 0.04 -1.02 -0.12 0.00 0.02 0.00 0.00 55.36 54.28 3mlw s GLN 6 Cb -0.13 -2.48 0.21 0.00 1.00 0.00 0.00 33.01 31.62 3mlw s GLN 6 CO 0.03 0.46 1.07 -1.54 -2.12 0.00 0.00 175.29 173.19 3mlw s SER 7 N -3.08 2.06 1.02 5.90 1.04 -0.81 -4.97 113.70 114.86 3mlw s SER 7 Ca 0.29 1.58 -0.15 0.00 0.48 0.00 0.00 55.95 58.16 3mlw s SER 7 Cb -0.09 -2.26 0.20 0.00 0.10 0.00 0.00 66.02 63.96 3mlw s SER 7 CO 0.21 -3.54 1.16 -0.83 0.98 0.00 0.00 173.24 171.21 3mlw s GLY 8 N -2.86 1.61 0.36 7.32 0.00 -1.26 -4.65 107.32 107.84 3mlw s GLY 8 Ca 0.67 -0.75 -0.28 0.00 0.00 0.00 0.00 44.72 44.35 3mlw s GLY 8 CO 0.61 -0.05 1.50 0.00 0.00 0.00 0.00 173.10 175.16 3mlw s ALA 9 N -3.27 3.60 -0.11 3.20 0.00 -1.26 -4.76 121.76 119.16 3mlw s ALA 9 Ca 0.68 1.57 0.00 0.00 0.00 0.00 0.00 51.96 54.22 3mlw s ALA 9 Cb -0.12 -3.62 0.02 0.00 0.00 0.00 0.00 23.12 19.41 3mlw s ALA 9 CO 0.55 -1.04 -0.11 -1.21 0.00 0.00 0.00 175.76 173.95 3mlw s GLU 10 N -1.82 1.78 -0.20 0.00 0.41 0.07 -4.99 118.70 113.95 3mlw s GLU 10 Ca 0.54 -0.37 -0.04 0.00 -0.41 0.00 0.00 54.97 54.69 3mlw s GLU 10 Cb -0.47 -1.69 -0.02 0.00 -1.78 0.00 0.00 34.13 30.17 3mlw s GLU 10 CO 0.61 -0.19 -0.02 0.08 -0.49 0.00 0.00 175.26 175.24 3mlw s VAL 11 N 1.41 3.72 0.27 2.63 1.01 -1.26 -1.02 120.40 127.16 3mlw s VAL 11 Ca 0.00 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.61 3mlw s VAL 11 Cb -0.13 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 3mlw s VAL 11 CO -0.06 0.44 0.14 -0.54 0.00 0.00 0.00 175.10 175.07 3mlw s LYS 12 N 1.06 1.46 0.13 2.72 -0.14 -0.22 -5.00 119.74 119.76 3mlw s LYS 12 Ca 0.01 -1.81 0.04 0.00 -1.36 0.00 0.00 55.97 52.85 3mlw s LYS 12 Cb -0.14 -0.07 -0.04 0.00 -1.68 0.00 0.00 37.83 35.89 3mlw s LYS 12 CO 0.01 -0.39 0.16 0.15 -0.76 0.00 0.00 175.35 174.52 3mlw s LYS 13 N -3.94 3.05 0.52 1.68 3.01 -1.26 -1.65 119.74 121.14 3mlw s LYS 13 Ca 0.37 -0.74 -0.22 0.00 -1.01 0.00 0.00 55.97 54.37 3mlw s LYS 13 Cb 0.06 -2.76 -0.07 0.00 -1.01 0.00 0.00 37.83 34.06 3mlw s LYS 13 CO 0.15 0.52 1.21 0.00 0.51 0.00 0.00 175.35 177.74 3mlw n ALA 14 N -0.16 1.04 0.00 5.17 0.00 -0.56 -2.50 120.51 123.50 3mlw n ALA 14 Ca -0.08 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3mlw n ALA 14 Cb 0.54 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.74 3mlw n ALA 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mlw n GLY 15 N 0.94 2.98 3.75 0.00 0.00 0.07 -4.91 105.19 108.02 3mlw n GLY 15 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 3mlw n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mlw s GLU 16 N -0.18 1.82 0.21 1.61 2.02 -1.04 -4.28 118.70 118.86 3mlw s GLU 16 Ca 0.00 0.91 0.06 0.00 0.02 0.00 0.00 54.97 55.96 3mlw s GLU 16 Cb 0.00 -1.87 -0.04 0.00 0.10 0.00 0.00 34.13 32.33 3mlw s GLU 16 CO 0.00 -1.87 0.17 0.45 0.02 0.00 0.00 175.26 174.03 3mlw s SER 17 N -3.52 5.53 -0.22 -0.19 0.15 -1.24 0.10 113.70 114.31 3mlw s SER 17 Ca 0.62 -0.19 -0.27 0.00 0.70 0.00 0.00 55.95 56.81 3mlw s SER 17 Cb -0.17 -1.43 0.08 0.00 -1.71 0.00 0.00 66.02 62.80 3mlw s SER 17 CO 0.56 0.01 0.79 -0.22 1.20 0.00 0.00 173.24 175.58 3mlw s LEU 18 N -3.49 -0.65 0.07 3.45 2.96 -0.82 -4.98 118.68 115.22 3mlw s LEU 18 Ca 0.32 1.13 0.07 0.00 -0.22 0.00 0.00 54.13 55.43 3mlw s LEU 18 Cb -0.09 2.34 -0.03 0.00 0.50 0.00 0.00 46.19 48.91 3mlw s LEU 18 CO 0.24 -0.31 -0.20 -1.83 -1.32 0.00 0.00 176.35 172.93 3mlw s GLU 19 N -0.06 1.26 0.03 1.98 4.04 -1.26 -0.83 118.70 123.86 3mlw s GLU 19 Ca -0.02 -1.02 0.06 0.00 0.04 0.00 0.00 54.97 54.03 3mlw s GLU 19 Cb -0.04 -1.43 -0.02 0.00 0.02 0.00 0.00 34.13 32.67 3mlw s GLU 19 CO 0.02 0.35 -0.16 0.96 -1.84 0.00 0.00 175.26 174.58 3mlw s ILE 20 N -0.94 1.31 0.17 1.83 -4.36 -0.82 -4.98 121.20 113.41 3mlw s ILE 20 Ca 0.07 -1.02 0.07 0.00 -0.26 0.00 0.00 60.65 59.51 3mlw s ILE 20 Cb -0.09 -1.15 -0.04 0.00 1.25 0.00 0.00 42.46 42.42 3mlw s ILE 20 CO 0.03 0.12 -0.01 -0.94 0.24 0.00 0.00 174.94 174.38 3mlw s SER 21 N -1.04 4.74 -0.20 4.36 1.04 -1.26 -1.88 113.70 119.45 3mlw s SER 21 Ca 0.04 -0.41 -0.04 0.00 0.48 0.00 0.00 55.95 56.02 3mlw s SER 21 Cb -0.08 -1.00 0.07 0.00 0.10 0.00 0.00 66.02 65.11 3mlw s SER 21 CO 0.01 0.09 0.09 0.00 0.98 0.00 0.00 173.24 174.41 3mlw s LYS 23 N 2.08 3.98 -0.42 0.00 2.20 0.57 0.00 119.74 128.15 3mlw s LYS 23 Ca 0.03 -0.33 -0.10 0.00 -0.36 0.00 0.00 55.97 55.21 3mlw s LYS 23 Cb -0.16 -3.40 0.07 0.00 -1.51 0.00 0.00 37.83 32.83 3mlw s LYS 23 CO -0.15 0.10 0.27 0.20 -0.36 0.00 0.00 175.35 175.41 3mlw s GLY 24 N 0.90 1.97 0.52 5.54 0.00 -0.69 -1.49 107.32 114.07 3mlw s GLY 24 Ca 0.06 -2.07 0.06 0.00 0.00 0.00 0.00 44.72 42.76 3mlw s GLY 24 CO 0.03 0.96 0.71 -1.35 0.00 0.00 0.00 173.10 173.45 3mlw s SER 25 N 2.10 5.31 -0.76 1.64 1.04 -1.14 -4.71 113.70 117.17 3mlw s SER 25 Ca 0.03 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.08 3mlw s SER 25 Cb -0.23 -0.47 0.00 0.00 0.10 0.00 0.00 66.02 65.42 3mlw s SER 25 CO 0.03 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.78 3mlw n GLY 26 N -2.16 0.93 3.62 7.32 0.00 -1.26 -3.21 105.19 110.44 3mlw n GLY 26 Ca 0.10 -0.69 -0.00 0.00 0.00 0.00 0.00 46.02 45.42 3mlw n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mlw s TYR 27 N -2.26 -0.07 -0.60 1.61 -0.85 -1.26 -4.11 117.35 109.81 3mlw s TYR 27 Ca 0.00 -0.03 -0.28 0.00 -0.52 0.00 0.00 57.07 56.25 3mlw s TYR 27 Cb 0.00 0.54 0.01 0.00 0.38 0.00 0.00 41.96 42.90 3mlw s TYR 27 CO 0.00 -0.30 1.41 0.99 -1.52 0.00 0.00 175.55 176.14 3mlw s THR 28 N -2.49 3.76 0.15 -3.49 2.01 -1.26 -4.88 115.64 109.43 3mlw s THR 28 Ca 0.13 0.60 -0.17 0.00 0.31 0.00 0.00 61.69 62.56 3mlw s THR 28 Cb 0.03 -4.50 0.00 0.00 0.01 0.00 0.00 72.50 68.04 3mlw s THR 28 CO -0.04 -1.28 1.75 0.15 -0.69 0.00 0.00 174.62 174.51 3mlw h PHE 29 N 11.08 0.22 -0.82 4.92 3.57 -1.96 -2.76 116.94 131.19 3mlw h PHE 29 Ca -0.27 0.02 0.24 0.00 3.53 0.00 0.00 57.97 61.49 3mlw h PHE 29 Cb 1.09 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.74 3mlw h PHE 29 CO 1.05 0.10 1.04 1.15 -2.23 0.00 0.00 178.31 179.42 3mlw h THR 30 N 0.26 0.07 0.00 4.41 2.02 -1.90 -3.00 112.91 114.77 3mlw h THR 30 Ca 0.14 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.24 3mlw h THR 30 Cb 0.10 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 3mlw h THR 30 CO -0.14 0.00 -1.01 0.44 0.37 0.00 0.00 175.52 175.19 3mlw h ASP 31 N 0.00 0.00 -4.19 4.18 3.45 -1.76 -3.36 116.42 114.74 3mlw h ASP 31 Ca 0.39 0.00 -0.35 0.00 0.43 0.00 0.00 57.03 57.50 3mlw h ASP 31 Cb 2.47 0.00 -0.26 0.00 -0.56 0.00 0.00 39.33 40.98 3mlw h ASP 31 CO -0.00 0.32 -0.76 -1.00 -1.57 0.00 0.00 179.24 176.22 3mlw s HIS 32 N -3.11 0.70 0.34 4.55 3.76 -1.14 -5.04 115.29 115.36 3mlw s HIS 32 Ca -0.00 -0.23 -0.28 0.00 -0.15 0.00 0.00 55.06 54.39 3mlw s HIS 32 Cb 0.08 -0.44 -0.12 0.00 1.11 0.00 0.00 32.58 33.21 3mlw s HIS 32 CO 0.78 -0.02 1.32 0.91 -0.85 0.00 0.00 174.74 176.88 3mlw n TRP 33 N 2.45 2.35 -4.79 1.40 7.02 -1.26 -4.50 117.44 120.11 3mlw n TRP 33 Ca -0.16 0.53 -0.33 0.00 -1.02 0.00 0.00 57.50 56.52 3mlw n TRP 33 Cb 0.57 -2.43 -0.15 0.00 -2.42 0.00 0.00 31.31 26.88 3mlw n TRP 33 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3mlw s ILE 34 N -0.99 2.97 0.09 -0.99 -1.09 -0.71 -1.33 121.20 119.15 3mlw s ILE 34 Ca 0.56 -0.69 0.04 0.00 -2.23 0.00 0.00 60.65 58.34 3mlw s ILE 34 Cb -0.57 -2.24 -0.04 0.00 -1.58 0.00 0.00 42.46 38.03 3mlw s ILE 34 CO 0.61 0.53 0.04 0.00 -1.23 0.00 0.00 174.94 174.89 3mlw s ALA 35 N 0.38 3.44 -0.21 9.38 0.00 0.74 -1.88 121.76 