#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yxt s GLU 4 N 0.00 4.16 -0.26 3.49 1.03 -1.26 -5.05 118.70 120.80 2yxt s GLU 4 Ca 0.00 0.93 -0.06 0.00 0.03 0.00 0.00 54.97 55.87 2yxt s GLU 4 Cb 0.00 -2.35 -0.00 0.00 -0.80 0.00 0.00 34.13 30.98 2yxt s GLU 4 CO 0.00 0.09 0.04 0.00 -1.33 0.00 0.00 175.26 174.05 2yxt s ARG 6 N 1.50 3.39 -0.06 0.00 0.52 -1.26 -0.95 118.95 122.09 2yxt s ARG 6 Ca 0.04 -0.36 0.03 0.00 -0.52 0.00 0.00 55.73 54.92 2yxt s ARG 6 Cb -0.16 -2.98 0.01 0.00 0.52 0.00 0.00 34.95 32.34 2yxt s ARG 6 CO 0.01 0.56 -0.14 0.08 0.02 0.00 0.00 175.30 175.83 2yxt s VAL 7 N -0.46 1.24 -0.32 3.52 1.01 -0.92 -1.90 120.40 122.57 2yxt s VAL 7 Ca 0.09 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.43 2yxt s VAL 7 Cb -0.12 -1.11 0.01 0.00 0.00 0.00 0.00 36.38 35.16 2yxt s VAL 7 CO 0.02 0.37 0.14 -0.22 0.00 0.00 0.00 175.10 175.41 2yxt s LEU 8 N 0.51 4.15 -0.25 3.92 2.96 -0.52 -0.72 118.68 128.73 2yxt s LEU 8 Ca -0.13 -0.70 -0.04 0.00 -0.22 0.00 0.00 54.13 53.05 2yxt s LEU 8 Cb -0.15 -1.96 0.01 0.00 0.50 0.00 0.00 46.19 44.59 2yxt s LEU 8 CO 0.04 -0.23 -0.02 -0.55 -1.32 0.00 0.00 176.35 174.26 2yxt s SER 9 N 1.56 4.48 -0.52 3.68 0.15 -0.51 -0.28 113.70 122.26 2yxt s SER 9 Ca 0.03 -0.62 -0.05 0.00 0.70 0.00 0.00 55.95 56.01 2yxt s SER 9 Cb -0.18 -1.74 0.13 0.00 -1.71 0.00 0.00 66.02 62.53 2yxt s SER 9 CO 0.05 -0.09 0.34 -0.63 1.20 0.00 0.00 173.24 174.11 2yxt s ILE 10 N 1.43 3.74 0.26 6.45 1.01 0.24 -1.29 121.20 133.04 2yxt s ILE 10 Ca 0.03 -2.33 -0.12 0.00 0.00 0.00 0.00 60.65 58.23 2yxt s ILE 10 Cb -0.16 -3.48 -0.00 0.00 0.01 0.00 0.00 42.46 38.83 2yxt s ILE 10 CO -0.02 -0.79 0.48 -1.10 0.00 0.00 0.00 174.94 173.51 2yxt s GLN 11 N 0.73 1.60 0.78 2.79 -0.21 -0.99 -4.04 119.66 120.32 2yxt s GLN 11 Ca 0.11 -1.31 -0.14 0.00 0.02 0.00 0.00 55.36 54.04 2yxt s GLN 11 Cb -0.22 0.47 0.07 0.00 1.00 0.00 0.00 33.01 34.33 2yxt s GLN 11 CO -0.03 -0.67 1.20 -1.54 -2.12 0.00 0.00 175.29 172.13 2yxt s SER 12 N -3.04 3.82 -0.03 5.90 1.04 -1.26 -1.29 113.70 118.83 2yxt s SER 12 Ca 0.23 2.33 0.07 0.00 0.48 0.00 0.00 55.95 59.06 2yxt s SER 12 Cb -0.01 -2.58 -0.02 0.00 0.10 0.00 0.00 66.02 63.51 2yxt s SER 12 CO 0.10 -2.51 -0.24 -2.28 0.98 0.00 0.00 173.24 169.28 2yxt s HIS 13 N -2.15 2.26 0.08 5.02 2.46 0.58 -1.22 115.29 122.32 2yxt s HIS 13 Ca 0.73 -0.51 0.07 0.00 0.47 0.00 0.00 55.06 55.81 2yxt s HIS 13 Cb -0.28 -1.47 -0.03 0.00 -0.13 0.00 0.00 32.58 30.67 2yxt s HIS 13 CO 0.49 -0.10 -0.18 0.14 -2.47 0.00 0.00 174.74 172.62 2yxt s VAL 14 N -0.43 1.46 -0.05 0.89 -7.23 -1.26 -0.55 120.40 113.24 2yxt s VAL 14 Ca 0.05 -1.37 -0.14 0.00 -1.81 0.00 0.00 61.98 58.71 2yxt s VAL 14 Cb -0.11 -1.34 -0.08 0.00 0.56 0.00 0.00 36.38 35.41 2yxt s VAL 14 CO 0.01 -0.07 0.57 0.40 -0.31 0.00 0.00 175.10 175.69 2yxt h ILE 15 N 4.22 0.10 -3.11 -0.62 2.04 -1.00 -3.44 117.51 115.72 2yxt h ILE 15 Ca -0.43 -0.73 -0.61 0.00 1.00 0.00 0.00 64.86 64.09 2yxt h ILE 15 Cb 1.18 0.18 -0.09 0.00 -0.74 0.00 0.00 36.82 37.35 2yxt h ILE 15 CO 0.41 0.03 -0.33 -0.60 0.00 0.00 0.00 178.15 177.65 2yxt s ARG 16 N -3.08 4.02 0.09 2.37 6.06 -0.06 -5.00 118.95 123.35 2yxt s ARG 16 Ca -0.07 0.11 0.00 0.00 -2.50 0.00 0.00 55.73 53.26 2yxt s ARG 16 Cb 0.01 -3.34 0.00 0.00 0.06 0.00 0.00 34.95 31.68 2yxt s ARG 16 CO 0.23 0.44 0.00 0.41 -2.50 0.00 0.00 175.30 173.89 2yxt n GLY 17 N 2.78 -3.16 2.79 8.12 0.00 -1.26 -4.48 105.19 109.98 2yxt n GLY 17 Ca -0.14 -1.95 -0.30 0.00 0.00 0.00 0.00 46.02 43.63 2yxt n GLY 17 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yxt s TYR 18 N -0.65 1.92 0.17 1.61 1.51 -1.26 -4.84 117.35 115.80 2yxt s TYR 18 Ca 0.00 -1.77 -0.13 0.00 -1.01 0.00 0.00 57.07 54.16 2yxt s TYR 18 Cb 0.00 -1.75 0.01 0.00 -0.11 0.00 0.00 41.96 40.11 2yxt s TYR 18 CO 0.00 -0.84 0.40 0.14 -1.11 0.00 0.00 175.55 174.13 2yxt s VAL 19 N 1.55 0.05 0.00 0.71 -7.23 -1.26 -4.13 120.40 110.08 2yxt s VAL 19 Ca 0.07 -1.03 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 2yxt s VAL 19 Cb -0.18 -1.64 0.00 0.00 0.56 0.00 0.00 36.38 35.12 2yxt s VAL 19 CO -0.19 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 174.97 2yxt n GLY 20 N -0.26 2.49 0.35 2.32 0.00 -1.26 -1.26 105.19 107.57 2yxt n GLY 20 Ca -0.10 -0.31 0.18 0.00 0.00 0.00 0.00 46.02 45.80 2yxt n GLY 20 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2yxt h ASN 21 N 5.89 0.00 0.06 1.61 -0.26 -1.37 0.74 115.58 122.24 2yxt h ASN 21 Ca 0.00 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.61 2yxt h ASN 21 Cb 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.25 2yxt h ASN 21 CO 0.00 0.00 -0.44 0.03 -1.06 0.00 0.00 177.43 175.96 2yxt h ARG 22 N 0.00 0.47 0.05 0.81 3.08 -1.34 0.51 114.38 117.96 2yxt h ARG 22 Ca 0.12 -0.25 -0.25 0.00 0.07 0.00 0.00 59.98 59.67 2yxt h ARG 22 Cb 0.69 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 2yxt h ARG 22 CO -0.00 0.82 -1.25 0.00 -1.07 0.00 0.00 179.97 178.47 2yxt h ALA 23 N 1.14 0.33 0.07 0.04 0.00 -0.63 -3.39 119.26 116.83 2yxt h ALA 23 Ca 0.03 -1.02 -0.30 0.00 0.00 0.00 0.00 54.91 53.62 2yxt h ALA 23 Cb 0.93 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 2yxt h ALA 23 CO 0.08 1.21 -1.59 0.00 0.00 0.00 0.00 179.25 178.95 2yxt h ALA 24 N 0.81 0.47 0.55 0.00 0.00 -1.03 -3.41 119.26 116.64 2yxt h ALA 24 Ca -0.12 -1.24 -0.03 0.00 0.00 0.00 0.00 54.91 53.52 2yxt h ALA 24 Cb 1.89 0.36 0.01 0.00 0.00 0.00 0.00 17.79 20.05 2yxt h ALA 24 CO 0.15 1.33 -0.26 1.15 0.00 0.00 0.00 179.25 181.61 2yxt h THR 25 N 0.04 0.22 -0.49 0.00 2.02 -0.16 -3.13 112.91 111.41 2yxt h THR 25 Ca -0.26 -0.43 0.09 0.00 0.77 0.00 0.00 66.41 66.59 2yxt h THR 25 Cb 1.99 0.32 -0.08 0.00 -1.74 0.00 0.00 68.15 68.64 2yxt h THR 25 CO 0.12 0.04 0.00 0.15 0.37 0.00 0.00 175.52 176.20 2yxt h PHE 26 N -1.09 -0.03 -0.89 3.16 3.57 -1.79 0.13 116.94 120.01 2yxt h PHE 26 Ca -0.08 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.51 2yxt h PHE 26 Cb 0.62 0.09 -0.05 0.00 2.79 0.00 0.00 35.95 39.40 2yxt h PHE 26 CO 0.01 -0.11 0.58 -1.00 -2.23 0.00 0.00 178.31 175.56 2yxt h PRO 27 N 0.12 1.04 -0.04 6.41 0.13 -1.80 0.66 132.00 138.52 2yxt h PRO 27 Ca 0.25 -0.06 -0.17 0.00 -0.87 0.00 0.00 66.00 65.14 2yxt h PRO 27 Cb 0.37 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 31.26 2yxt h PRO 27 CO -0.41 0.69 -0.73 -0.07 -0.23 0.00 0.00 178.00 177.25 2yxt h LEU 28 N 1.07 0.29 -0.32 1.56 3.38 -1.34 -2.57 115.31 117.38 2yxt h LEU 28 Ca 0.37 -0.20 -0.18 0.00 0.09 0.00 0.00 57.88 57.96 2yxt h LEU 28 Cb 0.09 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2yxt h LEU 28 CO -0.12 0.92 -0.51 1.56 0.09 0.00 0.00 178.44 180.38 2yxt h GLN 29 N 0.16 0.89 0.00 1.13 4.20 -0.25 -2.11 115.11 119.14 2yxt h GLN 29 Ca -0.02 -0.54 -0.02 0.00 0.06 0.00 0.00 58.65 58.12 2yxt h GLN 29 Cb 1.30 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 29.13 2yxt h GLN 29 CO 0.11 1.18 -0.08 0.28 -0.67 0.00 0.00 178.83 179.65 2yxt h VAL 30 N 0.70 0.92 -0.10 -0.54 2.07 -0.83 -0.01 116.25 118.46 2yxt h VAL 30 Ca 0.03 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2yxt h VAL 30 Cb 1.12 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2yxt h VAL 30 CO 0.12 0.08 0.00 0.18 0.02 0.00 0.00 177.57 177.97 2yxt n LEU 31 N -4.24 1.50 0.00 2.57 4.77 -0.98 -4.86 117.00 115.77 2yxt n LEU 31 Ca -0.03 -0.58 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 2yxt n LEU 31 Cb 0.16 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2yxt n LEU 31 CO 0.33 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 2yxt n GLY 32 N 1.13 0.63 3.76 -0.72 0.00 -0.02 -5.06 105.19 104.91 2yxt n GLY 32 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 2yxt n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2yxt s PHE 33 N -2.17 3.76 -1.31 1.61 0.40 -0.81 -4.74 117.98 114.71 2yxt s PHE 33 Ca 0.00 1.43 -0.18 0.00 -0.60 0.00 0.00 56.93 57.58 2yxt s PHE 33 Cb 0.00 -2.74 0.06 0.00 0.51 0.00 0.00 43.02 40.85 2yxt s PHE 33 CO 0.00 0.35 1.80 0.39 0.70 0.00 0.00 175.22 178.46 2yxt n GLU 34 N 2.51 3.13 -3.43 0.44 -0.58 -0.12 -4.35 120.64 118.24 2yxt n GLU 34 Ca -0.04 -3.19 -0.37 0.00 -0.42 0.00 0.00 57.16 53.13 2yxt n GLU 34 Cb 0.50 -3.48 -0.06 0.00 -0.57 0.00 0.00 31.44 27.83 2yxt n GLU 34 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 2yxt s ILE 35 N 4.24 5.21 -0.15 -3.67 2.07 -1.26 -2.16 121.20 125.48 2yxt s ILE 35 Ca 0.53 0.77 -0.04 0.00 -1.41 0.00 0.00 60.65 60.51 2yxt s ILE 35 Cb 0.05 -3.73 -0.03 0.00 0.13 0.00 0.00 42.46 38.88 2yxt s ILE 35 CO 0.06 0.39 -0.02 -1.81 -1.91 0.00 0.00 174.94 171.65 2yxt s ASP 36 N 0.30 4.93 -0.21 4.50 1.01 0.11 -4.95 116.67 122.36 2yxt s ASP 36 Ca 0.22 -0.08 -0.06 0.00 0.71 0.00 0.00 52.55 53.34 2yxt s ASP 36 Cb -0.14 -1.76 -0.03 0.00 1.01 0.00 0.00 42.92 42.00 2yxt s ASP 36 CO 0.08 0.19 0.04 0.00 0.21 0.00 0.00 175.17 175.69 2yxt s ALA 37 N 0.21 3.14 -0.27 5.23 0.00 -1.26 -1.42 121.76 127.39 2yxt s ALA 37 Ca -0.01 -0.99 -0.07 0.00 0.00 0.00 0.00 51.96 50.89 2yxt s ALA 37 Cb -0.14 -1.90 -0.01 0.00 0.00 0.00 0.00 23.12 21.08 2yxt s ALA 37 CO 0.02 -0.21 0.06 0.08 0.00 0.00 0.00 175.76 175.72 2yxt s VAL 38 N 1.10 