#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xov n MET 1 N 0.00 0.00 -4.10 0.00 3.85 -1.21 -4.89 117.12 110.76 1xov n MET 1 Ca 0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 57.70 56.47 1xov n MET 1 Cb 0.00 0.00 -0.06 0.00 -1.05 0.00 0.00 33.22 32.11 1xov n MET 1 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 1xov s SER 2 N 0.00 4.72 -0.12 3.17 0.01 -1.26 -4.98 113.70 115.24 1xov s SER 2 Ca 0.00 -0.73 -0.00 0.00 1.31 0.00 0.00 55.95 56.53 1xov s SER 2 Cb 0.00 -0.77 -0.02 0.00 0.21 0.00 0.00 66.02 65.44 1xov s SER 2 CO 0.00 -0.26 -0.11 0.20 0.41 0.00 0.00 173.24 173.47 1xov s ASN 3 N -3.84 4.18 -0.04 2.44 0.01 -1.26 -1.39 114.94 115.05 1xov s ASN 3 Ca 0.37 -0.26 0.05 0.00 -0.71 0.00 0.00 52.86 52.31 1xov s ASN 3 Cb -0.03 -1.51 -0.01 0.00 0.41 0.00 0.00 41.25 40.11 1xov s ASN 3 CO 0.23 0.20 -0.18 -0.31 -1.51 0.00 0.00 177.10 175.53 1xov s TYR 4 N 0.14 1.77 -0.18 2.20 2.02 0.19 -0.65 117.35 122.83 1xov s TYR 4 Ca -0.06 -0.47 0.00 0.00 -0.37 0.00 0.00 57.07 56.18 1xov s TYR 4 Cb -0.15 -1.18 0.01 0.00 -0.40 0.00 0.00 41.96 40.25 1xov s TYR 4 CO 0.04 -0.14 -0.17 -1.12 -1.57 0.00 0.00 175.55 172.60 1xov s SER 5 N -0.09 3.38 -0.05 2.29 0.01 -1.02 -0.92 113.70 117.29 1xov s SER 5 Ca -0.01 -0.59 0.02 0.00 1.31 0.00 0.00 55.95 56.68 1xov s SER 5 Cb -0.11 -1.53 0.01 0.00 0.21 0.00 0.00 66.02 64.60 1xov s SER 5 CO 0.02 0.01 -0.10 -0.04 0.41 0.00 0.00 173.24 173.53 1xov s MET 6 N 1.26 1.34 0.13 12.44 -1.94 -0.28 -1.20 119.30 131.05 1xov s MET 6 Ca 0.04 -0.33 0.08 0.00 -1.71 0.00 0.00 55.69 53.76 1xov s MET 6 Cb -0.14 -1.17 -0.04 0.00 2.01 0.00 0.00 34.83 35.50 1xov s MET 6 CO -0.10 0.04 -0.18 -1.54 -0.01 0.00 0.00 175.02 173.23 1xov s SER 7 N 0.57 2.49 0.40 3.03 1.04 0.32 -1.29 113.70 120.26 1xov s SER 7 Ca -0.11 -0.78 -0.17 0.00 0.48 0.00 0.00 55.95 55.37 1xov s SER 7 Cb -0.14 -0.13 -0.09 0.00 0.10 0.00 0.00 66.02 65.76 1xov s SER 7 CO 0.02 -0.02 0.86 -0.60 0.98 0.00 0.00 173.24 174.49 1xov s ARG 8 N -2.40 4.07 0.56 4.02 3.52 -0.82 -0.85 118.95 127.05 1xov s ARG 8 Ca 0.11 0.88 -0.19 0.00 -0.13 0.00 0.00 55.73 56.40 1xov s ARG 8 Cb -0.07 -2.28 -0.05 0.00 -1.56 0.00 0.00 34.95 30.99 1xov s ARG 8 CO 0.05 0.00 1.13 0.20 -0.81 0.00 0.00 175.30 175.88 1xov s GLY 9 N -2.42 2.57 0.05 8.12 0.00 0.11 -4.77 107.32 110.99 1xov s GLY 9 Ca 0.58 0.80 0.00 0.00 0.00 0.00 0.00 44.72 46.10 1xov s GLY 9 CO 0.19 1.16 0.00 1.42 0.00 0.00 0.00 173.10 175.86 1xov n HIS 10 N -1.48 -1.94 -4.17 1.90 8.25 -1.26 -4.86 115.22 111.66 1xov n HIS 10 Ca 0.12 0.29 -0.17 0.00 -0.26 0.00 0.00 57.72 57.70 1xov n HIS 10 Cb 0.51 -0.50 -0.12 0.00 1.12 0.00 0.00 29.99 31.01 1xov n HIS 10 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1xov s SER 11 N -3.79 1.57 0.59 0.41 0.15 -0.51 -4.37 113.70 107.76 1xov s SER 11 Ca 0.00 -0.66 0.39 0.00 0.70 0.00 0.00 55.95 56.38 1xov s SER 11 Cb 0.00 -0.03 2.05 0.00 -1.71 0.00 0.00 66.02 66.33 1xov s SER 11 CO 0.00 -0.13 2.20 0.44 1.20 0.00 0.00 173.24 176.95 1xov h ASP 12 N 4.10 0.00 -0.37 5.45 5.19 -1.48 -1.73 116.42 127.58 1xov h ASP 12 Ca -0.39 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1xov h ASP 12 Cb 1.19 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.70 1xov h ASP 12 CO 0.44 0.00 0.00 0.29 -3.12 0.00 0.00 179.24 176.85 1xov n LYS 13 N -2.95 2.91 -2.76 3.56 4.76 -1.25 -4.72 118.16 117.70 1xov n LYS 13 Ca -0.02 -2.24 -0.04 0.00 -2.87 0.00 0.00 58.31 53.14 1xov n LYS 13 Cb 0.11 -1.40 0.01 0.00 -1.84 0.00 0.00 35.03 31.92 1xov n LYS 13 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xov s VAL 15 N 0.87 2.01 0.00 0.00 -7.23 -1.12 -1.42 120.40 113.51 1xov s VAL 15 Ca 0.30 -0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.44 1xov s VAL 15 Cb 0.00 -2.99 0.00 0.00 0.56 0.00 0.00 36.38 33.95 1xov s VAL 15 CO -0.05 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.35 1xov n GLY 16 N -3.55 1.70 3.77 2.32 0.00 -1.26 -4.78 105.19 103.39 1xov n GLY 16 Ca 0.12 -1.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.07 1xov n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xov s ALA 17 N -3.21 2.98 -0.09 4.61 0.00 -1.26 -4.89 121.76 119.91 1xov s ALA 17 Ca 0.00 0.99 -0.04 0.00 0.00 0.00 0.00 51.96 52.92 1xov s ALA 17 Cb 0.00 -3.41 0.05 0.00 0.00 0.00 0.00 23.12 19.76 1xov s ALA 17 CO 0.00 -0.73 0.17 -1.21 0.00 0.00 0.00 175.76 173.99 1xov s GLU 18 N -2.67 0.05 0.00 0.00 0.41 -1.26 -1.18 118.70 114.05 1xov s GLU 18 Ca 0.64 0.58 0.00 0.00 -0.41 0.00 0.00 54.97 55.77 1xov s GLU 18 Cb -0.30 -0.27 0.00 0.00 -1.78 0.00 0.00 34.13 31.77 1xov s GLU 18 CO 0.37 -0.31 0.00 -3.47 -0.49 0.00 0.00 175.26 171.36 1xov n ASP 19 N 5.33 0.00 -0.10 -0.19 2.03 -1.26 -4.97 116.55 117.39 1xov n ASP 19 Ca -0.05 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.17 1xov n ASP 19 Cb 0.50 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.88 1xov n ASP 19 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1xov h ILE 20 N 0.00 1.17 -2.39 5.18 2.04 -1.51 -3.43 117.51 118.57 1xov h ILE 20 Ca 0.00 -0.48 -0.51 0.00 1.00 0.00 0.00 64.86 64.87 1xov h ILE 20 Cb 0.00 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1xov h ILE 20 CO 0.00 0.17 -0.45 -0.76 0.00 0.00 0.00 178.15 177.11 1xov s LEU 21 N -9.88 4.31 -0.30 1.44 1.43 -0.61 -5.07 118.68 110.01 1xov s LEU 21 Ca -0.13 0.11 -0.13 0.00 -1.03 0.00 0.00 54.13 52.95 1xov s LEU 21 Cb 0.09 -2.86 -0.03 0.00 0.03 0.00 0.00 46.19 43.41 1xov s LEU 21 CO 0.73 -0.00 0.29 -0.55 0.23 0.00 0.00 176.35 177.05 1xov s SER 22 N -3.57 6.13 0.15 2.29 0.15 -1.26 -4.31 113.70 113.29 1xov s SER 22 Ca 0.34 0.00 -0.18 0.00 0.70 0.00 0.00 55.95 56.82 1xov s SER 22 Cb -0.10 -2.17 0.05 0.00 -1.71 0.00 0.00 66.02 62.09 1xov s SER 22 CO 0.29 -0.17 1.71 -0.08 1.20 0.00 0.00 173.24 176.18 1xov h GLU 23 N 8.34 0.08 -0.17 5.44 4.81 -1.49 -1.50 114.58 130.09 1xov h GLU 23 Ca -0.32 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.80 1xov h GLU 23 Cb 1.17 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1xov h GLU 23 CO 0.62 0.05 -0.35 -0.84 -0.73 0.00 0.00 179.01 177.77 1xov h ILE 24 N 0.08 1.29 0.14 2.32 3.07 -1.89 0.13 117.51 122.65 1xov h ILE 24 Ca 0.15 -1.40 -0.01 0.00 1.55 0.00 0.00 64.86 65.15 1xov h ILE 24 Cb 0.21 1.54 0.00 0.00 -0.27 0.00 0.00 36.82 38.30 1xov h ILE 24 CO -0.26 0.43 -0.07 0.50 -1.05 0.00 0.00 178.15 177.70 1xov h LYS 25 N 0.30 -0.18 -0.34 0.16 3.64 -1.85 -2.29 116.57 116.01 1xov h LYS 25 Ca 0.04 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 1xov h LYS 25 Cb 0.76 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.61 1xov h LYS 25 CO 0.06 0.02 -0.15 0.93 -2.27 0.00 0.00 179.45 178.04 1xov h GLU 26 N -0.36 0.70 -0.55 1.90 4.39 -1.17 -2.88 114.58 116.63 1xov h GLU 26 Ca -0.02 -0.30 -0.00 0.00 0.34 0.00 0.00 59.36 59.38 1xov h GLU 26 Cb 0.28 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.88 1xov h GLU 26 CO 0.03 0.90 0.33 0.00 -1.16 0.00 0.00 179.01 179.11 1xov h ALA 27 N 0.79 1.54 -0.48 3.43 0.00 -0.75 -1.51 119.26 122.28 1xov h ALA 27 Ca 0.08 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1xov h ALA 27 Cb 0.68 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1xov h ALA 27 CO 0.05 0.40 -0.18 1.49 0.00 0.00 0.00 179.25 181.00 1xov h GLU 28 N 0.75 0.98 -0.60 0.00 4.81 -1.34 0.11 114.58 119.29 1xov h GLU 28 Ca 0.20 -0.40 -0.04 0.00 -0.13 0.00 0.00 59.36 58.98 1xov h GLU 28 Cb -0.02 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 1xov h GLU 28 CO -0.04 1.08 0.21 0.87 -0.73 0.00 0.00 179.01 180.40 1xov h LYS 29 N 0.83 0.91 -0.25 1.92 1.57 -1.20 -0.31 116.57 120.03 1xov h LYS 29 Ca 0.11 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 1xov h LYS 29 Cb 0.76 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1xov h LYS 29 CO 0.06 0.80 -0.11 0.28 -0.57 0.00 0.00 179.45 179.92 1xov h VAL 30 N 0.84 1.30 -0.20 0.50 2.07 -1.14 -1.79 116.25 117.82 1xov h VAL 30 Ca 0.19 -1.17 0.04 0.00 0.82 0.00 0.00 66.70 66.59 1xov h VAL 30 Cb 0.25 1.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 1xov h VAL 30 CO -0.01 0.36 -0.04 0.25 0.02 0.00 0.00 177.57 178.16 1xov h LEU 31 N 0.25 -0.16 -0.83 2.57 7.12 -0.64 0.11 115.31 123.73 1xov h LEU 31 Ca 0.06 0.06 -0.00 0.00 0.13 0.00 0.00 57.88 58.13 1xov h LEU 31 Cb 0.60 0.11 -0.04 0.00 -0.53 0.00 0.00 40.66 40.80 1xov h LEU 31 CO 0.03 -0.05 0.52 0.78 -0.13 0.00 0.00 178.44 179.59 1xov h ASN 32 N 0.02 0.99 -0.08 1.25 2.35 -1.01 0.22 115.58 119.32 1xov h ASN 32 Ca 0.10 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1xov h ASN 32 Cb 0.14 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 1xov h ASN 32 CO -0.20 0.75 0.02 0.00 -1.65 0.00 0.00 177.43 176.35 1xov h ALA 33 N 1.28 0.10 -0.41 -0.83 0.00 -0.94 0.13 119.26 118.60 1xov h ALA 33 Ca 0.30 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1xov h ALA 33 Cb -0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1xov h ALA 33 CO -0.06 -0.29 0.24 0.00 0.00 0.00 0.00 179.25 179.14 1xov h ALA 34 N 0.83 0.52 0.01 0.00 0.00 -0.82 -0.77 119.26 119.03 1xov h ALA 34 Ca 0.02 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1xov h ALA 34 Cb 0.22 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1xov h ALA 34 CO -0.00 0.03 -0.11 1.03 0.00 0.00 0.00 179.25 180.20 1xov h SER 35 N 0.54 -0.31 -0.63 0.00 0.87 -0.86 -0.23 113.55 112.93 1xov h SER 35 Ca 0.15 0.05 0.05 0.00 -1.23 0.00 0.00 61.79 60.80 1xov h SER 35 Cb 0.03 0.13 -0.05 0.00 -0.44 0.00 0.00 62.40 62.07 1xov h SER 35 CO -0.03 -0.16 0.35 0.44 -0.53 0.00 0.00 176.83 176.90 1xov h ASP 36 N -0.19 0.52 -0.41 6.23 3.32 -0.87 -0.12 116.42 124.89 1xov h ASP 36 Ca 0.04 0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.01 1xov h ASP 36 Cb 0.24 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1xov h ASP 36 CO -0.10 0.34 -0.14 -0.08 -1.72 0.00 0.00 179.24 177.54 1xov h GLU 37 N 0.65 0.83 -0.55 3.56 4.57 -0.87 -1.07 114.58 121.69 1xov h GLU 37 Ca 0.28 -0.34 -0.07 0.00 -1.18 0.00 0.00 59.36 58.05 1xov h GLU 37 Cb 0.16 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.69 1xov h GLU 37 CO -0.17 0.96 0.06 -0.07 -1.18 0.00 0.00 179.01 178.62 1xov h LEU 38 N 0.64 0.85 -0.39 1.64 3.38 -0.66 -0.56 115.31 120.21 1xov h LEU 38 Ca 0.10 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1xov h LEU 38 Cb 0.68 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1xov h LEU 38 CO 0.05 0.87 -0.10 0.11 0.09 0.00 0.00 178.44 179.46 1xov h LYS 39 N 0.84 0.76 -0.68 1.13 1.57 -0.93 -1.87 116.57 117.40 1xov h LYS 39 Ca 0.17 -0.30 0.08 0.00 -1.87 0.00 0.00 60.65 58.74 1xov h LYS 39 Cb 0.41 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 1xov h LYS 39 CO 0.01 0.90 0.45 -0.09 -0.57 0.00 0.00 179.45 180.15 1xov h ARG 40 N 0.57 0.58 0.00 3.15 2.43 -0.87 -0.89 114.38 119.35 1xov h ARG 40 Ca 0.10 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1xov