#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pvv s VAL 2 N 0.00 0.39 0.38 3.34 -7.23 -1.26 -5.09 120.40 110.93 1pvv s VAL 2 Ca 0.00 -1.93 -0.26 0.00 -1.81 0.00 0.00 61.98 57.98 1pvv s VAL 2 Cb 0.00 -2.03 -0.09 0.00 0.56 0.00 0.00 36.38 34.83 1pvv s VAL 2 CO 0.00 -0.52 1.14 -0.55 -0.31 0.00 0.00 175.10 174.85 1pvv s SER 3 N -3.09 6.66 -0.03 4.85 0.15 -1.26 -4.93 113.70 116.05 1pvv s SER 3 Ca 0.22 2.28 0.04 0.00 0.70 0.00 0.00 55.95 59.20 1pvv s SER 3 Cb 0.07 -2.61 0.07 0.00 -1.71 0.00 0.00 66.02 61.83 1pvv s SER 3 CO 0.02 -0.57 0.98 0.18 1.20 0.00 0.00 173.24 175.05 1pvv n LEU 4 N 0.19 1.80 -4.65 3.45 4.77 -1.26 -5.06 117.00 116.25 1pvv n LEU 4 Ca 0.04 -2.01 -0.50 0.00 -0.03 0.00 0.00 56.01 53.51 1pvv n LEU 4 Cb 0.47 -0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 41.41 1pvv n LEU 4 CO 0.50 0.49 1.16 0.00 -1.33 0.00 0.00 177.39 178.21 1pvv n ALA 5 N -0.64 0.34 -0.58 -1.18 0.00 -1.19 -1.39 120.51 115.87 1pvv n ALA 5 Ca 0.04 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1pvv n ALA 5 Cb 0.38 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.56 1pvv n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pvv n GLY 6 N 3.37 1.68 3.78 0.00 0.00 -0.31 -5.00 105.19 108.71 1pvv n GLY 6 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 1pvv n GLY 6 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pvv s ARG 7 N -0.06 4.37 0.50 1.61 1.81 -0.49 -4.47 118.95 122.22 1pvv s ARG 7 Ca 0.00 1.52 -0.18 0.00 -1.72 0.00 0.00 55.73 55.35 1pvv s ARG 7 Cb 0.00 -2.74 -0.08 0.00 -0.45 0.00 0.00 34.95 31.67 1pvv s ARG 7 CO 0.00 0.04 0.99 -0.51 -0.68 0.00 0.00 175.30 175.14 1pvv s ASP 8 N -1.44 6.59 -0.43 0.23 1.01 -1.26 -4.48 116.67 116.88 1pvv s ASP 8 Ca 0.53 1.67 0.02 0.00 0.71 0.00 0.00 52.55 55.48 1pvv s ASP 8 Cb -0.23 -2.53 0.14 0.00 1.01 0.00 0.00 42.92 41.31 1pvv s ASP 8 CO 0.29 -0.61 0.25 -0.22 0.21 0.00 0.00 175.17 175.09 1pvv s LEU 9 N -3.81 2.45 -0.22 1.23 2.96 -0.27 -4.93 118.68 116.09 1pvv s LEU 9 Ca 0.61 -2.61 -0.04 0.00 -0.22 0.00 0.00 54.13 51.87 1pvv s LEU 9 Cb -0.11 -0.94 -0.12 0.00 0.50 0.00 0.00 46.19 45.52 1pvv s LEU 9 CO 0.26 -0.26 -0.24 0.18 -1.32 0.00 0.00 176.35 174.97 1pvv n LEU 10 N 3.55 2.37 -3.69 -0.68 4.32 -1.26 -0.41 117.00 121.20 1pvv n LEU 10 Ca 0.10 0.06 -0.13 0.00 -0.02 0.00 0.00 56.01 56.02 1pvv n LEU 10 Cb 0.35 -0.71 -0.09 0.00 -1.62 0.00 0.00 43.42 41.35 1pvv n LEU 10 CO 0.22 0.69 0.22 0.00 -1.22 0.00 0.00 177.39 177.30 1pvv n LEU 12 N 2.91 0.00 0.24 0.00 4.32 -1.26 -3.37 117.00 119.84 1pvv n LEU 12 Ca -0.14 0.37 0.10 0.00 -0.02 0.00 0.00 56.01 56.32 1pvv n LEU 12 Cb 0.56 -0.37 0.62 0.00 -1.62 0.00 0.00 43.42 42.61 1pvv n LEU 12 CO 0.08 -0.05 0.91 -0.61 -1.22 0.00 0.00 177.39 176.50 1pvv h GLN 13 N 0.00 0.00 -0.76 3.23 5.75 -1.97 -1.02 115.11 120.34 1pvv h GLN 13 Ca 0.00 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.45 1pvv h GLN 13 Cb 0.32 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.84 1pvv h GLN 13 CO 0.00 0.17 0.06 -0.40 -2.65 0.00 0.00 178.83 176.01 1pvv n ASP 14 N -3.70 4.05 -4.58 -0.69 5.75 -1.22 -4.85 116.55 111.30 1pvv n ASP 14 Ca -0.02 -2.68 -0.34 0.00 -0.01 0.00 0.00 54.79 51.75 1pvv n ASP 14 Cb 0.29 -0.64 -0.11 0.00 -1.03 0.00 0.00 41.12 39.63 1pvv n ASP 14 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1pvv s TYR 15 N -2.17 2.93 0.70 2.11 1.51 -0.39 -5.13 117.35 116.92 1pvv s TYR 15 Ca 0.36 0.02 -0.11 0.00 -1.01 0.00 0.00 57.07 56.32 1pvv s TYR 15 Cb 0.28 -1.70 0.01 0.00 -0.11 0.00 0.00 41.96 40.45 1pvv s TYR 15 CO 0.10 0.34 1.09 0.95 -1.11 0.00 0.00 175.55 176.92 1pvv s THR 16 N -0.84 3.62 0.32 -0.71 -4.23 -1.26 -4.92 115.64 107.61 1pvv s THR 16 Ca 0.13 0.53 -0.00 0.00 -1.18 0.00 0.00 61.69 61.16 1pvv s THR 16 Cb -0.11 -3.48 0.26 0.00 1.34 0.00 0.00 72.50 70.51 1pvv s THR 16 CO 0.02 -0.69 1.98 0.00 -0.54 0.00 0.00 174.62 175.39 1pvv h ALA 17 N -0.66 1.47 -0.17 3.99 0.00 -1.97 -1.77 119.26 120.14 1pvv h ALA 17 Ca -0.45 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.28 1pvv h ALA 17 Cb 1.25 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1pvv h ALA 17 CO 0.63 0.49 -0.45 1.49 0.00 0.00 0.00 179.25 181.40 1pvv h GLU 18 N 1.03 0.43 -0.46 0.00 4.81 -1.93 -0.31 114.58 118.14 1pvv h GLU 18 Ca 0.29 -0.23 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 1pvv h GLU 18 Cb -0.09 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1pvv h GLU 18 CO -0.07 0.80 -0.05 0.93 -0.73 0.00 0.00 179.01 179.89 1pvv h GLU 19 N 0.34 0.78 -0.38 1.92 5.08 -1.77 -0.35 114.58 120.21 1pvv h GLU 19 Ca 0.02 -0.23 -0.12 0.00 -1.00 0.00 0.00 59.36 58.03 1pvv h GLU 19 Cb 0.93 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 1pvv h GLU 19 CO 0.08 0.82 -0.24 0.82 -1.00 0.00 0.00 179.01 179.49 1pvv h ILE 20 N 0.72 1.28 0.00 3.13 2.04 -1.06 -2.69 117.51 120.93 1pvv h ILE 20 Ca 0.13 -1.38 -0.04 0.00 1.00 0.00 0.00 64.86 64.57 1pvv h ILE 20 Cb 0.51 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1pvv h ILE 20 CO 0.03 0.46 -0.20 -0.50 0.00 0.00 0.00 178.15 177.93 1pvv h TRP 21 N 0.62 0.00 -0.60 1.37 4.06 -0.71 -0.96 115.95 119.73 1pvv h TRP 21 Ca 0.08 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.02 1pvv h TRP 21 Cb 0.80 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.93 1pvv h TRP 21 CO 0.06 0.20 0.33 1.15 -3.56 0.00 0.00 178.44 176.62 1pvv h THR 22 N 0.00 1.19 -0.27 1.49 2.02 -0.81 0.40 112.91 116.93 1pvv h THR 22 Ca -0.00 -0.48 -0.03 0.00 0.77 0.00 0.00 66.41 66.67 1pvv h THR 22 Cb 0.37 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 1pvv h THR 22 CO 0.03 0.21 0.05 0.40 0.37 0.00 0.00 175.52 176.57 1pvv h ILE 23 N 0.81 1.23 -0.56 3.11 2.04 -1.01 -1.76 117.51 121.37 1pvv h ILE 23 Ca 0.21 -0.76 -0.10 0.00 1.00 0.00 0.00 64.86 65.20 1pvv h ILE 23 Cb 0.04 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1pvv h ILE 23 CO -0.03 0.25 -0.05 -0.07 0.00 0.00 0.00 178.15 178.24 1pvv h LEU 24 N 0.26 1.01 -0.53 1.44 3.38 -0.64 0.15 115.31 120.38 1pvv h LEU 24 Ca 0.08 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 1pvv h LEU 24 Cb 0.32 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1pvv h LEU 24 CO 0.00 1.10 0.17 -0.33 0.09 0.00 0.00 178.44 179.48 1pvv h GLU 25 N 0.90 0.82 -0.70 1.13 5.08 -0.20 -0.50 114.58 121.11 1pvv h GLU 25 Ca 0.15 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1pvv h GLU 25 Cb 0.61 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 1pvv h GLU 25 CO 0.04 0.75 0.21 1.15 -1.00 0.00 0.00 179.01 180.16 1pvv h THR 26 N 0.73 1.25 -0.68 1.13 2.02 -1.09 -2.18 112.91 114.08 1pvv h THR 26 Ca 0.17 -0.88 -0.05 0.00 0.77 0.00 0.00 66.41 66.43 1pvv h THR 26 Cb 0.27 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1pvv h THR 26 CO -0.01 0.34 0.24 0.00 0.37 0.00 0.00 175.52 176.46 1pvv h ALA 27 N 1.20 0.89 -0.70 6.16 0.00 -0.36 -0.47 119.26 125.97 1pvv h ALA 27 Ca 0.23 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1pvv h ALA 27 Cb 0.29 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1pvv h ALA 27 CO -0.01 0.54 0.24 -0.22 0.00 0.00 0.00 179.25 179.80 1pvv h LYS 28 N 0.98 1.06 -0.18 0.00 3.64 -0.89 0.26 116.57 121.44 1pvv h LYS 28 Ca 0.22 -0.20 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1pvv h LYS 28 Cb 0.26 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1pvv h LYS 28 CO -0.01 0.89 0.04 1.98 -2.27 0.00 0.00 179.45 180.08 1pvv h MET 29 N 1.02 0.29 -0.94 1.90 4.05 -1.06 -1.12 114.93 119.08 1pvv h MET 29 Ca 0.23 -0.07 0.04 0.00 -0.28 0.00 0.00 59.70 59.62 1pvv h MET 29 Cb 0.26 -0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 30.96 1pvv h MET 29 CO -0.01 0.42 0.60 0.74 0.23 0.00 0.00 176.91 178.90 1pvv h PHE 30 N 0.10 1.13 -0.51 1.39 0.04 -0.91 -1.40 116.94 116.78 1pvv h PHE 30 Ca 0.06 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.80 1pvv h PHE 30 Cb 0.27 -0.37 -0.02 0.00 2.20 0.00 0.00 35.95 38.02 1pvv h PHE 30 CO 0.01 0.63 0.11 -0.22 -0.60 0.00 0.00 178.31 178.24 1pvv h LYS 31 N 1.15 0.82 -0.56 1.51 3.64 -0.69 0.76 116.57 123.20 1pvv h LYS 31 Ca 0.38 -0.20 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1pvv h LYS 31 Cb 0.05 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1pvv h LYS 31 CO -0.14 0.80 0.28 0.82 -2.27 0.00 0.00 179.45 178.94 1pvv h ILE 32 N 0.71 1.20 -0.61 2.00 2.04 -1.01 -0.28 117.51 121.57 1pvv h ILE 32 Ca 0.16 -0.57 0.07 0.00 1.00 0.00 0.00 64.86 65.53 1pvv h ILE 32 Cb 0.35 0.54 -0.06 0.00 -0.74 0.00 0.00 36.82 36.91 1pvv h ILE 32 CO 0.00 0.23 0.28 -0.50 0.00 0.00 0.00 178.15 178.17 1pvv h TRP 33 N 0.76 0.51 -0.79 1.37 6.55 -0.97 -1.01 115.95 122.37 1pvv h TRP 33 Ca 0.19 0.03 -0.02 0.00 0.95 0.00 0.00 58.89 60.04 1pvv h TRP 33 Cb 0.11 -0.14 -0.04 0.00 -0.86 0.00 0.00 29.16 28.23 1pvv h TRP 33 CO -0.00 0.20 0.43 0.37 -1.05 0.00 0.00 178.44 178.38 1pvv h GLN 34 N 0.52 1.11 0.00 0.49 5.75 -0.44 0.68 115.11 123.22 1pvv h GLN 34 Ca 0.29 -0.13 -0.07 0.00 -0.15 0.00 0.00 58.65 58.59 1pvv h GLN 34 Cb 0.27 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 1pvv h GLN 34 CO -0.24 0.82 -0.33 0.87 -2.65 0.00 0.00 178.83 177.30 1pvv h LYS 35 N 1.10 0.00 -0.02 1.69 1.79 -0.18 -3.07 116.57 117.89 1pvv h LYS 35 Ca 0.28 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.75 1pvv h LYS 35 Cb 0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1pvv h LYS 35 CO -0.04 0.33 -0.36 0.44 -1.08 0.00 0.00 179.45 178.74 1pvv n ILE 36 N -3.65 0.00 -1.08 1.86 -5.35 -0.47 -4.95 119.36 105.72 1pvv n ILE 36 Ca -0.01 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.20 1pvv n ILE 36 Cb 0.45 1.14 0.00 0.00 -1.74 0.00 0.00 39.64 39.48 1pvv n ILE 36 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1pvv n GLY 37 N 1.39 0.74 3.62 3.28 0.00 -0.32 -5.03 105.19 108.86 1pvv n GLY 37 Ca 0.11 -0.68 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 1pvv n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pvv s LYS 38 N -2.32 4.04 0.76 1.61 2.20 0.08 -5.02 119.74 121.09 1pvv s LYS 38 Ca 0.00 0.62 -0.12 0.00 -0.36 0.00 0.00 55.97 56.11 1pvv s LYS 38 Cb 0.00 -3.69 0.05 0.00 -1.51 0.00 0.00 37.83 32.68 1pvv s LYS 38 CO 0.00 -0.56 1.12 -2.14 -0.36 0.00 0.00 175.35 173.41 1pvv s PRO 39 N 2.77 2.19 -0.45 4.03 0.02 -1.26 -4.52 135.00 137.79 1pvv s PRO 39 Ca 0.30 1.38 0.07 0.00 0.02 0.00 0.00 61.00 62.77 1pvv s PRO 39 Cb -0.15 -1.87 0.31 0.00 0.02 0.00 0.00 34.50 32.81 1pvv s PRO 39 CO 0.10 -1.72 0.99 -2.39 -0.33 0.00 0.00 177.00 173.65 1pvv n HIS 40 N -3.21 -2.30 -1.66 6.54 1.44 -1.26 -5.03 115.22 109.74 1pvv n HIS 40 Ca 0.11 -2.44 -0.42 0.00 -2.01 0.00 0.00 57.72 52.96 1pvv n HIS 40 Cb 0.52 1.18 -0.01 0.00 0.12 0.00 0.00 29.99 31.80 1pvv n HIS 40 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1pvv n ARG 41 N 0.58 2.90 0.04 -1.40 1.74 -1.26 -4.42 116.66 114.84 1pvv n ARG 41 Ca 0.10 -2.53 0.14 0.00 -0.77 0.00 0.00 57.85 54.79 