4.00 -0.53 0.00 1.01 -0.41 -4.99 120.40 120.58 2yxt s VAL 38 Ca 0.03 -0.49 -0.21 0.00 0.00 0.00 0.00 61.98 61.31 2yxt s VAL 38 Cb -0.14 -2.97 0.05 0.00 0.00 0.00 0.00 36.38 33.32 2yxt s VAL 38 CO 0.02 0.21 0.77 0.20 0.00 0.00 0.00 175.10 176.31 2yxt s ASN 39 N 1.54 6.28 0.57 3.32 0.02 -1.26 -2.34 114.94 123.06 2yxt s ASN 39 Ca 0.04 -0.64 0.27 0.00 -1.02 0.00 0.00 52.86 51.51 2yxt s ASN 39 Cb -0.16 -2.36 1.70 0.00 0.02 0.00 0.00 41.25 40.45 2yxt s ASN 39 CO 0.02 -1.05 2.22 0.77 0.02 0.00 0.00 177.10 179.09 2yxt h SER 40 N 9.14 0.00 -5.09 -1.22 4.64 -1.51 -3.43 113.55 116.08 2yxt h SER 40 Ca -0.27 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.02 2yxt h SER 40 Cb 1.08 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.07 2yxt h SER 40 CO 1.02 0.01 0.01 0.68 -0.87 0.00 0.00 176.83 177.68 2yxt s VAL 41 N -4.67 0.03 -0.23 0.95 -7.23 -1.26 -0.46 120.40 107.53 2yxt s VAL 41 Ca -0.05 -0.78 -0.04 0.00 -1.81 0.00 0.00 61.98 59.30 2yxt s VAL 41 Cb 0.15 -1.55 0.08 0.00 0.56 0.00 0.00 36.38 35.62 2yxt s VAL 41 CO 0.57 -0.14 0.10 -1.58 -0.31 0.00 0.00 175.10 173.74 2yxt s GLN 42 N -3.87 0.24 0.30 4.82 0.74 -0.32 -0.31 119.66 121.26 2yxt s GLN 42 Ca 0.09 -0.37 0.10 0.00 0.05 0.00 0.00 55.36 55.23 2yxt s GLN 42 Cb -0.01 -1.63 -0.05 0.00 1.10 0.00 0.00 33.01 32.43 2yxt s GLN 42 CO -0.03 -0.82 -0.06 -0.06 -0.55 0.00 0.00 175.29 173.76 2yxt s PHE 43 N 2.05 2.50 0.24 1.67 0.40 0.29 -1.29 117.98 123.84 2yxt s PHE 43 Ca 0.05 -0.36 0.02 0.00 -0.60 0.00 0.00 56.93 56.04 2yxt s PHE 43 Cb -0.16 -1.26 0.28 0.00 0.51 0.00 0.00 43.02 42.38 2yxt s PHE 43 CO -0.21 0.59 1.60 0.66 0.70 0.00 0.00 175.22 178.56 2yxt h SER 44 N 1.98 0.40 -5.44 1.36 4.64 -1.15 -0.66 113.55 114.68 2yxt h SER 44 Ca -0.42 -0.20 0.19 0.00 -0.47 0.00 0.00 61.79 60.89 2yxt h SER 44 Cb 1.25 -0.11 -0.06 0.00 -0.31 0.00 0.00 62.40 63.17 2yxt h SER 44 CO 0.64 0.83 0.59 0.54 -0.87 0.00 0.00 176.83 178.55 2yxt s ASN 45 N -6.88 -0.07 0.79 4.97 2.20 -1.26 -0.88 114.94 113.80 2yxt s ASN 45 Ca -0.06 -0.49 -0.11 0.00 -0.94 0.00 0.00 52.86 51.26 2yxt s ASN 45 Cb 0.12 0.44 0.06 0.00 -2.00 0.00 0.00 41.25 39.88 2yxt s ASN 45 CO 0.80 -0.85 1.09 -1.38 -2.94 0.00 0.00 177.10 173.82 2yxt s HIS 46 N -2.63 2.74 -2.00 1.54 -3.43 -1.26 -4.83 115.29 105.43 2yxt s HIS 46 Ca 0.17 1.32 0.17 0.00 -0.80 0.00 0.00 55.06 55.92 2yxt s HIS 46 Cb -0.01 -3.06 1.01 0.00 -1.43 0.00 0.00 32.58 29.10 2yxt s HIS 46 CO 0.03 -1.77 1.45 0.25 -2.00 0.00 0.00 174.74 172.69 2yxt n THR 47 N -3.47 0.00 1.49 -5.38 -2.24 -1.26 -2.92 114.28 100.50 2yxt n THR 47 Ca 0.08 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.00 2yxt n THR 47 Cb 0.55 -0.58 0.68 0.00 -2.10 0.00 0.00 70.33 68.88 2yxt n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yxt n GLY 48 N 0.28 -0.98 3.93 3.38 0.00 -1.26 -4.85 105.19 105.70 2yxt n GLY 48 Ca 0.13 -0.24 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 2yxt n GLY 48 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yxt s TYR 49 N -2.42 3.31 0.52 1.61 1.51 -1.15 -4.89 117.35 115.85 2yxt s TYR 49 Ca 0.31 0.45 0.21 0.00 -1.01 0.00 0.00 57.07 57.03 2yxt s TYR 49 Cb 0.20 -2.39 1.42 0.00 -0.11 0.00 0.00 41.96 41.09 2yxt s TYR 49 CO 0.45 -0.43 2.15 0.00 -1.11 0.00 0.00 175.55 176.62 2yxt h ALA 50 N 0.25 1.75 -2.63 3.71 0.00 -1.91 -3.43 119.26 116.99 2yxt h ALA 50 Ca -0.46 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.24 2yxt h ALA 50 Cb 1.24 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.85 2yxt h ALA 50 CO 0.59 0.05 -0.70 -1.01 0.00 0.00 0.00 179.25 178.18 2yxt s HIS 51 N -4.80 0.48 -0.03 0.00 3.76 -1.26 -5.16 115.29 108.28 2yxt s HIS 51 Ca -0.05 -0.78 -0.26 0.00 -0.15 0.00 0.00 55.06 53.82 2yxt s HIS 51 Cb 0.16 -0.33 0.06 0.00 1.11 0.00 0.00 32.58 33.58 2yxt s HIS 51 CO 0.63 -0.25 0.57 1.67 -0.85 0.00 0.00 174.74 176.51 2yxt s TRP 52 N -2.65 -0.51 0.02 1.40 -2.14 -1.26 -4.85 118.94 108.94 2yxt s TRP 52 Ca -0.03 0.84 -0.06 0.00 2.66 0.00 0.00 56.10 59.51 2yxt s TRP 52 Cb -0.01 0.33 -0.01 0.00 -3.10 0.00 0.00 33.47 30.68 2yxt s TRP 52 CO -0.05 -0.56 0.10 0.15 -2.66 0.00 0.00 176.95 173.93 2yxt s LYS 53 N -1.38 0.49 0.00 3.25 -0.14 -1.26 -5.01 119.74 115.69 2yxt s LYS 53 Ca -0.11 -0.55 0.00 0.00 -1.36 0.00 0.00 55.97 53.95 2yxt s LYS 53 Cb -0.01 0.20 0.00 0.00 -1.68 0.00 0.00 37.83 36.33 2yxt s LYS 53 CO 0.07 -0.12 0.00 0.41 -0.76 0.00 0.00 175.35 174.96 2yxt n GLY 54 N 1.24 -0.94 3.38 -3.33 0.00 -1.26 -0.59 105.19 103.69 2yxt n GLY 54 Ca -0.22 -1.19 -0.19 0.00 0.00 0.00 0.00 46.02 44.41 2yxt n GLY 54 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yxt s GLN 55 N -2.00 1.42 0.18 1.61 1.11 -0.41 -4.97 119.66 116.60 2yxt s GLN 55 Ca 0.00 -1.68 0.10 0.00 0.01 0.00 0.00 55.36 53.79 2yxt s GLN 55 Cb 0.00 -1.07 -0.04 0.00 -1.01 0.00 0.00 33.01 30.89 2yxt s GLN 55 CO 0.00 0.09 -0.17 0.14 0.01 0.00 0.00 175.29 175.36 2yxt s VAL 56 N -3.04 2.78 -0.07 1.09 -7.23 -1.26 -1.18 120.40 111.49 2yxt s VAL 56 Ca 0.26 -1.82 -0.20 0.00 -1.81 0.00 0.00 61.98 58.41 2yxt s VAL 56 Cb 0.02 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 2yxt s VAL 56 CO 0.09 -0.10 0.56 -0.22 -0.31 0.00 0.00 175.10 175.12 2yxt s LEU 57 N -2.72 4.33 0.36 1.32 2.96 0.39 -4.94 118.68 120.38 2yxt s LEU 57 Ca 0.23 1.00 0.05 0.00 -0.22 0.00 0.00 54.13 55.18 2yxt s LEU 57 Cb -0.08 -2.84 -0.01 0.00 0.50 0.00 0.00 46.19 43.76 2yxt s LEU 57 CO 0.12 0.01 0.51 0.54 -1.32 0.00 0.00 176.35 176.22 2yxt s ASN 58 N 0.39 5.97 0.33 3.68 2.20 -1.26 -4.90 114.94 121.36 2yxt s ASN 58 Ca 0.30 -0.03 0.08 0.00 -0.94 0.00 0.00 52.86 52.26 2yxt s ASN 58 Cb -0.17 -1.37 0.78 0.00 -2.00 0.00 0.00 41.25 38.50 2yxt s ASN 58 CO 0.14 -0.47 1.82 0.77 -2.94 0.00 0.00 177.10 176.42 2yxt h SER 59 N 0.79 0.72 -0.38 3.54 4.64 -1.93 0.48 113.55 121.41 2yxt h SER 59 Ca -0.46 0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 60.90 2yxt h SER 59 Cb 1.25 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 2yxt h SER 59 CO 0.55 0.31 0.17 0.44 -0.87 0.00 0.00 176.83 177.42 2yxt h ASP 60 N 0.73 0.52 -0.42 4.97 3.32 -1.96 0.23 116.42 123.81 2yxt h ASP 60 Ca 0.52 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 57.33 2yxt h ASP 60 Cb 0.84 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.24 2yxt h ASP 60 CO -0.29 0.52 -0.08 -0.33 -1.72 0.00 0.00 179.24 177.35 2yxt h GLU 61 N 0.48 0.87 -0.25 3.56 5.08 -1.65 -0.16 114.58 122.51 2yxt h GLU 61 Ca 0.13 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2yxt h GLU 61 Cb 0.15 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2yxt h GLU 61 CO -0.01 0.91 0.15 1.25 -1.00 0.00 0.00 179.01 180.31 2yxt h LEU 62 N 0.79 0.29 -0.86 1.33 5.85 -0.72 -1.70 115.31 120.29 2yxt h LEU 62 Ca 0.13 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.83 2yxt h LEU 62 Cb 0.58 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2yxt h LEU 62 CO 0.04 0.24 0.57 -0.61 -0.34 0.00 0.00 178.44 178.34 2yxt h GLN 63 N 0.32 1.12 -0.55 1.25 4.15 -0.58 -2.47 115.11 118.35 2yxt h GLN 63 Ca 0.09 -0.07 0.06 0.00 0.77 0.00 0.00 58.65 59.50 2yxt h GLN 63 Cb -0.00 -0.25 -0.05 0.00 0.21 0.00 0.00 27.48 27.38 2yxt h GLN 63 CO -0.02 0.74 0.26 1.49 -1.93 0.00 0.00 178.83 179.37 2yxt h GLU 64 N 1.15 0.48 -0.48 1.69 4.81 -0.69 0.05 114.58 121.59 2yxt h GLU 64 Ca 0.32 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.51 2yxt h GLU 64 Cb -0.12 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 2yxt h GLU 64 CO -0.07 0.32 0.26 -0.07 -0.73 0.00 0.00 179.01 178.71 2yxt h LEU 65 N 0.49 0.61 -0.68 1.64 3.38 -0.93 -2.21 115.31 117.61 2yxt h LEU 65 Ca 0.26 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.13 2yxt h LEU 65 Cb 0.21 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2yxt h LEU 65 CO -0.20 0.54 0.45 0.22 0.09 0.00 0.00 178.44 179.54 2yxt h TYR 66 N 0.64 0.85 -0.84 1.13 3.20 -1.10 -2.32 116.97 118.53 2yxt h TYR 66 Ca 0.17 0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.14 2yxt h TYR 66 Cb 0.07 -0.29 -0.07 0.00 1.54 0.00 0.00 36.73 37.98 2yxt h TYR 66 CO -0.02 0.53 0.50 0.93 -1.64 0.00 0.00 178.16 178.47 2yxt h GLU 67 N 0.92 0.85 -0.33 1.82 4.39 -0.48 0.34 114.58 122.08 2yxt h GLU 67 Ca 0.25 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.92 2yxt h GLU 67 Cb -0.09 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.34 2yxt h GLU 67 CO -0.06 0.56 0.19 0.78 -1.16 0.00 0.00 179.01 179.32 2yxt h GLY 68 N 0.87 0.46 1.00 -3.84 0.00 -0.90 0.48 103.07 101.14 2yxt h GLY 68 Ca 0.39 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2yxt h GLY 68 CO -0.21 0.13 0.02 1.41 0.00 0.00 0.00 176.54 177.88 2yxt h LEU 69 N 0.39 0.03 -0.07 3.11 3.38 -0.82 -2.57 115.31 118.77 2yxt h LEU 69 Ca 0.13 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2yxt h LEU 69 Cb 0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2yxt h LEU 69 CO -0.06 0.02 0.04 -0.09 0.09 0.00 0.00 178.44 178.45 2yxt h ARG 70 N 0.03 0.09 -0.40 1.13 2.43 -0.03 0.62 114.38 118.25 2yxt h ARG 70 Ca 0.01 -0.01 0.12 0.00 -0.81 0.00 0.00 59.98 59.29 2yxt h ARG 70 Cb -0.00 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 2yxt h ARG 70 CO -0.00 