#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jvu s ASP 2 N 0.00 4.34 0.50 3.17 -4.77 -1.26 -5.04 116.67 113.62 3jvu s ASP 2 Ca 0.00 -1.34 0.28 0.00 -3.30 0.00 0.00 52.55 48.19 3jvu s ASP 2 Cb 0.00 0.10 1.30 0.00 -1.09 0.00 0.00 42.92 43.23 3jvu s ASP 2 CO 0.00 -0.79 1.99 -0.29 0.70 0.00 0.00 175.17 176.77 3jvu h ILE 3 N 1.24 0.45 0.66 2.11 2.10 -2.00 -2.93 117.51 119.14 3jvu h ILE 3 Ca -0.42 -0.72 -0.03 0.00 1.08 0.00 0.00 64.86 64.77 3jvu h ILE 3 Cb 1.29 1.51 0.01 0.00 -1.09 0.00 0.00 36.82 38.53 3jvu h ILE 3 CO 0.69 0.13 -0.32 0.74 -1.08 0.00 0.00 178.15 178.32 3jvu h THR 4 N 0.00 0.23 -0.86 2.19 2.02 -1.98 0.15 112.91 114.65 3jvu h THR 4 Ca -0.00 -0.25 0.17 0.00 0.77 0.00 0.00 66.41 67.09 3jvu h THR 4 Cb 0.50 0.29 -0.16 0.00 -1.74 0.00 0.00 68.15 67.03 3jvu h THR 4 CO 0.02 0.02 -0.24 -0.33 0.37 0.00 0.00 175.52 175.36 3jvu h GLU 5 N -1.08 -0.01 0.55 6.66 5.08 -1.94 0.51 114.58 124.35 3jvu h GLU 5 Ca -0.09 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 3jvu h GLU 5 Cb 0.71 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 3jvu h GLU 5 CO 0.15 -0.01 -0.47 -0.07 -1.00 0.00 0.00 179.01 177.61 3jvu h LEU 6 N -0.01 -1.26 -0.54 1.33 3.38 -1.45 0.37 115.31 117.14 3jvu h LEU 6 Ca 0.39 0.09 0.11 0.00 0.09 0.00 0.00 57.88 58.56 3jvu h LEU 6 Cb 0.62 0.40 -0.10 0.00 0.09 0.00 0.00 40.66 41.67 3jvu h LEU 6 CO -0.89 -0.65 -0.14 -0.07 0.09 0.00 0.00 178.44 176.79 3jvu h LEU 7 N -0.99 -0.52 -0.45 1.67 3.38 0.10 0.97 115.31 119.47 3jvu h LEU 7 Ca -0.07 0.16 0.09 0.00 0.09 0.00 0.00 57.88 58.15 3jvu h LEU 7 Cb 0.84 0.34 -0.08 0.00 0.09 0.00 0.00 40.66 41.85 3jvu h LEU 7 CO -0.01 -0.18 -0.06 0.00 0.09 0.00 0.00 178.44 178.27 3jvu h ALA 8 N 1.51 0.35 -0.72 1.53 0.00 0.15 -2.19 119.26 119.89 3jvu h ALA 8 Ca 0.26 0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.34 3jvu h ALA 8 Cb 0.40 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 3jvu h ALA 8 CO -0.56 -0.42 0.47 0.35 0.00 0.00 0.00 179.25 179.09 3jvu h PHE 9 N 0.05 0.88 -0.43 0.00 3.04 0.13 -0.84 116.94 119.78 3jvu h PHE 9 Ca 0.22 0.02 0.06 0.00 3.98 0.00 0.00 57.97 62.25 3jvu h PHE 9 Cb 0.33 -0.30 -0.09 0.00 2.56 0.00 0.00 35.95 38.46 3jvu h PHE 9 CO -0.34 0.54 -0.53 0.77 -2.02 0.00 0.00 178.31 176.72 3jvu h SER 10 N 0.94 -1.78 0.04 0.41 0.02 -0.36 -1.21 113.55 111.61 3jvu h SER 10 Ca 0.28 0.24 0.03 0.00 -0.84 0.00 0.00 61.79 61.50 3jvu h SER 10 Cb -0.06 0.74 -0.05 0.00 0.14 0.00 0.00 62.40 63.17 3jvu h SER 10 CO -0.08 -0.39 -0.34 0.00 -1.14 0.00 0.00 176.83 174.87 3jvu h ALA 11 N 0.09 -0.54 -0.03 3.77 0.00 -0.91 0.42 119.26 122.06 3jvu h ALA 11 Ca 0.09 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.98 3jvu h ALA 11 Cb 0.59 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 3jvu h ALA 11 CO -0.61 -0.87 0.39 -0.22 0.00 0.00 0.00 179.25 177.94 3jvu h LYS 12 N -0.52 0.00 -0.02 0.00 3.64 -0.77 0.68 116.57 119.58 3jvu h LYS 12 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3jvu h LYS 12 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 3jvu h LYS 12 CO -0.25 0.00 -0.28 1.04 -2.27 0.00 0.00 179.45 177.68 3jvu n GLN 13 N -2.90 1.42 -1.42 1.90 1.13 0.13 -4.93 117.38 112.72 3jvu n GLN 13 Ca -0.01 -1.10 -0.10 0.00 -1.94 0.00 0.00 57.00 53.85 3jvu n GLN 13 Cb 0.44 -1.48 -0.04 0.00 0.11 0.00 0.00 30.24 29.28 3jvu n GLN 13 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3jvu n GLY 14 N 1.37 0.98 3.75 1.08 0.00 0.24 -4.98 105.19 107.63 3jvu n GLY 14 Ca 0.12 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 3jvu n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jvu s ALA 15 N -2.39 3.60 -0.09 4.61 0.00 -0.38 -4.70 121.76 122.42 3jvu s ALA 15 Ca 0.00 1.34 0.14 0.00 0.00 0.00 0.00 51.96 53.45 3jvu s ALA 15 Cb 0.00 -3.55 -0.09 0.00 0.00 0.00 0.00 23.12 19.48 3jvu s ALA 15 CO 0.00 -0.75 1.07 0.66 0.00 0.00 0.00 175.76 176.74 3jvu h SER 16 N 4.59 0.00 -4.49 0.00 4.64 -0.92 -3.43 113.55 113.94 3jvu h SER 16 Ca -0.47 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.66 3jvu h SER 16 Cb 1.22 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 63.07 3jvu h SER 16 CO 0.75 0.65 -0.68 -1.81 -0.87 0.00 0.00 176.83 174.86 3jvu s ASP 17 N -6.16 0.12 -0.14 4.97 1.01 -1.21 -3.47 116.67 111.79 3jvu s ASP 17 Ca -0.00 -0.27 -0.03 0.00 0.71 0.00 0.00 52.55 52.96 3jvu s ASP 17 Cb 0.08 0.09 -0.03 0.00 1.01 0.00 0.00 42.92 44.07 3jvu s ASP 17 CO 0.79 -0.19 -0.04 -0.22 0.21 0.00 0.00 175.17 175.72 3jvu s LEU 18 N -0.88 3.23 -0.14 1.23 2.96 -0.84 -0.81 118.68 123.43 3jvu s LEU 18 Ca -0.10 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 3jvu s LEU 18 Cb -0.06 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.85 3jvu s LEU 18 CO -0.00 0.19 -0.14 -1.00 -1.32 0.00 0.00 176.35 174.08 3jvu s HIS 19 N 0.22 2.80 -0.17 5.38 3.76 0.15 -0.58 115.29 126.85 3jvu s HIS 19 Ca -0.03 -0.77 -0.03 0.00 -0.15 0.00 0.00 55.06 54.09 3jvu s HIS 19 Cb -0.14 -1.86 -0.02 0.00 1.11 0.00 0.00 32.58 31.67 3jvu s HIS 19 CO 0.03 -0.30 -0.06 -0.51 -0.85 0.00 0.00 174.74 173.05 3jvu s LEU 20 N 0.50 3.03 -0.16 0.89 1.02 0.47 -1.85 118.68 122.58 3jvu s LEU 20 Ca -0.09 -0.25 -0.04 0.00 0.02 0.00 0.00 54.13 53.77 3jvu s LEU 20 Cb -0.16 -1.73 0.06 0.00 0.02 0.00 0.00 46.19 44.39 3jvu s LEU 20 CO 0.04 0.12 0.13 -0.55 0.02 0.00 0.00 176.35 176.11 3jvu s SER 21 N 0.66 1.82 -0.40 2.29 0.15 -1.26 -1.13 113.70 115.82 3jvu s SER 21 Ca -0.03 -0.35 -0.44 0.00 0.70 0.00 0.00 55.95 55.82 3jvu s SER 21 Cb -0.15 -0.02 -0.19 0.00 -1.71 0.00 0.00 66.02 63.96 3jvu s SER 21 CO 0.02 -0.32 1.61 0.00 1.20 0.00 0.00 173.24 175.75 3jvu n ALA 22 N 5.30 -1.11 0.00 5.45 0.00 0.10 -0.66 120.51 129.59 3jvu n ALA 22 Ca -0.06 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3jvu n ALA 22 Cb 0.49 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.94 3jvu n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jvu n GLY 23 N 3.92 1.27 3.02 0.00 0.00 0.22 -4.47 105.19 109.15 3jvu n GLY 23 Ca 0.29 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.22 3jvu n GLY 23 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jvu s LEU 24 N 0.00 2.30 0.77 0.99 1.43 0.16 -4.70 118.68 119.62 3jvu s LEU 24 Ca 0.00 -0.61 -0.15 0.00 -1.03 0.00 0.00 54.13 52.34 3jvu s LEU 24 Cb 0.00 0.07 0.05 0.00 0.03 0.00 0.00 46.19 46.34 3jvu s LEU 24 CO 0.00 -0.34 1.17 -0.81 0.23 0.00 0.00 176.35 176.60 3jvu n PRO 25 N 1.26 0.40 -1.59 1.29 -0.04 -1.26 -2.18 135.00 132.88 3jvu n PRO 25 Ca -0.22 0.21 -0.41 0.00 -0.04 0.00 0.00 63.50 63.04 3jvu n PRO 25 Cb 0.56 -2.42 0.02 0.00 -0.04 0.00 0.00 33.50 31.62 3jvu n PRO 25 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3jvu n PRO 26 N -2.78 1.21 -4.12 0.54 -0.04 -1.26 -4.73 135.00 123.81 3jvu n PRO 26 Ca 0.14 0.44 -0.13 0.00 -0.04 0.00 0.00 63.50 63.91 3jvu n PRO 26 Cb 0.50 -2.00 -0.11 0.00 -0.04 0.00 0.00 33.50 31.85 3jvu n PRO 26 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3jvu s MET 27 N -2.05 0.70 0.11 0.54 -1.94 -0.77 -0.04 119.30 115.84 3jvu s MET 27 Ca 0.65 -1.02 0.08 0.00 -1.71 0.00 0.00 55.69 53.69 3jvu s MET 27 Cb -0.54 -0.36 -0.04 0.00 2.01 0.00 0.00 34.83 35.90 3jvu s MET 27 CO 0.56 0.05 -0.20 0.96 -0.01 0.00 0.00 175.02 176.37 3jvu s ILE 28 N -2.22 1.71 -0.23 2.53 -4.36 -0.64 0.34 121.20 118.34 3jvu s ILE 28 Ca -0.00 -1.58 -0.14 0.00 -0.26 0.00 0.00 60.65 58.67 3jvu s ILE 28 Cb -0.04 -1.58 -0.04 0.00 1.25 0.00 0.00 42.46 42.05 3jvu s ILE 28 CO -0.01 -0.09 0.33 -0.60 0.24 0.00 0.00 174.94 174.81 3jvu s ARG 29 N -2.00 4.11 -0.04 0.37 3.52 0.01 -0.53 118.95 124.40 3jvu s ARG 29 Ca 0.07 0.04 0.02 0.00 -0.13 0.00 0.00 55.73 55.73 3jvu s ARG 29 Cb -0.10 -3.56 0.01 0.00 -1.56 0.00 0.00 34.95 29.75 3jvu s ARG 29 CO 0.04 -0.06 -0.07 0.08 -0.81 0.00 0.00 175.30 174.49 3jvu s VAL 30 N 1.40 0.66 -1.17 7.11 1.01 0.28 -0.20 120.40 129.49 3jvu s VAL 30 Ca 0.15 -0.24 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 3jvu s VAL 30 Cb -0.15 -0.64 0.06 0.00 0.00 0.00 0.00 36.38 35.65 3jvu s VAL 30 CO 0.07 0.24 0.36 0.47 0.00 0.00 0.00 175.10 176.24 3jvu n ASP 31 N 3.73 -3.56 0.00 3.32 8.00 -1.26 -1.05 116.55 125.73 3jvu n ASP 31 Ca -0.23 -0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.04 3jvu n ASP 31 Cb 0.52 -2.98 0.00 0.00 -0.02 0.00 0.00 41.12 38.65 3jvu n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3jvu n GLY 32 N -1.06 3.17 3.88 0.44 0.00 -1.26 -5.03 105.19 105.33 3jvu n GLY 32 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 3jvu n GLY 32 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3jvu s ASP 33 N -1.11 6.61 -0.18 1.61 1.11 -0.21 -5.01 116.67 119.48 3jvu s ASP 33 Ca 0.00 0.87 -0.04 0.00 0.18 0.00 0.00 52.55 53.57 3jvu s ASP 33 Cb 0.00 -2.21 -0.02 0.00 1.07 0.00 0.00 42.92 41.76 3jvu s ASP 33 CO 0.00 -0.05 -0.04 -0.69 1.18 0.00 0.00 175.17 175.57 3jvu s VAL 34 N -1.78 3.62 -0.06 -1.27 1.01 -1.26 1.00 120.40 121.65 3jvu s VAL 34 Ca 0.46 -0.43 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 3jvu s VAL 34 Cb -0.11 -2.61 0.02 0.00 0.00 0.00 0.00 36.38 33.67 3jvu s VAL 34 CO 0.22 0.46 0.19 -0.13 0.00 0.00 0.00 175.10 175.83 3jvu s ARG 35 N 0.89 0.25 0.39 2.72 0.52 0.31 -4.93 118.95 119.11 3jvu s ARG 35 Ca -0.01 0.20 -0.27 0.00 -0.52 0.00 0.00 55.73 55.14 3jvu s ARG 35 Cb -0.15 0.12 -0.09 0.00 0.52 0.00 0.00 34.95 35.35 3jvu s ARG 35 CO 0.01 -0.04 1.33 1.03 0.02 0.00 0.00 175.30 177.66 3jvu s ARG 36 N -0.04 4.02 0.44 3.54 0.52 -1.26 -1.62 118.95 124.55 3jvu s ARG 36 Ca -0.01 2.22 -0.15 0.00 -0.52 0.00 0.00 55.73 57.27 3jvu s ARG 36 Cb -0.02 -2.82 -0.08 0.00 0.52 0.00 0.00 34.95 32.55 3jvu s ARG 36 CO 0.00 -0.47 0.88 0.42 0.02 0.00 0.00 175.30 176.16 3jvu s ILE 37 N -1.22 4.60 -1.14 1.52 1.01 0.94 -4.89 121.20 122.01 3jvu s ILE 37 Ca 0.55 1.07 -0.16 0.00 0.00 0.00 0.00 60.65 62.11 3jvu s ILE 37 Cb -0.40 -3.68 -0.06 0.00 0.01 0.00 0.00 42.46 38.33 3jvu s ILE 37 CO 0.51 -0.50 2.14 -3.20 0.00 0.00 0.00 174.94 173.90 3jvu n ASN 38 N -1.14 3.73 -4.10 3.58 5.15 -1.26 -4.76 115.26 116.46 3jvu n ASN 38 Ca 0.05 -2.71 -0.08 0.00 -0.60 0.00 0.00 54.58 51.24 3jvu n ASN 38 Cb 0.54 -1.37 -0.10 0.00 -0.53 0.00 0.00 39.78 38.31 3jvu n ASN 38 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3jvu s LEU 39 N 1.44 2.48 0.63 1.20 1.43 -1.26 -5.15 118.68 119.45 3jvu s LEU 39 Ca 0.52 -0.96 -0.17 0.00 -1.03 0.00 0.00 54.13 52.49 3jvu s LEU 39 Cb 0.14 0.12 -0.01 0.00 0.03 0.00 0.00 46.19 46.46 3jvu s LEU 39 CO 0.00 -0.54 1.18 -2.84 0.23 0.00 0.00 176.35 174.39 3jvu s PRO 40 N -3.71 2.77 0.55 1.29 0.02 -1.26 -4.62 135.00 130.04 3jvu s PRO 40 Ca 0.07 1.71 -0.22 0.00 0.02 0.00 0.00 61.00 62.58 3jvu s PRO 40 Cb 0.06 -1.92 -0.05 0.00 0.02 0.00 0.00 34.50 32.61 3jvu s PRO 40 CO -0.08 -1.33 1.34 -2.30 -0.33 0.00 0.00 177.00 174.29 3jvu n PRO 41 N -1.99 1.65 -3.36 5.54 -0.02 -1.26 -4.30 135.00 131.26 3jvu n PRO 41 Ca 0.13 0.61 -0.41 0.00 -2.02 0.00 0.00 63.50 61.81 3jvu n PRO 41 Cb 0.50 -2.55 -0.09 0.00 -0.02 0.00 0.00 33.50 31.35 3jvu n PRO 41 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3jvu s LEU 42 N -3.31 4.33 0.85 2.45 1.43 -0.93 -4.74 118.68 118.77 3jvu s LEU 42 Ca 0.72 -0.08 -0.11 0.00 -1.03 0.00 0.00 54.13 53.63 3jvu s LEU 42 Cb -0.42 -2.41 0.10 0.00 0.03 0.00 0.00 46.19 43.49 3jvu s LEU 42 CO 0.49 -0.34 1.11 -1.61 0.23 0.00 0.00 176.35 176.23 3jvu s GLU 43 N 2.12 1.60 0.11 1.70 2.02 -1.26 0.71 118.70 125.70 3jvu s GLU 43 Ca 0.14 1.25 -0.31 0.00 0.02 0.00 0.00 54.97 56.08 3jvu s GLU 43 Cb -0.16 -1.82 -0.11 0.00 0.10 0.00 0.00 34.13 32.14 3jvu s GLU 43 CO 0.12 -2.13 1.50 1.25 0.02 0.00 0.00 175.26 176.02 3jvu h HIS 44 N -1.49 -1.52 -0.94 1.61 -0.00 -1.90 -1.61 115.15 109.30 3jvu h HIS 44 Ca -0.45 0.06 0.17 0.00 -0.00 0.00 0.00 60.37 60.16 3jvu h HIS 44 Cb 1.25 0.69 -0.17 0.00 -0.00 0.00 0.00 27.41 29.19 3jvu h HIS 44 CO 0.52 -0.48 -0.30 1.63 -0.00 0.00 0.00 177.93 179.30 3jvu n LYS 45 N -5.16 -0.15 0.38 5.26 5.02 -1.26 -1.29 118.16 120.96 3jvu n LYS 45 Ca -0.05 1.46 -0.18 0.00 -2.02 0.00 0.00 58.31 57.53 3jvu n LYS 45 Cb 0.33 -2.18 -0.09 0.00 -0.02 0.00 0.00 35.03 33.07 3jvu n LYS 45 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 3jvu h GLN 46 N 0.00 -0.93 -0.69 1.97 4.20 -1.66 0.21 115.11 118.20 3jvu h GLN 46 Ca 0.39 0.06 0.02 0.00 0.06 0.00 0.00 58.65 59.18 3jvu h GLN 46 Cb 0.63 0.21 -0.04 0.00 0.30 0.00 0.00 27.48 28.58 3jvu h GLN 46 CO -0.96 -0.62 0.44 -0.39 -0.67 0.00 0.00 178.83 176.64 3jvu h VAL 47 N -0.97 1.13 -0.75 -0.54 -1.51 -0.97 0.33 116.25 112.97 3jvu h VAL 47 Ca -0.09 -0.30 -0.03 0.00 -1.23 0.00 0.00 66.70 65.05 3jvu h VAL 47 Cb 0.76 0.17 -0.04 0.00 -2.13 0.00 0.00 31.29 30.05 3jvu h VAL 47 CO 0.13 0.16 0.36 -0.74 -1.23 0.00 0.00 177.57 176.26 3jvu h HIS 48 N 0.89 1.05 0.00 5.19 -0.00 -0.94 0.12 115.15 121.47 3jvu h HIS 48 Ca 0.26 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.59 3jvu h HIS 48 Cb -0.04 -0.33 0.00 0.00 -0.00 0.00 0.00 27.41 27.04 3jvu h HIS 48 CO -0.03 0.76 0.00 0.00 -0.00 0.00 0.00 177.93 178.66 3jvu n ALA 49 N -2.43 -0.39 -0.27 5.26 0.00 0.70 -1.37 120.51 122.02 3jvu n ALA 49 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.63 3jvu n ALA 49 Cb 0.13 0.10 0.23 0.00 0.00 0.00 0.00 19.45 19.92 3jvu n ALA 49 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3jvu n LEU 50 N -2.17 -0.08 0.30 0.00 4.77 0.10 -1.06 117.00 118.86 3jvu n LEU 50 Ca 0.00 1.33 -0.12 0.00 -0.03 0.00 0.00 56.01 57.19 3jvu n LEU 50 Cb 0.00 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.55 3jvu n LEU 50 CO 0.00 -1.35 0.39 0.40 -1.33 0.00 0.00 177.39 175.50 3jvu h ILE 51 N 0.00 0.00 -0.78 -0.08 2.04 -0.65 -3.15 117.51 114.89 3jvu h ILE 51 Ca 0.48 -0.22 0.16 0.00 1.00 0.00 0.00 64.86 66.28 3jvu h ILE 51 Cb 0.99 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 3jvu h ILE 51 CO -0.73 0.00 0.52 1.88 0.00 0.00 0.00 178.15 179.82 3jvu h TYR 52 N -1.01 0.48 -0.14 1.37 0.05 -0.19 0.22 116.97 117.75 3jvu h TYR 52 Ca -0.08 0.01 0.04 0.00 0.05 0.00 0.00 58.73 58.75 3jvu h TYR 52 Cb 0.61 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.19 3jvu h TYR 52 CO 0.03 0.17 0.35 -0.44 -1.05 0.00 0.00 178.16 177.22 3jvu h ASP 53 N 0.40 0.00 -0.08 3.88 3.32 -1.05 0.01 116.42 122.91 3jvu h ASP 53 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3jvu h ASP 53 Cb 0.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.47 3jvu h ASP 53 CO -0.12 0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.70 3jvu n ILE 54 N -3.21 0.41 -3.57 0.35 -5.35 0.76 -5.02 119.36 103.74 3jvu n ILE 54 Ca 0.01 -0.71 -0.19 0.00 -0.27 0.00 0.00 62.75 61.59 3jvu n ILE 54 Cb 0.44 0.86 -0.01 0.00 -1.74 0.00 0.00 39.64 39.19 3jvu n ILE 54 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 3jvu s MET 55 N -0.69 3.17 0.54 6.28 -1.94 -0.01 -5.06 119.30 121.59 3jvu s MET 55 Ca 0.09 -0.97 0.05 0.00 -1.71 0.00 0.00 55.69 53.15 3jvu s MET 55 Cb 0.05 -2.83 0.03 0.00 2.01 0.00 0.00 34.83 34.10 3jvu s MET 55 CO 0.07 0.13 0.39 0.54 -0.01 0.00 0.00 175.02 176.15 3jvu s ASN 56 N -4.13 4.62 0.03 3.03 2.20 -1.26 -4.90 114.94 114.53 3jvu s ASN 56 Ca 0.43 -1.24 -0.09 0.00 -0.94 0.00 0.00 52.86 51.01 3jvu s ASN 56 Cb -0.09 0.39 -0.03 0.00 -2.00 0.00 0.00 41.25 39.51 3jvu s ASN 56 CO 0.31 -1.08 1.15 0.44 -2.94 0.00 0.00 177.10 174.97 3jvu h ASP 57 N 0.78 -0.50 -0.57 3.54 5.19 -1.98 0.36 116.42 123.24 3jvu h ASP 57 Ca -0.37 0.06 0.05 0.00 -0.62 0.00 0.00 57.03 56.15 3jvu h ASP 57 Cb 1.30 0.20 -0.07 0.00 0.18 0.00 0.00 39.33 40.95 3jvu h ASP 57 CO 0.58 -0.11 -0.34 1.17 -3.12 0.00 0.00 179.24 177.42 3jvu n LYS 58 N -3.41 -0.25 -0.18 3.56 4.81 -1.26 0.16 118.16 121.58 3jvu n LYS 58 Ca -0.01 1.25 -0.01 0.00 -0.87 0.00 0.00 58.31 58.67 3jvu n LYS 58 Cb 0.09 -1.85 0.08 0.00 0.02 0.00 0.00 35.03 33.37 3jvu n LYS 58 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 3jvu h GLN 59 N 0.00 0.10 -0.78 1.64 4.20 -1.79 0.32 115.11 118.80 3jvu h GLN 59 Ca 0.09 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.84 3jvu h GLN 59 Cb 0.23 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 3jvu h GLN 59 CO -0.54 0.06 0.49 0.00 -0.67 0.00 0.00 178.83 178.18 3jvu h ARG 60 N 0.10 0.91 -0.18 1.46 3.08 0.34 -0.52 114.38 119.57 3jvu h ARG 60 Ca 0.28 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.27 3jvu h ARG 60 Cb 0.44 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 3jvu h ARG 60 CO -0.49 0.60 0.08 0.87 -1.07 0.00 0.00 179.97 179.97 3jvu h LYS 61 N 0.94 0.26 0.56 0.04 1.57 0.49 -2.07 116.57 118.36 3jvu h LYS 61 Ca 0.32 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 3jvu h LYS 61 Cb 0.06 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 3jvu h LYS 61 CO -0.13 0.30 -0.35 -0.44 -0.57 0.00 0.00 179.45 178.27 3jvu h ASP 62 N 0.15 -0.88 -0.97 0.86 3.32 -0.45 0.18 116.42 118.63 3jvu h ASP 62 Ca 0.06 0.05 0.26 0.00 0.02 0.00 0.00 57.03 57.42 3jvu h ASP 62 Cb 0.13 0.26 -0.18 0.00 0.22 0.00 0.00 39.33 39.76 3jvu h ASP 62 CO -0.01 -0.53 0.01 0.33 -1.72 0.00 0.00 179.24 177.32 3jvu n PHE 63 N -4.56 0.61 -0.07 4.55 -0.00 -0.22 0.12 117.46 117.89 3jvu n PHE 63 Ca -0.10 1.17 -0.12 0.00 -0.00 0.00 0.00 57.45 58.40 3jvu n PHE 63 Cb 0.35 -1.22 -0.05 0.00 -0.00 0.00 0.00 39.48 38.56 3jvu n PHE 63 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 3jvu h GLU 64 N 0.00 0.38 -0.04 -4.13 4.39 -1.15 0.12 114.58 114.15 3jvu h GLU 64 Ca 0.58 -0.13 -0.14 0.00 0.34 0.00 0.00 59.36 60.01 3jvu h GLU 64 Cb 1.19 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.82 3jvu h GLU 64 CO -0.91 0.60 -0.52 0.93 -1.16 0.00 0.00 179.01 177.94 3jvu h GLU 65 N 0.13 0.43 -0.14 2.33 5.08 0.41 -3.35 114.58 119.47 3jvu h GLU 65 Ca 0.06 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 3jvu h GLU 65 Cb 0.44 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3jvu h GLU 65 CO 0.01 1.06 0.00 1.19 -1.00 0.00 0.00 179.01 180.27 3jvu n PHE 66 N -4.26 0.31 -0.35 4.33 3.72 0.33 -4.96 117.46 116.59 3jvu n PHE 66 Ca -0.09 -0.70 0.00 0.00 -0.05 0.00 0.00 57.45 56.60 3jvu n PHE 66 Cb 0.62 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 3jvu n PHE 66 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3jvu n LEU 67 N -0.49 0.69 -3.46 4.37 4.77 0.43 -4.80 117.00 118.51 3jvu n LEU 67 Ca 0.11 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.95 3jvu n LEU 67 Cb 0.53 -1.19 -0.04 0.00 -2.33 0.00 0.00 43.42 40.39 3jvu n LEU 67 CO 0.05 -0.35 0.41 -1.83 -1.33 0.00 0.00 177.39 174.35 3jvu s GLU 68 N -0.69 1.19 0.03 3.23 -1.05 -1.22 -3.42 118.70 116.77 3jvu s GLU 68 Ca 0.00 -0.17 -0.27 0.00 -0.15 0.00 0.00 54.97 54.37 3jvu s GLU 68 Cb 0.00 0.55 0.09 0.00 -0.44 0.00 0.00 34.13 34.33 3jvu s GLU 68 CO 0.00 -0.46 0.79 -0.08 0.95 0.00 0.00 175.26 176.46 3jvu s THR 69 N -2.70 0.00 0.17 1.83 -1.32 -0.66 -4.27 115.64 108.69 3jvu s THR 69 Ca -0.04 0.00 0.11 0.00 -1.21 0.00 0.00 61.69 60.55 3jvu s THR 69 Cb -0.01 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.94 3jvu s THR 69 CO -0.04 0.00 -0.24 -1.81 -2.21 0.00 0.00 174.62 170.32 3jvu s ASP 70 N -2.32 3.31 -0.08 8.08 1.01 -1.26 -1.21 116.67 124.20 3jvu s ASP 70 Ca 0.02 -0.82 -0.32 0.00 0.71 0.00 0.00 52.55 52.13 3jvu s ASP 70 Cb -0.01 -0.23 0.12 0.00 1.01 0.00 0.00 42.92 43.81 3jvu s ASP 70 CO -0.08 0.13 1.14 0.72 0.21 0.00 0.00 175.17 177.29 3jvu s PHE 71 N -1.49 -0.15 0.26 4.23 -0.12 0.51 -4.96 117.98 116.26 3jvu s PHE 71 Ca 0.18 0.05 0.06 0.00 -0.05 0.00 0.00 56.93 57.17 3jvu s PHE 71 Cb -0.08 0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 42.81 3jvu s PHE 71 CO 0.08 -0.34 0.29 -1.54 -0.05 0.00 0.00 175.22 173.66 3jvu s SER 72 N -2.49 5.82 -0.16 1.98 1.04 -1.26 0.14 113.70 118.77 3jvu s SER 72 Ca 0.10 -0.16 -0.11 0.00 0.48 0.00 0.00 55.95 56.26 3jvu s SER 72 Cb 0.00 -1.50 0.05 0.00 0.10 0.00 0.00 66.02 64.67 3jvu s SER 72 CO -0.05 -0.12 0.39 0.12 0.98 0.00 0.00 173.24 174.57 3jvu s PHE 73 N -2.10 -0.52 -0.08 5.02 5.36 -0.20 -4.89 117.98 120.57 3jvu s PHE 73 Ca 0.35 1.17 0.01 0.00 -0.96 0.00 0.00 56.93 57.50 3jvu s PHE 73 Cb -0.08 0.21 -0.02 0.00 -0.34 0.00 0.00 43.02 42.78 3jvu s PHE 73 CO 0.27 -0.29 -0.11 -2.00 -1.46 0.00 0.00 175.22 171.64 3jvu s GLU 74 N 0.95 2.90 -0.44 10.12 2.12 -1.26 0.67 118.70 133.76 3jvu s GLU 74 Ca -0.06 -0.64 -0.13 0.00 0.36 0.00 0.00 54.97 54.51 3jvu s GLU 74 Cb -0.06 -2.55 0.06 0.00 0.26 0.00 0.00 34.13 31.84 3jvu s GLU 74 CO -0.08 0.50 0.32 0.08 -0.54 0.00 0.00 175.26 175.54 3jvu s VAL 75 N -0.38 4.85 0.09 3.70 1.01 0.12 -4.98 120.40 124.80 3jvu s VAL 75 Ca 0.05 -1.09 -0.19 0.00 0.00 0.00 0.00 61.98 60.75 3jvu s VAL 75 Cb -0.12 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 3jvu s VAL 75 CO 0.02 -0.48 1.32 1.55 0.00 0.00 0.00 175.10 177.51 3jvu h PRO 76 N 8.59 -0.02 0.00 2.72 0.13 -1.98 0.29 132.00 141.73 3jvu h PRO 76 Ca -0.26 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.78 3jvu h PRO 76 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 3jvu h PRO 76 CO 0.80 -0.01 -0.42 0.78 -0.23 0.00 0.00 178.00 178.92 3jvu h GLY 77 N -0.02 0.00 0.00 1.56 0.00 -2.06 -3.42 103.07 99.13 3jvu h GLY 77 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3jvu h GLY 77 CO -0.54 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 175.38 3jvu n VAL 78 N -3.43 0.00 -3.63 4.60 0.31 0.88 -5.11 118.33 111.95 3jvu n VAL 78 Ca 0.00 0.45 0.01 0.00 -0.01 0.00 0.00 64.34 64.80 3jvu n VAL 78 Cb 0.57 -1.43 -0.01 0.00 -0.91 0.00 0.00 33.84 32.07 3jvu n VAL 78 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3jvu s ALA 79 N -3.16 -2.20 0.20 3.52 0.00 -0.35 -5.01 121.76 114.76 3jvu s ALA 79 Ca 0.00 0.65 -0.02 0.00 0.00 0.00 0.00 51.96 52.59 3jvu s ALA 79 Cb 0.00 0.38 -0.05 0.00 0.00 0.00 0.00 23.12 23.45 3jvu s ALA 79 CO 0.00 -1.05 0.40 1.03 0.00 0.00 0.00 175.76 176.14 3jvu s ARG 80 N -2.49 3.55 0.10 0.00 0.52 -1.26 0.10 118.95 119.47 3jvu s ARG 80 Ca 0.14 -0.26 0.04 0.00 -0.52 0.00 0.00 55.73 55.12 3jvu s ARG 80 Cb 0.04 -2.82 -0.04 0.00 0.52 0.00 0.00 34.95 32.65 3jvu s ARG 80 CO -0.03 0.40 -0.10 -0.06 0.02 0.00 0.00 175.30 175.52 3jvu s PHE 81 N -1.85 1.05 -0.35 -0.53 0.08 0.21 0.68 117.98 117.28 3jvu s PHE 81 Ca 0.39 -0.68 -0.11 0.00 0.12 0.00 0.00 56.93 56.65 3jvu s PHE 81 Cb -0.11 -0.58 0.01 0.00 -0.57 0.00 0.00 43.02 41.78 3jvu s PHE 81 CO 0.28 -0.01 0.19 1.03 -0.10 0.00 0.00 175.22 176.62 3jvu s ARG 82 N -2.93 3.04 -0.23 0.44 0.52 0.95 -1.03 118.95 119.70 3jvu s ARG 82 Ca 0.07 -0.93 -0.05 0.00 -0.52 0.00 0.00 55.73 54.30 3jvu s ARG 82 Cb -0.02 -3.68 -0.01 0.00 0.52 0.00 0.00 34.95 31.76 3jvu s ARG 82 CO -0.00 -0.59 -0.01 0.08 0.02 0.00 0.00 175.30 174.80 3jvu s VAL 83 N 1.59 3.60 -0.19 3.52 1.01 0.37 -1.47 120.40 128.82 3jvu s VAL 83 Ca 0.03 -0.47 -0.00 0.00 0.00 0.00 0.00 61.98 61.55 3jvu s VAL 83 Cb -0.18 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.54 3jvu s VAL 83 CO 0.07 0.37 -0.16 0.21 0.00 0.00 0.00 175.10 175.58 3jvu s ASN 84 N 1.50 3.43 -0.08 3.32 3.84 -0.97 -0.36 114.94 125.62 3jvu s ASN 84 Ca 0.05 -0.62 -0.04 0.00 0.21 0.00 0.00 52.86 52.47 3jvu s ASN 84 Cb -0.15 -1.54 -0.04 0.00 -0.55 0.00 0.00 41.25 38.97 3jvu s ASN 84 CO -0.01 -0.01 0.11 0.00 -2.79 0.00 0.00 177.10 174.39 3jvu s ALA 85 N 1.33 3.72 0.25 1.71 0.00 -0.35 -1.49 121.76 126.93 3jvu s ALA 85 Ca 0.05 -0.73 -0.17 0.00 0.00 0.00 0.00 51.96 51.10 3jvu s ALA 85 Cb -0.13 -1.79 0.01 0.00 0.00 0.00 0.00 23.12 21.21 3jvu s ALA 85 CO -0.11 0.65 0.59 -0.59 0.00 0.00 0.00 175.76 176.30 3jvu s