h ARG 40 Cb 0.63 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1xov h ARG 40 CO 0.04 0.38 0.00 0.39 -1.51 0.00 0.00 179.97 179.27 1xov n GLU 41 N -4.48 0.62 -0.04 0.20 -0.58 -0.25 -4.90 120.64 111.21 1xov n GLU 41 Ca 0.11 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 1xov n GLU 41 Cb 0.31 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 1xov n GLU 41 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xov n GLY 42 N 0.83 0.83 3.93 0.62 0.00 -0.34 -1.24 105.19 109.82 1xov n GLY 42 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1xov n GLY 42 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xov s HIS 43 N -2.03 3.38 -0.17 1.61 3.76 -0.74 -3.35 115.29 117.75 1xov s HIS 43 Ca 0.00 0.51 -0.15 0.00 -0.15 0.00 0.00 55.06 55.27 1xov s HIS 43 Cb 0.00 -2.31 -0.04 0.00 1.11 0.00 0.00 32.58 31.33 1xov s HIS 43 CO 0.00 -0.33 0.36 -0.80 -0.85 0.00 0.00 174.74 173.12 1xov s ASN 44 N -4.17 6.47 -0.06 1.40 0.01 -0.48 -4.26 114.94 113.84 1xov s ASN 44 Ca 0.48 0.55 0.01 0.00 -0.71 0.00 0.00 52.86 53.19 1xov s ASN 44 Cb -0.10 -2.22 0.02 0.00 0.41 0.00 0.00 41.25 39.36 1xov s ASN 44 CO 0.41 0.01 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.24 1xov s VAL 45 N 0.85 0.87 -0.07 1.60 1.01 -1.26 -0.64 120.40 122.76 1xov s VAL 45 Ca 0.19 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1xov s VAL 45 Cb -0.14 -0.84 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 1xov s VAL 45 CO 0.07 0.30 -0.07 -0.54 0.00 0.00 0.00 175.10 174.86 1xov s LYS 46 N 0.92 2.79 0.16 2.72 1.02 -0.10 -4.98 119.74 122.27 1xov s LYS 46 Ca -0.10 -0.55 0.07 0.00 0.02 0.00 0.00 55.97 55.40 1xov s LYS 46 Cb -0.15 -2.60 -0.04 0.00 -0.52 0.00 0.00 37.83 34.52 1xov s LYS 46 CO 0.01 0.64 -0.15 0.95 -0.92 0.00 0.00 175.35 175.87 1xov s THR 47 N -0.74 1.61 -0.06 2.17 -4.23 -1.26 -1.13 115.64 112.01 1xov s THR 47 Ca 0.11 -1.95 -0.03 0.00 -1.18 0.00 0.00 61.69 58.65 1xov s THR 47 Cb -0.11 -1.80 0.03 0.00 1.34 0.00 0.00 72.50 71.96 1xov s THR 47 CO 0.02 -0.45 0.13 0.12 -0.54 0.00 0.00 174.62 173.90 1xov s PHE 48 N -2.41 -0.14 -0.07 3.99 5.36 -0.41 -4.96 117.98 119.34 1xov s PHE 48 Ca 0.16 0.42 -0.01 0.00 -0.96 0.00 0.00 56.93 56.54 1xov s PHE 48 Cb -0.04 -0.07 0.03 0.00 -0.34 0.00 0.00 43.02 42.60 1xov s PHE 48 CO 0.05 -0.14 -0.01 0.42 -1.46 0.00 0.00 175.22 174.08 1xov s ILE 49 N 0.92 0.44 -0.35 3.12 1.01 -1.26 -1.95 121.20 123.13 1xov s ILE 49 Ca -0.07 0.04 -0.29 0.00 0.00 0.00 0.00 60.65 60.33 1xov s ILE 49 Cb -0.09 -0.56 0.02 0.00 0.01 0.00 0.00 42.46 41.84 1xov s ILE 49 CO -0.04 0.25 1.08 -0.62 0.00 0.00 0.00 174.94 175.61 1xov s ASP 50 N 1.67 6.86 0.00 3.58 -1.08 -1.26 -4.92 116.67 121.51 1xov s ASP 50 Ca 0.01 0.91 0.22 0.00 -0.52 0.00 0.00 52.55 53.16 1xov s ASP 50 Cb -0.13 -2.54 -0.07 0.00 -1.46 0.00 0.00 42.92 38.72 1xov s ASP 50 CO -0.04 -0.95 1.02 0.54 0.52 0.00 0.00 175.17 176.25 1xov n ARG 51 N 7.06 0.39 0.00 4.34 5.12 -1.26 -1.67 116.66 130.64 1xov n ARG 51 Ca 0.12 -0.31 0.00 0.00 -1.93 0.00 0.00 57.85 55.72 1xov n ARG 51 Cb 0.48 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.28 1xov n ARG 51 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1xov n THR 52 N -1.03 0.00 -1.72 0.55 -2.24 -1.26 -3.91 114.28 104.67 1xov n THR 52 Ca 0.06 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.41 1xov n THR 52 Cb 0.37 -0.31 -0.02 0.00 -2.10 0.00 0.00 70.33 68.28 1xov n THR 52 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1xov n SER 53 N -1.40 3.38 -0.39 3.42 7.64 -1.26 -4.74 113.62 120.28 1xov n SER 53 Ca 0.00 1.15 0.08 0.00 1.01 0.00 0.00 58.87 61.11 1xov n SER 53 Cb 0.22 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 61.90 1xov n SER 53 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1xov n THR 54 N 1.88 0.00 -4.32 0.44 -2.24 -1.26 -3.29 114.28 105.48 1xov n THR 54 Ca 0.09 -0.35 -0.17 0.00 -2.27 0.00 0.00 64.05 61.35 1xov n THR 54 Cb 0.35 1.20 -0.10 0.00 -2.10 0.00 0.00 70.33 69.68 1xov n THR 54 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1xov s THR 55 N -1.83 1.54 0.14 4.28 -4.23 -1.26 -4.74 115.64 109.53 1xov s THR 55 Ca 0.14 -2.16 -0.15 0.00 -1.18 0.00 0.00 61.69 58.34 1xov s THR 55 Cb 0.13 -2.02 0.01 0.00 1.34 0.00 0.00 72.50 71.96 1xov s THR 55 CO 0.38 -0.61 1.68 1.56 -0.54 0.00 0.00 174.62 177.09 1xov h GLN 56 N 2.61 0.67 -0.49 3.99 4.20 -1.93 -1.75 115.11 122.40 1xov h GLN 56 Ca -0.38 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.13 1xov h GLN 56 Cb 1.21 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.87 1xov h GLN 56 CO 0.63 0.63 0.01 0.66 -0.67 0.00 0.00 178.83 180.09 1xov h SER 57 N 0.57 0.84 -0.72 1.46 4.64 -1.99 -1.02 113.55 117.34 1xov h SER 57 Ca 0.15 -0.30 -0.01 0.00 -0.47 0.00 0.00 61.79 61.16 1xov h SER 57 Cb 0.22 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.05 1xov h SER 57 CO -0.01 0.93 0.41 0.00 -0.87 0.00 0.00 176.83 177.29 1xov h ALA 58 N 0.94 0.92 -0.07 5.18 0.00 -1.96 -0.51 119.26 123.75 1xov h ALA 58 Ca 0.14 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1xov h ALA 58 Cb 0.49 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1xov h ALA 58 CO 0.02 0.42 0.04 -0.97 0.00 0.00 0.00 179.25 178.76 1xov h ASN 59 N 0.99 0.09 -0.59 0.00 -0.00 -1.05 -0.73 115.58 114.29 1xov h ASN 59 Ca 0.25 -0.07 -0.09 0.00 -0.00 0.00 0.00 56.30 56.40 1xov h ASN 59 Cb 0.01 -0.02 -0.02 0.00 -0.00 0.00 0.00 38.32 38.29 1xov h ASN 59 CO -0.04 0.13 0.03 -0.07 -0.00 0.00 0.00 177.43 177.48 1xov h LEU 60 N 0.04 1.01 -0.38 0.34 3.38 -1.08 -0.80 115.31 117.83 1xov h LEU 60 Ca 0.03 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1xov h LEU 60 Cb 0.06 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1xov h LEU 60 CO -0.00 1.04 0.23 0.78 0.09 0.00 0.00 178.44 180.58 1xov h ASN 61 N 0.96 0.39 -0.48 -0.43 2.35 -0.98 -1.00 115.58 116.38 1xov h ASN 61 Ca 0.18 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.88 1xov h ASN 61 Cb 0.51 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 1xov h ASN 61 CO 0.02 0.28 0.12 0.50 -1.65 0.00 0.00 177.43 176.70 1xov h LYS 62 N 0.48 0.78 0.21 0.81 3.64 -0.72 -1.08 116.57 120.68 1xov h LYS 62 Ca 0.14 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1xov h LYS 62 Cb -0.02 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1xov h LYS 62 CO -0.05 0.76 -0.10 0.82 -2.27 0.00 0.00 179.45 178.61 1xov h ILE 63 N 0.66 0.83 -0.19 2.00 2.04 -1.04 -1.62 117.51 120.19 1xov h ILE 63 Ca 0.15 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 1xov h ILE 63 Cb 0.33 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 1xov h ILE 63 CO 0.00 0.04 0.10 0.58 0.00 0.00 0.00 178.15 178.87 1xov h VAL 64 N -0.37 1.12 -0.71 1.67 2.07 -1.15 -1.43 116.25 117.45 1xov h VAL 64 Ca -0.03 -0.33 0.11 0.00 0.82 0.00 0.00 66.70 67.27 1xov h VAL 64 Cb 0.28 0.99 -0.08 0.00 -1.52 0.00 0.00 31.29 30.96 1xov h VAL 64 CO 0.05 0.11 0.33 0.78 0.02 0.00 0.00 177.57 178.86 1xov h ASN 65 N 0.19 0.39 -0.29 0.57 2.35 -1.19 -1.01 115.58 116.59 1xov h ASN 65 Ca 0.07 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 1xov h ASN 65 Cb 0.09 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 1xov h ASN 65 CO -0.01 0.21 0.14 -0.25 -1.65 0.00 0.00 177.43 175.87 1xov h TRP 66 N 0.54 0.41 -0.86 1.19 7.01 -1.02 -1.32 115.95 121.90 1xov h TRP 66 Ca 0.36 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.38 1xov h TRP 66 Cb 0.44 -0.13 -0.05 0.00 -2.10 0.00 0.00 29.16 27.32 1xov h TRP 66 CO -0.13 0.36 0.56 0.45 -2.79 0.00 0.00 178.44 176.89 1xov h HIS 67 N 0.33 1.04 0.00 2.65 3.86 -0.80 -1.50 115.15 120.74 1xov h HIS 67 Ca 0.10 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1xov h HIS 67 Cb 0.10 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 28.22 1xov h HIS 67 CO -0.02 0.60 0.00 -0.91 0.86 0.00 0.00 177.93 178.46 1xov h ASN 68 N 1.08 0.00 0.67 2.45 2.35 -0.97 -2.11 115.58 119.05 1xov h ASN 68 Ca 0.34 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.09 1xov h ASN 68 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1xov h ASN 68 CO -0.11 0.00 -0.47 0.00 -1.65 0.00 0.00 177.43 175.20 1xov n ALA 69 N -1.93 3.21 -3.41 -0.83 0.00 -0.52 -4.53 120.51 112.50 1xov n ALA 69 Ca 0.02 -0.29 -0.26 0.00 0.00 0.00 0.00 53.44 52.91 1xov n ALA 69 Cb 0.32 -1.18 -0.09 0.00 0.00 0.00 0.00 19.45 18.50 1xov n ALA 69 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xov n ASN 70 N -1.68 1.26 -4.59 0.00 3.02 -0.79 -5.07 115.26 107.39 1xov n ASN 70 Ca 0.05 -2.86 -0.40 0.00 -0.03 0.00 0.00 54.58 51.34 1xov n ASN 70 Cb 0.37 -0.64 0.03 0.00 -0.61 0.00 0.00 39.78 38.92 1xov n ASN 70 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1xov n PRO 71 N 1.74 1.10 -3.72 3.52 -0.02 -1.25 -4.78 135.00 131.58 1xov n PRO 71 Ca 0.25 0.40 -0.10 0.00 -2.02 0.00 0.00 63.50 62.04 1xov n PRO 71 Cb 0.46 -2.03 -0.05 0.00 -0.02 0.00 0.00 33.50 31.86 1xov n PRO 71 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xov s ALA 72 N -1.41 -0.72 0.19 3.55 0.00 -1.26 -4.86 121.76 117.24 1xov s ALA 72 Ca 0.68 -0.26 -0.06 0.00 0.00 0.00 0.00 51.96 52.31 1xov s ALA 72 Cb -0.50 0.71 0.09 0.00 0.00 0.00 0.00 23.12 23.43 1xov s ALA 72 CO 0.54 -0.65 1.56 -0.44 0.00 0.00 0.00 175.76 176.76 1xov h ASP 73 N 2.41 0.84 -3.74 0.00 3.32 -1.26 -3.44 116.42 114.55 1xov h ASP 73 Ca -0.33 -0.35 -0.22 0.00 0.02 0.00 0.00 57.03 56.15 1xov h ASP 73 Cb 1.25 -0.23 -0.28 0.00 0.22 0.00 0.00 39.33 40.28 1xov h ASP 73 CO 0.47 1.09 -0.65 -0.69 -1.72 0.00 0.00 179.24 177.74 1xov s VAL 74 N -4.44 -0.00 -0.14 -1.35 1.01 -1.23 -4.42 120.40 109.83 1xov s VAL 74 Ca -0.10 0.