0.08 0.34 -0.07 -1.51 0.00 0.00 179.97 178.81 2yxt h LEU 71 N 0.07 0.00 -1.92 3.80 3.38 0.05 0.27 115.31 120.96 2yxt h LEU 71 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2yxt h LEU 71 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2yxt h LEU 71 CO -0.00 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.12 2yxt n ASN 72 N -4.06 2.87 -1.85 -0.43 3.02 -0.93 -4.92 115.26 108.95 2yxt n ASN 72 Ca 0.07 -1.91 -0.16 0.00 -0.03 0.00 0.00 54.58 52.54 2yxt n ASN 72 Cb 0.52 -0.22 -0.01 0.00 -0.61 0.00 0.00 39.78 39.47 2yxt n ASN 72 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2yxt n ASN 73 N 1.10 -4.80 -1.68 6.41 5.15 0.96 -4.86 115.26 117.54 2yxt n ASN 73 Ca 0.18 -0.02 0.07 0.00 -0.60 0.00 0.00 54.58 54.21 2yxt n ASN 73 Cb 0.51 -3.91 0.38 0.00 -0.53 0.00 0.00 39.78 36.23 2yxt n ASN 73 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 2yxt n MET 74 N -2.57 4.46 -2.10 1.20 2.81 0.21 -4.59 117.12 116.54 2yxt n MET 74 Ca -0.19 -3.09 -0.39 0.00 -1.81 0.00 0.00 57.70 52.22 2yxt n MET 74 Cb 0.64 -2.17 0.02 0.00 -0.71 0.00 0.00 33.22 31.01 2yxt n MET 74 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2yxt n ASN 75 N 0.41 7.43 -3.81 7.83 6.94 -1.22 -4.79 115.26 128.05 2yxt n ASN 75 Ca 0.26 -3.72 -0.30 0.00 -0.02 0.00 0.00 54.58 50.80 2yxt n ASN 75 Cb 1.13 -1.12 -0.15 0.00 -2.36 0.00 0.00 39.78 37.27 2yxt n ASN 75 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2yxt s LYS 76 N -3.86 0.94 0.15 -3.83 1.02 -1.26 -4.87 119.74 108.01 2yxt s LYS 76 Ca 0.49 -1.32 0.11 0.00 0.02 0.00 0.00 55.97 55.27 2yxt s LYS 76 Cb 0.35 -2.32 -0.04 0.00 -0.52 0.00 0.00 37.83 35.30 2yxt s LYS 76 CO -0.31 -0.98 -0.25 0.71 -0.92 0.00 0.00 175.35 173.60 2yxt s TYR 77 N 1.38 2.25 0.03 3.18 1.51 -1.26 -4.93 117.35 119.52 2yxt s TYR 77 Ca 0.10 -0.38 0.04 0.00 -1.01 0.00 0.00 57.07 55.83 2yxt s TYR 77 Cb -0.18 -1.18 -0.24 0.00 -0.11 0.00 0.00 41.96 40.24 2yxt s TYR 77 CO -0.20 0.38 0.97 -0.44 -1.11 0.00 0.00 175.55 175.15 2yxt h ASP 78 N 3.67 0.16 -5.05 2.29 3.32 -1.77 -3.42 116.42 115.61 2yxt h ASP 78 Ca -0.49 -0.22 -0.12 0.00 0.02 0.00 0.00 57.03 56.22 2yxt h ASP 78 Cb 1.18 -0.05 -0.18 0.00 0.22 0.00 0.00 39.33 40.50 2yxt h ASP 78 CO 0.42 1.18 -0.44 -0.31 -1.72 0.00 0.00 179.24 178.37 2yxt s TYR 79 N -2.65 0.08 -0.02 4.55 1.51 -0.81 -1.57 117.35 118.44 2yxt s TYR 79 Ca -0.04 -0.29 0.05 0.00 -1.01 0.00 0.00 57.07 55.78 2yxt s TYR 79 Cb 0.08 -0.06 -0.01 0.00 -0.11 0.00 0.00 41.96 41.86 2yxt s TYR 79 CO 0.84 -0.38 -0.17 0.08 -1.11 0.00 0.00 175.55 174.80 2yxt s VAL 80 N -2.29 1.39 -0.08 0.71 1.01 -0.60 -1.44 120.40 119.10 2yxt s VAL 80 Ca -0.07 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.17 2yxt s VAL 80 Cb -0.03 -1.16 0.02 0.00 0.00 0.00 0.00 36.38 35.21 2yxt s VAL 80 CO -0.03 0.39 -0.10 -0.22 0.00 0.00 0.00 175.10 175.15 2yxt s LEU 81 N -0.36 1.46 0.06 3.92 2.96 0.62 0.00 118.68 127.34 2yxt s LEU 81 Ca 0.06 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.69 2yxt s LEU 81 Cb -0.07 -0.80 -0.03 0.00 0.50 0.00 0.00 46.19 45.78 2yxt s LEU 81 CO -0.00 -0.03 -0.06 0.42 -1.32 0.00 0.00 176.35 175.35 2yxt s THR 82 N 1.06 0.53 0.00 3.68 -4.23 -0.87 -0.59 115.64 115.22 2yxt s THR 82 Ca -0.07 -1.51 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2yxt s THR 82 Cb -0.15 -1.14 0.00 0.00 1.34 0.00 0.00 72.50 72.56 2yxt s THR 82 CO -0.01 -0.67 0.00 0.61 -0.54 0.00 0.00 174.62 174.01 2yxt n GLY 83 N 0.68 4.87 3.70 3.99 0.00 -1.26 -1.42 105.19 115.75 2yxt n GLY 83 Ca -0.17 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 2yxt n GLY 83 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2yxt s TYR 84 N 3.24 2.39 0.00 1.61 6.14 -1.26 -4.57 117.35 124.90 2yxt s TYR 84 Ca 0.00 0.16 0.02 0.00 0.64 0.00 0.00 57.07 57.89 2yxt s TYR 84 Cb 0.00 -4.10 -0.01 0.00 0.42 0.00 0.00 41.96 38.27 2yxt s TYR 84 CO 0.00 -4.44 -0.05 0.99 0.64 0.00 0.00 175.55 172.68 2yxt s THR 85 N 2.36 0.40 -0.87 4.34 2.01 -1.26 -4.60 115.64 118.02 2yxt s THR 85 Ca 0.78 -0.35 0.09 0.00 0.31 0.00 0.00 61.69 62.52 2yxt s THR 85 Cb -0.45 -0.37 0.20 0.00 0.01 0.00 0.00 72.50 71.89 2yxt s THR 85 CO 0.34 0.03 1.08 -1.14 -0.69 0.00 0.00 174.62 174.25 2yxt n ARG 86 N 2.72 2.12 -4.50 4.92 0.63 -1.26 -4.94 116.66 116.34 2yxt n ARG 86 Ca -0.14 -1.68 -0.33 0.00 -0.92 0.00 0.00 57.85 54.77 2yxt n ARG 86 Cb 0.58 -1.21 -0.16 0.00 0.45 0.00 0.00 32.46 32.12 2yxt n ARG 86 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2yxt s ASP 87 N -0.93 3.35 0.11 6.15 2.15 -1.26 -4.64 116.67 121.60 2yxt s ASP 87 Ca 0.17 -0.56 -0.22 0.00 0.43 0.00 0.00 52.55 52.37 2yxt s ASP 87 Cb 0.09 -1.50 -0.09 0.00 -0.30 0.00 0.00 42.92 41.12 2yxt s ASP 87 CO 0.12 0.06 1.72 0.50 -0.17 0.00 0.00 175.17 177.41 2yxt h LYS 88 N 7.45 -0.04 -0.77 4.34 3.64 -1.94 -0.05 116.57 129.19 2yxt h LYS 88 Ca -0.35 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.06 2yxt h LYS 88 Cb 1.18 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.96 2yxt h LYS 88 CO 0.57 -0.03 0.49 1.03 -2.27 0.00 0.00 179.45 179.25 2yxt h SER 89 N -0.04 0.82 0.06 4.20 0.87 -1.99 -1.54 113.55 115.93 2yxt h SER 89 Ca 0.05 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2yxt h SER 89 Cb 0.11 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 2yxt h SER 89 CO -0.10 0.57 -0.03 0.15 -0.53 0.00 0.00 176.83 176.89 2yxt h PHE 90 N 0.97 -0.08 -0.81 2.24 3.57 -1.89 -1.71 116.94 119.23 2yxt h PHE 90 Ca 0.30 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.89 2yxt h PHE 90 Cb -0.01 0.03 -0.07 0.00 2.79 0.00 0.00 35.95 38.68 2yxt h PHE 90 CO -0.03 0.13 0.46 1.25 -2.23 0.00 0.00 178.31 177.90 2yxt h LEU 91 N -0.28 0.67 -0.75 0.59 6.46 -0.84 -0.24 115.31 120.92 2yxt h LEU 91 Ca -0.01 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.78 2yxt h LEU 91 Cb 0.24 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.06 2yxt h LEU 91 CO 0.01 0.39 0.40 0.00 -0.62 0.00 0.00 178.44 178.62 2yxt h ALA 92 N 1.45 0.96 -0.38 1.25 0.00 -1.12 -1.42 119.26 120.00 2yxt h ALA 92 Ca 0.39 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 2yxt h ALA 92 Cb 0.34 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2yxt h ALA 92 CO -0.24 0.48 -0.01 1.98 0.00 0.00 0.00 179.25 181.46 2yxt h MET 93 N 1.03 0.60 -0.94 0.00 1.85 -0.33 -2.05 114.93 115.09 2yxt h MET 93 Ca 0.26 -0.14 0.02 0.00 -0.61 0.00 0.00 59.70 59.23 2yxt h MET 93 Cb 0.05 -0.08 -0.05 0.00 0.43 0.00 0.00 31.60 31.94 2yxt h MET 93 CO -0.04 0.63 0.62 0.28 -0.40 0.00 0.00 176.91 178.00 2yxt h VAL 94 N 0.57 1.20 -0.18 -5.77 2.07 -0.14 -1.03 116.25 112.98 2yxt h VAL 94 Ca 0.12 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 2yxt h VAL 94 Cb 0.37 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 2yxt h VAL 94 CO 0.01 0.23 0.10 0.58 0.02 0.00 0.00 177.57 178.51 2yxt h VAL 95 N 1.24 1.10 -0.95 2.57 2.07 -0.89 0.93 116.25 122.32 2yxt h VAL 95 Ca 0.36 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.61 2yxt h VAL 95 Cb -0.08 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 2yxt h VAL 95 CO -0.10 0.10 0.63 0.44 0.02 0.00 0.00 177.57 178.66 2yxt h ASP 96 N 0.19 1.09 -0.13 0.57 3.32 -0.82 0.19 116.42 120.83 2yxt h ASP 96 Ca 0.06 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 2yxt h ASP 96 Cb 0.07 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 2yxt h ASP 96 CO -0.01 0.79 -0.04 0.40 -1.72 0.00 0.00 179.24 178.66 2yxt h ILE 97 N 1.29 1.30 -0.48 0.35 2.04 -0.84 0.09 117.51 121.25 2yxt h ILE 97 Ca 0.35 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 2yxt h ILE 97 Cb -0.14 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 2yxt h ILE 97 CO -0.08 0.29 0.21 0.58 0.00 0.00 0.00 178.15 179.15 2yxt h VAL 98 N -0.07 1.20 -0.38 1.67 2.07 -0.59 0.25 116.25 120.40 2yxt h VAL 98 Ca 0.03 -0.58 0.08 0.00 0.82 0.00 0.00 66.70 67.05 2yxt h VAL 98 Cb 0.46 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 30.85 2yxt h VAL 98 CO 0.01 0.22 -0.15 -0.61 0.02 0.00 0.00 177.57 177.07 2yxt h GLN 99 N 0.63 -0.07 -0.33 1.57 4.15 -0.53 0.25 115.11 120.78 2yxt h GLN 99 Ca 0.16 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.49 2yxt h GLN 99 Cb 0.15 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.84 2yxt h GLN 99 CO -0.02 -0.05 -0.20 1.49 -1.93 0.00 0.00 178.83 178.13 2yxt h GLU 100 N -0.07 0.62 -0.24 1.69 4.81 -0.36 -1.91 114.58 119.11 2yxt h GLU 100 Ca 0.19 -0.23 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 2yxt h GLU 100 Cb 0.36 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2yxt h GLU 100 CO -0.43 0.78 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.48 2yxt h LEU 101 N 0.55 0.36 -0.49 1.64 3.38 0.60 -1.41 115.31 119.94 2yxt h LEU 101 Ca 0.09 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 2yxt h LEU 101 Cb 0.65 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2yxt h LEU 101 CO 0.05 0.49 -0.26 0.11 0.09 0.00 0.00 178.44 178.92 2yxt h LYS 102 N 0.36 0.96 -0.13 1.13 1.57 -0.29 0.30 116.57 120.47 2yxt h LYS 102 Ca 0.07 -0.43 -0.04 0.00 -1.87 0.00 0.00 60.65 58.38 2yxt h LYS 102 Cb 0.39 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2yxt h