PHE 86 N -1.08 0.05 0.01 0.00 -0.71 0.21 -1.66 117.98 114.81 3jvu s PHE 86 Ca 0.18 -0.45 0.04 0.00 -1.04 0.00 0.00 56.93 55.66 3jvu s PHE 86 Cb -0.12 0.44 -0.03 0.00 -1.21 0.00 0.00 43.02 42.10 3jvu s PHE 86 CO 0.08 -1.09 -0.09 -0.80 -1.34 0.00 0.00 175.22 171.98 3jvu s ASN 87 N -2.95 4.47 0.38 1.98 -0.87 -1.22 0.04 114.94 116.76 3jvu s ASN 87 Ca 0.15 -0.20 0.04 0.00 -1.57 0.00 0.00 52.86 51.29 3jvu s ASN 87 Cb -0.03 -0.99 -0.03 0.00 -0.02 0.00 0.00 41.25 40.18 3jvu s ASN 87 CO 0.06 0.28 0.16 0.00 -2.57 0.00 0.00 177.10 175.03 3jvu s GLN 88 N -1.42 1.84 0.55 -0.60 1.03 0.48 -4.93 119.66 116.61 3jvu s GLN 88 Ca 0.17 -2.10 0.28 0.00 0.04 0.00 0.00 55.36 53.74 3jvu s GLN 88 Cb -0.11 -0.34 1.45 0.00 0.03 0.00 0.00 33.01 34.04 3jvu s GLN 88 CO 0.07 -0.51 1.94 -0.97 -2.54 0.00 0.00 175.29 173.28 3jvu h ASN 89 N 1.92 0.00 0.32 12.60 -1.24 -1.98 -0.90 115.58 126.31 3jvu h ASN 89 Ca -0.33 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.68 3jvu h ASN 89 Cb 1.26 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.31 3jvu h ASN 89 CO 0.52 0.00 -0.94 0.54 -1.29 0.00 0.00 177.43 176.25 3jvu n ARG 90 N -4.21 0.17 0.00 6.67 1.74 -1.26 -5.06 116.66 114.71 3jvu n ARG 90 Ca 0.12 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 3jvu n ARG 90 Cb 0.74 -1.55 0.00 0.00 -1.02 0.00 0.00 32.46 30.63 3jvu n ARG 90 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3jvu n GLY 91 N 1.42 0.73 3.74 -0.13 0.00 -0.34 -4.68 105.19 105.94 3jvu n GLY 91 Ca 0.03 -1.61 -0.31 0.00 0.00 0.00 0.00 46.02 44.13 3jvu n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jvu s ALA 92 N -1.02 2.03 -0.21 4.61 0.00 -1.26 -0.38 121.76 125.52 3jvu s ALA 92 Ca 0.00 0.33 -0.20 0.00 0.00 0.00 0.00 51.96 52.09 3jvu s ALA 92 Cb 0.00 -3.31 0.06 0.00 0.00 0.00 0.00 23.12 19.86 3jvu s ALA 92 CO 0.00 -2.04 0.58 0.20 0.00 0.00 0.00 175.76 174.50 3jvu s GLY 93 N -3.22 -0.44 -0.09 0.00 0.00 0.11 -0.72 107.32 102.97 3jvu s GLY 93 Ca 0.63 1.62 -0.11 0.00 0.00 0.00 0.00 44.72 46.86 3jvu s GLY 93 CO 0.57 1.39 0.28 0.00 0.00 0.00 0.00 173.10 175.34 3jvu s ALA 94 N 0.25 -0.70 -0.06 3.20 0.00 -0.29 0.67 121.76 124.84 3jvu s ALA 94 Ca -0.00 0.68 0.03 0.00 0.00 0.00 0.00 51.96 52.66 3jvu s ALA 94 Cb -0.04 -0.35 0.01 0.00 0.00 0.00 0.00 23.12 22.73 3jvu s ALA 94 CO 0.01 -0.16 -0.15 0.54 0.00 0.00 0.00 175.76 176.00 3jvu s VAL 95 N -0.17 1.34 -0.25 0.00 0.11 -0.56 -0.39 120.40 120.48 3jvu s VAL 95 Ca -0.03 -0.62 -0.05 0.00 -2.93 0.00 0.00 61.98 58.35 3jvu s VAL 95 Cb -0.03 -1.18 -0.00 0.00 -1.53 0.00 0.00 36.38 33.64 3jvu s VAL 95 CO 0.01 0.40 0.01 -0.36 -3.33 0.00 0.00 175.10 171.82 3jvu s PHE 96 N 0.40 3.04 -0.27 1.54 0.08 0.25 -2.30 117.98 120.72 3jvu s PHE 96 Ca -0.11 -0.95 -0.09 0.00 0.12 0.00 0.00 56.93 55.90 3jvu s PHE 96 Cb -0.14 -2.16 -0.03 0.00 -0.57 0.00 0.00 43.02 40.12 3jvu s PHE 96 CO 0.04 -0.55 0.12 1.03 -0.10 0.00 0.00 175.22 175.76 3jvu s ARG 97 N 1.48 3.67 0.23 0.44 0.52 -0.54 -1.99 118.95 122.76 3jvu s ARG 97 Ca 0.04 -0.48 -0.30 0.00 -0.52 0.00 0.00 55.73 54.47 3jvu s ARG 97 Cb -0.15 -3.47 -0.09 0.00 0.52 0.00 0.00 34.95 31.76 3jvu s ARG 97 CO -0.01 -0.23 1.26 0.95 0.02 0.00 0.00 175.30 177.29 3jvu s THR 98 N 1.65 3.24 -0.15 0.02 -4.23 -1.23 0.32 115.64 115.26 3jvu s THR 98 Ca 0.06 1.08 -0.14 0.00 -1.18 0.00 0.00 61.69 61.51 3jvu s THR 98 Cb -0.16 -3.69 -0.05 0.00 1.34 0.00 0.00 72.50 69.95 3jvu s THR 98 CO 0.06 0.19 0.30 -0.63 -0.54 0.00 0.00 174.62 174.00 3jvu s ILE 99 N -0.28 5.30 -0.37 2.99 1.01 0.22 -4.84 121.20 125.22 3jvu s ILE 99 Ca 0.53 0.57 -0.41 0.00 0.00 0.00 0.00 60.65 61.34 3jvu s ILE 99 Cb -0.36 -3.64 -0.16 0.00 0.01 0.00 0.00 42.46 38.31 3jvu s ILE 99 CO 0.41 0.39 1.88 -2.65 0.00 0.00 0.00 174.94 174.97 3jvu n PRO 100 N 3.52 0.76 -0.04 2.79 -0.02 -1.26 -4.24 135.00 136.51 3jvu n PRO 100 Ca -0.12 0.26 -0.17 0.00 -2.02 0.00 0.00 63.50 61.45 3jvu n PRO 100 Cb 0.52 -1.98 -0.13 0.00 -0.02 0.00 0.00 33.50 31.89 3jvu n PRO 100 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3jvu h SER 101 N 8.25 0.12 -3.52 2.55 4.64 -1.95 -3.45 113.55 120.20 3jvu h SER 101 Ca -0.36 -0.91 -0.52 0.00 -0.47 0.00 0.00 61.79 59.53 3jvu h SER 101 Cb 1.34 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.38 3jvu h SER 101 CO 1.00 1.19 0.38 -0.75 -0.87 0.00 0.00 176.83 177.78 3jvu s LYS 102 N -2.30 4.65 -0.07 4.77 2.36 -1.26 -4.90 119.74 122.99 3jvu s LYS 102 Ca -0.19 1.48 -0.19 0.00 -2.55 0.00 0.00 55.97 54.52 3jvu s LYS 102 Cb -0.00 -3.38 -0.05 0.00 -1.05 0.00 0.00 37.83 33.34 3jvu s LYS 102 CO 0.71 0.13 0.51 0.08 1.55 0.00 0.00 175.35 178.33 3jvu s VAL 103 N 0.23 5.08 -0.05 4.02 1.01 -1.26 -5.06 120.40 124.38 3jvu s VAL 103 Ca 0.49 1.05 -0.17 0.00 0.00 0.00 0.00 61.98 63.35 3jvu s VAL 103 Cb -0.24 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 3jvu s VAL 103 CO 0.30 0.38 0.46 -0.76 0.00 0.00 0.00 175.10 175.48 3jvu s LEU 104 N 0.18 4.39 0.59 3.92 1.02 -1.26 -5.05 118.68 122.47 3jvu s LEU 104 Ca 0.28 0.93 0.00 0.00 0.02 0.00 0.00 54.13 55.36 3jvu s LEU 104 Cb -0.16 -2.67 0.05 0.00 0.02 0.00 0.00 46.19 43.43 3jvu s LEU 104 CO 0.13 0.17 0.83 0.42 0.02 0.00 0.00 176.35 177.92 3jvu s THR 105 N -0.31 2.55 0.37 5.49 -4.23 -1.26 -4.37 115.64 113.89 3jvu s THR 105 Ca 0.25 -0.61 0.14 0.00 -1.18 0.00 0.00 61.69 60.29 3jvu s THR 105 Cb -0.16 -2.94 0.36 0.00 1.34 0.00 0.00 72.50 71.10 3jvu s THR 105 CO 0.12 0.00 1.80 0.24 -0.54 0.00 0.00 174.62 176.24 3jvu h MET 106 N -0.08 0.50 0.97 3.99 2.86 -1.89 0.91 114.93 122.19 3jvu h MET 106 Ca -0.42 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.15 3jvu h MET 106 Cb 1.30 -0.11 0.01 0.00 0.06 0.00 0.00 31.60 32.85 3jvu h MET 106 CO 0.51 0.33 -0.47 0.93 1.06 0.00 0.00 176.91 179.28 3jvu h GLU 107 N 0.52 -1.26 -0.72 1.72 5.08 -1.93 0.71 114.58 118.69 3jvu h GLU 107 Ca 0.55 0.09 0.21 0.00 -1.00 0.00 0.00 59.36 59.21 3jvu h GLU 107 Cb 1.20 0.29 -0.03 0.00 0.50 0.00 0.00 28.75 30.71 3jvu h GLU 107 CO -0.29 -0.84 0.55 0.93 -1.00 0.00 0.00 179.01 178.37 3jvu h GLU 108 N -1.31 0.00 -0.22 2.33 5.08 -1.61 0.24 114.58 119.09 3jvu h GLU 108 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3jvu h GLU 108 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 3jvu h GLU 108 CO 0.22 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.51 3jvu n LEU 109 N -4.18 3.19 -2.97 1.33 4.77 0.20 -4.89 117.00 114.44 3jvu n LEU 109 Ca 0.14 -1.24 -0.22 0.00 -0.03 0.00 0.00 56.01 54.66 3jvu n LEU 109 Cb 0.82 -0.13 0.02 0.00 -2.33 0.00 0.00 43.42 41.80 3jvu n LEU 109 CO 0.36 0.62 -0.04 0.61 -1.33 0.00 0.00 177.39 177.61 3jvu n GLY 110 N 1.43 -0.52 3.82 -0.72 0.00 0.17 -4.98 105.19 104.38 3jvu n GLY 110 Ca 0.17 0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.93 3jvu n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3jvu s MET 111 N -5.64 4.19 0.35 1.61 -1.94 0.19 -4.99 119.30 113.07 3jvu s MET 111 Ca 0.27 0.76 0.06 0.00 -1.71 0.00 0.00 55.69 55.06 3jvu s MET 111 Cb -0.12 -3.03 0.06 0.00 2.01 0.00 0.00 34.83 33.74 3jvu s MET 111 CO 0.33 0.50 0.47 0.41 -0.01 0.00 0.00 175.02 176.73 3jvu n GLY 112 N 1.10 1.99 0.50 -0.03 0.00 -1.26 -4.56 105.19 102.93 3jvu n GLY 112 Ca -0.06 -2.19 0.32 0.00 0.00 0.00 0.00 46.02 44.09 3jvu n GLY 112 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3jvu h GLU 113 N 0.00 0.02 -0.67 1.61 4.39 -2.00 -1.19 114.58 116.75 3jvu h GLU 113 Ca -0.16 -0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.65 3jvu h GLU 113 Cb 0.75 -0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.31 3jvu h GLU 113 CO 0.24 0.01 0.25 -0.24 -1.16 0.00 0.00 179.01 178.11 3jvu h VAL 114 N 0.02 0.72 0.29 3.13 3.04 -1.94 0.29 116.25 121.80 3jvu h VAL 114 Ca 0.51 -0.14 -0.01 0.00 -1.01 0.00 0.00 66.70 66.04 3jvu h VAL 114 Cb 1.99 0.26 0.00 0.00 -2.01 0.00 0.00 31.29 31.54 3jvu h VAL 114 CO -0.02 0.08 -0.14 -0.26 -1.01 0.00 0.00 177.57 176.22 3jvu h PHE 115 N 0.42 -0.36 0.12 3.17 -1.00 -1.59 -1.45 116.94 116.25 3jvu h PHE 115 Ca 0.35 -0.01 0.02 0.00 2.81 0.00 0.00 57.97 61.14 3jvu h PHE 115 Cb 0.48 0.12 -0.04 0.00 3.61 0.00 0.00 35.95 40.11 3jvu h PHE 115 CO -0.17 -0.17 -0.41 0.87 -1.61 0.00 0.00 178.31 176.81 3jvu h LYS 116 N -0.47 -0.62 -0.94 1.51 1.57 -1.19 0.14 116.57 116.58 3jvu h LYS 116 Ca -0.04 0.04 0.20 0.00 -1.87 0.00 0.00 60.65 58.98 3jvu h LYS 116 Cb 0.35 0.14 -0.18 0.00 0.08 0.00 0.00 32.23 32.63 3jvu h LYS 116 CO 0.07 -0.41 -0.20 0.00 -0.57 0.00 0.00 179.45 178.34 3jvu h ARG 117 N -0.64 0.00 0.27 3.15 3.08 -0.34 0.24 114.38 120.14 3jvu h ARG 117 Ca 0.02 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 3jvu h ARG 117 Cb 0.67 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.72 3jvu h ARG 117 CO -0.24 0.00 -0.13 0.28 -1.07 0.00 0.00 179.97 178.82 3jvu h VAL 118 N 0.00 0.76 -0.15 2.04 2.07 -0.12 -1.70 116.25 119.16 3jvu h VAL 118 Ca 0.47 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.82 3jvu h VAL 118 Cb 0.75 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 3jvu h VAL 118 CO -0.95 0.05 0.33 0.28 0.02 0.00 0.00 177.57 177.30 3jvu h SER 119 N -0.47 0.00 0.93 0.57 0.02 0.12 -2.30 113.55 112.42 3jvu h SER 119 Ca -0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 3jvu h SER 119 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 3jvu h SER 119 CO 0.06 0.00 -0.62 0.44 -1.14 0.00 0.00 176.83 175.57 3jvu h ASP 120 N 0.00 0.00 -1.95 3.07 3.32 0.35 -3.47 116.42 117.75 3jvu h ASP 120 Ca 0.07 -0.18 -0.64 0.00 0.02 0.00 0.00 57.03 56.30 3jvu h ASP 120 Cb 0.73 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.37 3jvu h ASP 120 CO -0.00 0.09 0.11 1.33 -1.72 0.00 0.00 179.24 179.05 3jvu n VAL 121 N -2.20 1.36 0.04 -1.35 0.24 -0.87 -4.86 118.33 110.70 3jvu n VAL 121 Ca 0.03 -0.34 0.01 0.00 -2.04 0.00 0.00 64.34 62.00 3jvu n VAL 121 Cb 0.45 -0.75 0.34 0.00 -1.47 0.00 0.00 33.84 32.41 3jvu n VAL 121 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3jvu h PRO 122 N 2.60 0.43 0.00 7.34 0.13 -1.92 -3.46 132.00 137.12 3jvu h PRO 122 Ca -0.40 -0.09 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 3jvu h PRO 122 Cb 1.36 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3jvu h PRO 122 CO 0.65 0.48 0.15 2.89 -0.23 0.00 0.00 178.00 181.94 3jvu n ARG 123 N -4.29 0.68 0.00 0.86 1.85 -1.26 -3.91 116.66 110.59 3jvu n ARG 123 Ca 0.01 -1.39 0.00 0.00 -1.00 0.00 0.00 57.85 55.47 3jvu n ARG 123 Cb 0.24 1.70 0.00 0.00 -1.05 0.00 0.00 32.46 33.35 3jvu n ARG 123 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3jvu n GLY 124 N -0.33 -1.31 3.51 2.89 0.00 -0.67 -4.69 105.19 104.59 3jvu n GLY 124 Ca -0.05 -2.10 -0.33 0.00 0.00 0.00 0.00 46.02 43.54 3jvu n GLY 124 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3jvu s LEU 125 N 0.00 3.03 -0.09 0.99 2.96 0.37 -0.41 118.68 125.53 3jvu s LEU 125 Ca 0.00 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.79 3jvu s LEU 125 Cb 0.00 -1.67 0.02 0.00 0.50 0.00 0.00 46.19 45.04 3jvu s LEU 125 CO 0.00 0.29 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.55 3jvu s VAL 126 N -0.38 0.98 -0.19 1.68 1.01 0.01 0.28 120.40 123.79 3jvu s VAL 126 Ca 0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 3jvu s VAL 126 Cb -0.12 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 3jvu s VAL 126 CO 0.02 0.35 -0.04 -0.76 0.00 0.00 0.00 175.10 174.68 3jvu s LEU 127 N 1.42 3.08 -0.34 3.92 1.43 -0.96 -1.76 118.68 125.47 3jvu s LEU 127 Ca -0.01 -0.26 -0.06 0.00 -1.03 0.00 0.00 54.13 52.77 3jvu s LEU 127 Cb -0.13 -1.76 0.05 0.00 0.03 0.00 0.00 46.19 44.37 3jvu s LEU 127 CO -0.05 0.07 0.11 -0.69 0.23 0.00 0.00 176.35 176.02 3jvu s VAL 128 N 0.95 3.68 0.44 -1.59 1.01 -0.25 -0.08 120.40 124.56 3jvu s VAL 128 Ca 0.00 -1.25 0.06 0.00 0.00 