133.60 3mlw s ALA 35 Ca -0.11 -1.07 -0.03 0.00 0.00 0.00 0.00 51.96 50.75 3mlw s ALA 35 Cb -0.16 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 3mlw s ALA 35 CO 0.06 0.72 -0.06 -1.58 0.00 0.00 0.00 175.76 174.89 3mlw s TRP 36 N -1.37 2.93 -0.12 0.00 0.52 -0.39 -2.00 118.94 118.52 3mlw s TRP 36 Ca 0.28 -0.96 -0.00 0.00 0.02 0.00 0.00 56.10 55.43 3mlw s TRP 36 Cb -0.12 -2.07 -0.02 0.00 -1.15 0.00 0.00 33.47 30.11 3mlw s TRP 36 CO 0.20 -0.54 -0.10 0.08 0.02 0.00 0.00 176.95 176.62 3mlw s VAL 37 N 1.36 3.34 -0.04 4.03 1.01 0.95 -0.92 120.40 130.13 3mlw s VAL 37 Ca 0.04 -0.57 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 3mlw s VAL 37 Cb -0.14 -2.40 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 3mlw s VAL 37 CO -0.03 0.53 0.03 -0.60 0.00 0.00 0.00 175.10 175.03 3mlw s ARG 38 N 0.07 2.96 -0.22 2.72 3.52 0.50 0.63 118.95 129.12 3mlw s ARG 38 Ca -0.04 -0.49 -0.04 0.00 -0.13 0.00 0.00 55.73 55.04 3mlw s ARG 38 Cb -0.14 -2.78 0.12 0.00 -1.56 0.00 0.00 34.95 30.58 3mlw s ARG 38 CO 0.04 0.66 0.36 -1.14 -0.81 0.00 0.00 175.30 174.41 3mlw s GLN 39 N -1.36 0.31 0.06 5.12 0.74 -0.08 -0.69 119.66 123.76 3mlw s GLN 39 Ca 0.18 0.60 -0.29 0.00 0.05 0.00 0.00 55.36 55.90 3mlw s GLN 39 Cb -0.12 -0.38 -0.05 0.00 1.10 0.00 0.00 33.01 33.57 3mlw s GLN 39 CO 0.08 -0.55 0.94 0.08 -0.55 0.00 0.00 175.29 175.30 3mlw s VAL 40 N 2.52 4.68 -0.36 1.34 1.01 -1.26 -0.29 120.40 128.05 3mlw s VAL 40 Ca 0.09 2.01 -0.33 0.00 0.00 0.00 0.00 61.98 63.74 3mlw s VAL 40 Cb -0.15 -4.29 -0.14 0.00 0.00 0.00 0.00 36.38 31.80 3mlw s VAL 40 CO -0.14 0.26 1.29 -2.65 0.00 0.00 0.00 175.10 173.85 3mlw n PRO 41 N 3.25 0.00 -3.26 2.72 -0.02 -1.26 -0.57 135.00 135.86 3mlw n PRO 41 Ca 0.03 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.35 3mlw n PRO 41 Cb 0.50 -1.08 0.06 0.00 -0.02 0.00 0.00 33.50 32.96 3mlw n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mlw n GLY 42 N 3.75 -0.17 2.90 -1.23 0.00 -1.26 -5.05 105.19 104.14 3mlw n GLY 42 Ca 0.28 0.01 -0.18 0.00 0.00 0.00 0.00 46.02 46.13 3mlw n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mlw n LYS 43 N -3.76 0.39 0.00 1.61 5.02 0.27 -5.18 118.16 116.51 3mlw n LYS 43 Ca -0.05 -3.02 0.00 0.00 -2.02 0.00 0.00 58.31 53.22 3mlw n LYS 43 Cb 0.57 2.39 0.00 0.00 -0.02 0.00 0.00 35.03 37.96 3mlw n LYS 43 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mlw n GLY 44 N -0.57 -1.35 3.70 0.72 0.00 -1.26 -4.71 105.19 101.72 3mlw n GLY 44 Ca 0.06 -1.59 -0.35 0.00 0.00 0.00 0.00 46.02 44.13 3mlw n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mlw s LEU 45 N 0.00 4.02 -0.13 0.99 1.43 -1.26 -4.40 118.68 119.33 3mlw s LEU 45 Ca 0.00 0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.28 3mlw s LEU 45 Cb 0.00 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.19 3mlw s LEU 45 CO 0.00 0.21 -0.14 -1.61 0.23 0.00 0.00 176.35 175.03 3mlw s GLU 46 N 0.19 3.33 -0.31 1.70 2.02 0.13 -4.97 118.70 120.80 3mlw s GLU 46 Ca 0.06 -0.71 -0.28 0.00 0.02 0.00 0.00 54.97 54.06 3mlw s GLU 46 Cb -0.12 -2.60 0.01 0.00 0.10 0.00 0.00 34.13 31.53 3mlw s GLU 46 CO -0.00 0.19 1.02 -0.46 0.02 0.00 0.00 175.26 176.03 3mlw s TRP 47 N 0.40 3.18 -0.02 1.61 -0.00 -1.26 -0.37 118.94 122.48 3mlw s TRP 47 Ca -0.11 1.17 0.12 0.00 -0.00 0.00 0.00 56.10 57.28 3mlw s TRP 47 Cb -0.16 -3.56 -0.22 0.00 -0.00 0.00 0.00 33.47 29.54 3mlw s TRP 47 CO 0.06 -0.70 0.79 0.52 -0.00 0.00 0.00 176.95 177.62 3mlw h MET 48 N 8.01 0.00 0.00 5.86 2.86 -1.41 -3.41 114.93 126.84 3mlw h MET 48 Ca -0.21 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 3mlw h MET 48 Cb 1.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.73 3mlw h MET 48 CO 1.00 0.56 0.00 0.41 1.06 0.00 0.00 176.91 179.94 3mlw n GLY 49 N 1.50 0.76 3.58 8.32 0.00 -1.24 0.61 105.19 118.73 3mlw n GLY 49 Ca -0.13 -1.83 -0.14 0.00 0.00 0.00 0.00 46.02 43.92 3mlw n GLY 49 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3mlw s MET 50 N -2.00 0.80 0.09 1.61 0.23 -0.46 -1.26 119.30 118.32 3mlw s MET 50 Ca 0.00 0.46 0.04 0.00 -1.03 0.00 0.00 55.69 55.15 3mlw s MET 50 Cb 0.00 0.38 -0.04 0.00 -1.53 0.00 0.00 34.83 33.64 3mlw s MET 50 CO 0.00 -0.20 0.08 0.96 -2.03 0.00 0.00 175.02 173.83 3mlw s ILE 51 N -0.57 4.47 -0.48 3.16 -5.25 -0.79 -1.74 121.20 119.99 3mlw s ILE 51 Ca -0.04 -0.84 -0.13 0.00 -0.99 0.00 0.00 60.65 58.65 3mlw s ILE 51 Cb -0.02 -3.17 0.10 0.00 2.95 0.00 0.00 42.46 42.32 3mlw s ILE 51 CO 0.03 0.09 0.39 -0.47 -1.79 0.00 0.00 174.94 173.19 3mlw s TYR 52 N -1.43 3.30 -0.97 1.37 5.04 -0.28 -1.74 117.35 122.64 3mlw s TYR 52 Ca 0.29 -1.35 -0.07 0.00 -2.44 0.00 0.00 57.07 53.51 3mlw s TYR 52 Cb -0.12 -3.37 -0.08 0.00 0.35 0.00 0.00 41.96 38.74 3mlw s TYR 52 CO 0.22 -0.91 2.44 -0.35 -1.34 0.00 0.00 175.55 175.61 3mlw n PRO 52 N 5.10 2.43 0.00 4.97 -0.04 -1.26 -0.85 135.00 145.35 3mlw n PRO 52 Ca -0.11 -1.55 0.00 0.00 -0.04 0.00 0.00 63.50 61.80 3mlw n PRO 52 Cb 0.42 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.42 3mlw n PRO 52 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3mlw n GLY 53 N 3.54 0.67 0.04 0.55 0.00 -1.26 -4.13 105.19 104.61 3mlw n GLY 53 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.54 3mlw n GLY 53 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3mlw n ASP 54 N 0.00 0.00 -2.76 1.61 5.75 -1.10 -5.03 116.55 115.01 3mlw n ASP 54 Ca 0.00 -1.00 -0.18 0.00 -0.01 0.00 0.00 54.79 53.60 3mlw n ASP 54 Cb 0.00 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 3mlw n ASP 54 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 3mlw n SER 55 N 0.00 -4.47 -4.76 -1.12 2.88 -0.03 -4.92 113.62 101.20 3mlw n SER 55 Ca 0.00 -0.06 -0.41 0.00 -1.33 0.00 0.00 58.87 57.08 3mlw n SER 55 Cb 0.50 -3.72 -0.04 0.00 -0.75 0.00 0.00 64.21 60.20 3mlw n SER 55 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3mlw s ASP 56 N -2.32 7.10 0.13 -3.46 3.68 -1.21 -4.83 116.67 115.77 3mlw s ASP 56 Ca 0.15 2.37 0.07 0.00 2.13 0.00 0.00 52.55 57.27 3mlw s ASP 56 Cb -0.08 -2.63 -0.04 0.00 -1.45 0.00 0.00 42.92 38.73 3mlw s ASP 56 CO 0.19 -0.29 -0.17 0.42 0.13 0.00 0.00 175.17 175.44 3mlw s THR 57 N -0.90 1.58 -0.07 1.71 -4.23 -1.26 -1.12 115.64 111.34 3mlw s THR 57 Ca 0.47 -1.72 -0.02 0.00 -1.18 0.00 0.00 61.69 59.24 3mlw s THR 57 Cb -0.34 -1.62 0.04 0.00 1.34 0.00 0.00 72.50 71.92 3mlw s THR 57 CO 0.43 -0.28 0.05 -0.60 -0.54 0.00 0.00 174.62 173.68 3mlw s ARG 58 N -2.47 0.10 -0.02 3.99 3.52 -0.71 -5.00 118.95 118.35 3mlw s ARG 58 Ca 0.10 0.22 -0.00 0.00 -0.13 0.00 0.00 55.73 55.92 3mlw s ARG 58 Cb -0.07 -0.87 -0.04 0.00 -1.56 0.00 0.00 34.95 32.41 3mlw s ARG 58 CO 0.05 -0.39 0.04 0.71 -0.81 0.00 0.00 175.30 174.90 3mlw s TYR 59 N 2.12 3.21 0.25 5.12 2.02 -1.26 -1.36 117.35 127.44 3mlw s TYR 59 Ca 0.04 0.18 -0.30 0.00 -0.37 0.00 0.00 57.07 56.62 3mlw s TYR 59 Cb -0.13 -1.73 -0.14 0.00 -0.40 0.00 0.00 41.96 39.56 3mlw s TYR 59 CO -0.05 0.52 1.18 0.45 -1.57 0.00 0.00 175.55 176.08 3mlw n SER 60 N 1.46 1.82 0.06 2.29 2.88 0.20 -4.84 113.62 117.50 3mlw n SER 60 Ca -0.15 1.16 0.17 0.00 -1.33 0.00 0.00 58.87 58.72 3mlw n SER 60 Cb 0.53 -1.32 0.67 0.00 -0.75 0.00 0.00 64.21 63.34 3mlw n SER 60 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3mlw h PRO 61 N 2.98 0.02 -0.80 -1.46 0.11 -1.93 -2.12 132.00 128.80 3mlw h PRO 61 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3mlw h PRO 61 Cb 1.32 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3mlw h PRO 61 CO 0.67 0.01 0.00 -1.13 -0.21 0.00 0.00 178.00 