LYS 102 CO 0.02 1.10 -0.12 1.96 -0.57 0.00 0.00 179.45 181.84 2yxt h GLN 103 N 0.82 0.20 -0.01 3.15 4.20 -0.66 -1.54 115.11 121.27 2yxt h GLN 103 Ca 0.10 -0.04 -0.21 0.00 0.06 0.00 0.00 58.65 58.55 2yxt h GLN 103 Cb 0.84 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.59 2yxt h GLN 103 CO 0.07 0.33 -0.90 0.37 -0.67 0.00 0.00 178.83 178.03 2yxt h GLN 104 N 0.20 0.35 -2.36 1.46 5.75 -0.86 -3.40 115.11 116.24 2yxt h GLN 104 Ca 0.04 -0.37 -0.49 0.00 -0.15 0.00 0.00 58.65 57.68 2yxt h GLN 104 Cb 0.34 0.10 -0.36 0.00 1.07 0.00 0.00 27.48 28.63 2yxt h GLN 104 CO 0.02 1.05 -0.78 1.21 -2.65 0.00 0.00 178.83 177.68 2yxt s ASN 105 N -7.03 2.32 0.53 -0.69 2.47 0.10 -5.02 114.94 107.62 2yxt s ASN 105 Ca -0.05 -1.82 0.29 0.00 0.42 0.00 0.00 52.86 51.70 2yxt s ASN 105 Cb 0.09 -0.01 1.44 0.00 -1.45 0.00 0.00 41.25 41.33 2yxt s ASN 105 CO 0.85 -0.31 1.93 -0.65 -3.72 0.00 0.00 177.10 175.20 2yxt h PRO 106 N 7.23 0.01 0.00 0.43 0.11 -1.53 0.97 132.00 139.22 2yxt h PRO 106 Ca 0.02 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 2yxt h PRO 106 Cb 1.01 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2yxt h PRO 106 CO 0.26 0.01 0.00 0.54 -0.21 0.00 0.00 178.00 178.60 2yxt n ARG 107 N -4.31 0.37 -1.67 1.05 1.74 -1.26 -4.90 116.66 107.67 2yxt n ARG 107 Ca 0.15 0.05 -0.46 0.00 -0.77 0.00 0.00 57.85 56.83 2yxt n ARG 107 Cb 0.83 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.73 2yxt n ARG 107 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2yxt n LEU 108 N -1.27 3.09 -4.53 0.55 0.00 0.34 -4.96 117.00 110.21 2yxt n LEU 108 Ca 0.12 1.10 -0.37 0.00 0.00 0.00 0.00 56.01 56.86 2yxt n LEU 108 Cb 0.19 -1.43 -0.12 0.00 0.00 0.00 0.00 43.42 42.07 2yxt n LEU 108 CO 0.19 -0.36 -0.21 -0.69 0.00 0.00 0.00 177.39 176.31 2yxt s VAL 109 N 0.58 4.90 -0.31 1.96 1.01 -0.61 -4.98 120.40 122.95 2yxt s VAL 109 Ca 0.75 0.02 -0.12 0.00 0.00 0.00 0.00 61.98 62.63 2yxt s VAL 109 Cb -0.67 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 2yxt s VAL 109 CO 0.42 0.28 0.24 -0.47 0.00 0.00 0.00 175.10 175.57 2yxt s TYR 110 N 1.70 3.22 -0.38 5.22 5.04 -1.26 -1.56 117.35 129.33 2yxt s TYR 110 Ca 0.07 -0.01 -0.15 0.00 -2.44 0.00 0.00 57.07 54.54 2yxt s TYR 110 Cb -0.16 -2.46 0.01 0.00 0.35 0.00 0.00 41.96 39.70 2yxt s TYR 110 CO 0.08 -0.27 0.31 0.08 -1.34 0.00 0.00 175.55 174.40 2yxt s VAL 111 N 1.79 5.23 -0.18 3.14 1.01 0.10 -0.81 120.40 130.69 2yxt s VAL 111 Ca 0.08 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 2yxt s VAL 111 Cb -0.17 -3.87 -0.00 0.00 0.00 0.00 0.00 36.38 32.34 2yxt s VAL 111 CO 0.11 -0.21 -0.12 0.00 0.00 0.00 0.00 175.10 174.87 2yxt s ASP 113 N 1.03 6.08 -1.22 0.00 2.15 -0.51 -2.55 116.67 121.66 2yxt s ASP 113 Ca -0.01 -1.81 -0.19 0.00 0.43 0.00 0.00 52.55 50.98 2yxt s ASP 113 Cb -0.15 -2.17 -0.02 0.00 -0.30 0.00 0.00 42.92 40.29 2yxt s ASP 113 CO -0.02 -0.82 1.95 -0.81 -0.17 0.00 0.00 175.17 175.29 2yxt n PRO 114 N 5.18 2.44 -2.34 4.34 -0.04 -1.26 -4.29 135.00 139.03 2yxt n PRO 114 Ca -0.13 -2.65 -0.43 0.00 -0.04 0.00 0.00 63.50 60.25 2yxt n PRO 114 Cb 0.40 -3.38 -0.02 0.00 -0.04 0.00 0.00 33.50 30.46 2yxt n PRO 114 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2yxt s VAL 115 N 5.54 4.14 0.00 0.52 1.01 -1.26 -4.78 120.40 125.57 2yxt s VAL 115 Ca 0.56 1.38 0.00 0.00 0.00 0.00 0.00 61.98 63.92 2yxt s VAL 115 Cb 0.08 -3.89 0.00 0.00 0.00 0.00 0.00 36.38 32.56 2yxt s VAL 115 CO 0.05 -0.13 0.00 0.18 0.00 0.00 0.00 175.10 175.21 2yxt n LEU 116 N 6.73 1.25 0.00 3.92 4.77 -1.26 -4.77 117.00 127.64 2yxt n LEU 116 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2yxt n LEU 116 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2yxt n LEU 116 CO 0.57 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 2yxt n GLY 117 N 2.34 -0.78 3.73 -0.72 0.00 -1.26 0.14 105.19 108.64 2yxt n GLY 117 Ca 0.00 -0.97 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 2yxt n GLY 117 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2yxt s ASP 118 N -4.00 -0.00 0.22 1.61 -1.08 -0.75 -4.63 116.67 108.03 2yxt s ASP 118 Ca 0.00 -0.95 0.03 0.00 -0.52 0.00 0.00 52.55 51.11 2yxt s ASP 118 Cb 0.00 0.72 0.03 0.00 -1.46 0.00 0.00 42.92 42.21 2yxt s ASP 118 CO 0.00 -1.39 0.22 1.17 0.52 0.00 0.00 175.17 175.70 2yxt n LYS 119 N -0.47 1.04 0.00 4.34 3.00 -1.26 -0.53 118.16 124.27 2yxt n LYS 119 Ca -0.04 -1.26 0.04 0.00 -0.00 0.00 0.00 58.31 57.05 2yxt n LYS 119 Cb 0.60 0.04 0.26 0.00 0.00 0.00 0.00 35.03 35.93 2yxt n LYS 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2yxt n GLY 122 N 2.39 -0.32 3.68 3.14 0.00 -1.26 -4.93 105.19 107.90 2yxt n GLY 122 Ca 0.02 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 2yxt n GLY 122 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yxt s GLU 123 N -2.07 2.07 0.47 1.61 1.03 -1.26 -5.15 118.70 115.40 2yxt s GLU 123 Ca 0.13 -2.12 -0.04 0.00 0.03 0.00 0.00 54.97 52.97 2yxt s GLU 123 Cb 0.06 -1.70 -0.03 0.00 -0.80 0.00 0.00 34.13 31.67 2yxt s GLU 123 CO 0.11 -0.15 0.75 0.20 -1.33 0.00 0.00 175.26 174.84 2yxt s GLY 124 N -3.81 1.49 -0.06 -3.83 0.00 -1.26 -4.98 107.32 94.88 2yxt s GLY 124 Ca 0.30 -0.64 -0.02 0.00 0.00 0.00 0.00 44.72 44.35 2yxt s GLY 124 CO 0.16 -0.48 0.11 -0.56 0.00 0.00 0.00 173.10 172.33 2yxt s SER 125 N -4.13 0.37 0.46 1.64 0.01 0.31 -4.96 113.70 107.40 2yxt s SER 125 Ca 0.47 0.23 -0.17 0.00 1.31 0.00 0.00 55.95 57.79 2yxt s SER 125 Cb -0.10 0.11 -0.08 0.00 0.21 0.00 0.00 66.02 66.16 2yxt s SER 125 CO 0.43 -0.19 0.93 -0.04 0.41 0.00 0.00 173.24 174.78 2yxt s MET 126 N 1.64 3.99 0.00 12.44 -1.94 -1.26 -1.80 119.30 132.37 2yxt s MET 126 Ca -0.03 0.90 0.07 0.00 -1.71 0.00 0.00 55.69 54.91 2yxt s MET 126 Cb -0.12 -2.21 -0.02 0.00 2.01 0.00 0.00 34.83 34.49 2yxt s MET 126 CO -0.05 -0.15 0.46 0.66 -0.01 0.00 0.00 175.02 175.94 2yxt n TYR 127 N -1.23 0.00 -4.15 -0.03 4.01 0.37 -4.89 117.16 111.24 2yxt n TYR 127 Ca 0.06 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.69 2yxt n TYR 127 Cb 0.54 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.47 2yxt n TYR 127 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2yxt s VAL 128 N -1.21 0.67 0.57 -0.72 0.11 -1.21 -4.98 120.40 113.62 2yxt s VAL 128 Ca 0.05 -1.75 -0.20 0.00 -2.93 0.00 0.00 61.98 57.15 2yxt s VAL 128 Cb 0.05 -1.45 -0.04 0.00 -1.53 0.00 0.00 36.38 33.42 2yxt s VAL 128 CO 0.20 -0.76 1.28 -2.84 -3.33 0.00 0.00 175.10 169.64 2yxt s PRO 129 N -3.33 3.06 0.60 1.54 0.02 -1.26 -4.88 135.00 130.75 2yxt s PRO 129 Ca 0.07 2.03 0.30 0.00 0.02 0.00 0.00 61.00 63.42 2yxt s PRO 129 Cb 0.02 -2.11 1.68 0.00 0.02 0.00 0.00 34.50 34.11 2yxt s PRO 129 CO -0.04 -1.19 2.07 1.49 -0.33 0.00 0.00 177.00 179.01 2yxt h GLU 130 N 1.20 0.00 0.00 5.54 4.81 -2.00 -2.50 114.58 121.63 2yxt h GLU 130 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 2yxt h GLU 130 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2yxt h GLU 130 CO 0.56 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.44 2yxt n ASP 131 N -3.66 0.00 0.05 1.04 5.68 -1.26 -2.85 116.55 115.54 2yxt n ASP 131 Ca 0.02 -0.19 -0.07 0.00 -0.50 0.00 0.00 54.79 54.05 2yxt n ASP 131 Cb 0.36 -0.21 -0.11 0.00 -1.14 0.00 0.00 41.12 40.02 2yxt n ASP 131 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 2yxt h LEU 132 N 0.00 0.00 -0.23 -2.12 4.07 -1.82 -3.36 115.31 111.86 2yxt h LEU 132 Ca 0.00 0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.02 2yxt h LEU 132 Cb 0.14 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 41.81 2yxt h LEU 132 CO 0.00 0.96 -0.30 0.25 -1.08 0.00 0.00 178.44 178.27 2yxt h LEU 133 N 0.00 -0.94 -1.36 1.67 5.85 -1.72 0.23 115.31 119.03 2yxt h LEU 133 Ca -0.07 0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.86 2yxt h LEU 133 Cb 1.79 0.42 -0.05 0.00 0.37 0.00 0.00 40.66 43.20 2yxt h LEU 133 CO 0.11 -0.32 0.48 -0.65 -0.34 0.00 0.00 178.44 177.72 2yxt h PRO 134 N -0.32 0.75 -0.29 5.25 0.11 -1.78 0.13 132.00 135.86 2yxt h PRO 134 Ca 0.13 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.09 2yxt h PRO 134 Cb 0.52 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 2yxt h PRO 134 CO -0.40 0.50 -0.23 0.28 -0.21 0.00 0.00 178.00 177.93 2yxt h VAL 135 N 0.77 1.30 -0.05 3.15 2.07 -1.36 0.60 116.25 122.74 2yxt h VAL 135 Ca 0.32 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 66.46 2yxt h VAL 135 Cb 0.25 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 2yxt h VAL 135 CO -0.11 0.44 0.03 1.88 0.02 0.00 0.00 177.57 179.83 2yxt h TYR 136 N 0.41 0.06 -0.01 1.57 0.05 0.10 0.81 116.97 119.96 2yxt h TYR 136 Ca 0.05 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.83 2yxt h TYR 136 Cb 0.78 -0.02 -0.00 0.00 1.01 0.00 0.00 36.73 38.50 2yxt h TYR 136 CO 0.07 0.06 0.00 0.87 -1.05 0.00 0.00 178.16 178.11 2yxt h LYS 137 N 0.04 0.02 0.13 4.88 1.57 -0.61 0.31 116.57 122.91 2yxt h LYS 137 Ca 0.02 -0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.50 2yxt h LYS 137 Cb 0.02 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2yxt h LYS 137 CO -0.00 0.23 -1.39 0.93 -0.57 0.00 0.00 179.45 178.64 2yxt h GLU 138 N -0.19 0.28 0.00 3.15 5.08 0.25 -3.40 114.58 