#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mvu n GLU 3 N 0.00 1.59 0.00 4.33 1.02 -1.26 -4.98 120.64 121.34 3mvu n GLU 3 Ca 0.00 -4.23 0.15 0.00 -0.02 0.00 0.00 57.16 53.06 3mvu n GLU 3 Cb 0.00 -2.13 0.73 0.00 -0.02 0.00 0.00 31.44 30.02 3mvu n GLU 3 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 3mvu n PRO 4 N 1.94 0.34 -0.53 3.49 -0.04 -1.26 -3.61 135.00 135.33 3mvu n PRO 4 Ca 0.23 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.74 3mvu n PRO 4 Cb 0.39 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.55 3mvu n PRO 4 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3mvu n TYR 5 N -1.33 0.44 0.00 0.54 4.01 -1.26 -4.71 117.16 114.85 3mvu n TYR 5 Ca 0.13 -1.35 0.00 0.00 -0.16 0.00 0.00 57.90 56.52 3mvu n TYR 5 Cb 0.26 -0.31 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 3mvu n TYR 5 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mvu n GLY 6 N -1.12 0.35 0.12 2.72 0.00 -1.24 -4.21 105.19 101.81 3mvu n GLY 6 Ca 0.23 -1.86 -0.14 0.00 0.00 0.00 0.00 46.02 44.25 3mvu n GLY 6 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3mvu h LYS 7 N 0.00 0.29 -0.61 1.61 1.63 -1.89 -2.84 116.57 114.76 3mvu h LYS 7 Ca 0.00 -0.20 -0.03 0.00 -0.85 0.00 0.00 60.65 59.57 3mvu h LYS 7 Cb 0.00 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 3mvu h LYS 7 CO 0.00 0.82 0.27 0.00 -3.45 0.00 0.00 179.45 177.08 3mvu h ALA 8 N 0.47 0.79 -0.60 5.00 0.00 -1.88 -1.80 119.26 121.24 3mvu h ALA 8 Ca -0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3mvu h ALA 8 Cb 0.83 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3mvu h ALA 8 CO 0.05 0.39 0.31 0.35 0.00 0.00 0.00 179.25 180.34 3mvu h PHE 9 N 0.84 0.84 -0.88 0.00 3.57 -1.78 -2.80 116.94 116.75 3mvu h PHE 9 Ca 0.21 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 3mvu h PHE 9 Cb 0.17 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 3mvu h PHE 9 CO 0.01 0.63 0.53 0.77 -2.23 0.00 0.00 178.31 178.02 3mvu h SER 10 N 0.81 1.05 0.00 0.41 0.02 -1.15 0.01 113.55 114.69 3mvu h SER 10 Ca 0.21 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3mvu h SER 10 Cb 0.09 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.36 3mvu h SER 10 CO -0.03 0.81 0.00 0.18 -1.14 0.00 0.00 176.83 176.65 3mvu n LEU 11 N -4.41 0.92 0.00 5.07 4.77 -0.73 -2.36 117.00 120.26 3mvu n LEU 11 Ca 0.09 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.61 3mvu n LEU 11 Cb 0.06 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 3mvu n LEU 11 CO 0.38 0.17 0.00 -1.14 -1.33 0.00 0.00 177.39 175.47 3mvu n ARG 13 N 0.51 0.00 -0.00 3.23 0.63 -0.01 -2.22 116.66 118.80 3mvu n ARG 13 Ca 0.00 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 56.92 3mvu n ARG 13 Cb 0.17 0.00 0.26 0.00 0.45 0.00 0.00 32.46 33.34 3mvu n ARG 13 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3mvu h ALA 14 N 0.00 1.27 0.00 5.13 0.00 -1.71 -2.04 119.26 121.91 3mvu h ALA 14 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3mvu h ALA 14 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3mvu h ALA 14 CO 0.00 0.48 0.00 0.39 0.00 0.00 0.00 179.25 180.12 3mvu n GLU 15 N -4.23 0.14 -0.11 0.00 -0.58 -0.94 -3.64 120.64 111.28 3mvu n GLU 15 Ca 0.01 0.16 0.12 0.00 -0.42 0.00 0.00 57.16 57.03 3mvu n GLU 15 Cb 0.30 -1.67 0.21 0.00 -0.57 0.00 0.00 31.44 29.71 3mvu n GLU 15 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3mvu n ALA 16 N -1.65 2.45 -1.80 0.62 0.00 -0.77 -4.94 120.51 114.42 3mvu n ALA 16 Ca 0.06 -0.82 -0.34 0.00 0.00 0.00 0.00 53.44 52.34 3mvu n ALA 16 Cb 0.35 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 18.87 3mvu n ALA 16 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3mvu s GLU 17 N -1.72 3.90 0.00 0.00 0.41 -1.20 -1.87 118.70 118.22 3mvu s GLU 17 Ca 0.35 1.29 0.23 0.00 -0.41 0.00 0.00 54.97 56.43 3mvu s GLU 17 Cb 0.21 -2.12 1.03 0.00 -1.78 0.00 0.00 34.13 31.47 3mvu s GLU 17 CO 0.31 -0.34 1.70 -0.35 -0.49 0.00 0.00 175.26 176.09 3mvu n PRO 18 N -0.91 1.44 -0.37 0.39 -0.04 -1.26 -4.87 135.00 129.38 3mvu n PRO 18 Ca 0.09 -0.66 -0.01 0.00 -0.04 0.00 0.00 63.50 62.88 3mvu n PRO 18 Cb 0.53 -1.39 0.12 0.00 -0.04 0.00 0.00 33.50 32.72 3mvu n PRO 18 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3mvu h ALA 19 N 3.98 1.29 -0.37 0.55 0.00 -1.79 -2.16 119.26 120.76 3mvu h ALA 19 Ca 0.00 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.91 3mvu h ALA 19 Cb 0.31 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 3mvu h ALA 19 CO 0.00 0.60 0.09 2.35 0.00 0.00 0.00 179.25 182.29 3mvu h TRP 20 N 1.31 0.15 -0.83 0.00 2.91 -1.72 0.56 115.95 118.33 3mvu h TRP 20 Ca 0.38 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.38 3mvu h TRP 20 Cb -0.08 -0.01 -0.04 0.00 -0.51 0.00 0.00 29.16 28.53 3mvu h TRP 20 CO -0.00 0.03 0.36 -0.09 -1.03 0.00 0.00 178.44 177.72 3mvu h ARG 21 N 0.22 1.21 -0.08 2.65 2.43 -1.81 -0.31 114.38 118.69 3mvu h ARG 21 Ca 0.18 -0.20 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 3mvu h ARG 21 Cb 0.19 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 3mvu h ARG 21 CO -0.22 0.95 -0.02 0.00 -1.51 0.00 0.00 179.97 179.17 3mvu h ALA 22 N 1.20 1.82 0.25 2.80 0.00 -0.69 0.11 119.26 124.74 3mvu h ALA 22 Ca 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3mvu h ALA 22 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3mvu h ALA 22 CO -0.03 0.14 -0.12 -0.92 0.00 0.00 0.00 179.25 178.32 3mvu h TYR 23 N 0.11 -0.31 0.00 0.00 3.20 -0.48 -3.03 116.97 116.47 3mvu h TYR 23 Ca 0.03 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3mvu h TYR 23 Cb 0.12 0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.49 3mvu h TYR 23 CO 0.00 -0.16 0.00 1.79 -1.64 0.00 0.00 178.16 178.15 3mvu h THR 24 N -1.08 0.00 0.00 1.81 1.35 -0.98 -2.95 112.91 111.07 3mvu h THR 24 Ca -0.03 -0.43 -0.00 0.00 -0.55 0.00 0.00 66.41 65.40 3mvu h THR 24 Cb 0.28 1.34 -0.00 0.00 -1.73 0.00 0.00 68.15 68.04 3mvu h THR 24 CO 0.06 0.00 -0.35 1.41 -0.25 0.00 0.00 175.52 176.39 3mvu n HIS 25 N -2.34 0.00 -1.50 4.73 8.25 0.02 -4.85 115.22 119.53 3mvu n HIS 25 Ca 0.04 -1.33 -0.36 0.00 -0.26 0.00 0.00 57.72 55.81 3mvu n HIS 25 Cb 0.36 -0.22 0.08 0.00 1.12 0.00 0.00 29.99 31.34 3mvu n HIS 25 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 3mvu n HIS 26 N -1.20 1.41 -0.32 4.41 -0.00 -1.12 -4.75 115.22 113.65 3mvu n HIS 26 Ca 0.18 0.41 0.14 0.00 -0.00 0.00 0.00 57.72 58.45 3mvu n HIS 26 Cb 0.68 -2.18 0.37 0.00 -0.00 0.00 0.00 29.99 28.85 3mvu n HIS 26 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3mvu h ALA 27 N 0.04 1.81 -0.68 1.57 0.00 -1.92 -0.46 119.26 119.62 3mvu h ALA 27 Ca -0.49 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3mvu h ALA 27 Cb 1.33 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 3mvu h ALA 27 CO 0.50 -0.13 0.43 0.35 0.00 0.00 0.00 179.25 180.40 3mvu h PHE 28 N 0.70 0.87 -0.68 0.00 3.04 -1.91 -0.94 116.94 118.02 3mvu h PHE 28 Ca 0.53 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 62.42 3mvu h PHE 28 Cb 0.90 -0.29 -0.03 0.00 2.56 0.00 0.00 35.95 39.09 3mvu h PHE 28 CO -0.00 0.56 0.14 0.28 -2.02 0.00 0.00 178.31 177.27 3mvu h VAL 29 N 0.92 1.26 -0.44 1.41 2.07 -1.49 -1.48 116.25 118.49 3mvu h VAL 29 Ca 0.25 -0.99 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 3mvu h VAL 29 Cb -0.08 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 3mvu h VAL 29 CO -0.05 0.38 0.06 -0.33 0.02 0.00 0.00 177.57 177.65 3mvu h GLU 30 N 1.02 0.68 -0.76 1.57 4.39 -0.68 -0.18 114.58 120.63 3mvu h GLU 30 Ca 0.21 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 3mvu h GLU 30 Cb 0.40 