0.00 0.00 61.98 60.80 3jvu s VAL 128 Cb -0.15 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 3jvu s VAL 128 CO 0.01 -0.23 0.17 0.42 0.00 0.00 0.00 175.10 175.48 3jvu s THR 129 N 1.37 2.06 0.00 3.92 -4.23 0.22 -3.65 115.64 115.33 3jvu s THR 129 Ca -0.01 -1.73 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 3jvu s THR 129 Cb -0.20 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 70.85 3jvu s THR 129 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 3jvu n GLY 130 N -1.28 3.90 3.26 3.99 0.00 -0.46 -1.53 105.19 113.06 3jvu n GLY 130 Ca -0.04 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 45.10 3jvu n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3jvu n PRO 131 N -1.20 -2.22 -2.54 1.61 -0.04 -1.24 -4.29 135.00 125.08 3jvu n PRO 131 Ca 0.00 -0.64 -0.41 0.00 -0.04 0.00 0.00 63.50 62.41 3jvu n PRO 131 Cb 0.00 -1.76 -0.04 0.00 -0.04 0.00 0.00 33.50 31.66 3jvu n PRO 131 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3jvu s THR 132 N -2.22 3.90 0.00 0.52 -4.23 -1.26 -2.77 115.64 109.57 3jvu s THR 132 Ca 0.56 1.67 0.00 0.00 -1.18 0.00 0.00 61.69 62.74 3jvu s THR 132 Cb -0.13 -4.07 0.00 0.00 1.34 0.00 0.00 72.50 69.64 3jvu s THR 132 CO 0.60 0.30 0.00 0.61 -0.54 0.00 0.00 174.62 175.59 3jvu n GLY 133 N 1.94 2.34 0.31 3.99 0.00 -1.26 -4.93 105.19 107.58 3jvu n GLY 133 Ca 0.02 -0.20 0.15 0.00 0.00 0.00 0.00 46.02 45.99 3jvu n GLY 133 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3jvu h SER 134 N 0.67 0.00 0.00 1.61 4.64 -1.85 -3.43 113.55 115.18 3jvu h SER 134 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3jvu h SER 134 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3jvu h SER 134 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3jvu n GLY 135 N -1.40 0.66 0.28 -0.77 0.00 -1.26 -3.75 105.19 98.95 3jvu n GLY 135 Ca -0.01 -0.67 0.04 0.00 0.00 0.00 0.00 46.02 45.39 3jvu n GLY 135 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3jvu h LYS 136 N 0.00 0.51 -0.09 1.61 1.57 -1.87 -2.59 116.57 115.70 3jvu h LYS 136 Ca 0.00 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3jvu h LYS 136 Cb 0.08 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 3jvu h LYS 136 CO 0.00 0.33 -0.08 0.77 -0.57 0.00 0.00 179.45 179.91 3jvu h SER 137 N 0.52 -0.25 -0.12 0.86 0.02 -1.93 -0.46 113.55 112.19 3jvu h SER 137 Ca 0.41 0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.45 3jvu h SER 137 Cb 0.56 0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.17 3jvu h SER 137 CO -0.36 -0.11 -0.23 0.74 -1.14 0.00 0.00 176.83 175.74 3jvu h THR 138 N -0.10 0.45 -0.23 -2.27 2.02 -1.88 1.99 112.91 112.89 3jvu h THR 138 Ca 0.06 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.27 3jvu h THR 138 Cb 0.19 0.45 -0.05 0.00 -1.74 0.00 0.00 68.15 66.99 3jvu h THR 138 CO -0.15 0.00 -0.39 0.74 0.37 0.00 0.00 175.52 176.10 3jvu h THR 139 N -0.29 0.00 -0.62 3.16 2.02 -1.42 0.37 112.91 116.13 3jvu h THR 139 Ca 0.10 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.33 3jvu h THR 139 Cb 0.44 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.77 3jvu h THR 139 CO -0.29 0.00 -0.37 -0.07 0.37 0.00 0.00 175.52 175.16 3jvu h LEU 140 N -0.32 -1.35 -0.78 2.58 3.38 0.87 0.18 115.31 119.87 3jvu h LEU 140 Ca 0.04 0.21 0.16 0.00 0.09 0.00 0.00 57.88 58.37 3jvu h LEU 140 Cb 0.43 0.60 -0.15 0.00 0.09 0.00 0.00 40.66 41.63 3jvu h LEU 140 CO -0.38 -0.14 -0.21 0.00 0.09 0.00 0.00 178.44 177.80 3jvu h ALA 141 N -0.07 0.49 -0.98 1.53 0.00 0.40 0.42 119.26 121.05 3jvu h ALA 141 Ca 0.10 0.30 0.03 0.00 0.00 0.00 0.00 54.91 55.34 3jvu h ALA 141 Cb 0.26 0.61 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 3jvu h ALA 141 CO -0.59 -0.42 0.65 0.00 0.00 0.00 0.00 179.25 178.89 3jvu h ALA 142 N 1.75 1.34 -0.19 0.00 0.00 0.25 0.65 119.26 123.06 3jvu h ALA 142 Ca 0.37 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 3jvu h ALA 142 Cb 0.58 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3jvu h ALA 142 CO -0.81 0.58 -0.01 0.52 0.00 0.00 0.00 179.25 179.53 3jvu h MET 143 N 1.27 0.33 -0.22 0.00 2.07 0.20 0.45 114.93 119.04 3jvu h MET 143 Ca 0.38 -0.11 0.01 0.00 -2.07 0.00 0.00 59.70 57.91 3jvu h MET 143 Cb -0.05 -0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 29.64 3jvu h MET 143 CO -0.11 0.55 0.13 -0.07 1.07 0.00 0.00 176.91 178.48 3jvu h LEU 144 N 0.08 0.21 -0.39 1.22 3.38 -0.21 -2.06 115.31 117.54 3jvu h LEU 144 Ca 0.05 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.11 3jvu h LEU 144 Cb 0.40 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.02 3jvu h LEU 144 CO 0.01 0.15 -0.20 -0.78 0.09 0.00 0.00 178.44 177.72 3jvu h ASP 145 N 0.27 -0.67 -0.73 -0.43 3.58 0.42 0.51 116.42 119.37 3jvu h ASP 145 Ca 0.09 0.15 0.16 0.00 0.42 0.00 0.00 57.03 57.85 3jvu h ASP 145 Cb -0.00 0.36 -0.13 0.00 1.72 0.00 0.00 39.33 41.28 3jvu h ASP 145 CO -0.04 -0.23 -0.03 0.22 -2.88 0.00 0.00 179.24 176.28 3jvu h TYR 146 N -0.13 -0.12 -0.17 0.28 3.20 -0.22 0.11 116.97 119.93 3jvu h TYR 146 Ca 0.19 0.06 -0.20 0.00 3.14 0.00 0.00 58.73 61.92 3jvu h TYR 146 Cb 0.43 0.17 0.01 0.00 1.54 0.00 0.00 36.73 38.87 3jvu h TYR 146 CO -0.43 -0.25 -0.68 -0.07 -1.64 0.00 0.00 178.16 175.09 3jvu h LEU 147 N 0.08 0.90 -2.18 2.82 4.07 -0.92 -2.84 115.31 117.24 3jvu h LEU 147 Ca 0.39 -0.61 0.06 0.00 0.08 0.00 0.00 57.88 57.79 3jvu h LEU 147 Cb 0.66 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.13 3jvu h LEU 147 CO -0.66 1.36 0.27 -1.13 -1.08 0.00 0.00 178.44 177.19 3jvu h ASN 148 N 0.49 0.00 0.59 -0.43 -1.24 0.38 0.56 115.58 115.92 3jvu h ASN 148 Ca -0.04 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.97 3jvu h ASN 148 Cb 1.31 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.36 3jvu h ASN 148 CO 0.14 0.00 -0.62 0.59 -1.29 0.00 0.00 177.43 176.25 3jvu n ASN 149 N -3.61 0.58 0.00 1.15 4.13 0.27 -0.44 115.26 117.34 3jvu n ASN 149 Ca 0.02 -0.15 0.00 0.00 1.68 0.00 0.00 54.58 56.14 3jvu n ASN 149 Cb 0.39 0.32 0.00 0.00 -1.54 0.00 0.00 39.78 38.95 3jvu n ASN 149 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 3jvu n THR 150 N -1.75 0.00 -4.96 3.41 -2.24 0.13 -4.82 114.28 104.05 3jvu n THR 150 Ca 0.04 -0.08 -0.30 0.00 -2.27 0.00 0.00 64.05 61.44 3jvu n THR 150 Cb 0.38 0.48 -0.15 0.00 -2.10 0.00 0.00 70.33 68.94 3jvu n THR 150 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3jvu s LYS 151 N -0.82 1.91 -1.34 -0.78 1.02 0.15 -5.02 119.74 114.87 3jvu s LYS 151 Ca 0.00 -1.05 -0.07 0.00 0.02 0.00 0.00 55.97 54.87 3jvu s LYS 151 Cb 0.00 -2.03 0.01 0.00 -0.52 0.00 0.00 37.83 35.29 3jvu s LYS 151 CO 0.00 0.53 2.71 0.66 -0.92 0.00 0.00 175.35 178.33 3jvu n TYR 152 N 1.90 2.34 -4.21 3.18 4.02 -1.25 -3.59 117.16 119.55 3jvu n TYR 152 Ca -0.17 -2.82 -0.27 0.00 -0.01 0.00 0.00 57.90 54.63 3jvu n TYR 152 Cb 0.52 -2.08 -0.03 0.00 -0.02 0.00 0.00 39.34 37.74 3jvu n TYR 152 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 3jvu n HIS 153 N 2.49 0.07 -3.90 -0.72 8.25 -1.25 -4.93 115.22 115.24 3jvu n HIS 153 Ca 0.68 -2.25 -0.34 0.00 -0.26 0.00 0.00 57.72 55.55 3jvu n HIS 153 Cb 0.29 -0.38 -0.13 0.00 1.12 0.00 0.00 29.99 30.89 3jvu n HIS 153 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3jvu s HIS 154 N -2.62 3.63 -0.18 4.41 2.46 -1.26 -0.83 115.29 120.90 3jvu s HIS 154 Ca 0.17 -2.61 -0.23 0.00 0.47 0.00 0.00 55.06 52.86 3jvu s HIS 154 Cb -0.01 -2.97 -0.02 0.00 -0.13 0.00 0.00 32.58 29.45 3jvu s HIS 154 CO 0.11 -0.95 0.72 0.42 -2.47 0.00 0.00 174.74 172.57 3jvu s ILE 155 N 1.05 4.96 -0.17 0.89 1.01 0.65 -0.60 121.20 128.99 3jvu s ILE 155 Ca 0.08 1.39 0.01 0.00 0.00 0.00 0.00 60.65 62.13 3jvu s ILE 155 Cb -0.21 -4.03 0.02 0.00 0.01 0.00 0.00 42.46 38.25 3jvu s ILE 155 CO -0.06 0.09 -0.18 -0.22 0.00 0.00 0.00 174.94 174.57 3jvu s LEU 156 N 1.93 2.04 0.16 2.97 2.96 0.44 -0.63 118.68 128.54 3jvu s LEU 156 Ca 0.33 -0.62 0.10 0.00 -0.22 0.00 0.00 54.13 53.72 3jvu s LEU 156 Cb -0.16 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.09 3jvu s LEU 156 CO 0.12 -0.02 -0.19 0.42 -1.32 0.00 0.00 176.35 175.35 3jvu s THR 157 N 1.34 2.69 -0.49 3.68 -4.23 -0.54 -0.50 115.64 117.59 3jvu s THR 157 Ca 0.05 -1.74 0.07 0.00 -1.18 0.00 0.00 61.69 58.89 3jvu s THR 157 Cb -0.13 -2.27 0.25 0.00 1.34 0.00 0.00 72.50 71.69 3jvu s THR 157 CO -0.12 -0.02 0.60 -0.38 -0.54 0.00 0.00 174.62 174.16 3jvu n ILE 158 N 0.47 0.46 -3.10 2.99 5.41 0.88 -1.15 119.36 125.31 3jvu n ILE 158 Ca -0.14 -4.47 -0.24 0.00 1.00 0.00 0.00 62.75 58.91 3jvu n ILE 158 Cb 0.54 -2.01 0.00 0.00 -0.71 0.00 0.00 39.64 37.46 3jvu n ILE 158 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 3jvu s GLU 159 N -1.66 3.29 -0.38 0.38 2.02 -0.89 -2.78 118.70 118.68 3jvu s GLU 159 Ca 0.37 -0.35 0.03 0.00 0.02 0.00 0.00 54.97 55.04 3jvu s GLU 159 Cb 0.16 -2.58 0.16 0.00 0.10 0.00 0.00 34.13 31.97 3jvu s GLU 159 CO -0.07 -0.09 0.35 0.34 0.02 0.00 0.00 175.26 175.80 3jvu s ASP 160 N -4.13 1.48 0.67 -0.19 2.15 -1.26 -0.76 116.67 114.63 3jvu s ASP 160 Ca 0.45 -1.94 -0.02 0.00 0.43 0.00 0.00 52.55 51.46 3jvu s ASP 160 Cb -0.10 0.28 0.07 0.00 -0.30 0.00 0.00 42.92 42.87 3jvu s ASP 160 CO 0.38 -0.25 0.49 -0.81 -0.17 0.00 0.00 175.17 174.81 3jvu n PRO 161 N 3.92 0.04 -1.98 4.34 -0.04 -1.26 -5.00 135.00 135.03 3jvu n PRO 161 Ca 0.14 -1.12 -0.42 0.00 -0.04 0.00 0.00 63.50 62.06 3jvu n PRO 161 Cb 0.44 -0.38 -0.03 0.00 -0.04 0.00 0.00 33.50 33.49 3jvu n PRO 161 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3jvu s ILE 162 N -1.54 2.80 0.00 0.52 1.01 -1.26 -4.99 121.20 117.74 3jvu s ILE 162 Ca 0.31 0.54 0.00 0.00 0.00 0.00 0.00 60.65 61.49 3jvu s ILE 162 Cb -0.01 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 39.11 3jvu s ILE 162 CO 0.21 0.04 0.00 -0.62 0.00 0.00 0.00 174.94 174.56 3jvu n GLU 163 N 4.19 0.00 -3.76 2.79 -0.58 -1.26 -4.91 120.64 117.10 3jvu n GLU 163 Ca 0.14 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.56 3jvu n GLU 163 Cb 0.39 -0.07 -0.04 0.00 -0.57 0.00 0.00 31.44 31.15 3jvu n GLU 163 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 3jvu s PHE 164 N 0.00 3.49 -0.19 -0.32 0.08 -1.26 -4.82 117.98 114.96 3jvu s PHE 164 Ca 0.00 0.44 -0.08 0.00 0.12 0.00 0.00 56.93 57.41 3jvu s PHE 164 Cb 0.00 -1.91 -0.04 0.00 -0.57 0.00 0.00 43.02 40.49 3jvu s PHE 164 CO 0.00 0.49 0.09 0.08 -0.10 0.00 0.00 175.22 175.78 3jvu s VAL 165 N -1.61 5.09 0.10 -0.44 1.01 -1.26 -5.09 120.40 118.20 3jvu s VAL 165 Ca 0.39 0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.47 3jvu s VAL 165 Cb -0.12 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 3jvu s VAL 165 CO 0.26 0.46 0.13 -1.00 0.00 0.00 0.00 175.10 174.95 3jvu s HIS 166 N 0.28 3.25 -0.20 5.22 3.76 -1.26 -5.05 115.29 121.29 3jvu s HIS 166 Ca 0.06 0.09 -0.13 0.00 -0.15 0.00 0.00 55.06 54.93 3jvu s HIS 166 Cb -0.12 -1.62 -0.05 0.00 1.11 0.00 0.00 32.58 31.91 3jvu s HIS 166 CO -0.01 0.53 0.26 -2.00 -0.85 0.00 0.00 174.74 172.67 3jvu s GLU 167 N -2.62 4.17 -0.26 1.40 2.56 -1.26 -5.00 118.70 117.70 3jvu s GLU 167 Ca 0.31 -0.03 -0.31 0.00 0.00 0.00 0.00 54.97 54.94 3jvu s GLU 167 Cb -0.12 -3.48 -0.07 0.00 2.00 0.00 0.00 34.13 32.46 3jvu s GLU 167 CO 0.24 0.13 2.21 0.43 -0.56 0.00 0.00 175.26 177.70 3jvu n SER 168 N 3.99 2.88 0.00 -1.70 7.64 -1.26 -4.85 113.62 120.32 3jvu n SER 168 Ca -0.13 0.28 0.00 0.00 1.01 0.00 0.00 58.87 60.04 3jvu n SER 168 Cb 0.52 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.26 3jvu n SER 168 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3jvu n LYS 169 N 8.54 0.00 0.04 1.43 5.02 -1.26 -4.81 118.16 127.12 3jvu n LYS 169 Ca 0.34 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.76 3jvu n LYS 169 Cb 0.37 0.00 0.43 0.00 -0.02 0.00 0.00 35.03 35.81 