119.74 2yxt h GLU 138 Ca 0.00 -0.47 -0.09 0.00 -1.00 0.00 0.00 59.36 57.81 2yxt h GLU 138 Cb 0.21 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2yxt h GLU 138 CO -0.00 1.18 -1.32 1.63 -1.00 0.00 0.00 179.01 179.50 2yxt n LYS 139 N -3.50 1.77 -0.04 2.33 5.02 0.26 -4.69 118.16 119.31 2yxt n LYS 139 Ca -0.13 0.01 -0.00 0.00 -2.02 0.00 0.00 58.31 56.18 2yxt n LYS 139 Cb 1.04 -1.12 -0.00 0.00 -0.02 0.00 0.00 35.03 34.93 2yxt n LYS 139 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2yxt h VAL 140 N 0.00 0.00 -0.87 -0.18 2.07 -0.54 -3.33 116.25 113.41 2yxt h VAL 140 Ca -0.13 -0.84 0.16 0.00 0.82 0.00 0.00 66.70 66.71 2yxt h VAL 140 Cb 1.24 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.92 2yxt h VAL 140 CO -0.01 0.00 0.45 0.58 0.02 0.00 0.00 177.57 178.61 2yxt h VAL 141 N -0.84 0.71 -0.02 2.57 2.07 -0.64 0.12 116.25 120.21 2yxt h VAL 141 Ca -0.00 -0.21 0.01 0.00 0.82 0.00 0.00 66.70 67.31 2yxt h VAL 141 Cb 0.01 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 29.81 2yxt h VAL 141 CO 0.00 0.11 0.02 -0.65 0.02 0.00 0.00 177.57 177.07 2yxt h PRO 142 N 0.62 0.00 0.00 1.57 0.11 -1.74 -2.22 132.00 130.33 2yxt h PRO 142 Ca 0.48 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.50 2yxt h PRO 142 Cb 0.71 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 2yxt h PRO 142 CO -0.38 0.00 -0.96 -0.07 -0.21 0.00 0.00 178.00 176.38 2yxt h LEU 143 N 0.00 0.00-10.04 2.35 3.38 -1.09 -3.45 115.31 106.47 2yxt h LEU 143 Ca 0.01 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.49 2yxt h LEU 143 Cb 0.05 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.84 2yxt h LEU 143 CO -0.00 0.34 0.42 0.00 0.09 0.00 0.00 178.44 179.29 2yxt s ALA 144 N -3.09 2.89 -0.12 1.53 0.00 -0.83 -4.69 121.76 117.45 2yxt s ALA 144 Ca 0.00 0.75 0.08 0.00 0.00 0.00 0.00 51.96 52.80 2yxt s ALA 144 Cb 0.08 -3.31 -0.13 0.00 0.00 0.00 0.00 23.12 19.76 2yxt s ALA 144 CO 0.78 -0.49 0.01 -0.25 0.00 0.00 0.00 175.76 175.81 2yxt n ASP 145 N -0.78 2.33 -3.95 0.00 9.92 0.01 -3.04 116.55 121.04 2yxt n ASP 145 Ca 0.09 -0.02 -0.24 0.00 -0.53 0.00 0.00 54.79 54.09 2yxt n ASP 145 Cb 0.51 0.58 -0.17 0.00 -0.64 0.00 0.00 41.12 41.40 2yxt n ASP 145 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2yxt s ILE 146 N -2.28 0.94 0.08 0.53 1.01 -0.70 -1.78 121.20 119.00 2yxt s ILE 146 Ca -0.08 -0.33 0.06 0.00 0.00 0.00 0.00 60.65 60.30 2yxt s ILE 146 Cb 0.04 -0.91 -0.03 0.00 0.01 0.00 0.00 42.46 41.56 2yxt s ILE 146 CO 0.44 0.33 -0.17 0.27 0.00 0.00 0.00 174.94 175.81 2yxt s ILE 147 N 1.05 1.33 -0.46 2.92 -4.36 -0.79 0.02 121.20 120.90 2yxt s ILE 147 Ca -0.08 -1.39 0.09 0.00 -0.26 0.00 0.00 60.65 59.01 2yxt s ILE 147 Cb -0.14 -1.25 0.33 0.00 1.25 0.00 0.00 42.46 42.65 2yxt s ILE 147 CO -0.01 -0.17 0.79 0.35 0.24 0.00 0.00 174.94 176.15 2yxt n THR 148 N 1.20 1.07 -1.82 8.37 -2.24 -1.06 -2.33 114.28 117.47 2yxt n THR 148 Ca -0.21 -4.93 -0.31 0.00 -2.27 0.00 0.00 64.05 56.34 2yxt n THR 148 Cb 0.54 -0.91 0.02 0.00 -2.10 0.00 0.00 70.33 67.88 2yxt n THR 148 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2yxt s PRO 149 N -2.69 3.49 0.75 -0.78 0.04 -1.19 -4.64 135.00 129.97 2yxt s PRO 149 Ca 0.43 0.78 -0.03 0.00 0.04 0.00 0.00 61.00 62.21 2yxt s PRO 149 Cb 0.30 -2.07 0.13 0.00 0.04 0.00 0.00 34.50 32.90 2yxt s PRO 149 CO -0.10 -0.66 1.03 0.54 0.04 0.00 0.00 177.00 177.86 2yxt s ASN 150 N -4.12 4.23 0.15 6.66 6.03 -1.26 -1.54 114.94 125.08 2yxt s ASN 150 Ca 0.56 -0.22 -0.24 0.00 -1.03 0.00 0.00 52.86 51.92 2yxt s ASN 150 Cb -0.11 -0.14 0.01 0.00 -3.03 0.00 0.00 41.25 37.98 2yxt s ASN 150 CO 0.54 -1.94 1.61 -0.61 -2.03 0.00 0.00 177.10 174.67 2yxt h GLN 151 N -0.66 -0.31 -0.63 3.55 4.15 -1.23 0.53 115.11 120.51 2yxt h GLN 151 Ca -0.38 0.02 0.12 0.00 0.77 0.00 0.00 58.65 59.18 2yxt h GLN 151 Cb 1.27 0.07 -0.09 0.00 0.21 0.00 0.00 27.48 28.94 2yxt h GLN 151 CO 0.41 -0.20 0.17 0.35 -1.93 0.00 0.00 178.83 177.63 2yxt h PHE 152 N -0.32 0.29 -0.07 3.99 3.57 -1.90 -0.07 116.94 122.42 2yxt h PHE 152 Ca 0.12 0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.51 2yxt h PHE 152 Cb 0.51 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 2yxt h PHE 152 CO -0.43 0.00 -0.63 0.93 -2.23 0.00 0.00 178.31 175.96 2yxt h GLU 153 N 0.31 0.27 -0.83 1.11 5.08 -1.73 -1.14 114.58 117.65 2yxt h GLU 153 Ca 0.33 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 2yxt h GLU 153 Cb 0.49 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.73 2yxt h GLU 153 CO -0.39 0.81 0.42 0.00 -1.00 0.00 0.00 179.01 178.85 2yxt h ALA 154 N 1.14 1.18 0.20 3.43 0.00 -0.00 -0.76 119.26 124.44 2yxt h ALA 154 Ca -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2yxt h ALA 154 Cb 1.15 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2yxt h ALA 154 CO 0.10 0.64 -0.10 0.93 0.00 0.00 0.00 179.25 180.83 2yxt h GLU 155 N 1.18 -0.26 -0.59 0.00 5.08 -0.79 -2.41 114.58 116.78 2yxt h GLU 155 Ca 0.29 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.76 2yxt h GLU 155 Cb 0.08 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.31 2yxt h GLU 155 CO -0.04 0.05 0.19 -0.07 -1.00 0.00 0.00 179.01 178.13 2yxt h LEU 156 N -0.57 0.14 -1.11 1.33 3.38 -1.05 0.34 115.31 117.78 2yxt h LEU 156 Ca -0.03 0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2yxt h LEU 156 Cb 0.42 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2yxt h LEU 156 CO 0.04 0.09 -0.33 -0.07 0.09 0.00 0.00 178.44 178.26 2yxt h LEU 157 N 0.35 0.00 0.00 1.67 3.38 -1.15 -3.21 115.31 116.35 2yxt h LEU 157 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2yxt h LEU 157 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2yxt h LEU 157 CO -0.33 0.33 -1.55 -1.54 0.09 0.00 0.00 178.44 175.44 2yxt n SER 158 N -3.60 0.58 0.00 -0.43 3.41 -0.91 -4.94 113.62 107.74 2yxt n SER 158 Ca -0.01 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.25 2yxt n SER 158 Cb 0.46 1.58 0.00 0.00 -0.26 0.00 0.00 64.21 65.99 2yxt n SER 158 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yxt n GLY 159 N 1.39 1.67 3.74 5.00 0.00 0.11 -5.04 105.19 112.07 2yxt n GLY 159 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2yxt n GLY 159 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yxt s ARG 160 N -0.13 2.96 0.28 1.61 0.52 -1.18 -5.00 118.95 118.01 2yxt s ARG 160 Ca 0.00 -0.52 -0.20 0.00 -0.52 0.00 0.00 55.73 54.49 2yxt s ARG 160 Cb 0.00 -2.79 -0.09 0.00 0.52 0.00 0.00 34.95 32.59 2yxt s ARG 160 CO 0.00 0.64 0.78 0.15 0.02 0.00 0.00 175.30 176.90 2yxt s LYS 161 N -1.61 4.25 -0.25 3.54 1.02 -1.26 -4.38 119.74 121.06 2yxt s LYS 161 Ca 0.21 0.92 -0.04 0.00 0.02 0.00 0.00 55.97 57.08 2yxt s LYS 161 Cb -0.12 -2.71 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 2yxt s LYS 161 CO 0.12 0.29 -0.02 0.42 -0.92 0.00 0.00 175.35 175.24 2yxt s ILE 162 N -1.69 3.40 -0.38 2.17 1.01 -1.26 -4.94 121.20 119.51 2yxt s ILE 162 Ca 0.48 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.53 2yxt s ILE 162 Cb -0.15 -2.65 -0.09 0.00 0.01 0.00 0.00 42.46 39.59 2yxt s ILE 162 CO 0.20 0.28 0.34 1.41 0.00 0.00 0.00 174.94 177.17 2yxt n HIS 163 N 4.78 0.00 -3.92 3.97 8.25 -1.26 -5.03 115.22 122.01 2yxt n HIS 163 Ca -0.17 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.20 2yxt n HIS 163 Cb 0.49 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.58 2yxt n HIS 163 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2yxt s SER 164 N -1.76 0.04 0.34 0.41 1.04 -1.26 -5.00 113.70 107.50 2yxt s SER 164 Ca 0.03 -0.98 0.03 0.00 0.48 0.00 0.00 55.95 55.51 2yxt s SER 164 Cb 0.06 0.71 0.60 0.00 0.10 0.00 0.00 66.02 67.49 2yxt s SER 164 CO 0.33 -1.37 1.90 -0.61 0.98 0.00 0.00 173.24 174.47 2yxt h GLN 165 N 2.09 0.61 -0.03 4.02 4.15 -1.99 -1.38 115.11 122.58 2yxt h GLN 165 Ca -0.26 -0.11 -0.22 0.00 0.77 0.00 0.00 58.65 58.83 2yxt h GLN 165 Cb 1.25 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.84 2yxt h GLN 165 CO 0.34 0.57 -0.89 0.93 -1.93 0.00 0.00 178.83 177.85 2yxt h GLU 166 N 0.60 0.47 0.00 1.69 3.07 -1.99 -1.60 114.58 116.82 2yxt h GLU 166 Ca 0.14 -0.46 -0.08 0.00 -0.50 0.00 0.00 59.36 58.46 2yxt h GLU 166 Cb 0.24 0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.26 2yxt h GLU 166 CO -0.00 1.11 -0.38 0.93 -1.40 0.00 0.00 179.01 179.27 2yxt h GLU 167 N 0.28 0.00 -0.27 2.33 5.08 -1.89 -1.77 114.58 118.34 2yxt h GLU 167 Ca -0.07 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 2yxt h GLU 167 Cb 1.