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.91 3mvu h GLU 30 CO 0.01 0.66 0.42 0.78 -1.16 0.00 0.00 179.01 179.72 3mvu h GLY 31 N 0.90 1.13 0.98 -3.84 0.00 -0.76 -1.35 103.07 100.14 3mvu h GLY 31 Ca 0.14 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 3mvu h GLY 31 CO 0.01 0.49 0.28 1.41 0.00 0.00 0.00 176.54 178.72 3mvu h LEU 32 N 1.05 0.65 -0.20 3.11 3.38 -0.69 -0.35 115.31 122.26 3mvu h LEU 32 Ca 0.27 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 3mvu h LEU 32 Cb 0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3mvu h LEU 32 CO -0.04 0.55 0.11 0.50 0.09 0.00 0.00 178.44 179.65 3mvu h LYS 33 N 0.69 0.28 -0.01 1.13 3.64 -0.70 -2.93 116.57 118.67 3mvu h LYS 33 Ca 0.18 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3mvu h LYS 33 Cb 0.05 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 3mvu h LYS 33 CO -0.03 0.26 -0.09 0.00 -2.27 0.00 0.00 179.45 177.32 3mvu n ALA 34 N -2.19 2.75 -1.95 5.00 0.00 -0.54 -1.18 120.51 122.40 3mvu n ALA 34 Ca -0.03 -0.40 -0.19 0.00 0.00 0.00 0.00 53.44 52.81 3mvu n ALA 34 Cb 0.07 -1.19 -0.04 0.00 0.00 0.00 0.00 19.45 18.29 3mvu n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mvu n GLY 35 N 1.23 0.70 0.00 0.00 0.00 -0.46 -4.46 105.19 102.20 3mvu n GLY 35 Ca 0.17 -0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.18 3mvu n GLY 35 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3mvu n THR 36 N -3.24 0.00 -1.70 2.61 -2.24 -0.27 -4.95 114.28 104.50 3mvu n THR 36 Ca -0.21 -0.04 -0.44 0.00 -2.27 0.00 0.00 64.05 61.10 3mvu n THR 36 Cb 0.64 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 69.78 3mvu n THR 36 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3mvu n LEU 37 N -1.53 3.62 -4.77 3.22 7.94 -0.94 -4.94 117.00 119.60 3mvu n LEU 37 Ca 0.03 1.07 -0.38 0.00 -1.11 0.00 0.00 56.01 55.63 3mvu n LEU 37 Cb 0.34 -1.51 -0.00 0.00 0.53 0.00 0.00 43.42 42.77 3mvu n LEU 37 CO 0.42 -0.02 0.87 -2.84 -1.11 0.00 0.00 177.39 174.71 3mvu s PRO 38 N 1.04 3.79 0.32 1.96 0.02 -1.26 -4.86 135.00 136.00 3mvu s PRO 38 Ca 0.76 1.91 -0.00 0.00 0.02 0.00 0.00 61.00 63.69 3mvu s PRO 38 Cb -0.58 -2.51 0.52 0.00 0.02 0.00 0.00 34.50 31.95 3mvu s PRO 38 CO 0.35 -0.56 1.97 -0.09 -0.33 0.00 0.00 177.00 178.33 3mvu h ARG 39 N 2.22 0.99 -0.91 5.54 2.43 -1.98 -1.21 114.38 121.46 3mvu h ARG 39 Ca -0.49 -0.06 0.06 0.00 -0.81 0.00 0.00 59.98 58.68 3mvu h ARG 39 Cb 1.25 -0.22 -0.06 0.00 -0.42 0.00 0.00 29.97 30.51 3mvu h ARG 39 CO 0.61 0.66 0.57 1.49 -1.51 0.00 0.00 179.97 181.79 3mvu h GLU 40 N 1.02 1.02 -0.33 0.20 4.57 -1.99 0.58 114.58 119.65 3mvu h GLU 40 Ca 0.30 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 58.35 3mvu h GLU 40 Cb -0.04 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 28.31 3mvu h GLU 40 CO -0.08 0.67 -0.09 0.00 -1.18 0.00 0.00 179.01 178.34 3mvu h ALA 41 N 1.42 0.46 -0.37 2.92 0.00 -1.54 -1.97 119.26 120.17 3mvu h ALA 41 Ca 0.39 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3mvu h ALA 41 Cb 0.16 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3mvu h ALA 41 CO -0.17 0.30 0.21 0.35 0.00 0.00 0.00 179.25 179.94 3mvu h PHE 42 N 0.42 0.50 -0.67 0.00 3.57 -0.55 -0.75 116.94 119.47 3mvu h PHE 42 Ca 0.08 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 3mvu h PHE 42 Cb 0.59 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.14 3mvu h PHE 42 CO 0.05 0.38 0.13 -0.07 -2.23 0.00 0.00 178.31 176.58 3mvu h LEU 43 N 0.48 1.04 -0.43 0.59 3.38 -0.88 0.50 115.31 119.99 3mvu h LEU 43 Ca 0.13 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.87 3mvu h LEU 43 Cb 0.04 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3mvu h LEU 43 CO -0.02 1.03 0.25 -0.74 0.09 0.00 0.00 178.44 179.05 3mvu h HIS 44 N 1.02 0.47 -0.86 1.13 2.76 -1.23 -2.11 115.15 116.33 3mvu h HIS 44 Ca 0.21 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.40 3mvu h HIS 44 Cb 0.41 -0.15 -0.04 0.00 1.55 0.00 0.00 27.41 29.18 3mvu h HIS 44 CO 0.03 0.28 0.57 -0.92 -1.30 0.00 0.00 177.93 176.59 3mvu h TYR 45 N 0.51 1.09 -0.36 5.26 3.20 -0.58 -1.93 116.97 124.16 3mvu h TYR 45 Ca 0.17 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.06 3mvu h TYR 45 Cb 0.01 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 37.89 3mvu h TYR 45 CO -0.07 0.69 0.22 -0.07 -1.64 0.00 0.00 178.16 177.29 3mvu h LEU 46 N 1.17 0.42 -0.27 2.82 3.38 -0.57 0.26 115.31 122.53 3mvu h LEU 46 Ca 0.32 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 3mvu h LEU 46 Cb -0.13 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3mvu h LEU 46 CO -0.07 0.34 0.14 -0.61 0.09 0.00 0.00 178.44 178.32 3mvu h GLN 47 N 0.47 0.39 -0.51 1.13 4.15 -1.19 -1.16 115.11 118.40 3mvu h GLN 47 Ca 0.13 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 59.42 3mvu h GLN 47 Cb -0.02 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.58 3mvu h GLN 47 CO -0.03 0.37 0.01 1.96 -1.93 0.00 0.00 178.83 179.22 3mvu h GLN 48 N 0.31 0.85 0.00 1.69 1.08 -1.19 -2.41 115.11 115.43 3mvu h GLN 48 Ca 0.09 -0.23 -0.05 0.00 -1.45 0.00 0.00 58.65 57.02 3mvu h GLN 48 Cb 0.11 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 3mvu h GLN 48 CO -0.01 0.84 -0.23 0.22 -0.95 0.00 0.00 178.83 178.70 3mvu h ASP 49 N 0.79 0.00 -0.45 1.46 3.58 -0.10 -0.09 116.42 121.60 3mvu h ASP 49 Ca 0.15 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.58 3mvu h ASP 49 Cb 0.46 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.49 3mvu h ASP 49 CO 0.02 0.23 0.19 0.22 -2.88 0.00 0.00 179.24 177.02 3mvu h TYR 50 N 0.00 0.67 -0.43 0.28 3.20 -0.70 0.57 116.97 120.56 3mvu h TYR 50 Ca -0.00 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.74 3mvu h TYR 50 Cb 0.48 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 3mvu h TYR 50 CO 0.00 0.56 -0.07 0.28 -1.64 0.00 0.00 178.16 177.29 3mvu h VAL 51 N 0.58 1.27 -0.59 1.81 2.07 -1.34 -2.94 116.25 117.10 3mvu h VAL 51 Ca 0.15 -1.16 0.05 0.00 0.82 0.00 0.00 66.70 66.56 3mvu h VAL 51 Cb 0.17 1.15 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 3mvu h VAL 51 CO -0.01 0.39 0.31 0.15 0.02 0.00 0.00 177.57 178.43 3mvu h PHE 52 N 0.63 0.57 -0.25 1.57 3.04 -0.64 -2.21 116.94 119.65 3mvu h PHE 52 Ca 0.11 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.06 3mvu h PHE 52 Cb 0.60 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 38.92 3mvu h PHE 52 CO 0.05 0.27 0.04 -0.07 -2.02 0.00 0.00 178.31 176.58 3mvu h LEU 53 N 0.59 0.33 0.26 0.59 3.38 -0.79 0.14 115.31 119.80 3mvu h LEU 53 Ca 0.26 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 3mvu h LEU 53 Cb 0.17 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3mvu h LEU 53 CO -0.18 0.35 -0.23 0.40 0.09 0.00 0.00 178.44 178.88 3mvu h ILE 54 N 0.36 0.50 -0.03 1.22 1.08 -1.23 0.52 117.51 119.92 3mvu h ILE 54 Ca 0.09 0.00 -0.18 0.00 -0.39 0.00 0.00 64.86 64.38 3mvu h ILE 54 Cb 0.18 0.50 -0.01 0.00 -3.07 0.00 0.00 36.82 34.42 3mvu h ILE 54 CO -0.00 0.00 -0.75 0.45 -0.69 0.00 0.00 178.15 177.16 3mvu h HIS 55 N -0.51 0.32 -0.51 1.37 3.86 -1.20 -2.09 115.15 116.39 3mvu h HIS 55 Ca -0.01 -0.15 -0.10 0.00 -1.16 0.00 0.00 60.37 58.95 3mvu h HIS 55 Cb 0.47 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.87 3mvu h HIS 55 CO -0.15 0.90 -0.08 0.35 0.86 0.00 0.00 177.93 179.81 3mvu h PHE 56 N 0.15 1.02 -0.60 2.45 3.57 -0.67 -0.98 116.94 121.87 3mvu h PHE 56 Ca -0.03 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.28 3mvu h PHE 56 Cb 1.33 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.78 3mvu h PHE 56 CO 0.03 0.95 0.38 0.77 -2.23 0.00 0.00 178.31 178.21 3mvu h SER 57 N 0.84 0.71 -0.90 0.41 0.02 -0.69 -1.19 113.55 112.74 3mvu h SER 57 Ca 0.14 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 3mvu h SER 57 Cb 0.61 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 3mvu h SER 57 CO 0.04 0.54 0.59 0.03 -1.14 0.00 0.00 176.83 176.89 3mvu h ARG 58 N 0.81 1.18 -0.64 3.45 3.08 -0.99 -0.55 114.38 120.72 3mvu h ARG 58 Ca 0.22 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.12 3mvu h ARG 58 Cb -0.05 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 29.70 3mvu h ARG 58 CO -0.04 0.78 0.10 0.00 -1.07 0.00 0.00 179.97 179.73 3mvu h ALA 59 N 1.44 0.95 -0.14 0.04 0.00 -0.68 0.63 119.26 121.50 3mvu h ALA 59 Ca 0.33 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 3mvu h ALA 59 Cb -0.14 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 3mvu h ALA 59 CO -0.07 0.65 -0.34 -1.49 0.00 0.00 0.00 179.25 178.00 3mvu h TRP 60 N 0.99 0.34 -0.65 0.00 4.06 -0.84 -1.84 115.95 118.02 3mvu h TRP 60 Ca 0.20 -0.08 -0.08 0.00 2.06 0.00 0.00 58.89 60.99 3mvu h TRP 60 Cb 0.44 -0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 28.49 3mvu h TRP 60 CO 0.03 0.61 0.11 0.00 -3.56 0.00 0.00 178.44 175.63 3mvu h ALA 61 N 1.39 0.96 -0.62 1.49 0.00 -0.61 -2.17 119.26 119.69 3mvu h ALA 61 Ca 0.03 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.73 3mvu h ALA 61 Cb 0.73 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 3mvu h ALA 61 CO 0.06 0.65 0.41 1.25 0.00 0.00 0.00 179.25 181.62 3mvu h LEU 62 N 1.00 0.56 -1.13 0.00 5.85 -0.38 -1.28 115.31 119.93 3mvu h LEU 62 Ca 0.20 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 3mvu h LEU 62 Cb 0.43 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 3mvu h LEU 62 CO 0.01 0.37 0.44 0.00 -0.34 0.00 0.00 178.44 178.92 3mvu h ALA 63 N 1.66 1.34 -0.17 1.25 0.00 -0.70 0.12 119.26 122.76 3mvu h ALA 63 Ca 0.26 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.10 3mvu h ALA 63 Cb 0.23 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3mvu h ALA 63 CO -0.08 0.55 0.02 0.28 0.00 0.00 0.00 179.25 180.02 3mvu h VAL 64 N 1.05 0.90 -0.79 0.00 2.07 -0.99 -1.78 116.25 116.72 3mvu h VAL 64 Ca 0.27 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.80 3mvu h VAL 64 Cb -0.01 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 30.53 3mvu h VAL 64 CO -0.05 0.01 0.52 0.58 0.02 0.00 0.00 177.57 178.66 3mvu h VAL 65 N 0.08 1.12 -0.00 2.57 2.07 -0.92 -1.95 116.25 119.21 3mvu h VAL 65 Ca 0.08 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3mvu h VAL 65 Cb 0.08 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.92 3mvu h VAL 65 CO -0.12 0.18 -0.11 0.29 0.02 0.00 0.00 177.57 177.83 3mvu n LYS 66 N -4.45 0.79 -2.40 1.57 4.76 -0.07 -4.90 118.16 113.45 3mvu n LYS 66 Ca 0.10 -0.30 -0.37 0.00 -2.87 0.00 0.00 58.31 54.88 3mvu n LYS 66 Cb 0.12 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 31.80 3mvu n LYS 66 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 3mvu s SER 67 N -2.42 6.43 -0.09 4.39 0.01 -0.69 -4.38 113.70 116.95 3mvu s SER 67 Ca 0.30 2.16 0.14 0.00 1.31 0.00 0.00 55.95 59.86 3mvu s SER 67 Cb 0.20 -2.59 -0.21 0.00 0.21 0.00 0.00 66.02 63.63 3mvu s SER 67 CO 0.46 -0.73 0.18 -0.62 0.41 0.00 0.00 173.24 172.95 3mvu n GLU 68 N -0.36 1.10 -4.41 12.44 1.02 -1.26 -5.02 120.64 124.15 3mvu n GLU 68 Ca 0.07 -0.07 -0.25 0.00 -0.02 0.00 0.00 57.16 56.88 3mvu n GLU 68 Cb 0.49 -1.38 -0.10 0.00 -0.02 0.00 0.00 31.44 30.43 3mvu n GLU 68 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3mvu s THR 69 N -2.69 2.64 0.37 2.62 -4.23 -1.26 -5.02 115.64 108.07 3mvu s THR 69 Ca -0.07 -2.10 0.04 0.00 -1.18 0.00 0.00 61.69 58.39 3mvu s THR 69 Cb 0.07 -2.33 0.24 0.00 1.34 0.00 0.00 72.50 71.82 3mvu s THR 69 CO 0.63 -0.24 2.00 -0.74 -0.54 0.00 0.00 174.62 175.73 3mvu h HIS 70 N 2.69 0.64 -0.28 3.99 2.76 -2.03 -2.70 115.15 120.23 3mvu h HIS 70 Ca -0.44 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 57.72 3mvu h HIS 70 Cb 1.23 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.97 3mvu h HIS 70 CO 0.73 0.44 0.15 1.03 -1.30 0.00 0.00 177.93 178.98 3mvu h SER 71 N 0.67 0.35 0.00 3.26 0.87 -2.02 0.37 113.55 117.06 3mvu h SER 71 Ca 0.18 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3mvu h SER 71 Cb -0.00 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 3mvu h SER 71 CO -0.03 0.35 0.00 -0.62 -0.53 0.00 0.00 176.83 175.99 3mvu n GLU 72 N -4.82 0.00 0.00 2.24 1.02 -1.02 -1.78 120.64 116.28 3mvu n GLU 72 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 3mvu n GLU 72 Cb 0.08 -1.02 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 3mvu n GLU 72 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3mvu n LEU 74 N 0.53 0.00 -0.10 -4.62 4.77 0.12 -1.52 117.00 116.18 3mvu n LEU 74 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 3mvu n LEU 74 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 3mvu n LEU 74 CO 0.00 0.00 0.87 0.00 -1.33 0.00 0.00 177.39 176.93 3mvu h ALA 75 N 0.00 0.41 -0.58 -1.18 0.00 -1.60 0.86 119.26 117.18 3mvu h ALA 75 Ca 0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 3mvu h ALA 75 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3mvu h ALA 75 CO 0.00 0.04 0.14 0.00 0.00 0.00 0.00 179.25 179.43 3mvu h ALA 76 N 0.95 0.76 -0.49 0.00 0.00 -1.54 -2.09 119.26 116.85 3mvu h ALA 76 Ca 0.10 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3mvu h ALA 76 Cb 0.23 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3mvu h ALA 76 CO -0.01 0.47 0.30 0.28 0.00 0.00 0.00 179.25 180.30 3mvu h VAL 77 N 0.83 1.15 -0.56 0.00 2.07 -1.77 -0.28 116.25 117.70 3mvu h VAL 77 Ca 0.18 -0.32 0.11 0.00 0.82 0.00 0.00 66.70 67.49 3mvu h VAL 77 Cb 0.35 0.48 -0.10 0.00 -1.52 0.00 0.00 31.29 30.50 3mvu h VAL 77 CO 0.00 0.15 -0.02 1.23 0.02 0.00 0.00 177.57 178.95 3mvu h GLY 78 N 0.66 0.56 1.07 2.17 0.00 -0.68 -1.46 103.07 105.39 3mvu h GLY 78 Ca 0.18 0.09 -0.11 0.00 0.00 0.00 0.00 47.33 47.49 3mvu h GLY 78 CO -0.03 -0.18 -0.10 -0.84 0.00 0.00 0.00 176.54 175.38 3mvu h THR 79 N 0.10 1.27 -0.94 4.70 2.02 -0.83 -0.84 112.91 118.39 3mvu h THR 79 Ca 0.29 -1.25 0.07 0.00 0.77 0.00 0.00 66.41 66.29 3mvu h THR 79 Cb 0.45 1.03 -0.07 0.00 -1.74 0.00 0.00 68.15 67.82 3mvu h THR 79 CO -0.49 0.44 0.59 0.58 0.37 0.00 0.00 175.52 177.01 3mvu h VAL 80 N 0.83 1.05 -0.21 3.16 2.07 -0.52 -1.85 116.25 120.78 3mvu h VAL 80 Ca 0.13 -0.36 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 3mvu h VAL 80 Cb 0.66 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 3mvu h VAL 80 CO 0.05 0.19 -0.06 0.78 0.02 0.00 0.00 177.57 178.55 3mvu h ASN 81 N 1.06 0.42 -0.01 0.57 2.35 -1.04 0.31 115.58 119.25 3mvu h ASN 81 Ca 0.41 -0.38 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3mvu h ASN 81 Cb 0.21 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 3mvu h ASN 81 CO -0.18 0.71 0.46 0.00 -1.65 0.00 0.00 177.43 176.76 3mvu h ALA 82 N 0.73 1.47 0.00 -0.83 0.00 -0.84 -2.47 119.26 117.32 3mvu h ALA 82 Ca 0.05 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 3mvu h ALA 82 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 3mvu h ALA 82 CO 0.02 -0.47 -1.90 1.28 0.00 0.00 0.00 179.25 178.19 3mvu n LEU 83 N -2.82 2.74 -0.06 0.00 4.77 -0.72 -2.62 117.00 118.28 3mvu n LEU 83 Ca -0.01 -0.08 -0.04 0.00 -0.03 0.00 0.00 56.01 55.85 3mvu n LEU 83 Cb 0.50 -0.49 -0.11 0.00 -2.33 0.00 0.00 43.42 40.99 3mvu n LEU 83 CO 0.11 0.73 -0.90 0.52 -1.33 0.00 0.00 177.39 176.52 3mvu n VAL 84 N -2.92 0.75 -1.42 4.08 0.31 0.10 -3.12 118.33 116.11 3mvu n VAL 84 Ca -0.28 -0.54 -0.07 0.00 -0.01 0.00 0.00 64.34 63.44 3mvu n VAL 84 Cb 