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.86 1xov s VAL 74 Cb 0.12 -0.10 -0.03 0.00 0.00 0.00 0.00 36.38 36.37 1xov s VAL 74 CO 0.85 0.01 -0.00 -1.00 0.00 0.00 0.00 175.10 174.96 1xov s HIS 75 N 0.10 3.12 -0.03 5.22 3.76 0.88 -2.45 115.29 125.89 1xov s HIS 75 Ca -0.01 -0.05 0.04 0.00 -0.15 0.00 0.00 55.06 54.89 1xov s HIS 75 Cb -0.01 -1.93 -0.00 0.00 1.11 0.00 0.00 32.58 31.74 1xov s HIS 75 CO -0.00 0.17 -0.15 0.42 -0.85 0.00 0.00 174.74 174.33 1xov s ILE 76 N -0.03 1.26 -0.11 0.60 1.09 -0.34 -1.41 121.20 122.26 1xov s ILE 76 Ca 0.03 -0.63 0.01 0.00 -1.10 0.00 0.00 60.65 58.96 1xov s ILE 76 Cb -0.13 -1.08 -0.01 0.00 -1.06 0.00 0.00 42.46 40.18 1xov s ILE 76 CO 0.02 0.37 -0.15 -0.55 -0.10 0.00 0.00 174.94 174.52 1xov s SER 77 N 0.00 3.85 -0.24 3.58 0.15 -0.78 -0.52 113.70 119.74 1xov s SER 77 Ca -0.02 -0.35 -0.06 0.00 0.70 0.00 0.00 55.95 56.22 1xov s SER 77 Cb -0.10 -1.46 -0.02 0.00 -1.71 0.00 0.00 66.02 62.73 1xov s SER 77 CO 0.01 0.19 0.03 -0.69 1.20 0.00 0.00 173.24 173.98 1xov s VAL 78 N 0.20 3.92 0.22 4.45 1.01 -0.03 -0.72 120.40 129.46 1xov s VAL 78 Ca -0.09 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.59 1xov s VAL 78 Cb -0.16 -2.83 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 1xov s VAL 78 CO 0.06 0.35 -0.01 -1.00 0.00 0.00 0.00 175.10 174.50 1xov s HIS 79 N 1.55 1.54 0.20 5.22 3.76 0.28 -0.71 115.29 127.14 1xov s HIS 79 Ca 0.06 -0.91 0.10 0.00 -0.15 0.00 0.00 55.06 54.16 1xov s HIS 79 Cb -0.15 -0.89 -0.04 0.00 1.11 0.00 0.00 32.58 32.61 1xov s HIS 79 CO 0.01 -0.03 -0.20 -0.51 -0.85 0.00 0.00 174.74 173.16 1xov s LEU 80 N -3.30 2.48 0.41 0.89 1.02 -1.26 -1.01 118.68 117.90 1xov s LEU 80 Ca 0.28 -0.91 0.08 0.00 0.02 0.00 0.00 54.13 53.59 1xov s LEU 80 Cb 0.05 -0.99 0.00 0.00 0.02 0.00 0.00 46.19 45.28 1xov s LEU 80 CO 0.08 0.03 0.53 0.21 0.02 0.00 0.00 176.35 177.22 1xov s ASN 81 N -2.88 5.64 0.07 2.29 3.84 0.89 -4.84 114.94 119.94 1xov s ASN 81 Ca 0.21 -0.42 -0.08 0.00 0.21 0.00 0.00 52.86 52.78 1xov s ASN 81 Cb -0.06 -0.73 -0.01 0.00 -0.55 0.00 0.00 41.25 39.90 1xov s ASN 81 CO 0.09 -0.70 0.15 0.00 -2.79 0.00 0.00 177.10 173.86 1xov s ALA 82 N -2.34 -0.14 0.00 1.71 0.00 -1.26 -0.87 121.76 118.86 1xov s ALA 82 Ca 0.53 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.87 1xov s ALA 82 Cb -0.09 0.40 0.00 0.00 0.00 0.00 0.00 23.12 23.43 1xov s ALA 82 CO 0.32 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 176.05 1xov n GLY 83 N 0.18 0.62 2.31 0.00 0.00 -1.26 -4.86 105.19 102.18 1xov n GLY 83 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 1xov n GLY 83 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xov n LYS 84 N 0.00 -1.82 -0.48 1.61 5.02 -1.26 -5.01 118.16 116.23 1xov n LYS 84 Ca 0.00 0.75 -0.13 0.00 -2.02 0.00 0.00 58.31 56.91 1xov n LYS 84 Cb 0.00 -5.24 0.10 0.00 -0.02 0.00 0.00 35.03 29.87 1xov n LYS 84 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xov n GLY 85 N -0.64 -2.46 3.04 0.72 0.00 -1.26 -5.01 105.19 99.57 1xov n GLY 85 Ca -0.16 -1.49 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 1xov n GLY 85 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xov s THR 86 N -1.88 -0.01 0.00 2.61 -1.32 -1.26 -4.80 115.64 108.98 1xov s THR 86 Ca 0.30 0.04 0.00 0.00 -1.21 0.00 0.00 61.69 60.82 1xov s THR 86 Cb -0.03 -0.27 0.00 0.00 -1.51 0.00 0.00 72.50 70.69 1xov s THR 86 CO 0.23 0.02 0.00 0.61 -2.21 0.00 0.00 174.62 173.27 1xov n GLY 87 N 3.28 -0.59 3.53 6.08 0.00 -1.26 -4.64 105.19 111.59 1xov n GLY 87 Ca -0.16 -2.18 -0.33 0.00 0.00 0.00 0.00 46.02 43.35 1xov n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xov s VAL 88 N 0.00 3.34 0.07 1.61 1.01 -0.59 -4.18 120.40 121.66 1xov s VAL 88 Ca 0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 1xov s VAL 88 Cb 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 36.38 34.03 1xov s VAL 88 CO 0.00 0.57 0.20 -1.83 0.00 0.00 0.00 175.10 174.04 1xov s GLU 89 N -0.84 0.79 -0.06 2.72 -1.05 -1.00 -0.01 118.70 119.26 1xov s GLU 89 Ca 0.12 -0.83 0.01 0.00 -0.15 0.00 0.00 54.97 54.12 1xov s GLU 89 Cb -0.11 0.33 0.02 0.00 -0.44 0.00 0.00 34.13 33.93 1xov s GLU 89 CO 0.02 -0.25 -0.05 0.08 0.95 0.00 0.00 175.26 176.01 1xov s VAL 90 N -3.39 0.61 -0.02 1.83 1.01 -0.94 -1.09 120.40 118.41 1xov s VAL 90 Ca 0.01 -0.13 -0.10 0.00 0.00 0.00 0.00 61.98 61.76 1xov s VAL 90 Cb 0.03 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.71 1xov s VAL 90 CO -0.08 0.26 0.31 0.26 0.00 0.00 0.00 175.10 175.84 1xov s TRP 91 N 1.15 3.65 0.12 5.22 0.52 0.24 -0.83 118.94 129.00 1xov s TRP 91 Ca -0.07 0.76 -0.02 0.00 0.02 0.00 0.00 56.10 56.79 1xov s TRP 91 Cb -0.14 -2.12 -0.04 0.00 -1.15 0.00 0.00 33.47 30.02 1xov s TRP 91 CO -0.01 0.65 0.07 1.52 0.02 0.00 0.00 176.95 179.20 1xov s TYR 92 N -1.14 0.73 -0.06 -1.98 -0.85 -0.49 -0.93 117.35 112.61 1xov s TYR 92 Ca 0.23 -1.13 -0.30 0.00 -0.52 0.00 0.00 57.07 55.35 1xov s TYR 92 Cb -0.14 -0.41 -0.04 0.00 0.38 0.00 0.00 41.96 41.75 1xov s TYR 92 CO 0.12 -0.51 1.34 -0.47 -1.52 0.00 0.00 175.55 174.50 1xov s TYR 93 N -4.01 2.84 -0.07 -3.49 5.04 -1.26 -1.26 117.35 115.15 1xov s TYR 93 Ca 0.19 0.90 -0.37 0.00 -2.44 0.00 0.00 57.07 55.36 1xov s TYR 93 Cb 0.07 -3.58 -0.15 0.00 0.35 0.00 0.00 41.96 38.65 1xov s TYR 93 CO -0.01 -2.10 1.65 0.00 -1.34 0.00 0.00 175.55 173.75 1xov n ALA 94 N 5.84 0.16 0.00 3.97 0.00 -0.62 -1.43 120.51 128.42 1xov n ALA 94 Ca 0.13 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1xov n ALA 94 Cb 0.45 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1xov n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xov n GLY 95 N 3.71 1.28 3.55 0.00 0.00 -1.26 -4.96 105.19 107.52 1xov n GLY 95 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 1xov n GLY 95 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xov s ASP 96 N -2.22 5.99 0.29 1.61 2.15 -0.52 -4.89 116.67 119.08 1xov s ASP 96 Ca 0.00 -0.62 0.01 0.00 0.43 0.00 0.00 52.55 52.37 1xov s ASP 96 Cb 0.00 -2.56 0.43 0.00 -0.30 0.00 0.00 42.92 40.50 1xov s ASP 96 CO 0.00 -1.94 1.78 -0.08 -0.17 0.00 0.00 175.17 174.76 1xov h GLU 97 N 10.95 0.63 -0.28 4.34 4.57 -1.95 -0.62 114.58 132.21 1xov h GLU 97 Ca -0.10 -0.18 -0.03 0.00 -1.18 0.00 0.00 59.36 57.87 1xov h GLU 97 Cb 1.05 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.56 1xov h GLU 97 CO 1.30 0.70 0.05 -0.22 -1.18 0.00 0.00 179.01 179.66 1xov h LYS 98 N 0.58 0.45 -0.73 1.92 3.64 -1.98 -2.21 116.57 118.24 1xov h LYS 98 Ca 0.11 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 1xov h LYS 98 Cb 0.48 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 1xov h LYS 98 CO 0.03 0.56 0.31 0.78 -2.27 0.00 0.00 179.45 178.86 1xov h GLY 99 N 0.27 1.15 0.98 5.01 0.00 -1.83 -2.63 103.07 106.01 1xov h GLY 99 Ca 0.08 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 1xov h GLY 99 CO 0.00 0.56 0.24 -0.09 0.00 0.00 0.00 176.54 177.25 1xov h ARG 100 N 1.05 0.55 -0.67 4.80 2.43 -0.92 -0.23 114.38 121.41 1xov h ARG 100 Ca 0.25 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.31 1xov h ARG 100 Cb 0.17 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1xov h ARG 100 CO -0.02 0.42 0.22 0.87 -1.51 0.00 0.00 179.97 179.95 1xov h LYS 101 N 0.53 1.01 -0.49 0.20 1.57 -1.24 -0.09 116.57 118.06 1xov h LYS 101 Ca 0.14 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 1xov h LYS 101 Cb 0.02 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 1xov h LYS 101 CO -0.03 0.86 0.04 -0.07 -0.57 0.00 0.00 179.45 179.68 1xov h LEU 102 N 0.98 0.81 -0.42 2.94 3.38 -1.19 -2.58 115.31 119.24 1xov h LEU 102 Ca 0.22 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1xov h LEU 102 Cb 0.26 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1xov h LEU 102 CO -0.01 0.89 0.13 0.00 0.09 0.00 0.00 178.44 179.54 1xov h ALA 103 N 0.95 0.55 -0.31 1.53 0.00 -0.51 -0.22 119.26 121.25 1xov h ALA 103 Ca 0.14 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1xov h ALA 103 Cb 0.45 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1xov h ALA 103 CO 0.02 0.20 0.16 0.28 0.00 0.00 0.00 179.25 179.90 1xov h VAL 104 N 0.53 0.99 -0.34 0.00 2.07 -0.95 -1.21 116.25 117.34 1xov h VAL 104 Ca 0.13 -0.11 -0.13 0.00 0.82 0.00 0.00 66.70 67.41 1xov h VAL 104 Cb 0.27 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1xov h VAL 104 CO -0.00 0.06 -0.30 -0.33 0.02 0.00 0.00 177.57 177.01 1xov h GLU 105 N 0.32 0.80 -0.36 1.57 4.39 -1.19 -2.33 114.58 117.78 1xov h GLU 105 Ca 0.13 -0.41 -0.05 0.00 0.34 0.00 0.00 59.36 59.36 1xov h GLU 105 Cb 0.04 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1xov h GLU 105 CO -0.09 1.04 0.01 0.82 -1.16 0.00 0.00 179.01 179.64 1xov h ILE 106 N 0.58 1.25 -0.35 3.13 2.04 -0.98 -1.57 117.51 121.60 1xov h ILE 106 Ca 0.06 -0.95 -0.00 0.00 1.00 0.00 0.00 64.86 64.96 1xov h ILE 106 Cb 0.88 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 1xov h ILE 106 CO 0.08 0.32 0.20 -1.28 0.00 0.00 0.00 178.15 177.47 1xov h SER 107 N 0.44 0.43 -0.61 1.72 0.87 -1.22 -0.96 113.55 114.23 1xov h SER 107 Ca 0.10 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1xov h SER 107 Cb 0.44 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.26 1xov h SER 107 CO 0.02 0.38 0.35 0.00 -0.53 0.00 0.00 176.83 177.05 1xov h ALA 108 N 1.07 0.78 -0.36 6.23 0.00 -1.32 -1.57 119.26 124.09 1xov h ALA 108 Ca 0.13 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1xov h ALA 108 Cb 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1xov h ALA 108 CO -0.02 0.28 -0.02 0.87 0.00 0.00 0.00 179.25 180.36 1xov h LYS 109 N 0.83 0.65 -0.36 0.00 1.79 -1.04 -1.67 116.57 116.75 1xov h LYS 109 Ca 0.22 -0.22 -0.02 0.00 -2.18 0.00 0.00 60.65 58.46 1xov h LYS 109 Cb 0.01 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.59 1xov h LYS 109 CO -0.04 0.77 0.16 0.52 -1.08 0.00 0.00 179.45 179.79 1xov h MET 110 N 0.45 0.53 -0.80 3.15 2.86 -1.09 -1.37 114.93 118.66 1xov h MET 110 Ca 0.10 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1xov h MET 110 Cb 0.49 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.02 1xov h MET 110 CO 0.02 0.49 0.53 0.00 1.06 0.00 0.00 176.91 179.02 1xov h ALA 111 N 1.01 1.02 -0.56 6.32 0.00 -1.19 -0.81 119.26 125.05 1xov h ALA 111 Ca 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1xov h ALA 111 Cb 0.14 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1xov h ALA 111 CO -0.01 0.43 0.14 -0.22 0.00 0.00 0.00 179.25 179.59 1xov h LYS 112 N 1.09 0.88 -0.54 0.00 3.64 -1.19 -0.27 116.57 120.19 1xov h LYS 112 Ca 0.29 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1xov h LYS 112 Cb -0.12 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.55 1xov h LYS 112 CO -0.06 0.82 0.29 0.00 -2.27 0.00 0.00 179.45 178.23 1xov h ALA 113 N 1.02 0.69 0.00 5.00 0.00 -0.76 -3.14 119.26 122.08 1xov h ALA 113 Ca 0.18 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1xov h ALA 113 Cb 0.33 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1xov h ALA 113 CO 0.00 0.22 -0.30 -0.07 0.00 0.00 0.00 179.25 179.10 1xov h LEU 114 N 0.72 0.00 0.14 0.00 3.38 -1.06 -3.48 115.31 115.01 1xov h LEU 114 Ca 0.19 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.01 1xov h LEU 114 Cb 0.06 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.83 1xov h LEU 114 CO -0.03 0.30 -0.22 0.61 0.09 0.00 0.00 178.44 179.19 1xov n GLY 115 N 1.06 0.22 3.62 0.83 0.00 -0.16 -4.81 105.19 105.95 1xov n GLY 115 Ca 0.02 -0.46 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 1xov n GLY 115 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xov s LEU 116 N -2.68 2.98 0.54 0.99 1.43 -0.90 -5.05 118.68 115.99 1xov s LEU 116 Ca 0.10 -0.93 -0.22 0.00 -1.03 0.00 0.00 54.13 52.05 1xov s LEU 116 Cb -0.04 -1.40 -0.05 0.00 0.03 0.00 0.00 46.19 44.73 1xov s LEU 116 CO 0.12 -0.17 1.36 -2.84 0.23 0.00 0.00 176.35 175.05 1xov s PRO 117 N -3.69 3.19 -0.47 1.29 0.02 -1.26 -4.54 135.00 129.53 1xov s PRO 117 Ca 0.34 2.23 -0.21 0.00 0.02 0.00 0.00 61.00 63.38 1xov s PRO 117 Cb -0.02 -2.28 0.03 0.00 