177.34 3mlw n SER 62 N -4.42 1.48 -4.91 -2.05 3.41 -1.26 -4.64 113.62 101.22 3mlw n SER 62 Ca 0.06 -2.11 -0.31 0.00 -0.26 0.00 0.00 58.87 56.26 3mlw n SER 62 Cb 0.46 -0.45 -0.04 0.00 -0.26 0.00 0.00 64.21 63.92 3mlw n SER 62 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3mlw s LEU 63 N -0.49 4.28 0.39 1.04 1.43 -0.80 -5.13 118.68 119.41 3mlw s LEU 63 Ca 0.07 0.50 0.08 0.00 -1.03 0.00 0.00 54.13 53.75 3mlw s LEU 63 Cb 0.05 -3.22 -0.01 0.00 0.03 0.00 0.00 46.19 43.05 3mlw s LEU 63 CO 0.03 0.07 0.44 -1.58 0.23 0.00 0.00 176.35 175.53 3mlw s GLN 64 N -2.68 2.75 0.00 1.70 0.74 -1.26 -4.96 119.66 115.95 3mlw s GLN 64 Ca 0.39 -1.32 0.00 0.00 0.05 0.00 0.00 55.36 54.48 3mlw s GLN 64 Cb -0.12 -2.58 0.00 0.00 1.10 0.00 0.00 33.01 31.40 3mlw s GLN 64 CO 0.26 -0.13 0.17 0.41 -0.55 0.00 0.00 175.29 175.45 3mlw n GLY 65 N -1.63 0.00 0.18 2.59 0.00 -1.26 -2.56 105.19 102.51 3mlw n GLY 65 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.14 3mlw n GLY 65 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3mlw h ARG 66 N 0.00 0.00 -4.61 1.61 0.11 -1.96 -3.45 114.38 106.09 3mlw h ARG 66 Ca 0.00 0.00 -0.55 0.00 0.10 0.00 0.00 59.98 59.53 3mlw h ARG 66 Cb 0.00 0.00 -0.34 0.00 1.11 0.00 0.00 29.97 30.74 3mlw h ARG 66 CO 0.00 0.14 -0.82 0.54 0.10 0.00 0.00 179.97 179.92 3mlw s VAL 67 N -3.16 1.31 0.39 0.08 0.11 -1.06 -3.22 120.40 114.85 3mlw s VAL 67 Ca 0.04 -0.54 0.04 0.00 -2.93 0.00 0.00 61.98 58.60 3mlw s VAL 67 Cb 0.07 -1.21 -0.03 0.00 -1.53 0.00 0.00 36.38 33.68 3mlw s VAL 67 CO 0.72 0.40 0.15 0.42 -3.33 0.00 0.00 175.10 173.46 3mlw s THR 68 N 0.97 0.50 -0.01 5.04 -4.23 -0.30 -4.87 115.64 112.74 3mlw s THR 68 Ca -0.08 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.46 3mlw s THR 68 Cb -0.15 -2.39 -0.01 0.00 1.34 0.00 0.00 72.50 71.30 3mlw s THR 68 CO -0.00 0.00 -0.11 -0.04 -0.54 0.00 0.00 174.62 173.92 3mlw s MET 69 N -3.68 0.90 0.11 3.99 -1.94 -1.26 -0.43 119.30 116.98 3mlw s MET 69 Ca 0.27 -0.42 0.00 0.00 -1.71 0.00 0.00 55.69 53.83 3mlw s MET 69 Cb 0.03 -0.87 -0.04 0.00 2.01 0.00 0.00 34.83 35.96 3mlw s MET 69 CO 0.17 0.24 -0.00 -1.54 -0.01 0.00 0.00 175.02 173.87 3mlw s SER 70 N -0.32 0.68 -0.11 3.03 1.04 -0.56 -4.99 113.70 112.47 3mlw s SER 70 Ca 0.04 -1.10 -0.04 0.00 0.48 0.00 0.00 55.95 55.33 3mlw s SER 70 Cb -0.05 0.20 0.06 0.00 0.10 0.00 0.00 66.02 66.33 3mlw s SER 70 CO -0.00 -0.61 0.21 0.00 0.98 0.00 0.00 173.24 173.82 3mlw s ALA 71 N -3.86 -0.35 -0.45 5.32 0.00 -1.26 0.44 121.76 121.60 3mlw s ALA 71 Ca 0.16 0.74 -0.19 0.00 0.00 0.00 0.00 51.96 52.68 3mlw s ALA 71 Cb 0.07 -0.92 0.03 0.00 0.00 0.00 0.00 23.12 22.30 3mlw s ALA 71 CO -0.03 -0.61 0.55 0.34 0.00 0.00 0.00 175.76 176.02 3mlw s ASP 72 N 2.36 6.24 0.23 0.00 3.68 -0.67 -4.93 116.67 123.57 3mlw s ASP 72 Ca 0.02 -0.66 -0.07 0.00 2.13 0.00 0.00 52.55 53.98 3mlw s ASP 72 Cb -0.12 -2.27 0.37 0.00 -1.45 0.00 0.00 42.92 39.46 3mlw s ASP 72 CO -0.07 -0.73 1.74 0.11 0.13 0.00 0.00 175.17 176.35 3mlw h LYS 73 N 8.85 0.42 0.35 4.34 1.57 -1.87 -0.60 116.57 129.62 3mlw h LYS 73 Ca -0.26 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.49 3mlw h LYS 73 Cb 1.10 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.30 3mlw h LYS 73 CO 0.87 0.28 -0.30 1.15 -0.57 0.00 0.00 179.45 180.88 3mlw h THR 74 N 0.44 0.38 -0.32 -0.16 2.02 -1.96 -2.89 112.91 110.41 3mlw h THR 74 Ca 0.37 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.55 3mlw h THR 74 Cb 0.51 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 3mlw h THR 74 CO -0.36 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.71 3mlw n LEU 75 N -5.42 1.92 -4.26 2.58 4.32 -1.15 -4.94 117.00 110.06 3mlw n LEU 75 Ca -0.10 -0.92 -0.34 0.00 -0.02 0.00 0.00 56.01 54.63 3mlw n LEU 75 Cb 0.32 -0.21 -0.07 0.00 -1.62 0.00 0.00 43.42 41.84 3mlw n LEU 75 CO 0.30 0.46 -0.41 -1.20 -1.22 0.00 0.00 177.39 175.33 3mlw n SER 76 N 0.53 -0.11 -3.96 -1.43 7.64 -0.25 -4.83 113.62 111.21 3mlw n SER 76 Ca 0.14 -1.27 -0.12 0.00 1.01 0.00 0.00 58.87 58.62 3mlw n SER 76 Cb 0.32 -1.67 -0.13 0.00 -1.01 0.00 0.00 64.21 61.72 3mlw n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3mlw s THR 77 N -4.20 0.24 0.03 0.44 2.01 -1.13 -1.71 115.64 111.32 3mlw s THR 77 Ca 0.10 -0.52 0.02 0.00 0.31 0.00 0.00 61.69 61.60 3mlw s THR 77 Cb -0.05 -0.28 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 3mlw s THR 77 CO 0.99 -0.19 0.01 0.00 -0.69 0.00 0.00 174.62 174.75 3mlw s ALA 78 N -0.71 3.32 0.06 7.40 0.00 0.10 -1.67 121.76 130.27 3mlw s ALA 78 Ca -0.06 -0.99 0.08 0.00 0.00 0.00 0.00 51.96 51.00 3mlw s ALA 78 Cb -0.05 -1.33 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 3mlw s ALA 78 CO -0.00 0.67 -0.24 0.71 0.00 0.00 0.00 175.76 176.90 3mlw s TYR 79 N -1.17 2.05 -0.07 0.00 1.51 0.17 -0.02 117.35 119.83 3mlw s TYR 79 Ca 0.22 -0.39 0.05 0.00 -1.01 0.00 0.00 57.07 55.94 3mlw s TYR 79 Cb -0.12 -1.21 -0.01 0.00 -0.11 0.00 0.00 41.96 40.51 3mlw s TYR 79 CO 0.13 0.14 -0.22 -1.17 -1.11 0.00 0.00 175.55 173.32 3mlw s LEU 80 N -1.33 2.24 -0.02 -1.29 2.96 -0.79 -1.50 118.68 118.95 3mlw s LEU 80 Ca 0.10 -0.45 0.01 0.00 -0.22 0.00 0.00 54.13 53.57 3mlw s LEU 80 Cb -0.09 -1.43 0.01 0.00 0.50 0.00 0.00 46.19 45.18 3mlw s LEU 80 CO 0.02 0.25 -0.04 -1.10 -1.32 0.00 0.00 176.35 174.17 3mlw s GLN 81 N -0.18 0.44 -0.10 1.98 -0.21 0.43 -1.94 119.66 120.08 3mlw s GLN 81 Ca -0.03 -0.11 0.02 0.00 0.02 0.00 0.00 55.36 55.26 3mlw s GLN 81 Cb -0.14 -0.47 0.01 0.00 1.00 0.00 0.00 33.01 33.42 3mlw s GLN 81 CO 0.04 0.02 -0.15 -1.58 -2.12 0.00 0.00 175.29 171.50 3mlw s TRP 82 N 0.29 1.90 0.06 0.91 0.51 -0.01 -1.15 118.94 121.45 3mlw s TRP 82 Ca -0.03 -0.87 -0.37 0.00 -2.12 0.00 0.00 56.10 52.72 3mlw s TRP 82 Cb -0.06 -1.38 -0.20 0.00 -0.81 0.00 0.00 33.47 31.02 3mlw s TRP 82 CO -0.00 -0.45 1.54 0.77 -0.51 0.00 0.00 176.95 178.30 3mlw h SER 82 N 7.35 -1.12 -3.25 2.95 0.02 -1.85 -2.17 113.55 115.48 3mlw h SER 82 Ca -0.30 0.04 -0.45 0.00 -0.84 0.00 0.00 61.79 60.24 3mlw h SER 82 Cb 1.18 0.29 -0.38 0.00 0.14 0.00 0.00 62.40 63.63 3mlw h SER 82 CO 0.48 -0.80 -0.77 0.00 -1.14 0.00 0.00 176.83 174.61 3mlw s ARG 82 N -5.88 0.64 0.33 3.45 1.70 -1.26 -3.64 118.95 114.30 3mlw s ARG 82 Ca -0.19 0.05 -0.28 0.00 -0.47 0.00 0.00 55.73 54.84 3mlw s ARG 82 Cb 0.02 -1.09 -0.10 0.00 -0.57 0.00 0.00 34.95 33.21 3mlw s ARG 82 CO 0.58 -0.33 1.23 -0.51 -1.08 0.00 0.00 175.30 175.19 3mlw s LEU 82 N 1.96 4.43 0.35 -1.89 1.43 0.12 -4.78 118.68 120.30 3mlw s LEU 82 Ca 0.05 2.53 0.07 0.00 -1.03 0.00 0.00 54.13 55.74 3mlw s LEU 82 Cb -0.13 -3.69 -0.01 0.00 0.03 0.00 0.00 46.19 42.39 3mlw s LEU 82 CO -0.06 -0.44 0.43 -1.61 0.23 0.00 0.00 176.35 174.90 3mlw s GLU 83 N -1.76 2.91 0.26 1.70 0.41 -1.26 -0.75 118.70 120.21 3mlw s GLU 83 Ca 0.49 -1.17 0.01 0.00 -0.41 0.00 0.00 54.97 53.89 3mlw s GLU 83 Cb -0.36 -2.68 0.34 0.00 -1.78 0.00 0.00 34.13 29.65 3mlw s GLU 83 CO 0.48 -0.00 1.68 0.00 -0.49 0.00 0.00 175.26 176.92 3mlw h ALA 84 N 0.97 1.02 0.00 5.21 0.00 -1.92 -2.78 119.26 121.75 3mlw h ALA 84 Ca -0.44 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.09 3mlw h ALA 84 Cb 1.26 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3mlw h ALA 84 CO 0.54 0.59 0.00 -1.13 0.00 0.00 0.00 179.25 179.25 3mlw n SER 85 N -4.09 0.00 0.00 0.00 3.41 -1.26 -1.38 113.62 110.31 3mlw n SER 85 Ca -0.01 0.46 0.14 0.00 -0.26 0.00 0.00 58.87 59.21 3mlw n SER 85 Cb 0.44 -0.48 0.73 0.00 -0.26 0.00 0.00 64.21 64.65 3mlw n SER 85 