3jvu n LYS 169 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3jvu n LYS 170 N 0.00 0.13 -4.24 1.97 5.02 0.41 -4.83 118.16 116.62 3jvu n LYS 170 Ca 0.00 0.08 -0.32 0.00 -2.02 0.00 0.00 58.31 56.05 3jvu n LYS 170 Cb 0.00 -1.62 -0.08 0.00 -0.02 0.00 0.00 35.03 33.30 3jvu n LYS 170 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3jvu s LEU 172 N -1.68 3.84 -0.26 0.00 2.96 -0.01 -4.46 118.68 119.07 3jvu s LEU 172 Ca 0.21 1.19 -0.08 0.00 -0.22 0.00 0.00 54.13 55.22 3jvu s LEU 172 Cb -0.12 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.00 3jvu s LEU 172 CO 0.12 -1.15 0.10 -0.69 -1.32 0.00 0.00 176.35 173.40 3jvu s VAL 173 N 4.60 4.50 -0.24 1.68 1.01 -1.26 -0.26 120.40 130.44 3jvu s VAL 173 Ca 0.58 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.46 3jvu s VAL 173 Cb -0.17 -3.12 0.05 0.00 0.00 0.00 0.00 36.38 33.14 3jvu s VAL 173 CO 0.25 0.31 -0.13 0.20 0.00 0.00 0.00 175.10 175.73 3jvu s ASN 174 N 1.64 4.13 -0.18 3.32 0.01 0.19 -4.84 114.94 119.22 3jvu s ASN 174 Ca 0.06 -1.22 -0.06 0.00 -0.71 0.00 0.00 52.86 50.93 3jvu s ASN 174 Cb -0.15 -1.51 -0.03 0.00 0.41 0.00 0.00 41.25 39.96 3jvu s ASN 174 CO 0.05 -0.15 0.02 -1.10 -1.51 0.00 0.00 177.10 174.41 3jvu s GLN 175 N 1.16 3.81 -0.20 -0.60 -0.21 -1.26 -1.47 119.66 120.89 3jvu s GLN 175 Ca -0.06 -0.43 -0.03 0.00 0.02 0.00 0.00 55.36 54.86 3jvu s GLN 175 Cb -0.18 -3.09 -0.00 0.00 1.00 0.00 0.00 33.01 30.73 3jvu s GLN 175 CO -0.07 0.22 -0.08 1.03 -2.12 0.00 0.00 175.29 174.28 3jvu s ARG 176 N 0.47 3.32 -0.41 2.91 0.52 -0.30 -4.98 118.95 120.48 3jvu s ARG 176 Ca 0.00 -0.66 -0.20 0.00 -0.52 0.00 0.00 55.73 54.35 3jvu s ARG 176 Cb -0.13 -2.89 0.02 0.00 0.52 0.00 0.00 34.95 32.46 3jvu s ARG 176 CO 0.02 -0.15 0.62 -2.00 0.02 0.00 0.00 175.30 173.81 3jvu s GLU 177 N 1.30 3.39 0.21 3.54 2.12 -1.26 -2.10 118.70 125.90 3jvu s GLU 177 Ca 0.04 -0.29 -0.30 0.00 0.36 0.00 0.00 54.97 54.78 3jvu s GLU 177 Cb -0.14 -3.91 -0.16 0.00 0.26 0.00 0.00 34.13 30.18 3jvu s GLU 177 CO -0.04 -0.91 0.93 0.28 -0.54 0.00 0.00 175.26 174.99 3jvu n VAL 178 N 5.73 1.52 0.00 3.70 0.31 0.06 0.23 118.33 129.89 3jvu n VAL 178 Ca -0.02 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 3jvu n VAL 178 Cb 0.48 -0.62 0.00 0.00 -0.91 0.00 0.00 33.84 32.79 3jvu n VAL 178 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3jvu n HIS 179 N 0.64 0.00 0.01 3.52 8.25 0.32 -4.66 115.22 123.30 3jvu n HIS 179 Ca 0.14 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.60 3jvu n HIS 179 Cb 0.26 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.37 3jvu n HIS 179 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 3jvu n ARG 180 N -2.00 0.01 0.01 -0.41 0.63 -0.33 -4.76 116.66 109.80 3jvu n ARG 180 Ca 0.00 0.00 0.11 0.00 -0.92 0.00 0.00 57.85 57.04 3jvu n ARG 180 Cb 0.00 -0.51 0.00 0.00 0.45 0.00 0.00 32.46 32.40 3jvu n ARG 180 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3jvu n ASP 181 N -3.09 0.73 -3.49 6.15 8.00 0.14 -4.98 116.55 120.00 3jvu n ASP 181 Ca -0.01 -0.57 -0.14 0.00 0.71 0.00 0.00 54.79 54.78 3jvu n ASP 181 Cb 0.43 0.82 -0.04 0.00 -0.02 0.00 0.00 41.12 42.31 3jvu n ASP 181 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3jvu s THR 182 N -3.08 0.00 -0.12 -3.53 -1.32 -1.22 -4.88 115.64 101.49 3jvu s THR 182 Ca 0.07 0.00 0.15 0.00 -1.21 0.00 0.00 61.69 60.69 3jvu s THR 182 Cb 0.16 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.20 3jvu s THR 182 CO 0.81 0.00 1.45 -0.07 -2.21 0.00 0.00 174.62 174.60 3jvu h LEU 183 N 2.52 0.00 0.00 9.08 3.38 -1.92 0.92 115.31 129.30 3jvu h LEU 183 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3jvu h LEU 183 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3jvu h LEU 183 CO 0.37 0.53 0.00 0.61 0.09 0.00 0.00 178.44 180.04 3jvu n GLY 184 N 1.18 0.52 0.29 0.83 0.00 -1.26 -4.50 105.19 102.24 3jvu n GLY 184 Ca 0.02 -0.83 0.03 0.00 0.00 0.00 0.00 46.02 45.23 3jvu n GLY 184 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3jvu h PHE 185 N 0.00 0.72 0.18 1.61 0.04 -1.93 0.20 116.94 117.75 3jvu h PHE 185 Ca 0.00 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 3jvu h PHE 185 Cb 0.00 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 37.95 3jvu h PHE 185 CO 0.00 0.25 -0.09 0.66 -0.60 0.00 0.00 178.31 178.53 3jvu h SER 186 N 0.65 -0.20 -0.16 2.17 4.64 -1.96 0.54 113.55 119.24 3jvu h SER 186 Ca 0.38 -0.28 0.05 0.00 -0.47 0.00 0.00 61.79 61.47 3jvu h SER 186 Cb 0.42 0.05 -0.07 0.00 -0.31 0.00 0.00 62.40 62.50 3jvu h SER 186 CO -0.28 0.21 -0.30 -0.33 -0.87 0.00 0.00 176.83 175.25 3jvu h GLU 187 N -0.66 -0.35 -0.24 4.77 3.07 -1.92 -0.20 114.58 119.05 3jvu h GLU 187 Ca -0.02 0.02 0.03 0.00 -0.50 0.00 0.00 59.36 58.89 3jvu h GLU 187 Cb 0.48 0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.43 3jvu h GLU 187 CO 0.04 -0.23 0.05 0.00 -1.40 0.00 0.00 179.01 177.47 3jvu h ALA 188 N 0.51 0.25 -0.16 3.43 0.00 -0.89 -2.59 119.26 119.82 3jvu h ALA 188 Ca 0.11 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.11 3jvu h ALA 188 Cb 0.53 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 3jvu h ALA 188 CO -0.36 -0.36 -0.24 -0.07 0.00 0.00 0.00 179.25 178.22 3jvu h LEU 189 N 0.15 -0.74 -0.08 0.00 3.38 0.68 -0.38 115.31 118.32 3jvu h LEU 189 Ca 0.11 0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.24 3jvu h LEU 189 Cb 0.10 0.33 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 3jvu h LEU 189 CO -0.14 -0.28 -0.43 0.03 0.09 0.00 0.00 178.44 177.71 3jvu h ARG 190 N -0.28 -0.52 -0.83 1.13 3.08 -0.78 0.54 114.38 116.73 3jvu h ARG 190 Ca 0.11 0.04 0.21 0.00 0.07 0.00 0.00 59.98 60.40 3jvu h ARG 190 Cb 0.45 0.12 -0.13 0.00 0.08 0.00 0.00 29.97 30.48 3jvu h ARG 190 CO -0.33 -0.34 0.18 0.77 -1.07 0.00 0.00 179.97 179.18 3jvu h SER 191 N -0.54 -0.07 -1.02 7.04 0.02 -1.09 0.25 113.55 118.15 3jvu h SER 191 Ca 0.06 0.19 0.25 0.00 -0.84 0.00 0.00 61.79 61.45 3jvu h SER 191 Cb 0.65 0.27 -0.11 0.00 0.14 0.00 0.00 62.40 63.34 3jvu h SER 191 CO -0.37 -0.13 0.63 0.00 -1.14 0.00 0.00 176.83 175.82 3jvu h ALA 192 N 1.73 1.97 0.00 3.77 0.00 0.85 0.18 119.26 127.77 3jvu h ALA 192 Ca 0.50 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.50 3jvu h ALA 192 Cb 0.94 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3jvu h ALA 192 CO -0.63 -0.42 0.00 1.28 0.00 0.00 0.00 179.25 179.48 3jvu n LEU 193 N -4.77 0.00 -2.71 0.00 4.77 0.88 -1.62 117.00 113.55 3jvu n LEU 193 Ca 0.26 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.22 3jvu n LEU 193 Cb 0.80 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 42.00 3jvu n LEU 193 CO 0.20 0.00 0.46 -2.11 -1.33 0.00 0.00 177.39 174.62 3jvu n ARG 194 N -0.71 1.43 -0.09 3.23 1.85 0.63 -4.79 116.66 118.22 3jvu n ARG 194 Ca 0.03 -1.83 0.02 0.00 -1.00 0.00 0.00 57.85 55.07 3jvu n ARG 194 Cb 0.01 -0.11 0.03 0.00 -1.05 0.00 0.00 32.46 31.34 3jvu n ARG 194 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3jvu n GLU 195 N -1.23 1.34 -3.75 2.89 1.02 -0.64 -5.01 120.64 115.26 3jvu n GLU 195 Ca -0.10 -1.32 -0.24 0.00 -0.02 0.00 0.00 57.16 55.48 3jvu n GLU 195 Cb 0.86 -0.87 0.03 0.00 -0.02 0.00 0.00 31.44 31.45 3jvu n GLU 195 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3jvu n ASP 196 N -0.45 -2.48 -4.79 1.62 2.03 -1.26 -4.96 116.55 106.26 3jvu n ASP 196 Ca 0.03 -0.79 -0.37 0.00 0.52 0.00 0.00 54.79 54.18 3jvu n ASP 196 Cb 0.46 -4.08 -0.06 0.00 -0.72 0.00 0.00 41.12 36.72 3jvu n ASP 196 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3jvu s PRO 197 N -6.17 4.51 -0.19 -0.67 0.04 -1.26 -4.78 135.00 126.48 3jvu s PRO 197 Ca 0.22 1.23 -0.17 0.00 0.04 0.00 0.00 61.00 62.32 3jvu s PRO 197 Cb -0.11 -2.80 -0.14 0.00 0.04 0.00 0.00 34.50 31.50 3jvu s PRO 197 CO 0.81 0.29 0.08 -0.25 0.04 0.00 0.00 177.00 177.97 3jvu n ASP 198 N 0.55 1.84 -4.30 6.66 8.00 0.24 -4.94 116.55 124.61 3jvu n ASP 198 Ca 0.01 0.49 -0.32 0.00 0.71 0.00 0.00 54.79 55.69 3jvu n ASP 198 Cb 0.50 -0.93 -0.16 0.00 -0.02 0.00 0.00 41.12 40.51 3jvu n ASP 198 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3jvu s ILE 199 N -2.32 2.32 -0.16 0.53 1.01 -0.95 -2.51 121.20 119.12 3jvu s ILE 199 Ca -0.24 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 59.47 3jvu s ILE 199 Cb 0.05 -1.88 0.01 0.00 0.01 0.00 0.00 42.46 40.65 3jvu s ILE 199 CO 0.47 0.56 -0.20 -0.63 0.00 0.00 0.00 174.94 175.14 3jvu s ILE 200 N -0.06 2.11 -0.37 2.92 1.01 -0.46 -0.42 121.20 125.93 3jvu s ILE 200 Ca -0.06 -0.94 -0.18 0.00 0.00 0.00 0.00 60.65 59.47 3jvu s ILE 200 Cb -0.14 -1.87 0.00 0.00 0.01 0.00 0.00 42.46 40.46 3jvu s ILE 200 CO 0.05 0.54 0.49 -0.22 0.00 0.00 0.00 174.94 175.79 3jvu s LEU 201 N 1.04 4.47 -0.40 2.97 2.96 0.34 0.26 118.68 130.33 3jvu s LEU 201 Ca -0.01 -0.22 -0.23 0.00 -0.22 0.00 0.00 54.13 53.45 3jvu s LEU 201 Cb -0.14 -2.52 0.02 0.00 0.50 0.00 0.00 46.19 44.04 3jvu s LEU 201 CO -0.07 -0.51 0.81 0.68 -1.32 0.00 0.00 176.35 175.94 3jvu s VAL 202 N 2.33 4.67 0.00 1.68 -7.23 0.11 -0.08 120.40 121.88 3jvu s VAL 202 Ca 0.17 0.75 0.00 0.00 -1.81 0.00 0.00 61.98 61.09 3jvu s VAL 202 Cb -0.16 -4.27 0.00 0.00 0.56 0.00 0.00 36.38 32.51 3jvu s VAL 202 CO 0.14 -0.56 0.23 0.61 -0.31 0.00 0.00 175.10 175.20 3jvu n GLY 203 N 4.70 -1.69 3.56 2.32 0.00 -1.12 -4.17 105.19 108.80 3jvu n GLY 203 Ca 0.03 0.36 -0.26 0.00 0.00 0.00 0.00 46.02 46.15 3jvu n GLY 203 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3jvu s GLU 204 N -0.52 1.85 -1.25 1.61 -1.05 -1.26 -4.15 118.70 113.93 3jvu s GLU 204 Ca 0.00 -2.01 -0.09 0.00 -0.15 0.00 0.00 54.97 52.72 3jvu s GLU 204 Cb 0.00 -1.55 0.19 0.00 -0.44 0.00 0.00 34.13 32.33 3jvu s GLU 204 CO 0.00 0.01 1.80 -1.33 0.95 0.00 0.00 175.26 176.68 3jvu n MET 205 N -0.85 3.72 -0.36 -4.83 2.81 -1.26 -4.83 117.12 111.51 3jvu n MET 205 Ca -0.05 -3.68 0.31 0.00 -1.81 0.00 0.00 57.70 52.47 3jvu n MET 205 Cb 0.66 -2.88 0.63 0.00 -0.71 0.00 0.00 33.22 30.91 3jvu n MET 205 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 3jvu h ARG 206 N 5.79 0.19 -1.60 0.03 9.65 -1.95 -3.45 114.38 123.05 3jvu h ARG 206 Ca 0.36 -0.01 0.30 0.00 -1.10 0.00 0.00 59.98 59.53 3jvu h ARG 206 Cb 0.64 -0.04 -0.12 0.00 -1.39 0.00 0.00 29.97 29.06 3jvu h ARG 206 CO 1.56 0.12 0.77 0.16 2.80 0.00 0.00 179.97 185.39 3jvu s ASP 207 N -5.02 -0.08 0.24 -3.80 1.47 -1.26 -5.01 116.67 103.20 3jvu s ASP 207 Ca -0.07 -0.17 -0.16 0.00 1.18 0.00 0.00 52.55 53.33 3jvu s ASP 207 Cb 0.25 0.22 0.27 0.00 -0.34 0.00 0.00 42.92 43.33 3jvu s ASP 207 CO 0.81 -0.40 1.56 -0.07 0.68 0.00 0.00 175.17 177.75 3jvu h LEU 208 N 2.00 -1.28 -1.10 2.11 -0.00 -1.94 0.18 115.31 115.28 3jvu h LEU 208 Ca -0.29 0.30 -0.05 0.00 -0.00 0.00 0.00 57.88 57.84 3jvu h LEU 208 Cb 1.21 0.70 -0.02 0.00 -0.00 0.00 0.00 40.66 42.54 3jvu h LEU 208 CO 0.28 -0.30 0.11 -0.08 -0.00 0.00 0.00 178.44 178.45 3jvu h GLU 209 N -0.02 0.74 -0.72 1.13 4.57 -1.98 0.37 114.58 118.67 3jvu h GLU 209 Ca 0.36 -0.15 0.09 0.00 -1.18 0.00 0.00 59.36 58.49 3jvu h GLU 209 Cb 0.62 -0.11 -0.07 0.00 -0.16 0.00 0.00 28.75 29.02 3jvu h GLU 209 CO -0.96 0.68 0.37 1.15 -1.18 0.00 0.00 179.01 179.07 3jvu h THR 210 N 0.72 0.86 0.57 0.32 2.02 -1.07 0.31 112.91 116.63 3jvu h THR 210 Ca 0.16 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 67.10 3jvu h THR 210 Cb 0.28 0.17 0.01 0.00 -1.74 0.00 0.00 68.15 66.87 3jvu h THR 210 CO -0.00 0.11 -0.27 0.40 0.37 0.00 0.00 175.52 176.13 3jvu h ILE 211 N 0.63 0.00 -0.28 3.11 2.04 -0.07 0.16 117.51 123.09 3jvu h ILE 211 Ca 0.36 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 66.07 3jvu h ILE 211 Cb 0.36 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.41 3jvu h ILE 211 CO -0.26 0.00 -0.17 -1.14 0.00 0.00 0.00 178.15 176.58 3jvu n ARG 212 