0.02 0.00 0.00 34.50 32.25 1xov s PRO 117 CO 0.19 -1.15 0.70 1.21 -0.33 0.00 0.00 177.00 177.62 1xov s ASN 118 N -0.94 6.32 0.34 2.53 2.47 -1.26 -1.55 114.94 122.85 1xov s ASN 118 Ca 0.71 -0.40 0.26 0.00 0.42 0.00 0.00 52.86 53.84 1xov s ASN 118 Cb -0.40 -2.34 0.81 0.00 -1.45 0.00 0.00 41.25 37.87 1xov s ASN 118 CO 0.48 -0.88 1.75 0.03 -3.72 0.00 0.00 177.10 174.76 1xov h ARG 119 N 8.97 0.00 0.00 0.43 3.08 -0.73 -3.47 114.38 122.66 1xov h ARG 119 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.79 1xov h ARG 119 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.14 1xov h ARG 119 CO 0.94 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 180.25 1xov n GLY 120 N 0.76 -3.66 3.76 0.04 0.00 -1.14 -4.93 105.19 100.03 1xov n GLY 120 Ca 0.04 -1.95 -0.39 0.00 0.00 0.00 0.00 46.02 43.72 1xov n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xov s ALA 121 N -1.05 3.30 -0.04 4.61 0.00 -1.26 -2.21 121.76 125.11 1xov s ALA 121 Ca 0.00 0.70 0.01 0.00 0.00 0.00 0.00 51.96 52.67 1xov s ALA 121 Cb 0.00 -3.25 0.02 0.00 0.00 0.00 0.00 23.12 19.89 1xov s ALA 121 CO 0.00 0.04 -0.03 0.15 0.00 0.00 0.00 175.76 175.92 1xov s LYS 122 N -1.59 0.68 0.11 0.00 1.02 -0.01 -4.93 119.74 115.02 1xov s LYS 122 Ca 0.46 -0.06 -0.18 0.00 0.02 0.00 0.00 55.97 56.22 1xov s LYS 122 Cb -0.26 -0.74 -0.07 0.00 -0.52 0.00 0.00 37.83 36.24 1xov s LYS 122 CO 0.33 -0.10 0.58 0.00 -0.92 0.00 0.00 175.35 175.24 1xov s ALA 123 N 0.95 3.57 0.04 5.17 0.00 -1.26 -1.40 121.76 128.82 1xov s ALA 123 Ca -0.11 -0.01 -0.24 0.00 0.00 0.00 0.00 51.96 51.60 1xov s ALA 123 Cb -0.14 -2.61 0.06 0.00 0.00 0.00 0.00 23.12 20.42 1xov s ALA 123 CO -0.00 0.41 0.56 -0.08 0.00 0.00 0.00 175.76 176.65 1xov s THR 124 N -1.27 0.02 -0.16 0.00 -1.32 -0.39 -4.80 115.64 107.72 1xov s THR 124 Ca 0.33 -0.16 0.16 0.00 -1.21 0.00 0.00 61.69 60.81 1xov s THR 124 Cb -0.18 -0.97 0.32 0.00 -1.51 0.00 0.00 72.50 70.16 1xov s THR 124 CO 0.19 -0.09 1.21 0.29 -2.21 0.00 0.00 174.62 174.01 1xov n LYS 125 N 0.46 1.96 0.00 7.08 5.02 -1.26 -1.59 118.16 129.83 1xov n LYS 125 Ca -0.18 -2.51 0.08 0.00 -2.02 0.00 0.00 58.31 53.68 1xov n LYS 125 Cb 0.60 -1.53 0.06 0.00 -0.02 0.00 0.00 35.03 34.14 1xov n LYS 125 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1xov n ASP 126 N -1.01 2.22 -4.52 4.39 10.43 -1.26 -4.95 116.55 121.85 1xov n ASP 126 Ca 0.15 -1.61 -0.36 0.00 2.57 0.00 0.00 54.79 55.55 1xov n ASP 126 Cb 0.65 0.07 -0.12 0.00 1.84 0.00 0.00 41.12 43.57 1xov n ASP 126 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1xov s LEU 127 N -1.43 3.57 0.22 0.64 1.43 -1.26 -4.99 118.68 116.87 1xov s LEU 127 Ca 0.18 -0.10 -0.08 0.00 -1.03 0.00 0.00 54.13 53.10 1xov s LEU 127 Cb 0.13 -1.94 0.27 0.00 0.03 0.00 0.00 46.19 44.69 1xov s LEU 127 CO 0.23 0.05 1.83 -0.09 0.23 0.00 0.00 176.35 178.59 1xov h ARG 128 N 7.64 0.78 -0.28 1.70 9.65 -1.98 -0.35 114.38 131.54 1xov h ARG 128 Ca -0.37 -0.05 0.06 0.00 -1.10 0.00 0.00 59.98 58.53 1xov h ARG 128 Cb 1.18 -0.18 -0.06 0.00 -1.39 0.00 0.00 29.97 29.52 1xov h ARG 128 CO 0.62 0.52 -0.13 0.35 2.80 0.00 0.00 179.97 184.12 1xov h PHE 129 N 0.80 -0.31 -0.10 2.20 3.57 -1.94 -0.08 116.94 121.08 1xov h PHE 129 Ca 0.32 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.72 1xov h PHE 129 Cb 0.17 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1xov h PHE 129 CO -0.06 -0.20 -0.53 -0.07 -2.23 0.00 0.00 178.31 175.23 1xov h LEU 130 N -0.09 0.32 -0.31 0.59 3.38 -1.80 -2.68 115.31 114.71 1xov h LEU 130 Ca 0.15 -0.17 -0.20 0.00 0.09 0.00 0.00 57.88 57.75 1xov h LEU 130 Cb 0.31 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1xov h LEU 130 CO -0.34 0.79 -0.81 0.78 0.09 0.00 0.00 178.44 178.95 1xov h ASN 131 N 0.23 0.48 0.00 -0.43 2.35 -0.62 -3.37 115.58 114.22 1xov h ASN 131 Ca 0.01 -0.34 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 1xov h ASN 131 Cb 1.00 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.23 1xov h ASN 131 CO 0.08 1.11 -1.46 -1.20 -1.65 0.00 0.00 177.43 174.31 1xov n SER 132 N -3.79 0.96 -4.68 5.81 7.64 -0.08 -4.87 113.62 114.60 1xov n SER 132 Ca -0.05 -0.30 -0.43 0.00 1.01 0.00 0.00 58.87 59.11 1xov n SER 132 Cb 0.76 1.53 -0.02 0.00 -1.01 0.00 0.00 64.21 65.46 1xov n SER 132 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xov s THR 133 N -3.00 4.53 0.21 0.44 2.01 -1.01 -4.95 115.64 113.87 1xov s THR 133 Ca -0.02 1.83 -0.06 0.00 0.31 0.00 0.00 61.69 63.75 1xov s THR 133 Cb 0.12 -4.18 0.08 0.00 0.01 0.00 0.00 72.50 68.53 1xov s THR 133 CO 0.71 -0.03 1.68 0.11 -0.69 0.00 0.00 174.62 176.40 1xov h LYS 134 N 7.37 0.96 0.00 4.92 6.56 -1.91 -3.46 116.57 131.01 1xov h LYS 134 Ca -0.30 -0.29 -0.21 0.00 -1.06 0.00 0.00 60.65 58.78 1xov h LYS 134 Cb 1.14 -0.09 0.06 0.00 -0.57 0.00 0.00 32.23 32.77 1xov h LYS 134 CO 0.89 0.96 0.13 0.41 -2.06 0.00 0.00 179.45 179.77 1xov n GLY 135 N -0.49 -0.31 3.72 3.86 0.00 -1.26 -4.99 105.19 105.73 1xov n GLY 135 Ca 0.03 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 1xov n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xov s THR 136 N -1.85 2.67 0.01 2.61 2.01 -1.26 -4.88 115.64 114.94 1xov s THR 136 Ca 0.33 0.49 0.01 0.00 0.31 0.00 0.00 61.69 62.83 1xov s THR 136 Cb -0.01 -3.32 -0.01 0.00 0.01 0.00 0.00 72.50 69.17 1xov s THR 136 CO 0.23 0.05 -0.03 0.00 -0.69 0.00 0.00 174.62 174.17 1xov s ALA 137 N 0.94 0.21 0.06 7.40 0.00 -1.26 -0.09 121.76 129.03 1xov s ALA 137 Ca 0.68 -0.26 0.02 0.00 0.00 0.00 0.00 51.96 52.40 1xov s ALA 137 Cb -0.43 0.00 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 1xov s ALA 137 CO 0.33 -0.00 -0.08 0.14 0.00 0.00 0.00 175.76 176.15 1xov s VAL 138 N -0.46 0.65 -0.21 0.00 -7.23 -0.50 -4.40 120.40 108.24 1xov s VAL 138 Ca -0.04 -1.34 0.01 0.00 -1.81 0.00 0.00 61.98 58.81 1xov s VAL 138 Cb -0.04 -0.95 0.05 0.00 0.56 0.00 0.00 36.38 36.00 1xov s VAL 138 CO -0.00 -0.50 -0.09 -0.22 -0.31 0.00 0.00 175.10 173.98 1xov s LEU 139 N -2.00 2.44 -0.02 1.32 0.20 -0.11 -1.86 118.68 118.64 1xov s LEU 139 Ca -0.03 -1.00 -0.27 0.00 0.69 0.00 0.00 54.13 53.52 1xov s LEU 139 Cb -0.06 -1.24 -0.04 0.00 -0.43 0.00 0.00 46.19 44.43 1xov s LEU 139 CO -0.01 -0.17 0.84 -0.76 -0.29 0.00 0.00 176.35 175.96 1xov s LEU 140 N 1.38 4.36 -0.59 -0.68 1.02 0.10 -0.59 118.68 123.68 1xov s LEU 140 Ca -0.03 1.44 -0.05 0.00 0.02 0.00 0.00 54.13 55.51 1xov s LEU 140 Cb -0.17 -3.33 0.15 0.00 0.02 0.00 0.00 46.19 42.86 1xov s LEU 140 CO -0.07 -0.17 0.42 -1.61 0.02 0.00 0.00 176.35 174.94 1xov s GLU 141 N 0.79 2.56 0.16 1.70 0.41 -0.25 -0.55 118.70 123.51 1xov s GLU 141 Ca 0.44 -2.30 -0.16 0.00 -0.41 0.00 0.00 54.97 52.54 1xov s GLU 141 Cb -0.20 -3.80 0.05 0.00 -1.78 0.00 0.00 34.13 28.41 1xov s GLU 141 CO 0.23 -1.17 1.79 0.28 -0.49 0.00 0.00 175.26 175.90 1xov h VAL 142 N 5.53 1.00 -2.17 2.63 2.07 -1.30 -2.66 116.25 121.34 1xov h VAL 142 Ca -0.05 -0.15 0.24 0.00 0.82 0.00 0.00 66.70 67.57 1xov h VAL 142 Cb 0.99 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 31.23 1xov h VAL 142 CO 0.73 0.08 0.69 0.00 0.02 0.00 0.00 177.57 179.09 1xov s PHE 144 N -2.39 3.59 -0.99 0.00 0.08 -1.26 -0.08 117.98 116.94 1xov s PHE 144 Ca 0.20 1.15 0.27 0.00 0.12 0.00 0.00 56.93 58.68 1xov s PHE 144 Cb -0.00 -2.44 0.96 0.00 -0.57 0.00 0.00 43.02 40.96 1xov s PHE 144 CO 0.01 0.37 1.74 1.33 -0.10 0.00 0.00 175.22 178.57 1xov n VAL 145 N 0.66 0.02 -1.94 -0.44 0.24 -0.05 -4.18 118.33 112.64 1xov n VAL 145 Ca -0.04 -0.01 -0.04 0.00 -2.04 0.00 0.00 64.34 62.21 1xov n VAL 145 Cb 0.52 -0.23 0.11 0.00 -1.47 0.00 0.00 33.84 32.77 1xov n VAL 145 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1xov n ASP 146 N -1.52 2.66 -3.73 -1.34 5.68 -1.26 -1.15 116.55 115.88 1xov n ASP 146 Ca 0.06 -3.49 -0.17 0.00 -0.50 0.00 0.00 54.79 50.70 1xov n ASP 146 Cb 0.34 -0.44 -0.17 0.00 -1.14 0.00 0.00 41.12 39.72 1xov n ASP 146 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1xov s ARG 147 N -3.03 -0.04 0.27 0.11 6.06 -1.26 -4.60 118.95 116.47 1xov s ARG 147 Ca 0.41 0.28 -0.00 0.00 -2.50 0.00 0.00 55.73 53.91 1xov s ARG 147 Cb 0.38 -0.34 0.39 0.00 0.06 0.00 0.00 34.95 35.44 1xov s ARG 147 CO -0.04 -0.23 1.77 0.87 -2.50 0.00 0.00 175.30 175.17 1xov h LYS 148 N 7.73 0.70 -0.34 5.12 1.57 -1.93 -1.73 116.57 127.69 1xov h LYS 148 Ca -0.33 -0.19 0.06 0.00 -1.87 0.00 0.00 60.65 58.32 1xov h LYS 148 Cb 1.12 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 33.30 1xov h LYS 148 CO 0.35 0.75 0.01 0.93 -0.57 0.00 0.00 179.45 180.91 1xov h GLU 149 N 0.65 0.10 -0.59 3.15 3.07 -1.97 0.25 114.58 119.24 1xov h GLU 149 Ca 0.12 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 58.88 1xov h GLU 149 Cb 0.47 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.34 1xov h GLU 149 CO 0.02 0.07 -0.00 -0.44 -1.40 0.00 0.00 179.01 177.26 1xov h ASP 150 N 0.10 1.01 -0.23 1.42 3.45 -1.81 -1.55 116.42 118.81 1xov h ASP 150 Ca 0.16 -0.28 -0.01 0.00 0.43 0.00 0.00 57.03 57.33 1xov h ASP 150 Cb 0.22 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.71 1xov h ASP 150 CO -0.27 1.06 0.12 0.00 -1.57 0.00 0.00 179.24 178.58 1xov h ALA 151 N 1.04 0.30 -0.73 3.45 0.00 -0.99 -1.71 119.26 120.61 1xov h ALA 151 Ca 0.17 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1xov h ALA 151 Cb 0.55 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 1xov h ALA 151 CO 0.03 -0.15 0.37 -0.97 0.00 0.00 0.00 179.25 178.53 1xov h ASN 152 N 0.25 0.49 -0.04 0.00 -1.24 -0.75 -2.59 115.58 111.71 1xov h ASN 152 Ca 0.08 0.06 -0.00 0.00 0.71 0.00 0.00 56.30 57.15 1xov h ASN 152 Cb 0.10 -0.03 -0.00 0.00 0.73 0.00 0.00 38.32 39.12 1xov h ASN 152 CO -0.01 0.28 0.01 0.00 -1.29 0.00 0.00 177.43 176.41 1xov h ALA 153 N 1.44 0.05 0.00 1.57 0.00 -1.07 -2.72 119.26 118.52 1xov h ALA 153 Ca 0.36 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1xov h ALA 153 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1xov h ALA 153 CO -0.27 -0.31 0.00 0.97 0.00 0.00 0.00 179.25 179.64 1xov h ILE 154 N -0.19 0.00 -0.30 0.00 2.10 -1.25 -2.72 117.51 115.15 1xov h ILE 154 Ca 0.01 -0.57 0.00 0.00 1.08 0.00 0.00 64.86 65.38 1xov h ILE 154 Cb 0.27 1.54 0.00 0.00 -1.09 0.00 0.00 36.82 37.55 1xov h ILE 154 CO 0.00 0.00 0.00 1.41 -1.08 0.00 0.00 178.15 178.48 1xov n HIS 155 N -2.98 0.38 -1.70 2.19 8.25 -0.98 -4.58 115.22 115.80 1xov n HIS 155 Ca 0.02 -0.19 -0.34 0.00 -0.26 0.00 0.00 57.72 56.94 1xov n HIS 155 Cb 0.34 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.51 1xov n HIS 155 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1xov s LYS 156 N -1.62 2.58 0.20 -0.41 1.02 -1.03 -4.91 119.74 115.57 1xov s LYS 156 Ca 0.35 1.67 -0.31 0.00 0.02 0.00 0.00 55.97 57.70 1xov s LYS 156 Cb 0.20 -1.90 -0.11 0.00 -0.52 0.00 0.00 37.83 35.51 1xov s LYS 156 CO 0.29 -1.47 1.61 0.45 -0.92 0.00 0.00 175.35 175.30 1xov s SER 157 N -2.06 6.51 -0.15 2.83 0.15 -1.26 -1.95 113.70 117.76 1xov s SER 157 Ca 0.73 2.73 0.00 0.00 0.70 0.00 0.00 55.95 60.11 1xov s SER 157 Cb -0.27 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.44 1xov s SER 157 CO 0.40 -0.87 0.00 0.61 1.20 0.00 0.00 173.24 174.58 1xov n GLY 158 N 3.56 0.41 0.26 9.45 0.00 -1.26 -4.92 105.19 112.69 1xov n GLY 158 Ca 0.13 -0.