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.75 2yxt h GLU 167 CO 0.16 0.38 -0.11 0.00 -1.00 0.00 0.00 179.01 178.43 2yxt h ALA 168 N 1.62 0.38 0.00 3.43 0.00 -1.02 -0.54 119.26 123.14 2yxt h ALA 168 Ca -0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 2yxt h ALA 168 Cb 0.74 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2yxt h ALA 168 CO 0.05 0.24 -0.15 -0.07 0.00 0.00 0.00 179.25 179.32 2yxt h LEU 169 N 0.30 0.00 0.02 0.00 3.38 -1.06 -0.68 115.31 117.27 2yxt h LEU 169 Ca 0.06 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.76 2yxt h LEU 169 Cb 0.61 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.39 2yxt h LEU 169 CO 0.04 0.15 -1.10 0.03 0.09 0.00 0.00 178.44 177.66 2yxt h ARG 170 N 0.00 0.66 -0.39 1.13 3.08 -0.85 -2.45 114.38 115.55 2yxt h ARG 170 Ca -0.00 -0.75 -0.06 0.00 0.07 0.00 0.00 59.98 59.24 2yxt h ARG 170 Cb 0.48 0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.74 2yxt h ARG 170 CO 0.02 1.33 0.01 0.28 -1.07 0.00 0.00 179.97 180.53 2yxt h VAL 171 N 0.35 1.22 -0.29 2.04 2.07 -0.64 -1.81 116.25 119.18 2yxt h VAL 171 Ca -0.14 -0.86 -0.09 0.00 0.82 0.00 0.00 66.70 66.43 2yxt h VAL 171 Cb 1.75 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 2yxt h VAL 171 CO 0.21 0.30 -0.18 0.24 0.02 0.00 0.00 177.57 178.16 2yxt h MET 172 N 0.59 0.53 -0.63 1.57 2.86 -1.10 -1.24 114.93 117.51 2yxt h MET 172 Ca 0.12 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 2yxt h MET 172 Cb 0.37 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.96 2yxt h MET 172 CO 0.01 0.69 0.28 -0.44 1.06 0.00 0.00 176.91 178.51 2yxt h ASP 173 N 0.48 0.85 -0.69 1.22 3.32 -0.85 0.27 116.42 121.01 2yxt h ASP 173 Ca 0.08 -0.15 -0.06 0.00 0.02 0.00 0.00 57.03 56.92 2yxt h ASP 173 Cb 0.58 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 2yxt h ASP 173 CO 0.04 0.76 0.22 0.24 -1.72 0.00 0.00 179.24 178.78 2yxt h MET 174 N 0.87 1.09 -0.54 3.56 2.86 -1.06 -1.76 114.93 119.96 2yxt h MET 174 Ca 0.21 -0.23 -0.12 0.00 -2.06 0.00 0.00 59.70 57.51 2yxt h MET 174 Cb 0.16 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2yxt h MET 174 CO -0.02 0.93 -0.12 -0.07 1.06 0.00 0.00 176.91 178.68 2yxt h LEU 175 N 1.05 1.04 -1.00 1.22 3.38 -0.52 -1.41 115.31 119.06 2yxt h LEU 175 Ca 0.23 -0.35 0.02 0.00 0.09 0.00 0.00 57.88 57.86 2yxt h LEU 175 Cb 0.30 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 2yxt h LEU 175 CO -0.01 1.15 0.66 0.45 0.09 0.00 0.00 178.44 180.79 2yxt h HIS 176 N 0.91 1.26 -0.02 1.13 3.86 -0.07 -1.58 115.15 120.64 2yxt h HIS 176 Ca 0.14 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.30 2yxt h HIS 176 Cb 0.70 -0.42 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 2yxt h HIS 176 CO 0.05 0.78 -0.34 0.66 0.86 0.00 0.00 177.93 179.93 2yxt h SER 177 N 1.34 0.04 0.51 2.45 4.64 -0.87 -1.28 113.55 120.37 2yxt h SER 177 Ca 0.38 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2yxt h SER 177 Cb -0.12 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 2yxt h SER 177 CO -0.09 0.38 0.00 0.24 -0.87 0.00 0.00 176.83 176.49 2yxt h MET 178 N 0.03 0.00 0.00 4.77 2.07 -0.24 -3.47 114.93 118.10 2yxt h MET 178 Ca 0.00 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 2yxt h MET 178 Cb 0.62 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.35 2yxt h MET 178 CO 0.05 0.00 0.00 0.41 1.07 0.00 0.00 176.91 178.44 2yxt n GLY 179 N -0.49 2.33 3.74 8.32 0.00 -0.48 -3.91 105.19 114.69 2yxt n GLY 179 Ca -0.00 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 2yxt n GLY 179 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yxt s PRO 180 N 0.00 4.22 0.18 1.61 0.04 -1.17 -4.90 135.00 134.98 2yxt s PRO 180 Ca 0.00 2.38 0.24 0.00 0.04 0.00 0.00 61.00 63.66 2yxt s PRO 180 Cb 0.00 -3.10 0.91 0.00 0.04 0.00 0.00 34.50 32.35 2yxt s PRO 180 CO 0.00 -0.51 1.72 -0.25 0.04 0.00 0.00 177.00 178.00 2yxt n ASP 181 N 2.60 0.54 -3.84 6.66 8.00 -1.04 -4.21 116.55 125.27 2yxt n ASP 181 Ca 0.08 0.60 -0.20 0.00 0.71 0.00 0.00 54.79 55.98 2yxt n ASP 181 Cb 0.39 -0.73 -0.17 0.00 -0.02 0.00 0.00 41.12 40.60 2yxt n ASP 181 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2yxt s THR 182 N -3.17 0.37 -0.04 -3.53 2.01 -0.74 -0.58 115.64 109.98 2yxt s THR 182 Ca 0.08 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.11 2yxt s THR 182 Cb 0.11 -0.46 0.01 0.00 0.01 0.00 0.00 72.50 72.18 2yxt s THR 182 CO 0.45 0.21 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.83 2yxt s VAL 183 N 1.24 0.66 -0.14 3.82 1.01 -0.04 -1.89 120.40 125.06 2yxt s VAL 183 Ca -0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 2yxt s VAL 183 Cb -0.14 -0.64 0.04 0.00 0.00 0.00 0.00 36.38 35.65 2yxt s VAL 183 CO -0.02 0.24 0.00 -0.69 0.00 0.00 0.00 175.10 174.63 2yxt s VAL 184 N 0.59 0.60 -0.52 2.92 1.01 -0.98 0.23 120.40 124.24 2yxt s VAL 184 Ca -0.09 -0.30 -0.23 0.00 0.00 0.00 0.00 61.98 61.37 2yxt s VAL 184 Cb -0.12 -0.89 0.04 0.00 0.00 0.00 0.00 36.38 35.41 2yxt s VAL 184 CO 0.01 0.06 0.83 -0.63 0.00 0.00 0.00 175.10 175.37 2yxt s ILE 185 N 1.85 4.56 -0.07 2.22 1.01 0.20 -3.15 121.20 127.82 2yxt s ILE 185 Ca 0.02 0.14 0.31 0.00 0.00 0.00 0.00 60.65 61.12 2yxt s ILE 185 Cb -0.15 -4.43 0.35 0.00 0.01 0.00 0.00 42.46 38.24 2yxt s ILE 185 CO -0.07 -0.95 1.91 0.71 0.00 0.00 0.00 174.94 176.54 2yxt h THR 186 N 5.97 0.00 -1.66 2.92 1.35 -1.54 -2.61 112.91 117.34 2yxt h THR 186 Ca -0.26 -0.44 0.05 0.00 -0.55 0.00 0.00 66.41 65.21 2yxt h THR 186 Cb 1.08 1.37 -0.24 0.00 -1.73 0.00 0.00 68.15 68.63 2yxt h THR 186 CO 1.03 0.00 0.43 -0.94 -0.25 0.00 0.00 175.52 175.79 2yxt s SER 187 N -5.29 -0.47 0.19 5.36 1.04 -1.26 -4.87 113.70 108.40 2yxt s SER 187 Ca 0.02 0.75 -0.09 0.00 0.48 0.00 0.00 55.95 57.11 2yxt s SER 187 Cb 0.09 0.70 -0.01 0.00 0.10 0.00 0.00 66.02 66.90 2yxt s SER 187 CO 0.50 -0.27 0.31 -0.94 0.98 0.00 0.00 173.24 173.83 2yxt s SER 188 N -0.34 0.02 -0.07 7.02 1.04 -1.23 -0.61 113.70 119.52 2yxt s SER 188 Ca -0.00 -0.93 0.15 0.00 0.48 0.00 0.00 55.95 55.65 2yxt s SER 188 Cb -0.03 0.47 0.55 0.00 0.10 0.00 0.00 66.02 67.11 2yxt s SER 188 CO -0.01 -0.94 1.44 0.47 0.98 0.00 0.00 173.24 175.17 2yxt n ASP 189 N -0.26 3.66 -4.74 7.02 8.00 -1.26 -4.44 116.55 124.53 2yxt n ASP 189 Ca -0.05 -2.28 -0.41 0.00 0.71 0.00 0.00 54.79 52.76 2yxt n ASP 189 Cb 0.63 -0.48 -0.04 0.00 -0.02 0.00 0.00 41.12 41.21 2yxt n ASP 189 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2yxt s LEU 190 N -1.43 4.48 0.48 0.64 1.43 -1.26 -5.02 118.68 118.00 2yxt s LEU 190 Ca 0.40 2.10 -0.20 0.00 -1.03 0.00 0.00 54.13 55.40 2yxt s LEU 190 Cb 0.25 -3.60 -0.09 0.00 0.03 0.00 0.00 46.19 42.78 2yxt s LEU 190 CO 0.21 -0.25 1.04 -2.16 0.23 0.00 0.00 176.35 175.41 2yxt s PRO 191 N -0.29 3.81 0.04 1.29 0.04 -1.26 -3.69 135.00 134.93 2yxt s PRO 191 Ca 0.50 1.36 0.05 0.00 0.04 0.00 0.00 61.00 62.95 2yxt s PRO 191 Cb -0.30 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 2yxt s PRO 191 CO 0.35 -0.42 -0.10 0.45 0.04 0.00 0.00 177.00 177.32 2yxt s SER 192 N -1.98 4.41 0.03 6.66 0.15 -1.26 -4.87 113.70 116.83 2yxt s SER 192 Ca 0.67 -0.27 0.17 0.00 0.70 0.00 0.00 55.95 57.22 2yxt s SER 192 Cb -0.16 -0.92 0.70 0.00 -1.71 0.00 0.00 66.02 63.93 2yxt s SER 192 CO 0.20 0.24 1.52 -0.81 1.20 0.00 0.00 173.24 175.59 2yxt n PRO 193 N 1.27 0.02 0.07 5.44 -0.04 -1.26 -2.47 135.00 138.04 2yxt n PRO 193 Ca -0.15 0.25 0.12 0.00 -0.04 0.00 0.00 63.50 63.69 2yxt n PRO 193 Cb 0.52 -1.54 0.47 0.00 -0.04 0.00 0.00 33.50 32.91 2yxt n PRO 193 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2yxt n GLN 194 N -1.58 0.15 0.00 0.54 1.13 -1.26 -5.00 117.38 111.36 2yxt n GLN 194 Ca 0.04 0.20 0.00 0.00 -1.94 0.00 0.00 57.00 55.30 2yxt n GLN 194 Cb 0.19 -1.70 0.00 0.00 0.11 0.00 0.00 30.24 28.84 2yxt n GLN 194 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2yxt n GLY 195 N 0.97 3.89 0.25 1.08 0.00 -1.03 -4.86 105.19 105.49 2yxt n GLY 195 Ca 0.05 -1.64 0.17 0.00 0.00 0.00 0.00 46.02 44.60 2yxt n GLY 195 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2yxt h SER 196 N 0.00 0.00 -0.45 1.61 4.64 -1.95 -2.65 113.55 114.75 2yxt h SER 196 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2yxt h SER 196 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 2yxt h SER 196 CO 0.00 0.00 0.12 -0.46 -0.87 0.00 0.00 176.83 175.62 2yxt n ASN 197 N -2.77 3.95 -4.28 4.97 6.94 -1.26 -4.88 115.26 117.92 2yxt n ASN 197 Ca -0.01 -2.73 -0.20 0.00 -0.02 0.00 0.00 54.58 51.62 2yxt n ASN 197 Cb 0.17 -0.65 -0.11 0.00 -2.36 0.00 0.00 39.78 36.83 2yxt n ASN 197 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2yxt s TYR 198 N -2.16 1.60 0.19 -2.53 1.51 -1.00 -0.08 117.35 114.88 2yxt s TYR 198 Ca 0.36 -0.52 0.04 0.00 -1.01 0.00 0.00 57.07 55.95 2yxt s TYR 198 Cb 0.28 -0.82 -0.05 0.00 -0.11 0.00 0.00 41.96 41.27 2yxt s TYR 198 CO 0.10 0.23 -0.05 -0.48 -1.11 0.00 0.00 175.55 174.23 2yxt s LEU 199 N -2.54 2.34 -0.07 -1.29 0.05 0.13 -4.42 118.68 112.88 2yxt s LEU 199 Ca 0.12 -1.12 -0.04 0.00 0.05 0.00 0.00 54.13 53.13 2yxt s LEU 199 Cb -0.05 -0.30 -0.04 0.00 -2.05 0.00 0.00 46.19 43.75 2yxt s LEU 199 CO 0.05 -0.43 0.11 -0.63 -0.55 0.00 0.00 176.35 174.90 2yxt s ILE 200 N -3.38 5.14 -0.06 1.48 -1.09 -1.24 -0.97 121.20 121.08 2yxt s ILE 200 Ca 0.23 -0.05 0.06 0.00 -2.23 0.00 0.00 60.65 58.66 2yxt s ILE 200 Cb 0.04 -3.27 -0.01 0.00 -1.58 0.00 0.00 42.46 37.64 2yxt s ILE 200 CO 0.05 0.52 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.35 2yxt s VAL 201 N -1.08 1.94 -0.04 2.92 1.01 0.24 -3.54 120.40 121.85 2yxt s VAL 201 Ca 0.18 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 61.21 2yxt s VAL 201 Cb -0.12 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 2yxt s VAL 201 CO 0.08 0.54 -0.20 -0.76 0.00 0.00 0.00 175.10 174.77 2yxt s LEU 202 N -0.06 1.98 0.07 3.92 