1pvv n ARG 41 Cb 0.68 -3.22 0.54 0.00 -1.02 0.00 0.00 32.46 29.43 1pvv n ARG 41 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1pvv n LEU 42 N 5.86 0.29 -1.97 0.55 4.77 -0.99 -3.71 117.00 121.79 1pvv n LEU 42 Ca 0.55 0.53 -0.19 0.00 -0.03 0.00 0.00 56.01 56.86 1pvv n LEU 42 Cb 0.37 -0.44 0.04 0.00 -2.33 0.00 0.00 43.42 41.06 1pvv n LEU 42 CO 0.90 -0.07 0.18 0.18 -1.33 0.00 0.00 177.39 177.25 1pvv n LEU 43 N -1.77 4.45 -4.70 2.23 4.77 0.94 -4.98 117.00 117.93 1pvv n LEU 43 Ca 0.06 -4.52 -0.44 0.00 -0.03 0.00 0.00 56.01 51.09 1pvv n LEU 43 Cb 0.37 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 1pvv n LEU 43 CO 0.28 1.95 1.23 1.21 -1.33 0.00 0.00 177.39 180.73 1pvv n GLU 44 N -0.72 2.41 -0.65 3.23 4.07 -1.21 -0.95 120.64 126.82 1pvv n GLU 44 Ca 0.39 0.87 0.00 0.00 -0.06 0.00 0.00 57.16 58.35 1pvv n GLU 44 Cb 0.94 -2.64 0.00 0.00 -0.06 0.00 0.00 31.44 29.67 1pvv n GLU 44 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1pvv n GLY 45 N 3.19 1.43 3.92 8.31 0.00 -1.21 -4.93 105.19 115.90 1pvv n GLY 45 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 1pvv n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pvv s LYS 46 N -0.10 3.56 0.06 1.61 -0.14 -0.12 -4.95 119.74 119.65 1pvv s LYS 46 Ca 0.00 -0.17 0.03 0.00 -1.36 0.00 0.00 55.97 54.47 1pvv s LYS 46 Cb 0.00 -2.68 -0.03 0.00 -1.68 0.00 0.00 37.83 33.44 1pvv s LYS 46 CO 0.00 0.22 -0.10 0.95 -0.76 0.00 0.00 175.35 175.66 1pvv s THR 47 N -2.13 0.76 -0.21 2.17 -4.23 -1.26 -1.18 115.64 109.56 1pvv s THR 47 Ca 0.42 -1.23 0.01 0.00 -1.18 0.00 0.00 61.69 59.71 1pvv s THR 47 Cb -0.10 -0.86 0.04 0.00 1.34 0.00 0.00 72.50 72.91 1pvv s THR 47 CO 0.32 -0.37 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.67 1pvv s LEU 48 N -1.76 2.53 -0.25 4.79 2.96 -0.41 -1.05 118.68 125.49 1pvv s LEU 48 Ca -0.05 -0.92 -0.27 0.00 -0.22 0.00 0.00 54.13 52.66 1pvv s LEU 48 Cb -0.09 -1.42 0.01 0.00 0.50 0.00 0.00 46.19 45.19 1pvv s LEU 48 CO 0.01 -0.10 0.96 0.00 -1.32 0.00 0.00 176.35 175.90 1pvv s ALA 49 N 1.28 3.65 -0.38 5.97 0.00 -0.35 -1.11 121.76 130.81 1pvv s ALA 49 Ca -0.01 0.02 -0.14 0.00 0.00 0.00 0.00 51.96 51.83 1pvv s ALA 49 Cb -0.16 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 19.50 1pvv s ALA 49 CO -0.09 -1.06 0.28 -1.64 0.00 0.00 0.00 175.76 173.24 1pvv s MET 50 N 3.12 3.18 -0.30 0.00 1.00 0.49 -0.30 119.30 126.49 1pvv s MET 50 Ca 0.41 -0.87 -0.11 0.00 0.00 0.00 0.00 55.69 55.11 1pvv s MET 50 Cb -0.15 -3.91 -0.03 0.00 0.00 0.00 0.00 34.83 30.74 1pvv s MET 50 CO 0.08 -0.63 0.19 0.42 0.00 0.00 0.00 175.02 175.08 1pvv s ILE 51 N 1.70 5.15 -0.08 2.53 1.01 0.88 -0.67 121.20 131.72 1pvv s ILE 51 Ca 0.05 -0.03 0.04 0.00 0.00 0.00 0.00 60.65 60.71 1pvv s ILE 51 Cb -0.18 -3.52 -0.01 0.00 0.01 0.00 0.00 42.46 38.75 1pvv s ILE 51 CO 0.10 0.16 -0.20 -0.36 0.00 0.00 0.00 174.94 174.65 1pvv s PHE 52 N 1.72 2.61 -0.38 3.97 0.40 -0.16 -0.49 117.98 125.66 1pvv s PHE 52 Ca 0.06 -0.66 0.14 0.00 -0.60 0.00 0.00 56.93 55.87 1pvv s PHE 52 Cb -0.16 -1.69 -0.18 0.00 0.51 0.00 0.00 43.02 41.49 1pvv s PHE 52 CO 0.10 -0.18 0.47 1.04 0.70 0.00 0.00 175.22 177.34 1pvv n GLN 53 N 3.10 1.59 -4.11 0.44 6.02 0.15 0.02 117.38 124.58 1pvv n GLN 53 Ca -0.18 -0.06 -0.11 0.00 -0.01 0.00 0.00 57.00 56.65 1pvv n GLN 53 Cb 0.52 -1.23 -0.11 0.00 1.02 0.00 0.00 30.24 30.45 1pvv n GLN 53 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1pvv s LYS 54 N -2.59 0.68 0.39 -1.09 3.01 -1.26 -4.97 119.74 113.91 1pvv s LYS 54 Ca 0.01 -1.09 -0.24 0.00 -1.01 0.00 0.00 55.97 53.63 1pvv s LYS 54 Cb 0.10 -0.17 -0.12 0.00 -1.01 0.00 0.00 37.83 36.63 1pvv s LYS 54 CO 0.58 -0.01 0.72 -2.30 0.51 0.00 0.00 175.35 174.85 1pvv n PRO 55 N 0.55 0.82 -3.66 -1.68 -0.02 -1.26 -5.02 135.00 124.74 1pvv n PRO 55 Ca -0.16 0.30 -0.11 0.00 -2.02 0.00 0.00 63.50 61.51 1pvv n PRO 55 Cb 0.58 -1.65 -0.08 0.00 -0.02 0.00 0.00 33.50 32.33 1pvv n PRO 55 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1pvv s SER 56 N -0.86 -0.75 -0.13 2.55 0.15 -1.26 -5.06 113.70 108.35 1pvv s SER 56 Ca 0.63 1.30 -0.14 0.00 0.70 0.00 0.00 55.95 58.44 1pvv s SER 56 Cb -0.62 1.24 -0.05 0.00 -1.71 0.00 0.00 66.02 64.87 1pvv s SER 56 CO 0.58 -0.22 -0.28 0.41 1.20 0.00 0.00 173.24 174.92 1pvv n THR 57 N 3.63 1.42 0.07 6.45 -1.04 -1.26 -4.50 114.28 119.05 1pvv n THR 57 Ca -0.18 0.14 -0.12 0.00 -2.04 0.00 0.00 64.05 61.85 1pvv n THR 57 Cb 0.57 -2.16 -0.09 0.00 -1.82 0.00 0.00 70.33 66.84 1pvv n THR 57 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1pvv h ARG 58 N -0.80 -0.21 -0.46 -2.82 3.08 -1.97 -1.23 114.38 109.97 1pvv h ARG 58 Ca -0.06 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1pvv h ARG 58 Cb 0.87 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.95 1pvv h ARG 58 CO -0.04 0.19 0.15 1.15 -1.07 0.00 0.00 179.97 180.36 1pvv h THR 59 N -0.67 1.22 0.40 2.04 2.02 -1.90 -1.22 112.91 114.80 1pvv h THR 59 Ca -0.02 -0.72 -0.01 0.00 0.77 0.00 0.00 66.41 66.42 1pvv h THR 59 Cb 0.49 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1pvv h THR 59 CO 0.04 0.26 -0.41 -0.09 0.37 0.00 0.00 175.52 175.68 1pvv h ARG 60 N 0.61 -0.79 0.00 6.66 9.65 -1.79 -2.58 114.38 126.15 1pvv h ARG 60 Ca 0.15 0.05 -0.16 0.00 -1.10 0.00 0.00 59.98 58.92 1pvv h ARG 60 Cb 0.25 0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 28.99 1pvv h ARG 60 CO -0.01 -0.52 -0.97 -0.39 2.80 0.00 0.00 179.97 180.88 1pvv h VAL 61 N -0.82 0.95 -0.57 0.20 -1.51 -1.19 -1.59 116.25 111.72 1pvv h VAL 61 Ca -0.05 -2.47 -0.03 0.00 -1.23 0.00 0.00 66.70 62.92 1pvv h VAL 61 Cb 0.71 2.41 -0.03 0.00 -2.13 0.00 0.00 31.29 32.25 1pvv h VAL 61 CO -0.06 0.54 0.22 0.77 -1.23 0.00 0.00 177.57 177.82 1pvv h SER 62 N 0.00 0.76 0.15 4.19 4.64 -1.31 0.18 113.55 122.16 1pvv h SER 62 Ca -0.07 -0.10 -0.24 0.00 -0.47 0.00 0.00 61.79 60.91 1pvv h SER 62 Cb 1.58 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 63.48 1pvv h SER 62 CO 0.08 0.69 -0.95 -0.26 -0.87 0.00 0.00 176.83 175.52 1pvv h PHE 63 N 0.82 0.82 -0.32 4.77 0.04 -1.38 -1.89 116.94 119.79 1pvv h PHE 63 Ca 0.19 -0.43 -0.14 0.00 2.80 0.00 0.00 57.97 60.39 1pvv h PHE 63 Cb 0.17 -0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.22 1pvv h PHE 63 CO 0.01 1.25 -0.34 1.49 -0.60 0.00 0.00 178.31 180.12 1pvv h GLU 64 N 0.33 0.81 -0.48 1.51 4.81 -0.94 -2.15 114.58 118.46 1pvv h GLU 64 Ca -0.09 -0.43 -0.08 0.00 -0.13 0.00 0.00 59.36 58.62 1pvv h GLU 64 Cb 1.58 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.97 1pvv h GLU 64 CO 0.18 1.07 -0.03 0.28 -0.73 0.00 0.00 179.01 179.77 1pvv h VAL 65 N 0.58 1.27 -0.60 0.32 2.07 -0.74 -2.54 116.25 116.60 1pvv h VAL 65 Ca 0.05 -1.12 0.06 0.00 0.82 0.00 0.00 66.70 66.51 1pvv h VAL 65 Cb 0.93 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.66 1pvv h VAL 65 CO 0.08 0.39 0.30 0.00 0.02 0.00 0.00 177.57 178.37 1pvv h ALA 66 N 0.91 0.80 -0.58 1.67 0.00 -1.14 -0.52 119.26 120.40 1pvv h ALA 66 Ca 0.13 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1pvv h ALA 66 Cb 0.55 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1pvv h ALA 66 CO 0.03 -0.05 0.04 0.52 0.00 0.00 0.00 179.25 179.79 1pvv h MET 67 N 0.56 0.97 -0.23 0.00 2.07 -1.29 -2.01 114.93 115.00 1pvv h MET 67 Ca 0.28 -0.27 0.01 0.00 -2.07 0.00 0.00 59.70 57.65 1pvv h MET 67 Cb 0.22 -0.11 -0.01 0.00 -1.87 0.00 0.00 31.60 29.82 1pvv h MET 67 CO -0.20 0.93 0.14 0.00 1.07 0.00 0.00 176.91 178.85 1pvv h ALA 68 N 1.13 0.29 -0.82 6.32 0.00 -0.88 0.05 119.26 125.35 1pvv h ALA 68 Ca 0.17 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1pvv h ALA 68 Cb 0.47 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1pvv h ALA 68 CO 0.02 -0.26 0.54 0.45 0.00 0.00 0.00 179.25 180.00 1pvv h HIS 69 N 0.28 1.02 -0.01 0.00 3.86 -0.99 -1.39 115.15 117.92 1pvv h HIS 69 Ca 0.09 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1pvv h HIS 69 Cb -0.01 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.12 1pvv h HIS 69 CO -0.08 0.63 0.00 1.28 0.86 0.00 0.00 177.93 180.62 1pvv n LEU 70 N -4.42 0.12 0.00 2.43 4.77 -0.77 -4.05 117.00 115.08 1pvv n LEU 70 Ca 0.09 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1pvv n LEU 70 Cb 0.04 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1pvv n LEU 70 CO 0.36 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1pvv n GLY 71 N 0.80 0.84 0.00 -0.72 0.00 -0.52 -0.04 105.19 105.55 1pvv n GLY 71 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1pvv n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pvv n GLY 72 N -2.04 3.71 2.95 -0.02 0.00 -0.05 -3.32 105.19 106.41 1pvv n GLY 72 Ca 0.00 -1.88 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 1pvv n GLY 72 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1pvv s HIS 73 N 2.35 -0.25 -0.06 1.61 2.46 -0.32 -4.16 115.29 116.91 1pvv s HIS 73 Ca 0.00 0.67 -0.14 0.00 0.47 0.00 0.00 55.06 56.06 1pvv s HIS 73 Cb 0.00 -0.08 -0.05 0.00 -0.13 0.00 0.00 32.58 32.32 1pvv s HIS 73 CO 0.00 -0.24 0.37 0.00 -2.47 0.00 0.00 174.74 172.40 1pvv s ALA 74 N 1.66 3.66 -0.22 1.58 0.00 -1.26 -1.28 121.76 125.90 1pvv s ALA 74 Ca -0.05 -0.30 -0.11 0.00 0.00 0.00 0.00 51.96 51.50 1pvv s ALA 74 Cb -0.11 -2.39 -0.05 0.00 0.00 0.00 0.00 23.12 20.57 1pvv s ALA 74 CO -0.07 0.34 0.19 -0.51 0.00 0.00 0.00 175.76 175.70 1pvv s LEU 75 N -0.49 4.16 -0.47 0.00 1.02 -0.27 -4.94 118.68 117.70 1pvv s LEU 75 Ca 0.22 0.22 -0.20 0.00 0.02 0.00 0.00 54.13 54.39 1pvv s LEU 75 Cb -0.15 -2.16 0.04 0.00 0.02 0.00 0.00 46.19 43.93 1pvv s LEU 75 CO 0.10 0.09 0.63 -0.47 0.02 0.00 0.00 176.35 176.72 1pvv s TYR 76 N 0.81 3.06 -0.59 0.29 5.04 -1.26 -0.38 117.35 124.33 1pvv s TYR 76 Ca 0.10 -0.27 -0.01 0.00 -2.44 0.00 0.00 57.07 54.44 1pvv s TYR 76 Cb -0.13 -3.40 0.15 0.00 0.35 0.00 0.00 41.96 38.94 1pvv s TYR 76 CO 0.03 -0.93 0.38 -0.51 -1.34 0.00 0.00 175.55 173.17 1pvv s LEU 77 N 2.73 5.03 0.08 6.97 1.02 0.16 -4.99 118.68 129.67 1pvv s LEU 77 Ca 0.19 -2.83 -0.31 0.00 0.02 0.00 0.00 54.13 51.20 1pvv s LEU 77 Cb -0.16 -1.80 -0.08 0.00 0.02 0.00 0.00 46.19 44.17 1pvv s LEU 77 CO 0.16 -0.35 1.56 0.21 0.02 0.00 0.00 176.35 177.95 1pvv s ASN 78 N 0.54 6.67 0.62 2.29 3.84 -1.26 -0.99 114.94 126.66 1pvv s ASN 78 Ca 0.16 2.42 0.31 0.00 0.21 0.00 0.00 52.86 55.96 1pvv s ASN 78 Cb -0.21 -2.57 1.67 0.00 -0.55 0.00 0.00 41.25 39.59 1pvv s ASN 78 CO -0.03 -0.82 2.01 0.00 -2.79 0.00 0.00 177.10 175.47 1pvv h ALA 79 N 7.82 1.65 0.00 1.71 0.00 -0.76 0.86 119.26 130.53 1pvv h ALA 79 Ca -0.42 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 1pvv h ALA 79 Cb 1.20 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1pvv h ALA 79 CO 0.92 -0.39 -0.09 1.96 0.00 0.00 0.00 179.25 181.65 1pvv h GLN 80 N 0.00 0.00 -0.01 0.00 1.08 -1.89 -3.07 115.11 111.22 1pvv h GLN 80 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1pvv h GLN 80 Cb 0.68 