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 1xov n GLY 158 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1xov h MET 159 N 0.48 0.75 -0.78 1.61 -1.53 -1.67 -1.72 114.93 112.07 1xov h MET 159 Ca -0.03 -0.29 -0.04 0.00 -3.44 0.00 0.00 59.70 55.90 1xov h MET 159 Cb 0.46 -0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.44 1xov h MET 159 CO 0.04 0.89 0.32 1.88 0.14 0.00 0.00 176.91 180.18 1xov h TYR 160 N 0.66 1.17 -0.39 1.39 0.05 -1.83 0.18 116.97 118.20 1xov h TYR 160 Ca 0.10 -0.08 0.04 0.00 0.05 0.00 0.00 58.73 58.83 1xov h TYR 160 Cb 0.69 -0.35 -0.04 0.00 1.01 0.00 0.00 36.73 38.04 1xov h TYR 160 CO 0.03 0.88 0.17 -0.44 -1.05 0.00 0.00 178.16 177.75 1xov h ASP 161 N 1.12 0.22 -0.29 3.88 3.32 -1.88 -0.10 116.42 122.69 1xov h ASP 161 Ca 0.26 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.31 1xov h ASP 161 Cb 0.20 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 1xov h ASP 161 CO -0.02 0.17 0.10 0.11 -1.72 0.00 0.00 179.24 177.87 1xov h LYS 162 N 0.35 0.53 -0.06 3.56 1.57 -0.73 -1.64 116.57 120.15 1xov h LYS 162 Ca 0.17 -0.08 -0.21 0.00 -1.87 0.00 0.00 60.65 58.67 1xov h LYS 162 Cb 0.12 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1xov h LYS 162 CO -0.15 0.48 -0.82 -0.07 -0.57 0.00 0.00 179.45 178.33 1xov h LEU 163 N 0.52 0.60 -1.00 2.94 3.38 -0.62 -1.63 115.31 119.50 1xov h LEU 163 Ca 0.12 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 1xov h LEU 163 Cb 0.18 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 1xov h LEU 163 CO -0.01 1.19 0.58 1.23 0.09 0.00 0.00 178.44 181.53 1xov h GLY 164 N 1.10 1.35 0.86 0.83 0.00 -0.51 -1.28 103.07 105.42 1xov h GLY 164 Ca -0.05 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 1xov h GLY 164 CO 0.15 0.53 0.04 -2.22 0.00 0.00 0.00 176.54 175.03 1xov h ILE 165 N 1.29 1.14 -0.56 2.60 2.04 -1.23 -1.55 117.51 121.25 1xov h ILE 165 Ca 0.34 -0.43 0.07 0.00 1.00 0.00 0.00 64.86 65.83 1xov h ILE 165 Cb -0.08 1.27 -0.06 0.00 -0.74 0.00 0.00 36.82 37.21 1xov h ILE 165 CO -0.07 0.13 0.25 0.00 0.00 0.00 0.00 178.15 178.46 1xov h ALA 166 N 0.88 0.72 -0.41 1.87 0.00 -1.00 0.15 119.26 121.47 1xov h ALA 166 Ca 0.03 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1xov h ALA 166 Cb 0.17 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1xov h ALA 166 CO -0.00 -0.12 -0.15 0.82 0.00 0.00 0.00 179.25 179.80 1xov h ILE 167 N 0.47 1.28 -0.43 0.00 2.04 -1.21 0.38 117.51 120.04 1xov h ILE 167 Ca 0.26 -1.27 -0.05 0.00 1.00 0.00 0.00 64.86 64.80 1xov h ILE 167 Cb 0.24 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1xov h ILE 167 CO -0.22 0.42 0.06 0.00 0.00 0.00 0.00 178.15 178.41 1xov h ALA 168 N 0.83 0.57 -0.32 1.87 0.00 -0.81 -0.03 119.26 121.37 1xov h ALA 168 Ca 0.10 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 1xov h ALA 168 Cb 0.69 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1xov h ALA 168 CO 0.05 0.30 -0.30 0.93 0.00 0.00 0.00 179.25 180.23 1xov h GLU 169 N 0.57 0.69 -0.55 0.00 5.08 -0.68 -0.96 114.58 118.72 1xov h GLU 169 Ca 0.13 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 1xov h GLU 169 Cb 0.40 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1xov h GLU 169 CO 0.01 0.91 0.10 0.78 -1.00 0.00 0.00 179.01 179.81 1xov h GLY 170 N 0.98 0.94 1.01 -3.84 0.00 -0.68 0.15 103.07 101.64 1xov h GLY 170 Ca 0.07 -0.57 -0.17 0.00 0.00 0.00 0.00 47.33 46.66 1xov h GLY 170 CO 0.07 0.54 -0.54 1.41 0.00 0.00 0.00 176.54 178.02 1xov h LEU 171 N 0.83 0.79 0.00 3.11 3.38 -0.81 -3.38 115.31 119.23 1xov h LEU 171 Ca 0.18 -0.59 -0.00 0.00 0.09 0.00 0.00 57.88 57.56 1xov h LEU 171 Cb 0.36 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1xov h LEU 171 CO 0.01 1.24 -1.84 0.35 0.09 0.00 0.00 178.44 178.28 1xov n THR 172 N -4.13 0.11 -1.12 0.22 -2.24 -0.38 -4.97 114.28 101.76 1xov n THR 172 Ca -0.06 -0.51 -0.04 0.00 -2.27 0.00 0.00 64.05 61.16 1xov n THR 172 Cb 0.62 -0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 1xov n THR 172 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xov n GLY 173 N 1.25 0.69 3.06 3.38 0.00 0.53 -5.01 105.19 109.09 1xov n GLY 173 Ca -0.03 -0.45 -0.24 0.00 0.00 0.00 0.00 46.02 45.29 1xov n GLY 173 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xov s LYS 174 N -1.84 1.52 0.24 1.61 2.20 -1.25 -5.06 119.74 117.15 1xov s LYS 174 Ca 0.00 -0.46 -0.30 0.00 -0.36 0.00 0.00 55.97 54.85 1xov s LYS 174 Cb 0.00 -1.32 -0.10 0.00 -1.51 0.00 0.00 37.83 34.91 1xov s LYS 174 CO 0.00 0.13 1.42 0.99 -0.36 0.00 0.00 175.35 177.53 1xov s THR 175 N 0.29 2.76 0.47 3.43 2.01 -1.26 -4.43 115.64 118.91 1xov s THR 175 Ca -0.07 0.63 -0.21 0.00 0.31 0.00 0.00 61.69 62.36 1xov s THR 175 Cb -0.12 -3.41 -0.09 0.00 0.01 0.00 0.00 72.50 68.90 1xov s THR 175 CO 0.02 0.10 1.03 0.68 -0.69 0.00 0.00 174.62 175.76 1xov s VAL 176 N 0.02 3.86 0.13 3.82 -7.23 -1.26 -4.98 120.40 114.77 1xov s VAL 176 Ca 0.59 1.18 -0.08 0.00 -1.81 0.00 0.00 61.98 61.87 1xov s VAL 176 Cb -0.41 -3.49 -0.15 0.00 0.56 0.00 0.00 36.38 32.89 1xov s VAL 176 CO 0.42 -0.23 1.33 0.00 -0.31 0.00 0.00 175.10 176.31 1xov h ALA 177 N 1.68 0.39 -1.10 1.32 0.00 -1.97 -3.39 119.26 116.20 1xov h ALA 177 Ca -0.49 -0.64 -0.76 0.00 0.00 0.00 0.00 54.91 53.02 1xov h ALA 177 Cb 1.21 -0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.81 1xov h ALA 177 CO 0.60 0.73 1.82 0.00 0.00 0.00 0.00 179.25 182.40 1xov n ALA 178 N -2.57 5.23 -2.93 0.00 0.00 -1.26 -4.93 120.51 114.05 1xov n ALA 178 Ca -0.07 -4.37 -0.34 0.00 0.00 0.00 0.00 53.44 48.66 1xov n ALA 178 Cb 0.77 -2.90 -0.12 0.00 0.00 0.00 0.00 19.45 17.20 1xov n ALA 178 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xov s LYS 179 N 0.06 3.74 0.31 0.00 1.02 -1.26 -5.02 119.74 118.59 1xov s LYS 179 Ca 0.39 -0.48 -0.00 0.00 0.02 0.00 0.00 55.97 55.89 1xov s LYS 179 Cb 0.08 -2.99 0.51 0.00 -0.52 0.00 0.00 37.83 34.90 1xov s LYS 179 CO 0.02 0.24 1.97 -0.97 -0.92 0.00 0.00 175.35 175.68 1xov h ASN 180 N 6.74 0.89 -0.46 2.83 -1.24 -1.97 -0.47 115.58 121.91 1xov h ASN 180 Ca -0.33 -0.02 0.13 0.00 0.71 0.00 0.00 56.30 56.80 1xov h ASN 180 Cb 1.18 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 40.00 1xov h ASN 180 CO 0.64 0.63 0.49 -0.65 -1.29 0.00 0.00 177.43 177.25 1xov h PRO 181 N 1.04 0.00 -0.52 6.67 0.11 -2.00 -1.90 132.00 135.40 1xov h PRO 181 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.41 1xov h PRO 181 Cb -0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.06 1xov h PRO 181 CO -0.08 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.80 1xov n ASN 182 N -3.70 3.43 -4.80 -2.05 3.02 -0.19 -4.97 115.26 106.00 1xov n ASN 182 Ca 0.08 -1.97 -0.37 0.00 -0.03 0.00 0.00 54.58 52.29 1xov n ASN 182 Cb 0.68 -0.34 -0.06 0.00 -0.61 0.00 0.00 39.78 39.44 1xov n ASN 182 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1xov s ARG 183 N -1.06 4.35 0.03 3.52 3.52 -0.72 -0.96 118.95 127.64 1xov s ARG 183 Ca 0.37 1.00 0.01 0.00 -0.13 0.00 0.00 55.73 56.97 1xov s ARG 183 Cb 0.20 -2.90 -0.02 0.00 -1.56 0.00 0.00 34.95 30.66 1xov s ARG 183 CO 0.26 0.39 -0.05 -1.01 -0.81 0.00 0.00 175.30 174.08 1xov s HIS 184 N -1.51 0.46 -0.02 5.12 3.76 0.84 -4.97 115.29 118.97 1xov s HIS 184 Ca 0.44 -0.58 0.05 0.00 -0.15 0.00 0.00 55.06 54.81 1xov s HIS 184 Cb -0.18 -0.30 -0.01 0.00 1.11 0.00 0.00 32.58 33.20 1xov s HIS 184 CO 0.22 -0.16 -0.16 -1.12 -0.85 0.00 0.00 174.74 172.67 1xov s SER 185 N -1.70 1.92 0.00 1.40 0.01 -1.26 -0.88 113.70 113.18 1xov s SER 185 Ca -0.11 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 56.85 1xov s SER 185 Cb -0.08 -0.32 0.00 0.00 0.21 0.00 0.00 66.02 65.83 1xov s SER 185 CO -0.01 0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.42 1xov n GLY 186 N 2.84 1.85 3.25 3.44 0.00 -0.51 -5.01 105.19 111.06 1xov n GLY 186 Ca -0.16 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 1xov n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xov s ALA 187 N -1.00 -0.59 0.19 4.61 0.00 -0.51 -1.69 121.76 122.77 1xov s ALA 187 Ca 0.00 -0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.45 1xov s ALA 187 Cb 0.00 0.46 -0.10 0.00 0.00 0.00 0.00 23.12 23.48 1xov s ALA 187 CO 0.00 -0.50 1.49 0.08 0.00 0.00 0.00 175.76 176.83 1xov s VAL 188 N -3.26 2.74 0.96 0.00 1.01 -0.25 -1.88 120.40 119.72 1xov s VAL 188 Ca -0.00 0.57 -0.13 0.00 0.00 0.00 0.00 61.98 62.42 1xov s VAL 188 Cb 0.02 -3.36 0.16 0.00 0.00 0.00 0.00 36.38 33.20 1xov s VAL 188 CO -0.08 0.06 1.13 0.68 0.00 0.00 0.00 175.10 176.89 1xov s VAL 189 N 0.70 1.98 -0.20 2.92 -7.23 -0.63 -0.79 120.40 117.14 1xov s VAL 189 Ca 0.65 0.00 0.15 0.00 -1.81 0.00 0.00 61.98 60.97 1xov s VAL 189 Cb -0.42 -2.67 0.46 0.00 0.56 0.00 0.00 36.38 34.31 1xov s VAL 189 CO 0.36 0.00 1.36 -0.90 -0.31 0.00 0.00 175.10 175.60 1xov n ASP 190 N -3.95 2.98 -4.23 4.85 5.75 -1.26 -4.35 116.55 116.34 1xov n ASP 190 Ca 0.07 -3.31 -0.17 0.00 -0.01 0.00 0.00 54.79 51.37 1xov n ASP 190 Cb 0.59 -0.54 -0.11 0.00 -1.03 0.00 0.00 41.12 40.03 1xov n ASP 190 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1xov s SER 191 N -2.42 1.85 0.12 -1.12 0.01 -1.26 -0.61 113.70 110.27 1xov s SER 191 Ca 0.40 -0.84 0.07 0.00 1.31 0.00 0.00 55.95 56.89 1xov s SER 191 Cb 0.35 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.50 1xov s SER 191 CO 0.04 -0.20 -0.16 0.68 0.41 0.00 0.00 173.24 174.01 1xov s VAL 192 N -2.38 1.45 0.16 3.43 -7.23 0.07 -4.89 120.40 111.01 1xov s VAL 192 Ca 0.09 -1.68 -0.20 0.00 -1.81 0.00 0.00 61.98 58.38 1xov s VAL 192 Cb -0.03 -1.54 -0.08 0.00 0.56 0.00 0.00 36.38 35.29 1xov s VAL 192 CO 0.02 -0.32 0.67 -2.16 -0.31 0.00 0.00 175.10 173.00 1xov s PRO 193 N -2.48 4.28 -0.31 4.82 0.04 -1.26 -0.35 135.00 139.74 1xov s PRO 193 Ca 0.09 0.85 -0.20 0.00 0.04 0.00 0.00 61.00 61.77 1xov s PRO 193 Cb -0.06 -3.07 -0.01 0.00 0.04 0.00 0.00 34.50 31.40 1xov s PRO 193 CO 0.04 0.51 0.63 1.41 0.04 0.00 0.00 177.00 179.63 1xov s MET 194 N -1.56 3.89 0.18 4.56 1.75 0.22 -4.58 119.30 123.76 1xov s MET 194 Ca 0.37 0.30 0.05 0.00 -1.25 0.00 0.00 55.69 55.16 1xov s MET 194 Cb -0.19 -3.73 -0.04 0.00 2.84 0.00 0.00 34.83 33.72 1xov s MET 194 CO 0.21 -0.58 0.14 -0.51 -0.65 0.00 0.00 175.02 173.63 1xov s LEU 195 N 2.62 3.80 0.39 4.11 1.43 0.69 -0.32 118.68 131.40 1xov s LEU 195 Ca 0.25 -0.15 0.21 0.00 -1.03 0.00 0.00 54.13 53.41 1xov s LEU 195 Cb -0.15 -2.40 0.57 0.00 0.03 0.00 0.00 46.19 44.24 1xov s LEU 195 CO 0.12 0.06 1.67 0.77 0.23 0.00 0.00 176.35 179.20 