0.81 -0.44 0.20 0.00 -0.91 0.00 0.00 33.84 33.49 3mvu n VAL 84 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3mvu n ALA 85 N -2.41 4.53 -0.84 3.52 0.00 -0.95 -4.67 120.51 119.69 3mvu n ALA 85 Ca -0.18 -3.10 0.00 0.00 0.00 0.00 0.00 53.44 50.15 3mvu n ALA 85 Cb 0.83 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.43 3mvu n ALA 85 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3mvu n GLU 86 N -1.12 0.00 0.00 0.00 0.28 -1.16 -4.91 120.64 113.73 3mvu n GLU 86 Ca 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.37 3mvu n GLU 86 Cb 1.14 0.00 0.00 0.00 1.43 0.00 0.00 31.44 34.01 3mvu n GLU 86 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 3mvu n GLU 87 N -1.24 0.19 0.00 3.44 2.13 -1.08 -1.42 120.64 122.67 3mvu n GLU 87 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3mvu n GLU 87 Cb 0.00 -1.27 0.00 0.00 0.27 0.00 0.00 31.44 30.44 3mvu n GLU 87 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3mvu n GLN 89 N 0.68 0.00 -0.12 5.31 6.02 -1.26 -0.97 117.38 127.04 3mvu n GLN 89 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.88 3mvu n GLN 89 Cb 0.07 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.31 3mvu n GLN 89 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3mvu h LEU 90 N 0.00 0.57 -0.71 1.08 3.38 -1.64 -2.82 115.31 115.17 3mvu h LEU 90 Ca 0.00 -0.29 0.07 0.00 0.09 0.00 0.00 57.88 57.75 3mvu h LEU 90 Cb 0.00 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.54 3mvu h LEU 90 CO 0.00 0.72 0.39 -0.74 0.09 0.00 0.00 178.44 178.91 3mvu h HIS 91 N 0.40 0.72 -0.99 1.13 2.76 -1.29 0.67 115.15 118.53 3mvu h HIS 91 Ca 0.10 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.32 3mvu h HIS 91 Cb 0.42 -0.22 -0.05 0.00 1.55 0.00 0.00 27.41 29.11 3mvu h HIS 91 CO 0.03 0.32 0.66 0.97 -1.30 0.00 0.00 177.93 178.61 3mvu h ILE 92 N 0.70 1.21 -0.80 6.26 2.10 -1.81 -0.72 117.51 124.46 3mvu h ILE 92 Ca 0.33 -0.45 -0.03 0.00 1.08 0.00 0.00 64.86 65.79 3mvu h ILE 92 Cb 0.25 -0.20 -0.04 0.00 -1.09 0.00 0.00 36.82 35.74 3mvu h ILE 92 CO -0.21 0.24 0.36 1.23 -1.08 0.00 0.00 178.15 178.69 3mvu h GLY 93 N 1.30 1.24 0.84 8.18 0.00 -0.89 0.17 103.07 113.92 3mvu h GLY 93 Ca 0.38 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 3mvu h GLY 93 CO -0.10 0.60 0.04 0.16 0.00 0.00 0.00 176.54 177.24 3mvu h ILE 94 N 1.13 1.22 -0.47 2.60 3.07 -0.33 0.63 117.51 125.37 3mvu h ILE 94 Ca 0.27 -0.72 0.06 0.00 1.55 0.00 0.00 64.86 66.02 3mvu h ILE 94 Cb 0.15 1.32 -0.05 0.00 -0.27 0.00 0.00 36.82 37.96 3mvu h ILE 94 CO -0.03 0.22 0.16 0.00 -1.05 0.00 0.00 178.15 177.45 3mvu h GLU 96 N 0.34 0.89 0.00 0.00 4.81 -0.81 -1.62 114.58 118.19 3mvu h GLU 96 Ca 0.22 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 3mvu h GLU 96 Cb 0.23 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 3mvu h GLU 96 CO -0.23 0.79 -0.23 0.00 -0.73 0.00 0.00 179.01 178.62 3mvu h ALA 97 N 1.06 1.61 -0.16 2.92 0.00 -0.65 -2.42 119.26 121.62 3mvu h ALA 97 Ca 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3mvu h ALA 97 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3mvu h ALA 97 CO -0.01 0.28 0.00 0.43 0.00 0.00 0.00 179.25 179.95 3mvu n SER 98 N -4.25 1.22 0.00 0.00 7.64 -0.51 -4.95 113.62 112.78 3mvu n SER 98 Ca -0.02 -1.74 0.00 0.00 1.01 0.00 0.00 58.87 58.11 3mvu n SER 98 Cb 0.28 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 3mvu n SER 98 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mvu n GLY 99 N 0.99 2.52 3.64 0.23 0.00 -0.79 -5.05 105.19 106.74 3mvu n GLY 99 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 3mvu n GLY 99 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mvu s ILE 100 N -2.51 4.08 0.94 -0.61 -5.25 -0.68 -4.96 121.20 112.21 3mvu s ILE 100 Ca 0.00 1.24 -0.13 0.00 -0.99 0.00 0.00 60.65 60.77 3mvu s ILE 100 Cb 0.00 -4.02 0.02 0.00 2.95 0.00 0.00 42.46 41.41 3mvu s ILE 100 CO 0.00 -0.35 0.35 -0.24 -1.79 0.00 0.00 174.94 172.91 3mvu n SER 101 N 7.52 -2.23 0.09 4.36 2.88 -1.26 -3.91 113.62 121.07 3mvu n SER 101 Ca 0.15 0.34 -0.14 0.00 -1.33 0.00 0.00 58.87 57.90 3mvu n SER 101 Cb 0.46 -1.18 -0.10 0.00 -0.75 0.00 0.00 64.21 62.64 3mvu n SER 101 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 3mvu h GLN 102 N -1.44 0.28 -0.17 -1.46 -0.00 -1.98 -2.37 115.11 107.97 3mvu h GLN 102 Ca -0.44 -0.40 -0.09 0.00 -0.00 0.00 0.00 58.65 57.73 3mvu h GLN 102 Cb 1.29 0.14 -0.00 0.00 -0.00 0.00 0.00 27.48 28.90 3mvu h GLN 102 CO 0.34 1.14 -0.24 1.05 -0.00 0.00 0.00 178.83 181.12 3mvu h GLU 103 N 0.11 0.47 -0.91 0.06 9.09 -1.99 -2.26 114.58 119.15 3mvu h GLU 103 Ca -0.10 -0.27 -0.01 0.00 0.05 0.00 0.00 59.36 59.02 3mvu h GLU 103 Cb 1.80 0.02 -0.04 0.00 -1.65 0.00 0.00 28.75 28.88 3mvu h GLU 103 CO 0.18 0.86 0.52 0.00 0.05 0.00 0.00 179.01 180.62 3mvu h ALA 104 N 0.60 1.21 -0.63 1.06 0.00 -1.95 -1.48 119.26 118.06 3mvu h ALA 104 Ca 0.02 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.82 3mvu h ALA 104 Cb 0.81 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 3mvu h ALA 104 CO 0.06 0.66 0.41 1.25 0.00 0.00 0.00 179.25 181.63 3mvu h LEU 105 N 1.27 0.71 -1.12 0.00 5.85 -1.44 -2.70 115.31 117.87 3mvu h LEU 105 Ca 0.32 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.94 3mvu h LEU 105 Cb -0.01 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 3mvu h LEU 105 CO -0.06 0.51 -0.43 -0.26 -0.34 0.00 0.00 178.44 177.87 3mvu h PHE 106 N 0.84 0.03 -0.22 1.25 0.04 -0.91 -2.14 116.94 115.82 3mvu h PHE 106 Ca 0.24 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.99 3mvu h PHE 106 Cb -0.08 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.06 3mvu h PHE 106 CO -0.03 0.45 0.02 0.00 -0.60 0.00 0.00 178.31 178.14 3mvu n ALA 107 N -2.46 3.06 -2.02 2.45 0.00 -0.60 -4.94 120.51 116.00 3mvu n ALA 107 Ca -0.02 -0.73 -0.42 0.00 0.00 0.00 0.00 53.44 52.27 3mvu n ALA 107 Cb 0.46 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 3mvu n ALA 107 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3mvu s THR 108 N -1.62 3.54 -0.16 0.00 2.01 -0.81 -4.94 115.64 113.66 3mvu s THR 108 Ca 0.20 0.72 -0.29 0.00 0.31 0.00 0.00 61.69 62.63 3mvu s THR 108 Cb 0.15 -3.46 -0.02 0.00 0.01 0.00 0.00 72.50 69.18 3mvu s THR 108 CO 0.06 -0.05 1.34 -0.60 -0.69 0.00 0.00 174.62 174.68 3mvu s ARG 109 N 3.74 4.19 -0.06 4.92 3.52 -1.26 -4.98 118.95 129.01 3mvu s ARG 109 Ca 0.72 1.72 -0.30 0.00 -0.13 0.00 0.00 55.73 57.75 3mvu s ARG 109 Cb -0.34 -3.82 -0.04 0.00 -1.56 0.00 0.00 34.95 29.19 3mvu s ARG 109 CO 0.29 -0.78 1.43 -2.00 -0.81 0.00 0.00 175.30 173.43 3mvu s GLU 110 N 3.68 4.24 0.58 5.12 2.12 -1.26 -4.99 118.70 128.18 3mvu s GLU 110 Ca 0.59 1.93 -0.19 0.00 0.36 0.00 0.00 54.97 57.66 3mvu s GLU 110 Cb -0.23 -3.74 -0.04 0.00 0.26 0.00 0.00 34.13 30.37 3mvu s GLU 110 CO 0.18 -0.68 1.17 1.03 -0.54 0.00 0.00 175.26 176.42 3mvu s ARG 111 N 3.15 3.12 0.24 4.30 1.81 -1.26 -4.83 118.95 125.49 3mvu s ARG 111 Ca 0.64 1.72 -0.04 0.00 -1.72 0.00 0.00 55.73 56.32 3mvu s ARG 111 Cb -0.29 -1.96 0.39 0.00 -0.45 0.00 0.00 34.95 32.64 3mvu s ARG 111 CO 0.24 -1.06 1.80 0.00 -0.68 0.00 0.00 175.30 175.60 3mvu h ALA 112 N 0.98 1.15 -0.11 2.13 0.00 -1.98 -0.70 119.26 120.73 3mvu h ALA 112 Ca -0.50 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 3mvu h ALA 112 Cb 1.28 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3mvu h ALA 112 CO 0.56 0.06 -0.11 0.93 0.00 0.00 0.00 179.25 180.69 3mvu h GLU 113 N 0.75 0.17 0.33 0.00 3.07 -1.92 0.25 114.58 117.23 3mvu h GLU 113 Ca 0.39 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 59.20 3mvu h GLU 113 Cb 0.38 