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.11 1pvv h GLN 80 CO -0.00 0.09 -0.48 -0.25 -0.95 0.00 0.00 178.83 177.25 1pvv n ASP 81 N -3.24 1.30 -4.98 1.46 8.00 0.30 -4.80 116.55 114.58 1pvv n ASP 81 Ca 0.00 -1.04 -0.20 0.00 0.71 0.00 0.00 54.79 54.27 1pvv n ASP 81 Cb 0.35 0.40 0.02 0.00 -0.02 0.00 0.00 41.12 41.86 1pvv n ASP 81 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1pvv s LEU 82 N -2.63 3.58 0.00 0.64 1.43 -1.15 -4.99 118.68 115.55 1pvv s LEU 82 Ca 0.18 -0.13 0.26 0.00 -1.03 0.00 0.00 54.13 53.41 1pvv s LEU 82 Cb 0.18 -2.83 1.45 0.00 0.03 0.00 0.00 46.19 45.03 1pvv s LEU 82 CO 0.61 -0.83 1.89 0.00 0.23 0.00 0.00 176.35 178.26 1pvv n GLN 83 N -2.02 0.64 -0.28 1.70 1.13 -1.26 -1.91 117.38 115.38 1pvv n GLN 83 Ca 0.06 0.02 0.05 0.00 -1.94 0.00 0.00 57.00 55.19 1pvv n GLN 83 Cb 0.59 -1.50 0.20 0.00 0.11 0.00 0.00 30.24 29.64 1pvv n GLN 83 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1pvv h LEU 84 N 0.00 0.52 -1.19 1.08 3.38 -1.80 -1.33 115.31 115.98 1pvv h LEU 84 Ca 0.00 0.08 0.10 0.00 0.09 0.00 0.00 57.88 58.15 1pvv h LEU 84 Cb 0.09 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.77 1pvv h LEU 84 CO 0.00 0.25 0.58 -0.09 0.09 0.00 0.00 178.44 179.27 1pvv h ARG 85 N 0.64 0.87 -0.67 1.13 1.12 -1.44 -1.22 114.38 114.80 1pvv h ARG 85 Ca 0.43 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 59.25 1pvv h ARG 85 Cb 0.55 -0.20 0.00 0.00 -0.01 0.00 0.00 29.97 30.32 1pvv h ARG 85 CO -0.33 0.57 0.00 0.54 -3.11 0.00 0.00 179.97 177.64 1pvv n ARG 86 N -4.53 3.99 0.00 0.20 5.12 -0.89 -4.93 116.66 115.61 1pvv n ARG 86 Ca 0.15 -2.45 0.00 0.00 -1.93 0.00 0.00 57.85 53.63 1pvv n ARG 86 Cb 0.31 -2.08 0.00 0.00 -1.16 0.00 0.00 32.46 29.54 1pvv n ARG 86 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1pvv n GLY 87 N 0.53 2.40 3.71 -0.13 0.00 -0.46 -5.07 105.19 106.17 1pvv n GLY 87 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1pvv n GLY 87 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1pvv n GLU 88 N -1.20 2.29 -1.76 1.61 2.13 -0.56 -4.92 120.64 118.24 1pvv n GLU 88 Ca 0.00 0.81 -0.33 0.00 0.66 0.00 0.00 57.16 58.30 1pvv n GLU 88 Cb 0.00 -2.49 0.05 0.00 0.27 0.00 0.00 31.44 29.27 1pvv n GLU 88 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 1pvv s THR 89 N -0.43 3.28 0.11 6.31 -4.23 -1.26 -4.43 115.64 114.99 1pvv s THR 89 Ca 0.62 0.59 -0.24 0.00 -1.18 0.00 0.00 61.69 61.48 1pvv s THR 89 Cb -0.57 -3.11 -0.08 0.00 1.34 0.00 0.00 72.50 70.07 1pvv s THR 89 CO 0.54 -0.37 1.69 0.40 -0.54 0.00 0.00 174.62 176.33 1pvv h ILE 90 N 0.02 0.69 -0.53 2.99 2.04 -1.98 -0.04 117.51 120.71 1pvv h ILE 90 Ca -0.47 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.50 1pvv h ILE 90 Cb 1.24 0.69 -0.10 0.00 -0.74 0.00 0.00 36.82 37.92 1pvv h ILE 90 CO 0.54 0.00 -0.15 0.00 0.00 0.00 0.00 178.15 178.55 1pvv h ALA 91 N 0.74 0.32 -0.34 1.87 0.00 -1.92 0.12 119.26 120.04 1pvv h ALA 91 Ca 0.04 0.20 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1pvv h ALA 91 Cb 0.26 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1pvv h ALA 91 CO -0.12 -0.45 -0.13 -0.44 0.00 0.00 0.00 179.25 178.11 1pvv h ASP 92 N -0.02 0.58 0.70 0.00 5.19 -1.88 -1.13 116.42 119.86 1pvv h ASP 92 Ca 0.25 -0.16 -0.19 0.00 -0.62 0.00 0.00 57.03 56.31 1pvv h ASP 92 Cb 0.40 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 39.74 1pvv h ASP 92 CO -0.55 0.74 -0.88 0.71 -3.12 0.00 0.00 179.24 176.14 1pvv h THR 93 N 0.55 1.55 -0.75 0.35 1.35 0.53 -1.09 112.91 115.38 1pvv h THR 93 Ca 0.10 -2.76 -0.02 0.00 -0.55 0.00 0.00 66.41 63.17 1pvv h THR 93 Cb 0.54 2.53 -0.03 0.00 -1.73 0.00 0.00 68.15 69.46 1pvv h THR 93 CO 0.03 0.80 0.37 0.00 -0.25 0.00 0.00 175.52 176.48 1pvv h ALA 94 N 1.03 0.96 -0.28 6.62 0.00 -0.65 0.28 119.26 127.23 1pvv h ALA 94 Ca -0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1pvv h ALA 94 Cb 1.52 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1pvv h ALA 94 CO 0.13 0.51 0.10 0.00 0.00 0.00 0.00 179.25 179.99 1pvv h ARG 95 N 1.05 0.42 -0.21 0.00 -0.00 -1.10 -1.33 114.38 113.21 1pvv h ARG 95 Ca 0.26 -0.08 -0.15 0.00 -0.50 0.00 0.00 59.98 59.51 1pvv h ARG 95 Cb 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 30.00 1pvv h ARG 95 CO -0.04 0.46 -0.44 -0.24 0.00 0.00 0.00 179.97 179.72 1pvv h VAL 96 N 0.30 1.32 -0.95 2.04 3.04 -1.00 -3.01 116.25 117.99 1pvv h VAL 96 Ca 0.09 -1.66 0.10 0.00 -1.01 0.00 0.00 66.70 64.22 1pvv h VAL 96 Cb 0.21 1.85 -0.07 0.00 -2.01 0.00 0.00 31.29 31.27 1pvv h VAL 96 CO -0.01 0.52 0.61 -0.07 -1.01 0.00 0.00 177.57 177.61 1pvv h LEU 97 N 0.35 0.88 -2.41 3.16 4.07 -0.91 0.21 115.31 120.67 1pvv h LEU 97 Ca 0.00 0.03 0.01 0.00 0.08 0.00 0.00 57.88 58.00 1pvv h LEU 97 Cb 1.05 -0.15 -0.00 0.00 1.08 0.00 0.00 40.66 42.63 1pvv h LEU 97 CO 0.10 0.51 0.19 0.28 -1.08 0.00 0.00 178.44 178.43 1pvv h SER 98 N 0.96 0.00 0.27 -0.43 0.02 -1.10 0.23 113.55 113.51 1pvv h SER 98 Ca 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 1pvv h SER 98 Cb 0.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1pvv h SER 98 CO -0.20 0.00 -0.31 0.54 -1.14 0.00 0.00 176.83 175.72 1pvv n ARG 99 N -3.10 0.70 -0.02 3.45 5.12 0.06 -4.48 116.66 118.40 1pvv n ARG 99 Ca -0.02 -0.42 -0.04 0.00 -1.93 0.00 0.00 57.85 55.45 1pvv n ARG 99 Cb 0.26 -1.49 -0.02 0.00 -1.16 0.00 0.00 32.46 30.05 1pvv n ARG 99 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1pvv n TYR 100 N -0.78 0.00 -3.71 -1.55 4.01 0.65 -5.10 117.16 110.68 1pvv n TYR 100 Ca 0.11 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.62 1pvv n TYR 100 Cb 0.35 -0.16 -0.02 0.00 -0.31 0.00 0.00 39.34 39.20 1pvv n TYR 100 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1pvv s VAL 101 N -2.08 2.18 -0.61 -0.72 -7.23 -0.18 -4.92 120.40 106.83 1pvv s VAL 101 Ca -0.06 -1.41 0.12 0.00 -1.81 0.00 0.00 61.98 58.83 1pvv s VAL 101 Cb 0.02 -2.59 -0.13 0.00 0.56 0.00 0.00 36.38 34.23 1pvv s VAL 101 CO 0.09 0.00 0.54 0.47 -0.31 0.00 0.00 175.10 175.89 1pvv n ASP 102 N -1.66 0.62 -3.65 4.85 8.00 -0.22 -4.75 116.55 119.74 1pvv n ASP 102 Ca 0.02 -0.81 -0.08 0.00 0.71 0.00 0.00 54.79 54.63 1pvv n ASP 102 Cb 0.63 0.98 -0.02 0.00 -0.02 0.00 0.00 41.12 42.69 1pvv n ASP 102 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pvv s ALA 103 N -2.17 -1.49 -0.03 2.24 0.00 -1.12 -4.22 121.76 114.97 1pvv s ALA 103 Ca 0.05 0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.21 1pvv s ALA 103 Cb 0.10 0.78 0.01 0.00 0.00 0.00 0.00 23.12 24.00 1pvv s ALA 103 CO 0.51 -0.91 -0.08 0.42 0.00 0.00 0.00 175.76 175.70 1pvv s ILE 104 N -3.67 0.76 -0.10 0.00 1.01 0.16 -1.21 121.20 118.15 1pvv s ILE 104 Ca 0.07 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.42 1pvv s ILE 104 Cb -0.03 -0.70 -0.01 0.00 0.01 0.00 0.00 42.46 41.73 1pvv s ILE 104 CO -0.02 0.25 -0.17 -0.32 0.00 0.00 0.00 174.94 174.68 1pvv s MET 105 N 0.40 3.06 -0.03 2.79 1.75 0.58 -0.64 119.30 127.21 1pvv s MET 105 Ca -0.06 -0.75 0.07 0.00 -1.25 0.00 0.00 55.69 53.69 1pvv s MET 105 Cb -0.11 -2.46 -0.01 0.00 2.84 0.00 0.00 34.83 35.09 1pvv s MET 105 CO 0.01 0.30 -0.23 0.00 -0.65 0.00 0.00 175.02 174.45 1pvv s ALA 106 N 0.09 1.99 -0.33 4.11 0.00 0.79 -0.08 121.76 128.32 1pvv s ALA 106 Ca -0.08 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 50.92 1pvv s ALA 106 Cb -0.15 -0.56 0.10 0.00 0.00 0.00 0.00 23.12 22.51 1pvv s ALA 106 CO 0.05 0.44 0.05 0.50 0.00 0.00 0.00 175.76 176.80 1pvv s ARG 107 N -0.36 1.40 0.14 0.00 6.06 0.36 0.55 118.95 127.10 1pvv s ARG 107 Ca 0.03 -1.70 0.04 0.00 -2.50 0.00 0.00 55.73 51.61 1pvv s ARG 107 Cb -0.11 -2.98 -0.04 0.00 0.06 0.00 0.00 34.95 31.88 1pvv s ARG 107 CO 0.01 -0.92 -0.10 0.54 -2.50 0.00 0.00 175.30 172.33 1pvv s VAL 108 N 1.04 1.10 0.00 7.11 0.11 -1.04 0.31 120.40 129.03 1pvv s VAL 108 Ca 0.09 -2.02 0.00 0.00 -2.93 0.00 0.00 61.98 57.12 1pvv s VAL 108 Cb -0.19 -1.80 0.00 0.00 -1.53 0.00 0.00 36.38 32.86 1pvv s VAL 108 CO -0.11 -0.75 0.09 -1.22 -3.33 0.00 0.00 175.10 169.78 1pvv n TYR 109 N -0.13 0.00 -2.72 1.54 4.02 -1.26 -4.12 117.16 114.49 1pvv n TYR 109 Ca -0.11 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.36 1pvv n TYR 109 Cb 0.60 -0.34 -0.03 0.00 -0.02 0.00 0.00 39.34 39.56 1pvv n TYR 109 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1pvv s ASP 110 N -2.33 7.06 0.44 7.72 2.15 -1.26 -0.71 116.67 129.74 1pvv s ASP 110 Ca 0.00 1.32 0.18 0.00 0.43 0.00 0.00 52.55 54.48 1pvv s ASP 110 Cb 0.00 -2.52 1.13 0.00 -0.30 0.00 0.00 42.92 41.23 1pvv s ASP 110 CO 0.00 -0.61 1.92 -0.74 -0.17 0.00 0.00 175.17 175.57 1pvv h HIS 111 N 7.45 0.41 0.00 -5.34 -0.00 -1.94 0.34 115.15 116.08 1pvv h HIS 111 Ca -0.21 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.17 1pvv h HIS 111 Cb 1.08 -0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 28.36 1pvv h HIS 111 CO 0.75 0.14 -0.00 -0.22 -0.00 0.00 0.00 177.93 178.60 1pvv h LYS 112 N 0.34 0.00 -0.34 5.26 3.64 -1.98 0.33 116.57 123.81 1pvv h LYS 112 Ca 0.38 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.68 1pvv h LYS 112 Cb 0.98 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.79 1pvv h LYS 112 CO -0.11 0.00 -0.09 -0.44 -2.27 0.00 0.00 179.45 176.55 1pvv h ASP 113 N 0.00 0.67 1.50 4.20 5.19 -0.70 -0.57 116.42 126.71 1pvv h ASP 113 Ca -0.00 -0.37 0.00 0.00 -0.62 0.00 0.00 57.03 56.04 1pvv h ASP 113 Cb 0.00 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.33 1pvv h ASP 113 CO 0.00 0.88 -0.31 1.62 -3.12 0.00 0.00 179.24 178.32 1pvv h VAL 114 N 0.45 0.00 -0.34 -1.35 3.04 -1.10 -1.95 116.25 115.00 1pvv h VAL 114 Ca 0.09 -0.81 -0.13 0.00 -1.01 0.00 0.00 66.70 64.84 1pvv h VAL 114 Cb 0.59 1.64 -0.01 0.00 -2.01 0.00 0.00 31.29 31.50 1pvv h VAL 114 CO 0.03 0.00 -0.31 -0.33 -1.01 0.00 0.00 177.57 175.96 1pvv h GLU 115 N 0.00 0.73 -0.51 4.17 5.08 -0.86 -1.83 114.58 121.36 1pvv h GLU 115 Ca 0.00 -0.33 -0.13 0.00 -1.00 0.00 0.00 59.36 57.90 1pvv h GLU 115 Cb 0.90 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 1pvv h GLU 115 CO 0.00 0.94 -0.17 -0.44 -1.00 0.00 0.00 179.01 178.34 1pvv h ASP 116 N 0.62 1.03 -0.31 1.42 3.32 -1.01 -0.89 116.42 120.60 1pvv h ASP 116 Ca 0.07 -0.37 0.06 0.00 0.02 0.00 0.00 57.03 56.81 1pvv h ASP 116 Cb 0.83 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 40.03 1pvv h ASP 116 CO 0.07 1.17 -0.09 -0.07 -1.72 0.00 0.00 179.24 178.60 1pvv h LEU 117 N 0.88 -0.33 -0.92 1.55 4.07 -1.27 -0.39 115.31 118.90 1pvv h LEU 117 Ca 0.12 0.10 -0.06 0.00 0.08 0.00 0.00 57.88 58.12 1pvv h LEU 117 Cb 0.75 0.21 -0.03 0.00 1.08 0.00 0.00 40.66 42.67 1pvv h LEU 117 CO 0.06 -0.12 0.11 0.00 -1.08 0.00 0.00 178.44 177.41 1pvv h ALA 118 N 1.28 1.12 -0.06 1.53 0.00 -0.97 0.00 119.26 122.17 1pvv h ALA 118 Ca 0.15 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1pvv h ALA 118 Cb 0.25 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1pvv h ALA 118 CO -0.33 0.58 0.03 -0.22 0.00 0.00 0.00 179.25 179.32 1pvv h LYS 119 N 0.86 0.08 0.00 0.00 3.64 -0.58 -3.22 116.57 117.34 1pvv h LYS 119 Ca 0.18 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1pvv h LYS 119 Cb 0.35 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1pvv h LYS 119 CO 0.00 0.12 -0.77 1.88 -2.27 0.00 0.00 179.45 178.41 1pvv h TYR 120 N 0.02 0.00 -3.66 1.91 0.05 -0.90 -3.47 116.97 110.92 1pvv h TYR 120 Ca 0.02 0.00 -0.50 0.00 0.05 0.00 0.00 58.73 58.30 1pvv h TYR 120 Cb 0.06 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 1pvv h TYR 120 CO -0.05 0.00 0.13 0.00 -1.05 0.00 0.00 178.16 177.19 1pvv s ALA 121 N -3.24 3.35 -1.73 3.88 0.00 -0.03 -4.25 121.76 119.74 1pvv s ALA 121 Ca 0.04 0.15 0.19 0.00 0.00 0.00 0.00 51.96 52.34 1pvv s ALA 121 Cb 0.12 -2.84 0.60 0.00 0.00 0.00 0.00 23.12 21.00 1pvv s ALA 121 CO 0.75 0.31 1.50 0.25 0.00 0.00 0.00 175.76 178.57 1pvv n THR 122 N 0.27 1.13 -4.49 0.00 -2.24 -1.26 -4.90 114.28 102.79 1pvv n THR 122 Ca 0.00 -0.93 -0.25 0.00 -2.27 0.00 0.00 64.05 60.60 1pvv n THR 122 Cb 0.52 0.31 -0.10 0.00 -2.10 0.00 0.00 70.33 68.96 1pvv n THR 122 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1pvv s VAL 123 N -1.36 2.36 0.44 2.28 -7.23 -1.26 -5.10 120.40 110.53 1pvv s VAL 123 Ca 0.44 -2.17 -0.25 0.00 -1.81 0.00 0.00 61.98 58.20 1pvv s VAL 123 Cb 0.25 -2.66 -0.08 0.00 0.56 0.00 0.00 36.38 34.45 1pvv s VAL 123 CO 0.27 -0.22 1.39 -2.84 -0.31 0.00 0.00 175.10 173.39 1pvv s PRO 124 N -3.63 3.73 -0.10 4.82 0.02 -1.26 -4.80 135.00 133.78 1pvv s PRO 124 Ca 0.33 2.33 0.04 0.00 0.02 0.00 0.00 61.00 63.72 1pvv s PRO 124 Cb 0.01 -2.65 0.00 0.00 0.02 0.00 0.00 34.50 31.88 1pvv s PRO 124 CO 0.17 -0.75 -0.24 0.08 -0.33 0.00 0.00 177.00 175.93 1pvv s VAL 125 N -1.23 2.05 -0.16 3.83 1.01 -1.26 -0.67 120.40 123.97 1pvv s VAL 125 Ca 0.61 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 1pvv s VAL 125 Cb -0.42 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 1pvv s VAL 125 CO 0.53 0.56 -0.13 -0.63 0.00 0.00 0.00 175.10 175.43 1pvv s ILE 126 N 0.34 2.91 -0.54 2.22 1.01 0.19 -1.11 121.20 126.21 1pvv s ILE 126 Ca -0.19 -0.69 -0.28 0.00 0.00 0.00 0.00 60.65 59.49 1pvv s ILE 126 Cb -0.18 -2.24 0.02 0.00 0.01 0.00 0.00 42.46 40.07 1pvv s ILE 126 CO 0.09 0.50 1.33 0.21 0.00 0.00 0.00 174.94 177.07 1pvv s ASN 127 N 0.76 6.28 0.00 3.58 2.47 0.45 -0.15 114.94 128.33 1pvv s ASN 127 Ca -0.05 0.31 0.28 0.00 0.42 0.00 0.00 52.86 53.82 1pvv s ASN 127 Cb -0.15 -2.55 1.11 0.00 -1.45 0.00 0.00 41.25 38.21 1pvv s ASN 127 CO 0.01 -1.58 1.79 0.61 -3.72 0.00 0.00 177.10 174.21 1pvv n GLY 128 N 5.15 -0.94 0.00 1.21 0.00 0.19 -4.50 105.19 106.29 1pvv n GLY 128 Ca 0.12 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1pvv n GLY 128 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1pvv n LEU 129 N -0.98 0.00 -4.30 0.99 0.00 -1.24 -4.89 117.00 106.59 1pvv n LEU 129 Ca 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 56.01 55.97 1pvv n LEU 129 Cb 0.30 0.00 -0.09 0.00 0.00 0.00 0.00 43.42 43.62 1pvv n LEU 129 CO 0.25 0.00 -0.19 -0.94 0.00 0.00 0.00 177.39 176.50 1pvv s SER 130 N 0.00 1.25 0.55 1.96 1.04 -0.62 -2.50 113.70 115.38 1pvv s SER 130 Ca 0.00 -1.55 0.32 0.00 0.48 0.00 0.00 55.95 55.20 1pvv s SER 130 Cb 0.00 0.41 1.54 0.00 0.10 0.00 0.00 66.02 68.07 1pvv s SER 130 CO 0.00 -0.90 2.07 -2.24 0.98 0.00 0.00 173.24 173.15 1pvv h ASP 131 N 2.29 0.00 0.33 7.02 2.03 -1.07 -3.20 116.42 123.82 1pvv h ASP 131 Ca -0.33 0.00 -0.32 0.00 -0.73 0.00 0.00 57.03 55.65 1pvv h ASP 131 Cb 1.25 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.71 1pvv h ASP 131 CO 0.50 0.08 -1.83 0.15 -1.03 0.00 0.00 179.24 177.11 1pvv h PHE 132 N 0.00 0.23 -3.03 4.15 3.57 -1.94 -3.34 116.94 116.59 1pvv h PHE 132 Ca -0.00 -0.17 0.01 0.00 3.53 0.00 0.00 57.97 61.34 1pvv h PHE 132 Cb 0.37 -0.01 -0.10 0.00 2.79 0.00 0.00 35.95 39.00 1pvv h PHE 132 CO 0.00 1.36 0.20 -1.54 -2.23 0.00 0.00 178.31 176.10 1pvv s SER 133 N -6.54 -0.45 -0.39 0.41 1.04 -1.21 -4.40 113.70 102.15 1pvv s SER 133 Ca -0.13 -0.22 0.09 0.00 0.48 0.00 0.00 55.95 56.17 1pvv s SER 133 Cb 0.07 0.63 0.27 0.00 0.10 0.00 0.00 66.02 67.10 1pvv s SER 133 CO 0.80 -1.09 0.61 1.57 0.98 0.00 0.00 173.24 176.12 1pvv n HIS 134 N -0.40 -0.53 -0.30 5.02 -0.00 -1.25 -1.59 115.22 116.18 1pvv n HIS 134 Ca -0.13 -3.45 -0.04 0.00 0.46 0.00 0.00 57.72 54.56 1pvv n HIS 134 Cb 0.63 -0.17 0.09 0.00 -0.12 0.00 0.00 29.99 30.42 1pvv n HIS 134 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1pvv h PRO 135 N 3.74 1.20 0.00 1.57 0.13 -1.83 -1.51 132.00 135.29 1pvv h PRO 135 Ca 0.06 -0.18 -0.04 0.00 -0.87 0.00 0.00 66.00 64.97 1pvv h PRO 135 Cb 0.92 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 1pvv h PRO 135 CO 0.45 0.92 -0.21 0.00 -0.23 0.00 0.00 178.00 178.93 1pvv h GLN 137 N 0.00 0.66 -0.84 0.00 5.75 -1.66 -2.27 115.11 116.75 1pvv h GLN 137 Ca -0.00 -0.29 -0.01 0.00 -0.15 0.00 0.00 58.65 58.20 1pvv h GLN 137 Cb 0.43 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.93 1pvv h GLN 137 CO 0.03 0.89 0.51 0.00 -2.65 0.00 0.00 178.83 177.60 1pvv h ALA 138 N 0.76 1.30 -0.28 3.38 0.00 -1.00 0.35 119.26 123.78 1pvv h ALA 138 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1pvv h ALA 138 Cb 0.69 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1pvv h ALA 138 CO 0.05 0.60 0.17 -0.07 0.00 0.00 0.00 179.25 180.00 1pvv h LEU 139 N 1.16 0.32 -1.03 0.00 3.38 -1.12 0.45 115.31 118.48 1pvv h LEU 139 Ca 0.30 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.25 1pvv h LEU 139 Cb -0.05 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 1pvv h LEU 139 CO -0.06 0.26 0.66 0.00 0.09 0.00 0.00 178.44 179.39 1pvv h ALA 140 N 1.08 1.29 -0.10 1.53 0.00 -0.93 0.12 119.26 122.25 1pvv h ALA 140 Ca 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1pvv h ALA 140 Cb -0.01 -0.40 -0.00 0.00 0.00 0.00 0.00 17.79 17.37 1pvv h ALA 140 CO -0.02 0.66 0.02 -0.44 0.00 0.00 0.00 179.25 179.46 1pvv h ASP 141 N 1.35 0.17 1.45 0.00 3.32 0.51 -1.60 116.42 121.61 1pvv h ASP 141 Ca 0.36 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1pvv h ASP 141 Cb -0.16 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1pvv h ASP 141 CO -0.08 0.39 0.00 1.88 -1.72 0.00 0.00 179.24 179.71 1pvv h TYR 142 N -0.06 0.00 -0.44 4.55 0.05 -0.85 -1.70 116.97 118.52 1pvv h TYR 142 Ca 0.03 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 1pvv h TYR 142 Cb 0.29 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 1pvv h TYR 142 CO 0.02 0.00 0.13 1.98 -1.05 0.00 0.00 178.16 179.24 1pvv h MET 143 N 0.00 0.69 -0.38 4.88 4.05 -0.53 -1.38 114.93 122.26 1pvv h MET 143 Ca 0.00 -0.15 -0.02 0.00 -0.28 0.00 0.00 59.70 59.24 1pvv h MET 143 Cb 0.73 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.41 1pvv h MET 143 CO 0.00 0.67 0.14 1.15 0.23 0.00 0.00 176.91 179.10 1pvv h THR 144 N 0.57 1.20 -0.38 -0.77 2.02 -0.83 0.13 112.91 114.86 1pvv h THR 144 Ca 0.14 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.70 1pvv h THR 144 Cb 0.27 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 1pvv h THR 144 CO -0.00 0.22 0.24 0.40 0.37 0.00 0.00 175.52 176.75 1pvv h ILE 145 N 0.46 1.11 -0.84 3.11 2.04 -1.33 0.13 117.51 122.20 1pvv h ILE 145 Ca 0.12 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.80 1pvv h ILE 145 Cb 0.21 0.59 -0.06 0.00 -0.74 0.00 0.00 36.82 36.82 1pvv h ILE 145 CO -0.01 0.11 0.53 -0.25 0.00 0.00 0.00 178.15 178.53 1pvv h TRP 146 N 0.50 0.98 -0.38 1.37 7.01 -0.87 0.12 115.95 124.69 1pvv h TRP 146 Ca 0.14 0.03 -0.08 0.00 2.11 0.00 0.00 58.89 61.08 1pvv h TRP 146 Cb -0.03 -0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 26.70 1pvv h TRP 146 CO -0.04 0.53 -0.09 0.93 -2.79 0.00 0.00 178.44 176.97 1pvv h GLU 147 N 0.99 0.73 0.04 2.65 5.08 -0.34 0.30 114.58 124.04 1pvv h GLU 147 Ca 0.35 -0.28 -0.24 0.00 -1.00 0.00 0.00 59.36 58.19 1pvv h GLU 147 Cb 0.10 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1pvv h GLU 147 CO -0.15 0.88 -1.16 0.87 -1.00 0.00 0.00 179.01 178.45 1pvv h LYS 148 N 0.53 0.09 0.00 2.33 6.56 -0.48 -3.35 116.57 122.26 1pvv h LYS 148 Ca 0.10 -0.16 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 1pvv h LYS 148 Cb 0.61 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.33 1pvv h LYS 148 CO 0.04 1.03 -0.85 1.63 -2.06 0.00 0.00 179.45 179.24 1pvv n LYS 149 N -3.39 1.12 -0.69 3.15 4.76 0.41 -4.97 118.16 118.55 1pvv n LYS 149 Ca -0.05 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.39 1pvv n LYS 149 Cb 0.98 -1.34 0.00 0.00 -1.84 0.00 0.00 35.03 32.83 1pvv n LYS 149 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1pvv n GLY 150 N 1.42 1.54 3.77 0.72 0.00 0.11 -4.93 105.19 107.81 1pvv n GLY 150 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 1pvv n GLY 150 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1pvv s THR 151 N -3.66 0.00 0.00 2.61 -1.32 -1.22 -4.98 115.64 107.07 1pvv s THR 151 Ca 0.00 -0.70 0.00 0.00 -1.21 0.00 0.00 61.69 59.78 1pvv s THR 151 Cb 0.00 -2.03 0.00 0.00 -1.51 0.00 0.00 72.50 68.96 1pvv s THR 151 CO 0.00 0.00 0.00 -0.38 -2.21 0.00 0.00 174.62 172.03 1pvv n ILE 152 N -0.48 0.00 -1.67 5.08 5.41 -1.26 -4.13 119.36 122.31 1pvv n ILE 152 Ca -0.06 0.00 -0.47 0.00 1.00 0.00 0.00 62.75 63.22 1pvv n ILE 152 Cb 0.60 -0.49 -0.04 0.00 -0.71 0.00 0.00 39.64 39.00 1pvv n ILE 152 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1pvv n LYS 153 N -2.24 2.11 -0.93 0.38 4.81 -1.25 -1.09 118.16 119.95 1pvv n LYS 153 Ca 0.00 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.21 1pvv n LYS 153 Cb 0.42 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 32.91 1pvv n LYS 153 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1pvv n GLY 154 N 3.73 0.59 3.84 3.14 0.00 -0.55 -4.93 105.19 111.01 1pvv n GLY 154 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1pvv n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pvv s VAL 155 N -2.59 4.66 -0.36 1.61 -7.23 -0.25 -4.63 120.40 111.60 1pvv s VAL 155 Ca 0.00 1.00 -0.15 0.00 -1.81 0.00 0.00 61.98 61.02 1pvv s VAL 155 Cb 0.00 -3.65 -0.00 0.00 0.56 0.00 0.00 36.38 33.29 1pvv s VAL 155 CO 0.00 -0.13 0.32 -0.75 -0.31 0.00 0.00 175.10 174.24 1pvv s LYS 156 N -2.83 3.37 -0.35 4.82 2.20 -1.26 -0.72 119.74 124.98 1pvv s LYS 156 Ca 0.52 -0.64 -0.05 0.00 -0.36 0.00 0.00 55.97 55.45 1pvv s LYS 156 Cb -0.11 -3.86 0.06 0.00 -1.51 0.00 0.00 37.83 32.41 1pvv s LYS 156 CO 0.18 -0.58 0.11 0.08 -0.36 0.00 0.00 175.35 174.77 1pvv s VAL 157 N 1.88 3.49 -0.20 4.02 1.01 -0.05 0.05 120.40 130.61 1pvv s VAL 157 Ca 0.09 -1.42 -0.02 0.00 0.00 0.00 0.00 61.98 60.63 1pvv s VAL 157 Cb -0.17 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1pvv s VAL 157 CO 0.11 -0.29 -0.11 -0.69 0.00 0.00 0.00 175.10 174.12 1pvv s VAL 158 N 1.31 2.87 -0.19 2.92 1.01 0.77 -2.07 120.40 127.01 1pvv s