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3mlw n ASP 86 N -1.48 0.00 -4.70 4.04 8.00 -1.05 -4.82 116.55 116.55 3mlw n ASP 86 Ca 0.02 -0.25 -0.42 0.00 0.71 0.00 0.00 54.79 54.85 3mlw n ASP 86 Cb 0.07 -0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 40.91 3mlw n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3mlw s THR 87 N -2.47 2.78 -0.17 -3.53 2.01 -0.48 -4.86 115.64 108.92 3mlw s THR 87 Ca 0.29 0.32 -0.35 0.00 0.31 0.00 0.00 61.69 62.26 3mlw s THR 87 Cb 0.19 -3.21 0.15 0.00 0.01 0.00 0.00 72.50 69.64 3mlw s THR 87 CO 0.41 0.00 1.41 0.00 -0.69 0.00 0.00 174.62 175.76 3mlw s ALA 88 N 2.40 -2.38 -0.14 7.40 0.00 -0.27 -4.58 121.76 124.19 3mlw s ALA 88 Ca 0.76 1.35 -0.19 0.00 0.00 0.00 0.00 51.96 53.87 3mlw s ALA 88 Cb -0.43 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 3mlw s ALA 88 CO 0.33 -0.85 0.54 -1.64 0.00 0.00 0.00 175.76 174.14 3mlw s MET 89 N -2.04 4.30 -0.19 0.00 -1.94 0.61 -1.20 119.30 118.83 3mlw s MET 89 Ca 0.14 0.52 -0.06 0.00 -1.71 0.00 0.00 55.69 54.58 3mlw s MET 89 Cb 0.04 -3.49 -0.03 0.00 2.01 0.00 0.00 34.83 33.36 3mlw s MET 89 CO -0.05 0.01 0.03 0.71 -0.01 0.00 0.00 175.02 175.71 3mlw s TYR 90 N 1.10 3.13 -0.15 -0.03 1.51 -0.44 -0.90 117.35 121.56 3mlw s TYR 90 Ca 0.27 -0.20 -0.06 0.00 -1.01 0.00 0.00 57.07 56.07 3mlw s TYR 90 Cb -0.16 -2.09 -0.04 0.00 -0.11 0.00 0.00 41.96 39.56 3mlw s TYR 90 CO 0.11 -0.07 0.07 0.71 -1.11 0.00 0.00 175.55 175.26 3mlw s TYR 91 N 0.76 3.30 0.14 2.71 2.02 0.20 -1.23 117.35 125.26 3mlw s TYR 91 Ca 0.02 0.18 -0.17 0.00 -0.37 0.00 0.00 57.07 56.73 3mlw s TYR 91 Cb -0.14 -2.00 -0.07 0.00 -0.40 0.00 0.00 41.96 39.35 3mlw s TYR 91 CO 0.02 0.32 0.60 0.00 -1.57 0.00 0.00 175.55 174.92 3mlw s ALA 93 N -1.36 -1.22 -0.04 0.00 0.00 -0.85 -0.70 121.76 117.59 3mlw s ALA 93 Ca 0.36 1.47 -0.01 0.00 0.00 0.00 0.00 51.96 53.79 3mlw s ALA 93 Cb -0.17 -0.86 -0.04 0.00 0.00 0.00 0.00 23.12 22.05 3mlw s ALA 93 CO 0.20 -0.25 0.05 -0.98 0.00 0.00 0.00 175.76 174.79 3mlw s ARG 94 N 0.55 3.04 -1.05 0.00 1.70 -0.36 -0.19 118.95 122.64 3mlw s ARG 94 Ca -0.02 -0.45 -0.15 0.00 -0.47 0.00 0.00 55.73 54.63 3mlw s ARG 94 Cb -0.04 -2.85 0.17 0.00 -0.57 0.00 0.00 34.95 31.66 3mlw s ARG 94 CO -0.03 0.67 1.22 -1.17 -1.08 0.00 0.00 175.30 174.91 3mlw s LEU 95 N -1.43 5.32 -0.29 -1.89 2.96 -0.44 -3.66 118.68 119.25 3mlw s LEU 95 Ca 0.19 -2.64 -0.22 0.00 -0.22 0.00 0.00 54.13 51.24 3mlw s LEU 95 Cb -0.12 -2.37 0.17 0.00 0.50 0.00 0.00 46.19 44.37 3mlw s LEU 95 CO 0.09 -0.82 1.24 -2.28 -1.32 0.00 0.00 176.35 173.26 3mlw s HIS 96 N 1.65 -0.25 -0.04 5.38 2.46 0.43 -4.50 115.29 120.42 3mlw s HIS 96 Ca 0.35 0.56 -0.09 0.00 0.47 0.00 0.00 55.06 56.36 3mlw s HIS 96 Cb -0.05 0.36 0.01 0.00 -0.13 0.00 0.00 32.58 32.78 3mlw s HIS 96 CO -0.05 -0.12 0.20 -0.47 -2.47 0.00 0.00 174.74 171.83 3mlw s TYR 97 N 0.41 -0.12 -0.15 3.88 5.04 -0.38 -4.04 117.35 121.99 3mlw s TYR 97 Ca 0.02 0.25 -0.04 0.00 -2.44 0.00 0.00 57.07 54.86 3mlw s TYR 97 Cb -0.04 0.03 0.07 0.00 0.35 0.00 0.00 41.96 42.37 3mlw s TYR 97 CO -0.12 -0.23 0.19 0.45 -1.34 0.00 0.00 175.55 174.50 3mlw s SER 98 N -0.73 1.12 0.96 4.32 0.15 -1.26 0.13 113.70 118.39 3mlw s SER 98 Ca -0.08 0.04 -0.13 0.00 0.70 0.00 0.00 55.95 56.48 3mlw s SER 98 Cb -0.05 0.31 0.17 0.00 -1.71 0.00 0.00 66.02 64.74 3mlw s SER 98 CO 0.01 -0.29 1.14 1.51 1.20 0.00 0.00 173.24 176.82 3mlw s ASP 99 N 2.31 3.08 0.27 5.45 1.47 -1.16 -4.87 116.67 123.21 3mlw s ASP 99 Ca 0.04 0.90 -0.01 0.00 1.18 0.00 0.00 52.55 54.67 3mlw s ASP 99 Cb -0.14 -1.42 0.58 0.00 -0.34 0.00 0.00 42.92 41.61 3mlw s ASP 99 CO -0.09 -2.81 1.71 -0.09 0.68 0.00 0.00 175.17 174.57 3mlw h ARG 100 N -1.68 0.39 0.00 2.11 2.43 -2.02 0.26 114.38 115.88 3mlw h ARG 100 Ca -0.50 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 3mlw h ARG 100 Cb 1.32 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 3mlw h ARG 100 CO 0.57 0.26 0.20 1.03 -1.51 0.00 0.00 179.97 180.52 3mlw h SER 100 N 0.40 0.00 0.00 -3.80 0.87 -2.06 -3.45 113.55 105.52 3mlw h SER 100 Ca 0.48 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.04 3mlw h SER 100 Cb 0.83 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 3mlw h SER 100 CO -0.48 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.43 3mlw n GLY 100 N -1.23 0.44 3.71 5.77 0.00 0.92 -5.03 105.19 109.77 3mlw n GLY 100 Ca -0.02 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 3mlw n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mlw s SER 100 N -2.60 7.12 -0.16 1.61 0.01 -1.26 -4.92 113.70 113.50 3mlw s SER 100 Ca 0.00 1.97 -0.08 0.00 1.31 0.00 0.00 55.95 59.15 3mlw s SER 100 Cb 0.00 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 3mlw s SER 100 CO 0.00 -0.44 0.12 -0.72 0.41 0.00 0.00 173.24 172.60 3mlw s TYR 100 N 1.05 3.46 -0.16 2.43 -0.85 -1.26 -2.97 117.35 119.05 3mlw s TYR 100 Ca 0.58 0.38 0.00 0.00 -0.52 0.00 0.00 57.07 57.51 3mlw s TYR 100 Cb -0.28 -2.03 0.00 0.00 0.38 0.00 0.00 41.96 40.02 3mlw s TYR 100 CO 0.29 0.48 -0.16 -0.06 -1.52 0.00 0.00 175.55 174.58 3mlw s PHE 100 N -0.32 2.78 -2.16 -3.49 0.40 0.12 -5.01 117.98 110.30 3mlw s PHE 100 Ca 0.11 -1.10 0.22 0.00 -0.60 0.00 0.00 56.93 55.56 3mlw s PHE 100 Cb -0.12 -1.89 0.57 0.00 0.51 0.00 0.00 43.02 42.09 3mlw s PHE 100 CO 0.01 -0.51 1.48 0.27 0.70 0.00 0.00 175.22 177.18 3mlw n ASN 100 N 4.12 3.62 0.00 1.36 0.23 -1.26 -1.24 115.26 122.08 3mlw n ASN 100 Ca -0.19 -1.99 0.00 0.00 -0.53 0.00 0.00 54.58 51.87 3mlw n ASN 100 Cb 0.52 -0.39 0.00 0.00 -2.08 0.00 0.00 39.78 37.82 3mlw n ASN 100 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3mlw n ASP 100 N 1.51 1.05 -4.49 0.53 5.75 -1.26 -4.69 116.55 114.94 3mlw n ASP 100 Ca 0.22 -1.52 -0.36 0.00 -0.01 0.00 0.00 54.79 53.12 3mlw n ASP 100 Cb 0.59 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.56 3mlw n ASP 100 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3mlw s VAL 100 N -0.52 4.33 -1.31 2.12 1.01 -1.26 -4.93 120.40 119.83 3mlw s VAL 100 Ca 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 61.67 3mlw s VAL 100 Cb 0.00 -2.99 0.11 0.00 0.00 0.00 0.00 36.38 33.50 3mlw s VAL 100 CO 0.00 0.39 1.82 0.49 0.00 0.00 0.00 175.10 177.80 3mlw n PHE 100 N 4.43 4.03 0.09 5.22 3.72 -1.26 -0.43 117.46 133.27 3mlw n PHE 100 Ca -0.16 -2.99 -0.23 0.00 -0.05 0.00 0.00 57.45 54.02 3mlw n PHE 100 Cb 0.52 -2.34 -0.15 0.00 -0.94 0.00 0.00 39.48 36.57 3mlw n PHE 100 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3mlw h HIS 101 N 6.62 0.77 -3.43 1.38 -0.00 -1.70 -3.46 115.15 115.32 3mlw h HIS 101 Ca 0.43 -0.56 -0.61 0.00 -0.00 0.00 0.00 60.37 59.63 3mlw h HIS 101 Cb 0.75 -0.03 -0.13 0.00 -0.00 0.00 0.00 27.41 28.00 3mlw h HIS 101 CO 1.31 1.54 -0.48 1.41 -0.00 0.00 0.00 177.93 181.71 3mlw s MET 102 N -2.54 4.13 0.04 5.26 -2.45 -1.26 -5.02 119.30 117.46 3mlw s MET 102 Ca -0.13 -0.22 0.06 0.00 -1.25 0.00 0.00 55.69 54.15 3mlw s MET 102 Cb 0.04 -3.48 -0.02 0.00 1.25 0.00 0.00 34.83 32.61 3mlw s MET 102 CO 0.88 0.17 -0.18 -1.58 1.05 0.00 0.00 175.02 175.36 3mlw s TRP 103 N 0.73 1.58 0.84 4.11 0.52 -1.26 -1.23 118.94 124.23 3mlw s TRP 103 Ca 0.08 -0.36 -0.12 0.00 0.02 0.00 0.00 56.10 55.72 3mlw s TRP 103 Cb -0.12 -0.94 0.10 0.00 -1.15 0.00 0.00 33.47 31.35 3mlw s TRP 103 CO 0.02 0.07 1.10 0.20 0.02 0.00 0.00 176.95 178.35 3mlw s GLY 104 N -1.16 1.62 0.26 0.98 0.00 0.12 -4.60 107.32 104.54 3mlw s GLY 104 Ca 0.05 -0.18 0.25 0.00 0.00 0.00 0.00 44.72 44.84 3mlw s GLY 104 CO 0.02 0.28 1.74 0.06 0.00 0.00 0.00 173.10 