#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mcv s ALA 3 N 0.00 3.22 0.92 4.31 0.00 -1.26 -5.05 121.76 123.90 3mcv s ALA 3 Ca 0.00 0.56 -0.12 0.00 0.00 0.00 0.00 51.96 52.40 3mcv s ALA 3 Cb 0.00 -3.20 0.15 0.00 0.00 0.00 0.00 23.12 20.07 3mcv s ALA 3 CO 0.00 0.14 1.12 -1.25 0.00 0.00 0.00 175.76 175.76 3mcv s PRO 4 N -2.00 1.03 0.03 0.00 0.04 -1.26 -4.78 135.00 128.06 3mcv s PRO 4 Ca 0.50 0.42 0.04 0.00 0.04 0.00 0.00 61.00 62.00 3mcv s PRO 4 Cb -0.20 -1.82 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 3mcv s PRO 4 CO 0.25 -2.30 -0.12 0.00 0.04 0.00 0.00 177.00 174.87 3mcv s ALA 5 N -3.15 1.03 0.01 8.56 0.00 -1.26 -1.17 121.76 125.77 3mcv s ALA 5 Ca 0.64 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.92 3mcv s ALA 5 Cb -0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 3mcv s ALA 5 CO 0.55 0.20 -0.10 0.00 0.00 0.00 0.00 175.76 176.41 3mcv s ALA 6 N -0.71 0.84 -0.21 0.00 0.00 0.26 -0.34 121.76 121.59 3mcv s ALA 6 Ca 0.01 -0.53 -0.09 0.00 0.00 0.00 0.00 51.96 51.36 3mcv s ALA 6 Cb -0.07 -0.17 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 3mcv s ALA 6 CO 0.01 0.18 0.11 0.08 0.00 0.00 0.00 175.76 176.14 3mcv s VAL 7 N -0.46 5.10 -0.19 0.00 1.01 0.12 -0.69 120.40 125.29 3mcv s VAL 7 Ca 0.02 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.09 3mcv s VAL 7 Cb -0.05 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 33.00 3mcv s VAL 7 CO 0.00 0.40 -0.17 -0.69 0.00 0.00 0.00 175.10 174.64 3mcv s VAL 8 N 0.72 2.25 0.37 2.92 1.01 -0.76 -0.25 120.40 126.66 3mcv s VAL 8 Ca 0.06 -0.94 -0.21 0.00 0.00 0.00 0.00 61.98 60.90 3mcv s VAL 8 Cb -0.13 -1.99 -0.10 0.00 0.00 0.00 0.00 36.38 34.17 3mcv s VAL 8 CO 0.02 0.48 0.88 0.42 0.00 0.00 0.00 175.10 176.90 3mcv s THR 9 N 1.30 4.43 -1.37 3.92 -4.23 -0.64 -1.84 115.64 117.21 3mcv s THR 9 Ca 0.04 1.43 -0.04 0.00 -1.18 0.00 0.00 61.69 61.94 3mcv s THR 9 Cb -0.14 -3.71 0.02 0.00 1.34 0.00 0.00 72.50 70.01 3mcv s THR 9 CO -0.11 -0.14 0.76 0.61 -0.54 0.00 0.00 174.62 175.20 3mcv n GLY 10 N -0.20 -0.34 1.14 3.99 0.00 -1.05 -2.82 105.19 105.90 3mcv n GLY 10 Ca 0.04 0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.32 3mcv n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mcv n ALA 11 N -4.40 2.42 0.14 4.61 0.00 -0.06 -4.16 120.51 119.05 3mcv n ALA 11 Ca -0.21 -1.04 -0.00 0.00 0.00 0.00 0.00 53.44 52.19 3mcv n ALA 11 Cb 0.64 -0.93 0.26 0.00 0.00 0.00 0.00 19.45 19.41 3mcv n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mcv h ALA 12 N 4.31 1.18 -2.69 0.00 0.00 -1.88 -2.90 119.26 117.28 3mcv h ALA 12 Ca 0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 3mcv h ALA 12 Cb 0.89 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.47 3mcv h ALA 12 CO 0.00 0.58 -0.41 0.15 0.00 0.00 0.00 179.25 179.57 3mcv s LYS 13 N -4.04 1.35 4.75 0.00 1.02 -1.26 -4.45 119.74 117.10 3mcv s LYS 13 Ca -0.03 -1.48 0.00 0.00 0.02 0.00 0.00 55.97 54.48 3mcv s LYS 13 Cb 0.14 0.35 0.00 0.00 -0.52 0.00 0.00 37.83 37.80 3mcv s LYS 13 CO 0.75 -0.50 0.00 0.54 -0.92 0.00 0.00 175.35 175.23 3mcv n ARG 14 N -0.32 0.00 -0.23 1.68 1.74 -1.26 -1.58 116.66 116.69 3mcv n ARG 14 Ca 0.01 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.01 3mcv n ARG 14 Cb 0.64 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 32.12 3mcv n ARG 14 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3mcv h ILE 15 N 0.00 1.26 -0.64 0.55 2.04 -1.91 -2.05 117.51 116.76 3mcv h ILE 15 Ca 0.00 -0.98 0.04 0.00 1.00 0.00 0.00 64.86 64.92 3mcv h ILE 15 Cb 0.00 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 3mcv h ILE 15 CO 0.00 0.37 0.38 1.23 0.00 0.00 0.00 178.15 180.13 3mcv h GLY 16 N 0.98 0.92 0.96 5.37 0.00 -1.66 -0.05 103.07 109.58 3mcv h GLY 16 Ca 0.20 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 3mcv h GLY 16 CO 0.01 0.22 0.16 -0.09 0.00 0.00 0.00 176.54 176.83 3mcv h ARG 17 N 0.74 0.71 -0.97 4.80 2.43 -1.05 -1.25 114.38 119.79 3mcv h ARG 17 Ca 0.27 -0.15 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 3mcv h ARG 17 Cb 0.07 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 3mcv h ARG 17 CO -0.13 0.67 0.64 0.00 -1.51 0.00 0.00 179.97 179.65 3mcv h ALA 18 N 1.01 1.32 -0.12 2.80 0.00 -0.66 0.12 119.26 123.73 3mcv h ALA 18 Ca 0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3mcv h ALA 18 Cb 0.25 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3mcv h ALA 18 CO -0.01 0.62 0.02 0.82 0.00 0.00 0.00 179.25 180.70 3mcv h ILE 19 N 1.30 1.22 -0.56 0.00 2.04 -0.80 -1.43 117.51 119.28 3mcv h ILE 19 Ca 0.36 -0.71 0.06 0.00 1.00 0.00 0.00 64.86 65.58 3mcv h ILE 19 Cb -0.13 1.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 3mcv h ILE 19 CO -0.08 0.21 0.26 0.00 0.00 0.00 0.00 178.15 178.53 3mcv h ALA 20 N 0.79 0.72 -0.27 1.87 0.00 -0.71 -0.48 119.26 121.18 3mcv h ALA 20 Ca 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3mcv h ALA 20 Cb 0.30 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3mcv h ALA 20 CO 0.00 -0.11 0.14 0.28 0.00 0.00 0.00 179.25 179.56 3mcv h VAL 21 N 0.49 1.13 -0.48 0.00 2.07 -0.72 -0.29 116.25 118.46 3mcv h VAL 21 Ca 0.26 -0.36 -0.12 0.00 0.82 0.00 0.00 66.70 67.30 3mcv h VAL 21 Cb 0.22 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3mcv h VAL 21 CO -0.21 0.13 -0.17 0.50 0.02 0.00 0.00 177.57 177.84 3mcv h LYS 22 N 0.31 0.93 -0.67 1.57 3.64 -0.98 0.15 116.57 121.52 3mcv h LYS 22 Ca 0.09 -0.36 -0.01 0.00 -1.27 0.00 0.00 60.65 59.10 3mcv h LYS 22 Cb 0.08 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 3mcv h LYS 22 CO -0.01 1.02 0.38 -0.07 -2.27 0.00 0.00 179.45 178.49 3mcv h LEU 23 N 0.81 0.83 -0.39 5.20 3.38 -0.96 -0.89 115.31 123.30 3mcv h LEU 23 Ca 0.12 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3mcv h LEU 23 Cb 0.72 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3mcv h LEU 23 CO 0.06 0.68 0.10 -0.74 0.09 0.00 0.00 178.44 178.63 3mcv h HIS 24 N 0.92 0.64 0.00 1.13 2.76 -0.60 -1.03 115.15 118.97 3mcv h HIS 24 Ca 0.24 -0.07 -0.00 0.00 -2.20 0.00 0.00 60.37 58.33 3mcv h HIS 24 Cb 0.02 -0.18 -0.00 0.00 1.55 0.00 0.00 27.41 28.80 3mcv h HIS 24 CO -0.01 0.62 -0.01 1.96 -1.30 0.00 0.00 177.93 179.19 3mcv h GLN 25 N 0.48 0.00 0.00 5.26 4.20 -0.45 -0.81 115.11 123.79 3mcv h GLN 25 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3mcv h GLN 25 Cb 0.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.07 3mcv h GLN 25 CO -0.00 0.01 0.00 2.41 -0.67 0.00 0.00 178.83 180.58 3mcv n THR 26 N -4.45 0.19 0.00 -0.54 -1.04 -0.36 -4.91 114.28 103.17 3mcv n THR 26 Ca -0.03 0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 3mcv n THR 26 Cb 0.09 -0.58 0.00 0.00 -1.82 0.00 0.00 70.33 68.02 3mcv n THR 26 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3mcv n GLY 27 N 1.27 0.97 3.78 3.41 0.00 -0.31 -5.08 105.19 109.24 3mcv n GLY 27 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 3mcv n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3mcv s TYR 28 N -2.00 3.41 0.24 1.61 1.51 -0.46 -4.34 117.35 117.32 3mcv s TYR 28 Ca 0.00 1.68 -0.21 0.00 -1.01 0.00 0.00 57.07 57.54 3mcv s TYR 28 Cb 0.00 -3.04 -0.09 0.00 -0.11 0.00 0.00 41.96 38.73 3mcv s TYR 28 CO 0.00 -0.31 0.76 1.03 -1.11 0.00 0.00 175.55 175.92 3mcv s ARG 29 N -2.41 4.30 -0.02 -0.62 0.52 -0.32 -4.17 118.95 116.24 3mcv s ARG 29 Ca 0.56 0.94 0.03 0.00 -0.52 0.00 0.00 55.73 56.74 3mcv s ARG 29 Cb -0.20 -2.86 -0.00 0.00 0.52 0.00 0.00 34.95 32.41 3mcv s ARG 29 CO 0.25 0.37 -0.10 0.14 0.02 0.00 0.00 175.30 175.98 3mcv s VAL 30 N -1.55 0.86 -0.35 3.52 -7.23 -0.08 -0.57 120.40 115.00 3mcv s VAL 30 Ca 0.44 -0.43 -0.18 0.00 -1.81 0.00 0.00 61.98 60.01 3mcv s VAL 30 Cb -0.17 -0.75 -0.00 0.00 0.56 0.00 0.00 36.38 36.02 3mcv s VAL 30 CO 0.21 0.26 0.48 -0.69 -0.31 0.00 0.00 175.10 175.05 3mcv s VAL 31 N 0.01 5.04 -0.78 1.32 1.01 0.14 -1.74 120.40 125.41 3mcv s VAL 31 Ca -0.00 0.24 -0.20 0.00 0.00 0.00 0.00 61.98 62.02 3mcv s VAL 31 Cb -0.07 -3.95 0.11 0.00 0.00 0.00 0.00 36.38 32.47 3mcv s VAL 31 CO 0.00 -0.21 0.99 -0.63 0.00 0.00 0.00 175.10 175.25 3mcv s ILE 32 N 2.32 4.63 0.33 2.22 1.01 0.45 -1.83 121.20 130.34 3mcv s ILE 32 Ca 0.17 -1.08 -0.26 0.00 0.00 0.00 0.00 60.65 59.48 3mcv s ILE 32 Cb -0.16 -4.69 -0.10 0.00 0.01 0.00 0.00 42.46 37.53 3mcv s ILE 32 CO 0.13 -1.41 0.96 -2.28 0.00 0.00 0.00 174.94 172.34 3mcv s HIS 33 N 3.09 3.63 0.19 3.97 5.65 -0.77 -1.38 115.29 129.67 3mcv s HIS 33 Ca 0.25 1.76 -0.12 0.00 0.25 0.00 0.00 55.06 57.20 3mcv s HIS 33 Cb -0.12 -2.96 0.00 0.00 -1.18 0.00 0.00 32.58 28.32 3mcv s HIS 33 CO -0.00 0.07 0.39 1.52 -0.65 0.00 0.00 174.74 176.07 3mcv s TYR 34 N -1.61 0.26 0.00 3.88 -0.85 -0.49 -0.88 117.35 117.66 3mcv s TYR 34 Ca 0.51 -0.62 0.00 0.00 -0.52 0.00 0.00 57.07 56.44 3mcv s TYR 34 Cb -0.19 0.11 0.00 0.00 0.38 0.00 0.00 41.96 42.25 3mcv s TYR 34 CO 0.25 -0.83 0.00 1.58 -1.52 0.00 0.00 175.55 175.03 3mcv n HIS 35 N -0.28 0.00 0.02 -3.49 -0.00 -1.26 -1.05 115.22 109.16 3mcv n HIS 35 Ca -0.07 0.00 0.10 0.00 -0.00 0.00 0.00 57.72 57.75 3mcv n HIS 35 Cb 0.63 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 30.50 3mcv n HIS 35 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 3mcv n ASN 36 N -1.65 0.27 -3.66 0.26 3.02 -1.26 -4.74 115.26 107.51 3mcv n ASN 36 Ca 0.00 0.11 -0.41 0.00 -0.03 0.00 0.00 54.58 54.25 3mcv n ASN 36 Cb 0.00 1.46 -0.00 0.00 -0.61 0.00 0.00 39.78 40.63 3mcv n ASN 36 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3mcv n SER 37 N -2.42 6.74 -0.09 6.41 7.64 -1.26 -4.74 113.62 125.90 3mcv n SER 37 Ca -0.04 -3.13 -0.11 0.00 1.01 0.00 0.00 58.87 56.59 3mcv n SER 37 Cb 0.59 -1.41 -0.04 0.00 -1.01 0.00 0.00 64.21 62.34 3mcv n SER 37 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3mcv h ALA 38 N 5.11 0.34 -0.35 -0.43 0.00 -1.97 -0.97 119.26 121.00 3mcv h ALA 38 Ca 0.56 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 3mcv h ALA 38 Cb 0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3mcv h ALA 38 CO 1.54 0.08 0.22 1.49 0.00 0.00 0.00 179.25 182.58 3mcv h GLU 39 N 0.23 0.47 -0.62 0.00 4.81 -2.00 -0.75 114.58 116.72 3mcv h GLU 39 Ca 0.07 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 3mcv h GLU 39 Cb 0.42 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 3mcv h GLU 39 CO 0.01 0.34 0.01 0.00 -0.73 0.00 0.00 179.01 178.64 3mcv h ALA 40 N 1.10 0.85 -0.02 2.92 0.00 -1.87 -0.71 119.26 121.52 3mcv h ALA 40 Ca 0.13 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 3mcv h ALA 40 Cb -0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3mcv h ALA 40 CO -0.02 0.67 0.01 0.00 0.00 0.00 0.00 179.25 179.91 3mcv h ALA 41 N 1.01 0.03 -0.78 0.00 0.00 -0.80 -1.52 119.26 117.21 3mcv h ALA 41 Ca 0.18 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3mcv h ALA 41 Cb 0.55 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 3mcv h ALA 41 CO 0.03 -0.40 0.33 0.28 0.00 0.00 0.00 179.25 179.48 3mcv h VAL 42 N -0.09 1.25 -0.72 0.00 2.07 -1.06 -1.25 116.25 116.45 3mcv h VAL 42 Ca 0.01 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 3mcv h VAL 42 Cb 0.13 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 3mcv h VAL 42 CO -0.00 0.32 0.40 -1.28 0.02 0.00 0.00 177.57 177.03 3mcv h SER 43 N 1.12 0.90 -0.13 0.57 0.87 -0.95 -0.17 113.55 115.76 3mcv h SER 43 Ca 0.26 -0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 3mcv h SER 43 Cb 0.18 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 3mcv h SER 43 CO -0.03 0.74 0.03 0.25 -0.53 0.00 0.00 176.83 177.29 3mcv h LEU 44 N 1.00 0.20 -0.93 2.23 5.85 -1.02 -1.90 115.31 120.74 3mcv h LEU 44 Ca 0.26 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.77 3mcv h LEU 44 Cb 0.03 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 3mcv h LEU 44 CO -0.04 0.39 0.61 0.00 -0.34 0.00 0.00 178.44 179.05 3mcv h ALA 45 N 0.82 1.23 -0.06 1.25 0.00 -0.90 -0.82 119.26 120.78 3mcv h ALA 45 Ca 0.04 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3mcv h ALA 45 Cb 0.26 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3mcv h ALA 45 CO 0.00 0.49 -0.03 -0.44 0.00 0.00 0.00 179.25 179.27 3mcv h ASP 46 N 1.19 -0.10 -0.40 0.00 3.32 -0.93 0.53 116.42 120.03 3mcv h ASP 46 Ca 0.37 0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.50 3mcv h ASP 46 Cb -0.02 0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.53 3mcv h ASP 46 CO -0.11 -0.04 0.07 -0.33 -1.72 0.00 0.00 179.24 177.10 3mcv h GLU 47 N -0.03 0.19 -0.57 3.56 5.08 -0.79 -0.64 114.58 121.38 3mcv h GLU 47 Ca 0.03 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 3mcv h GLU 47 Cb 0.08 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3mcv h GLU 47 CO -0.08 0.13 -0.07 -0.07 -1.00 0.00 0.00 179.01 177.92 3mcv h LEU 48 N 0.20 1.05 -1.17 1.33 3.38 -0.77 -2.68 115.31 116.64 3mcv h LEU 48 Ca 0.19 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 3mcv h LEU 48 Cb 0.23 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3mcv h LEU 48 CO -0.26 1.13 -0.40 0.78 0.09 0.00 0.00 178.44 179.78 3mcv h ASN 49 N 0.94 0.00 -0.34 -0.43 2.35 -0.72 -1.25 115.58 116.14 3mcv h ASN 49 Ca 0.15 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.85 3mcv h ASN 49 Cb 0.64 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.99 3mcv h ASN 49 CO 0.04 0.40 0.03 0.11 -1.65 0.00 0.00 177.43 176.37 3mcv h LYS 50 N 0.00 0.67 -0.07 0.81 6.56 -0.94 -2.37 116.57 121.23 3mcv h LYS 50 Ca -0.00 -0.15 -0.04 0.00 -1.06 0.00 0.00 60.65 59.39 3mcv h LYS 50 Cb 0.74 -0.09 -0.00 0.00 -0.57 0.00 0.00 32.23 32.31 3mcv h LYS 50 CO 0.05 0.67 -0.11 1.49 -2.06 0.00 0.00 179.45 179.50 3mcv h GLU 51 N 0.64 0.20 -3.00 3.15 4.57 -1.06 -3.43 114.58 115.65 3mcv h GLU 51 Ca 0.14 -0.12 -0.31 0.00 -1.18 0.00 0.00 59.36 57.88 3mcv h GLU 51 Cb 0.36 0.01 -0.36 0.00 -0.16 0.00 0.00 28.75 28.59 3mcv h GLU 51 CO 0.01 0.67 -0.65 1.03 -1.18 0.00 0.00 179.01 178.90 3mcv s ARG 52 N -4.12 0.06 0.38 1.92 0.52 -0.53 -5.13 118.95 112.04 3mcv s ARG 52 Ca -0.15 0.45 -0.27 0.00 -0.52 0.00 0.00 55.73 55.24 3mcv s ARG 52 Cb 0.03 -0.55 -0.11 0.00 0.52 0.00 0.00 34.95 34.84 3mcv s ARG 52 CO 0.72 -0.39 1.38 0.43 0.02 0.00 0.00 175.30 177.47 3mcv n SER 53 N 5.32 3.22 -3.69 0.23 7.64 -0.90 -3.26 113.62 122.18 3mcv n SER 53 Ca -0.05 1.19 -0.26 0.00 1.01 0.00 0.00 58.87 60.77 3mcv n SER 53 Cb 0.50 -1.56 0.06 0.00 -1.01 0.00 0.00 64.21 62.20 3mcv n SER 53 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3mcv n ASN 54 N 0.45 -5.65 -0.12 6.43 3.02 -1.26 -4.90 115.26 113.24 3mcv n ASN 54 Ca 0.04 -0.62 0.01 0.00 -0.03 0.00 0.00 54.58 53.98 3mcv n ASN 54 Cb 0.38 -4.68 0.01 0.00 -0.61 0.00 0.00 39.78 34.89 3mcv n ASN 54 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3mcv n THR 55 N -4.87 0.04 -3.78 3.41 -2.24 -1.20 -5.01 114.28 100.62 3mcv n THR 55 Ca 0.00 -0.52 -0.13 0.00 -2.27 0.00 0.00 64.05 61.13 3mcv n THR 55 Cb 0.56 1.04 -0.14 0.00 -2.10 0.00 0.00 70.33 69.68 3mcv n THR 55 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mcv s ALA 56 N -0.27 -0.21 0.12 6.98 0.00 -1.26 -0.90 121.76 126.22 3mcv s ALA 56 Ca 0.03 0.48 0.04 0.00 0.00 0.00 0.00 51.96 52.52 3mcv s ALA 56 Cb 0.02 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 3mcv s ALA 56 CO 0.04 -0.11 -0.10 0.14 0.00 0.00 0.00 175.76 175.72 3mcv s VAL 57 N 0.73 1.09 0.18 0.00 -7.23 -0.71 -4.89 120.40 109.57 3mcv s VAL 57 Ca -0.06 -1.87 0.04 0.00 -1.81 0.00 0.00 61.98 58.28 3mcv s VAL 57 Cb -0.08 -1.63 -0.03 0.00 0.56 0.00 0.00 36.38 35.20 3mcv s VAL 57 CO -0.03 -0.65 0.29 0.68 -0.31 0.00 0.00 175.10 175.08 3mcv s VAL 58 N -2.88 5.17 -0.16 1.32 -7.23 -1.26 -0.41 120.40 114.94 3mcv s VAL 58 Ca 0.12 -0.86 -0.04 0.00 -1.81 0.00 0.00 61.98 59.39 3mcv s VAL 58 Cb -0.00 -3.71 0.08 0.00 0.56 0.00 0.00 36.38 33.31 3mcv s VAL 58 CO 0.00 -0.18 0.26 0.00 -0.31 0.00 0.00 175.10 174.88 3mcv s GLN 60 N 2.40 4.29 -0.27 0.00 -0.44 -1.26 -1.39 119.66 122.99 3mcv s GLN 60 Ca 0.04 0.70 -0.24 0.00 -2.50 0.00 0.00 55.36 53.36 3mcv s GLN 60 Cb -0.14 -3.34 0.09 0.00 -1.64 0.00 0.00 33.01 27.98 3mcv s GLN 60 CO -0.10 0.38 0.80 0.00 0.50 0.00 0.00 175.29 176.87 3mcv s ALA 61 N -0.21 -1.85 -0.05 1.58 0.00 -0.21 -4.94 121.76 116.08 3mcv s ALA 61 Ca 0.30 2.02 -0.30 0.00 0.00 0.00 0.00 51.96 53.99 3mcv s ALA 61 Cb -0.18 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.63 3mcv s ALA 61 CO 0.16 -0.32 1.08 0.34 0.00 0.00 0.00 175.76 177.03 3mcv s ASP 62 N 0.46 7.19 -0.09 0.00 2.15 -1.26 -4.22 116.67 120.90 3mcv s ASP 62 Ca -0.00 1.71 0.17 0.00 0.43 0.00 0.00 52.55 54.86 3mcv s ASP 62 Cb -0.05 -2.56 0.60 0.00 -0.30 0.00 0.00 42.92 40.61 3mcv s ASP 62 CO -0.03 -0.45 1.52 0.18 -0.17 0.00 0.00 175.17 176.22 3mcv n LEU 63 N 4.68 4.20 -4.76 -1.34 4.77 -1.26 -4.96 117.00 118.33 3mcv n LEU 63 Ca 0.09 -2.39 -0.41 0.00 -0.03 0.00 0.00 56.01 53.27 3mcv n LEU 63 Cb 0.48 -0.49 0.01 0.00 -2.33 0.00 0.00 43.42 41.09 3mcv n LEU 63 CO 0.53 0.80 1.06 0.41 -1.33 0.00 0.00 177.39 178.86 3mcv n THR 64 N 0.83 2.47 -1.96 -5.08 -1.04 -1.26 -3.08 114.28 105.16 3mcv n THR 64 Ca 0.22 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.32 3mcv n THR 64 Cb 0.77 -1.84 -0.01 0.00 -1.82 0.00 0.00 70.33 67.43 3mcv n THR 64 