N -4.53 -0.13 -0.06 2.37 0.63 0.11 -0.66 116.66 114.40 3jvu n ARG 212 Ca -0.09 0.85 -0.07 0.00 -0.92 0.00 0.00 57.85 57.62 3jvu n ARG 212 Cb 0.30 -1.27 -0.01 0.00 0.45 0.00 0.00 32.46 31.93 3jvu n ARG 212 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 3jvu h LEU 213 N 0.00 -0.48 -1.15 6.15 3.38 -0.42 -1.77 115.31 121.02 3jvu h LEU 213 Ca 0.05 0.11 0.21 0.00 0.09 0.00 0.00 57.88 58.33 3jvu h LEU 213 Cb 0.12 0.26 -0.10 0.00 0.09 0.00 0.00 40.66 41.02 3jvu h LEU 213 CO -0.27 -0.18 0.62 0.00 0.09 0.00 0.00 178.44 178.70 3jvu h ALA 214 N 1.06 1.85 -0.20 1.53 0.00 0.13 -0.79 119.26 122.83 3jvu h ALA 214 Ca 0.14 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 3jvu h ALA 214 Cb 0.33 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3jvu h ALA 214 CO -0.33 -0.22 -0.07 -0.07 0.00 0.00 0.00 179.25 178.56 3jvu h LEU 215 N 0.64 0.42 -1.80 0.00 3.38 -0.01 -2.23 115.31 115.71 3jvu h LEU 215 Ca 0.57 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 3jvu h LEU 215 Cb 1.05 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 3jvu h LEU 215 CO -0.34 0.71 -0.07 0.74 0.09 0.00 0.00 178.44 179.58 3jvu h THR 216 N 0.12 1.07 -0.10 0.22 2.02 -0.85 0.42 112.91 115.81 3jvu h THR 216 Ca 0.05 -0.31 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 3jvu h THR 216 Cb 0.54 1.13 -0.00 0.00 -1.74 0.00 0.00 68.15 68.08 3jvu h THR 216 CO 0.03 0.09 0.04 0.00 0.37 0.00 0.00 175.52 176.05 3jvu h ALA 217 N 1.89 0.13 -0.30 6.16 0.00 -0.99 0.57 119.26 126.73 3jvu h ALA 217 Ca 0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3jvu h ALA 217 Cb 0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3jvu h ALA 217 CO 0.01 -0.30 0.07 0.00 0.00 0.00 0.00 179.25 179.03 3jvu h ALA 218 N 0.90 1.57 0.08 0.00 0.00 -0.52 -2.74 119.26 118.56 3jvu h ALA 218 Ca 0.03 -0.12 -0.26 0.00 0.00 0.00 0.00 54.91 54.56 3jvu h ALA 218 Cb 0.14 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.81 3jvu h ALA 218 CO -0.00 0.33 -1.13 1.49 0.00 0.00 0.00 179.25 179.93 3jvu h GLU 219 N 0.43 0.45 -0.00 0.00 4.81 0.12 -3.22 114.58 117.16 3jvu h GLU 219 Ca 0.10 -0.59 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3jvu h GLU 219 Cb 0.17 0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.74 3jvu h GLU 219 CO -0.00 1.23 0.00 0.25 -0.73 0.00 0.00 179.01 179.76 3jvu n THR 220 N -3.70 0.00 0.00 0.32 -2.24 0.16 -4.86 114.28 103.96 3jvu n THR 220 Ca -0.10 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3jvu n THR 220 Cb 0.94 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 3jvu n THR 220 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jvu n GLY 221 N 1.04 0.73 2.98 3.38 0.00 -1.19 -5.08 105.19 107.05 3jvu n GLY 221 Ca 0.23 -0.61 -0.13 0.00 0.00 0.00 0.00 46.02 45.50 3jvu n GLY 221 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3jvu s HIS 222 N -1.29 0.41 0.07 1.61 3.76 -1.04 -4.95 115.29 113.86 3jvu s HIS 222 Ca 0.00 -0.30 -0.31 0.00 -0.15 0.00 0.00 55.06 54.30 3jvu s HIS 222 Cb 0.00 -0.26 -0.07 0.00 1.11 0.00 0.00 32.58 33.36 3jvu s HIS 222 CO 0.00 -0.07 1.39 -1.17 -0.85 0.00 0.00 174.74 174.04 3jvu s LEU 223 N -0.87 4.35 -0.08 0.89 2.96 -1.04 -1.66 118.68 123.22 3jvu s LEU 223 Ca -0.06 2.23 0.05 0.00 -0.22 0.00 0.00 54.13 56.13 3jvu s LEU 223 Cb -0.06 -3.58 -0.00 0.00 0.50 0.00 0.00 46.19 43.05 3jvu s LEU 223 CO -0.00 -0.67 -0.24 -0.69 -1.32 0.00 0.00 176.35 173.43 3jvu s VAL 224 N 1.62 2.02 -0.16 1.68 1.01 0.46 -1.35 120.40 125.66 3jvu s VAL 224 Ca 0.64 -1.01 -0.05 0.00 0.00 0.00 0.00 61.98 61.56 3jvu s VAL 224 Cb -0.34 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 3jvu s VAL 224 CO 0.29 0.55 0.01 -0.36 0.00 0.00 0.00 175.10 175.59 3jvu s PHE 225 N 0.19 3.13 0.20 5.22 0.08 0.14 -0.81 117.98 126.13 3jvu s PHE 225 Ca -0.14 -0.11 -0.01 0.00 0.12 0.00 0.00 56.93 56.79 3jvu s PHE 225 Cb -0.16 -2.00 -0.04 0.00 -0.57 0.00 0.00 43.02 40.24 3jvu s PHE 225 CO 0.07 0.07 0.13 0.20 -0.10 0.00 0.00 175.22 175.59 3jvu s GLY 226 N 0.30 1.42 -0.01 4.36 0.00 -0.72 0.05 107.32 112.72 3jvu s GLY 226 Ca -0.00 -1.69 -0.05 0.00 0.00 0.00 0.00 44.72 42.98 3jvu s GLY 226 CO 0.02 -1.39 0.10 -0.51 0.00 0.00 0.00 173.10 171.32 3jvu s THR 227 N -4.16 0.05 0.45 0.90 -4.23 -1.26 -1.09 115.64 106.31 3jvu s THR 227 Ca 0.39 -0.45 0.03 0.00 -1.18 0.00 0.00 61.69 60.48 3jvu s THR 227 Cb 0.07 -0.30 -0.04 0.00 1.34 0.00 0.00 72.50 73.57 3jvu s THR 227 CO 0.12 -0.25 0.03 -0.76 -0.54 0.00 0.00 174.62 173.22 3jvu s LEU 228 N -0.82 2.39 0.00 4.79 1.43 -1.24 -4.25 118.68 120.99 3jvu s LEU 228 Ca -0.09 -1.55 0.25 0.00 -1.03 0.00 0.00 54.13 51.71 3jvu s LEU 228 Cb -0.05 -0.64 0.54 0.00 0.03 0.00 0.00 46.19 46.06 3jvu s LEU 228 CO 0.01 -0.73 1.46 1.41 0.23 0.00 0.00 176.35 178.72 3jvu n HIS 229 N -1.07 0.02 -1.41 0.29 8.25 -1.26 -1.36 115.22 118.67 3jvu n HIS 229 Ca -0.12 -0.01 -0.35 0.00 -0.26 0.00 0.00 57.72 56.98 3jvu n HIS 229 Cb 0.67 0.00 0.10 0.00 1.12 0.00 0.00 29.99 31.88 3jvu n HIS 229 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3jvu s THR 230 N -1.98 2.02 -0.31 1.59 -4.23 -1.26 -3.60 115.64 107.86 3jvu s THR 230 Ca 0.32 0.01 0.09 0.00 -1.18 0.00 0.00 61.69 60.93 3jvu s THR 230 Cb 0.20 -2.70 0.21 0.00 1.34 0.00 0.00 72.50 71.55 3jvu s THR 230 CO 0.31 -0.00 1.16 0.35 -0.54 0.00 0.00 174.62 175.89 3jvu n THR 231 N -2.63 1.33 -3.67 3.99 -2.24 -1.26 -1.94 114.28 107.85 3jvu n THR 231 Ca 0.15 -1.34 -0.13 0.00 -2.27 0.00 0.00 64.05 60.46 3jvu n THR 231 Cb 0.49 0.27 -0.08 0.00 -2.10 0.00 0.00 70.33 68.91 3jvu n THR 231 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3jvu s SER 232 N -1.46 -0.64 0.15 3.42 0.15 -1.26 -4.83 113.70 109.24 3jvu s SER 232 Ca 0.18 1.18 -0.31 0.00 0.70 0.00 0.00 55.95 57.70 3jvu s SER 232 Cb 0.13 1.17 -0.07 0.00 -1.71 0.00 0.00 66.02 65.53 3jvu s SER 232 CO 0.06 -0.20 1.54 0.00 1.20 0.00 0.00 173.24 175.84 3jvu h ALA 233 N 5.61 -0.59 -0.49 5.45 0.00 -1.91 1.01 119.26 128.35 3jvu h ALA 233 Ca -0.29 0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.81 3jvu h ALA 233 Cb 1.18 1.32 -0.08 0.00 0.00 0.00 0.00 17.79 20.21 3jvu h ALA 233 CO 0.16 -0.98 0.02 0.00 0.00 0.00 0.00 179.25 178.44 3jvu h ALA 234 N 0.39 0.48 -0.22 0.00 0.00 -1.96 -0.80 119.26 117.15 3jvu h ALA 234 Ca 0.14 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 3jvu h ALA 234 Cb 0.46 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3jvu h ALA 234 CO -0.86 -0.37 0.00 0.87 0.00 0.00 0.00 179.25 178.88 3jvu h LYS 235 N 0.14 0.39 -0.40 0.00 1.57 -1.67 -2.45 116.57 114.14 3jvu h LYS 235 Ca 0.25 -0.12 0.06 0.00 -1.87 0.00 0.00 60.65 58.97 3jvu h LYS 235 Cb 0.37 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.56 3jvu h LYS 235 CO -0.39 0.58 -0.49 1.15 -0.57 0.00 0.00 179.45 179.73 3jvu h THR 236 N 0.16 0.06 -0.02 -0.16 2.02 0.19 0.54 112.91 115.69 3jvu h THR 236 Ca 0.06 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 3jvu h THR 236 Cb 0.40 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 3jvu h THR 236 CO 0.01 0.00 -0.06 0.40 0.37 0.00 0.00 175.52 176.24 3jvu h ILE 237 N -0.36 0.00 -0.78 3.11 1.08 -1.12 -1.20 117.51 118.23 3jvu h ILE 237 Ca 0.11 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.70 3jvu h ILE 237 Cb 0.60 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.22 3jvu h ILE 237 CO -0.58 0.00 -0.32 0.47 -0.69 0.00 0.00 178.15 177.03 3jvu n ASP 238 N -2.89 -0.54 -0.34 1.72 8.00 -0.92 0.12 116.55 121.69 3jvu n ASP 238 Ca -0.01 1.37 0.12 0.00 0.71 0.00 0.00 54.79 56.98 3jvu n ASP 238 Cb 0.04 -0.30 0.30 0.00 -0.02 0.00 0.00 41.12 41.14 3jvu n ASP 238 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 3jvu h ARG 239 N 0.00 0.73 0.22 -1.24 9.65 0.84 0.24 114.38 124.82 3jvu h ARG 239 Ca 0.26 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 59.08 3jvu h ARG 239 Cb 0.45 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 3jvu h ARG 239 CO -0.77 0.48 -0.10 0.28 2.80 0.00 0.00 179.97 182.65 3jvu h VAL 240 N 0.75 0.74 -0.17 0.20 2.07 0.20 -3.23 116.25 116.81 3jvu h VAL 240 Ca 0.56 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 3jvu h VAL 240 Cb 0.84 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 3jvu h VAL 240 CO -0.38 0.18 -0.14 0.58 0.02 0.00 0.00 177.57 177.83 3jvu h VAL 241 N -0.86 1.19 0.00 2.57 2.07 -0.98 -3.24 116.25 117.01 3jvu h VAL 241 Ca -0.03 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.64 3jvu h VAL 241 Cb 0.51 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 3jvu h VAL 241 CO 0.05 0.27 -0.04 0.44 0.02 0.00 0.00 177.57 178.31 3jvu h ASP 242 N 0.26 0.00 -0.05 0.57 3.32 -0.57 -3.00 116.42 116.96 3jvu h ASP 242 Ca 0.05 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3jvu h ASP 242 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 3jvu h ASP 242 CO 0.02 0.01 0.00 1.33 -1.72 0.00 0.00 179.24 178.88 3jvu n VAL 243 N -2.32 0.05 -3.85 -1.35 0.24 -1.22 -4.83 118.33 105.05 3jvu n VAL 243 Ca 0.05 -0.18 -0.34 0.00 -2.04 0.00 0.00 64.34 61.83 3jvu n VAL 243 Cb 0.44 0.10 -0.05 0.00 -1.47 0.00 0.00 33.84 32.86 3jvu n VAL 243 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 3jvu s PHE 244 N -1.95 3.57 0.26 6.34 0.08 -1.14 -4.98 117.98 120.16 3jvu s PHE 244 Ca 0.37 0.46 -0.31 0.00 0.12 0.00 0.00 56.93 57.58 3jvu s PHE 244 Cb 0.19 -1.90 -0.13 0.00 -0.57 0.00 0.00 43.02 40.60 3jvu s PHE 244 CO 0.30 0.65 1.35 -0.35 -0.10 0.00 0.00 175.22 177.08 3jvu n PRO 245 N 1.16 1.98 -0.29 0.24 -0.04 -1.26 -4.70 135.00 132.09 3jvu n PRO 245 Ca -0.12 0.70 -0.01 0.00 -0.04 0.00 0.00 63.50 64.03 3jvu n PRO 245 Cb 0.53 -2.32 0.03 0.00 -0.04 0.00 0.00 33.50 31.70 3jvu n PRO 245 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3jvu n ALA 246 N 1.51 -0.10 0.00 0.55 0.00 -1.26 0.26 120.51 121.47 3jvu n ALA 246 Ca 0.10 0.75 0.00 0.00 0.00 0.00 0.00 53.44 54.29 3jvu n ALA 246 Cb 0.32 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.44 3jvu n ALA 246 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3jvu n GLU 247 N -5.10 0.00 0.00 0.00 -0.58 -1.26 -2.06 120.64 111.64 3jvu n GLU 247 Ca 0.08 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 3jvu n GLU 247 Cb 0.30 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 3jvu n GLU 247 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3jvu n GLU 248 N -0.91 0.33 0.13 3.49 2.13 0.14 -4.88 120.64 121.07 3jvu n GLU 248 Ca 0.00 -0.03 -0.13 0.00 0.66 0.00 0.00 57.16 57.66 3jvu n GLU 248 Cb 0.01 -0.34 -0.06 0.00 0.27 0.00 0.00 31.44 31.32 3jvu n GLU 248 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 3jvu h LYS 249 N 0.00 -0.48 -0.68 5.31 1.57 -1.30 -2.75 116.57 118.24 3jvu h LYS 249 Ca 0.00 0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 3jvu h LYS 249 Cb 0.24 0.11 -0.08 0.00 0.08 0.00 0.00 32.23 32.57 3jvu h LYS 249 CO 0.00 -0.32 -0.40 0.00 -0.57 0.00 0.00 179.45 178.16 3jvu n ALA 250 N -2.60 -0.44 0.13 3.86 0.00 -1.26 0.11 120.51 120.32 3jvu n ALA 250 Ca -0.07 0.58 0.05 0.00 0.00 0.00 0.00 53.44 54.00 3jvu n ALA 250 Cb 0.29 -0.05 0.51 0.00 0.00 0.00 0.00 19.45 20.20 3jvu n ALA 250 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 3jvu h MET 251 N 0.00 0.25 0.10 0.00 1.85 -1.88 0.87 114.93 116.12 3jvu h MET 251 Ca 0.11 -0.02 -0.00 0.00 -0.61 0.00 0.00 59.70 59.17 3jvu h MET 251 Cb 0.28 -0.05 0.00 0.00 0.43 0.00 0.00 31.60 32.26 3jvu h MET 251 CO -0.64 0.21 -0.05 0.28 -0.40 0.00 0.00 176.91 176.31 3jvu h VAL 252 N 0.25 0.78 -1.00 -5.77 2.07 0.19 -2.06 116.25 110.72 3jvu h VAL 252 Ca 0.07 -1.33 0.15 0.00 0.82 0.00 0.00 66.70 66.41 3jvu h VAL 252 Cb 0.05 1.40 -0.09 0.00 -1.52 0.00 0.00 31.29 31.13 3jvu h VAL 252 CO -0.01 0.24 0.62 -0.09 0.02 0.00 0.00 177.57 178.35 3jvu h ARG 253 N -0.95 0.84 0.46 1.57 2.43 