175.20 3mlw h GLN 105 N -1.29 0.00 0.00 2.90 -0.00 -1.90 -3.43 115.11 111.40 3mlw h GLN 105 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 3mlw h GLN 105 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 3mlw h GLN 105 CO 0.58 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.82 3mlw n GLY 106 N 0.44 1.88 3.13 0.06 0.00 -1.26 -5.04 105.19 104.39 3mlw n GLY 106 Ca 0.03 -1.70 -0.30 0.00 0.00 0.00 0.00 46.02 44.04 3mlw n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mlw s THR 107 N -2.07 1.79 -0.17 2.61 2.01 -0.36 -4.90 115.64 114.55 3mlw s THR 107 Ca 0.00 -0.83 -0.21 0.00 0.31 0.00 0.00 61.69 60.97 3mlw s THR 107 Cb 0.00 -1.59 -0.03 0.00 0.01 0.00 0.00 72.50 70.89 3mlw s THR 107 CO 0.00 0.50 0.60 0.28 -0.69 0.00 0.00 174.62 175.31 3mlw s THR 108 N 0.79 5.06 -0.17 -0.82 -1.32 -1.26 -1.33 115.64 116.58 3mlw s THR 108 Ca -0.09 1.16 -0.01 0.00 -1.21 0.00 0.00 61.69 61.54 3mlw s THR 108 Cb -0.16 -3.93 0.04 0.00 -1.51 0.00 0.00 72.50 66.95 3mlw s THR 108 CO 0.00 0.17 -0.03 -0.69 -2.21 0.00 0.00 174.62 171.86 3mlw s VAL 109 N 1.52 1.00 -0.15 5.08 1.01 -0.34 -0.75 120.40 127.77 3mlw s VAL 109 Ca 0.29 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.67 3mlw s VAL 109 Cb -0.16 -1.23 -0.00 0.00 0.00 0.00 0.00 36.38 34.99 3mlw s VAL 109 CO 0.11 0.07 -0.15 -0.89 0.00 0.00 0.00 175.10 174.24 3mlw s THR 110 N 1.67 2.69 -0.24 3.92 2.01 -0.19 -1.11 115.64 124.40 3mlw s THR 110 Ca 0.00 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 61.24 3mlw s THR 110 Cb -0.16 -2.13 0.07 0.00 0.01 0.00 0.00 72.50 70.29 3mlw s THR 110 CO -0.07 0.52 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.67 3mlw s VAL 111 N 0.75 1.29 0.06 3.82 1.01 -1.26 -1.06 120.40 125.02 3mlw s VAL 111 Ca -0.06 -1.18 -0.19 0.00 0.00 0.00 0.00 61.98 60.54 3mlw s VAL 111 Cb -0.15 -1.68 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 3mlw s VAL 111 CO 0.01 -0.23 0.56 -0.55 0.00 0.00 0.00 175.10 174.89 3mlw s SER 112 N 1.48 7.03 -0.18 3.32 0.15 -0.66 -4.51 113.70 120.34 3mlw s SER 112 Ca -0.02 1.23 0.14 0.00 0.70 0.00 0.00 55.95 58.00 3mlw s SER 112 Cb -0.18 -2.35 0.43 0.00 -1.71 0.00 0.00 66.02 62.20 3mlw s SER 112 CO -0.09 0.25 1.20 -1.54 1.20 0.00 0.00 173.24 174.27 3mlw n SER 113 N 1.88 1.93 -3.62 5.45 3.41 -1.26 -1.50 113.62 119.91 3mlw n SER 113 Ca -0.10 -3.43 -0.07 0.00 -0.26 0.00 0.00 58.87 55.01 3mlw n SER 113 Cb 0.51 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 3mlw n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mlw s ALA 114 N -2.63 -2.03 0.66 7.33 0.00 -1.26 -4.85 121.76 118.97 3mlw s ALA 114 Ca 0.38 1.74 -0.16 0.00 0.00 0.00 0.00 51.96 53.93 3mlw s ALA 114 Cb 0.38 -1.27 -0.00 0.00 0.00 0.00 0.00 23.12 22.23 3mlw s ALA 114 CO -0.08 -0.24 1.15 -1.12 0.00 0.00 0.00 175.76 175.47 3mlw s SER 115 N -0.49 4.95 -0.12 0.00 0.01 -1.26 -4.96 113.70 111.84 3mlw s SER 115 Ca 0.03 2.15 -0.29 0.00 1.31 0.00 0.00 55.95 59.15 3mlw s SER 115 Cb -0.03 -2.57 -0.05 0.00 0.21 0.00 0.00 66.02 63.59 3mlw s SER 115 CO -0.06 -1.74 1.71 0.42 0.41 0.00 0.00 173.24 173.98 3mlw s THR 116 N -2.11 3.53 0.14 1.44 -4.23 -1.26 -4.78 115.64 108.38 3mlw s THR 116 Ca 0.71 0.63 0.10 0.00 -1.18 0.00 0.00 61.69 61.94 3mlw s THR 116 Cb -0.24 -3.47 -0.04 0.00 1.34 0.00 0.00 72.50 70.09 3mlw s THR 116 CO 0.40 -0.13 -0.22 -0.75 -0.54 0.00 0.00 174.62 173.37 3mlw s LYS 117 N 4.46 1.59 0.61 3.99 2.20 -0.60 -4.93 119.74 127.06 3mlw s LYS 117 Ca 0.76 -1.32 -0.15 0.00 -0.36 0.00 0.00 55.97 54.90 3mlw s LYS 117 Cb -0.31 -1.98 -0.03 0.00 -1.51 0.00 0.00 37.83 34.00 3mlw s LYS 117 CO 0.31 0.45 1.05 0.20 -0.36 0.00 0.00 175.35 177.00 3mlw s GLY 118 N -2.25 2.00 0.50 5.54 0.00 -1.26 -1.99 107.32 109.87 3mlw s GLY 118 Ca 0.17 0.29 -0.19 0.00 0.00 0.00 0.00 44.72 44.99 3mlw s GLY 118 CO 0.09 0.60 1.02 2.56 0.00 0.00 0.00 173.10 177.37 3mlw s PRO 119 N -4.32 3.79 -0.30 2.90 0.04 -1.26 -4.54 135.00 131.31 3mlw s PRO 119 Ca 0.62 1.23 -0.05 0.00 0.04 0.00 0.00 61.00 62.83 3mlw s PRO 119 Cb -0.15 -2.10 0.02 0.00 0.04 0.00 0.00 34.50 32.31 3mlw s PRO 119 CO 0.41 -0.42 0.06 -1.54 0.04 0.00 0.00 177.00 175.54 3mlw s SER 120 N -2.34 5.03 0.15 6.66 1.04 -0.65 -4.96 113.70 118.63 3mlw s SER 120 Ca 0.64 -0.91 -0.16 0.00 0.48 0.00 0.00 55.95 56.01 3mlw s SER 120 Cb -0.14 -1.83 -0.07 0.00 0.10 0.00 0.00 66.02 64.08 3mlw s SER 120 CO 0.24 -0.23 0.58 -0.69 0.98 0.00 0.00 173.24 174.13 3mlw s VAL 121 N 1.42 4.79 0.03 5.02 1.01 -1.26 -2.78 120.40 128.64 3mlw s VAL 121 Ca 0.00 0.97 0.02 0.00 0.00 0.00 0.00 61.98 62.98 3mlw s VAL 121 Cb -0.18 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.40 3mlw s VAL 121 CO 0.01 0.29 -0.08 -0.36 0.00 0.00 0.00 175.10 174.97 3mlw s PHE 122 N -1.41 0.67 0.12 5.22 0.08 0.04 -5.00 117.98 117.71 3mlw s PHE 122 Ca 0.37 -0.41 -0.24 0.00 0.12 0.00 0.00 56.93 56.77 3mlw s PHE 122 Cb -0.16 -0.41 -0.07 0.00 -0.57 0.00 0.00 43.02 41.81 3mlw s PHE 122 CO 0.19 -0.06 0.74 -1.25 -0.10 0.00 0.00 175.22 174.75 3mlw s PRO 123 N -1.27 4.49 -0.75 0.24 0.04 -1.26 -0.72 135.00 135.78 3mlw s PRO 123 Ca -0.07 1.06 -0.13 0.00 0.04 0.00 0.00 61.00 61.90 3mlw s PRO 123 Cb -0.08 -3.29 0.20 0.00 0.04 0.00 0.00 34.50 31.37 3mlw s PRO 123 CO 0.00 0.50 0.68 -0.51 0.04 0.00 0.00 177.00 177.72 3mlw s LEU 124 N -0.84 6.52 0.17 -3.56 1.43 0.11 -4.84 118.68 117.67 3mlw s LEU 124 Ca 0.35 -2.52 -0.31 0.00 -1.03 0.00 0.00 54.13 50.63 3mlw s LEU 124 Cb -0.22 -2.18 -0.09 0.00 0.03 0.00 0.00 46.19 43.74 3mlw s LEU 124 CO 0.24 -0.61 1.39 0.00 0.23 0.00 0.00 176.35 177.59 3mlw s ALA 125 N 0.45 3.59 0.32 4.21 0.00 -1.26 -1.89 121.76 127.17 3mlw s ALA 125 Ca 0.15 1.17 -0.29 0.00 0.00 0.00 0.00 51.96 52.99 3mlw s ALA 125 Cb -0.15 -3.53 -0.10 0.00 0.00 0.00 0.00 23.12 19.34 3mlw s ALA 125 CO -0.06 -0.62 1.32 -1.25 0.00 0.00 0.00 175.76 175.15 3mlw s PRO 126 N 0.46 4.35 0.26 0.00 0.04 -1.26 -4.93 135.00 133.92 3mlw s PRO 126 Ca 0.62 2.21 0.01 0.00 0.04 0.00 0.00 61.00 63.88 3mlw s PRO 126 Cb -0.38 -3.08 -0.03 0.00 0.04 0.00 0.00 34.50 31.05 3mlw s PRO 126 CO 0.35 -0.21 0.24 0.45 0.04 0.00 0.00 177.00 177.87 3mlw s SER 127 N -0.35 0.76 0.16 6.66 0.15 -1.26 -4.21 113.70 115.61 3mlw s SER 127 Ca 0.50 -1.50 -0.15 0.00 0.70 0.00 0.00 55.95 55.50 3mlw s SER 127 Cb -0.40 0.48 0.10 0.00 -1.71 0.00 0.00 66.02 64.49 3mlw s SER 127 CO 0.51 -0.98 1.75 0.77 1.20 0.00 0.00 173.24 176.49 3mlw h SER 128 N 2.37 0.16 -0.19 5.45 4.64 -1.96 -1.46 113.55 122.57 3mlw h SER 128 Ca -0.31 0.04 0.05 0.00 -0.47 0.00 0.00 61.79 61.11 3mlw h SER 128 Cb 1.24 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 3mlw h SER 128 CO 0.44 0.13 0.19 0.50 -0.87 0.00 0.00 176.83 177.22 3mlw h LYS 129 N 0.32 0.00 -0.30 4.77 3.11 -1.99 -2.07 116.57 120.40 3mlw h LYS 129 Ca 0.19 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.03 3mlw h LYS 129 Cb 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.40 3mlw h LYS 129 CO -0.19 0.00 0.00 -1.13 -2.81 0.00 0.00 179.45 175.32 3mlw n SER 130 N -3.90 3.04 -4.49 4.20 3.41 -0.83 -4.95 113.62 110.09 3mlw n SER 130 Ca 0.02 -1.88 -0.35 0.00 -0.26 0.00 0.00 58.87 56.40 3mlw n SER 130 Cb 0.32 -0.20 -0.12 0.00 -0.26 0.00 0.00 64.21 63.95 3mlw n SER 130 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3mlw s THR 131 N -1.26 4.13 -0.39 6.66 -1.32 -0.61 -1.94 115.64 120.92 3mlw s THR 131 Ca 0.30 -0.26 0.02 0.00 -1.21 0.00 0.00 61.69 60.54 3mlw s THR 131 Cb 0.18 -2.86 0.12 0.00 -1.51 0.00 0.00 72.50 68.42 3mlw s THR 131 CO 0.24 0.44 0.15 -0.55 -2.21 0.00 0.00 174.62 172.70 3mlw s SER 132 N 0.81 4.12 1.25 8.08 0.15 0.61 -4.95 113.70 123.77 3mlw s SER 132 Ca 0.01 -2.27 0.00 0.00 0.70 0.00 0.00 55.95 54.39 3mlw s SER 132 Cb -0.14 -1.