1xov h SER 196 N 2.30 0.00 -5.07 2.29 4.64 -1.81 0.26 113.55 116.16 1xov h SER 196 Ca -0.48 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.62 1xov h SER 196 Cb 1.21 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.15 1xov h SER 196 CO 0.63 0.28 -0.65 -0.54 -0.87 0.00 0.00 176.83 175.68 1xov s LYS 197 N -3.36 1.01 -1.46 4.77 1.02 -1.26 -4.72 119.74 115.74 1xov s LYS 197 Ca 0.03 -1.49 -0.11 0.00 0.02 0.00 0.00 55.97 54.42 1xov s LYS 197 Cb 0.09 0.05 0.04 0.00 -0.52 0.00 0.00 37.83 37.48 1xov s LYS 197 CO 0.68 -0.22 2.41 -1.33 -0.92 0.00 0.00 175.35 175.97 1xov n MET 198 N -0.16 3.52 -3.55 1.68 2.81 -1.26 -4.73 117.12 115.42 1xov n MET 198 Ca -0.05 -2.78 -0.02 0.00 -1.81 0.00 0.00 57.70 53.03 1xov n MET 198 Cb 0.64 -2.97 -0.05 0.00 -0.71 0.00 0.00 33.22 30.12 1xov n MET 198 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1xov s ASP 199 N 2.02 -0.94 0.50 7.83 3.68 -1.26 -5.04 116.67 123.45 1xov s ASP 199 Ca 0.54 1.28 0.33 0.00 2.13 0.00 0.00 52.55 56.82 1xov s ASP 199 Cb 0.15 2.03 1.57 0.00 -1.45 0.00 0.00 42.92 45.23 1xov s ASP 199 CO -0.06 -0.23 2.00 -0.26 0.13 0.00 0.00 175.17 176.74 1xov h PHE 200 N 8.04 0.00 -0.17 -5.34 0.04 -1.85 -1.59 116.94 116.07 1xov h PHE 200 Ca -0.18 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.59 1xov h PHE 200 Cb 1.11 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.26 1xov h PHE 200 CO 0.17 0.00 0.00 1.63 -0.60 0.00 0.00 178.31 179.51 1xov n LYS 201 N -2.81 1.42 -0.76 1.51 5.02 -1.26 -4.86 118.16 116.42 1xov n LYS 201 Ca -0.00 -0.65 -0.04 0.00 -2.02 0.00 0.00 58.31 55.60 1xov n LYS 201 Cb 0.19 -1.16 0.02 0.00 -0.02 0.00 0.00 35.03 34.05 1xov n LYS 201 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1xov n SER 202 N 0.01 0.16 -4.77 4.39 3.41 -0.60 -5.05 113.62 111.17 1xov n SER 202 Ca 0.07 -1.14 -0.39 0.00 -0.26 0.00 0.00 58.87 57.15 1xov n SER 202 Cb 0.16 -0.11 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 1xov n SER 202 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1xov s SER 203 N -1.63 6.98 -0.19 4.04 0.01 -1.26 -4.95 113.70 116.70 1xov s SER 203 Ca 0.10 1.17 -0.29 0.00 1.31 0.00 0.00 55.95 58.24 1xov s SER 203 Cb -0.00 -2.36 -0.01 0.00 0.21 0.00 0.00 66.02 63.85 1xov s SER 203 CO 0.07 0.12 1.23 -2.84 0.41 0.00 0.00 173.24 172.23 1xov s PRO 204 N -0.27 4.21 0.20 12.44 0.02 -1.26 -2.64 135.00 147.70 1xov s PRO 204 Ca 0.31 1.58 -0.00 0.00 0.02 0.00 0.00 61.00 62.91 1xov s PRO 204 Cb -0.18 -3.76 0.13 0.00 0.02 0.00 0.00 34.50 30.71 1xov s PRO 204 CO 0.17 -0.73 1.49 0.82 -0.33 0.00 0.00 177.00 178.42 1xov h ILE 205 N 5.53 1.37 -2.22 2.83 1.08 -1.00 -3.47 117.51 121.62 1xov h ILE 205 Ca -0.25 -2.02 -0.07 0.00 -0.39 0.00 0.00 64.86 62.13 1xov h ILE 205 Cb 1.10 2.00 -0.20 0.00 -3.07 0.00 0.00 36.82 36.65 1xov h ILE 205 CO 0.98 0.61 0.08 -0.75 -0.69 0.00 0.00 178.15 178.37 1xov s LYS 206 N -3.74 0.94 -0.08 2.37 2.20 -1.19 -5.02 119.74 115.20 1xov s LYS 206 Ca -0.06 0.28 -0.00 0.00 -0.36 0.00 0.00 55.97 55.83 1xov s LYS 206 Cb 0.11 0.44 -0.03 0.00 -1.51 0.00 0.00 37.83 36.84 1xov s LYS 206 CO 0.83 -0.26 -0.05 -1.64 -0.36 0.00 0.00 175.35 173.86 1xov s MET 207 N -0.97 2.93 -0.17 4.03 -1.94 -1.26 -0.61 119.30 121.31 1xov s MET 207 Ca -0.10 -0.52 -0.01 0.00 -1.71 0.00 0.00 55.69 53.35 1xov s MET 207 Cb -0.02 -2.67 -0.01 0.00 2.01 0.00 0.00 34.83 34.14 1xov s MET 207 CO 0.07 0.60 -0.11 0.71 -0.01 0.00 0.00 175.02 176.29 1xov s TYR 208 N -0.64 2.86 0.46 -0.03 2.02 0.52 -4.90 117.35 117.65 1xov s TYR 208 Ca 0.10 -0.89 -0.21 0.00 -0.37 0.00 0.00 57.07 55.69 1xov s TYR 208 Cb -0.12 -1.95 -0.08 0.00 -0.40 0.00 0.00 41.96 39.41 1xov s TYR 208 CO 0.02 -0.42 1.05 0.21 -1.57 0.00 0.00 175.55 174.84 1xov s LYS 209 N 0.91 3.88 0.24 -0.62 2.20 -1.26 -0.75 119.74 124.34 1xov s LYS 209 Ca -0.02 1.44 -0.29 0.00 -0.36 0.00 0.00 55.97 56.73 1xov s LYS 209 Cb -0.15 -2.24 -0.15 0.00 -1.51 0.00 0.00 37.83 33.78 1xov s LYS 209 CO -0.00 -0.37 0.95 0.00 -0.36 0.00 0.00 175.35 175.57 1xov n ALA 210 N -0.70 -0.94 0.00 3.13 0.00 0.22 -1.21 120.51 121.02 1xov n ALA 210 Ca 0.08 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1xov n ALA 210 Cb 0.51 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 18.03 1xov n ALA 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xov n GLY 211 N 1.57 2.39 3.82 0.00 0.00 -0.40 -4.83 105.19 107.74 1xov n GLY 211 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1xov n GLY 211 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xov s SER 212 N -3.53 6.58 0.02 1.61 1.04 -0.35 -4.61 113.70 114.47 1xov s SER 212 Ca 0.00 1.71 -0.00 0.00 0.48 0.00 0.00 55.95 58.14 1xov s SER 212 Cb 0.00 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 1xov s SER 212 CO 0.00 -0.62 0.14 -0.55 0.98 0.00 0.00 173.24 173.19 1xov s SER 213 N -2.51 5.99 0.20 7.02 0.15 -1.26 -0.67 113.70 122.62 1xov s SER 213 Ca 0.62 0.20 -0.16 0.00 0.70 0.00 0.00 55.95 57.31 1xov s SER 213 Cb -0.12 -1.78 0.02 0.00 -1.71 0.00 0.00 66.02 62.44 1xov s SER 213 CO 0.23 0.23 0.50 -1.48 1.20 0.00 0.00 173.24 173.92 1xov s LEU 214 N -2.09 0.17 -0.13 3.45 2.34 -0.49 -5.00 118.68 116.93 1xov s LEU 214 Ca 0.28 -0.57 -0.03 0.00 0.06 0.00 0.00 54.13 53.87 1xov s LEU 214 Cb -0.12 2.04 -0.03 0.00 -0.56 0.00 0.00 46.19 47.52 1xov s LEU 214 CO 0.20 -1.06 -0.02 -0.76 -1.06 0.00 0.00 176.35 173.65 1xov s LEU 215 N -2.90 3.37 0.24 1.48 1.43 -1.26 -0.89 118.68 120.15 1xov s LEU 215 Ca 0.11 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 1xov s LEU 215 Cb -0.01 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 1xov s LEU 215 CO -0.01 0.25 0.19 0.68 0.23 0.00 0.00 176.35 177.69 1xov s VAL 216 N -0.10 0.00 0.18 -1.59 -7.23 -0.15 -4.87 120.40 106.64 1xov s VAL 216 Ca 0.03 -1.97 0.11 0.00 -1.81 0.00 0.00 61.98 58.33 1xov s VAL 216 Cb -0.13 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 1xov s VAL 216 CO 0.02 0.00 -0.21 -0.31 -0.31 0.00 0.00 175.10 174.29 1xov s TYR 217 N -3.93 2.39 0.58 2.82 2.02 0.81 -0.26 117.35 121.78 1xov s TYR 217 Ca 0.39 -0.32 -0.20 0.00 -0.37 0.00 0.00 57.07 56.57 1xov s TYR 217 Cb 0.05 -1.20 -0.04 0.00 -0.40 0.00 0.00 41.96 40.38 1xov s TYR 217 CO 0.16 0.47 1.27 -1.21 -1.57 0.00 0.00 175.55 174.68 1xov s GLU 218 N -2.59 2.97 0.03 -0.62 2.02 -1.26 -0.94 118.70 118.32 1xov s GLU 218 Ca 0.21 2.00 0.00 0.00 0.02 0.00 0.00 54.97 57.20 1xov s GLU 218 Cb -0.09 -2.04 0.00 0.00 0.10 0.00 0.00 34.13 32.11 1xov s GLU 218 CO 0.10 -1.25 0.00 1.58 0.02 0.00 0.00 175.26 175.71 1xov n HIS 219 N -1.42 -0.26 -3.47 1.61 -0.00 -1.16 -4.58 115.22 105.94 1xov n HIS 219 Ca 0.13 0.05 0.00 0.00 0.46 0.00 0.00 57.72 58.35 1xov n HIS 219 Cb 0.48 0.39 0.00 0.00 -0.12 0.00 0.00 29.99 30.74 1xov n HIS 219 CO 0.00 0.00 0.00 0.27 0.46 0.00 0.00 176.34 177.07 1xov n ASN 220 N -2.63 0.00 0.26 0.26 0.23 -0.70 -5.02 115.26 107.66 1xov n ASN 220 Ca 0.00 -0.57 0.08 0.00 -0.53 0.00 0.00 54.58 53.57 1xov n ASN 220 Cb 0.00 0.00 0.64 0.00 -2.08 0.00 0.00 39.78 38.34 1xov n ASN 220 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1xov h LYS 221 N 0.00 0.00 0.00 -3.83 3.64 -2.04 -3.19 116.57 111.15 1xov h LYS 221 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xov h LYS 221 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1xov h LYS 221 CO 0.00 0.05 -0.52 0.66 -2.27 0.00 0.00 179.45 177.36 1xov n TYR 222 N -4.39 0.00 -4.33 1.91 4.02 -1.26 -4.92 117.16 108.18 1xov n TYR 222 Ca -0.03 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.68 1xov n TYR 222 Cb 0.13 -0.03 -0.15 0.00 -0.02 0.00 0.00 39.34 39.27 1xov n TYR 222 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1xov s TRP 223 N -1.76 0.76 0.28 -0.72 0.52 -1.21 -1.01 118.94 115.80 1xov s TRP 223 Ca 0.01 -0.15 0.02 0.00 0.02 0.00 0.00 56.10 56.00 1xov s TRP 223 Cb 0.04 -0.49 -0.03 0.00 -1.15 0.00 0.00 33.47 31.84 1xov s TRP 223 CO 0.24 -0.01 0.45 0.71 0.02 0.00 0.00 176.95 178.35 1xov s TYR 224 N -0.23 3.48 0.22 -1.98 2.02 -0.16 -1.73 117.35 118.98 1xov s TYR 224 Ca 0.03 0.21 0.10 0.00 -0.37 0.00 0.00 57.07 57.04 1xov s TYR 224 Cb -0.03 -1.77 -0.05 0.00 -0.40 0.00 0.00 41.96 39.71 1xov s TYR 224 CO -0.00 0.29 -0.18 -1.59 -1.57 0.00 0.00 175.55 172.50 1xov s LYS 225 N -3.99 1.46 0.16 -0.62 -2.85 -0.12 -1.48 119.74 112.32 1xov s LYS 225 Ca 0.37 -1.61 -0.18 0.00 -1.00 0.00 0.00 55.97 53.55 1xov s LYS 225 Cb -0.10 -1.47 0.04 0.00 -2.06 0.00 0.00 37.83 34.24 1xov s LYS 225 CO 0.32 0.28 0.50 0.00 0.10 0.00 0.00 175.35 176.55 1xov s ALA 226 N -2.47 -1.10 -0.20 0.59 0.00 -0.57 -0.13 121.76 117.87 1xov s ALA 226 Ca 0.24 0.01 -0.07 0.00 0.00 0.00 0.00 51.96 52.13 1xov s ALA 226 Cb -0.04 0.80 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 1xov s ALA 226 CO 0.10 -0.74 0.07 0.71 0.00 0.00 0.00 175.76 175.90 1xov s TYR 227 N -3.82 3.20 -0.18 0.00 2.02 -1.26 -0.10 117.35 117.21 1xov s TYR 227 Ca 0.05 -0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.72 1xov s TYR 227 Cb -0.00 -2.13 0.02 0.00 -0.40 0.00 0.00 41.96 39.45 1xov s TYR 227 CO -0.09 0.02 -0.19 0.42 -1.57 0.00 0.00 175.55 174.14 1xov s ILE 228 N 0.72 2.02 -1.34 2.71 1.01 -0.06 -4.73 121.20 121.51 1xov s ILE 228 Ca 0.04 -0.91 -0.02 0.00 0.00 0.00 0.00 60.65 59.75 1xov s ILE 228 Cb -0.13 -1.82 0.01 0.00 0.01 0.00 0.00 42.46 40.53 1xov s ILE 228 CO 0.02 0.53 0.76 0.59 0.00 0.00 0.00 174.94 176.84 1xov n ASN 229 N 4.63 -1.86 -1.00 3.58 3.02 -1.26 -1.77 115.26 120.60 1xov n ASN 229 Ca -0.21 -0.80 -0.13 0.00 -0.03 0.00 0.00 54.58 53.41 1xov n ASN 229 Cb 0.50 -4.06 -0.05 0.00 -0.61 0.00 0.00 39.78 35.55 1xov n ASN 229 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1xov n ASP 230 N -3.02 -5.53 -4.48 6.41 8.00 -1.26 -4.96 116.55 111.71 1xov n ASP 230 Ca -0.24 0.32 -0.32 0.00 0.71 0.00 0.00 54.79 55.25 1xov n ASP 230 Cb 0.65 -4.25 -0.13 0.00 -0.02 0.00 0.00 41.12 37.38 1xov n ASP 230 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1xov s LYS 231 N -3.06 2.44 0.04 -1.24 1.02 -0.73 -5.08 119.74 113.13 1xov s LYS 231 Ca 0.00 -0.74 -0.27 0.00 0.02 0.00 0.00 55.97 54.98 1xov s LYS 231 Cb 0.00 -2.36 -0.05 0.00 -0.52 0.00 0.00 37.83 34.90 1xov s LYS 231 CO 0.00 0.61 0.86 -1.17 -0.92 0.00 0.00 175.35 174.73 1xov s LEU 232 N -0.89 4.43 0.27 3.17 2.96 -1.26 -0.88 118.68 126.47 1xov s LEU 232 Ca 0.12 1.56 0.02 0.00 -0.22 0.00 0.00 54.13 55.61 1xov s LEU 232 Cb -0.11 -3.39 -0.03 0.00 0.50 0.00 0.00 46.19 43.17 1xov s LEU 232 CO 0.02 -0.09 0.24 0.00 -1.32 0.00 0.00 176.35 175.20 1xov s TYR 234 N -3.76 0.15 -0.00 0.00 2.02 0.91 -1.52 117.35 115.14 1xov s TYR 234 Ca 0.38 -0.30 0.03 0.00 -0.37 0.00 0.00 57.07 56.82 1xov s TYR 234 Cb 0.04 -0.11 -0.01 0.00 -0.40 0.00 0.00 41.96 41.48 1xov s TYR 234 CO 0.19 -0.12 -0.10 -1.50 -1.57 0.00 0.00 175.55 172.45 1xov s ILE 235 N -0.87 0.82 0.04 2.71 2.07 -0.55 -0.22 121.20 