1.43 -0.98 -0.51 118.68 124.53 2yxt s LEU 202 Ca -0.06 -0.39 0.05 0.00 -1.03 0.00 0.00 54.13 52.70 2yxt s LEU 202 Cb -0.14 -1.07 -0.03 0.00 0.03 0.00 0.00 46.19 44.98 2yxt s LEU 202 CO 0.04 0.20 -0.13 -0.83 0.23 0.00 0.00 176.35 175.86 2yxt s GLY 203 N -0.14 0.85 -0.11 -3.19 0.00 -0.58 0.59 107.32 104.73 2yxt s GLY 203 Ca -0.01 -1.01 -0.07 0.00 0.00 0.00 0.00 44.72 43.63 2yxt s GLY 203 CO 0.02 -1.05 0.27 -0.45 0.00 0.00 0.00 173.10 171.89 2yxt s SER 204 N -1.83 -0.29 -0.03 1.64 0.15 0.13 -1.05 113.70 112.43 2yxt s SER 204 Ca -0.01 0.56 -0.01 0.00 0.70 0.00 0.00 55.95 57.19 2yxt s SER 204 Cb -0.09 0.50 0.03 0.00 -1.71 0.00 0.00 66.02 64.75 2yxt s SER 204 CO 0.02 -0.14 0.05 -1.58 1.20 0.00 0.00 173.24 172.80 2yxt s GLN 205 N 0.78 -0.01 -0.24 5.44 0.74 -0.47 -0.86 119.66 125.04 2yxt s GLN 205 Ca -0.05 0.21 -0.11 0.00 0.05 0.00 0.00 55.36 55.46 2yxt s GLN 205 Cb -0.06 -0.22 -0.05 0.00 1.10 0.00 0.00 33.01 33.78 2yxt s GLN 205 CO -0.05 -0.16 0.17 0.50 -0.55 0.00 0.00 175.29 175.20 2yxt s ARG 206 N 1.02 4.08 0.00 1.67 3.52 0.26 -1.07 118.95 128.43 2yxt s ARG 206 Ca -0.08 -0.24 0.00 0.00 -0.13 0.00 0.00 55.73 55.27 2yxt s ARG 206 Cb -0.12 -3.54 0.00 0.00 -1.56 0.00 0.00 34.95 29.74 2yxt s ARG 206 CO -0.03 0.06 0.00 2.89 -0.81 0.00 0.00 175.30 177.41 2yxt n ARG 207 N 4.27 0.00 0.00 5.12 1.85 -0.16 -4.85 116.66 122.89 2yxt n ARG 207 Ca -0.15 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.70 2yxt n ARG 207 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 2yxt n ARG 207 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2yxt n GLY 212 N 0.00 2.04 1.33 2.89 0.00 -1.26 -1.18 105.19 109.00 2yxt n GLY 212 Ca 0.00 -0.98 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 2yxt n GLY 212 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yxt n SER 213 N 0.00 1.46 -4.49 1.61 2.88 -1.26 -5.08 113.62 108.74 2yxt n SER 213 Ca 0.00 -1.64 -0.42 0.00 -1.33 0.00 0.00 58.87 55.48 2yxt n SER 213 Cb 0.00 -0.04 -0.04 0.00 -0.75 0.00 0.00 64.21 63.39 2yxt n SER 213 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2yxt s VAL 214 N -0.82 4.10 0.20 2.46 0.11 -1.26 -5.05 120.40 120.13 2yxt s VAL 214 Ca 0.13 -0.07 0.10 0.00 -2.93 0.00 0.00 61.98 59.21 2yxt s VAL 214 Cb -0.01 -4.77 -0.04 0.00 -1.53 0.00 0.00 36.38 30.02 2yxt s VAL 214 CO 0.08 -1.61 -0.16 0.68 -3.33 0.00 0.00 175.10 170.76 2yxt s VAL 215 N 4.70 2.81 -0.09 2.04 -7.23 -0.33 -4.93 120.40 117.37 2yxt s VAL 215 Ca 0.27 -1.88 0.00 0.00 -1.81 0.00 0.00 61.98 58.57 2yxt s VAL 215 Cb -0.14 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.39 2yxt s VAL 215 CO 0.12 -0.14 -0.07 -0.04 -0.31 0.00 0.00 175.10 174.66 2yxt s MET 216 N -2.85 2.93 -0.10 4.82 1.00 -1.26 -0.99 119.30 122.85 2yxt s MET 216 Ca 0.24 -0.56 0.03 0.00 0.00 0.00 0.00 55.69 55.40 2yxt s MET 216 Cb -0.08 -2.64 0.01 0.00 0.00 0.00 0.00 34.83 32.12 2yxt s MET 216 CO 0.13 0.56 -0.19 -2.00 0.00 0.00 0.00 175.02 173.53 2yxt s GLU 217 N -0.53 2.52 0.01 2.03 2.12 -0.23 -4.99 118.70 119.62 2yxt s GLU 217 Ca 0.08 -0.68 0.05 0.00 0.36 0.00 0.00 54.97 54.78 2yxt s GLU 217 Cb -0.12 -2.02 -0.02 0.00 0.26 0.00 0.00 34.13 32.24 2yxt s GLU 217 CO 0.02 0.04 -0.16 1.03 -0.54 0.00 0.00 175.26 175.65 2yxt s ARG 218 N 0.69 1.23 0.05 4.30 0.52 -1.26 -1.37 118.95 123.11 2yxt s ARG 218 Ca -0.12 -0.68 -0.00 0.00 -0.52 0.00 0.00 55.73 54.41 2yxt s ARG 218 Cb -0.16 -1.22 -0.04 0.00 0.52 0.00 0.00 34.95 34.05 2yxt s ARG 218 CO 0.03 0.32 -0.04 0.96 0.02 0.00 0.00 175.30 176.60 2yxt s ILE 219 N -0.55 0.29 -0.00 1.52 -5.25 -0.22 0.35 121.20 117.34 2yxt s ILE 219 Ca 0.05 -1.75 0.01 0.00 -0.99 0.00 0.00 60.65 57.97 2yxt s ILE 219 Cb -0.07 -1.44 -0.00 0.00 2.95 0.00 0.00 42.46 43.90 2yxt s ILE 219 CO 0.00 -0.93 -0.03 -0.60 -1.79 0.00 0.00 174.94 171.59 2yxt s ARG 220 N -3.69 0.22 0.03 0.37 6.06 0.26 -1.53 118.95 120.68 2yxt s ARG 220 Ca 0.06 -0.10 0.03 0.00 -2.50 0.00 0.00 55.73 53.22 2yxt s ARG 220 Cb 0.06 -0.22 -0.02 0.00 0.06 0.00 0.00 34.95 34.83 2yxt s ARG 220 CO -0.08 0.06 -0.10 -1.64 -2.50 0.00 0.00 175.30 171.03 2yxt s MET 221 N -0.06 0.69 -0.26 5.12 -1.94 0.33 -0.68 119.30 122.50 2yxt s MET 221 Ca 0.01 -0.65 -0.02 0.00 -1.71 0.00 0.00 55.69 53.33 2yxt s MET 221 Cb -0.01 -0.61 0.03 0.00 2.01 0.00 0.00 34.83 36.25 2yxt s MET 221 CO -0.00 0.14 -0.04 -0.51 -0.01 0.00 0.00 175.02 174.60 2yxt s ASP 222 N -1.09 4.47 0.03 3.03 1.11 -1.26 -0.59 116.67 122.36 2yxt s ASP 222 Ca -0.02 -0.94 0.06 0.00 0.18 0.00 0.00 52.55 51.83 2yxt s ASP 222 Cb -0.07 -1.68 -0.02 0.00 1.07 0.00 0.00 42.92 42.21 2yxt s ASP 222 CO 0.01 -0.16 -0.16 0.27 1.18 0.00 0.00 175.17 176.31 2yxt s ILE 223 N 1.32 1.30 0.33 0.77 -5.25 -0.14 -4.91 121.20 114.61 2yxt s ILE 223 Ca -0.01 -0.99 -0.29 0.00 -0.99 0.00 0.00 60.65 58.38 2yxt s ILE 223 Cb -0.17 -1.14 -0.12 0.00 2.95 0.00 0.00 42.46 43.98 2yxt s ILE 223 CO -0.03 0.14 1.41 -1.14 -1.79 0.00 0.00 174.94 173.53 2yxt n ARG 224 N 2.05 2.36 -2.58 0.37 3.00 -1.26 -0.70 116.66 119.91 2yxt n ARG 224 Ca -0.17 0.83 -0.31 0.00 -0.00 0.00 0.00 57.85 58.21 2yxt n ARG 224 Cb 0.54 -2.50 -0.02 0.00 0.00 0.00 0.00 32.46 30.48 2yxt n ARG 224 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2yxt s LYS 225 N -1.45 3.78 -0.26 -0.14 1.02 0.89 -4.84 119.74 118.74 2yxt s LYS 225 Ca 0.58 0.62 -0.29 0.00 0.02 0.00 0.00 55.97 56.91 2yxt s LYS 225 Cb -0.54 -2.28 0.01 0.00 -0.52 0.00 0.00 37.83 34.50 2yxt s LYS 225 CO 0.58 -0.19 1.04 0.14 -0.92 0.00 0.00 175.35 176.00 2yxt s VAL 226 N -2.58 4.63 -2.00 3.17 -7.23 -1.26 -4.93 120.40 110.19 2yxt s VAL 226 Ca 0.54 1.89 0.05 0.00 -1.81 0.00 0.00 61.98 62.65 2yxt s VAL 226 Cb -0.10 -4.34 0.16 0.00 0.56 0.00 0.00 36.38 32.66 2yxt s VAL 226 CO 0.36 -0.28 0.84 -0.67 -0.31 0.00 0.00 175.10 175.03 2yxt n ASP 227 N 6.50 0.00 -1.96 4.85 -0.08 -1.26 -4.79 116.55 119.82 2yxt n ASP 227 Ca 0.12 -0.95 -0.06 0.00 -1.51 0.00 0.00 54.79 52.39 2yxt n ASP 227 Cb 0.46 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.92 2yxt n ASP 227 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2yxt n ALA 228 N -0.65 -0.45 -4.03 -1.67 0.00 -1.26 -5.14 120.51 107.31 2yxt n ALA 228 Ca 0.04 -0.74 -0.32 0.00 0.00 0.00 0.00 53.44 52.42 2yxt n ALA 228 Cb 0.02 0.60 -0.15 0.00 0.00 0.00 0.00 19.45 19.92 2yxt n ALA 228 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2yxt s VAL 229 N -2.60 2.26 0.02 0.00 1.01 -1.26 -5.09 120.40 114.74 2yxt s VAL 229 Ca 0.12 -1.77 -0.06 0.00 0.00 0.00 0.00 61.98 60.27 2yxt s VAL 229 Cb -0.01 -2.40 -0.05 0.00 0.00 0.00 0.00 36.38 33.92 2yxt s VAL 229 CO 0.09 -0.16 0.27 -0.36 0.00 0.00 0.00 175.10 174.94 2yxt s PHE 230 N 1.07 3.57 -0.02 5.22 0.08 -1.26 -5.02 117.98 121.62 2yxt s PHE 230 Ca -0.05 0.56 0.01 0.00 0.12 0.00 0.00 56.93 57.58 2yxt s PHE 230 Cb -0.20 -1.99 -0.04 0.00 -0.57 0.00 0.00 43.02 40.23 2yxt s PHE 230 CO -0.05 0.60 -0.00 0.08 -0.10 0.00 0.00 175.22 175.75 2yxt s VAL 231 N -1.33 4.17 0.00 -0.44 1.01 -1.26 -4.54 120.40 118.01 2yxt s VAL 231 Ca 0.29 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2yxt s VAL 231 Cb -0.13 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.41 2yxt s VAL 231 CO 0.17 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.31 2yxt n GLY 232 N 1.56 0.76 0.29 4.51 0.00 -1.26 -4.65 105.19 106.39 2yxt n GLY 232 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 2yxt n GLY 232 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2yxt h THR 233 N 0.00 1.26 -0.10 2.61 1.35 -1.88 -0.81 112.91 115.35 2yxt h THR 233 Ca 0.00 -1.22 -0.16 0.00 -0.55 0.00 0.00 66.41 64.48 2yxt h THR 233 Cb 0.00 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 67.40 2yxt h THR 233 CO 0.00 0.43 -0.61 1.23 -0.25 0.00 0.00 175.52 176.31 2yxt h GLY 234 N 0.96 0.39 0.99 5.82 0.00 -1.93 0.21 103.07 109.50 2yxt h GLY 234 Ca 0.13 -0.48 -0.11 0.00 0.00 0.00 0.00 47.33 46.87 2yxt h GLY 234 CO 0.04 0.43 -0.22 -0.55 0.00 0.00 0.00 176.54 176.24 2yxt h ASP 235 N 0.26 0.78 -0.49 0.19 3.32 -1.88 -1.39 116.42 117.21 2yxt h ASP 235 Ca -0.01 -0.43 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 2yxt h ASP 235 Cb 1.14 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 2yxt h ASP 235 CO 0.10 1.05 0.26 0.25 -1.72 0.00 0.00 179.24 179.18 2yxt h LEU 236 N 0.52 0.62 -0.09 1.55 5.85 -1.01 -2.36 115.31 120.39 2yxt h LEU 236 Ca 0.07 -0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.71 2yxt h LEU 236 Cb 0.78 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 2yxt h LEU 236 CO 0.06 0.54 -0.03 0.15 -0.34 0.00 0.00 178.44 178.82 2yxt h PHE 237 N 0.65 -0.07 -0.54 1.25 3.57 -0.48 0.18 116.94 121.49 2yxt h PHE 237 Ca 0.17 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2yxt h PHE 237 Cb 0.06 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 2yxt h PHE 237 CO -0.02 -0.06 0.35 0.00 -2.23 0.00 0.00 178.31 176.36 2yxt h ALA 238 N 1.06 0.68 -0.75 2.41 0.00 -1.13 0.10 119.26 121.64 2yxt h ALA 238 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2yxt h ALA 238 Cb 0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 2yxt h ALA 238 CO -0.10 0.14 0.49 0.00 0.00 0.00 0.00 179.25 179.77 