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.96 3mlw s SER 132 CO 0.02 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.74 3mlw n GLY 133 N 4.04 2.43 0.00 9.45 0.00 -1.26 -3.18 105.19 116.68 3mlw n GLY 133 Ca 0.04 -0.40 0.10 0.00 0.00 0.00 0.00 46.02 45.76 3mlw n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mlw n GLY 134 N 0.00 -0.67 3.20 -0.02 0.00 -1.26 -4.79 105.19 101.65 3mlw n GLY 134 Ca 0.00 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.74 3mlw n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mlw s THR 135 N -2.00 1.09 0.03 2.61 -4.23 -1.19 -0.78 115.64 111.17 3mlw s THR 135 Ca 0.30 -1.64 -0.03 0.00 -1.18 0.00 0.00 61.69 59.13 3mlw s THR 135 Cb 0.14 -1.40 -0.02 0.00 1.34 0.00 0.00 72.50 72.56 3mlw s THR 135 CO 0.23 -0.49 0.04 0.00 -0.54 0.00 0.00 174.62 173.87 3mlw s ALA 136 N -2.26 0.02 -0.09 3.99 0.00 0.55 -0.29 121.76 123.68 3mlw s ALA 136 Ca 0.06 -0.56 0.01 0.00 0.00 0.00 0.00 51.96 51.47 3mlw s ALA 136 Cb -0.04 0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.25 3mlw s ALA 136 CO 0.01 -0.25 -0.12 0.00 0.00 0.00 0.00 175.76 175.41 3mlw s ALA 137 N -2.11 2.74 0.07 0.00 0.00 -0.82 -0.72 121.76 120.91 3mlw s ALA 137 Ca -0.09 -0.92 -0.13 0.00 0.00 0.00 0.00 51.96 50.82 3mlw s ALA 137 Cb -0.05 -1.16 0.02 0.00 0.00 0.00 0.00 23.12 21.94 3mlw s ALA 137 CO -0.03 0.42 0.29 -0.48 0.00 0.00 0.00 175.76 175.96 3mlw s LEU 138 N -0.26 0.94 0.00 0.00 0.05 0.11 -4.34 118.68 115.18 3mlw s LEU 138 Ca 0.02 -0.32 0.00 0.00 0.05 0.00 0.00 54.13 53.88 3mlw s LEU 138 Cb -0.13 1.35 0.00 0.00 -2.05 0.00 0.00 46.19 45.36 3mlw s LEU 138 CO 0.03 -0.68 0.00 0.61 -0.55 0.00 0.00 176.35 175.76 3mlw n GLY 139 N 0.31 2.57 3.00 -3.48 0.00 -0.79 0.16 105.19 106.96 3mlw n GLY 139 Ca -0.17 -0.90 -0.28 0.00 0.00 0.00 0.00 46.02 44.67 3mlw n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mlw s LEU 141 N 1.28 4.27 -0.50 0.00 2.96 0.11 -1.78 118.68 125.02 3mlw s LEU 141 Ca -0.01 -0.05 -0.12 0.00 -0.22 0.00 0.00 54.13 53.73 3mlw s LEU 141 Cb -0.14 -2.92 0.12 0.00 0.50 0.00 0.00 46.19 43.76 3mlw s LEU 141 CO -0.05 -0.83 0.40 -0.69 -1.32 0.00 0.00 176.35 173.86 3mlw s VAL 142 N 3.13 4.58 0.24 1.68 1.01 0.91 -0.78 120.40 131.17 3mlw s VAL 142 Ca 0.28 -1.69 0.10 0.00 0.00 0.00 0.00 61.98 60.67 3mlw s VAL 142 Cb -0.13 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 3mlw s VAL 142 CO 0.20 -0.81 -0.18 -1.59 0.00 0.00 0.00 175.10 172.73 3mlw s LYS 143 N 1.44 1.51 -0.99 2.72 -2.85 -1.12 -0.19 119.74 120.27 3mlw s LYS 143 Ca 0.05 -1.68 -0.05 0.00 -1.00 0.00 0.00 55.97 53.28 3mlw s LYS 143 Cb -0.28 -1.47 -0.05 0.00 -2.06 0.00 0.00 37.83 33.97 3mlw s LYS 143 CO 0.01 0.26 0.87 -0.25 0.10 0.00 0.00 175.35 176.34 3mlw n ASP 144 N -0.49 -6.84 -4.23 0.03 9.92 0.24 -1.63 116.55 113.54 3mlw n ASP 144 Ca -0.07 -0.59 -0.17 0.00 -0.53 0.00 0.00 54.79 53.44 3mlw n ASP 144 Cb 0.60 -5.15 -0.11 0.00 -0.64 0.00 0.00 41.12 35.82 3mlw n ASP 144 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 3mlw s TYR 145 N -3.31 1.34 -0.22 1.24 -0.85 -1.00 -4.28 117.35 110.27 3mlw s TYR 145 Ca 0.36 -0.58 -0.21 0.00 -0.52 0.00 0.00 57.07 56.12 3mlw s TYR 145 Cb -0.05 -0.70 0.06 0.00 0.38 0.00 0.00 41.96 41.64 3mlw s TYR 145 CO 0.75 0.12 0.60 0.12 -1.52 0.00 0.00 175.55 175.62 3mlw s PHE 146 N -2.29 -0.65 0.59 -3.49 5.36 -0.84 -1.63 117.98 115.03 3mlw s PHE 146 Ca 0.09 1.59 -0.03 0.00 -0.96 0.00 0.00 56.93 57.63 3mlw s PHE 146 Cb -0.04 0.23 0.12 0.00 -0.34 0.00 0.00 43.02 42.99 3mlw s PHE 146 CO 0.02 -0.32 0.81 -0.35 -1.46 0.00 0.00 175.22 173.93 3mlw n PRO 147 N 2.73 -0.14 -1.12 10.12 -0.04 -1.26 -1.56 135.00 143.73 3mlw n PRO 147 Ca -0.14 -1.99 -0.33 0.00 -0.04 0.00 0.00 63.50 61.01 3mlw n PRO 147 Cb 0.56 -0.61 0.12 0.00 -0.04 0.00 0.00 33.50 33.53 3mlw n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3mlw s GLU 148 N -4.61 1.71 0.00 0.54 2.02 -1.26 -4.81 118.70 112.29 3mlw s GLU 148 Ca 0.52 1.61 0.00 0.00 0.02 0.00 0.00 54.97 57.12 3mlw s GLU 148 Cb -0.03 -1.80 0.00 0.00 0.10 0.00 0.00 34.13 32.40 3mlw s GLU 148 CO 0.35 -2.13 0.00 -0.35 0.02 0.00 0.00 175.26 173.15 3mlw n PRO 149 N -3.41 1.83 -3.67 0.39 -0.04 -1.26 -4.99 135.00 123.85 3mlw n PRO 149 Ca 0.12 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.50 3mlw n PRO 149 Cb 0.51 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.88 3mlw n PRO 149 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3mlw s VAL 150 N 1.11 -0.23 0.05 0.52 0.11 -1.26 -4.65 120.40 116.05 3mlw s VAL 150 Ca 0.00 0.08 -0.03 0.00 -2.93 0.00 0.00 61.98 59.10 3mlw s VAL 150 Cb 0.00 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 34.07 3mlw s VAL 150 CO 0.00 0.03 0.24 0.42 -3.33 0.00 0.00 175.10 172.47 3mlw s THR 151 N 1.83 5.34 -0.08 5.04 -4.23 -0.37 -4.93 115.64 118.23 3mlw s THR 151 Ca -0.08 -0.15 -0.00 0.00 -1.18 0.00 0.00 61.69 60.28 3mlw s THR 151 Cb -0.09 -3.60 0.02 0.00 1.34 0.00 0.00 72.50 70.18 3mlw s THR 151 CO -0.15 0.21 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.39 3mlw s VAL 152 N -1.45 0.78 0.24 2.29 1.01 -1.26 -0.70 120.40 121.30 3mlw s VAL 152 Ca 0.33 -0.17 0.10 0.00 0.00 0.00 0.00 61.98 62.24 3mlw s VAL 152 Cb -0.13 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 3mlw s VAL 152 CO 0.23 0.31 -0.05 -0.94 0.00 0.00 0.00 175.10 174.65 3mlw s SER 153 N 1.52 4.36 -0.14 3.32 1.04 -0.74 -4.93 113.70 118.13 3mlw s SER 153 Ca -0.00 -0.66 0.01 0.00 0.48 0.00 0.00 55.95 55.77 3mlw s SER 153 Cb -0.13 -0.75 -0.01 0.00 0.10 0.00 0.00 66.02 65.23 3mlw s SER 153 CO -0.05 0.04 -0.16 0.26 0.98 0.00 0.00 173.24 174.31 3mlw s TRP 154 N -2.15 2.75 -1.25 5.02 0.52 -1.26 0.11 118.94 122.68 3mlw s TRP 154 Ca 0.29 -0.91 -0.11 0.00 0.02 0.00 0.00 56.10 55.39 3mlw s TRP 154 Cb -0.07 -1.84 -0.01 0.00 -1.15 0.00 0.00 33.47 30.40 3mlw s TRP 154 CO 0.18 -0.38 0.66 0.09 0.02 0.00 0.00 176.95 177.52 3mlw n ASN 155 N 3.79 -3.08 -0.80 2.95 3.02 0.16 -1.51 115.26 119.77 3mlw n ASN 155 Ca -0.19 -0.98 -0.10 0.00 -0.03 0.00 0.00 54.58 53.29 3mlw n ASN 155 Cb 0.52 -3.41 -0.04 0.00 -0.61 0.00 0.00 39.78 36.24 3mlw n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3mlw n SER 156 N -2.84 -5.18 0.00 6.41 7.64 -1.26 -0.74 113.62 117.65 3mlw n SER 156 Ca -0.19 0.24 0.00 0.00 1.01 0.00 0.00 58.87 59.93 3mlw n SER 156 Cb 0.64 -3.85 0.00 0.00 -1.01 0.00 0.00 64.21 59.99 3mlw n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mlw n GLY 157 N 0.25 0.54 0.13 0.23 0.00 -0.57 -4.95 105.19 100.82 3mlw n GLY 157 Ca -0.10 -0.