VAL 158 Ca -0.00 -0.67 -0.14 0.00 0.00 0.00 0.00 61.98 61.17 1pvv s VAL 158 Cb -0.21 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1pvv s VAL 158 CO 0.00 0.48 0.30 -0.47 0.00 0.00 0.00 175.10 175.41 1pvv s TYR 159 N 1.28 3.39 -0.06 5.22 5.04 0.27 -0.41 117.35 132.09 1pvv s TYR 159 Ca 0.03 0.52 0.05 0.00 -2.44 0.00 0.00 57.07 55.23 1pvv s TYR 159 Cb -0.14 -2.39 -0.01 0.00 0.35 0.00 0.00 41.96 39.77 1pvv s TYR 159 CO -0.06 0.11 -0.23 0.14 -1.34 0.00 0.00 175.55 174.17 1pvv s VAL 160 N 0.92 1.93 -3.09 3.14 -7.23 -0.32 -0.63 120.40 115.13 1pvv s VAL 160 Ca 0.15 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1pvv s VAL 160 Cb -0.14 -1.65 0.00 0.00 0.56 0.00 0.00 36.38 35.16 1pvv s VAL 160 CO 0.05 0.54 0.00 0.61 -0.31 0.00 0.00 175.10 175.99 1pvv n GLY 161 N 3.10 0.62 3.69 2.32 0.00 -0.25 -4.35 105.19 110.32 1pvv n GLY 161 Ca -0.18 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 1pvv n GLY 161 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pvv s ASP 162 N -4.00 7.22 -0.76 1.61 2.15 -1.26 -3.91 116.67 117.72 1pvv s ASP 162 Ca 0.00 1.58 -0.25 0.00 0.43 0.00 0.00 52.55 54.30 1pvv s ASP 162 Cb 0.00 -2.56 -0.21 0.00 -0.30 0.00 0.00 42.92 39.85 1pvv s ASP 162 CO 0.00 -0.46 1.89 0.61 -0.17 0.00 0.00 175.17 177.03 1pvv n GLY 163 N 3.13 1.03 0.00 2.66 0.00 -0.14 -4.75 105.19 107.11 1pvv n GLY 163 Ca 0.09 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1pvv n GLY 163 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1pvv n ASN 164 N 12.32 0.90 -0.13 1.61 0.23 -1.26 -4.00 115.26 124.93 1pvv n ASN 164 Ca 0.46 -0.17 -0.04 0.00 -0.53 0.00 0.00 54.58 54.30 1pvv n ASN 164 Cb 0.44 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.16 1pvv n ASN 164 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1pvv h ASN 165 N 0.00 -0.37 1.40 0.53 7.08 -1.77 0.78 115.58 123.23 1pvv h ASN 165 Ca 0.00 0.13 -0.02 0.00 -3.08 0.00 0.00 56.30 53.32 1pvv h ASN 165 Cb 0.00 0.25 -0.00 0.00 -2.08 0.00 0.00 38.32 36.49 1pvv h ASN 165 CO 0.00 -0.13 -0.11 -0.37 -2.08 0.00 0.00 177.43 174.74 1pvv h VAL 166 N 0.02 0.23 -0.48 6.14 -1.51 -1.90 -2.56 116.25 116.20 1pvv h VAL 166 Ca 0.21 -1.03 -0.13 0.00 -1.23 0.00 0.00 66.70 64.52 1pvv h VAL 166 Cb 0.32 1.85 -0.01 0.00 -2.13 0.00 0.00 31.29 31.32 1pvv h VAL 166 CO -0.43 0.11 -0.23 0.00 -1.23 0.00 0.00 177.57 175.79 1pvv h ALA 167 N 1.89 0.69 -0.22 5.19 0.00 -1.27 0.21 119.26 125.76 1pvv h ALA 167 Ca -0.00 -0.40 0.06 0.00 0.00 0.00 0.00 54.91 54.57 1pvv h ALA 167 Cb 0.84 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1pvv h ALA 167 CO 0.01 0.67 -0.20 0.45 0.00 0.00 0.00 179.25 180.19 1pvv h HIS 168 N 0.85 -0.53 -0.51 0.00 3.86 -0.59 0.80 115.15 119.03 1pvv h HIS 168 Ca 0.11 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.29 1pvv h HIS 168 Cb 0.80 0.27 -0.02 0.00 1.06 0.00 0.00 27.41 29.52 1pvv h HIS 168 CO 0.05 -0.28 0.09 0.77 0.86 0.00 0.00 177.93 179.42 1pvv h SER 169 N -0.22 0.81 -0.37 2.45 0.02 -1.37 0.16 113.55 115.03 1pvv h SER 169 Ca 0.13 -0.26 0.06 0.00 -0.84 0.00 0.00 61.79 60.88 1pvv h SER 169 Cb 0.41 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 62.68 1pvv h SER 169 CO -0.34 0.86 0.06 0.25 -1.14 0.00 0.00 176.83 176.52 1pvv h LEU 170 N 0.73 -0.01 0.11 5.07 6.46 -0.72 -1.00 115.31 125.94 1pvv h LEU 170 Ca 0.16 0.07 -0.00 0.00 -0.12 0.00 0.00 57.88 57.98 1pvv h LEU 170 Cb 0.39 0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 40.42 1pvv h LEU 170 CO 0.01 0.03 -0.07 0.24 -0.62 0.00 0.00 178.44 178.03 1pvv h MET 171 N 0.18 -0.17 -0.12 1.25 2.86 -0.34 -1.75 114.93 116.84 1pvv h MET 171 Ca 0.18 0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.81 1pvv h MET 171 Cb 0.22 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.91 1pvv h MET 171 CO -0.24 -0.11 -0.00 0.82 1.06 0.00 0.00 176.91 178.43 1pvv h ILE 172 N -0.18 1.25 -0.50 -1.22 1.08 -0.55 -1.52 117.51 115.88 1pvv h ILE 172 Ca -0.01 -0.82 -0.11 0.00 -0.39 0.00 0.00 64.86 63.53 1pvv h ILE 172 Cb 0.15 1.56 -0.02 0.00 -3.07 0.00 0.00 36.82 35.44 1pvv h ILE 172 CO 0.01 0.24 -0.10 0.00 -0.69 0.00 0.00 178.15 177.61 1pvv h ALA 173 N 0.75 0.68 -0.52 1.87 0.00 -1.26 -0.48 119.26 120.30 1pvv h ALA 173 Ca 0.03 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.62 1pvv h ALA 173 Cb 0.36 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1pvv h ALA 173 CO 0.01 0.58 0.32 0.78 0.00 0.00 0.00 179.25 180.94 1pvv h GLY 174 N 0.81 0.73 2.00 0.00 0.00 -1.28 -1.85 103.07 103.48 1pvv h GLY 174 Ca 0.13 -0.25 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 1pvv h GLY 174 CO 0.05 0.22 -0.50 -0.91 0.00 0.00 0.00 176.54 175.40 1pvv h THR 175 N 0.65 1.01 -0.25 4.70 1.35 -1.08 0.14 112.91 119.42 1pvv h THR 175 Ca 0.20 -1.98 -0.07 0.00 -0.55 0.00 0.00 66.41 64.01 1pvv h THR 175 Cb -0.02 2.19 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 1pvv h THR 175 CO -0.07 0.49 -0.15 0.11 -0.25 0.00 0.00 175.52 175.65 1pvv h LYS 176 N 0.00 0.42 -0.12 4.72 1.79 -0.60 -3.20 116.57 119.58 1pvv h LYS 176 Ca -0.00 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 1pvv h LYS 176 Cb 1.15 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1pvv h LYS 176 CO 0.06 0.57 0.00 1.28 -1.08 0.00 0.00 179.45 180.28 1pvv n LEU 177 N -4.20 2.00 0.00 2.94 4.77 -0.74 -4.59 117.00 117.18 1pvv n LEU 177 Ca 0.00 -0.76 0.00 0.00 -0.03 0.00 0.00 56.01 55.22 1pvv n LEU 177 Cb 0.33 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1pvv n LEU 177 CO 0.40 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 1pvv n GLY 178 N 1.22 0.53 3.91 -0.72 0.00 -0.95 -3.94 105.19 105.25 1pvv n GLY 178 Ca 0.17 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 1pvv n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pvv s ALA 179 N -2.00 3.01 -0.53 4.61 0.00 0.44 -1.48 121.76 125.80 1pvv s ALA 179 Ca 0.00 -0.71 -0.16 0.00 0.00 0.00 0.00 51.96 51.09 1pvv s ALA 179 Cb 0.00 -2.77 0.12 0.00 0.00 0.00 0.00 23.12 20.47 1pvv s ALA 179 CO 0.00 -1.28 0.50 -0.51 0.00 0.00 0.00 175.76 174.47 1pvv s ASP 180 N -4.47 6.18 -0.13 0.00 1.01 0.11 -1.31 116.67 118.06 1pvv s ASP 180 Ca 0.59 -1.67 -0.11 0.00 0.71 0.00 0.00 52.55 52.08 1pvv s ASP 180 Cb -0.11 -2.21 -0.05 0.00 1.01 0.00 0.00 42.92 41.56 1pvv s ASP 180 CO 0.47 -0.84 0.22 -0.69 0.21 0.00 0.00 175.17 174.54 1pvv s VAL 181 N 1.70 5.36 -0.02 -1.27 1.01 0.23 -0.87 120.40 126.54 1pvv s VAL 181 Ca 0.04 0.39 0.01 0.00 0.00 0.00 0.00 61.98 62.42 1pvv s VAL 181 Cb -0.28 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.58 1pvv s VAL 181 CO 0.04 0.52 -0.04 0.54 0.00 0.00 0.00 175.10 176.16 1pvv s VAL 182 N -0.39 0.36 -0.14 2.92 0.11 -0.88 -0.56 120.40 121.82 1pvv s VAL 182 Ca 0.15 -0.13 0.02 0.00 -2.93 0.00 0.00 61.98 59.09 1pvv s VAL 182 Cb -0.13 -0.35 0.01 0.00 -1.53 0.00 0.00 36.38 34.39 1pvv s VAL 182 CO 0.04 0.13 -0.20 -0.69 -3.33 0.00 0.00 175.10 171.06 1pvv s VAL 183 N 0.28 1.90 -0.17 2.04 1.01 -0.12 -0.57 120.40 124.76 1pvv s VAL 183 Ca -0.03 -0.87 -0.00 0.00 0.00 0.00 0.00 61.98 61.08 1pvv s VAL 183 Cb -0.06 -1.70 0.04 0.00 0.00 0.00 0.00 36.38 34.66 1pvv s VAL 183 CO -0.00 0.52 -0.06 0.00 0.00 0.00 0.00 175.10 175.55 1pvv s ALA 184 N 0.96 1.59 0.17 5.51 0.00 0.20 -1.95 121.76 128.24 1pvv s ALA 184 Ca -0.05 -0.91 0.10 0.00 0.00 0.00 0.00 51.96 51.11 1pvv s ALA 184 Cb -0.15 -1.15 -0.04 0.00 0.00 0.00 0.00 23.12 21.78 1pvv s ALA 184 CO -0.04 -0.78 -0.20 0.95 0.00 0.00 0.00 175.76 175.69 1pvv s THR 185 N 1.58 2.63 0.53 0.00 -4.23 -1.25 -1.10 115.64 113.80 1pvv s THR 185 Ca 0.00 -1.81 -0.20 0.00 -1.18 0.00 0.00 61.69 58.51 1pvv s THR 185 Cb -0.15 -2.25 -0.09 0.00 1.34 0.00 0.00 72.50 71.35 1pvv s THR 185 CO -0.08 -0.05 0.65 -2.65 -0.54 0.00 0.00 174.62 171.95 1pvv n PRO 186 N 0.39 0.68 -0.33 3.99 -0.02 -1.26 -4.60 135.00 133.86 1pvv n PRO 186 Ca -0.13 0.26 0.12 0.00 -2.02 0.00 0.00 63.50 61.73 1pvv n PRO 186 Cb 0.55 -1.77 0.34 0.00 -0.02 0.00 0.00 33.50 32.60 1pvv n PRO 186 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1pvv h GLU 187 N 0.55 0.74 -0.63 -0.52 4.39 -1.93 0.30 114.58 117.48 1pvv h GLU 187 Ca -0.45 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1pvv h GLU 187 Cb 1.39 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1pvv h GLU 187 CO 0.50 0.49 0.00 0.41 -1.16 0.00 0.00 179.01 179.25 1pvv n GLY 188 N -1.38 2.22 2.72 -3.84 0.00 -1.26 -4.58 105.19 99.07 1pvv n GLY 188 Ca 0.21 -0.70 -0.28 0.00 0.00 0.00 0.00 46.02 45.25 1pvv n GLY 188 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pvv n TYR 189 N 0.97 3.71 -3.58 1.61 4.02 0.11 -5.05 117.16 118.95 1pvv n TYR 189 Ca 0.21 -3.52 -0.20 0.00 -0.01 0.00 0.00 57.90 54.39 1pvv n TYR 189 Cb 0.73 -0.34 -0.01 0.00 -0.02 0.00 0.00 39.34 39.69 1pvv n TYR 189 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1pvv s GLU 190 N -3.55 2.99 0.82 -0.72 8.01 -1.26 -0.97 118.70 124.03 1pvv s GLU 190 Ca 0.48 -1.10 -0.12 0.00 0.01 0.00 0.00 54.97 54.24 1pvv s GLU 190 Cb 0.34 -2.71 0.09 0.00 -4.31 0.00 0.00 34.13 27.54 1pvv s GLU 190 CO -0.17 0.07 1.17 -1.25 0.01 0.00 0.00 175.26 175.09 1pvv s PRO 191 N -4.12 1.62 0.47 0.39 0.04 -1.26 -4.61 135.00 127.54 1pvv s PRO 191 Ca 0.44 1.61 -0.22 0.00 0.04 0.00 0.00 61.00 62.86 1pvv s PRO 191 Cb -0.08 -1.79 -0.10 0.00 0.04 0.00 0.00 34.50 32.57 1pvv s PRO 191 CO 0.30 -2.20 0.84 -0.25 0.04 0.00 0.00 177.00 175.73 1pvv n ASP 192 N -3.52 0.43 0.18 6.66 9.92 -1.26 -4.79 116.55 124.18 1pvv n ASP 192 Ca 0.12 0.93 0.06 0.00 -0.53 0.00 0.00 54.79 55.38 1pvv n ASP 192 Cb 0.51 -1.28 0.25 0.00 -0.64 0.00 0.00 41.12 39.96 1pvv n ASP 192 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 1pvv h GLU 193 N 1.05 0.00 -0.72 -1.24 4.57 -2.00 -1.60 114.58 114.64 1pvv h GLU 193 Ca -0.44 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.74 1pvv h GLU 193 Cb 1.36 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.92 1pvv h GLU 193 CO 0.53 0.35 0.46 -0.22 -1.18 0.00 0.00 179.01 178.95 1pvv h LYS 194 N 0.00 0.97 -0.16 1.92 3.64 -2.00 -2.20 116.57 118.74 1pvv h LYS 194 Ca -0.00 -0.07 -0.21 0.00 -1.27 0.00 0.00 60.65 59.09 1pvv h LYS 194 Cb 1.03 -0.21 0.01 0.00 -0.41 0.00 0.00 32.23 32.65 1pvv h LYS 194 CO 0.05 0.66 -0.75 0.28 -2.27 0.00 0.00 179.45 177.42 1pvv h VAL 195 N 0.98 1.29 -0.81 2.00 2.07 -1.82 -1.25 116.25 118.71 1pvv h VAL 195 Ca 0.26 -1.97 0.06 0.00 0.82 0.00 0.00 66.70 65.87 1pvv h VAL 195 Cb -0.07 1.96 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 1pvv h VAL 195 CO -0.05 0.62 0.50 0.40 0.02 0.00 0.00 177.57 179.06 1pvv h ILE 196 N 0.51 1.04 -0.12 4.57 2.04 -1.18 0.29 117.51 124.66 1pvv h ILE 196 Ca -0.04 -0.31 -0.22 0.00 1.00 0.00 0.00 64.86 65.29 1pvv h ILE 196 Cb 1.36 0.04 0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1pvv h ILE 196 CO 0.15 0.17 -0.79 0.50 0.00 0.00 0.00 178.15 178.18 1pvv h LYS 197 N 0.91 0.68 -0.41 2.37 3.64 -1.33 -0.70 