125.21 1xov s ILE 235 Ca -0.09 -0.49 -0.30 0.00 -1.41 0.00 0.00 60.65 58.35 1xov s ILE 235 Cb -0.06 -0.69 -0.05 0.00 0.13 0.00 0.00 42.46 41.79 1xov s ILE 235 CO -0.01 0.20 1.14 -0.47 -1.91 0.00 0.00 174.94 173.89 1xov s TYR 236 N -0.31 3.48 0.35 3.50 5.04 -1.26 -0.99 117.35 127.16 1xov s TYR 236 Ca 0.03 1.40 0.07 0.00 -2.44 0.00 0.00 57.07 56.13 1xov s TYR 236 Cb -0.04 -3.34 0.66 0.00 0.35 0.00 0.00 41.96 39.58 1xov s TYR 236 CO -0.00 -0.96 1.87 0.87 -1.34 0.00 0.00 175.55 175.98 1xov h LYS 237 N 6.83 0.36 0.00 4.97 1.57 -1.41 -2.57 116.57 126.32 1xov h LYS 237 Ca -0.41 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1xov h LYS 237 Cb 1.21 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1xov h LYS 237 CO 0.80 0.49 0.00 -1.13 -0.57 0.00 0.00 179.45 179.04 1xov n SER 238 N -4.24 0.24 0.00 0.86 3.41 -1.26 -0.93 113.62 111.70 1xov n SER 238 Ca -0.00 0.57 0.14 0.00 -0.26 0.00 0.00 58.87 59.31 1xov n SER 238 Cb 0.29 -0.61 0.64 0.00 -0.26 0.00 0.00 64.21 64.26 1xov n SER 238 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1xov n PHE 239 N -1.77 0.00 -4.38 7.33 3.72 -0.97 -4.86 117.46 116.52 1xov n PHE 239 Ca 0.02 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.18 1xov n PHE 239 Cb 0.16 -0.43 -0.11 0.00 -0.94 0.00 0.00 39.48 38.15 1xov n PHE 239 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1xov s ILE 241 N -1.84 2.96 -0.03 0.00 1.01 0.21 -4.87 121.20 118.64 1xov s ILE 241 Ca 0.18 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 60.15 1xov s ILE 241 Cb -0.07 -2.22 0.01 0.00 0.01 0.00 0.00 42.46 40.19 1xov s ILE 241 CO 0.08 0.54 -0.08 -0.55 0.00 0.00 0.00 174.94 174.93 1xov s SER 242 N 0.18 1.19 -0.28 3.58 0.15 -1.26 -1.69 113.70 115.57 1xov s SER 242 Ca -0.08 -0.18 -0.00 0.00 0.70 0.00 0.00 55.95 56.38 1xov s SER 242 Cb -0.15 -0.41 0.08 0.00 -1.71 0.00 0.00 66.02 63.83 1xov s SER 242 CO 0.05 0.03 0.05 0.21 1.20 0.00 0.00 173.24 174.78 1xov s ASN 243 N 0.41 3.91 0.00 5.45 3.04 -1.26 -5.12 114.94 121.38 1xov s ASN 243 Ca -0.07 -1.48 0.00 0.00 0.04 0.00 0.00 52.86 51.36 1xov s ASN 243 Cb -0.11 -1.00 0.00 0.00 -1.54 0.00 0.00 41.25 38.61 1xov s ASN 243 CO 0.01 -0.35 0.00 0.61 -3.04 0.00 0.00 177.10 174.33 1xov n GLY 244 N 4.76 -1.63 3.68 1.21 0.00 -1.26 -4.95 105.19 106.99 1xov n GLY 244 Ca -0.05 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.60 1xov n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xov s LYS 245 N -2.96 4.27 -0.00 1.61 1.02 -1.26 -4.80 119.74 117.61 1xov s LYS 245 Ca 0.00 1.83 0.00 0.00 0.02 0.00 0.00 55.97 57.83 1xov s LYS 245 Cb 0.00 -3.69 -0.00 0.00 -0.52 0.00 0.00 37.83 33.62 1xov s LYS 245 CO 0.00 -0.63 0.00 1.63 -0.92 0.00 0.00 175.35 175.44 1xov n LYS 246 N 5.97 3.10 -1.89 1.68 4.01 -1.26 -5.06 118.16 124.70 1xov n LYS 246 Ca 0.13 -0.00 -0.41 0.00 -0.51 0.00 0.00 58.31 57.52 1xov n LYS 246 Cb 0.44 -1.01 -0.01 0.00 -0.51 0.00 0.00 35.03 33.94 1xov n LYS 246 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1xov s ASP 247 N -2.81 6.49 0.57 4.39 2.15 -1.26 -4.87 116.67 121.33 1xov s ASP 247 Ca -0.00 2.87 0.29 0.00 0.43 0.00 0.00 52.55 56.14 1xov s ASP 247 Cb 0.00 -2.64 1.72 0.00 -0.30 0.00 0.00 42.92 41.70 1xov s ASP 247 CO 0.01 -0.80 2.20 0.00 -0.17 0.00 0.00 175.17 176.41 1xov h ALA 248 N 4.24 1.45 -0.27 3.66 0.00 -1.97 -1.16 119.26 125.20 1xov h ALA 248 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1xov h ALA 248 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1xov h ALA 248 CO 0.73 0.05 0.00 1.63 0.00 0.00 0.00 179.25 181.66 1xov n LYS 249 N -3.78 2.28 -0.81 0.00 4.76 -1.26 -4.96 118.16 114.39 1xov n LYS 249 Ca -0.03 -2.08 0.00 0.00 -2.87 0.00 0.00 58.31 53.33 1xov n LYS 249 Cb 0.13 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 31.87 1xov n LYS 249 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xov n GLY 250 N 1.30 0.56 3.77 0.72 0.00 -0.44 -5.04 105.19 106.06 1xov n GLY 250 Ca 0.16 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 1xov n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xov s ARG 251 N -0.76 3.62 -0.10 1.61 0.52 -1.26 -4.63 118.95 117.95 1xov s ARG 251 Ca 0.00 1.85 0.04 0.00 -0.52 0.00 0.00 55.73 57.10 1xov s ARG 251 Cb 0.00 -2.36 0.00 0.00 0.52 0.00 0.00 34.95 33.12 1xov s ARG 251 CO 0.00 -0.69 -0.22 0.42 0.02 0.00 0.00 175.30 174.83 1xov s ILE 252 N -1.51 1.92 -0.19 1.52 1.01 0.64 -4.04 121.20 120.55 1xov s ILE 252 Ca 0.66 -0.94 -0.26 0.00 0.00 0.00 0.00 60.65 60.11 1xov s ILE 252 Cb -0.31 -1.67 -0.01 0.00 0.01 0.00 0.00 42.46 40.49 1xov s ILE 252 CO 0.37 0.53 0.87 -0.75 0.00 0.00 0.00 174.94 175.95 1xov s LYS 253 N 0.39 4.27 0.29 2.79 2.20 -1.26 -0.97 119.74 127.45 1xov s LYS 253 Ca -0.18 1.06 0.08 0.00 -0.36 0.00 0.00 55.97 56.57 1xov s LYS 253 Cb -0.18 -3.60 -0.06 0.00 -1.51 0.00 0.00 37.83 32.48 1xov s LYS 253 CO 0.08 -0.42 -0.09 0.14 -0.36 0.00 0.00 175.35 174.70 1xov s VAL 254 N 2.47 1.92 -0.02 4.02 -7.23 -0.07 -4.46 120.40 117.04 1xov s VAL 254 Ca 0.39 -2.19 0.03 0.00 -1.81 0.00 0.00 61.98 58.40 1xov s VAL 254 Cb -0.16 -2.46 -0.00 0.00 0.56 0.00 0.00 36.38 34.32 1xov s VAL 254 CO 0.10 -0.30 -0.10 -0.13 -0.31 0.00 0.00 175.10 174.36 1xov s ARG 255 N -3.66 0.98 0.30 4.82 0.52 -0.68 -1.40 118.95 119.82 1xov s ARG 255 Ca 0.30 -0.36 -0.29 0.00 -0.52 0.00 0.00 55.73 54.86 1xov s ARG 255 Cb 0.02 -0.92 -0.10 0.00 0.52 0.00 0.00 34.95 34.47 1xov s ARG 255 CO 0.13 0.17 1.35 0.42 0.02 0.00 0.00 175.30 177.39 1xov s ILE 256 N -0.01 2.74 0.61 1.52 -1.09 0.15 -0.62 121.20 124.49 1xov s ILE 256 Ca 0.00 0.69 -0.18 0.00 -2.23 0.00 0.00 60.65 58.93 1xov s ILE 256 Cb -0.07 -3.44 -0.05 0.00 -1.58 0.00 0.00 42.46 37.32 1xov s ILE 256 CO 0.00 0.14 0.80 0.29 -1.23 0.00 0.00 174.94 174.95 1xov n LYS 257 N 1.41 0.70 -0.71 2.79 5.02 -0.14 -1.27 118.16 125.96 1xov n LYS 257 Ca 0.03 0.28 -0.30 0.00 -2.02 0.00 0.00 58.31 56.29 1xov n LYS 257 Cb 0.41 -2.01 0.18 0.00 -0.02 0.00 0.00 35.03 33.60 1xov n LYS 257 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1xov s SER 258 N -1.28 2.60 0.40 4.39 1.04 -1.26 -2.63 113.70 116.96 1xov s SER 258 Ca 0.74 2.02 0.11 0.00 0.48 0.00 0.00 55.95 59.29 1xov s SER 258 Cb -0.41 -2.50 0.91 0.00 0.10 0.00 0.00 66.02 64.12 1xov s SER 258 CO 0.50 -3.28 1.95 0.00 0.98 0.00 0.00 173.24 173.39 1xov h ALA 259 N -1.99 1.91 -0.25 5.32 0.00 -1.93 0.15 119.26 122.46 1xov h ALA 259 Ca -0.47 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.32 1xov h ALA 259 Cb 1.28 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1xov h ALA 259 CO 0.44 -0.06 -0.30 -0.22 0.00 0.00 0.00 179.25 179.11 1xov h LYS 260 N 0.56 0.52 0.00 0.00 3.64 -1.93 -3.34 116.57 116.02 1xov h LYS 260 Ca 0.33 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1xov h LYS 260 Cb 0.52 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1xov h LYS 260 CO -0.11 0.77 -1.96 -0.25 -2.27 0.00 0.00 179.45 175.63 1xov n ASP 261 N -4.08 0.18 -4.76 4.20 8.00 -0.60 -4.94 116.55 114.55 1xov n ASP 261 Ca -0.01 -0.01 -0.38 0.00 0.71 0.00 0.00 54.79 55.11 1xov n ASP 261 Cb 0.45 1.96 0.01 0.00 -0.02 0.00 0.00 41.12 43.52 1xov n ASP 261 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xov s LEU 262 N -4.46 3.98 -0.04 0.64 2.96 0.41 -4.90 118.68 117.28 1xov s LEU 262 Ca -0.08 2.57 0.01 0.00 -0.22 0.00 0.00 54.13 56.41 1xov s LEU 262 Cb 0.14 -4.20 0.02 0.00 0.50 0.00 0.00 46.19 42.65 1xov s LEU 262 CO 0.88 -1.19 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.55 1xov s ARG 263 N -2.71 0.74 -0.15 1.98 1.81 -1.26 -4.24 118.95 115.12 1xov s ARG 263 Ca 0.66 -0.09 -0.06 0.00 -1.72 0.00 0.00 55.73 54.52 1xov s ARG 263 Cb -0.35 -0.77 -0.04 0.00 -0.45 0.00 0.00 34.95 33.34 1xov s ARG 263 CO 0.43 -0.08 0.06 0.42 -0.68 0.00 0.00 175.30 175.45 1xov s ILE 264 N 0.87 4.79 0.27 1.52 -1.09 0.44 -4.79 121.20 123.22 1xov s ILE 264 Ca -0.11 -0.04 -0.24 0.00 -2.23 0.00 0.00 60.65 58.03 1xov s ILE 264 Cb -0.14 -3.11 -0.09 0.00 -1.58 0.00 0.00 42.46 37.54 1xov s ILE 264 CO 0.00 0.52 0.85 -2.16 -1.23 0.00 0.00 174.94 172.92 1xov s PRO 265 N -0.17 4.46 -0.12 2.79 0.04 -1.26 -0.95 135.00 139.79 1xov s PRO 265 Ca 0.07 1.14 -0.01 0.00 0.04 0.00 0.00 61.00 62.24 1xov s PRO 265 Cb -0.12 -2.88 0.03 0.00 0.04 0.00 0.00 34.50 31.57 1xov s PRO 265 CO 0.01 0.36 -0.03 0.08 0.04 0.00 0.00 177.00 177.46 1xov s VAL 266 N -1.53 0.76 0.17 -0.36 1.01 0.44 -4.78 120.40 116.12 1xov s VAL 266 Ca 0.46 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 62.21 1xov s VAL 266 Cb -0.18 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1xov s VAL 266 CO 0.23 0.19 0.20 0.26 0.00 0.00 0.00 175.10 175.99 1xov s TRP 267 N 1.80 3.28 -1.14 5.22 0.51 -0.10 0.26 118.94 128.78 1xov s TRP 267 Ca 0.03 0.03 0.05 0.00 -2.12 0.00 0.00 56.10 54.08 1xov s TRP 267 Cb -0.14 -1.56 0.22 0.00 -0.81 0.00 0.00 33.47 31.17 1xov s TRP 267 CO -0.07 0.51 0.93 0.27 -0.51 0.00 0.00 176.95 178.09 1xov n ASN 268 N -0.51 1.97 -3.82 2.95 6.94 -0.37 0.31 115.26 122.72 1xov n ASN 268 Ca -0.08 -2.18 -0.12 0.00 -0.02 0.00 0.00 54.58 52.18 1xov n ASN 268 Cb 0.55 -0.43 -0.09 0.00 -2.36 0.00 0.00 39.78 37.44 1xov n ASN 268 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1xov s ASN 269 N -0.44 -0.07 0.08 0.53 2.20 -1.26 -4.86 114.94 111.12 1xov s ASN 269 Ca 0.15 -0.07 0.24 0.00 -0.94 0.00 0.00 52.86 52.23 1xov s ASN 269 Cb 0.10 0.26 0.96 0.00 -2.00 0.00 0.00 41.25 40.57 1xov s ASN 269 CO 0.06 -0.39 1.75 0.35 -2.94 0.00 0.00 177.10 175.92 1xov n THR 270 N 1.42 0.49 0.32 0.54 -2.24 -1.26 -2.33 114.28 111.22 1xov n THR 270 Ca -0.22 0.03 0.14 0.00 -2.27 0.00 0.00 64.05 61.73 1xov n THR 270 Cb 0.56 -0.74 0.42 0.00 -2.10 0.00 0.00 70.33 68.47 1xov n THR 270 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1xov h LYS 271 N 0.00 0.00 -5.55 -0.78 1.79 -1.98 -3.48 116.57 106.58 1xov h LYS 271 Ca 0.00 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.14 1xov h LYS 271 Cb 0.47 0.00 0.16 0.00 -1.58 0.00 0.00 32.23 31.28 1xov h LYS 271 CO 0.00 0.00 -0.73 1.28 -1.08 0.00 0.00 179.45 178.92 1xov n LEU 272 N -2.89 -3.89 -3.61 2.94 4.32 -0.98 -4.77 117.00 108.13 1xov n LEU 272 Ca 0.03 -0.59 -0.10 0.00 -0.02 0.00 0.00 56.01 55.33 1xov n LEU 272 Cb 0.40 -3.03 -0.10 0.00 -1.62 0.00 0.00 43.42 39.07 1xov n LEU 272 CO 0.29 0.40 -0.03 0.21 -1.22 0.00 0.00 177.39 177.05 1xov s ASN 273 N -4.18 -0.01 0.87 -1.43 2.47 -1.26 -4.65 114.94 106.74 1xov s ASN 273 Ca 0.07 0.75 0.00 0.00 0.42 0.00 0.00 52.86 54.11 1xov s ASN 273 Cb -0.03 1.15 0.00 0.00 -1.45 0.00 0.00 41.25 40.91 1xov s ASN 273 CO 0.71 -0.25 0.00 -1.20 -3.72 0.00 0.00 177.10 172.64 1xov n SER 274 N 5.38 -0.57 0.00 -4.21 7.64 -1.26 -4.95 113.62 115.65 1xov n SER 274 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.81 1xov n SER 274 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1xov n SER 274 