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.91 3mlw n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mlw h ALA 158 N 0.00 -0.11 -2.05 4.61 0.00 -0.94 -3.44 119.26 117.33 3mlw h ALA 158 Ca 0.00 -0.76 -0.61 0.00 0.00 0.00 0.00 54.91 53.54 3mlw h ALA 158 Cb 0.00 0.13 -0.11 0.00 0.00 0.00 0.00 17.79 17.81 3mlw h ALA 158 CO 0.00 0.49 0.48 -1.17 0.00 0.00 0.00 179.25 179.05 3mlw s LEU 159 N -7.78 4.09 -0.10 0.00 2.96 -1.21 -4.87 118.68 111.77 3mlw s LEU 159 Ca -0.12 0.25 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 3mlw s LEU 159 Cb 0.02 -3.11 -0.07 0.00 0.50 0.00 0.00 46.19 43.53 3mlw s LEU 159 CO 0.87 -0.88 -0.10 0.41 -1.32 0.00 0.00 176.35 175.33 3mlw n THR 160 N 6.07 0.60 -2.20 3.68 -1.04 -1.26 -4.53 114.28 115.59 3mlw n THR 160 Ca 0.05 -0.22 -0.36 0.00 -2.04 0.00 0.00 64.05 61.47 3mlw n THR 160 Cb 0.48 -0.96 0.00 0.00 -1.82 0.00 0.00 70.33 68.04 3mlw n THR 160 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 3mlw s SER 161 N -5.12 5.83 -0.87 8.00 0.01 -1.26 -3.59 113.70 116.70 3mlw s SER 161 Ca -0.14 2.30 0.00 0.00 1.31 0.00 0.00 55.95 59.42 3mlw s SER 161 Cb 0.04 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.67 3mlw s SER 161 CO 0.23 -1.15 0.00 0.61 0.41 0.00 0.00 173.24 173.34 3mlw n GLY 162 N 0.37 0.91 3.73 3.44 0.00 -1.26 -4.76 105.19 107.62 3mlw n GLY 162 Ca 0.10 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 3mlw n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mlw s VAL 163 N -2.00 5.01 -0.28 1.61 1.01 -1.24 -1.92 120.40 122.60 3mlw s VAL 163 Ca 0.00 1.34 -0.03 0.00 0.00 0.00 0.00 61.98 63.29 3mlw s VAL 163 Cb 0.00 -3.99 0.09 0.00 0.00 0.00 0.00 36.38 32.48 3mlw s VAL 163 CO 0.00 0.31 0.11 -2.28 0.00 0.00 0.00 175.10 173.23 3mlw s HIS 164 N 0.49 0.84 -0.19 5.22 2.46 -0.17 -5.02 115.29 118.92 3mlw s HIS 164 Ca 0.34 -1.11 -0.23 0.00 0.47 0.00 0.00 55.06 54.53 3mlw s HIS 164 Cb -0.18 -1.16 -0.02 0.00 -0.13 0.00 0.00 32.58 31.09 3mlw s HIS 164 CO 0.17 -0.79 0.74 0.99 -2.47 0.00 0.00 174.74 173.38 3mlw s THR 165 N 1.92 4.94 0.28 0.89 2.01 -1.26 -1.46 115.64 122.96 3mlw s THR 165 Ca 0.07 1.43 -0.08 0.00 0.31 0.00 0.00 61.69 63.42 3mlw s THR 165 Cb -0.17 -4.05 -0.06 0.00 0.01 0.00 0.00 72.50 68.23 3mlw s THR 165 CO -0.27 0.05 0.59 -0.36 -0.69 0.00 0.00 174.62 173.94 3mlw s PHE 166 N 2.12 3.45 0.82 4.92 0.40 -0.27 -4.99 117.98 124.43 3mlw s PHE 166 Ca 0.34 0.83 -0.14 0.00 -0.60 0.00 0.00 56.93 57.36 3mlw s PHE 166 Cb -0.16 -2.25 0.03 0.00 0.51 0.00 0.00 43.02 41.15 3mlw s PHE 166 CO 0.11 0.17 0.72 -2.30 0.70 0.00 0.00 175.22 174.62 3mlw n PRO 167 N -0.60 0.07 -2.54 0.24 -0.02 -1.26 -4.45 135.00 126.44 3mlw n PRO 167 Ca 0.00 0.08 -0.26 0.00 -2.02 0.00 0.00 63.50 61.30 3mlw n PRO 167 Cb 0.53 -2.05 0.02 0.00 -0.02 0.00 0.00 33.50 31.99 3mlw n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3mlw s ALA 168 N -2.14 3.39 -0.13 3.55 0.00 -1.26 -4.69 121.76 120.48 3mlw s ALA 168 Ca 0.65 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.93 3mlw s ALA 168 Cb -0.29 -2.53 -0.01 0.00 0.00 0.00 0.00 23.12 20.29 3mlw s ALA 168 CO 0.58 -0.62 -0.16 0.08 0.00 0.00 0.00 175.76 175.65 3mlw s VAL 169 N -2.86 2.77 -0.31 0.00 1.01 0.83 -4.97 120.40 116.86 3mlw s VAL 169 Ca 0.51 -0.76 -0.23 0.00 0.00 0.00 0.00 61.98 61.50 3mlw s VAL 169 Cb -0.10 -2.14 0.00 0.00 0.00 0.00 0.00 36.38 34.13 3mlw s VAL 169 CO 0.44 0.53 0.79 -0.22 0.00 0.00 0.00 175.10 176.64 3mlw s LEU 170 N 0.44 4.09 0.77 3.92 2.96 -1.26 -1.47 118.68 128.13 3mlw s LEU 170 Ca -0.12 0.65 -0.12 0.00 -0.22 0.00 0.00 54.13 54.33 3mlw s LEU 170 Cb -0.16 -3.07 0.05 0.00 0.50 0.00 0.00 46.19 43.51 3mlw s LEU 170 CO 0.05 -0.61 1.11 -1.10 -1.32 0.00 0.00 176.35 174.47 3mlw s GLN 171 N 2.95 2.31 0.51 1.98 -0.21 0.86 -4.95 119.66 123.11 3mlw s GLN 171 Ca 0.32 0.51 0.24 0.00 0.02 0.00 0.00 55.36 56.46 3mlw s GLN 171 Cb -0.14 -1.95 1.37 0.00 1.00 0.00 0.00 33.01 33.28 3mlw s GLN 171 CO 0.13 -1.43 2.07 0.77 -2.12 0.00 0.00 175.29 174.70 3mlw h SER 172 N -0.95 0.00 0.00 5.90 0.02 -1.97 -1.47 113.55 115.08 3mlw h SER 172 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 3mlw h SER 172 Cb 1.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.81 3mlw h SER 172 CO 0.62 0.13 0.00 -1.54 -1.14 0.00 0.00 176.83 174.89 3mlw n SER 173 N -3.84 0.00 0.00 3.07 3.41 -1.26 -4.84 113.62 110.16 3mlw n SER 173 Ca -0.02 -0.79 0.00 0.00 -0.26 0.00 0.00 58.87 57.80 3mlw n SER 173 Cb 0.22 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 3mlw n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mlw n GLY 174 N 0.55 0.91 3.85 5.00 0.00 -0.55 -4.84 105.19 110.11 3mlw n GLY 174 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3mlw n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mlw s LEU 175 N 0.00 4.42 0.65 0.99 2.01 -1.26 -4.79 118.68 120.71 3mlw s LEU 175 Ca 0.00 0.85 -0.06 0.00 0.01 0.00 0.00 54.13 54.93 3mlw s LEU 175 Cb 0.00 -2.66 0.04 0.00 0.01 0.00 0.00 46.19 43.58 3mlw s LEU 175 CO 0.00 0.28 0.96 -0.31 1.01 0.00 0.00 176.35 178.30 3mlw s TYR 176 N -1.18 3.04 -0.14 0.29 2.02 -0.65 -0.10 117.35 120.63 3mlw s TYR 176 Ca 0.26 0.49 -0.24 0.00 -0.37 0.00 0.00 57.07 57.21 3mlw s TYR 176 Cb -0.15 -3.01 0.06 0.00 -0.40 0.00 0.00 41.96 38.46 3mlw s TYR 176 CO 0.14 -1.17 0.60 -1.12 -1.57 0.00 0.00 175.55 172.43 3mlw s SER 177 N -4.43 -0.58 0.23 2.29 0.01 -0.54 0.82 113.70 111.48 3mlw s SER 177 Ca 0.58 0.89 -0.04 0.00 1.31 0.00 0.00 55.95 58.68 3mlw s SER 177 Cb -0.11 0.87 -0.03 0.00 0.21 0.00 0.00 66.02 66.96 3mlw s SER 177 CO 0.45 -0.39 0.25 -1.48 0.41 0.00 0.00 173.24 172.48 3mlw s LEU 178 N -0.45 0.92 -0.04 2.44 0.05 0.73 -0.12 118.68 122.20 3mlw s LEU 178 Ca -0.06 -1.27 0.02 0.00 0.05 0.00 0.00 54.13 52.87 3mlw s LEU 178 Cb -0.03 0.85 0.02 0.00 -2.05 0.00 0.00 46.19 44.97 3mlw s LEU 178 CO 0.05 -0.96 -0.07 -0.44 -0.55 0.00 0.00 176.35 174.38 3mlw s SER 179 N -3.13 1.09 -0.28 1.48 0.01 -1.26 -0.06 113.70 111.55 3mlw s SER 179 Ca 0.34 -0.16 -0.02 0.00 1.31 0.00 0.00 55.95 57.41 3mlw s SER 179 Cb 0.04 -0.46 0.04 0.00 0.21 0.00 0.00 66.02 65.85 3mlw s SER 179 CO 0.12 -0.01 -0.02 -0.55 0.41 0.00 0.00 173.24 173.19 3mlw s SER 180 N 0.67 4.69 -0.12 2.44 0.15 -0.73 -1.11 113.70 119.68 3mlw s SER 180 Ca -0.10 -1.09 -0.02 0.00 0.70 0.00 0.00 55.95 55.44 3mlw s SER 180 Cb -0.13 -1.70 -0.03 0.00 -1.71 0.00 0.00 66.02 62.45 3mlw s SER 180 CO 0.01 -0.21 -0.03 0.54 1.20 0.00 0.00 173.24 174.75 3mlw s VAL 181 N 1.30 4.00 0.12 4.45 0.11 -0.53 -0.97 120.40 128.86 3mlw s VAL 181 Ca -0.03 -0.34 0.10 0.00 -2.93 0.00 0.00 61.98 58.78 3mlw s VAL 181 Cb -0.18 -2.71 -0.04 0.00 -1.53 0.00 0.00 36.38 31.92 3mlw s VAL 181 CO -0.02 0.54 -0.21 0.54 -3.33 0.00 0.00 175.10 172.62 3mlw s VAL 182 N -0.22 2.63 -0.19 2.04 0.11 0.41 -1.00 120.40 124.18 3mlw s VAL 182 Ca 0.04 -1.58 0.01 0.00 -2.93 0.00 0.00 61.98 57.53 3mlw s VAL 182 Cb -0.13 -2.19 0.02 0.00 -1.53 0.00 0.00 36.38 32.56 3mlw s VAL 182 CO 0.02 0.11 -0.19 -0.89 -3.33 0.00 0.00 175.10 170.83 3mlw s THR 183 N -1.10 2.05 0.29 5.04 2.01 -0.81 -0.72 115.64 122.41 3mlw s THR 183 Ca 0.16 -0.99 0.03 0.00 0.31 0.00 0.00 61.69 61.20 3mlw s THR 183 Cb -0.10 -1.88 -0.06 0.00 0.01 0.00 0.00 72.50 70.47 3mlw s THR 183 CO 0.08 0.48 0.07 0.68 -0.69 0.00 0.00 174.62 175.24 3mlw s VAL 184 N 1.28 0.95 0.37 3.82 -7.23 0.10 -4.69 120.40 115.01 3mlw s VAL 184 Ca 0.04 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 57.93 3mlw s VAL 184 Cb -0.14 -2.71 -0.09 0.00 0.56 0.00 0.00 36.38 34.00 3mlw s VAL 184 CO -0.12 -0.02 1.31 -2.84 -0.31 0.00 0.00 175.10 173.11 3mlw s PRO 185 N -3.94 4.15 0.49 4.82 0.02 -1.26 -0.33 135.00 138.94 3mlw s PRO 185 Ca 0.37 2.19 0.28 0.00 0.02 0.00 0.00 61.00 63.85 3mlw s PRO 185 Cb 0.08 -2.90 1.02 0.00 0.02 0.00 0.00 34.50 32.72 3mlw s PRO 185 CO 0.14 -0.35 1.86 1.03 -0.33 0.00 0.00 177.00 179.35 3mlw h SER 186 N 3.00 0.00 0.65 2.53 0.87 -1.24 -3.09 113.55 116.28 3mlw h SER 186 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 3mlw h SER 186 Cb 1.