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 3mvu h GLU 113 CO -0.26 0.29 -0.16 -0.97 -1.40 0.00 0.00 179.01 176.51 3mvu h ASN 114 N 0.16 -0.38 -0.64 1.42 -0.73 -1.64 -3.10 115.58 110.67 3mvu h ASN 114 Ca 0.04 -0.10 0.11 0.00 1.87 0.00 0.00 56.30 58.21 3mvu h ASN 114 Cb 0.30 0.10 -0.08 0.00 0.27 0.00 0.00 38.32 38.90 3mvu h ASN 114 CO 0.02 0.09 0.22 0.25 -0.37 0.00 0.00 177.43 177.63 3mvu h LEU 115 N -1.04 0.18 -0.53 0.34 6.46 -1.11 -1.69 115.31 117.93 3mvu h LEU 115 Ca -0.05 0.09 0.07 0.00 -0.12 0.00 0.00 57.88 57.88 3mvu h LEU 115 Cb 0.46 0.09 -0.06 0.00 -0.73 0.00 0.00 40.66 40.42 3mvu h LEU 115 CO 0.07 0.10 0.20 0.00 -0.62 0.00 0.00 178.44 178.20 3mvu h ALA 116 N 1.47 0.67 0.17 1.25 0.00 -0.59 -0.45 119.26 121.78 3mvu h ALA 116 Ca 0.34 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 3mvu h ALA 116 Cb 0.46 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3mvu h ALA 116 CO -0.35 -0.19 -0.08 -0.92 0.00 0.00 0.00 179.25 177.71 3mvu h TYR 117 N 0.39 -0.21 -0.46 0.00 5.03 -1.33 -1.34 116.97 119.06 3mvu h TYR 117 Ca 0.26 -0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.49 3mvu h TYR 117 Cb 0.27 0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.60 3mvu h TYR 117 CO -0.15 0.19 -0.03 1.79 -1.32 0.00 0.00 178.16 178.64 3mvu h THR 118 N -0.69 1.24 -0.12 1.81 1.35 -1.14 -1.98 112.91 113.39 3mvu h THR 118 Ca -0.02 -1.03 -0.13 0.00 -0.55 0.00 0.00 66.41 64.68 3mvu h THR 118 Cb 0.49 0.92 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 3mvu h THR 118 CO 0.04 0.36 -0.48 0.03 -0.25 0.00 0.00 175.52 175.21 3mvu h ARG 119 N 0.71 0.30 -0.29 4.72 2.47 -1.14 -1.32 114.38 119.83 3mvu h ARG 119 Ca 0.14 -0.16 0.01 0.00 -1.26 0.00 0.00 59.98 58.70 3mvu h ARG 119 Cb 0.47 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.78 3mvu h ARG 119 CO 0.02 0.72 0.17 0.35 0.56 0.00 0.00 179.97 181.79 3mvu h PHE 120 N 0.24 0.32 -0.18 3.04 3.57 -0.91 -0.71 116.94 122.30 3mvu h PHE 120 Ca 0.01 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 3mvu h PHE 120 Cb 0.94 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.57 3mvu h PHE 120 CO 0.02 0.19 -0.10 0.28 -2.23 0.00 0.00 178.31 176.47 3mvu h VAL 121 N 0.35 1.31 -0.35 1.41 2.07 -1.12 -1.56 116.25 118.37 3mvu h VAL 121 Ca 0.11 -1.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 3mvu h VAL 121 Cb -0.00 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 3mvu h VAL 121 CO -0.05 0.35 0.21 -0.07 0.02 0.00 0.00 177.57 178.02 3mvu h LEU 122 N 0.07 0.42 -0.77 2.57 3.38 -1.20 -1.96 115.31 117.82 3mvu h LEU 122 Ca 0.04 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 3mvu h LEU 122 Cb 0.59 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 3mvu h LEU 122 CO 0.03 0.36 -0.09 -0.08 0.09 0.00 0.00 178.44 178.74 3mvu h GLU 123 N 0.45 0.83 -0.76 1.13 4.22 -1.09 0.11 114.58 119.47 3mvu h GLU 123 Ca 0.12 -0.28 0.06 0.00 0.08 0.00 0.00 59.36 59.35 3mvu h GLU 123 Cb 0.02 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.14 3mvu h GLU 123 CO -0.02 0.90 0.45 0.00 -2.18 0.00 0.00 179.01 178.15 3mvu h ALA 124 N 1.14 1.03 -0.29 2.92 0.00 -0.98 -0.33 119.26 122.74 3mvu h ALA 124 Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3mvu h ALA 124 Cb 0.59 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3mvu h ALA 124 CO 0.04 0.16 -0.08 0.78 0.00 0.00 0.00 179.25 180.15 3mvu h GLY 125 N 0.82 0.62 0.93 0.00 0.00 -0.85 0.14 103.07 104.73 3mvu h GLY 125 Ca 0.33 -0.52 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 3mvu h GLY 125 CO -0.18 0.47 -0.07 -0.97 0.00 0.00 0.00 176.54 175.80 3mvu h TYR 126 N 0.33 0.74 0.10 5.60 0.05 -0.66 -3.29 116.97 119.86 3mvu h TYR 126 Ca 0.07 -0.16 -0.26 0.00 0.05 0.00 0.00 58.73 58.43 3mvu h TYR 126 Cb 0.57 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.13 3mvu h TYR 126 CO 0.05 0.82 -1.18 0.77 -1.05 0.00 0.00 178.16 177.57 3mvu h SER 127 N 0.46 0.43 -0.27 3.88 0.02 -1.11 -3.46 113.55 113.49 3mvu h SER 127 Ca 0.09 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 3mvu h SER 127 Cb 0.57 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.97 3mvu h SER 127 CO 0.03 1.32 0.00 0.61 -1.14 0.00 0.00 176.83 177.65 3mvu n GLY 128 N 1.41 2.08 0.05 -3.77 0.00 0.47 -5.08 105.19 100.36 3mvu n GLY 128 Ca -0.08 -1.92 -0.00 0.00 0.00 0.00 0.00 46.02 44.02 3mvu n GLY 128 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3mvu n ASP 129 N 0.00 1.22 -0.20 1.61 5.68 -1.26 -4.85 116.55 118.75 3mvu n ASP 129 Ca 0.00 -1.03 0.11 0.00 -0.50 0.00 0.00 54.79 53.37 3mvu n ASP 129 Cb 0.00 0.00 0.40 0.00 -1.14 0.00 0.00 41.12 40.39 3mvu n ASP 129 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3mvu h LEU 130 N 0.00 0.58 -0.47 -2.12 5.85 -1.89 -2.50 115.31 114.76 3mvu h LEU 130 Ca -0.01 0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.59 3mvu h LEU 130 Cb 0.02 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 3mvu h LEU 130 CO 0.01 0.33 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.10 3mvu h LEU 131 N 0.64 1.01 -0.41 2.25 3.38 -1.95 -0.10 115.31 120.12 3mvu h LEU 131 Ca 0.37 -0.41 0.02 0.00 0.09 0.00 0.00 57.88 57.95 3mvu h LEU 131 Cb 0.57 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3mvu h LEU 131 CO -0.14 1.21 0.23 0.44 0.09 0.00 0.00 178.44 180.27 3mvu h ASP 132 N 0.82 0.37 -0.42 -0.43 3.32 -1.79 -0.23 116.42 118.06 3mvu h ASP 132 Ca 0.09 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 3mvu h ASP 132 Cb 0.86 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 3mvu h ASP 132 CO 0.08 0.27 0.15 0.25 -1.72 0.00 0.00 179.24 178.26 3mvu h LEU 133 N 0.47 0.60 -0.79 1.55 5.85 -1.16 -2.34 115.31 119.50 3mvu h LEU 133 Ca 0.17 -0.19 -0.12 0.00 0.84 0.00 0.00 57.88 58.58 3mvu h LEU 133 Cb 0.03 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 3mvu h LEU 133 CO -0.09 0.63 -0.33 -0.07 -0.34 0.00 0.00 178.44 178.24 3mvu h LEU 134 N 0.54 0.55 -1.07 2.25 3.38 -0.82 -0.85 115.31 119.28 3mvu h LEU 134 Ca 0.14 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.90 3mvu h LEU 134 Cb 0.23 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 3mvu h LEU 134 CO -0.01 0.85 0.63 0.00 0.09 0.00 0.00 178.44 180.00 3mvu h ALA 135 N 1.19 1.34 -0.05 1.53 0.00 -0.92 -0.04 119.26 122.30 3mvu h ALA 135 Ca 0.05 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 3mvu h ALA 135 Cb 0.80 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3mvu h ALA 135 CO 0.06 0.61 -0.73 0.00 0.00 0.00 0.00 179.25 179.19 3mvu h ALA 136 N 1.42 0.66 0.00 0.00 0.00 -0.86 -3.29 119.26 117.20 3mvu h ALA 136 Ca 0.35 -0.62 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 3mvu h ALA 136 Cb -0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3mvu h ALA 136 CO -0.08 0.79 -0.60 -0.07 0.00 0.00 0.00 179.25 179.29 3mvu h LEU 137 N 0.19 0.00 -0.88 0.00 3.38 -0.85 -3.39 115.31 113.75 3mvu h LEU 137 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 3mvu h LEU 137 Cb 1.29 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.00 3mvu h LEU 137 CO 0.12 0.48 0.49 0.00 0.09 0.00 0.00 178.44 179.61 3mvu h ALA 138 N 1.52 1.13 -0.93 1.53 0.00 -1.07 -2.66 119.26 118.79 3mvu h ALA 138 Ca -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3mvu h ALA 138 Cb 1.38 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 3mvu h ALA 138 CO 0.06 0.64 0.54 -1.35 0.00 0.00 0.00 179.25 179.14 3mvu h PRO 139 N 1.24 1.27 0.59 0.00 0.11 -1.76 -2.78 132.00 130.66 3mvu h PRO 139 Ca 0.31 -0.13 -0.03 0.00 0.11 0.00 0.00 66.00 66.27 3mvu h PRO 139 Cb 0.02 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 30.88 3mvu h PRO 139 CO -0.05 0.90 -0.29 0.00 -0.21 0.00 0.00 178.00 178.35 3mvu n VAL 141 N -5.44 0.00 0.00 0.00 0.31 -1.02 -2.09 118.33 110.09 3mvu n VAL 141 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 3mvu n VAL 141 Cb 0.33 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.44 3mvu n VAL 141 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3mvu n GLY 143 N -0.82 0.00 0.24 2.92 0.00 0.17 -2.23 105.19 105.47 3mvu n GLY 143 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 3mvu n GLY 143 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3mvu h TYR 144 N 0.00 0.26 -0.13 1.61 -1.99 -1.58 -0.04 116.97 115.10 3mvu h TYR 144 Ca 0.00 -0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 3mvu h TYR 144 Cb 0.00 -0.08 -0.01 0.00 2.00 0.00 0.00 36.73 38.65 3mvu h TYR 144 CO 0.00 0.36 0.03 0.78 -0.00 0.00 0.00 178.16 179.33 3mvu h GLY 145 N 0.72 0.23 0.94 3.88 0.00 -1.70 0.92 103.07 108.06 3mvu h GLY 145 Ca 0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 3mvu h GLY 145 CO 0.02 0.14 0.13 -2.09 0.00 0.00 0.00 176.54 174.73 3mvu h GLU 146 N 0.01 0.63 -0.12 4.80 4.81 -1.79 -1.04 114.58 121.88 3mvu h GLU 146 Ca 0.04 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 3mvu h GLU 146 Cb 0.27 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3mvu h GLU 146 CO 0.00 0.63 0.05 0.82 -0.73 0.00 0.00 179.01 179.78 3mvu h ILE 147 N 0.51 1.14 -0.85 2.32 2.04 -1.01 -0.89 117.51 120.79 3mvu h ILE 147 Ca 0.13 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.57 3mvu h ILE 147 Cb 0.26 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 3mvu h ILE 147 CO -0.00 0.13 0.56 1.23 0.00 0.00 0.00 178.15 180.06 3mvu h GLY 148 N 0.04 1.20 0.91 5.37 0.00 -0.71 -0.37 103.07 109.51 3mvu h GLY 148 Ca 0.04 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.88 3mvu h GLY 148 CO -0.00 0.45 0.08 1.70 0.00 0.00 0.00 176.54 178.76 3mvu h LYS 149 N 1.15 0.52 -0.26 4.80 3.11 -1.05 -1.00 116.57 123.85 3mvu h LYS 149 Ca 0.31 -0.13 -0.00 0.00 -2.81 0.00 0.00 60.65 58.02 3mvu h LYS 149 Cb -0.12 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.03 3mvu h LYS 149 CO -0.07 0.58 0.16 -0.09 -2.81 0.00 0.00 179.45 177.23 3mvu h ARG 150 N 0.37 0.35 0.00 1.90 2.43 -0.76 -2.95 114.38 115.72 3mvu h ARG 150 Ca 0.10 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 3mvu h ARG 150 Cb 0.29 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 3mvu h ARG 150 CO 0.00 0.26 -0.27 -0.07 -1.51 0.00 0.00 179.97 178.39 3mvu h LEU 151 N 0.33 0.00 -0.90 3.80 4.07 -0.96 0.24 115.31 121.89 3mvu h LEU 151 Ca 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.03 3mvu h LEU 151 Cb 0.00 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.70 3mvu h LEU 151 CO -0.02 0.27 0.45 0.74 -1.08 0.00 0.00 178.44 178.80 3mvu h THR 152 N 0.00 1.26 0.07 0.22 2.02 -1.02 0.10 112.91 115.56 3mvu h THR 152 Ca -0.00 -0.68 -0.26 0.00 0.77 0.00 0.00 66.41 66.24 3mvu h THR 152 Cb 0.68 0.11 0.01 0.00 -1.74 0.00 0.00 68.15 67.21 3mvu h THR 152 CO 0.03 0.30 -1.10 0.00 0.37 0.00 0.00 175.52 175.12 3mvu h ALA 153 N 1.26 0.20 -0.00 6.16 0.00 -1.08 -3.41 119.26 122.40 3mvu h ALA 153 Ca 0.30 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3mvu h ALA 153 Cb 0.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3mvu h ALA 153 CO -0.04 0.84 -0.35 0.39 0.00 0.00 0.00 179.25 180.08 3mvu n GLU 154 N -3.68 3.55 -1.78 0.00 1.02 0.73 -5.03 120.64 115.45 3mvu n GLU 154 Ca -0.09 -0.16 -0.41 0.00 -0.02 0.00 0.00 57.16 56.48 3mvu n GLU 154 Cb 0.93 -0.96 -0.01 0.00 -0.02 0.00 0.00 31.44 31.39 3mvu n GLU 154 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3mvu s ALA 155 N -1.68 3.64 -1.73 0.62 0.00 0.34 -4.90 121.76 118.04 3mvu s ALA 155 Ca 0.05 1.59 0.16 0.00 0.00 0.00 0.00 51.96 53.75 3mvu s ALA 155 Cb 0.07 -3.63 0.25 0.00 0.00 0.00 0.00 23.12 19.81 3mvu s ALA 155 CO 0.33 -1.05 1.14 0.25 0.00 0.00 0.00 175.76 176.43 3mvu n THR 156 N 1.04 0.39 -3.93 0.00 -2.24 -0.32 -4.97 114.28 104.25 3mvu n THR 156 Ca 0.03 -0.69 -0.10 0.00 -2.27 0.00 0.00 64.05 61.02 3mvu n THR 156 Cb 0.38 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.52 3mvu n THR 156 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3mvu s SER 157 N -1.20 0.15 0.00 3.42 0.15 -1.21 -4.94 113.70 110.08 3mvu s SER 157 Ca 0.24 -0.39 0.22 0.00 0.70 0.00 0.00 55.95 56.71 3mvu s SER 157 Cb 0.15 0.16 0.62 0.00 -1.71 0.00 0.00 66.02 65.23 3mvu s SER 157 CO 0.21 -0.36 1.49 0.35 1.20 0.00 0.00 173.24 176.13 3mvu n THR 158 N 1.42 0.30 -0.18 6.45 -2.24 -1.26 -4.50 114.28 114.26 3mvu n THR 158 Ca -0.23 -0.48 -0.00 0.00 -2.27 0.00 0.00 64.05 61.07 3mvu n THR 158 Cb 0.56 0.61 0.08 0.00 -2.10 0.00 0.00 70.33 69.48 3mvu n THR 158 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3mvu h LEU 159 N 3.04 -0.21 -3.87 3.22 5.85 -1.93 0.32 115.31 121.73 3mvu h LEU 159 Ca 0.00 0.13 -0.46 0.00 0.84 0.00 0.00 57.88 58.39 3mvu h LEU 159 Cb 0.67 0.23 -0.27 0.00 0.37 0.00 0.00 40.66 41.66 3mvu h LEU 159 CO 0.00 -0.08 0.51 -1.22 -0.34 0.00 0.00 178.44 177.31 3mvu n TYR 160 N -5.24 2.70 -0.05 1.25 4.01 -1.26 -4.69 117.16 113.88 3mvu n TYR 160 Ca 0.08 -1.87 0.03 0.00 -0.16 0.00 0.00 57.90 55.97 3mvu n TYR 160 Cb 0.32 -0.88 0.37 0.00 -0.31 0.00 0.00 39.34 38.83 3mvu n TYR 160 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3mvu h GLY 161 N 1.06 0.68 0.88 2.72 0.00 -1.17 -1.42 103.07 105.82 3mvu h GLY 161 Ca 0.56 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.59 3mvu h GLY 161 CO 0.99 0.26 0.06 -0.55 0.00 0.00 0.00 176.54 177.31 3mvu h ASP 162 N 0.65 0.42 -0.10 0.19 3.32 -1.84 0.23 116.42 119.29 3mvu h ASP 162 Ca 0.17 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.99 3mvu h ASP 162 Cb -0.03 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3mvu h ASP 162 CO -0.03 0.54 0.06 -0.25 -1.72 0.00 0.00 179.24 177.84 3mvu h TRP 163 N 0.27 0.12 -0.64 4.55 7.01 -1.82 -1.01 115.95 124.43 3mvu h TRP 163 Ca 0.09 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.07 3mvu h TRP 163 Cb 0.29 -0.04 -0.03 0.00 -2.10 0.00 0.00 29.16 27.28 3mvu h TRP 163 CO 0.01 0.08 0.32 0.82 -2.79 0.00 0.00 178.44 176.88 3mvu h ILE 164 N 0.13 1.22 0.00 2.65 2.04 -1.11 -2.47 117.51 119.98 3mvu h ILE 164 Ca 0.04 -0.60 -0.07 0.00 1.00 0.00 0.00 64.86 65.23 3mvu h ILE 164 Cb -0.01 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 3mvu h ILE 164 CO -0.01 0.25 -0.32 0.44 0.00 0.00 0.00 178.15 178.50 3mvu h ASP 165 N 0.88 0.00 0.65 1.72 3.32 -0.43 0.13 116.42 122.68 3mvu h ASP 165 Ca 0.22 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 3mvu h ASP 165 Cb 0.10 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.66 3mvu h ASP 165 CO -0.03 0.32 -0.31 0.74 -1.72 0.00 0.00 179.24 178.24 3mvu h THR 166 N 0.00 0.34 0.00 0.35 2.02 -0.73 -1.88 112.91 113.01 3mvu h THR 166 Ca -0.00 -0.08 -0.09 0.00 0.77 0.00 0.00 66.41 67.00 3mvu h THR 166 Cb 0.93 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 3mvu h THR 166 CO 0.04 0.01 -0.74 1.88 0.37 0.00 0.00 175.52 177.08 3mvu h TYR 167 N -0.92 0.00 0.00 3.16 0.05 -1.30 -3.14 116.97 114.82 3mvu h TYR 167 Ca -0.09 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.69 3mvu h TYR 167 Cb 0.68 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.42 3mvu h TYR 167 CO -0.02 0.38 -0.33 0.41 -1.05 0.00 0.00 178.16 177.55 3mvu n GLY 168 N 1.25 -1.37 3.84 3.88 0.00 0.43 -4.38 105.19 108.85 3mvu n GLY 168 Ca -0.01 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.46 3mvu n GLY 168 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mvu s GLY 169 N -3.09 1.65 0.28 -0.02 0.00 -0.71 -4.76 107.32 