116.57 121.73 1pvv h LYS 197 Ca 0.35 -0.57 0.08 0.00 -1.27 0.00 0.00 60.65 59.25 1pvv h LYS 197 Cb 0.16 0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 32.02 1pvv h LYS 197 CO -0.17 1.18 -0.12 -1.49 -2.27 0.00 0.00 179.45 176.58 1pvv h TRP 198 N 0.45 -0.27 -0.74 1.91 6.55 -0.85 0.18 115.95 123.18 1pvv h TRP 198 Ca -0.05 0.04 0.12 0.00 0.95 0.00 0.00 58.89 59.95 1pvv h TRP 198 Cb 1.40 0.18 -0.08 0.00 -0.86 0.00 0.00 29.16 29.80 1pvv h TRP 198 CO 0.08 -0.20 0.33 0.00 -1.05 0.00 0.00 178.44 177.60 1pvv h ALA 199 N 1.37 1.04 -0.19 1.49 0.00 -0.03 0.21 119.26 123.14 1pvv h ALA 199 Ca 0.20 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 1pvv h ALA 199 Cb 0.33 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1pvv h ALA 199 CO -0.44 -0.14 -0.14 0.93 0.00 0.00 0.00 179.25 179.47 1pvv h GLU 200 N 0.52 0.43 -0.72 0.00 5.08 0.21 -0.01 114.58 120.08 1pvv h GLU 200 Ca 0.39 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1pvv h GLU 200 Cb 0.52 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 1pvv h GLU 200 CO -0.34 0.76 0.41 1.96 -1.00 0.00 0.00 179.01 180.79 1pvv h GLN 201 N 0.11 1.00 -0.58 2.33 4.20 -0.45 -0.92 115.11 120.80 1pvv h GLN 201 Ca 0.04 -0.11 0.04 0.00 0.06 0.00 0.00 58.65 58.68 1pvv h GLN 201 Cb 0.66 -0.20 -0.04 0.00 0.30 0.00 0.00 27.48 28.19 1pvv h GLN 201 CO 0.04 0.73 0.33 -0.91 -0.67 0.00 0.00 178.83 178.35 1pvv h ASN 202 N 0.99 0.50 -0.11 1.46 2.35 -0.23 -1.36 115.58 119.18 1pvv h ASN 202 Ca 0.26 0.02 -0.15 0.00 -0.55 0.00 0.00 56.30 55.88 1pvv h ASN 202 Cb 0.02 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1pvv h ASN 202 CO -0.04 0.34 -0.43 0.00 -1.65 0.00 0.00 177.43 175.65 1pvv h ALA 203 N 1.28 0.75 -1.00 -0.83 0.00 -0.76 0.24 119.26 118.94 1pvv h ALA 203 Ca 0.25 -0.46 0.10 0.00 0.00 0.00 0.00 54.91 54.80 1pvv h ALA 203 Cb 0.10 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 17.71 1pvv h ALA 203 CO -0.14 0.66 0.63 0.00 0.00 0.00 0.00 179.25 180.40 1pvv h ALA 204 N 0.99 1.47 0.09 0.00 0.00 -0.67 0.52 119.26 121.65 1pvv h ALA 204 Ca 0.04 0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.66 1pvv h ALA 204 Cb 0.96 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1pvv h ALA 204 CO 0.09 0.29 -1.52 1.49 0.00 0.00 0.00 179.25 179.59 1pvv h GLU 205 N 1.04 0.19 0.00 0.00 4.81 -0.71 -3.34 114.58 116.57 1pvv h GLU 205 Ca 0.48 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1pvv h GLU 205 Cb 0.39 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1pvv h GLU 205 CO -0.24 1.01 -0.40 0.66 -0.73 0.00 0.00 179.01 179.32 1pvv h SER 206 N 0.05 0.00 -0.01 1.04 4.64 -0.28 -3.47 113.55 115.52 1pvv h SER 206 Ca -0.23 -0.13 -0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1pvv h SER 206 Cb 1.99 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 64.08 1pvv h SER 206 CO 0.14 0.07 -0.00 0.61 -0.87 0.00 0.00 176.83 176.77 1pvv n GLY 207 N 1.32 0.47 0.00 -0.77 0.00 0.17 -4.59 105.19 101.79 1pvv n GLY 207 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1pvv n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pvv n GLY 208 N -2.89 1.43 3.43 -0.02 0.00 -0.63 -4.93 105.19 101.58 1pvv n GLY 208 Ca -0.00 -1.81 -0.16 0.00 0.00 0.00 0.00 46.02 44.05 1pvv n GLY 208 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pvv s SER 209 N -1.00 -0.51 0.13 1.61 1.04 -0.43 -4.55 113.70 109.99 1pvv s SER 209 Ca 0.00 0.62 0.10 0.00 0.48 0.00 0.00 55.95 57.15 1pvv s SER 209 Cb 0.00 0.60 -0.04 0.00 0.10 0.00 0.00 66.02 66.68 1pvv s SER 209 CO 0.00 -0.48 -0.22 0.12 0.98 0.00 0.00 173.24 173.64 1pvv s PHE 210 N -0.94 2.43 -0.23 5.02 5.36 -1.25 0.75 117.98 129.13 1pvv s PHE 210 Ca -0.10 -0.32 -0.11 0.00 -0.96 0.00 0.00 56.93 55.45 1pvv s PHE 210 Cb -0.02 -1.29 0.08 0.00 -0.34 0.00 0.00 43.02 41.45 1pvv s PHE 210 CO 0.06 0.38 0.53 -2.00 -1.46 0.00 0.00 175.22 172.74 1pvv s GLU 211 N -2.16 0.50 -0.54 10.12 2.12 0.28 -4.94 118.70 124.07 1pvv s GLU 211 Ca 0.17 1.08 -0.07 0.00 0.36 0.00 0.00 54.97 56.51 1pvv s GLU 211 Cb -0.10 0.25 0.14 0.00 0.26 0.00 0.00 34.13 34.68 1pvv s GLU 211 CO 0.09 -0.18 0.39 -1.17 -0.54 0.00 0.00 175.26 173.84 1pvv s LEU 212 N 1.98 5.59 0.00 2.70 0.20 -1.26 -0.95 118.68 126.94 1pvv s LEU 212 Ca -0.07 -2.30 -0.00 0.00 0.69 0.00 0.00 54.13 52.44 1pvv s LEU 212 Cb -0.09 -1.95 0.08 0.00 -0.43 0.00 0.00 46.19 43.80 1pvv s LEU 212 CO -0.16 -0.56 0.55 0.18 -0.29 0.00 0.00 176.35 176.07 1pvv n LEU 213 N 4.32 0.00 0.00 -0.68 4.77 -0.82 -5.00 117.00 119.59 1pvv n LEU 213 Ca 0.00 -1.12 0.00 0.00 -0.03 0.00 0.00 56.01 54.86 1pvv n LEU 213 Cb 0.41 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1pvv n LEU 213 CO 0.37 -0.77 0.13 1.41 -1.33 0.00 0.00 177.39 177.19 1pvv n HIS 214 N -2.21 0.00 -3.84 -1.77 8.25 -1.26 -3.83 115.22 110.56 1pvv n HIS 214 Ca 0.09 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.20 1pvv n HIS 214 Cb 0.32 0.02 -0.13 0.00 1.12 0.00 0.00 29.99 31.32 1pvv n HIS 214 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1pvv s ASP 215 N 0.00 5.11 0.29 0.41 2.15 -1.26 -4.81 116.67 118.56 1pvv s ASP 215 Ca 0.00 -1.94 0.02 0.00 0.43 0.00 0.00 52.55 51.06 1pvv s ASP 215 Cb 0.00 -1.77 0.60 0.00 -0.30 0.00 0.00 42.92 41.45 1pvv s ASP 215 CO 0.00 -0.47 1.81 1.55 -0.17 0.00 0.00 175.17 177.89 1pvv h PRO 216 N 7.96 0.87 0.00 4.34 0.13 -1.90 0.36 132.00 143.76 1pvv h PRO 216 Ca -0.12 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 64.90 1pvv h PRO 216 Cb 1.04 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 1pvv h PRO 216 CO 0.64 0.57 -0.28 0.28 -0.23 0.00 0.00 178.00 178.99 1pvv h VAL 217 N 0.89 1.08 0.10 1.56 2.07 -1.93 -1.57 116.25 118.46 1pvv h VAL 217 Ca 0.52 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 1pvv h VAL 217 Cb 0.62 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1pvv h VAL 217 CO -0.31 0.27 -0.05 0.50 0.02 0.00 0.00 177.57 178.00 1pvv h LYS 218 N 0.00 -0.13 -0.56 1.57 3.64 -0.83 -3.33 116.57 116.92 1pvv h LYS 218 Ca -0.00 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1pvv h LYS 218 Cb 0.52 0.03 -0.11 0.00 -0.41 0.00 0.00 32.23 32.26 1pvv h LYS 218 CO 0.04 0.37 -0.32 0.00 -2.27 0.00 0.00 179.45 177.27 1pvv h ALA 219 N -0.03 -0.02 0.00 5.00 0.00 -0.59 -2.97 119.26 120.66 1pvv h ALA 219 Ca -0.01 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1pvv h ALA 219 Cb 0.56 0.74 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1pvv h ALA 219 CO 0.02 -0.66 0.00 1.33 0.00 0.00 0.00 179.25 179.94 1pvv n VAL 220 N -5.43 0.05 -1.76 0.00 0.24 -0.61 -4.80 118.33 106.01 1pvv n VAL 220 Ca 0.04 0.01 -0.42 0.00 -2.04 0.00 0.00 64.34 61.93 1pvv n VAL 220 Cb 0.35 -0.64 -0.03 0.00 -1.47 0.00 0.00 33.84 32.05 1pvv n VAL 220 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1pvv s LYS 221 N -2.10 4.15 -2.07 7.34 2.47 -1.13 -0.92 119.74 127.49 1pvv s LYS 221 Ca 0.33 2.52 0.00 0.00 -1.56 0.00 0.00 55.97 57.27 1pvv s LYS 221 Cb 0.16 -3.73 0.00 0.00 -1.46 0.00 0.00 37.83 32.80 1pvv s LYS 221 CO 0.29 -0.84 0.00 -0.25 0.16 0.00 0.00 175.35 174.70 1pvv n ASP 222 N 6.12 -5.60 -4.75 1.43 8.00 -0.90 -4.93 116.55 115.92 1pvv n ASP 222 Ca 0.18 0.36 -0.37 0.00 0.71 0.00 0.00 54.79 55.67 1pvv n ASP 222 Cb 0.39 -4.83 0.05 0.00 -0.02 0.00 0.00 41.12 36.71 1pvv n ASP 222 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pvv s ALA 223 N -2.84 2.55 -0.07 2.24 0.00 -0.09 -4.26 121.76 119.29 1pvv s ALA 223 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1pvv s ALA 223 Cb 0.00 -3.51 -0.26 0.00 0.00 0.00 0.00 23.12 19.36 1pvv s ALA 223 CO 0.00 -1.34 0.56 -0.44 0.00 0.00 0.00 175.76 174.54 1pvv h ASP 224 N 0.92 0.28 -4.10 0.00 3.32 -0.72 -2.15 116.42 113.98 1pvv h ASP 224 Ca -0.51 -0.56 -0.44 0.00 0.02 0.00 0.00 57.03 55.54 1pvv h ASP 224 Cb 1.31 -0.09 -0.29 0.00 0.22 0.00 0.00 39.33 40.48 1pvv h ASP 224 CO 0.55 1.50 -0.79 0.68 -1.72 0.00 0.00 179.24 179.46 1pvv s VAL 225 N -2.58 0.89 -0.15 -1.35 -7.23 -0.54 0.06 120.40 109.50 1pvv s VAL 225 Ca -0.14 -0.48 0.01 0.00 -1.81 0.00 0.00 61.98 59.56 1pvv s VAL 225 Cb 0.07 -0.75 0.00 0.00 0.56 0.00 0.00 36.38 36.26 1pvv s VAL 225 CO 0.81 0.25 -0.17 -0.63 -0.31 0.00 0.00 175.10 175.04 1pvv s ILE 226 N -0.24 2.50 -0.10 -0.62 1.01 -0.45 -0.16 121.20 123.13 1pvv s ILE 226 Ca 0.04 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 59.89 1pvv s ILE 226 Cb -0.05 -2.04 0.00 0.00 0.01 0.00 0.00 42.46 40.39 1pvv s ILE 226 CO -0.00 0.53 -0.22 -0.47 0.00 0.00 0.00 174.94 174.77 1pvv s TYR 227 N 0.75 2.45 0.34 3.97 6.14 0.46 -1.00 117.35 130.46 1pvv s TYR 227 Ca -0.07 -1.04 0.06 0.00 0.64 0.00 0.00 57.07 56.66 1pvv s TYR 227 Cb -0.16 -1.65 -0.02 0.00 0.42 0.00 0.00 41.96 40.55 1pvv s TYR 227 CO 0.01 -0.44 0.22 -2.37 0.64 0.00 0.00 175.55 173.61 1pvv n THR 228 N 3.67 0.00 -4.02 4.34 5.66 -0.99 -1.18 114.28 121.76 1pvv n THR 228 Ca -0.20 -2.30 -0.12 0.00 -3.05 0.00 0.00 64.05 58.38 1pvv n THR 228 Cb 0.53 1.04 -0.03 0.00 -1.55 0.00 0.00 70.33 70.31 1pvv n THR 228 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1pvv s ASP 229 N -3.27 0.48 0.52 1.09 2.15 -1.26 -4.01 116.67 112.37 1pvv s ASP 229 Ca 0.32 -1.27 -0.22 0.00 0.43 0.00 0.00 52.55 51.81 1pvv s ASP 229 Cb 0.02 0.67 -0.05 0.00 -0.30 0.00 0.00 42.92 43.25 1pvv s ASP 229 CO 0.22 -1.31 1.27 0.68 -0.17 0.00 0.00 175.17 175.86 1pvv s VAL 230 N -3.21 2.49 0.79 1.11 -7.23 -1.26 -4.78 120.40 108.31 1pvv s VAL 230 Ca 0.26 0.36 -0.11 0.00 -1.81 0.00 0.00 61.98 60.67 1pvv s VAL 230 Cb -0.01 -3.18 0.07 0.00 0.56 0.00 0.00 36.38 33.82 1pvv s VAL 230 CO 0.16 -0.01 1.12 0.26 -0.31 0.00 0.00 175.10 176.31 1pvv s TRP 231 N -1.42 2.28 -0.34 2.82 0.51 -1.26 -4.62 118.94 116.91 1pvv s TRP 231 Ca 0.70 1.62 -0.28 0.00 -2.12 0.00 0.00 56.10 56.02 1pvv s TRP 231 Cb -0.35 -3.19 -0.06 0.00 -0.81 0.00 0.00 33.47 29.06 1pvv s TRP 231 CO 0.41 -2.13 2.30 0.00 -0.51 0.00 0.00 176.95 177.03 1pvv n ALA 232 N -3.46 1.37 -0.19 0.98 0.00 -1.26 -4.78 120.51 113.17 1pvv n ALA 232 Ca 0.10 -0.50 0.04 0.00 0.00 0.00 0.00 53.44 53.09 1pvv n ALA 232 Cb 0.52 -3.00 0.31 0.00 0.00 0.00 0.00 19.45 17.28 1pvv n ALA 232 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1pvv h SER 233 N 16.59 0.74 -1.31 0.00 0.02 -2.01 -3.43 113.55 124.15 1pvv h SER 233 Ca -0.34 -0.01 -0.78 0.00 -0.84 0.00 0.00 61.79 59.83 1pvv h SER 233 Cb 1.26 -0.17 0.03 0.00 0.14 0.00 0.00 62.40 63.65 1pvv h SER 233 CO 1.04 0.51 0.62 0.23 -1.14 0.00 0.00 176.83 178.08 1pvv n MET 234 N -4.46 0.61 -1.42 3.45 2.81 -1.26 -0.00 117.12 116.85 1pvv n MET 234 Ca 0.09 0.22 0.00 0.00 -1.81 0.00 0.00 57.70 56.20 1pvv n MET 234 Cb 0.14 -1.81 0.00 0.00 -0.71 0.00 0.00 33.22 30.84 1pvv n MET 234 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1pvv n GLY 235 N 3.38 0.75 1.56 3.03 0.00 -1.26 -4.81 105.19 107.84 1pvv n GLY 235 Ca 0.25 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1pvv n GLY 