0.13 0.11 114.38 118.97 3jvu h ARG 253 Ca -0.01 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 3jvu h ARG 253 Cb 0.49 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3jvu h ARG 253 CO 0.02 0.55 -0.22 1.03 -1.51 0.00 0.00 179.97 179.85 3jvu h SER 254 N 0.86 -0.52 -0.05 -3.80 0.87 0.67 -2.03 113.55 109.56 3jvu h SER 254 Ca 0.53 -0.07 0.01 0.00 -1.23 0.00 0.00 61.79 61.03 3jvu h SER 254 Cb 0.70 0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.77 3jvu h SER 254 CO -0.31 -0.23 -0.22 0.24 -0.53 0.00 0.00 176.83 175.78 3jvu h MET 255 N -0.82 -0.23 -0.79 2.24 2.86 -0.57 -2.86 114.93 114.76 3jvu h MET 255 Ca -0.06 0.02 0.11 0.00 -2.06 0.00 0.00 59.70 57.70 3jvu h MET 255 Cb 0.56 0.05 -0.13 0.00 0.06 0.00 0.00 31.60 32.15 3jvu h MET 255 CO 0.10 -0.15 -0.44 1.25 1.06 0.00 0.00 176.91 178.73 3jvu h LEU 256 N -0.24 -1.58 -0.77 1.22 5.85 -0.87 0.81 115.31 119.73 3jvu h LEU 256 Ca 0.01 0.28 0.00 0.00 0.84 0.00 0.00 57.88 59.01 3jvu h LEU 256 Cb 0.27 0.75 0.00 0.00 0.37 0.00 0.00 40.66 42.05 3jvu h LEU 256 CO -0.17 -0.30 0.43 0.77 -0.34 0.00 0.00 178.44 178.83 3jvu h SER 257 N -0.11 0.00 0.00 1.25 4.64 -1.14 0.37 113.55 118.57 3jvu h SER 257 Ca 0.23 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.27 3jvu h SER 257 Cb 0.55 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.58 3jvu h SER 257 CO -0.83 0.00 -2.11 -0.62 -0.87 0.00 0.00 176.83 172.40 3jvu n GLU 258 N -2.10 1.23 -0.00 4.77 1.02 0.28 -4.62 120.64 121.21 3jvu n GLU 258 Ca -0.01 -0.02 0.06 0.00 -0.02 0.00 0.00 57.16 57.17 3jvu n GLU 258 Cb 0.45 -1.43 -0.08 0.00 -0.02 0.00 0.00 31.44 30.36 3jvu n GLU 258 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3jvu n SER 259 N -2.57 1.23 -4.64 1.62 3.41 -0.06 -4.94 113.62 107.66 3jvu n SER 259 Ca -0.25 -0.44 -0.42 0.00 -0.26 0.00 0.00 58.87 57.49 3jvu n SER 259 Cb 0.99 1.26 -0.03 0.00 -0.26 0.00 0.00 64.21 66.18 3jvu n SER 259 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3jvu s LEU 260 N -3.17 4.10 -0.20 1.04 2.96 0.11 0.14 118.68 123.66 3jvu s LEU 260 Ca 0.01 2.10 0.18 0.00 -0.22 0.00 0.00 54.13 56.19 3jvu s LEU 260 Cb 0.09 -3.53 -0.25 0.00 0.50 0.00 0.00 46.19 43.00 3jvu s LEU 260 CO 0.53 -1.20 0.08 0.00 -1.32 0.00 0.00 176.35 174.44 3jvu n GLN 261 N 7.61 0.69 0.00 1.98 1.13 0.14 -4.48 117.38 124.45 3jvu n GLN 261 Ca 0.20 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.26 3jvu n GLN 261 Cb 0.43 -1.53 0.00 0.00 0.11 0.00 0.00 30.24 29.26 3jvu n GLN 261 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3jvu n SER 262 N -2.76 0.00 -4.02 1.08 2.88 -1.12 -0.18 113.62 109.49 3jvu n SER 262 Ca -0.33 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 56.97 3jvu n SER 262 Cb 1.15 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 64.45 3jvu n SER 262 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3jvu s VAL 263 N -2.00 1.14 -0.16 2.46 1.01 0.46 -2.26 120.40 121.05 3jvu s VAL 263 Ca 0.00 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.51 3jvu s VAL 263 Cb 0.00 -1.04 0.02 0.00 0.00 0.00 0.00 36.38 35.36 3jvu s VAL 263 CO 0.00 0.36 -0.15 -0.63 0.00 0.00 0.00 175.10 174.67 3jvu s ILE 264 N 0.67 1.70 -0.14 2.22 1.01 0.89 -1.13 121.20 126.42 3jvu s ILE 264 Ca -0.14 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.74 3jvu s ILE 264 Cb -0.16 -1.60 -0.02 0.00 0.01 0.00 0.00 42.46 40.69 3jvu s ILE 264 CO 0.04 0.45 -0.07 -0.44 0.00 0.00 0.00 174.94 174.91 3jvu s SER 265 N 1.43 4.49 0.44 3.58 0.01 -0.65 0.71 113.70 123.72 3jvu s SER 265 Ca 0.04 -0.20 0.04 0.00 1.31 0.00 0.00 55.95 57.15 3jvu s SER 265 Cb -0.13 -1.70 -0.05 0.00 0.21 0.00 0.00 66.02 64.35 3jvu s SER 265 CO -0.11 0.17 0.02 -1.58 0.41 0.00 0.00 173.24 172.15 3jvu s GLN 266 N 0.32 2.03 -0.29 12.44 0.74 -0.58 0.39 119.66 134.71 3jvu s GLN 266 Ca -0.06 -2.22 -0.27 0.00 0.05 0.00 0.00 55.36 52.86 3jvu s GLN 266 Cb -0.15 -1.49 0.19 0.00 1.10 0.00 0.00 33.01 32.66 3jvu s GLN 266 CO 0.04 -0.20 1.41 -0.08 -0.55 0.00 0.00 175.29 175.91 3jvu s THR 267 N -2.84 0.00 0.04 -0.34 -1.32 -0.43 -4.56 115.64 106.19 3jvu s THR 267 Ca 0.23 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.59 3jvu s THR 267 Cb 0.06 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.99 3jvu s THR 267 CO 0.12 0.00 0.41 -0.76 -2.21 0.00 0.00 174.62 172.17 3jvu s LEU 268 N -0.49 4.41 0.03 9.08 1.02 -1.25 0.14 118.68 131.63 3jvu s LEU 268 Ca 0.08 0.88 0.03 0.00 0.02 0.00 0.00 54.13 55.15 3jvu s LEU 268 Cb -0.03 -2.79 -0.02 0.00 0.02 0.00 0.00 46.19 43.37 3jvu s LEU 268 CO -0.12 0.25 -0.10 -0.63 0.02 0.00 0.00 176.35 175.77 3jvu s ILE 269 N -1.24 0.76 -0.29 -0.59 1.01 0.71 -4.92 121.20 116.63 3jvu s ILE 269 Ca 0.28 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.80 3jvu s ILE 269 Cb -0.15 -0.72 -0.02 0.00 0.01 0.00 0.00 42.46 41.57 3jvu s ILE 269 CO 0.16 -0.10 1.76 -0.54 0.00 0.00 0.00 174.94 176.22 3jvu s LYS 270 N -1.06 3.47 0.00 2.79 1.02 -1.26 0.79 119.74 125.49 3jvu s LYS 270 Ca -0.02 1.53 0.00 0.00 0.02 0.00 0.00 55.97 57.50 3jvu s LYS 270 Cb -0.07 -4.16 0.00 0.00 -0.52 0.00 0.00 37.83 33.08 3jvu s LYS 270 CO 0.01 -1.69 0.51 1.17 -0.92 0.00 0.00 175.35 174.42 3jvu n LYS 271 N 8.22 0.00 0.00 1.68 4.81 -1.26 -4.54 118.16 127.07 3jvu n LYS 271 Ca 0.22 0.08 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 3jvu n LYS 271 Cb 0.46 -1.02 0.00 0.00 0.02 0.00 0.00 35.03 34.49 3jvu n LYS 271 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3jvu n GLY 275 N -0.19 0.00 3.37 3.14 0.00 -1.26 -4.84 105.19 105.41 3jvu n GLY 275 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 3jvu n GLY 275 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3jvu s ARG 276 N 0.00 1.54 0.03 1.61 1.04 -1.26 -4.96 118.95 116.95 3jvu s ARG 276 Ca 0.00 -1.86 0.02 0.00 -1.04 0.00 0.00 55.73 52.85 3jvu s ARG 276 Cb 0.00 -0.45 -0.02 0.00 -2.04 0.00 0.00 34.95 32.44 3jvu s ARG 276 CO 0.00 -0.29 -0.07 0.54 -0.04 0.00 0.00 175.30 175.44 3jvu s VAL 277 N -3.56 0.48 -0.02 4.99 0.11 0.24 -4.88 120.40 117.76 3jvu s VAL 277 Ca 0.36 -0.92 -0.16 0.00 -2.93 0.00 0.00 61.98 58.33 3jvu s VAL 277 Cb 0.07 -0.53 -0.06 0.00 -1.53 0.00 0.00 36.38 34.34 3jvu s VAL 277 CO 0.15 -0.31 0.46 0.00 -3.33 0.00 0.00 175.10 172.06 3jvu s ALA 278 N -1.17 3.62 -0.14 1.54 0.00 -1.26 -0.21 121.76 124.14 3jvu s ALA 278 Ca -0.08 -0.16 -0.03 0.00 0.00 0.00 0.00 51.96 51.68 3jvu s ALA 278 Cb -0.09 -2.50 -0.03 0.00 0.00 0.00 0.00 23.12 20.51 3jvu s ALA 278 CO 0.00 0.34 -0.03 0.00 0.00 0.00 0.00 175.76 176.08 3jvu s ALA 279 N -0.65 3.06 -0.12 0.00 0.00 0.12 -4.94 121.76 119.23 3jvu s ALA 279 Ca 0.25 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.41 3jvu s ALA 279 Cb -0.17 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.40 3jvu s ALA 279 CO 0.14 0.28 -0.18 -1.01 0.00 0.00 0.00 175.76 174.99 3jvu s HIS 280 N 0.13 2.70 -0.12 0.00 3.76 -1.26 -1.31 115.29 119.19 3jvu s HIS 280 Ca -0.01 -0.81 -0.20 0.00 -0.15 0.00 0.00 55.06 53.90 3jvu s HIS 280 Cb -0.13 -1.78 -0.04 0.00 1.11 0.00 0.00 32.58 31.74 3jvu s HIS 280 CO 0.03 -0.29 0.56 -2.00 -0.85 0.00 0.00 174.74 172.18 3jvu s GLU 281 N 0.32 4.34 -0.11 1.40 2.12 0.16 -4.56 118.70 122.37 3jvu s GLU 281 Ca -0.14 0.58 0.03 0.00 0.36 0.00 0.00 54.97 55.80 3jvu s GLU 281 Cb -0.17 -3.47 0.01 0.00 0.26 0.00 0.00 34.13 30.76 3jvu s GLU 281 CO 0.07 0.05 -0.20 0.42 -0.54 0.00 0.00 175.26 175.06 3jvu s ILE 282 N 0.94 1.81 -0.08 -3.70 1.01 -0.33 -1.64 121.20 119.21 3jvu s ILE 282 Ca 0.29 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 60.11 3jvu s ILE 282 Cb -0.16 -1.61 0.01 0.00 0.01 0.00 0.00 42.46 40.72 3jvu s ILE 282 CO 0.12 0.50 -0.13 -0.32 0.00 0.00 0.00 174.94 175.12 3jvu s MET 283 N 0.72 1.83 -0.01 2.79 1.75 -0.29 -0.70 119.30 125.38 3jvu s MET 283 Ca -0.11 -0.43 0.05 0.00 -1.25 0.00 0.00 55.69 53.94 3jvu s MET 283 Cb -0.16 -1.56 -0.03 0.00 2.84 0.00 0.00 34.83 35.92 3jvu s MET 283 CO 0.02 -0.03 -0.14 0.42 -0.65 0.00 0.00 175.02 174.63 3jvu s ILE 284 N 0.88 3.06 0.33 10.11 1.01 -1.26 -0.40 121.20 134.94 3jvu s ILE 284 Ca -0.10 -0.88 -0.27 0.00 0.00 0.00 0.00 60.65 59.40 3jvu s ILE 284 Cb -0.15 -2.25 -0.13 0.00 0.01 0.00 0.00 42.46 39.94 3jvu s ILE 284 CO 0.01 0.48 0.97 0.61 0.00 0.00 0.00 174.94 177.01 3jvu n GLY 285 N 1.94 -0.34 3.50 6.18 0.00 0.74 -4.92 105.19 112.31 3jvu n GLY 285 Ca -0.16 0.26 -0.00 0.00 0.00 0.00 0.00 46.02 46.11 3jvu n GLY 285 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3jvu s THR 286 N -1.14 -0.32 0.17 2.61 -1.32 -1.26 -5.01 115.64 109.36 3jvu s THR 286 Ca 0.60 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.08 3jvu s THR 286 Cb -0.66 -1.00 0.23 0.00 -1.51 0.00 0.00 72.50 69.56 3jvu s THR 286 CO 0.59 0.00 0.84 -2.65 -2.21 0.00 0.00 174.62 171.19 3jvu n PRO 287 N 4.49 -0.04 0.34 7.08 -0.02 -1.26 0.15 135.00 145.74 3jvu n PRO 287 Ca -0.13 0.81 -0.17 0.00 -2.02 0.00 0.00 63.50 61.99 3jvu n PRO 287 Cb 0.54 -1.28 -0.09 0.00 -0.02 0.00 0.00 33.50 32.66 3jvu n PRO 287 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3jvu h ALA 288 N 1.08 -0.83 -0.83 3.55 0.00 -1.99 -2.87 119.26 117.36 3jvu h ALA 288 Ca 0.32 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3jvu h ALA 288 Cb 0.63 0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 3jvu h ALA 288 CO -0.51 -0.97 0.50 0.82 0.00 0.00 0.00 179.25 179.09 3jvu h ILE 289 N -0.83 1.23 -0.61 0.00 2.04 0.98 -2.08 117.51 118.24 3jvu h ILE 289 Ca -0.08 -0.50 0.06 0.00 1.00 0.00 0.00 64.86 65.33 3jvu h ILE 289 Cb 0.64 0.06 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 3jvu h ILE 289 CO 0.14 0.24 -0.36 0.54 0.00 0.00 0.00 178.15 178.70 3jvu n ARG 290 N -4.45 -0.27 -0.03 2.37 5.12 0.48 -0.93 116.66 118.94 3jvu n ARG 290 Ca 0.08 1.30 -0.15 0.00 -1.93 0.00 0.00 57.85 57.15 3jvu n ARG 290 Cb 0.05 -1.92 -0.10 0.00 -1.16 0.00 0.00 32.46 29.34 3jvu n ARG 290 CO 0.00 0.00 0.00 -0.91 -1.93 0.00 0.00 177.63 174.79 3jvu h ASN 291 N 0.00 -1.75 -0.78 0.55 4.21 -1.18 0.36 115.58 117.00 3jvu h ASN 291 Ca 0.10 0.21 0.30 0.00 1.21 0.00 0.00 56.30 58.12 3jvu h ASN 291 Cb 0.25 0.69 -0.11 0.00 -1.12 0.00 0.00 38.32 38.03 3jvu h ASN 291 CO -0.58 -0.47 0.46 0.18 -1.29 0.00 0.00 177.43 175.73 3jvu n LEU 292 N -5.39 0.20 -0.05 1.61 4.77 -0.39 0.49 117.00 118.24 3jvu n LEU 292 Ca -0.06 1.06 -0.01 0.00 -0.03 0.00 0.00 56.01 56.98 3jvu n LEU 292 Cb 0.37 -0.52 -0.00 0.00 -2.33 0.00 0.00 43.42 40.94 3jvu n LEU 292 CO 0.07 -1.18 -0.04 0.40 -1.33 0.00 0.00 177.39 175.31 3jvu h ILE 293 N 0.00 0.00 -0.12 -0.08 2.04 0.14 -2.65 117.51 116.84 3jvu h ILE 293 Ca 0.59 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 65.51 3jvu h ILE 293 Cb 1.68 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 3jvu h ILE 293 CO -0.45 0.00 -0.11 -0.09 0.00 0.00 0.00 178.15 177.50 3jvu h ARG 294 N -0.95 -0.04 -7.03 2.37 2.43 0.23 -3.36 114.38 108.04 3jvu h ARG 294 Ca 0.00 0.00 -0.44 0.00 -0.81 0.00 0.00 59.98 58.73 3jvu h ARG 294 Cb 0.06 0.01 0.22 0.00 -0.42 0.00 0.00 29.97 29.84 3jvu h ARG 294 CO 0.00 -0.03 -0.24 0.39 -1.51 0.00 0.00 179.97 178.58 3jvu n GLU 295 N -3.30 -2.38 -0.08 0.20 1.02 0.18 -4.77 120.64 111.51 3jvu n GLU 295 Ca -0.00 -0.67 0.12 0.00 -0.02 0.00 0.00 57.16 56.59 3jvu n GLU 295 Cb 0.06 -2.07 0.30 0.00 -0.02 0.00 0.00 31.44 29.71 3jvu n GLU 295 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3jvu n ASP 296 N -4.32 2.46 -2.12 1.62 2.03 -1.25 -4.62 116.55 110.34 3jvu n ASP 296 Ca 0.02 -1.82 -0.06 0.00 0.52 0.00 0.00 54.79 53.45 3jvu n ASP 296 Cb 0.56 -0.11 -0.09 0.00 -0.72 0.00 0.00 41.12 40.75 3jvu n ASP 296 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3jvu n LYS 297 N 0.87 1.15 0.23 -0.67 4.76 -1.01 -4.35 118.16 119.13 3jvu n LYS 297 Ca 0.17 -0.53 0.10 0.00 -2.87 0.00 0.00 58.31 55.18 3jvu n LYS 297 Cb 0.47 -1.72 0.52 0.00 -1.84 0.00 0.00 35.03 32.46 3jvu n LYS 297 CO 0.00 0.00 0.00 -0.24 -1.37 0.00 0.00 177.40 175.79 3jvu h VAL 298 N 2.25 0.58 -0.52 -0.18 3.04 -1.80 -3.04 116.25 116.58 3jvu h VAL 298 Ca 0.10 -1.01 0.05 0.00 -1.01 0.00 0.00 66.70 64.83 3jvu h VAL 298 Cb 0.89 1.68 -0.08 0.00 -2.01 0.00 0.00 31.29 31.77 3jvu h VAL 298 CO 0.29 0.21 -0.44 0.00 -1.01 0.00 0.00 177.57 176.62 3jvu h ALA 299 N 1.79 -0.55 0.00 3.17 0.00 -1.91 -2.27 119.26 119.49 3jvu h ALA 299 Ca -0.00 0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.74 3jvu h ALA 299 Cb 0.66 1.