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3mcv s ASN 65 N -0.36 6.57 0.20 8.00 2.47 0.06 -4.73 114.94 127.15 3mcv s ASN 65 Ca 0.58 2.82 -0.22 0.00 0.42 0.00 0.00 52.86 56.47 3mcv s ASN 65 Cb -0.47 -2.65 0.07 0.00 -1.45 0.00 0.00 41.25 36.75 3mcv s ASN 65 CO 0.60 -0.72 0.99 -0.94 -3.72 0.00 0.00 177.10 173.30 3mcv s SER 66 N -0.06 -0.04 0.23 -4.21 1.04 -1.26 -4.87 113.70 104.52 3mcv s SER 66 Ca 0.54 -0.67 0.23 0.00 0.48 0.00 0.00 55.95 56.54 3mcv s SER 66 Cb -0.43 0.54 0.94 0.00 0.10 0.00 0.00 66.02 67.17 3mcv s SER 66 CO 0.53 -1.06 1.70 0.59 0.98 0.00 0.00 173.24 175.98 3mcv n ASN 67 N -1.05 0.62 -0.16 7.02 3.02 -1.26 -2.64 115.26 120.81 3mcv n ASN 67 Ca -0.04 0.64 0.10 0.00 -0.03 0.00 0.00 54.58 55.25 3mcv n ASN 67 Cb 0.60 -0.78 -0.08 0.00 -0.61 0.00 0.00 39.78 38.91 3mcv n ASN 67 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3mcv n VAL 68 N -2.18 0.00 -0.29 2.41 0.31 -1.26 -4.47 118.33 112.86 3mcv n VAL 68 Ca 0.03 -0.09 0.08 0.00 -0.01 0.00 0.00 64.34 64.35 3mcv n VAL 68 Cb 0.25 1.08 0.23 0.00 -0.91 0.00 0.00 33.84 34.49 3mcv n VAL 68 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3mcv h LEU 69 N 0.80 0.45 -0.76 7.52 5.85 -1.79 -0.65 115.31 126.73 3mcv h LEU 69 Ca 0.00 0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.90 3mcv h LEU 69 Cb 0.59 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 3mcv h LEU 69 CO 0.00 0.16 0.44 -0.65 -0.34 0.00 0.00 178.44 178.05 3mcv h PRO 70 N 0.55 0.76 -0.81 5.25 0.11 -1.80 -0.04 132.00 136.02 3mcv h PRO 70 Ca 0.47 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.51 3mcv h PRO 70 Cb 0.72 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 31.62 3mcv h PRO 70 CO -0.40 0.50 0.42 0.00 -0.21 0.00 0.00 178.00 178.31 3mcv h ALA 71 N 1.40 1.04 -0.68 -0.75 0.00 -1.47 -0.05 119.26 118.75 3mcv h ALA 71 Ca 0.35 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 3mcv h ALA 71 Cb 0.24 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3mcv h ALA 71 CO -0.20 0.58 0.31 0.77 0.00 0.00 0.00 179.25 180.71 3mcv h SER 72 N 1.14 0.91 -0.35 0.00 0.02 -0.50 -0.54 113.55 114.23 3mcv h SER 72 Ca 0.28 -0.15 -0.11 0.00 -0.84 0.00 0.00 61.79 60.97 3mcv h SER 72 Cb 0.08 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 3mcv h SER 72 CO -0.04 0.80 -0.21 0.00 -1.14 0.00 0.00 176.83 176.24 3mcv h GLU 74 N 0.55 1.14 -0.15 0.00 4.81 -0.83 -2.49 114.58 117.62 3mcv h GLU 74 Ca 0.07 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 3mcv h GLU 74 Cb 0.77 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 3mcv h GLU 74 CO 0.06 0.76 -0.48 1.49 -0.73 0.00 0.00 179.01 180.11 3mcv h GLU 75 N 1.18 0.39 -0.21 1.92 4.57 -0.76 -0.24 114.58 121.42 3mcv h GLU 75 Ca 0.41 -0.22 0.02 0.00 -1.18 0.00 0.00 59.36 58.40 3mcv h GLU 75 Cb 0.12 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 3mcv h GLU 75 CO -0.16 0.79 0.07 0.82 -1.18 0.00 0.00 179.01 179.35 3mcv h ILE 76 N 0.31 0.94 -0.42 2.32 2.04 -0.83 0.11 117.51 121.98 3mcv h ILE 76 Ca 0.02 -0.06 -0.07 0.00 1.00 0.00 0.00 64.86 65.75 3mcv h ILE 76 Cb 0.96 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 3mcv h ILE 76 CO 0.08 0.03 0.00 0.40 0.00 0.00 0.00 178.15 178.67 3mcv h ILE 77 N 0.17 1.26 -0.97 -0.67 1.08 -1.32 -2.51 117.51 114.56 3mcv h ILE 77 Ca 0.09 -1.02 0.14 0.00 -0.39 0.00 0.00 64.86 63.69 3mcv h ILE 77 Cb 0.07 1.09 -0.08 0.00 -3.07 0.00 0.00 36.82 34.82 3mcv h ILE 77 CO -0.10 0.35 0.61 0.78 -0.69 0.00 0.00 178.15 179.10 3mcv h ASN 78 N 0.58 0.80 -0.27 1.72 2.35 -0.79 -1.71 115.58 118.26 3mcv h ASN 78 Ca 0.12 0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.89 3mcv h ASN 78 Cb 0.48 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 3mcv h ASN 78 CO 0.02 0.39 0.08 0.28 -1.65 0.00 0.00 177.43 176.56 3mcv h SER 79 N 0.84 0.47 -0.16 5.81 0.02 -0.33 0.11 113.55 120.30 3mcv h SER 79 Ca 0.49 -0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 61.34 3mcv h SER 79 Cb 0.65 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 3mcv h SER 79 CO -0.26 0.48 -0.07 0.00 -1.14 0.00 0.00 176.83 175.84 3mcv h PHE 81 N 0.02 0.91 -0.42 0.00 -1.00 -1.13 0.30 116.94 115.62 3mcv h PHE 81 Ca 0.04 -0.06 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 3mcv h PHE 81 Cb 0.53 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 39.79 3mcv h PHE 81 CO 0.06 0.71 0.15 -0.09 -1.61 0.00 0.00 178.31 177.54 3mcv h ARG 82 N 0.88 0.63 -0.06 1.51 2.43 -0.71 0.54 114.38 119.60 3mcv h ARG 82 Ca 0.20 -0.12 -0.17 0.00 -0.81 0.00 0.00 59.98 59.08 3mcv h ARG 82 Cb 0.20 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 29.66 3mcv h ARG 82 CO -0.02 0.60 -0.62 0.00 -1.51 0.00 0.00 179.97 178.42 3mcv h ALA 83 N 1.00 0.15 0.00 2.80 0.00 -1.13 -3.41 119.26 118.67 3mcv h ALA 83 Ca 0.14 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3mcv h ALA 83 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3mcv h ALA 83 CO -0.01 0.43 0.00 1.19 0.00 0.00 0.00 179.25 180.86 3mcv n PHE 84 N -4.16 0.00 -1.00 0.00 0.99 0.08 -5.03 117.46 108.34 3mcv n PHE 84 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.36 3mcv n PHE 84 Cb 0.67 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.15 3mcv n PHE 84 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3mcv n GLY 85 N 0.60 0.63 3.74 1.37 0.00 0.18 -4.95 105.19 106.77 3mcv n GLY 85 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3mcv n GLY 85 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3mcv s ARG 86 N -0.00 1.19 -0.28 1.61 1.70 -1.26 -4.95 118.95 116.96 3mcv s ARG 86 Ca 0.00 -0.65 0.02 0.00 -0.47 0.00 0.00 55.73 54.63 3mcv s ARG 86 Cb 0.00 0.41 0.17 0.00 -0.57 0.00 0.00 34.95 34.96 3mcv s ARG 86 CO 0.00 -0.54 0.45 0.00 -1.08 0.00 0.00 175.30 174.13 3mcv n ASP 88 N 5.37 0.92 -4.00 0.00 9.92 0.53 -4.96 116.55 124.33 3mcv n ASP 88 Ca 0.01 0.13 -0.20 0.00 -0.53 0.00 0.00 54.79 54.20 3mcv n ASP 88 Cb 0.50 0.16 -0.15 0.00 -0.64 0.00 0.00 41.12 41.00 3mcv n ASP 88 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3mcv s VAL 89 N -2.54 0.75 -0.12 2.53 1.01 -0.91 -1.44 120.40 119.68 3mcv s VAL 89 Ca -0.15 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.50 3mcv s VAL 89 Cb 0.07 -0.66 0.01 0.00 0.00 0.00 0.00 36.38 35.80 3mcv s VAL 89 CO 0.78 0.23 -0.20 -0.22 0.00 0.00 0.00 175.10 175.69 3mcv s LEU 90 N 0.09 1.96 -0.24 3.92 2.96 -0.82 -0.71 118.68 125.84 3mcv s LEU 90 Ca -0.01 -0.52 -0.00 0.00 -0.22 0.00 0.00 54.13 53.37 3mcv s LEU 90 Cb -0.07 -1.29 0.03 0.00 0.50 0.00 0.00 46.19 45.36 3mcv s LEU 90 CO 0.00 0.08 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.33 3mcv s VAL 91 N 0.74 2.63 -0.82 1.68 1.01 0.66 -0.97 120.40 125.33 3mcv s VAL 91 Ca -0.10 -1.15 -0.19 0.00 0.00 0.00 0.00 61.98 60.54 3mcv s VAL 91 Cb -0.16 -2.36 0.13 0.00 0.00 0.00 0.00 36.38 33.99 3mcv s VAL 91 CO 0.01 0.19 1.00 0.20 0.00 0.00 0.00 175.10 176.50 3mcv s ASN 92 N 1.27 6.50 -0.13 3.32 0.01 0.06 -1.62 114.94 124.37 3mcv s ASN 92 Ca -0.01 -1.84 0.03 0.00 -0.71 0.00 0.00 52.86 50.33 3mcv s ASN 92 Cb -0.17 -2.37 -0.10 0.00 0.41 0.00 0.00 41.25 39.02 3mcv s ASN 92 CO -0.06 -1.09 -0.08 -3.20 -1.51 0.00 0.00 177.10 171.17 3mcv n ASN 93 N 6.46 2.81 -4.65 -1.22 5.15 -1.26 -0.95 115.26 121.60 3mcv n ASN 93 Ca 0.13 -0.05 -0.44 0.00 -0.60 0.00 0.00 54.58 53.62 3mcv n ASN 93 Cb 0.47 0.06 -0.02 0.00 -0.53 0.00 0.00 39.78 39.76 3mcv n ASN 93 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3mcv n ALA 94 N -2.75 0.67 -3.58 5.20 0.00 -1.13 -4.89 120.51 114.03 3mcv n ALA 94 Ca -0.22 0.39 -0.02 0.00 0.00 0.00 0.00 53.44 53.60 3mcv n ALA 94 Cb 0.78 -2.18 -0.05 0.00 0.00 0.00 0.00 19.45 18.00 3mcv n ALA 94 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3mcv s SER 95 N -0.18 -0.85 0.30 0.00 0.15 -1.26 -4.54 113.70 107.32 3mcv s SER 95 Ca 0.61 1.24 -0.28 0.00 0.70 0.00 0.00 55.95 58.22 3mcv s SER 95 Cb -0.65 1.77 -0.09 0.00 -1.71 0.00 0.00 66.02 65.34 3mcv s SER 95 CO 0.57 -0.18 0.99 0.00 1.20 0.00 0.00 173.24 175.83 3mcv s ALA 96 N 2.27 3.27 -0.25 5.45 0.00 -1.26 -5.05 121.76 126.19 3mcv s ALA 96 Ca -0.06 0.66 -0.02 0.00 0.00 0.00 0.00 51.96 52.54 3mcv s ALA 96 Cb -0.08 -3.24 0.14 0.00 0.00 0.00 0.00 23.12 19.94 3mcv s ALA 96 CO -0.18 0.05 0.38 0.12 0.00 0.00 0.00 175.76 176.13 3mcv s PHE 97 N -1.40 -0.85 -0.08 0.00 2.19 -1.26 -4.84 117.98 111.73 3mcv s PHE 97 Ca 0.48 0.79 -0.30 0.00 0.33 0.00 0.00 56.93 58.22 3mcv s PHE 97 Cb -0.24 0.01 0.12 0.00 -1.31 0.00 0.00 43.02 41.59 3mcv s PHE 97 CO 0.30 -0.75 0.98 1.52 1.83 0.00 0.00 175.22 179.10 3mcv s TYR 98 N 2.55 -0.31 0.56 10.12 -0.85 -1.26 -5.16 117.35 