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 3mlw h SER 186 CO 0.64 0.10 0.00 -1.54 -0.53 0.00 0.00 176.83 175.50 3mlw n SER 187 N -3.21 0.00 -0.33 6.23 3.41 -1.26 -3.05 113.62 115.41 3mlw n SER 187 Ca 0.01 0.14 0.09 0.00 -0.26 0.00 0.00 58.87 58.85 3mlw n SER 187 Cb 0.40 -0.37 -0.03 0.00 -0.26 0.00 0.00 64.21 63.95 3mlw n SER 187 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3mlw n SER 188 N -1.37 1.61 0.30 4.04 3.41 -1.17 -4.61 113.62 115.83 3mlw n SER 188 Ca 0.10 -1.30 0.18 0.00 -0.26 0.00 0.00 58.87 57.58 3mlw n SER 188 Cb 0.25 0.60 0.90 0.00 -0.26 0.00 0.00 64.21 65.70 3mlw n SER 188 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3mlw h LEU 189 N 1.62 0.00 -3.00 1.04 4.07 -1.69 0.30 115.31 117.65 3mlw h LEU 189 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3mlw h LEU 189 Cb 0.61 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.35 3mlw h LEU 189 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.97 3mlw n GLY 190 N -1.24 3.43 1.07 0.83 0.00 -1.26 -4.69 105.19 103.33 3mlw n GLY 190 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.64 3mlw n GLY 190 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3mlw n THR 191 N -0.54 0.71 -3.54 2.61 -1.04 0.87 -5.06 114.28 108.29 3mlw n THR 191 Ca 0.07 0.23 -0.34 0.00 -2.04 0.00 0.00 64.05 61.97 3mlw n THR 191 Cb 0.40 -1.51 -0.05 0.00 -1.82 0.00 0.00 70.33 67.35 3mlw n THR 191 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 3mlw s GLN 192 N -2.00 3.77 0.16 -2.82 2.00 -0.16 -5.10 119.66 115.50 3mlw s GLN 192 Ca 0.00 0.18 -0.06 0.00 -2.00 0.00 0.00 55.36 53.48 3mlw s GLN 192 Cb 0.00 -2.90 -0.06 0.00 0.80 0.00 0.00 33.01 30.85 3mlw s GLN 192 CO 0.00 0.49 0.41 -0.08 -0.50 0.00 0.00 175.29 175.61 3mlw s THR 193 N -1.52 5.12 -0.19 -0.34 -1.32 -1.26 -4.77 115.64 111.35 3mlw s THR 193 Ca 0.37 0.13 -0.01 0.00 -1.21 0.00 0.00 61.69 60.98 3mlw s THR 193 Cb -0.13 -3.62 0.05 0.00 -1.51 0.00 0.00 72.50 67.29 3mlw s THR 193 CO 0.20 0.03 -0.02 -0.31 -2.21 0.00 0.00 174.62 172.31 3mlw s TYR 194 N -1.68 1.59 -0.10 9.09 2.02 -1.26 -4.98 117.35 122.03 3mlw s TYR 194 Ca 0.42 -1.14 0.03 0.00 -0.37 0.00 0.00 57.07 56.01 3mlw s TYR 194 Cb -0.12 -1.26 -0.01 0.00 -0.40 0.00 0.00 41.96 40.18 3mlw s TYR 194 CO 0.24 -0.64 -0.21 0.42 -1.57 0.00 0.00 175.55 173.78 3mlw s ILE 195 N 1.67 2.37 -0.03 2.71 -1.09 -1.26 -1.20 121.20 124.37 3mlw s ILE 195 Ca -0.02 -0.92 -0.02 0.00 -2.23 0.00 0.00 60.65 57.47 3mlw s ILE 195 Cb -0.17 -1.93 -0.04 0.00 -1.58 0.00 0.00 42.46 38.75 3mlw s ILE 195 CO -0.07 0.55 0.11 0.00 -1.23 0.00 0.00 174.94 174.30 3mlw s ASN 197 N -1.59 4.83 -0.24 0.00 0.02 0.30 -1.48 114.94 116.77 3mlw s ASN 197 Ca 0.22 -2.50 -0.21 0.00 -1.02 0.00 0.00 52.86 49.35 3mlw s ASN 197 Cb -0.12 -1.72 -0.02 0.00 0.02 0.00 0.00 41.25 39.41 3mlw s ASN 197 CO 0.12 -0.37 0.64 -0.69 0.02 0.00 0.00 177.10 176.83 3mlw s VAL 198 N 0.44 4.98 -0.17 1.60 1.01 0.14 -1.78 120.40 126.63 3mlw s VAL 198 Ca 0.13 1.18 -0.00 0.00 0.00 0.00 0.00 61.98 63.29 3mlw s VAL 198 Cb -0.22 -3.95 -0.00 0.00 0.00 0.00 0.00 36.38 32.21 3mlw s VAL 198 CO -0.04 0.04 -0.14 0.21 0.00 0.00 0.00 175.10 175.16 3mlw s ASN 199 N 1.40 3.70 -0.45 3.32 3.04 0.12 -0.83 114.94 125.25 3mlw s ASN 199 Ca 0.27 -0.47 0.02 0.00 0.04 0.00 0.00 52.86 52.72 3mlw s ASN 199 Cb -0.16 -1.58 0.14 0.00 -1.54 0.00 0.00 41.25 38.11 3mlw s ASN 199 CO 0.09 0.07 0.26 -2.28 -3.04 0.00 0.00 177.10 172.19 3mlw s HIS 200 N 0.93 1.92 0.23 0.43 5.65 -0.83 -1.24 115.29 122.38 3mlw s HIS 200 Ca -0.03 -2.41 -0.08 0.00 0.25 0.00 0.00 55.06 52.79 3mlw s HIS 200 Cb -0.15 -1.80 0.37 0.00 -1.18 0.00 0.00 32.58 29.82 3mlw s HIS 200 CO -0.02 -0.78 1.68 0.87 -0.65 0.00 0.00 174.74 175.85 3mlw h LYS 201 N 6.61 0.20 -0.79 2.88 1.79 -1.82 -1.84 116.57 123.59 3mlw h LYS 201 Ca 0.02 -0.01 0.04 0.00 -2.18 0.00 0.00 60.65 58.52 3mlw h LYS 201 Cb 0.92 -0.05 -0.05 0.00 -1.58 0.00 0.00 32.23 31.48 3mlw h LYS 201 CO 0.47 0.13 0.52 -1.35 -1.08 0.00 0.00 179.45 178.15 3mlw h PRO 202 N 0.21 0.92 -0.00 3.15 0.11 -1.91 -0.35 132.00 134.13 3mlw h PRO 202 Ca 0.36 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.42 3mlw h PRO 202 Cb 0.60 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.50 3mlw h PRO 202 CO -0.50 0.61 -0.34 0.45 -0.21 0.00 0.00 178.00 178.01 3mlw n SER 203 N -4.46 0.67 -2.41 -2.05 2.88 -1.04 -4.95 113.62 102.26 3mlw n SER 203 Ca 0.10 -0.49 -0.19 0.00 -1.33 0.00 0.00 58.87 56.97 3mlw n SER 203 Cb 0.13 0.13 -0.01 0.00 -0.75 0.00 0.00 64.21 63.72 3mlw n SER 203 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3mlw n ASN 204 N -1.12 -5.58 -4.60 -3.46 5.03 -0.14 -4.92 115.26 100.47 3mlw n ASN 204 Ca 0.09 0.02 -0.33 0.00 0.87 0.00 0.00 54.58 55.22 3mlw n ASN 204 Cb 0.33 -4.65 -0.11 0.00 -1.02 0.00 0.00 39.78 34.33 3mlw n ASN 204 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 3mlw s THR 205 N -2.97 3.78 0.02 3.41 -4.23 -1.11 -5.00 115.64 109.53 3mlw s THR 205 Ca 0.00 -0.54 0.05 0.00 -1.18 0.00 0.00 61.69 60.03 3mlw s THR 205 Cb -0.00 -2.58 -0.03 0.00 1.34 0.00 0.00 72.50 71.22 3mlw s THR 205 CO 0.00 0.53 -0.13 -0.54 -0.54 0.00 0.00 174.62 173.94 3mlw s LYS 206 N -1.02 2.30 -0.03 3.99 1.02 -1.26 -1.97 119.74 122.76 3mlw s LYS 206 Ca 0.14 -0.85 0.01 0.00 0.02 0.00 0.00 55.97 55.29 3mlw s LYS 206 Cb -0.11 -2.33 0.02 0.00 -0.52 0.00 0.00 37.83 34.89 3mlw s LYS 206 CO 0.04 0.57 -0.03 0.08 -0.92 0.00 0.00 175.35 175.09 3mlw s VAL 207 N -0.93 0.39 -0.10 3.17 1.01 -0.01 -5.01 120.40 118.91 3mlw s VAL 207 Ca 0.15 -0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 3mlw s VAL 207 Cb -0.11 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 3mlw s VAL 207 CO 0.06 0.18 -0.06 -1.81 0.00 0.00 0.00 175.10 173.47 3mlw s ASP 208 N 0.86 4.66 -0.03 3.32 1.01 -1.26 0.27 116.67 125.49 3mlw s ASP 208 Ca -0.10 -0.08 0.01 0.00 0.71 0.00 0.00 52.55 53.09 3mlw s ASP 208 Cb -0.13 -1.42 0.02 0.00 1.01 0.00 0.00 42.92 42.40 3mlw s ASP 208 CO -0.00 0.28 -0.03 -0.75 0.21 0.00 0.00 175.17 174.88 3mlw s LYS 209 N -0.34 0.54 -0.19 8.23 2.47 -0.55 -4.98 119.74 124.93 3mlw s LYS 209 Ca 0.05 -0.04 -0.23 0.00 -1.56 0.00 0.00 55.97 54.19 3mlw s LYS 209 Cb -0.12 -0.62 -0.02 0.00 -1.46 0.00 0.00 37.83 35.61 3mlw s LYS 209 CO 0.02 -0.07 0.72 0.21 0.16 0.00 0.00 175.35 176.39 3mlw s LYS 210 N 0.78 4.24 -0.46 4.03 2.20 -1.26 -1.59 119.74 127.68 3mlw s LYS 210 Ca -0.09 0.78 -0.12 0.00 -0.36 0.00 0.00 55.97 56.19 3mlw s LYS 210 Cb -0.12 -3.58 0.09 0.00 -1.51 0.00 0.00 37.83 32.71 3mlw s LYS 210 CO -0.01 -0.29 0.35 0.08 -0.36 0.00 0.00 175.35 175.12 3mlw s VAL 211 N 2.05 4.62 0.15 4.02 1.01 -0.34 -4.87 120.40 127.04 3mlw s VAL 211 Ca 0.33 -1.40 0.06 0.00 0.00 0.00 0.00 61.98 60.96 3mlw s VAL 211 Cb -0.16 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 3mlw s VAL 211 CO 0.11 -0.63 0.05 -1.61 0.00 0.00 0.00 175.10 173.02 3mlw s GLU 212 N 1.49 2.61 0.94 2.72 2.02 -1.26 -4.44 118.70 122.78 3mlw s GLU 212 Ca 0.04 -0.96 -0.11 0.00 0.02 0.00 0.00 54.97 53.96 3mlw s GLU 212 Cb -0.25 -2.50 0.16 0.00 0.10 0.00 0.00 34.13 31.63 3mlw s GLU 212 CO 0.03 0.49 1.10 -1.25 0.02 0.00 0.00 175.26 175.64 3mlw s PRO 213 N -2.84 0.88 -0.31 0.39 0.04 -1.26 -4.41 135.00 127.48 3mlw s PRO 213 Ca 0.28 1.15 0.03 0.00 0.04 0.00 0.00 61.00 62.50 3mlw s PRO 213 Cb -0.10 -1.74 0.08 0.00 0.04 0.00 0.00 34.50 32.78 3mlw s PRO 213 CO 0.20 -2.60 0.00 0.15 0.04 0.00 0.00 177.00 174.80 3mlw s LYS 214 N -4.73 1.81 0.00 4.56 1.02 -1.26 -5.00 119.74 116.13 3mlw s LYS 214 Ca 0.65 -1.67 0.00 0.00 0.02 0.00 0.00 55.97 54.97 3mlw s LYS 214 Cb -0.21 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 33.98 3mlw s LYS 214 CO 0.59 -0.81 0.44 0.45 -0.92 0.00 0.00 175.35 175.10