235 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1pvv n GLN 236 N -1.20 0.00 -4.20 1.61 1.13 1.00 0.18 117.38 115.90 1pvv n GLN 236 Ca 0.00 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.74 1pvv n GLN 236 Cb 0.33 -0.52 -0.06 0.00 0.11 0.00 0.00 30.24 30.11 1pvv n GLN 236 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1pvv n GLU 237 N 2.20 -2.16 0.00 -1.09 4.71 -1.26 -4.83 120.64 118.21 1pvv n GLU 237 Ca 0.00 0.26 0.00 0.00 -0.01 0.00 0.00 57.16 57.41 1pvv n GLU 237 Cb 0.23 -4.34 0.00 0.00 -1.01 0.00 0.00 31.44 26.31 1pvv n GLU 237 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1pvv n ALA 238 N -4.42 0.00 -0.25 0.62 0.00 0.48 0.43 120.51 117.37 1pvv n ALA 238 Ca -0.19 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.31 1pvv n ALA 238 Cb 0.62 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.26 1pvv n ALA 238 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1pvv h GLU 239 N 0.00 0.25 0.00 0.00 4.57 -1.88 -3.43 114.58 114.09 1pvv h GLU 239 Ca 0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1pvv h GLU 239 Cb 0.00 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.53 1pvv h GLU 239 CO 0.00 0.17 0.00 0.00 -1.18 0.00 0.00 179.01 178.00 1pvv n ALA 240 N -2.68 0.00 0.00 2.92 0.00 0.17 -5.00 120.51 115.92 1pvv n ALA 240 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1pvv n ALA 240 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1pvv n ALA 240 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1pvv n GLU 241 N 0.00 0.00 0.06 0.00 2.13 -0.85 -4.98 120.64 117.00 1pvv n GLU 241 Ca 0.00 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.61 1pvv n GLU 241 Cb 0.00 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.60 1pvv n GLU 241 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1pvv h GLU 242 N 0.00 0.67 -0.88 5.31 4.57 -1.89 -3.07 114.58 119.29 1pvv h GLU 242 Ca 0.00 -0.79 0.07 0.00 -1.18 0.00 0.00 59.36 57.46 1pvv h GLU 242 Cb 0.00 0.24 -0.07 0.00 -0.16 0.00 0.00 28.75 28.77 1pvv h GLU 242 CO 0.00 1.35 0.54 -0.09 -1.18 0.00 0.00 179.01 179.63 1pvv h ARG 243 N 0.34 0.93 0.17 1.92 9.65 -1.86 -2.78 114.38 122.76 1pvv h ARG 243 Ca -0.16 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.66 1pvv h ARG 243 Cb 1.80 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 30.17 1pvv h ARG 243 CO 0.22 0.62 -0.08 -0.09 2.80 0.00 0.00 179.97 183.44 1pvv h ARG 244 N 0.96 -0.22 -0.03 0.20 2.43 -1.95 -2.72 114.38 113.06 1pvv h ARG 244 Ca 0.40 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.59 1pvv h ARG 244 Cb 0.23 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1pvv h ARG 244 CO -0.20 0.12 0.03 1.57 -1.51 0.00 0.00 179.97 179.99 1pvv h LYS 245 N -0.59 0.00 0.03 0.20 2.10 -1.40 1.02 116.57 117.93 1pvv h LYS 245 Ca -0.02 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.31 1pvv h LYS 245 Cb 0.44 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.73 1pvv h LYS 245 CO 0.04 0.00 -1.88 0.44 -2.00 0.00 0.00 179.45 176.05 1pvv n ILE 246 N -3.87 1.62 -0.03 0.07 -5.35 -1.07 -4.38 119.36 106.36 1pvv n ILE 246 Ca -0.02 -0.76 -0.09 0.00 -0.27 0.00 0.00 62.75 61.60 1pvv n ILE 246 Cb 0.12 -1.15 -0.14 0.00 -1.74 0.00 0.00 39.64 36.72 1pvv n ILE 246 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1pvv n PHE 247 N -3.12 0.91 -0.29 4.28 3.72 -0.96 -4.31 117.46 117.69 1pvv n PHE 247 Ca -0.23 0.32 0.14 0.00 -0.05 0.00 0.00 57.45 57.63 1pvv n PHE 247 Cb 1.06 -1.17 0.40 0.00 -0.94 0.00 0.00 39.48 38.84 1pvv n PHE 247 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1pvv h ARG 248 N 0.00 0.61 0.00 -1.08 9.65 0.88 0.83 114.38 125.28 1pvv h ARG 248 Ca -0.32 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.52 1pvv h ARG 248 Cb 2.04 -0.14 -0.00 0.00 -1.39 0.00 0.00 29.97 30.48 1pvv h ARG 248 CO 0.07 0.41 -0.02 -1.00 2.80 0.00 0.00 179.97 182.23 1pvv h PRO 249 N 0.63 0.00 -0.89 0.20 0.13 -1.78 -1.71 132.00 128.58 1pvv h PRO 249 Ca 0.49 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.54 1pvv h PRO 249 Cb 0.91 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.99 1pvv h PRO 249 CO -0.24 0.02 0.10 1.19 -0.23 0.00 0.00 178.00 178.84 1pvv n PHE 250 N -3.16 1.01 -2.92 1.56 3.01 0.29 -4.89 117.46 112.36 1pvv n PHE 250 Ca -0.01 -0.59 -0.40 0.00 1.01 0.00 0.00 57.45 57.46 1pvv n PHE 250 Cb 0.20 -0.37 -0.04 0.00 -0.01 0.00 0.00 39.48 39.25 1pvv n PHE 250 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 1pvv s GLN 251 N -1.58 4.51 -0.43 -1.08 0.74 -0.65 -4.63 119.66 116.54 1pvv s GLN 251 Ca 0.23 1.12 -0.28 0.00 0.05 0.00 0.00 55.36 56.47 1pvv s GLN 251 Cb 0.18 -3.41 0.03 0.00 1.10 0.00 0.00 33.01 30.90 1pvv s GLN 251 CO 0.06 0.13 1.08 0.08 -0.55 0.00 0.00 175.29 176.09 1pvv s VAL 252 N 0.48 4.34 0.26 1.34 1.01 0.23 -4.82 120.40 123.23 1pvv s VAL 252 Ca 0.42 1.28 0.04 0.00 0.00 0.00 0.00 61.98 63.73 1pvv s VAL 252 Cb -0.20 -4.52 -0.02 0.00 0.00 0.00 0.00 36.38 31.64 1pvv s VAL 252 CO 0.23 -0.83 0.16 -0.46 0.00 0.00 0.00 175.10 174.20 1pvv n ASN 253 N 7.46 0.18 0.28 3.32 0.23 -1.26 -2.80 115.26 122.67 1pvv n ASN 253 Ca 0.11 -2.54 0.14 0.00 -0.53 0.00 0.00 54.58 51.76 1pvv n ASN 253 Cb 0.48 0.99 0.81 0.00 -2.08 0.00 0.00 39.78 39.98 1pvv n ASN 253 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 1pvv h LYS 254 N 0.00 0.00 0.00 -3.83 6.56 -1.95 -0.46 116.57 116.90 1pvv h LYS 254 Ca -0.19 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.40 1pvv h LYS 254 Cb 0.85 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.51 1pvv h LYS 254 CO 0.29 0.06 -0.00 -0.44 -2.06 0.00 0.00 179.45 177.30 1pvv h ASP 255 N 0.00 -0.01 -0.78 0.86 3.32 -1.96 -2.22 116.42 115.63 1pvv h ASP 255 Ca -0.00 -0.80 0.14 0.00 0.02 0.00 0.00 57.03 56.39 1pvv h ASP 255 Cb 0.17 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.63 1pvv h ASP 255 CO 0.01 0.88 0.35 0.25 -1.72 0.00 0.00 179.24 179.01 1pvv h LEU 256 N -0.98 0.36 -1.45 1.55 5.85 -1.83 -0.80 115.31 118.01 1pvv h LEU 256 Ca -0.00 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 1pvv h LEU 256 Cb 0.80 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 1pvv h LEU 256 CO 0.00 0.14 -0.27 0.58 -0.34 0.00 0.00 178.44 178.55 1pvv h VAL 257 N 0.50 0.98 -0.96 1.05 2.07 -1.15 -2.91 116.25 115.82 1pvv h VAL 257 Ca 0.43 -1.00 0.24 0.00 0.82 0.00 0.00 66.70 67.19 1pvv h VAL 257 Cb 0.64 1.57 -0.13 0.00 -1.52 0.00 0.00 31.29 31.86 1pvv h VAL 257 CO -0.39 0.26 0.52 0.50 0.02 0.00 0.00 177.57 178.48 1pvv h LYS 258 N 0.00 0.48 0.00 1.57 3.64 -0.48 -1.95 116.57 119.83 1pvv h LYS 258 Ca -0.00 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1pvv h LYS 258 Cb 0.55 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1pvv h LYS 258 CO 0.04 0.32 -0.12 0.45 -2.27 0.00 0.00 179.45 177.87 1pvv h HIS 259 N 0.50 0.00 -4.39 1.91 3.86 -1.62 -3.46 115.15 111.95 1pvv h HIS 259 Ca 0.62 0.00 -0.46 0.00 -1.16 0.00 0.00 60.37 59.37 1pvv h HIS 259 Cb 1.20 0.00 0.12 0.00 1.06 0.00 0.00 27.41 29.79 1pvv h HIS 259 CO -0.05 0.12 0.39 0.00 0.86 0.00 0.00 177.93 179.25 1pvv s ALA 260 N -3.64 2.38 0.70 2.45 0.00 -0.73 -2.13 121.76 120.79 1pvv s ALA 260 Ca 0.01 -0.78 -0.16 0.00 0.00 0.00 0.00 51.96 51.03 1pvv s ALA 260 Cb 0.09 -2.92 -0.01 0.00 0.00 0.00 0.00 23.12 20.29 1pvv s ALA 260 CO 0.60 -2.00 0.94 1.63 0.00 0.00 0.00 175.76 176.93 1pvv n LYS 261 N -3.53 0.56 -0.12 0.00 5.02 -0.81 -4.68 118.16 114.60 1pvv n LYS 261 Ca 0.10 0.24 -0.00 0.00 -2.02 0.00 0.00 58.31 56.63 1pvv n LYS 261 Cb 0.60 -2.19 0.26 0.00 -0.02 0.00 0.00 35.03 33.68 1pvv n LYS 261 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1pvv h PRO 262 N -0.14 0.80 -0.82 1.97 0.11 -1.92 -2.16 132.00 129.85 1pvv h PRO 262 Ca -0.47 -0.10 -0.05 0.00 0.11 0.00 0.00 66.00 65.49 1pvv h PRO 262 Cb 1.34 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1pvv h PRO 262 CO 0.47 0.62 0.07 -0.40 -0.21 0.00 0.00 178.00 178.55 1pvv n ASP 263 N -4.36 3.50 -4.70 -2.05 5.75 -1.26 -4.96 116.55 108.47 1pvv n ASP 263 Ca 0.05 -2.56 -0.33 0.00 -0.01 0.00 0.00 54.79 51.94 1pvv n ASP 263 Cb 0.13 -0.62 0.13 0.00 -1.03 0.00 0.00 41.12 39.73 1pvv n ASP 263 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 1pvv s TYR 264 N -1.90 1.78 -0.23 2.11 1.13 -0.81 -5.00 117.35 114.43 1pvv s TYR 264 Ca 0.29 1.68 -0.08 0.00 -1.41 0.00 0.00 57.07 57.55 1pvv s TYR 264 Cb 0.23 -3.47 -0.04 0.00 -1.10 0.00 0.00 41.96 37.58 1pvv s TYR 264 CO 0.08 -2.85 0.10 -1.64 -2.51 0.00 0.00 175.55 168.73 1pvv s MET 265 N -4.19 3.88 -0.21 -3.49 -1.94 0.11 -4.83 119.30 108.63 1pvv s MET 265 Ca 0.72 -0.37 -0.22 0.00 -1.71 0.00 0.00 55.69 54.11 1pvv s MET 265 Cb -0.28 -3.37 -0.02 0.00 2.01 0.00 0.00 34.83 33.17 1pvv s MET 265 CO 0.51 0.02 0.68 0.12 -0.01 0.00 0.00 175.02 176.34 1pvv s PHE 266 N 1.11 3.36 0.15 -0.03 5.36 -0.47 -1.34 117.98 126.11 1pvv s PHE 266 Ca 0.05 0.97 0.11 0.00 -0.96 0.00 0.00 56.93 57.10 1pvv s PHE 266 Cb -0.14 -2.86 -0.04 0.00 -0.34 0.00 0.00 43.02 39.64 1pvv s PHE 266 CO 0.04 -0.24 -0.25 -1.64 -1.46 0.00 0.00 175.22 171.68 1pvv s MET 267 N 2.15 1.39 -0.27 10.12 -1.94 -0.17 -1.22 119.30 129.36 1pvv s MET 267 Ca 0.30 -1.38 -0.13 0.00 -1.71 0.00 0.00 55.69 52.77 1pvv s MET 267 Cb -0.16 -1.77 0.09 0.00 2.01 0.00 0.00 34.83 35.01 1pvv s MET 267 CO 0.10 0.40 0.63 -1.58 -0.01 0.00 0.00 175.02 174.56 1pvv s HIS 268 N -1.34 -1.08 -0.19 -0.03 2.46 -1.26 -2.34 115.29 111.51 1pvv s HIS 268 Ca 0.15 2.06 0.28 0.00 0.47 0.00 0.00 55.06 58.02 1pvv s HIS 268 Cb -0.09 0.62 1.24 0.00 -0.13 0.00 0.00 32.58 34.22 1pvv s HIS 268 CO 0.07 -0.54 1.83 0.00 -2.47 0.00 0.00 174.74 173.62 1pvv n LEU 270 N -2.52 -0.81 -4.78 0.00 4.77 -1.26 -4.98 117.00 107.42 1pvv n LEU 270 Ca 0.01 1.88 -0.35 0.00 -0.03 0.00 0.00 56.01 57.52 1pvv n LEU 270 Cb 0.20 -2.38 -0.01 0.00 -2.33 0.00 0.00 43.42 38.90 1pvv n LEU 270 CO 0.20 -1.66 0.75 -2.16 -1.33 0.00 0.00 177.39 173.19 1pvv s PRO 271 N -4.00 3.54 0.01 3.23 0.04 -1.26 -5.02 135.00 131.54 1pvv s PRO 271 Ca 0.00 1.50 -0.02 0.00 0.04 0.00 0.00 61.00 62.52 1pvv s PRO 271 Cb 0.00 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 1pvv s PRO 271 CO 0.00 -0.67 0.20 0.00 0.04 0.00 0.00 177.00 176.56 1pvv s ALA 272 N -1.87 3.97 -0.78 8.56 0.00 -1.26 -4.62 121.76 125.76 1pvv s ALA 272 Ca 0.70 -0.77 -0.15 0.00 0.00 0.00 0.00 51.96 51.74 1pvv s ALA 272 Cb -0.21 -1.88 0.19 0.00 0.00 0.00 0.00 23.12 21.22 1pvv s ALA 272 CO 0.24 0.77 0.76 -1.01 0.00 0.00 0.00 175.76 176.52 1pvv s HIS 273 N -1.38 3.56 0.39 0.00 3.76 -1.26 -5.05 115.29 115.30 1pvv s HIS 273 Ca 0.30 -1.75 -0.28 0.00 -0.15 0.00 0.00 55.06 53.19 1pvv s HIS 273 Cb -0.13 -3.88 -0.10 0.00 1.11 0.00 0.00 32.58 29.58 1pvv s HIS 273 CO 0.21 -1.07 1.46 1.03 -0.85 0.00 0.00 174.74 175.53 1pvv s ARG 274 N 0.83 4.04 0.00 1.40 0.52 -1.26 -1.45 118.95 123.03 1pvv s ARG 274 Ca 0.17 2.52 0.00 0.00 -0.52 0.00 0.00 55.73 57.89 1pvv s