100.68 3mvu s GLY 169 Ca 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 44.72 44.69 3mvu s GLY 169 CO 0.64 0.22 1.92 -0.55 0.00 0.00 0.00 173.10 175.33 3mvu h ASP 170 N -0.67 0.96 -0.14 1.64 3.32 -1.89 -1.61 116.42 118.03 3mvu h ASP 170 Ca -0.45 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 56.54 3mvu h ASP 170 Cb 1.23 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 3mvu h ASP 170 CO 0.60 0.75 0.08 0.44 -1.72 0.00 0.00 179.24 179.39 3mvu h ASP 171 N 1.10 0.16 -0.49 6.45 3.32 -1.92 0.28 116.42 125.32 3mvu h ASP 171 Ca 0.29 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.21 3mvu h ASP 171 Cb -0.03 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3mvu h ASP 171 CO -0.05 0.15 -0.05 0.22 -1.72 0.00 0.00 179.24 177.79 3mvu h TYR 172 N 0.16 0.99 -0.70 4.55 3.20 -1.70 -1.40 116.97 122.07 3mvu h TYR 172 Ca 0.05 -0.19 -0.00 0.00 3.14 0.00 0.00 58.73 61.73 3mvu h TYR 172 Cb 0.01 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.00 3mvu h TYR 172 CO -0.06 0.94 0.43 1.96 -1.64 0.00 0.00 178.16 179.79 3mvu h GLN 173 N 0.75 0.95 -0.84 1.82 1.08 -1.19 -0.24 115.11 117.45 3mvu h GLN 173 Ca 0.13 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 3mvu h GLN 173 Cb 0.58 -0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 27.77 3mvu h GLN 173 CO 0.03 0.67 0.53 0.00 -0.95 0.00 0.00 178.83 179.11 3mvu h ALA 174 N 1.22 1.36 -0.37 3.87 0.00 -0.78 -1.13 119.26 123.44 3mvu h ALA 174 Ca 0.25 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 3mvu h ALA 174 Cb -0.04 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 3mvu h ALA 174 CO -0.05 0.57 -0.26 0.00 0.00 0.00 0.00 179.25 179.52 3mvu h ALA 175 N 1.44 0.85 -0.50 0.00 0.00 -0.31 -0.84 119.26 119.90 3mvu h ALA 175 Ca 0.30 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3mvu h ALA 175 Cb -0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3mvu h ALA 175 CO -0.06 0.63 0.31 0.00 0.00 0.00 0.00 179.25 180.13 3mvu h LYS 177 N 0.67 1.01 -0.63 0.00 1.57 -0.89 -1.27 116.57 117.02 3mvu h LYS 177 Ca 0.18 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 3mvu h LYS 177 Cb -0.03 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.09 3mvu h LYS 177 CO -0.04 0.83 0.19 0.00 -0.57 0.00 0.00 179.45 179.86 3mvu h ALA 178 N 1.30 0.83 -0.54 3.86 0.00 -0.76 -1.28 119.26 122.67 3mvu h ALA 178 Ca 0.23 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3mvu h ALA 178 Cb 0.21 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3mvu h ALA 178 CO -0.02 0.51 0.11 0.28 0.00 0.00 0.00 179.25 180.14 3mvu h VAL 179 N 0.91 1.23 -0.76 0.00 2.07 -0.94 -1.45 116.25 117.31 3mvu h VAL 179 Ca 0.20 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 3mvu h VAL 179 Cb 0.31 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3mvu h VAL 179 CO -0.00 0.31 0.33 1.23 0.02 0.00 0.00 177.57 179.46 3mvu h GLY 180 N 0.97 1.18 0.93 2.17 0.00 -0.82 0.18 103.07 107.68 3mvu h GLY 180 Ca 0.17 -0.61 -0.09 0.00 0.00 0.00 0.00 47.33 46.81 3mvu h GLY 180 CO 0.00 0.57 -0.14 -0.84 0.00 0.00 0.00 176.54 176.14 3mvu h THR 181 N 1.09 1.29 -0.47 4.70 2.02 -1.00 -1.14 112.91 119.38 3mvu h THR 181 Ca 0.26 -1.23 0.04 0.00 0.77 0.00 0.00 66.41 66.25 3mvu h THR 181 Cb 0.16 1.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.95 3mvu h THR 181 CO -0.03 0.40 0.25 0.25 0.37 0.00 0.00 175.52 176.75 3mvu h LEU 182 N 0.41 0.36 -0.28 2.58 5.85 -0.98 0.44 115.31 123.69 3mvu h LEU 182 Ca 0.07 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 3mvu h LEU 182 Cb 0.66 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 3mvu h LEU 182 CO 0.04 0.26 0.08 0.25 -0.34 0.00 0.00 178.44 178.73 3mvu h LEU 183 N 0.49 0.42 -0.45 2.25 5.85 -0.80 0.12 115.31 123.19 3mvu h LEU 183 Ca 0.20 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3mvu h LEU 183 Cb 0.10 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 3mvu h LEU 183 CO -0.13 0.52 0.23 0.44 -0.34 0.00 0.00 178.44 179.16 3mvu h ASP 184 N 0.29 0.57 -0.40 1.25 3.32 -1.02 -0.90 116.42 119.53 3mvu h ASP 184 Ca 0.09 -0.11 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 3mvu h ASP 184 Cb 0.26 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3mvu h ASP 184 CO -0.00 0.52 0.02 0.44 -1.72 0.00 0.00 179.24 178.49 3mvu h ASP 185 N 0.58 0.69 -0.58 6.45 3.32 -0.76 -1.76 116.42 124.36 3mvu h ASP 185 Ca 0.15 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.91 3mvu h ASP 185 Cb 0.09 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 3mvu h ASP 185 CO -0.02 0.81 0.37 0.00 -1.72 0.00 0.00 179.24 178.68 3mvu h ALA 186 N 0.90 0.74 -0.16 3.45 0.00 -0.62 -0.51 119.26 123.05 3mvu h ALA 186 Ca 0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3mvu h ALA 186 Cb 0.45 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3mvu h ALA 186 CO 0.02 0.20 0.09 -0.07 0.00 0.00 0.00 179.25 179.49 3mvu h LEU 187 N 0.79 0.20 -0.60 0.00 3.38 -1.10 -2.47 115.31 115.49 3mvu h LEU 187 Ca 0.21 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 3mvu h LEU 187 Cb -0.05 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3mvu h LEU 187 CO -0.04 0.22 0.03 -0.08 0.09 0.00 0.00 178.44 178.66 3mvu h GLU 188 N 0.16 1.05 -0.38 1.13 4.81 -1.15 0.28 114.58 120.47 3mvu h GLU 188 Ca 0.06 -0.32 0.04 0.00 -0.13 0.00 0.00 59.36 59.01 3mvu h GLU 188 Cb 0.06 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 3mvu h GLU 188 CO -0.01 1.01 0.16 -0.09 -0.73 0.00 0.00 179.01 179.35 3mvu h ARG 189 N 0.95 0.33 0.15 1.92 2.43 -1.06 -0.85 114.38 118.24 3mvu h ARG 189 Ca 0.18 -0.02 -0.31 0.00 -0.81 0.00 0.00 59.98 59.01 3mvu h ARG 189 Cb 0.52 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 3mvu h ARG 189 CO 0.02 0.22 -1.57 0.00 -1.51 0.00 0.00 179.97 177.14 3mvu h ARG 190 N 0.34 0.32 0.00 0.20 3.08 -1.26 -3.40 114.38 113.66 3mvu h ARG 190 Ca 0.17 -0.55 0.00 0.00 0.07 0.00 0.00 59.98 59.67 3mvu h ARG 190 Cb 0.12 0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3mvu h ARG 190 CO -0.15 1.26 -0.52 1.28 -1.07 0.00 0.00 179.97 180.77 3mvu n LEU 191 N -3.77 0.51 0.00 3.04 4.77 0.97 -5.10 117.00 117.41 3mvu n LEU 191 Ca -0.25 -0.50 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 3mvu n LEU 191 Cb 0.98 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.07 3mvu n LEU 191 CO 0.46 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 3mvu n GLY 192 N 1.26 0.64 0.37 -0.72 0.00 -0.32 -4.45 105.19 101.97 3mvu n GLY 192 Ca 0.02 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.14 3mvu n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mvu h ALA 193 N 0.00 1.30 -0.59 4.61 0.00 -1.89 -2.61 119.26 120.08 3mvu h ALA 193 Ca 0.00 -0.04 -0.64 0.00 0.00 0.00 0.00 54.91 54.22 3mvu h ALA 193 Cb 0.00 -0.35 -0.14 0.00 0.00 0.00 0.00 17.79 17.30 3mvu h ALA 193 CO 0.00 0.53 1.64 -0.85 0.00 0.00 0.00 179.25 180.57 3mvu n GLU 194 N -4.46 3.76 0.30 0.00 -0.00 -1.26 -4.76 120.64 114.22 3mvu n GLU 194 Ca 0.13 -3.02 0.18 0.00 -0.00 0.00 0.00 57.16 54.45 3mvu n GLU 194 Cb 0.10 -2.44 0.90 0.00 -0.00 0.00 0.00 31.44 29.99 3mvu n GLU 194 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 3mvu h PHE 195 N 3.99 0.00 0.00 -1.84 -5.15 -1.68 -1.49 116.94 110.78 3mvu h PHE 195 Ca 0.58 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.35 3mvu h PHE 195 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.64 3mvu h PHE 195 CO 1.56 0.04 0.00 0.25 -2.00 0.00 0.00 178.31 178.16 3mvu n THR 196 N -3.31 0.84 1.12 0.88 -2.24 -1.26 -2.28 114.28 108.03 3mvu n THR 196 Ca -0.02 0.21 0.12 0.00 -2.27 0.00 0.00 64.05 62.10 3mvu n THR 196 Cb 0.19 -0.93 0.30 0.00 -2.10 