122.99 3mcv s TYR 98 Ca 0.13 0.31 -0.18 0.00 -0.52 0.00 0.00 57.07 56.80 3mcv s TYR 98 Cb -0.15 0.51 -0.05 0.00 0.38 0.00 0.00 41.96 42.65 3mcv s TYR 98 CO -0.17 -0.43 1.09 -1.25 -1.52 0.00 0.00 175.55 173.27 3mcv s PRO 99 N -2.42 3.35 -0.43 -3.49 0.04 -1.26 -4.71 135.00 126.09 3mcv s PRO 99 Ca 0.04 1.45 0.06 0.00 0.04 0.00 0.00 61.00 62.58 3mcv s PRO 99 Cb -0.01 -2.02 0.20 0.00 0.04 0.00 0.00 34.50 32.71 3mcv s PRO 99 CO -0.05 -0.82 0.42 0.25 0.04 0.00 0.00 177.00 176.84 3mcv n THR 100 N -1.54 -0.78 -1.69 1.26 -2.24 0.11 -4.99 114.28 104.41 3mcv n THR 100 Ca 0.10 -3.76 -0.42 0.00 -2.27 0.00 0.00 64.05 57.70 3mcv n THR 100 Cb 0.52 -1.80 0.00 0.00 -2.10 0.00 0.00 70.33 66.95 3mcv n THR 100 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3mcv n PRO 101 N 2.22 2.01 0.10 -0.78 -0.02 -1.22 -4.36 135.00 132.95 3mcv n PRO 101 Ca 0.26 0.71 -0.04 0.00 -2.02 0.00 0.00 63.50 62.41 3mcv n PRO 101 Cb 0.49 -2.32 0.01 0.00 -0.02 0.00 0.00 33.50 31.65 3mcv n PRO 101 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3mcv h LEU 102 N 2.34 0.00 -8.35 2.45 3.38 -2.01 -3.43 115.31 109.70 3mcv h LEU 102 Ca -0.46 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 56.83 3mcv h LEU 102 Cb 1.29 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 41.71 3mcv h LEU 102 CO 0.61 0.81 -0.88 -0.69 0.09 0.00 0.00 178.44 178.39 3mcv s VAL 103 N -3.07 2.01 0.01 1.22 1.01 -1.26 -5.26 120.40 115.06 3mcv s VAL 103 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.99 3mcv s VAL 103 Cb 0.11 -1.73 0.00 0.00 0.00 0.00 0.00 36.38 34.76 3mcv s VAL 103 CO 0.79 0.55 0.02 0.00 0.00 0.00 0.00 175.10 176.46 3mcv n GLN 104 N 3.43 1.08 0.00 2.72 1.13 -1.26 -5.20 117.38 119.28 3mcv n GLN 104 Ca -0.19 -0.07 0.00 0.00 -1.94 0.00 0.00 57.00 54.80 3mcv n GLN 104 Cb 0.53 -0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.87 3mcv n GLN 104 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3mcv n GLY 113 N 4.84 0.79 3.78 1.08 0.00 -1.26 -5.25 105.19 109.18 3mcv n GLY 113 Ca 0.00 0.57 -0.37 0.00 0.00 0.00 0.00 46.02 46.23 3mcv n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mcv s LYS 114 N 0.00 4.49 0.71 1.61 1.02 -1.26 -5.03 119.74 121.27 3mcv s LYS 114 Ca 0.00 1.34 -0.13 0.00 0.02 0.00 0.00 55.97 57.21 3mcv s LYS 114 Cb 0.00 -2.70 0.02 0.00 -0.52 0.00 0.00 37.83 34.63 3mcv s LYS 114 CO 0.00 0.18 1.09 0.95 -0.92 0.00 0.00 175.35 176.65 3mcv s THR 115 N -1.67 3.45 0.32 2.17 -4.23 -1.26 -4.87 115.64 109.55 3mcv s THR 115 Ca 0.52 0.56 0.01 0.00 -1.18 0.00 0.00 61.69 61.60 3mcv s THR 115 Cb -0.18 -3.09 0.22 0.00 1.34 0.00 0.00 72.50 70.78 3mcv s THR 115 CO 0.24 -0.53 1.93 1.62 -0.54 0.00 0.00 174.62 177.33 3mcv h VAL 116 N -0.52 1.19 -0.64 2.29 3.04 -1.99 -1.79 116.25 117.84 3mcv h VAL 116 Ca -0.45 -0.53 0.07 0.00 -1.01 0.00 0.00 66.70 64.78 3mcv h VAL 116 Cb 1.23 0.41 -0.06 0.00 -2.01 0.00 0.00 31.29 30.86 3mcv h VAL 116 CO 0.54 0.22 0.33 -0.08 -1.01 0.00 0.00 177.57 177.57 3mcv h GLU 117 N 0.85 0.58 -0.47 4.17 4.81 -1.99 0.15 114.58 122.68 3mcv h GLU 117 Ca 0.21 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.30 3mcv h GLU 117 Cb 0.07 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 3mcv h GLU 117 CO -0.03 0.39 -0.13 1.15 -0.73 0.00 0.00 179.01 179.66 3mcv h THR 118 N 0.60 1.27 -0.34 0.32 2.02 -1.79 -0.60 112.91 114.39 3mcv h THR 118 Ca 0.30 -1.26 -0.00 0.00 0.77 0.00 0.00 66.41 66.21 3mcv h THR 118 Cb 0.23 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 3mcv h THR 118 CO -0.21 0.43 0.20 1.56 0.37 0.00 0.00 175.52 177.88 3mcv h GLN 119 N 0.76 0.45 -0.17 6.66 4.20 -0.87 0.39 115.11 126.54 3mcv h GLN 119 Ca 0.12 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.81 3mcv h GLN 119 Cb 0.68 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.35 3mcv h GLN 119 CO 0.05 0.34 0.03 0.28 -0.67 0.00 0.00 178.83 178.86 3mcv h VAL 120 N 0.44 0.93 -0.64 -0.54 2.07 -0.89 -0.10 116.25 117.53 3mcv h VAL 120 Ca 0.12 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.64 3mcv h VAL 120 Cb 0.00 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 3mcv h VAL 120 CO -0.02 0.02 0.38 0.00 0.02 0.00 0.00 177.57 177.96 3mcv h ALA 121 N 1.12 0.84 -0.02 1.67 0.00 -0.71 -0.89 119.26 121.26 3mcv h ALA 121 Ca 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3mcv h ALA 121 Cb 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3mcv h ALA 121 CO -0.10 0.10 -0.08 0.93 0.00 0.00 0.00 179.25 180.11 3mcv h GLU 122 N 0.73 0.09 -0.00 0.00 5.08 -0.84 0.63 114.58 120.27 3mcv h GLU 122 Ca 0.27 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.42 3mcv h GLU 122 Cb 0.08 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.35 3mcv h GLU 122 CO -0.13 0.72 -0.54 -0.07 -1.00 0.00 0.00 179.01 177.99 3mcv h LEU 123 N -0.53 0.48 -0.13 1.33 3.38 -0.97 -1.24 115.31 117.63 3mcv h LEU 123 Ca -0.00 -0.76 -0.24 0.00 0.09 0.00 0.00 57.88 56.97 3mcv h LEU 123 Cb 0.74 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.35 3mcv h LEU 123 CO 0.02 1.18 -0.97 0.40 0.09 0.00 0.00 178.44 179.15 3mcv h ILE 124 N -0.17 1.38 0.30 1.22 1.08 -1.34 -2.84 117.51 117.15 3mcv h ILE 124 Ca -0.07 -2.43 -0.01 0.00 -0.39 0.00 0.00 64.86 61.96 3mcv h ILE 124 Cb 1.26 2.43 0.00 0.00 -3.07 0.00 0.00 36.82 37.44 3mcv h ILE 124 CO 0.11 0.73 -0.15 1.23 -0.69 0.00 0.00 178.15 179.38 3mcv h GLY 125 N 1.08 -0.43 0.98 5.37 0.00 -1.16 -1.19 103.07 107.72 3mcv h GLY 125 Ca -0.09 0.16 -0.10 0.00 0.00 0.00 0.00 47.33 47.30 3mcv h GLY 125 CO 0.17 -0.15 -0.17 -0.91 0.00 0.00 0.00 176.54 175.48 3mcv h THR 126 N -0.50 1.28 0.00 4.70 1.35 -1.15 0.18 112.91 118.77 3mcv h THR 126 Ca -0.04 -1.29 -0.02 0.00 -0.55 0.00 0.00 66.41 64.52 3mcv h THR 126 Cb 0.37 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 68.15 3mcv h THR 126 CO 0.07 0.42 -0.45 0.78 -0.25 0.00 0.00 175.52 176.10 3mcv h ASN 127 N 0.53 0.00 0.00 5.36 2.35 -1.54 -3.40 115.58 118.88 3mcv h ASN 127 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3mcv h ASN 127 Cb 0.71 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.08 3mcv h ASN 127 CO 0.05 0.07 -0.13 0.00 -1.65 0.00 0.00 177.43 175.77 3mcv n ALA 128 N -2.15 3.00 -0.05 -0.83 0.00 -0.61 -4.44 120.51 115.44 3mcv n ALA 128 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.33 3mcv n ALA 128 Cb 0.57 0.08 -0.08 0.00 0.00 0.00 0.00 19.45 20.02 3mcv n ALA 128 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3mcv h ILE 129 N 0.00 1.35 -0.17 0.00 1.08 -1.06 -1.63 117.51 117.08 3mcv h ILE 129 Ca 0.00 -1.26 -0.00 0.00 -0.39 0.00 0.00 64.86 63.21 3mcv h ILE 129 Cb 0.13 1.92 -0.01 0.00 -3.07 0.00 0.00 36.82 35.79 3mcv h ILE 129 CO 0.00 0.36 0.10 0.00 -0.69 0.00 0.00 178.15 177.93 3mcv h ALA 130 N 0.60 0.22 -0.81 1.87 0.00 -0.90 -0.58 119.26 119.66 3mcv h ALA 130 Ca 0.02 -0.04 0.18 0.00 0.00 0.00 0.00 54.91 55.07 3mcv h ALA 130 Cb 0.63 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.23 3mcv h ALA 130 CO 0.03 -0.27 0.30 -1.35 0.00 0.00 0.00 179.25 177.96 3mcv h PRO 131 N 0.20 0.36 -0.19 0.00 0.11 -1.75 0.13 132.00 130.86 3mcv h PRO 131 Ca 0.06 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.14 3mcv h PRO 131 Cb 0.03 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 3mcv h PRO 131 CO -0.01 0.24 0.08 0.35 -0.21 0.00 0.00 178.00 178.45 3mcv h PHE 132 N 0.37 0.29 -0.46 0.65 3.57 -0.53 -0.41 116.94 120.42 3mcv h PHE 132 Ca 0.47 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.88 3mcv h PHE 132 Cb 0.82 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 3mcv h PHE 132 CO -0.19 0.32 0.00 -0.07 -2.23 0.00 0.00 178.31 176.14 3mcv h LEU 133 N 0.17 0.80 -1.13 0.59 3.38 -0.67 -0.43 115.31 118.02 3mcv h LEU 133 Ca 0.07 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 3mcv h LEU 133 Cb 0.15 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 3mcv h LEU 133 CO -0.01 0.91 0.47 -0.07 0.09 0.00 0.00 178.44 179.83 3mcv h LEU 134 N 0.66 0.94 -0.12 1.67 3.38 -0.73 -0.43 115.31 120.69 3mcv h LEU 134 Ca 0.13 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3mcv h LEU 134 Cb 0.49 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3mcv h LEU 134 CO 0.02 0.73 0.04 0.74 0.09 0.00 0.00 178.44 180.06 3mcv h THR 135 N 1.08 1.16 -0.20 0.22 2.02 -0.67 0.58 112.91 117.09 3mcv h THR 135 Ca 0.28 -0.48 0.06 0.00 0.77 0.00 0.00 66.41 67.04 3mcv h THR 135 Cb -0.04 1.27 -0.06 0.00 -1.74 0.00 0.00 68.15 67.57 3mcv h THR 135 CO -0.05 0.14 -0.23 0.24 0.37 0.00 0.00 175.52 175.99 3mcv h MET 136 N 0.02 -0.25 -0.65 6.66 2.86 -0.77 -0.97 114.93 121.83 3mcv h MET 136 Ca 0.04 