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 3jvu h ALA 299 CO 0.03 -0.81 1.10 1.04 0.00 0.00 0.00 179.25 180.62 3jvu n GLN 300 N -4.72 1.44 -0.09 0.00 6.02 -1.15 -3.73 117.38 115.15 3jvu n GLN 300 Ca -0.01 -0.90 -0.17 0.00 -0.01 0.00 0.00 57.00 55.92 3jvu n GLN 300 Cb 0.23 -2.05 -0.07 0.00 1.02 0.00 0.00 30.24 29.37 3jvu n GLN 300 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 177.06 175.93 3jvu n MET 301 N 3.40 0.41 -0.23 -1.09 1.56 -0.86 -4.35 117.12 115.96 3jvu n MET 301 Ca 0.31 0.14 -0.08 0.00 -0.27 0.00 0.00 57.70 57.80 3jvu n MET 301 Cb 0.33 -1.23 -0.04 0.00 2.15 0.00 0.00 33.22 34.42 3jvu n MET 301 CO 0.00 0.00 0.00 -0.92 -0.73 0.00 0.00 175.97 174.32 3jvu h TYR 302 N -0.40 -1.33 -0.09 1.12 -0.00 -1.80 0.79 116.97 115.26 3jvu h TYR 302 Ca -0.44 0.09 -0.06 0.00 -0.00 0.00 0.00 58.73 58.32 3jvu h TYR 302 Cb 1.49 0.67 -0.01 0.00 -0.00 0.00 0.00 36.73 38.87 3jvu h TYR 302 CO -0.03 -0.42 -0.22 0.66 -0.00 0.00 0.00 178.16 178.15 3jvu h SER 303 N -0.21 0.15 -0.55 -2.11 4.64 -1.88 -0.09 113.55 113.50 3jvu h SER 303 Ca 0.18 -0.04 0.08 0.00 -0.47 0.00 0.00 61.79 61.55 3jvu h SER 303 Cb 0.56 -0.04 -0.07 0.00 -0.31 0.00 0.00 62.40 62.54 3jvu h SER 303 CO -0.72 0.37 0.19 0.00 -0.87 0.00 0.00 176.83 175.81 3jvu h ALA 304 N 1.64 0.68 -0.22 5.18 0.00 -1.12 -1.51 119.26 123.92 3jvu h ALA 304 Ca 0.02 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 3jvu h ALA 304 Cb 0.47 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3jvu h ALA 304 CO 0.03 -0.22 -0.45 0.82 0.00 0.00 0.00 179.25 179.43 3jvu h ILE 305 N 0.36 1.31 0.00 0.00 2.04 0.57 -2.36 117.51 119.42 3jvu h ILE 305 Ca 0.27 -1.65 -0.04 0.00 1.00 0.00 0.00 64.86 64.44 3jvu h ILE 305 Cb 0.32 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 3jvu h ILE 305 CO -0.28 0.52 -0.20 1.56 0.00 0.00 0.00 178.15 179.75 3jvu h GLN 306 N 0.45 0.00 -0.22 2.37 4.20 -0.60 0.65 115.11 121.96 3jvu h GLN 306 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3jvu h GLN 306 Cb 0.97 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.75 3jvu h GLN 306 CO 0.09 0.20 0.00 0.25 -0.67 0.00 0.00 178.83 178.69 3jvu n THR 307 N -3.65 0.26 1.72 -0.54 -2.24 -0.63 -4.26 114.28 104.94 3jvu n THR 307 Ca -0.01 -0.63 0.14 0.00 -2.27 0.00 0.00 64.05 61.28 3jvu n THR 307 Cb 0.32 1.23 0.68 0.00 -2.10 0.00 0.00 70.33 70.46 3jvu n THR 307 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jvu n GLY 308 N 1.43 -0.46 0.12 3.38 0.00 0.22 -4.54 105.19 105.35 3jvu n GLY 308 Ca 0.17 -0.32 0.02 0.00 0.00 0.00 0.00 46.02 45.90 3jvu n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jvu n GLY 309 N 1.07 -0.57 0.23 -0.02 0.00 -1.24 -1.47 105.19 103.19 3jvu n GLY 309 Ca 0.20 0.37 0.13 0.00 0.00 0.00 0.00 46.02 46.72 3jvu n GLY 309 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3jvu h SER 310 N 0.00 0.00 0.80 1.61 4.64 -1.89 0.60 113.55 119.31 3jvu h SER 310 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3jvu h SER 310 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 3jvu h SER 310 CO -0.36 0.06 0.00 0.18 -0.87 0.00 0.00 176.83 175.85 3jvu n LEU 311 N -3.14 0.00 0.00 5.97 4.77 -0.54 -4.90 117.00 119.16 3jvu n LEU 311 Ca 0.02 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 3jvu n LEU 311 Cb 0.46 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 3jvu n LEU 311 CO 0.32 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3jvu n GLY 312 N 1.28 0.86 3.79 -0.72 0.00 0.21 -4.99 105.19 105.61 3jvu n GLY 312 Ca 0.09 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 3jvu n GLY 312 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3jvu s MET 313 N -0.51 1.81 -0.28 1.61 -1.94 -1.10 -4.92 119.30 113.96 3jvu s MET 313 Ca 0.00 0.62 -0.23 0.00 -1.71 0.00 0.00 55.69 54.37 3jvu s MET 313 Cb 0.00 -1.89 0.11 0.00 2.01 0.00 0.00 34.83 35.06 3jvu s MET 313 CO 0.00 -1.81 0.92 1.14 -0.01 0.00 0.00 175.02 175.26 3jvu s GLN 314 N -5.13 0.58 0.65 2.03 -2.07 0.12 -4.13 119.66 111.70 3jvu s GLN 314 Ca 0.62 0.76 -0.18 0.00 -1.82 0.00 0.00 55.36 54.73 3jvu s GLN 314 Cb -0.15 0.25 -0.01 0.00 -1.09 0.00 0.00 33.01 32.01 3jvu s GLN 314 CO 0.55 -0.08 1.27 0.99 -1.32 0.00 0.00 175.29 176.70 3jvu s THR 315 N 0.55 2.14 0.07 3.63 2.01 -1.26 -1.18 115.64 121.60 3jvu s THR 315 Ca -0.00 0.09 -0.30 0.00 0.31 0.00 0.00 61.69 61.78 3jvu s THR 315 Cb -0.05 -2.99 -0.18 0.00 0.01 0.00 0.00 72.50 69.29 3jvu s THR 315 CO -0.07 -0.02 1.63 0.25 -0.69 0.00 0.00 174.62 175.72 3jvu h LEU 316 N 0.49 -0.58 -0.45 4.42 5.85 -1.93 -0.44 115.31 122.67 3jvu h LEU 316 Ca -0.50 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.32 3jvu h LEU 316 Cb 1.33 0.15 -0.09 0.00 0.37 0.00 0.00 40.66 42.41 3jvu h LEU 316 CO 0.53 -0.40 -0.20 0.44 -0.34 0.00 0.00 178.44 178.47 3jvu h ASP 317 N -0.70 -0.69 -0.65 1.25 5.19 -1.92 0.50 116.42 119.40 3jvu h ASP 317 Ca -0.07 0.16 0.13 0.00 -0.62 0.00 0.00 57.03 56.63 3jvu h ASP 317 Cb 0.53 0.38 -0.12 0.00 0.18 0.00 0.00 39.33 40.30 3jvu h ASP 317 CO 0.11 -0.23 -0.20 -0.03 -3.12 0.00 0.00 179.24 175.77 3jvu h MET 318 N -0.11 -0.04 -0.31 3.56 4.05 -1.89 0.15 114.93 120.35 3jvu h MET 318 Ca 0.21 0.00 0.02 0.00 -0.28 0.00 0.00 59.70 59.65 3jvu h MET 318 Cb 0.44 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.23 3jvu h MET 318 CO -0.52 -0.03 0.17 0.00 0.23 0.00 0.00 176.91 176.77 3jvu h LEU 320 N 0.35 -1.35 -0.87 0.00 3.38 0.27 -1.74 115.31 115.35 3jvu h LEU 320 Ca 0.12 0.16 0.22 0.00 0.09 0.00 0.00 57.88 58.47 3jvu h LEU 320 Cb 0.02 0.53 -0.15 0.00 0.09 0.00 0.00 40.66 41.14 3jvu h LEU 320 CO -0.07 -0.36 0.04 0.07 0.09 0.00 0.00 178.44 178.21 3jvu h LYS 321 N -0.42 0.08 -0.93 1.13 2.10 -1.18 1.03 116.57 118.37 3jvu h LYS 321 Ca 0.03 -0.00 0.16 0.00 -2.00 0.00 0.00 60.65 58.83 3jvu h LYS 321 Cb 0.51 -0.02 -0.16 0.00 -0.90 0.00 0.00 32.23 31.66 3jvu h LYS 321 CO -0.36 0.05 -0.34 0.78 -2.00 0.00 0.00 179.45 177.59 3jvu h GLY 322 N 0.08 0.23 0.58 0.07 0.00 -1.21 0.22 103.07 103.03 3jvu h GLY 322 Ca 0.51 0.45 0.00 0.00 0.00 0.00 0.00 47.33 48.28 3jvu h GLY 322 CO -0.77 -0.25 0.00 1.04 0.00 0.00 0.00 176.54 176.56 3jvu n LEU 323 N -5.50 0.00 0.45 3.11 4.77 0.35 -1.51 117.00 118.67 3jvu n LEU 323 Ca 0.11 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.89 3jvu n LEU 323 Cb 0.42 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.41 3jvu n LEU 323 CO -0.10 0.00 0.53 -0.37 -1.33 0.00 0.00 177.39 176.12 3jvu h VAL 324 N 0.00 0.00 -0.16 4.08 -1.51 -0.63 -2.88 116.25 115.16 3jvu h VAL 324 Ca 0.00 0.00 0.03 0.00 -1.23 0.00 0.00 66.70 65.50 3jvu h VAL 324 Cb 0.00 0.00 -0.03 0.00 -2.13 0.00 0.00 31.29 29.13 3jvu h VAL 324 CO 0.00 0.00 -0.06 0.00 -1.23 0.00 0.00 177.57 176.28 3jvu n ALA 325 N -2.68 -0.01 -1.78 5.19 0.00 -0.57 -4.71 120.51 115.95 3jvu n ALA 325 Ca -0.15 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3jvu n ALA 325 Cb 0.49 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.86 3jvu n ALA 325 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3jvu n LEU 328 N -4.24 0.00 0.00 0.00 7.99 -1.09 -5.06 117.00 114.60 3jvu n LEU 328 Ca 0.02 0.00 0.06 0.00 -0.01 0.00 0.00 56.01 56.08 3jvu n LEU 328 Cb 0.07 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.36 3jvu n LEU 328 CO -0.02 0.00 -0.08 0.00 -1.51 0.00 0.00 177.39 175.78 3jvu n ILE 329 N 0.00 0.00 -4.02 -0.08 0.13 -1.18 -4.83 119.36 109.38 3jvu n ILE 329 Ca 0.00 0.00 -0.12 0.00 -1.10 0.00 0.00 62.75 61.53 3jvu n ILE 329 Cb 0.00 -0.15 -0.04 0.00 -0.84 0.00 0.00 39.64 38.61 3jvu n ILE 329 CO 0.00 0.00 0.00 -0.94 2.80 0.00 0.00 176.55 178.41 3jvu s SER 330 N -4.15 0.39 -0.09 9.51 1.04 -1.26 -4.82 113.70 114.31 3jvu s SER 330 Ca 0.00 -1.22 -0.22 0.00 0.48 0.00 0.00 55.95 54.99 3jvu s SER 330 Cb 0.00 0.65 -0.18 0.00 0.10 0.00 0.00 66.02 66.59 3jvu s SER 330 CO 0.00 -1.27 0.74 -0.09 0.98 0.00 0.00 173.24 173.60 3jvu h ARG 331 N 2.17 -0.07 -0.19 4.02 2.43 -1.95 -2.68 114.38 118.10 3jvu h ARG 331 Ca -0.28 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 58.91 3jvu h ARG 331 Cb 1.25 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.79 3jvu h ARG 331 CO 0.38 0.53 -0.11 0.39 -1.51 0.00 0.00 179.97 179.65 3jvu n GLU 332 N -4.77 -0.08 0.31 0.20 1.02 -1.26 -0.34 120.64 115.72 3jvu n GLU 332 Ca -0.08 0.94 -0.18 0.00 -0.02 0.00 0.00 57.16 57.83 3jvu n GLU 332 Cb 0.31 -1.41 -0.09 0.00 -0.02 0.00 0.00 31.44 30.23 3jvu n GLU 332 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 3jvu h ASN 333 N 0.00 -1.23 -0.82 1.62 -0.26 -1.98 -2.76 115.58 110.15 3jvu h ASN 333 Ca 0.03 0.09 0.18 0.00 -0.56 0.00 0.00 56.30 56.05 3jvu h ASN 333 Cb 0.08 0.40 -0.15 0.00 -1.06 0.00 0.00 38.32 37.58 3jvu h ASN 333 CO -0.18 -0.64 -0.13 0.00 -1.06 0.00 0.00 177.43 175.42 3jvu n ALA 334 N -2.75 0.27 -0.27 -0.83 0.00 -0.15 0.42 120.51 117.20 3jvu n ALA 334 Ca -0.12 0.89 0.09 0.00 0.00 0.00 0.00 53.44 54.30 3jvu n ALA 334 Cb 0.45 -0.57 0.23 0.00 0.00 0.00 0.00 19.45 19.55 3jvu n ALA 334 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3jvu h ARG 335 N 0.00 0.32 0.00 0.00 2.43 -0.38 0.39 114.38 117.15 3jvu h ARG 335 Ca 0.43 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 3jvu h ARG 335 Cb 0.74 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 3jvu h ARG 335 CO -0.82 0.21 0.00 0.39 -1.51 0.00 0.00 179.97 178.24 3jvu n GLU 336 N -5.11 0.00 0.00 0.20 -0.58 1.43 -2.70 120.64 113.89 3jvu n GLU 336 Ca 0.17 0.44 0.00 0.00 -0.42 0.00 0.00 57.16 57.35 3jvu n GLU 336 Cb 0.54 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.91 3jvu n GLU 336 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3jvu n LYS 337 N -1.47 3.30 -1.36 3.49 5.02 -0.23 -5.07 118.16 121.84 3jvu n LYS 337 Ca 0.01 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.91 3jvu n LYS 337 Cb 0.02 -0.54 0.02 0.00 -0.02 0.00 0.00 35.03 34.51 3jvu n LYS 337 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3jvu n ALA 338 N -0.56 -2.12 0.08 7.82 0.00 -0.04 -4.91 120.51 120.78 3jvu n ALA 338 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 53.44 53.33 3jvu n ALA 338 Cb 0.00 -1.62 -0.11 0.00 0.00 0.00 0.00 19.45 17.73 3jvu n ALA 338 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3jvu h LYS 339 N 0.18 0.11 -2.82 0.00 3.64 -1.91 -3.41 116.57 112.35 3jvu h LYS 339 Ca -0.43 -0.17 -0.60 0.00 -1.27 0.00 0.00 60.65 58.18 3jvu h LYS 339 Cb 1.42 0.06 -0.40 0.00 -0.41 0.00 0.00 32.23 32.91 3jvu h LYS 339 CO 0.45 1.05 -0.78 0.96 -2.27 0.00 0.00 179.45 178.87 3jvu s ILE 340 N -2.77 1.22 0.28 2.00 -4.36 -1.26 -5.13 121.20 111.17 3jvu s ILE 340 Ca -0.01 -2.69 -0.30 0.00 -0.26 0.00 0.00 60.65 57.40 3jvu s ILE 340 Cb 0.09 -1.84 -0.13 0.00 1.25 0.00 0.00 42.46 41.83 3jvu s ILE 340 CO 0.84 -0.99 1.30 -0.81 0.24 0.00 0.00 174.94 175.52 3jvu n PRO 341 N 3.26 1.93 0.00 0.37 -0.04 -1.26 -5.14 135.00 134.13 3jvu n PRO 341 Ca 0.15 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.29 3jvu n PRO 341 Cb 0.38 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.57 3jvu n PRO 341 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61