0.00 0.00 70.33 67.80 3mvu n THR 196 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3mvu n SER 197 N -1.53 0.77 -4.76 3.42 7.64 -0.56 -4.86 113.62 113.75 3mvu n SER 197 Ca 0.04 -0.58 -0.40 0.00 1.01 0.00 0.00 58.87 58.94 3mvu n SER 197 Cb 0.20 0.21 -0.04 0.00 -1.01 0.00 0.00 64.21 63.57 3mvu n SER 197 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3mvu s SER 198 N -2.75 7.17 0.61 6.43 0.15 -0.97 -4.93 113.70 119.40 3mvu s SER 198 Ca 0.17 2.27 0.31 0.00 0.70 0.00 0.00 55.95 59.41 3mvu s SER 198 Cb 0.18 -2.62 1.76 0.00 -1.71 0.00 0.00 66.02 63.63 3mvu s SER 198 CO 0.61 -0.21 2.13 -0.65 1.20 0.00 0.00 173.24 176.32 3mvu h PRO 199 N 3.63 0.00 0.00 5.44 0.11 -1.90 -1.44 132.00 137.85 3mvu h PRO 199 Ca -0.47 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 3mvu h PRO 199 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3mvu h PRO 199 CO 0.66 0.00 -0.17 0.00 -0.21 0.00 0.00 178.00 178.28 3mvu h ARG 200 N 0.00 0.00 -0.77 1.05 3.08 -1.91 -3.16 114.38 112.67 3mvu h ARG 200 Ca 0.06 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.19 3mvu h ARG 200 Cb 0.42 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.40 3mvu h ARG 200 CO -0.00 0.17 0.44 2.35 -1.07 0.00 0.00 179.97 181.86 3mvu h TRP 201 N 0.00 0.80 -0.81 3.04 2.91 -1.50 -0.32 115.95 120.07 3mvu h TRP 201 Ca -0.00 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.01 3mvu h TRP 201 Cb 0.53 -0.24 -0.04 0.00 -0.51 0.00 0.00 29.16 28.90 3mvu h TRP 201 CO 0.00 0.36 0.38 0.77 -1.03 0.00 0.00 178.44 178.91 3mvu h SER 202 N 0.77 1.08 -0.25 2.65 0.02 -1.73 -0.55 113.55 115.54 3mvu h SER 202 Ca 0.36 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 3mvu h SER 202 Cb 0.27 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 3mvu h SER 202 CO -0.21 0.92 0.11 -0.09 -1.14 0.00 0.00 176.83 176.41 3mvu h ARG 203 N 1.16 0.37 -0.60 3.45 9.65 -1.38 -1.47 114.38 125.56 3mvu h ARG 203 Ca 0.28 -0.06 -0.02 0.00 -1.10 0.00 0.00 59.98 59.07 3mvu h ARG 203 Cb 0.14 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.63 3mvu h ARG 203 CO -0.03 0.39 0.28 -0.07 2.80 0.00 0.00 179.97 183.34 3mvu h LEU 204 N 0.26 0.80 -1.24 3.80 3.38 -0.71 -0.64 115.31 120.97 3mvu h LEU 204 Ca 0.08 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3mvu h LEU 204 Cb 0.15 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 3mvu h LEU 204 CO -0.01 0.71 0.25 0.00 0.09 0.00 0.00 178.44 179.49 3mvu h GLN 206 N 0.78 0.74 -0.48 0.00 4.15 -0.71 0.14 115.11 119.73 3mvu h GLN 206 Ca 0.19 -0.26 0.04 0.00 0.77 0.00 0.00 58.65 59.39 3mvu h GLN 206 Cb 0.10 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.70 3mvu h GLN 206 CO -0.02 0.86 0.24 1.15 -1.93 0.00 0.00 178.83 179.13 3mvu h THR 207 N 0.56 0.97 -0.71 2.39 2.02 -0.73 0.98 112.91 118.39 3mvu h THR 207 Ca 0.11 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 3mvu h THR 207 Cb 0.55 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 3mvu h THR 207 CO 0.03 0.09 0.39 0.15 0.37 0.00 0.00 175.52 176.55 3mvu h PHE 208 N 0.48 0.97 -0.38 3.16 3.04 -1.03 -1.49 116.94 121.70 3mvu h PHE 208 Ca 0.21 -0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.11 3mvu h PHE 208 Cb 0.11 -0.31 -0.02 0.00 2.56 0.00 0.00 35.95 38.29 3mvu h PHE 208 CO -0.10 0.69 0.14 1.25 -2.02 0.00 0.00 178.31 178.27 3mvu h HIS 209 N 0.98 0.60 -0.46 0.41 2.76 -0.15 -0.17 115.15 119.12 3mvu h HIS 209 Ca 0.25 -0.05 0.02 0.00 -2.20 0.00 0.00 60.37 58.39 3mvu h HIS 209 Cb 0.04 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 28.79 3mvu h HIS 209 CO -0.00 0.55 0.28 1.15 -1.30 0.00 0.00 177.93 178.61 3mvu h THR 210 N 0.47 1.05 -0.33 6.26 2.02 -0.59 -0.86 112.91 120.95 3mvu h THR 210 Ca 0.13 -0.19 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 3mvu h THR 210 Cb 0.22 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 3mvu h THR 210 CO -0.01 0.10 0.00 0.00 0.37 0.00 0.00 175.52 175.99 3mvu h ALA 211 N 1.20 1.40 -0.42 6.16 0.00 -1.02 -0.63 119.26 125.96 3mvu h ALA 211 Ca 0.18 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3mvu h ALA 211 Cb 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3mvu h ALA 211 CO -0.08 0.42 0.13 1.15 0.00 0.00 0.00 179.25 180.87 3mvu h THR 212 N 0.48 1.22 -0.93 0.00 2.02 -0.43 -0.42 112.91 114.86 3mvu h THR 212 Ca 0.11 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.56 3mvu h THR 212 Cb 0.31 0.91 -0.05 0.00 -1.74 0.00 0.00 68.15 67.58 3mvu h THR 212 CO 0.01 0.26 0.56 -0.33 0.37 0.00 0.00 175.52 176.39 3mvu h GLU 213 N 0.53 1.26 -0.33 6.66 5.08 -0.47 -1.61 114.58 125.70 3mvu h GLU 213 Ca 0.13 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 3mvu h GLU 213 Cb 0.26 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3mvu h GLU 213 CO -0.00 0.88 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.76 3mvu h LEU 214 N 1.28 0.52 -0.44 1.33 3.38 -0.69 -1.86 115.31 118.83 3mvu h LEU 214 Ca 0.33 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.21 3mvu h LEU 214 Cb -0.06 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3mvu h LEU 214 CO -0.06 0.63 0.24 -0.33 0.09 0.00 0.00 178.44 179.01 3mvu h GLU 215 N 0.51 0.47 -0.60 1.13 4.39 -0.37 -0.41 114.58 119.71 3mvu h GLU 215 Ca 0.10 -0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.86 3mvu h GLU 215 Cb 0.42 -0.11 -0.07 0.00 -0.10 0.00 0.00 28.75 28.89 3mvu h GLU 215 CO 0.02 0.31 0.23 0.28 -1.16 0.00 0.00 179.01 178.70 3mvu h VAL 216 N 0.49 0.79 -0.84 3.13 2.07 -0.90 -1.24 116.25 119.75 3mvu h VAL 216 Ca 0.18 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.58 3mvu h VAL 216 Cb 0.05 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 3mvu h VAL 216 CO -0.10 0.08 0.56 1.23 0.02 0.00 0.00 177.57 179.35 3mvu h GLY 217 N 0.42 1.19 0.98 2.17 0.00 -0.93 -0.50 103.07 106.41 3mvu h GLY 217 Ca 0.30 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 3mvu h GLY 217 CO -0.29 0.39 0.20 -2.75 0.00 0.00 0.00 176.54 174.09 3mvu h PHE 218 N 1.09 0.82 -0.51 5.60 3.04 -0.32 -2.85 116.94 123.80 3mvu h PHE 218 Ca 0.32 -0.07 -0.11 0.00 3.98 0.00 0.00 57.97 62.09 3mvu h PHE 218 Cb -0.04 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.21 3mvu h PHE 218 CO -0.00 0.68 -0.13 -1.49 -2.02 0.00 0.00 178.31 175.36 3mvu h TRP 219 N 0.73 1.12 0.00 0.41 -0.00 -0.77 -0.48 115.95 116.95 3mvu h TRP 219 Ca 0.18 -0.24 0.00 0.00 -0.00 0.00 0.00 58.89 58.83 3mvu h TRP 219 Cb 0.22 -0.27 0.00 0.00 -0.00 0.00 0.00 29.16 29.11 3mvu h TRP 219 CO 0.01 1.05 0.00 0.94 -0.00 0.00 0.00 178.44 180.44 3mvu n GLN 220 N -4.17 0.00 0.00 0.49 -0.06 -0.24 -1.69 117.38 111.72 3mvu n GLN 220 Ca 0.01 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.01 3mvu n GLN 220 Cb 0.41 -1.40 0.00 0.00 -4.06 0.00 0.00 30.24 25.19 3mvu n GLN 220 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3mvu n GLY 222 N 0.90 0.00 0.00 1.69 0.00 -0.19 -2.86 105.19 104.73 3mvu n GLY 222 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3mvu n GLY 222 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mvu n LEU 223 N 0.00 0.00 -2.94 0.99 4.77 -0.68 -4.17 117.00 114.97 3mvu n LEU 223 Ca 0.00 0.31 -0.23 0.00 -0.03 0.00 0.00 56.01 56.06 3mvu n LEU 223 Cb 0.00 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 40.75 3mvu n LEU 223 CO 0.00 -0.06 0.02 0.35 -1.33 0.00 0.00 177.39 176.36 3mvu n THR 224 N -1.31 1.84 0.00 -5.08 -2.24 -1.14 -5.01 114.28 101.34 3mvu n THR 224 Ca 0.11 -5.01 0.00 0.00 -2.27 0.00 0.00 64.05 56.87 3mvu n THR 224 Cb 0.20 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 3mvu n THR 224 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69