0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.63 3mcv h MET 136 Cb 0.19 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 3mcv h MET 136 CO -0.00 -0.17 0.17 0.77 1.06 0.00 0.00 176.91 178.74 3mcv h SER 137 N -0.26 0.98 -0.22 1.22 0.02 -0.97 -0.21 113.55 114.12 3mcv h SER 137 Ca 0.12 -0.23 0.01 0.00 -0.84 0.00 0.00 61.79 60.86 3mcv h SER 137 Cb 0.44 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3mcv h SER 137 CO -0.35 0.96 0.12 0.15 -1.14 0.00 0.00 176.83 176.56 3mcv h PHE 138 N 0.96 0.22 -0.52 3.45 3.57 -0.70 -2.50 116.94 121.42 3mcv h PHE 138 Ca 0.21 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.59 3mcv h PHE 138 Cb 0.35 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 3mcv h PHE 138 CO 0.03 0.13 -0.16 0.00 -2.23 0.00 0.00 178.31 176.07 3mcv h ALA 139 N 1.11 0.73 0.00 2.41 0.00 -0.91 -3.04 119.26 119.55 3mcv h ALA 139 Ca 0.09 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 3mcv h ALA 139 Cb 0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3mcv h ALA 139 CO -0.05 0.68 -0.22 0.37 0.00 0.00 0.00 179.25 180.02 3mcv h GLN 140 N 0.90 0.00 0.00 0.00 5.75 -0.88 -2.69 115.11 118.19 3mcv h GLN 140 Ca 0.13 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 3mcv h GLN 140 Cb 0.74 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.29 3mcv h GLN 140 CO 0.06 0.22 -0.13 0.54 -2.65 0.00 0.00 178.83 176.86 3mcv n ARG 141 N -4.26 0.01 -1.00 1.69 5.12 -0.96 -5.09 116.66 112.17 3mcv n ARG 141 Ca -0.02 0.01 -0.15 0.00 -1.93 0.00 0.00 57.85 55.75 3mcv n ARG 141 Cb 0.28 -1.51 0.10 0.00 -1.16 0.00 0.00 32.46 30.17 3mcv n ARG 141 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3mcv n GLN 142 N -1.52 -0.62 0.00 5.56 1.13 -1.02 -5.06 117.38 115.86 3mcv n GLN 142 Ca 0.07 -1.07 0.00 0.00 -1.94 0.00 0.00 57.00 54.06 3mcv n GLN 142 Cb 0.34 -0.68 0.00 0.00 0.11 0.00 0.00 30.24 30.01 3mcv n GLN 142 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 3mcv n SER 151 N -3.42 0.00 -4.27 1.08 3.41 -1.26 -5.11 113.62 104.05 3mcv n SER 151 Ca 0.08 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.45 3mcv n SER 151 Cb 0.30 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.11 3mcv n SER 151 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3mcv s SER 152 N 0.00 2.52 -0.42 4.04 1.04 -1.26 -5.08 113.70 114.54 3mcv s SER 152 Ca 0.00 -0.60 0.06 0.00 0.48 0.00 0.00 55.95 55.89 3mcv s SER 152 Cb 0.00 -0.17 0.22 0.00 0.10 0.00 0.00 66.02 66.16 3mcv s SER 152 CO 0.00 0.11 0.52 -3.20 0.98 0.00 0.00 173.24 171.65 3mcv n ASN 153 N 1.47 -0.64 -4.73 7.02 5.15 -1.26 -5.11 115.26 117.15 3mcv n ASN 153 Ca -0.18 -2.67 -0.40 0.00 -0.60 0.00 0.00 54.58 50.72 3mcv n ASN 153 Cb 0.53 -0.17 -0.05 0.00 -0.53 0.00 0.00 39.78 39.57 3mcv n ASN 153 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3mcv s LEU 154 N -0.59 4.42 0.19 1.20 1.43 -1.26 -4.80 118.68 119.26 3mcv s LEU 154 Ca 0.34 1.45 -0.23 0.00 -1.03 0.00 0.00 54.13 54.66 3mcv s LEU 154 Cb 0.12 -3.27 0.06 0.00 0.03 0.00 0.00 46.19 43.13 3mcv s LEU 154 CO -0.15 -0.05 0.62 -0.94 0.23 0.00 0.00 176.35 176.06 3mcv s SER 155 N 0.25 -0.50 -0.04 2.29 1.04 -0.52 -2.28 113.70 113.93 3mcv s SER 155 Ca 0.41 -0.13 0.07 0.00 0.48 0.00 0.00 55.95 56.77 3mcv s SER 155 Cb -0.20 0.63 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 3mcv s SER 155 CO 0.23 -1.05 -0.25 -0.63 0.98 0.00 0.00 173.24 172.52 3mcv s ILE 156 N -3.79 2.03 -0.13 -1.02 1.01 -0.13 -1.93 121.20 117.24 3mcv s ILE 156 Ca 0.03 -1.07 0.01 0.00 0.00 0.00 0.00 60.65 59.62 3mcv s ILE 156 Cb -0.02 -1.71 0.02 0.00 0.01 0.00 0.00 42.46 40.76 3mcv s ILE 156 CO -0.09 0.57 -0.16 -0.69 0.00 0.00 0.00 174.94 174.58 3mcv s VAL 157 N -0.31 1.59 -0.19 2.92 1.01 -0.14 -1.39 120.40 123.88 3mcv s VAL 157 Ca 0.01 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.20 3mcv s VAL 157 Cb -0.12 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 3mcv s VAL 157 CO 0.02 0.46 0.17 0.20 0.00 0.00 0.00 175.10 175.95 3mcv s ASN 158 N 1.17 6.25 -0.47 3.32 0.01 -0.05 -0.76 114.94 124.42 3mcv s ASN 158 Ca -0.02 0.28 -0.26 0.00 -0.71 0.00 0.00 52.86 52.15 3mcv s ASN 158 Cb -0.14 -2.11 0.03 0.00 0.41 0.00 0.00 41.25 39.44 3mcv s ASN 158 CO -0.05 0.15 0.97 -0.76 -1.51 0.00 0.00 177.10 175.90 3mcv s LEU 159 N 0.44 3.94 0.00 0.60 2.01 -0.13 -1.34 118.68 124.20 3mcv s LEU 159 Ca 0.10 0.14 0.00 0.00 0.01 0.00 0.00 54.13 54.38 3mcv s LEU 159 Cb -0.12 -3.23 0.00 0.00 0.01 0.00 0.00 46.19 42.85 3mcv s LEU 159 CO -0.00 -1.10 0.00 0.00 1.01 0.00 0.00 176.35 176.25 3mcv s ASP 161 N -1.00 -0.73 0.16 0.00 -1.08 -1.26 -4.29 116.67 108.47 3mcv s ASP 161 Ca 0.00 1.16 0.18 0.00 -0.52 0.00 0.00 52.55 53.37 3mcv s ASP 161 Cb 0.00 1.83 0.79 0.00 -1.46 0.00 0.00 42.92 44.08 3mcv s ASP 161 CO 0.00 -0.24 1.55 0.00 0.52 0.00 0.00 175.17 177.00 3mcv n ALA 162 N 5.42 1.50 -0.53 3.66 0.00 0.56 -2.85 120.51 128.28 3mcv n ALA 162 Ca -0.09 0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.50 3mcv n ALA 162 Cb 0.49 -1.29 0.32 0.00 0.00 0.00 0.00 19.45 18.98 3mcv n ALA 162 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3mcv n MET 163 N -1.93 3.33 0.25 0.00 2.81 -1.26 -4.61 117.12 115.69 3mcv n MET 163 Ca 0.02 -2.73 0.13 0.00 -1.81 0.00 0.00 57.70 53.31 3mcv n MET 163 Cb 0.16 -1.73 0.79 0.00 -0.71 0.00 0.00 33.22 31.73 3mcv n MET 163 CO 0.00 0.00 0.00 -0.39 1.51 0.00 0.00 175.97 177.09 3mcv h VAL 164 N 3.77 0.69 -0.01 2.03 -1.51 -1.92 -0.33 116.25 118.96 3mcv h VAL 164 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 3mcv h VAL 164 Cb 1.24 0.95 0.00 0.00 -2.13 0.00 0.00 31.29 31.35 3mcv h VAL 164 CO 0.14 0.00 -0.25 0.47 -1.23 0.00 0.00 177.57 176.70 3mcv n ASP 165 N -4.11 1.44 -3.19 4.19 8.00 -1.26 -4.26 116.55 117.36 3mcv n ASP 165 Ca -0.01 -1.20 -0.22 0.00 0.71 0.00 0.00 54.79 54.07 3mcv n ASP 165 Cb 0.17 0.18 -0.05 0.00 -0.02 0.00 0.00 41.12 41.40 3mcv n ASP 165 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mcv n GLN 166 N -0.25 1.32 -1.52 -1.24 6.02 -0.17 -5.13 117.38 116.41 3mcv n GLN 166 Ca 0.13 -3.64 -0.31 0.00 -0.01 0.00 0.00 57.00 53.16 3mcv n GLN 166 Cb 0.39 -1.65 0.06 0.00 1.02 0.00 0.00 30.24 30.06 3mcv n GLN 166 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3mcv s PRO 167 N -2.09 2.81 0.29 -1.09 0.04 -0.99 -4.88 135.00 129.08 3mcv s PRO 167 Ca 0.39 0.98 -0.30 0.00 0.04 0.00 0.00 61.00 62.12 3mcv s PRO 167 Cb 0.25 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.71 3mcv s PRO 167 CO -0.09 -1.20 1.50 0.00 0.04 0.00 0.00 177.00 177.25 3mcv n MET 169 N 1.89 2.09 -1.34 0.00 1.56 -1.26 -2.81 117.12 117.24 3mcv n MET 169 Ca 0.06 0.75 -0.10 0.00 -0.27 0.00 0.00 57.70 58.14 3mcv n MET 169 Cb 0.39 -2.43 -0.04 0.00 2.15 0.00 0.00 33.22 33.29 3mcv n MET 169 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3mcv n ALA 170 N 2.22 -0.16 -1.84 -5.12 0.00 -1.26 -4.94 120.51 109.41 3mcv n ALA 170 Ca 0.13 0.15 -0.27 0.00 0.00 0.00 0.00 53.44 53.45 3mcv n ALA 170 Cb 0.31 -1.24 0.04 0.00 0.00 0.00 0.00 19.45 18.56 3mcv n ALA 170 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3mcv n PHE 171 N -2.80 2.90 0.04 0.00 3.01 -1.12 0.05 117.46 119.54 3mcv n PHE 171 Ca -0.10 -2.46 -0.11 0.00 1.01 0.00 0.00 57.45 55.79 3mcv n PHE 171 Cb 0.34 -0.65 -0.04 0.00 -0.01 0.00 0.00 39.48 39.12 3mcv n PHE 171 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3mcv h SER 172 N 2.14 -0.53 -0.61 4.37 0.02 -1.84 -0.56 113.55 116.55 3mcv h SER 172 Ca 0.44 0.08 -0.06 0.00 -0.84 0.00 0.00 61.79 61.41 3mcv h SER 172 Cb 1.32 0.23 -0.02 0.00 0.14 0.00 0.00 62.40 64.06 3mcv h SER 172 CO 1.00 -0.24 0.14 -0.07 -1.14 0.00 0.00 176.83 176.52 3mcv h LEU 173 N -0.27 0.92 -0.23 5.07 3.38 -1.89 0.22 115.31 122.50 3mcv h LEU 173 Ca 0.07 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.82 3mcv h LEU 173 Cb 0.36 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3mcv h LEU 173 CO -0.19 0.92 0.08 0.22 0.09 0.00 0.00 178.44 179.56 3mcv h TYR 174 N 0.88 0.15 -0.24 1.13 3.20 -1.79 -1.23 116.97 119.08 3mcv h TYR 174 Ca 0.19 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.97 3mcv h TYR 174 Cb 0.36 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 3mcv h TYR 174 CO 0.03 0.07 -0.30 -0.91 -1.64 0.00 0.00 178.16 175.41 3mcv h ASN 175 N 0.19 0.48 -0.48 -2.11 2.35 -0.69 -1.14 115.58 114.19 3mcv h ASN 175 Ca 0.10 -0.18 0.03 0.00 -0.55 0.00 0.00 56.30 55.70 3mcv h ASN 175 Cb 0.06 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.27 3mcv h ASN 175 CO -0.10 0.76 0.27 0.24 -1.65 0.00 0.00 177.43 176.95 3mcv h MET 176 N 0.41 0.51 -0.33 0.81 2.86 -0.32 -0.41 114.93 118.47 3mcv h MET 176 Ca 0.05 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.67 3mcv h MET 176 Cb 0.73 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.25 3mcv h MET 176 CO 0.06 0.34 0.20 0.78 1.06 0.00 0.00 176.91 179.35 3mcv h GLY 177 N 0.53 0.45 1.44 8.32 0.00 -0.59 -0.56 103.07 112.66 3mcv h GLY 177 Ca 0.20 -0.16 -0.09 0.00 0.00 0.00 0.00 47.33 47.29 3mcv h GLY 177 CO -0.11 0.15 -0.12 0.50 0.00 0.00 0.00 176.54 176.96 3mcv h LYS 178 N 0.42 0.67 -0.45 4.80 1.79 -0.99 -0.92 116.57 121.88 3mcv h LYS 178 Ca 0.12 -0.21 -0.02 0.00 -2.18 0.00 0.00 60.65 58.36 3mcv h LYS 178 Cb -0.02 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.54 3mcv h LYS 178 CO -0.04 0.77 0.21 0.45 -1.08 0.00 0.00 179.45 179.76 3mcv h HIS 179 N 0.61 0.66 -0.82 -1.35 3.86 -0.89 -2.14 115.15 115.08 3mcv h HIS 179 Ca 0.11 -0.04 0.07 0.00 -1.16 0.00 0.00 60.37 59.35 3mcv h HIS 179 Cb 0.56 -0.20 -0.05 0.00 1.06 0.00 0.00 27.41 28.77 3mcv h HIS 179 CO 0.02 0.54 0.54 0.00 0.86 0.00 0.00 177.93 179.89 3mcv h ALA 180 N 1.06 1.62 -0.31 2.45 0.00 -0.73 -1.20 119.26 122.13 3mcv h ALA 180 Ca 0.15 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3mcv h ALA 180 Cb 0.13 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3mcv h ALA 180 CO -0.02 0.25 -0.16 1.25 0.00 0.00 0.00 179.25 180.58 3mcv h LEU 181 N 0.89 0.55 -0.28 0.00 5.85 -0.73 0.53 115.31 122.10 3mcv h LEU 181 Ca 0.36 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 3mcv h LEU 181 Cb 0.26 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3mcv h LEU 181 CO -0.13 0.72 0.13 0.58 -0.34 0.00 0.00 178.44 179.40 3mcv h VAL 182 N 0.51 1.16 -0.67 1.05 2.07 -0.62 -0.51 116.25 119.24 3mcv h VAL 182 Ca 0.09 -0.48 0.06 0.00 0.82 0.00 0.00 66.70 67.19 3mcv h VAL 182 Cb 0.56 0.96 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 3mcv h VAL 182 CO 0.04 0.17 0.37 1.23 0.02 0.00 0.00 177.57 179.39 3mcv h GLY 183 N 0.32 0.99 0.99 2.17 0.00 -0.63 -1.79 103.07 105.11 3mcv h GLY 183 Ca 0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 3mcv h GLY 183 CO -0.01 0.15 0.20 -2.00 0.00 0.00 0.00 176.54 174.88 3mcv h LEU 184 N 0.68 0.37 -0.69 3.11 5.85 -0.74 -0.25 115.31 123.63 3mcv h LEU 184 Ca 0.30 -0.04 0.10 0.00 0.84 0.00 0.00 57.88 59.08 3mcv h LEU 184 Cb 0.20 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.06 3mcv h LEU 184 CO -0.19 0.30 0.33 0.74 -0.34 0.00 0.00 178.44 179.28 3mcv h THR 185 N 0.41 0.82 -0.00 1.05 2.02 -0.53 0.23 112.91 116.91 3mcv h THR 185 Ca 0.11 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 3mcv h THR 185 Cb -0.01 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 3mcv h THR 185 CO -0.02 0.10 -0.01 1.56 0.37 0.00 0.00 175.52 177.52 3mcv h GLN 186 N 0.55 0.01 -0.58 6.66 4.20 -1.16 -1.20 115.11 123.60 3mcv h GLN 186 Ca 0.35 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 59.05 3mcv h GLN 186 Cb 0.39 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 3mcv h GLN 186 CO -0.28 0.57 0.35 0.77 -0.67 0.00 0.00 178.83 179.57 3mcv h SER 187 N -0.54 0.69 0.06 1.46 0.02 -0.86 -1.91 113.55 112.47 3mcv h SER 187 Ca 0.00 -0.05 -0.15 0.00 -0.84 0.00 0.00 61.79 60.74 3mcv h SER 187 Cb 0.57 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 3mcv h SER 187 CO 0.00 0.54 -0.53 0.00 -1.14 0.00 0.00 176.83 175.71 3mcv h ALA 188 N 1.18 0.75 -0.42 3.77 0.00 -0.62 -1.63 119.26 122.30 3mcv h ALA 188 Ca 0.21 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.63 3mcv h ALA 188 Cb -0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3mcv h ALA 188 CO -0.04 0.68 0.26 0.00 0.00 0.00 0.00 179.25 180.15 3mcv h ALA 189 N 1.03 0.54 -0.12 0.00 0.00 -0.95 0.24 119.26 120.00 3mcv h ALA 189 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3mcv h ALA 189 Cb 1.05 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3mcv h ALA 189 CO 0.10 -0.06 0.08 -0.07 0.00 0.00 0.00 179.25 179.30 3mcv h LEU 190 N 0.52 0.13 0.00 0.00 3.38 -1.18 -2.46 115.31 115.71 3mcv h LEU 190 Ca 0.17 -0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.91 3mcv h LEU 190 Cb -0.01 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 3mcv h LEU 190 CO -0.07 0.10 -1.10 -0.08 0.09 0.00 0.00 178.44 177.38 3mcv h GLU 191 N 0.16 0.00 -0.00 1.13 4.81 -1.12 -3.30 114.58 116.26 3mcv h GLU 191 Ca 0.04 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3mcv h GLU 191 Cb -0.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.36 3mcv h GLU 191 CO -0.01 0.90 -0.58 1.28 -0.73 0.00 0.00 179.01 179.86 3mcv n LEU 192 N -3.29 0.95 -0.23 1.64 4.77 0.06 -4.36 117.00 116.53 3mcv n LEU 192 Ca -0.03 -0.29 0.04 0.00 -0.03 0.00 0.00 56.01 55.70 3mcv n LEU 192 Cb 0.95 -0.12 0.15 0.00 -2.33 0.00 0.00 43.42 42.07 3mcv n LEU 192 CO 0.46 0.21 0.93 0.00 -1.33 0.00 0.00 177.39 177.66 3mcv h ALA 193 N 3.26 0.85 -0.09 -1.18 0.00 -1.51 -0.29 119.26 120.30 3mcv h ALA 193 Ca 0.00 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3mcv h ALA 193 Cb 0.53 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 3mcv h ALA 193 CO 0.00 -0.32 0.13 -1.35 0.00 0.00 0.00 179.25 177.71 3mcv h PRO 194 N 0.27 0.00 -0.08 0.00 0.11 -1.81 -0.57 132.00 129.92 3mcv h PRO 194 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.48 3mcv h PRO 194 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.71 3mcv h PRO 194 CO -0.47 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 177.98 3mcv n TYR 195 N -3.58 0.08 -1.23 0.65 4.02 -0.14 -4.93 117.16 112.03 3mcv n TYR 195 Ca -0.01 -0.04 -0.08 0.00 -0.01 0.00 0.00 57.90 57.76 3mcv n TYR 195 Cb 0.23 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.51 3mcv n TYR 195 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3mcv n GLY 196 N 1.20 1.00 3.51 2.72 0.00 -0.22 -4.99 105.19 108.41 3mcv n GLY 196 Ca 0.18 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 3mcv n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mcv s ILE 197 N -2.29 5.27 0.28 -0.61 1.01 -1.08 -4.17 121.20 119.62 3mcv s ILE 197 Ca 0.00 -0.33 -0.19 0.00 0.00 0.00 0.00 60.65 60.14 3mcv s ILE 197 Cb 0.00 -3.78 -0.09 0.00 0.01 0.00 0.00 42.46 38.60 3mcv s ILE 197 CO 0.00 -0.09 0.77 -0.13 0.00 0.00 0.00 174.94 175.48 3mcv s ARG 198 N 1.72 4.19 -0.11 2.79 0.52 -0.97 -3.73 118.95 123.36 3mcv s ARG 198 Ca 0.06 0.86 -0.02 0.00 -0.52 0.00 0.00 55.73 56.11 3mcv s ARG 198 Cb -0.18 -2.65 0.04 0.00 0.52 0.00 0.00 34.95 32.68 3mcv s ARG 198 CO 0.10 0.26 0.00 0.08 0.02 0.00 0.00 175.30 175.77 3mcv s VAL 199 N -1.75 0.48 0.29 3.52 1.01 -1.26 -0.95 120.40 121.74 3mcv s VAL 199 Ca 0.49 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.37 3mcv s VAL 199 Cb -0.14 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 3mcv s VAL 199 CO 0.19 0.12 0.16 0.20 0.00 0.00 0.00 175.10 175.78 3mcv s ASN 200 N 1.91 1.32 0.08 3.32 0.01 -0.49 0.32 114.94 121.41 3mcv s ASN 200 Ca 0.03 -1.54 0.01 0.00 -0.71 0.00 0.00 52.86 50.66 3mcv s ASN 200 Cb -0.14 0.38 -0.04 0.00 0.41 0.00 0.00 41.25 41.86 3mcv s ASN 200 CO -0.06 -0.88 -0.06 -0.83 -1.51 0.00 0.00 177.10 173.76 3mcv s GLY 201 N -3.34 0.65 -0.10 0.66 0.00 0.22 -0.87 107.32 104.55 3mcv s GLY 201 Ca 0.37 -1.25 0.02 0.00 0.00 0.00 0.00 44.72 43.86 3mcv s GLY 201 CO 0.17 -1.36 -0.17 0.14 0.00 0.00 0.00 173.10 171.89 3mcv s VAL 202 N -3.51 1.55 -0.51 1.40 1.01 -0.45 -0.69 120.40 119.20 3mcv s VAL 202 Ca 0.08 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.38 3mcv s VAL 202 Cb 0.05 -1.39 0.13 0.00 0.00 0.00 0.00 36.38 35.17 3mcv s VAL 202 CO -0.06 0.45 0.27 0.00 0.00 0.00 0.00 175.10 175.76 3mcv s ALA 203 N 0.75 3.30 0.72 5.51 0.00 0.19 -0.33 121.76 131.89 3mcv s ALA 203 Ca -0.12 -3.07 -0.14 0.00 0.00 0.00 0.00 51.96 48.64 3mcv s ALA 203 Cb -0.16 -2.28 0.03 0.00 0.00 0.00 0.00 23.12 20.71 3mcv s ALA 203 CO 0.02 -1.96 1.13 -2.14 0.00 0.00 0.00 175.76 172.81 3mcv s PRO 204 N 0.11 2.38 0.00 0.00 0.02 -1.26 -0.93 135.00 135.32 3mcv s PRO 204 Ca 0.15 1.43 0.00 0.00 0.02 0.00 0.00 61.00 62.61 3mcv s PRO 204 Cb -0.23 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.40 3mcv s PRO 204 CO -0.03 -1.58 0.00 0.41 -0.33 0.00 0.00 177.00 175.47 3mcv n GLY 205 N -0.41 0.29 3.39 0.52 0.00 -1.17 -0.32 105.19 107.48 3mcv n GLY 205 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 3mcv n GLY 205 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mcv s VAL 206 N 0.23 4.23 0.00 1.61 0.11 -1.26 -4.83 120.40 120.50 3mcv s VAL 206 Ca 0.00 -0.56 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 3mcv s VAL 206 Cb 0.00 -3.17 0.00 0.00 -1.53 0.00 0.00 36.38 31.68 3mcv s VAL 