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xov n GLY 275 N 0.00 -0.02 3.75 0.23 0.00 -1.26 -4.68 105.19 103.21 1xov n GLY 275 Ca 0.00 -0.98 -0.38 0.00 0.00 0.00 0.00 46.02 44.66 1xov n GLY 275 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xov s LYS 276 N 0.00 4.23 -0.04 1.61 1.02 -1.26 -4.97 119.74 120.32 1xov s LYS 276 Ca 0.00 0.39 0.05 0.00 0.02 0.00 0.00 55.97 56.43 1xov s LYS 276 Cb 0.00 -3.38 -0.01 0.00 -0.52 0.00 0.00 37.83 33.92 1xov s LYS 276 CO 0.00 0.31 -0.20 0.42 -0.92 0.00 0.00 175.35 174.96 1xov s ILE 277 N 0.16 1.62 -0.13 2.17 1.01 -1.26 -1.24 121.20 123.52 1xov s ILE 277 Ca 0.24 -0.83 -0.11 0.00 0.00 0.00 0.00 60.65 59.95 1xov s ILE 277 Cb -0.15 -1.37 -0.05 0.00 0.01 0.00 0.00 42.46 40.90 1xov s ILE 277 CO 0.10 0.46 0.22 -0.54 0.00 0.00 0.00 174.94 175.18 1xov s LYS 278 N -0.09 3.93 -0.22 2.79 1.02 0.14 -4.93 119.74 122.38 1xov s LYS 278 Ca -0.02 -0.01 -0.01 0.00 0.02 0.00 0.00 55.97 55.95 1xov s LYS 278 Cb -0.12 -3.32 0.01 0.00 -0.52 0.00 0.00 37.83 33.89 1xov s LYS 278 CO 0.02 0.49 -0.10 -1.58 -0.92 0.00 0.00 175.35 173.26 1xov s TRP 279 N -0.26 2.94 0.05 3.18 0.52 -1.26 -0.42 118.94 123.69 1xov s TRP 279 Ca 0.15 -1.41 0.08 0.00 0.02 0.00 0.00 56.10 54.94 1xov s TRP 279 Cb -0.13 -2.02 -0.03 0.00 -1.15 0.00 0.00 33.47 30.14 1xov s TRP 279 CO 0.04 -0.70 -0.22 0.71 0.02 0.00 0.00 176.95 176.80 1xov s TYR 280 N 1.36 2.46 0.39 -1.98 2.02 -0.13 -4.83 117.35 116.64 1xov s TYR 280 Ca 0.03 -0.32 -0.24 0.00 -0.37 0.00 0.00 57.07 56.17 1xov s TYR 280 Cb -0.15 -1.43 -0.09 0.00 -0.40 0.00 0.00 41.96 39.89 1xov s TYR 280 CO -0.07 0.21 1.03 -1.54 -1.57 0.00 0.00 175.55 173.61 1xov s SER 281 N -1.39 6.83 0.17 2.29 1.04 -1.26 -0.42 113.70 120.97 1xov s SER 281 Ca 0.13 2.00 -0.32 0.00 0.48 0.00 0.00 55.95 58.24 1xov s SER 281 Cb -0.10 -2.58 -0.16 0.00 0.10 0.00 0.00 66.02 63.27 1xov s SER 281 CO 0.04 -0.44 1.00 -2.65 0.98 0.00 0.00 173.24 172.17 1xov n PRO 282 N -0.03 0.80 0.00 4.02 -0.02 -1.26 -2.13 135.00 136.38 1xov n PRO 282 Ca 0.05 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1xov n PRO 282 Cb 0.50 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 1xov n PRO 282 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xov n GLY 283 N 1.84 2.10 3.71 -1.23 0.00 0.03 -4.96 105.19 106.68 1xov n GLY 283 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1xov n GLY 283 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xov n THR 284 N -2.00 0.04 -2.92 2.61 -1.04 -0.91 -4.62 114.28 105.45 1xov n THR 284 Ca 0.00 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.59 1xov n THR 284 Cb 0.00 -1.93 -0.04 0.00 -1.82 0.00 0.00 70.33 66.54 1xov n THR 284 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1xov s LYS 285 N 1.07 4.45 0.04 -2.82 1.02 -1.26 -1.09 119.74 121.14 1xov s LYS 285 Ca 0.75 1.07 -0.01 0.00 0.02 0.00 0.00 55.97 57.79 1xov s LYS 285 Cb -0.52 -3.48 -0.03 0.00 -0.52 0.00 0.00 37.83 33.28 1xov s LYS 285 CO 0.34 -0.05 -0.02 -0.51 -0.92 0.00 0.00 175.35 174.19 1xov s LEU 286 N 1.13 2.35 0.05 3.17 1.43 -0.68 -4.98 118.68 121.15 1xov s LEU 286 Ca 0.42 -0.80 0.08 0.00 -1.03 0.00 0.00 54.13 52.80 1xov s LEU 286 Cb -0.18 0.21 -0.03 0.00 0.03 0.00 0.00 46.19 46.21 1xov s LEU 286 CO 0.20 -0.50 -0.20 -0.44 0.23 0.00 0.00 176.35 175.65 1xov s SER 287 N -2.38 3.71 0.27 2.29 0.01 -1.26 -1.42 113.70 114.91 1xov s SER 287 Ca -0.01 -0.48 -0.04 0.00 1.31 0.00 0.00 55.95 56.73 1xov s SER 287 Cb 0.01 -0.54 -0.02 0.00 0.21 0.00 0.00 66.02 65.68 1xov s SER 287 CO -0.07 0.24 0.35 -1.66 0.41 0.00 0.00 173.24 172.52 1xov s TRP 288 N -0.94 0.98 -0.05 2.43 -2.14 -0.06 -4.70 118.94 114.45 1xov s TRP 288 Ca 0.15 -1.21 0.05 0.00 2.66 0.00 0.00 56.10 57.75 1xov s TRP 288 Cb -0.10 -0.22 -0.02 0.00 -3.10 0.00 0.00 33.47 30.02 1xov s TRP 288 CO 0.05 -0.92 -0.19 0.71 -2.66 0.00 0.00 176.95 173.95 1xov s TYR 289 N -3.70 2.58 -0.33 1.66 2.02 0.81 -0.11 117.35 120.28 1xov s TYR 289 Ca 0.32 -0.40 0.03 0.00 -0.37 0.00 0.00 57.07 56.65 1xov s TYR 289 Cb 0.02 -1.62 0.10 0.00 -0.40 0.00 0.00 41.96 40.06 1xov s TYR 289 CO 0.16 0.00 0.05 0.34 -1.57 0.00 0.00 175.55 174.52 1xov s ASP 290 N -0.45 4.67 -0.18 2.29 -1.08 -0.14 -1.29 116.67 120.49 1xov s ASP 290 Ca 0.05 -2.06 0.16 0.00 -0.52 0.00 0.00 52.55 50.18 1xov s ASP 290 Cb -0.12 -1.54 0.71 0.00 -1.46 0.00 0.00 42.92 40.51 1xov s ASP 290 CO 0.01 -0.37 1.63 0.59 0.52 0.00 0.00 175.17 177.55 1xov n ASN 291 N 4.32 4.97 -2.89 -0.34 3.02 -1.26 -4.80 115.26 118.28 1xov n ASN 291 Ca 0.02 -2.78 -0.22 0.00 -0.03 0.00 0.00 54.58 51.57 1xov n ASN 291 Cb 0.42 -0.61 0.03 0.00 -0.61 0.00 0.00 39.78 39.01 1xov n ASN 291 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1xov n LYS 292 N 0.51 -4.20 0.00 3.52 5.02 -1.26 -4.89 118.16 116.86 1xov n LYS 292 Ca 0.25 0.93 0.14 0.00 -2.02 0.00 0.00 58.31 57.61 1xov n LYS 292 Cb 1.02 -5.75 0.59 0.00 -0.02 0.00 0.00 35.03 30.87 1xov n LYS 292 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xov n LYS 293 N -3.82 0.69 -0.09 1.97 5.02 -1.26 -4.90 118.16 115.78 1xov n LYS 293 Ca -0.14 -0.25 0.00 0.00 -2.02 0.00 0.00 58.31 55.90 1xov n LYS 293 Cb 0.63 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 1xov n LYS 293 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xov n GLY 294 N 1.29 0.74 3.58 0.72 0.00 -1.26 -5.06 105.19 105.20 1xov n GLY 294 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 1xov n GLY 294 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xov s TYR 295 N -2.10 -0.41 0.14 1.61 -0.85 -1.26 -4.57 117.35 109.92 1xov s TYR 295 Ca 0.00 0.11 -0.04 0.00 -0.52 0.00 0.00 57.07 56.63 1xov s TYR 295 Cb 0.00 0.61 -0.05 0.00 0.38 0.00 0.00 41.96 42.90 1xov s TYR 295 CO 0.00 -0.97 0.36 -0.51 -1.52 0.00 0.00 175.55 172.92 1xov s LEU 296 N -2.80 4.27 -0.15 -3.49 1.43 0.42 -4.68 118.68 113.69 1xov s LEU 296 Ca 0.05 0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.70 1xov s LEU 296 Cb -0.03 -3.26 0.01 0.00 0.03 0.00 0.00 46.19 42.95 1xov s LEU 296 CO -0.06 0.05 -0.20 -1.61 0.23 0.00 0.00 176.35 174.76 1xov s GLU 297 N -2.75 2.90 -0.13 1.70 2.02 -0.41 -1.65 118.70 120.37 1xov s GLU 297 Ca 0.40 -0.80 0.02 0.00 0.02 0.00 0.00 54.97 54.61 1xov s GLU 297 Cb -0.12 -2.40 0.01 0.00 0.10 0.00 0.00 34.13 31.72 1xov s GLU 297 CO 0.26 -0.09 -0.19 -0.51 0.02 0.00 0.00 175.26 174.75 1xov s LEU 298 N 1.00 1.94 -0.20 1.80 1.02 0.13 -0.13 118.68 124.23 1xov s LEU 298 Ca -0.03 -0.53 -0.14 0.00 0.02 0.00 0.00 54.13 53.45 1xov s LEU 298 Cb -0.15 -1.29 -0.04 0.00 0.02 0.00 0.00 46.19 44.73 1xov s LEU 298 CO -0.06 0.05 0.32 0.86 0.02 0.00 0.00 176.35 177.54 1xov s TRP 299 N 0.93 3.37 -0.20 0.29 -0.11 -1.26 -0.45 118.94 121.51 1xov s TRP 299 Ca -0.06 0.51 -0.02 0.00 1.22 0.00 0.00 56.10 57.75 1xov s TRP 299 Cb -0.15 -2.42 0.00 0.00 -1.50 0.00 0.00 33.47 29.40 1xov s TRP 299 CO -0.02 0.05 -0.11 0.71 -4.62 0.00 0.00 176.95 172.96 1xov s TYR 300 N 1.09 2.89 0.33 5.86 2.02 -0.54 -5.00 117.35 124.00 1xov s TYR 300 Ca 0.15 -1.23 0.10 0.00 -0.37 0.00 0.00 57.07 55.73 1xov s TYR 300 Cb -0.14 -2.03 0.86 0.00 -0.40 0.00 0.00 41.96 40.25 1xov s TYR 300 CO 0.06 -0.65 1.78 0.93 -1.57 0.00 0.00 175.55 176.10 1xov h GLU 301 N 8.04 0.62 0.03 -0.62 4.39 -1.98 0.71 114.58 125.78 1xov h GLU 301 Ca -0.43 -0.04 -0.24 0.00 0.34 0.00 0.00 59.36 58.99 1xov h GLU 301 Cb 1.15 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.63 1xov h GLU 301 CO 0.62 0.41 -1.22 0.87 -1.16 0.00 0.00 179.01 178.53 1xov h LYS 302 N 0.64 0.06 0.00 2.33 1.57 -2.04 -3.41 116.57 115.72 1xov h LYS 302 Ca 0.58 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1xov h LYS 302 Cb 1.07 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1xov h LYS 302 CO -0.36 0.94 0.00 -0.25 -0.57 0.00 0.00 179.45 179.22 1xov n ASP 303 N -3.32 0.11 0.00 0.86 8.00 -0.93 -5.12 116.55 116.15 1xov n ASP 303 Ca -0.06 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 54.90 1xov n ASP 303 Cb 0.98 0.83 0.00 0.00 -0.02 0.00 0.00 41.12 42.91 1xov n ASP 303 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xov n GLY 304 N 0.83 -1.35 3.74 0.44 0.00 0.20 -4.92 105.19 104.13 1xov n GLY 304 Ca 0.00 -1.57 -0.40 0.00 0.00 0.00 0.00 46.02 44.05 1xov n GLY 304 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xov s TRP 305 N 0.00 3.77 0.35 1.61 0.52 -1.26 -1.47 118.94 122.47 1xov s TRP 305 Ca 0.00 1.59 0.05 0.00 0.02 0.00 0.00 56.10 57.76 1xov s TRP 305 Cb 0.00 -2.89 -0.07 0.00 -1.15 0.00 0.00 33.47 29.36 1xov s TRP 305 CO 0.00 0.27 0.04 0.71 0.02 0.00 0.00 176.95 177.99 1xov s TYR 306 N -0.11 2.13 0.00 -1.98 2.02 0.41 -4.64 117.35 115.18 1xov s TYR 306 Ca 0.41 -0.88 -0.13 0.00 -0.37 0.00 0.00 57.07 56.11 1xov s TYR 306 Cb -0.22 -1.44 0.02 0.00 -0.40 0.00 0.00 41.96 39.92 1xov s TYR 306 CO 0.25 0.14 0.27 0.71 -1.57 0.00 0.00 175.55 175.35 1xov s TYR 307 N -3.11 -0.11 0.33 2.71 2.02 0.15 -0.70 117.35 118.64 1xov s TYR 307 Ca 0.36 0.10 -0.07 0.00 -0.37 0.00 0.00 57.07 57.09 1xov s TYR 307 Cb 0.09 0.06 0.01 0.00 -0.40 0.00 0.00 41.96 41.72 1xov s TYR 307 CO 0.16 -0.40 0.52 -0.08 -1.57 0.00 0.00 175.55 174.18 1xov s THR 308 N -1.66 0.00 0.48 -0.71 -1.32 -0.66 -0.92 115.64 110.85 1xov s THR 308 Ca -0.12 -1.47 -0.21 0.00 -1.21 0.00 0.00 61.69 58.68 1xov s THR 308 Cb -0.04 -2.58 -0.08 0.00 -1.51 0.00 0.00 72.50 68.28 1xov s THR 308 CO 0.02 0.00 1.08 0.00 -2.21 0.00 0.00 174.62 173.51 1xov s ALA 309 N -3.16 2.88 0.47 11.08 0.00 -1.26 -0.43 121.76 131.34 1xov s ALA 309 Ca 0.27 0.72 0.18 0.00 0.00 0.00 0.00 51.96 53.13 1xov s ALA 309 Cb -0.01 -3.30 1.17 0.00 0.00 0.00 0.00 23.12 20.98 1xov s ALA 309 CO 0.16 -0.45 1.97 -0.91 0.00 0.00 0.00 175.76 176.54 1xov h ASN 310 N 1.71 0.24 0.15 0.00 -0.26 -1.91 -2.04 115.58 113.47 1xov h ASN 310 Ca -0.49 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.26 1xov h ASN 310 Cb 1.23 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 38.45 1xov h ASN 310 CO 0.59 0.13 -0.13 0.00 -1.06 0.00 0.00 177.43 176.97 1xov n TYR 311 N -4.44 0.00 0.67 1.19 0.18 -1.26 -4.08 117.16 109.42 1xov n TYR 311 Ca 0.11 0.00 0.12 0.00 1.88 0.00 0.00 57.90 60.01 1xov n TYR 311 Cb 0.50 -0.08 0.15 0.00 -0.38 0.00 0.00 39.34 39.52 1xov n TYR 311 CO 0.00 0.00 0.00 1.19 -2.08 0.00 0.00 176.86 175.97 1xov n PHE 312 N -0.42 0.35 -4.71 -3.48 3.72 -0.77 -4.85 117.46 107.31 1xov n PHE 312 Ca 0.16 0.10 -0.25 0.00 -0.05 0.00 0.00 57.45 57.41 1xov n PHE 312 Cb 0.33 -0.51 -0.16 0.00 -0.94 0.00 0.00 39.48 38.20 1xov n PHE 312 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1xov s LEU 313 N -3.87 1.84 0.00 4.37 1.43 -1.26 -1.61 118.68 119.58 1xov s LEU 313 Ca 0.07 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 1xov s LEU 313 Cb 0.15 -0.87 0.00 0.00 0.03 0.00 0.00 46.19 45.49 1xov s LEU 313 CO 0.74 0.11 0.00 0.29 0.23 0.00 0.00 176.35 177.72