ARG 274 Cb -0.14 -2.91 0.00 0.00 0.52 0.00 0.00 34.95 32.42 1pvv s ARG 274 CO -0.06 -0.56 0.00 0.41 0.02 0.00 0.00 175.30 175.10 1pvv n GLY 275 N 0.50 1.44 0.00 -3.53 0.00 0.29 -4.93 105.19 98.96 1pvv n GLY 275 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1pvv n GLY 275 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pvv n GLU 276 N -2.00 0.00 0.32 1.61 1.02 -0.53 -4.81 120.64 116.25 1pvv n GLU 276 Ca 0.00 0.00 0.20 0.00 -0.02 0.00 0.00 57.16 57.34 1pvv n GLU 276 Cb 0.00 0.00 1.04 0.00 -0.02 0.00 0.00 31.44 32.46 1pvv n GLU 276 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1pvv h GLU 277 N 0.00 0.00 -3.02 3.49 9.09 -1.86 -3.43 114.58 118.84 1pvv h GLU 277 Ca 0.00 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 59.33 1pvv h GLU 277 Cb 0.00 0.00 -0.17 0.00 -1.65 0.00 0.00 28.75 26.93 1pvv h GLU 277 CO 0.00 0.01 -0.12 0.54 0.05 0.00 0.00 179.01 179.48 1pvv s VAL 278 N -4.05 0.06 0.15 -1.06 0.11 -1.26 -0.60 120.40 113.75 1pvv s VAL 278 Ca -0.03 -0.47 0.04 0.00 -2.93 0.00 0.00 61.98 58.59 1pvv s VAL 278 Cb 0.12 -0.92 -0.04 0.00 -1.53 0.00 0.00 36.38 34.01 1pvv s VAL 278 CO 0.46 -0.26 0.21 0.42 -3.33 0.00 0.00 175.10 172.61 1pvv s THR 279 N -2.33 4.93 0.27 5.04 -4.23 -1.12 -0.55 115.64 117.65 1pvv s THR 279 Ca -0.06 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 1pvv s THR 279 Cb -0.01 -3.53 0.25 0.00 1.34 0.00 0.00 72.50 70.56 1pvv s THR 279 CO -0.01 -0.10 1.78 0.44 -0.54 0.00 0.00 174.62 176.19 1pvv h ASP 280 N 2.28 0.63 0.29 3.99 3.32 -1.95 -1.42 116.42 123.56 1pvv h ASP 280 Ca -0.48 0.08 -0.04 0.00 0.02 0.00 0.00 57.03 56.61 1pvv h ASP 280 Cb 1.20 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 1pvv h ASP 280 CO 0.66 0.28 -0.21 0.44 -1.72 0.00 0.00 179.24 178.69 1pvv h ASP 281 N 0.71 0.00 0.00 6.45 5.19 -1.95 -0.04 116.42 126.79 1pvv h ASP 281 Ca 0.48 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.81 1pvv h ASP 281 Cb 0.64 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.14 1pvv h ASP 281 CO -0.34 0.21 -0.45 0.58 -3.12 0.00 0.00 179.24 176.12 1pvv h VAL 282 N 0.00 1.49 -0.49 -1.35 2.07 -1.59 -3.05 116.25 113.32 1pvv h VAL 282 Ca -0.00 -2.29 -0.09 0.00 0.82 0.00 0.00 66.70 65.14 1pvv h VAL 282 Cb 0.41 2.99 -0.02 0.00 -1.52 0.00 0.00 31.29 33.15 1pvv h VAL 282 CO 0.03 0.51 -0.04 -0.29 0.02 0.00 0.00 177.57 177.79 1pvv h ILE 283 N -0.99 1.25 -0.19 4.57 2.10 -1.31 0.24 117.51 123.19 1pvv h ILE 283 Ca -0.12 -1.11 0.00 0.00 1.08 0.00 0.00 64.86 64.71 1pvv h ILE 283 Cb 1.12 0.92 0.00 0.00 -1.09 0.00 0.00 36.82 37.77 1pvv h ILE 283 CO -0.07 0.39 0.00 0.47 -1.08 0.00 0.00 178.15 177.86 1pvv n ASP 284 N -4.18 1.05 -4.84 2.19 8.00 -0.04 -4.59 116.55 114.14 1pvv n ASP 284 Ca 0.02 -1.94 -0.32 0.00 0.71 0.00 0.00 54.79 53.26 1pvv n ASP 284 Cb 0.34 -0.12 -0.01 0.00 -0.02 0.00 0.00 41.12 41.31 1pvv n ASP 284 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1pvv s SER 285 N -1.08 6.28 0.59 -2.24 1.04 0.84 -4.93 113.70 114.21 1pvv s SER 285 Ca 0.16 1.59 0.29 0.00 0.48 0.00 0.00 55.95 58.47 1pvv s SER 285 Cb 0.08 -2.50 1.64 0.00 0.10 0.00 0.00 66.02 65.34 1pvv s SER 285 CO 0.11 -0.83 2.06 -0.65 0.98 0.00 0.00 173.24 174.92 1pvv h PRO 286 N 0.43 0.00 0.00 4.02 0.11 -1.88 0.16 132.00 134.83 1pvv h PRO 286 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1pvv h PRO 286 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1pvv h PRO 286 CO 0.60 0.00 -0.21 0.09 -0.21 0.00 0.00 178.00 178.27 1pvv n ASN 287 N -3.73 0.42 -4.75 -2.05 4.13 -1.26 -4.85 115.26 103.17 1pvv n ASN 287 Ca 0.02 0.29 -0.41 0.00 1.68 0.00 0.00 54.58 56.17 1pvv n ASN 287 Cb 0.38 -0.30 -0.04 0.00 -1.54 0.00 0.00 39.78 38.28 1pvv n ASN 287 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1pvv s SER 288 N -3.57 7.24 -0.16 6.41 0.15 0.04 -1.37 113.70 122.45 1pvv s SER 288 Ca 0.11 2.23 0.15 0.00 0.70 0.00 0.00 55.95 59.14 1pvv s SER 288 Cb 0.16 -2.62 0.34 0.00 -1.71 0.00 0.00 66.02 62.20 1pvv s SER 288 CO 0.61 -0.19 1.18 1.33 1.20 0.00 0.00 173.24 177.37 1pvv n VAL 289 N 1.61 1.88 0.22 4.45 0.24 -0.36 -4.84 118.33 121.53 1pvv n VAL 289 Ca 0.00 -2.57 0.06 0.00 -2.04 0.00 0.00 64.34 59.80 1pvv n VAL 289 Cb 0.45 -0.16 0.50 0.00 -1.47 0.00 0.00 33.84 33.16 1pvv n VAL 289 CO 0.00 0.00 0.00 -0.37 -2.14 0.00 0.00 176.83 174.32 1pvv h VAL 290 N 1.05 1.00 0.03 3.34 -1.51 -1.89 0.14 116.25 118.41 1pvv h VAL 290 Ca -0.01 -0.91 -0.19 0.00 -1.23 0.00 0.00 66.70 64.36 1pvv h VAL 290 Cb 1.05 1.51 0.02 0.00 -2.13 0.00 0.00 31.29 31.75 1pvv h VAL 290 CO 0.00 0.24 -0.76 -0.50 -1.23 0.00 0.00 177.57 175.32 1pvv h TRP 291 N 0.00 0.71 -0.95 5.19 -0.00 -1.93 -0.62 115.95 118.35 1pvv h TRP 291 Ca -0.00 -0.41 0.04 0.00 -0.00 0.00 0.00 58.89 58.51 1pvv h TRP 291 Cb 0.49 -0.07 -0.05 0.00 -0.00 0.00 0.00 29.16 29.53 1pvv h TRP 291 CO 0.00 1.24 0.62 -0.44 -0.00 0.00 0.00 178.44 179.87 1pvv h ASP 292 N -0.02 1.03 -0.51 -3.49 3.32 -1.88 0.05 116.42 114.92 1pvv h ASP 292 Ca -0.10 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.84 1pvv h ASP 292 Cb 1.48 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 1pvv h ASP 292 CO 0.15 0.71 -0.06 -0.61 -1.72 0.00 0.00 179.24 177.70 1pvv h GLN 293 N 1.20 0.94 -0.50 3.56 4.15 -0.95 -2.30 115.11 121.21 1pvv h GLN 293 Ca 0.38 -0.33 -0.12 0.00 0.77 0.00 0.00 58.65 59.35 1pvv h GLN 293 Cb 0.01 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 1pvv h GLN 293 CO -0.12 0.99 -0.16 0.00 -1.93 0.00 0.00 178.83 177.62 1pvv h ALA 294 N 0.92 0.77 -0.84 3.38 0.00 -0.66 -2.90 119.26 119.92 1pvv h ALA 294 Ca 0.14 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.74 1pvv h ALA 294 Cb 0.61 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1pvv h ALA 294 CO 0.04 0.67 0.52 1.49 0.00 0.00 0.00 179.25 181.96 1pvv h GLU 295 N 0.86 0.92 0.00 0.00 4.81 -0.84 -1.78 114.58 118.54 1pvv h GLU 295 Ca 0.12 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1pvv h GLU 295 Cb 0.72 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1pvv h GLU 295 CO 0.06 0.61 0.00 0.09 -0.73 0.00 0.00 179.01 179.03 1pvv n ASN 296 N -4.63 0.29 -0.30 1.04 3.02 -0.88 -1.18 115.26 112.61 1pvv n ASN 296 Ca 0.12 0.61 -0.05 0.00 -0.03 0.00 0.00 54.58 55.23 1pvv n ASN 296 Cb 0.18 -0.65 0.07 0.00 -0.61 0.00 0.00 39.78 38.76 1pvv n ASN 296 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1pvv h ARG 297 N 0.00 1.14 0.35 3.52 2.47 -1.32 -0.38 114.38 120.15 1pvv h ARG 297 Ca 0.00 -0.14 -0.02 0.00 -1.26 0.00 0.00 59.98 58.56 1pvv h ARG 297 Cb 0.11 -0.22 0.00 0.00 -1.65 0.00 0.00 29.97 28.22 1pvv h ARG 297 CO 0.00 0.86 -0.17 1.25 0.56 0.00 0.00 179.97 182.47 1pvv h LEU 298 N 1.13 -0.40 -0.52 3.04 5.85 -1.32 -1.41 115.31 121.69 1pvv h LEU 298 Ca 0.28 -0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.91 1pvv h LEU 298 Cb 0.06 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1pvv h LEU 298 CO -0.04 -0.23 0.08 0.45 -0.34 0.00 0.00 178.44 178.36 1pvv h HIS 299 N -0.54 0.92 -0.23 1.25 3.86 -1.57 0.09 115.15 118.94 1pvv h HIS 299 Ca -0.05 -0.13 -0.12 0.00 -1.16 0.00 0.00 60.37 58.91 1pvv h HIS 299 Cb 0.40 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 1pvv h HIS 299 CO -0.03 0.83 -0.37 0.00 0.86 0.00 0.00 177.93 179.21 1pvv h ALA 300 N 0.98 0.92 -0.02 2.45 0.00 -1.10 -2.22 119.26 120.28 1pvv h ALA 300 Ca 0.16 -0.42 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 1pvv h ALA 300 Cb 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1pvv h ALA 300 CO 0.01 0.62 -0.78 1.96 0.00 0.00 0.00 179.25 181.06 1pvv h GLN 301 N 0.43 0.17 -0.84 0.00 4.20 -1.08 -0.32 115.11 117.67 1pvv h GLN 301 Ca 0.04 -0.16 0.01 0.00 0.06 0.00 0.00 58.65 58.60 1pvv h GLN 301 Cb 0.85 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.63 1pvv h GLN 301 CO 0.07 0.87 0.56 0.87 -0.67 0.00 0.00 178.83 180.53 1pvv h LYS 302 N 0.11 1.10 0.06 1.46 1.57 -0.79 -0.25 116.57 119.82 1pvv h LYS 302 Ca -0.03 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1pvv h LYS 302 Cb 1.37 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.43 1pvv h LYS 302 CO 0.12 0.73 -0.03 0.00 -0.57 0.00 0.00 179.45 179.70 1pvv h ALA 303 N 1.31 -0.08 -0.25 3.86 0.00 -1.03 -1.70 119.26 121.37 1pvv h ALA 303 Ca 0.31 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.26 1pvv h ALA 303 Cb -0.12 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 1pvv h ALA 303 CO -0.07 -0.54 -0.19 0.28 0.00 0.00 0.00 179.25 178.73 1pvv h VAL 304 N -0.10 0.48 -0.31 0.00 2.07 -0.65 -0.97 116.25 116.77 1pvv h VAL 304 Ca -0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1pvv h VAL 304 Cb 0.08 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1pvv h VAL 304 CO 0.01 0.00 0.18 -0.07 0.02 0.00 0.00 177.57 177.71 1pvv h LEU 305 N -0.18 0.38 -1.10 2.57 3.38 -0.89 0.18 115.31 119.65 1pvv h LEU 305 Ca 0.14 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1pvv h LEU 305 Cb 0.40 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1pvv h LEU 305 CO -0.36 0.34 0.41 0.00 0.09 0.00 0.00 178.44 178.92 1pvv h ALA 306 N 1.06 1.31 0.04 1.53 0.00 -1.17 0.12 119.26 122.15 1pvv h ALA 306 Ca 0.11 -0.11 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 1pvv h ALA 306 Cb 0.04 -0.30 0.02 0.00 0.00 0.00 0.00 17.79 17.55 1pvv h ALA 306 CO -0.02 0.56 -1.08 -0.07 0.00 0.00 0.00 179.25 178.64 1pvv h LEU 307 N 1.04 0.80 0.00 0.00 3.38 -0.64 0.11 115.31 120.00 1pvv h LEU 307 Ca 0.26 -0.67 -0.09 0.00 0.09 0.00 0.00 57.88 57.47 1pvv h LEU 307 Cb 0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1pvv h LEU 307 CO -0.04 1.48 -0.97 -0.37 0.09 0.00 0.00 178.44 178.62 1pvv h VAL 308 N 0.31 0.40 0.00 1.22 -1.51 -0.51 -3.14 116.25 113.02 1pvv h VAL 308 Ca -0.13 -1.68 0.00 0.00 -1.23 0.00 0.00 66.70 63.65 1pvv h VAL 308 Cb 1.74 1.97 0.00 0.00 -2.13 0.00 0.00 31.29 32.87 1pvv h VAL 308 CO 0.20 0.23 -0.68 0.23 -1.23 0.00 0.00 177.57 176.32 1pvv n MET 309 N -2.93 2.57 -0.06 5.19 2.81 0.02 -1.16 117.12 123.56 1pvv n MET 309 Ca -0.03 -0.01 -0.20 0.00 -1.81 0.00 0.00 57.70 55.65 1pvv n MET 309 Cb 0.71 -1.12 -0.13 0.00 -0.71 0.00 0.00 33.22 31.97 1pvv n MET 309 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1pvv n GLY 310 N 1.34 -0.47 3.57 3.03 0.00 0.39 -4.54 105.19 108.50 1pvv n GLY 310 Ca 0.02 -0.23 -0.19 0.00 0.00 0.00 0.00 46.02 45.62 1pvv n GLY 310 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pvv n GLY 311 N 2.10 -0.16 3.87 -0.02 0.00 -1.22 -4.87 105.19 104.89 1pvv n GLY 311 Ca -0.38 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 1pvv n GLY 311 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pvv s ILE 312 N 15.65 5.20 0.00 -0.61 -4.36 -1.26 -4.55 121.20 131.27 1pvv s ILE 312 Ca 0.79 -0.32 0.00 0.00 -0.26 0.00 0.00 60.65 60.86 1pvv s ILE 312 Cb -0.02 -3.45 0.00 0.00 1.25 0.00 0.00 42.46 40.23 1pvv s ILE 312 CO 0.20 0.27 0.00 2.29 0.24 0.00 0.00 174.94 177.93