206 CO 0.00 0.08 0.00 -0.24 -3.33 0.00 0.00 175.10 171.61 3mcv n SER 207 N 4.92 0.00 -4.67 3.54 2.88 -1.26 -1.26 113.62 117.76 3mcv n SER 207 Ca -0.14 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 56.94 3mcv n SER 207 Cb 0.49 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.91 3mcv n SER 207 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3mcv n LEU 208 N 0.00 3.71 -4.81 2.46 4.77 -1.24 -4.62 117.00 117.28 3mcv n LEU 208 Ca 0.00 0.96 -0.31 0.00 -0.03 0.00 0.00 56.01 56.63 3mcv n LEU 208 Cb 0.00 -1.44 0.05 0.00 -2.33 0.00 0.00 43.42 39.70 3mcv n LEU 208 CO 0.00 0.04 0.71 -0.76 -1.33 0.00 0.00 177.39 176.05 3mcv s LEU 209 N 3.88 3.16 0.46 2.23 2.01 -1.26 -4.97 118.68 124.19 3mcv s LEU 209 Ca 0.90 1.69 -0.25 0.00 0.01 0.00 0.00 54.13 56.48 3mcv s LEU 209 Cb -0.59 -4.51 -0.08 0.00 0.01 0.00 0.00 46.19 41.02 3mcv s LEU 209 CO 0.46 -1.54 1.43 -2.84 1.01 0.00 0.00 176.35 174.87 3mcv s PRO 210 N -4.88 3.66 0.33 1.29 0.02 -1.26 -4.90 135.00 129.25 3mcv s PRO 210 Ca 0.59 2.42 0.02 0.00 0.02 0.00 0.00 61.00 64.05 3mcv s PRO 210 Cb -0.15 -2.64 0.59 0.00 0.02 0.00 0.00 34.50 32.32 3mcv s PRO 210 CO 0.53 -0.84 1.97 -0.39 -0.33 0.00 0.00 177.00 177.94 3mcv h VAL 211 N 2.27 1.12 0.00 3.83 -1.51 -2.04 -1.60 116.25 118.32 3mcv h VAL 211 Ca -0.51 -0.32 0.00 0.00 -1.23 0.00 0.00 66.70 64.64 3mcv h VAL 211 Cb 1.27 0.11 0.00 0.00 -2.13 0.00 0.00 31.29 30.54 3mcv h VAL 211 CO 0.61 0.17 0.00 0.00 -1.23 0.00 0.00 177.57 177.12 3mcv n ALA 212 N -2.43 1.83 -2.10 5.19 0.00 -1.26 -4.79 120.51 116.94 3mcv n ALA 212 Ca 0.10 -0.05 -0.41 0.00 0.00 0.00 0.00 53.44 53.08 3mcv n ALA 212 Cb 0.11 -1.31 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 3mcv n ALA 212 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3mcv s MET 213 N -3.03 4.72 0.49 0.00 0.00 -0.61 -5.02 119.30 115.85 3mcv s MET 213 Ca 0.08 1.51 -0.19 0.00 0.00 0.00 0.00 55.69 57.09 3mcv s MET 213 Cb 0.12 -3.34 -0.08 0.00 0.00 0.00 0.00 34.83 31.53 3mcv s MET 213 CO 0.34 0.27 1.01 0.20 0.00 0.00 0.00 175.02 176.84 3mcv s GLY 214 N -0.31 2.36 0.41 2.11 0.00 -1.26 -4.86 107.32 105.76 3mcv s GLY 214 Ca 0.46 0.47 0.09 0.00 0.00 0.00 0.00 44.72 45.74 3mcv s GLY 214 CO 0.31 0.77 2.01 -2.09 0.00 0.00 0.00 173.10 174.11 3mcv h GLU 215 N 1.37 0.52 -0.35 2.90 4.57 -1.98 -0.73 114.58 120.88 3mcv h GLU 215 Ca -0.49 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 57.65 3mcv h GLU 215 Cb 1.21 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.66 3mcv h GLU 215 CO 0.60 0.34 0.15 1.49 -1.18 0.00 0.00 179.01 180.41 3mcv h GLU 216 N 0.53 0.52 -0.66 1.92 4.81 -1.99 0.11 114.58 119.81 3mcv h GLU 216 Ca 0.22 -0.09 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 3mcv h GLU 216 Cb 0.21 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 3mcv h GLU 216 CO -0.06 0.49 0.13 1.49 -0.73 0.00 0.00 179.01 180.33 3mcv h GLU 217 N 0.42 1.08 -0.30 1.92 4.81 -1.73 -1.52 114.58 119.28 3mcv h GLU 217 Ca 0.12 -0.28 0.04 0.00 -0.13 0.00 0.00 59.36 59.11 3mcv h GLU 217 Cb 0.16 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 3mcv h GLU 217 CO -0.01 0.98 0.09 0.87 -0.73 0.00 0.00 179.01 180.21 3mcv h LYS 218 N 1.01 0.20 -0.08 1.92 1.57 -0.87 -2.75 116.57 117.57 3mcv h LYS 218 Ca 0.20 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.93 3mcv h LYS 218 Cb 0.41 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 3mcv h LYS 218 CO 0.01 0.13 -0.17 -0.44 -0.57 0.00 0.00 179.45 178.41 3mcv h ASP 219 N 0.21 0.12 -0.33 0.86 3.32 -0.49 -0.48 116.42 119.63 3mcv h ASP 219 Ca 0.13 -0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.19 3mcv h ASP 219 Cb 0.12 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 3mcv h ASP 219 CO -0.15 0.30 0.15 0.11 -1.72 0.00 0.00 179.24 177.92 3mcv h LYS 220 N 0.12 0.30 -0.15 3.56 1.57 -1.00 -1.31 116.57 119.65 3mcv h LYS 220 Ca 0.02 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3mcv h LYS 220 Cb 0.37 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 3mcv h LYS 220 CO 0.02 0.20 0.04 -1.49 -0.57 0.00 0.00 179.45 177.65 3mcv h TRP 221 N 0.31 0.25 -0.57 -1.35 4.06 -1.15 -3.15 115.95 114.34 3mcv h TRP 221 Ca 0.14 -0.03 0.11 0.00 2.06 0.00 0.00 58.89 61.17 3mcv h TRP 221 Cb 0.08 -0.07 -0.09 0.00 -1.00 0.00 0.00 29.16 28.08 3mcv h TRP 221 CO -0.11 0.38 0.09 0.00 -3.56 0.00 0.00 178.44 175.23 3mcv h ARG 222 N 0.04 0.21 0.00 0.49 3.08 -0.99 -1.57 114.38 115.64 3mcv h ARG 222 Ca 0.05 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3mcv h ARG 222 Cb 0.25 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3mcv h ARG 222 CO 0.00 0.14 0.00 0.00 -1.07 0.00 0.00 179.97 179.04 3mcv h ARG 223 N 0.21 0.00 0.00 0.04 3.08 -1.20 -2.18 114.38 114.34 3mcv h ARG 223 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 3mcv h ARG 223 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 3mcv h ARG 223 CO -0.41 0.00 0.00 0.87 -1.07 0.00 0.00 179.97 179.36 3mcv h LYS 224 N 0.00 0.00 -5.94 0.04 1.57 -1.28 -3.46 116.57 107.51 3mcv h LYS 224 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 3mcv h LYS 224 Cb 0.20 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.41 3mcv h LYS 224 CO 0.00 0.00 0.49 0.08 -0.57 0.00 0.00 179.45 179.45 3mcv s VAL 225 N -3.29 4.66 0.25 0.50 1.01 -0.83 -4.79 120.40 117.91 3mcv s VAL 225 Ca 0.06 1.04 -0.05 0.00 0.00 0.00 0.00 61.98 63.04 3mcv s VAL 225 Cb 0.07 -4.27 0.23 0.00 0.00 0.00 0.00 36.38 32.41 3mcv s VAL 225 CO 0.61 -0.48 1.88 -0.65 0.00 0.00 0.00 175.10 176.46 3mcv h PRO 226 N 8.47 1.08 -5.28 2.72 0.11 -1.83 -1.36 132.00 135.91 3mcv h PRO 226 Ca -0.24 -0.06 -0.70 0.00 0.11 0.00 0.00 66.00 65.11 3mcv h PRO 226 Cb 1.09 -0.24 -0.14 0.00 0.11 0.00 0.00 31.00 31.81 3mcv h PRO 226 CO 0.95 0.71 1.53 -1.17 -0.21 0.00 0.00 178.00 179.81 3mcv s LEU 227 N -10.17 4.52 0.00 2.35 2.96 -0.46 -4.28 118.68 113.60 3mcv s LEU 227 Ca -0.13 -2.50 0.00 0.00 -0.22 0.00 0.00 54.13 51.28 3mcv s LEU 227 Cb 0.18 -2.47 0.00 0.00 0.50 0.00 0.00 46.19 44.40 3mcv s LEU 227 CO 0.80 -1.01 0.00 0.61 -1.32 0.00 0.00 176.35 175.43 3mcv n GLY 228 N 5.04 0.69 3.97 7.98 0.00 -1.26 -4.48 105.19 117.14 3mcv n GLY 228 Ca 0.38 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.12 3mcv n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mcv n ARG 229 N -2.03 -3.83 -3.65 1.61 5.12 -0.51 -4.94 116.66 108.43 3mcv n ARG 229 Ca 0.00 0.46 -0.11 0.00 -1.93 0.00 0.00 57.85 56.27 3mcv n ARG 229 Cb 0.00 -4.88 -0.05 0.00 -1.16 0.00 0.00 32.46 26.37 3mcv n ARG 229 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 3mcv s ARG 230 N -6.56 1.03 0.55 5.56 1.70 -1.18 -4.33 118.95 115.72 3mcv s ARG 230 Ca 0.25 -0.65 -0.17 0.00 -0.47 0.00 0.00 55.73 54.70 3mcv s ARG 230 Cb -0.13 0.45 -0.06 0.00 -0.57 0.00 0.00 34.95 34.64 3mcv s ARG 230 CO 0.88 -0.39 1.03 -1.83 -1.08 0.00 0.00 175.30 173.91 3mcv s GLU 231 N -3.54 3.59 0.31 3.89 1.03 -1.26 -4.88 118.70 117.84 3mcv s GLU 231 Ca 0.01 1.16 -0.29 0.00 0.03 0.00 0.00 54.97 55.88 3mcv s GLU 231 Cb 0.01 -2.07 -0.11 0.00 -0.80 0.00 0.00 34.13 31.16 3mcv s GLU 231 CO -0.10 -0.58 1.50 0.00 -1.33 0.00 0.00 175.26 174.75 3mcv s ALA 232 N -2.42 3.65 0.72 -0.84 0.00 -0.39 -4.94 121.76 117.55 3mcv s ALA 232 Ca 0.63 1.48 -0.11 0.00 0.00 0.00 0.00 51.96 53.96 3mcv s ALA 232 Cb -0.14 -3.60 0.03 0.00 0.00 0.00 0.00 23.12 19.41 3mcv s ALA 232 CO 0.32 -0.91 1.08 -1.54 0.00 0.00 0.00 175.76 174.71 3mcv s SER 233 N 0.21 4.99 0.33 0.00 1.04 -1.26 -3.66 113.70 115.35 3mcv s SER 233 Ca 0.58 1.75 0.01 0.00 0.48 0.00 0.00 55.95 58.77 3mcv s SER 233 Cb -0.45 -2.51 0.58 0.00 0.10 0.00 0.00 66.02 63.73 3mcv s SER 233 CO 0.51 -1.71 1.99 0.00 0.98 0.00 0.00 173.24 175.02 3mcv h ALA 234 N -0.79 1.51 -0.55 5.32 0.00 -1.95 -1.84 119.26 120.96 3mcv h ALA 234 Ca -0.44 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 3mcv h ALA 234 Cb 1.22 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 3mcv h ALA 234 CO 0.54 0.44 0.15 1.49 0.00 0.00 0.00 179.25 181.87 3mcv h GLU 235 N 0.94 0.84 -0.72 0.00 4.81 -1.92 -0.83 114.58 117.71 3mcv h GLU 235 Ca 0.26 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 3mcv h GLU 235 Cb -0.08 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.14 3mcv h GLU 235 CO -0.06 0.75 0.23 1.96 -0.73 0.00 0.00 179.01 181.15 3mcv h GLN 236 N 0.81 1.11 -0.26 1.92 4.20 -1.71 0.22 115.11 121.40 3mcv h GLN 236 Ca 0.18 -0.23 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 3mcv h GLN 236 Cb 0.28 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 3mcv h GLN 236 CO -0.00 0.94 0.05 0.82 -0.67 0.00 0.00 178.83 179.97 3mcv h ILE 237 N 1.06 1.22 -0.64 2.54 1.08 -1.19 -3.01 117.51 118.57 3mcv h ILE 237 Ca 0.23 -0.75 0.03 0.00 -0.39 0.00 0.00 64.86 63.98 3mcv h ILE 237 Cb 0.29 1.21 -0.04 0.00 -3.07 0.00 0.00 36.82 35.22 3mcv h ILE 237 CO -0.01 0.24 0.43 0.00 -0.69 0.00 0.00 178.15 178.12 3mcv h ALA 238 N 0.87 1.63 -0.89 1.87 0.00 -0.55 -1.95 119.26 120.23 3mcv h ALA 238 Ca 0.08 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.01 3mcv h ALA 238 Cb 0.31 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 3mcv h ALA 238 CO 0.00 0.31 0.56 -0.44 0.00 0.00 0.00 179.25 179.68 3mcv h ASP 239 N 0.78 0.90 0.05 0.00 3.32 -0.45 0.88 116.42 121.90 3mcv h ASP 239 Ca 0.25 0.01 -0.18 0.00 0.02 0.00 0.00 57.03 57.13 3mcv h ASP 239 Cb 0.05 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 3mcv h ASP 239 CO -0.07 0.58 -0.64 0.00 -1.72 0.00 0.00 179.24 177.39 3mcv h ALA 240 N 1.41 0.59 -0.15 3.45 0.00 -1.34 -1.99 119.26 121.23 3mcv h ALA 240 Ca 0.38 -0.56 0.02 0.00 0.00 0.00 0.00 54.91 54.75 3mcv h ALA 240 Cb 0.14 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3mcv h ALA 240 CO -0.16 0.71 0.03 0.28 0.00 0.00 0.00 179.25 180.11 3mcv h VAL 241 N 0.41 0.94 -0.91 0.00 2.07 -0.98 -1.95 116.25 115.83 3mcv h VAL 241 Ca -0.01 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 3mcv h VAL 241 Cb 1.22 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.77 3mcv h VAL 241 CO 0.12 0.02 0.56 0.40 0.02 0.00 0.00 177.57 178.69 3mcv h ILE 242 N 0.10 1.25 -0.05 4.57 5.03 -0.76 -1.34 117.51 126.30 3mcv h ILE 242 Ca 0.07 -0.53 0.03 0.00 -0.12 0.00 0.00 64.86 64.31 3mcv h ILE 242 Cb 0.06 -0.05 -0.04 0.00 -3.03 0.00 0.00 36.82 33.76 3mcv h ILE 242 CO -0.09 0.26 -0.15 0.15 -0.68 0.00 0.00 178.15 177.64 3mcv h PHE 243 N 1.26 -0.38 -0.07 1.37 3.57 -1.13 -1.94 116.94 119.62 3mcv h PHE 243 Ca 0.33 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.79 3mcv h PHE 243 Cb -0.07 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 3mcv h PHE 243 CO 0.00 -0.22 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.56 3mcv h LEU 244 N -0.22 0.11 -0.02 0.59 3.38 -0.81 -1.94 115.31 116.40 3mcv h LEU 244 Ca 0.07 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3mcv h LEU 244 Cb 0.31 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3mcv h LEU 244 CO -0.18 0.35 0.00 -0.37 0.09 0.00 0.00 178.44 178.33 3mcv h VAL 245 N 0.11 0.00 -4.28 1.22 -1.51 -1.10 -3.44 116.25 107.25 3mcv h VAL 245 Ca 0.02 -0.74 -0.49 0.00 -1.23 0.00 0.00 66.70 64.26 3mcv h VAL 245 Cb 0.48 1.74 0.11 0.00 -2.13 0.00 0.00 31.29 31.50 3mcv h VAL 245 CO 0.03 0.00 0.33 -0.94 -1.23 0.00 0.00 177.57 175.76 3mcv s SER 246 N -5.40 4.41 0.56 4.19 1.04 -0.73 -4.95 113.70 112.83 3mcv s SER 246 Ca 0.09 1.30 0.37 0.00 0.48 0.00 0.00 55.95 58.19 3mcv s SER 246 Cb 0.09 -2.03 1.92 0.00 0.10 0.00 0.00 66.02 66.09 3mcv s SER 246 CO 0.63 -2.02 2.13 1.23 0.98 0.00 0.00 173.24 176.20 3mcv h GLY 247 N -1.12 0.00 1.36 7.32 0.00 -1.91 -2.14 103.07 106.58 3mcv h GLY 247 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3mcv h GLY 247 CO 0.59 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.57 3mcv n SER 248 N -2.89 0.00 -0.48 0.19 7.64 -1.26 -3.06 113.62 113.76 3mcv n SER 248 Ca -0.02 -0.19 0.06 0.00 1.01 0.00 0.00 58.87 59.74 3mcv n SER 248 Cb 0.12 -0.18 0.13 0.00 -1.01 0.00 0.00 64.21 63.27 3mcv n SER 248 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3mcv n ALA 249 N -1.18 2.70 0.69 -0.43 0.00 -0.81 -4.87 120.51 116.62 3mcv n ALA 249 Ca 0.10 -2.58 0.09 0.00 0.00 0.00 0.00 53.44 51.05 3mcv n ALA 249 Cb 0.11 -0.43 0.41 0.00 0.00 0.00 0.00 19.45 19.54 3mcv n ALA 249 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3mcv n GLN 250 N -0.89 0.07 -0.04 0.00 6.02 -1.17 -1.11 117.38 120.26 3mcv n GLN 250 Ca 0.13 0.17 0.11 0.00 -0.01 0.00 0.00 57.00 57.40 3mcv n GLN 250 Cb 0.73 -1.50 0.11 0.00 1.02 0.00 0.00 30.24 30.60 3mcv n GLN 250 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 3mcv n TYR 251 N -1.45 0.10 -3.27 1.08 9.36 -1.26 -4.94 117.16 116.77 3mcv n TYR 251 Ca 0.06 -0.05 -0.40 0.00 3.32 0.00 0.00 57.90 60.82 3mcv n TYR 251 Cb 0.20 -0.00 -0.08 0.00 -0.63 0.00 0.00 39.34 38.83 3mcv n TYR 251 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 3mcv s ILE 252 N -1.72 5.07 -0.10 2.97 1.01 -0.27 -5.04 121.20 123.13 3mcv s ILE 252 Ca 0.27 0.55 -0.12 0.00 0.00 0.00 0.00 60.65 61.35 3mcv s ILE 252 Cb 0.19 -3.86 0.03 0.00 0.01 0.00 0.00 42.46 38.82 3mcv s ILE 252 CO 0.27 -0.04 0.32 0.28 0.00 0.00 0.00 174.94 175.78 3mcv s THR 253 N 2.29 0.01 -0.14 2.92 -1.32 -1.26 -4.69 115.64 113.46 3mcv s THR 253 Ca 0.18 -0.11 0.00 0.00 -1.21 0.00 0.00 61.69 60.55 3mcv s THR 253 Cb -0.16 -0.50 0.00 0.00 -1.51 0.00 0.00 72.50 70.34 3mcv s THR 253 CO 0.11 -0.06 0.00 0.61 -2.21 0.00 0.00 174.62 173.07 3mcv n GLY 254 N 2.53 0.51 3.84 6.08 0.00 0.15 -4.95 105.19 113.35 3mcv n GLY 254 Ca -0.15 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 3mcv n GLY 254 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mcv s SER 255 N -2.41 6.28 -0.26 1.61 0.01 -1.26 -4.83 113.70 112.84 3mcv s SER 255 Ca 0.00 0.40 -0.01 0.00 1.31 0.00 0.00 55.95 57.66 3mcv s SER 255 Cb 0.00 -2.04 0.04 0.00 0.21 0.00 0.00 66.02 64.23 3mcv s SER 255 CO 0.00 0.37 -0.07 -0.63 0.41 0.00 0.00 173.24 173.32 3mcv s ILE 256 N -0.77 2.72 -0.35 1.44 1.01 -1.26 -0.61 121.20 123.38 3mcv s ILE 256 Ca 0.13 -1.19 -0.19 0.00 0.00 0.00 0.00 60.65 59.41 3mcv s ILE 256 Cb -0.12 -2.44 -0.00 0.00 0.01 0.00 0.00 42.46 39.92 3mcv s ILE 256 CO 0.03 0.13 0.55 -0.63 0.00 0.00 0.00 174.94 175.02 3mcv s ILE 257 N 1.27 4.98 0.21 2.92 1.01 0.13 -4.91 121.20 126.82 3mcv s ILE 257 Ca -0.02 0.40 -0.30 0.00 0.00 0.00 0.00 60.65 60.73 3mcv s ILE 257 Cb -0.18 -4.00 -0.09 0.00 0.01 0.00 0.00 42.46 38.20 3mcv s ILE 257 CO -0.05 -0.25 1.36 -0.54 0.00 0.00 0.00 174.94 175.46 3mcv s LYS 258 N 2.49 4.34 -0.59 2.79 1.02 -1.26 -0.64 119.74 127.89 3mcv s LYS 258 Ca 0.20 2.14 0.05 0.00 0.02 0.00 0.00 55.97 58.39 3mcv s LYS 258 Cb -0.15 -3.16 0.19 0.00 -0.52 0.00 0.00 37.83 34.19 3mcv s LYS 258 CO 0.14 -0.32 0.50 0.28 -0.92 0.00 0.00 175.35 175.04 3mcv n VAL 259 N 2.56 0.82 -0.63 3.17 0.31 -0.11 -4.87 118.33 119.58 3mcv n VAL 259 Ca 0.06 -4.48 0.00 0.00 -0.01 0.00 0.00 64.34 59.91 3mcv n VAL 259 Cb 0.42 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.33 3mcv n VAL 259 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3mcv n ASP 260 N 1.93 0.60 -2.02 4.52 5.75 -1.26 -3.06 116.55 123.01 3mcv n ASP 260 Ca 0.24 -1.22 -0.20 0.00 -0.01 0.00 0.00 54.79 53.60 3mcv n ASP 260 Cb 0.41 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.46 3mcv n ASP 260 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3mcv n GLY 261 N -0.11 0.61 2.10 6.12 0.00 -1.26 -1.29 105.19 111.35 3mcv n GLY 261 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3mcv n GLY 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mcv n GLY 262 N -0.70 0.83 0.26 -0.02 0.00 -1.26 -1.35 105.19 102.95 3mcv n GLY 262 Ca -0.22 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.83 3mcv n GLY 262 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3mcv h LEU 263 N 0.00 0.23 -0.41 0.99 5.85 -1.50 -1.23 115.31 119.25 3mcv h LEU 263 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3mcv h LEU 263 Cb 0.00 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.11 3mcv h LEU 263 CO 0.00 0.11 0.00 -1.54 -0.34 0.00 0.00 178.44 176.67 3mcv n SER 264 N -5.01 0.36 0.00 1.25 3.41 -1.26 -2.08 113.62 110.28 3mcv n SER 264 Ca 0.12 0.59 0.13 0.00 -0.26 0.00 0.00 58.87 59.45 3mcv n SER 264 Cb 0.36 -0.67 0.44 0.00 -0.26 0.00 0.00 64.21 64.08 3mcv n SER 264 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3mcv n LEU 265 N -1.90 0.25 -4.62 1.04 4.77 -0.46 -4.88 117.00 111.19 3mcv n LEU 265 Ca 0.02 0.25 -0.40 0.00 -0.03 0.00 0.00 56.01 55.85 3mcv n LEU 265 Cb 0.19 -0.38 -0.07 0.00 -2.33 0.00 0.00 43.42 40.83 3mcv n LEU 265 CO 0.16 0.06 0.31 -0.69 -1.33 0.00 0.00 177.39 175.90 3mcv s VAL 266 N -3.00 5.03 0.90 4.08 1.01 -0.89 -5.05 120.40 122.48 3mcv s VAL 266 Ca 0.13 0.98 -0.12 0.00 0.00 0.00 0.00 61.98 62.97 3mcv s VAL 266 Cb 0.18 -3.88 0.13 0.00 0.00 0.00 0.00 36.38 32.81 3mcv s VAL 266 CO 0.61 0.05 1.10 -1.38 0.00 0.00 0.00 175.10 175.48 3mcv s HIS 267 N 2.41 2.44 -1.54 5.22 -3.43 -1.26 -5.08 115.29 114.05 3mcv s HIS 267 Ca 0.23 1.08 0.00 0.00 -0.80 0.00 0.00 55.06 55.57 3mcv s HIS 267 Cb -0.16 -3.23 0.00 0.00 -1.43 0.00 0.00 32.58 27.77 3mcv s HIS 267 CO 0.09 -2.35 0.38 0.00 -2.00 0.00 0.00 174.74 170.87