2yxt h ALA 239 N 1.19 0.96 -0.29 0.00 0.00 -1.17 -0.94 119.26 119.01 2yxt h ALA 239 Ca 0.20 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.86 2yxt h ALA 239 Cb -0.07 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.42 2yxt h ALA 239 CO -0.04 0.39 -0.56 0.52 0.00 0.00 0.00 179.25 179.56 2yxt h MET 240 N 1.02 0.88 -0.88 0.00 2.07 -0.78 -2.31 114.93 114.94 2yxt h MET 240 Ca 0.27 -0.57 -0.01 0.00 -2.07 0.00 0.00 59.70 57.33 2yxt h MET 240 Cb -0.10 0.07 -0.04 0.00 -1.87 0.00 0.00 31.60 29.66 2yxt h MET 240 CO -0.06 1.20 0.52 1.25 1.07 0.00 0.00 176.91 180.89 2yxt h LEU 241 N 0.67 1.06 -0.11 1.22 5.85 -0.62 0.75 115.31 124.14 2yxt h LEU 241 Ca 0.01 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.69 2yxt h LEU 241 Cb 1.17 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 2yxt h LEU 241 CO 0.12 0.82 -0.02 0.25 -0.34 0.00 0.00 178.44 179.27 2yxt h LEU 242 N 1.21 -0.09 -0.29 2.25 6.46 -1.08 0.29 115.31 124.06 2yxt h LEU 242 Ca 0.31 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 58.09 2yxt h LEU 242 Cb -0.04 0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 39.94 2yxt h LEU 242 CO -0.06 -0.03 0.13 0.00 -0.62 0.00 0.00 178.44 177.86 2yxt h ALA 243 N 1.10 0.38 0.01 1.25 0.00 -0.84 -1.23 119.26 119.92 2yxt h ALA 243 Ca 0.05 -0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 2yxt h ALA 243 Cb 0.07 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2yxt h ALA 243 CO -0.11 -0.05 -0.89 -1.49 0.00 0.00 0.00 179.25 176.72 2yxt h TRP 244 N 0.33 0.22 0.00 0.00 4.06 -0.82 -2.06 115.95 117.68 2yxt h TRP 244 Ca 0.10 -0.13 -0.09 0.00 2.06 0.00 0.00 58.89 60.83 2yxt h TRP 244 Cb 0.14 -0.02 -0.01 0.00 -1.00 0.00 0.00 29.16 28.27 2yxt h TRP 244 CO -0.01 0.96 -0.43 1.79 -3.56 0.00 0.00 178.44 177.18 2yxt h THR 245 N 0.08 1.30 -0.36 1.49 1.35 -0.92 0.48 112.91 116.32 2yxt h THR 245 Ca -0.04 -1.49 -0.09 0.00 -0.55 0.00 0.00 66.41 64.25 2yxt h THR 245 Cb 1.53 1.81 -0.01 0.00 -1.73 0.00 0.00 68.15 69.75 2yxt h THR 245 CO 0.13 0.42 -0.11 -0.74 -0.25 0.00 0.00 175.52 174.97 2yxt h HIS 246 N 0.00 0.80 0.00 4.73 -0.00 -0.98 -2.52 115.15 117.18 2yxt h HIS 246 Ca -0.00 -0.18 -0.17 0.00 -0.00 0.00 0.00 60.37 60.02 2yxt h HIS 246 Cb 0.77 -0.19 -0.02 0.00 -0.00 0.00 0.00 27.41 27.96 2yxt h HIS 246 CO 0.00 0.87 -0.81 0.87 -0.00 0.00 0.00 177.93 178.87 2yxt h LYS 247 N 0.50 0.00 -2.47 5.26 1.79 -1.21 -3.35 116.57 117.09 2yxt h LYS 247 Ca 0.09 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.96 2yxt h LYS 247 Cb 0.63 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.87 2yxt h LYS 247 CO 0.04 0.81 -0.76 0.72 -1.08 0.00 0.00 179.45 179.18 2yxt n HIS 248 N -3.54 1.91 -0.27 -1.35 8.25 0.15 -5.01 115.22 115.36 2yxt n HIS 248 Ca -0.00 -3.93 0.07 0.00 -0.26 0.00 0.00 57.72 53.59 2yxt n HIS 248 Cb 0.79 -0.38 0.21 0.00 1.12 0.00 0.00 29.99 31.72 2yxt n HIS 248 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2yxt h PRO 249 N 4.79 0.44 -1.94 -0.41 0.13 -1.60 -3.13 132.00 130.28 2yxt h PRO 249 Ca 0.17 -0.03 -0.61 0.00 -0.87 0.00 0.00 66.00 64.67 2yxt h PRO 249 Cb 0.78 -0.10 -0.40 0.00 0.13 0.00 0.00 31.00 31.40 2yxt h PRO 249 CO 0.64 0.29 -0.50 0.09 -0.23 0.00 0.00 178.00 178.29 2yxt n ASN 250 N -5.00 4.91 -2.90 1.44 3.02 -1.26 -4.78 115.26 110.69 2yxt n ASN 250 Ca 0.16 -3.71 -0.11 0.00 -0.03 0.00 0.00 54.58 50.89 2yxt n ASN 250 Cb 0.46 -0.58 -0.01 0.00 -0.61 0.00 0.00 39.78 39.05 2yxt n ASN 250 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2yxt n ASN 251 N -0.35 -2.53 0.29 6.41 2.85 -1.18 -4.97 115.26 115.77 2yxt n ASN 251 Ca 0.37 -2.91 0.15 0.00 -0.11 0.00 0.00 54.58 52.08 2yxt n ASN 251 Cb 0.49 1.19 0.86 0.00 1.24 0.00 0.00 39.78 43.57 2yxt n ASN 251 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 2yxt h LEU 252 N 4.77 0.00 0.74 1.20 5.85 -1.86 -2.28 115.31 123.73 2yxt h LEU 252 Ca 0.04 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2yxt h LEU 252 Cb 1.04 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.07 2yxt h LEU 252 CO 0.19 0.05 -0.36 0.50 -0.34 0.00 0.00 178.44 178.48 2yxt h LYS 253 N 0.00 -0.96 -0.84 1.25 3.64 -1.95 -1.02 116.57 116.69 2yxt h LYS 253 Ca -0.00 0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2yxt h LYS 253 Cb 0.14 0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.14 2yxt h LYS 253 CO 0.01 -0.62 0.43 0.28 -2.27 0.00 0.00 179.45 177.27 2yxt h VAL 254 N -1.21 1.25 -0.81 2.00 2.07 -1.94 -1.81 116.25 115.81 2yxt h VAL 254 Ca -0.10 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 2yxt h VAL 254 Cb 0.78 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 2yxt h VAL 254 CO 0.17 0.29 0.47 0.00 0.02 0.00 0.00 177.57 178.52 2yxt h ALA 255 N 1.23 1.03 -0.02 1.67 0.00 -1.39 -0.87 119.26 120.91 2yxt h ALA 255 Ca 0.29 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 2yxt h ALA 255 Cb 0.08 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2yxt h ALA 255 CO -0.04 0.51 -0.70 0.00 0.00 0.00 0.00 179.25 179.02 2yxt h GLU 257 N 0.07 0.61 -0.34 0.00 5.08 -0.88 0.80 114.58 119.92 2yxt h GLU 257 Ca -0.01 -0.16 -0.15 0.00 -1.00 0.00 0.00 59.36 58.04 2yxt h GLU 257 Cb 1.24 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 2yxt h GLU 257 CO 0.10 0.66 -0.37 0.87 -1.00 0.00 0.00 179.01 179.27 2yxt h LYS 258 N 0.46 0.80 0.59 2.33 1.57 -1.15 0.17 116.57 121.35 2yxt h LYS 258 Ca 0.12 -0.40 -0.03 0.00 -1.87 0.00 0.00 60.65 58.46 2yxt h LYS 258 Cb 0.34 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.66 2yxt h LYS 258 CO 0.00 1.04 -0.28 1.15 -0.57 0.00 0.00 179.45 180.79 2yxt h THR 259 N 0.66 0.33 -0.72 -0.16 2.02 -1.00 -0.02 112.91 114.02 2yxt h THR 259 Ca 0.06 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 67.00 2yxt h THR 259 Cb 0.93 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 2yxt h THR 259 CO 0.09 0.03 0.48 0.58 0.37 0.00 0.00 175.52 177.06 2yxt h VAL 260 N -0.98 1.19 -0.55 3.16 2.07 -0.86 -1.68 116.25 118.59 2yxt h VAL 260 Ca -0.08 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.11 2yxt h VAL 260 Cb 0.66 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 2yxt h VAL 260 CO 0.13 0.18 0.35 0.28 0.02 0.00 0.00 177.57 178.53 2yxt h SER 261 N 0.98 0.59 -0.50 0.57 0.02 -0.52 0.16 113.55 114.84 2yxt h SER 261 Ca 0.26 -0.01 0.07 0.00 -0.84 0.00 0.00 61.79 61.28 2yxt h SER 261 Cb -0.11 -0.13 -0.06 0.00 0.14 0.00 0.00 62.40 62.24 2yxt h SER 261 CO -0.06 0.42 0.18 0.74 -1.14 0.00 0.00 176.83 176.97 2yxt h THR 262 N 0.70 0.83 -0.89 -2.27 2.02 -0.54 -1.31 112.91 111.45 2yxt h THR 262 Ca 0.21 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.27 2yxt h THR 262 Cb -0.03 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 66.78 2yxt h THR 262 CO -0.07 0.07 0.57 0.25 0.37 0.00 0.00 175.52 176.70 2yxt h LEU 263 N 0.36 1.05 0.13 2.58 7.12 -0.38 -2.45 115.31 123.72 2yxt h LEU 263 Ca 0.24 -0.05 0.02 0.00 0.13 0.00 0.00 57.88 58.22 2yxt h LEU 263 Cb 0.25 -0.26 -0.04 0.00 -0.53 0.00 0.00 40.66 40.08 2yxt h LEU 263 CO -0.24 0.78 -0.31 -0.74 -0.13 0.00 0.00 178.44 177.80 2yxt h HIS 264 N 1.22 -0.84 -0.86 1.25 2.76 0.10 -0.34 115.15 118.44 2yxt h HIS 264 Ca 0.32 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.54 2yxt h HIS 264 Cb -0.10 0.35 -0.05 0.00 1.55 0.00 0.00 27.41 29.17 2yxt h HIS 264 CO -0.00 -0.42 0.57 0.45 -1.30 0.00 0.00 177.93 177.23 2yxt h HIS 265 N -0.53 1.04 -0.21 5.26 3.86 -1.20 0.16 115.15 123.54 2yxt h HIS 265 Ca 0.03 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.22 2yxt h HIS 265 Cb 0.56 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 2yxt h HIS 265 CO -0.27 0.62 -0.05 0.28 0.86 0.00 0.00 177.93 179.37 2yxt h VAL 266 N 1.09 1.29 -0.33 2.45 2.07 -1.17 -2.52 116.25 119.13 2yxt h VAL 266 Ca 0.33 -1.04 -0.13 0.00 0.82 0.00 0.00 66.70 66.68 2yxt h VAL 266 Cb -0.02 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2yxt h VAL 266 CO -0.09 0.32 -0.32 -0.07 0.02 0.00 0.00 177.57 177.42 2yxt h LEU 267 N 0.12 0.75 -0.24 2.57 3.38 -0.60 -0.65 115.31 120.65 2yxt h LEU 267 Ca 0.05 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.73 2yxt h LEU 267 Cb 0.50 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2yxt h LEU 267 CO 0.02 1.01 0.11 1.56 0.09 0.00 0.00 178.44 181.23 2yxt h GLN 268 N 0.61 0.22 -0.63 1.13 1.08 -0.68 0.36 115.11 117.20 2yxt h GLN 268 Ca 0.07 -0.01 -0.06 0.00 -1.45 0.00 0.00 58.65 57.19 2yxt h GLN 268 Cb 0.84 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.20 2yxt h GLN 268 CO 0.07 0.15 0.15 -0.09 -0.95 0.00 0.00 178.83 178.16 2yxt h ARG 269 N 0.23 1.02 -0.49 1.46 2.43 -1.35 0.35 114.38 118.02 2yxt h ARG 269 Ca 0.10 -0.25 -0.02 0.00 -0.81 0.00 0.00 59.98 59.00 2yxt h ARG 269 Cb 0.04 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2yxt h ARG 269 CO -0.08 0.92 0.22 1.15 -1.51 0.00 0.00 179.97 180.67 2yxt h THR 270 N 0.93 1.20 -0.37 0.20 2.02 -0.46 -1.39 112.91 115.05 2yxt h THR 270 Ca 0.20 -0.59 -0.06 0.00 0.77 0.00 0.00 66.41 66.73 2yxt h THR 270 Cb 0.37 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2yxt h THR 270 CO 0.00 0.23 0.01 0.40 0.37 0.00 0.00 175.52 176.53 2yxt h ILE 271 N 0.65 1.26 -0.42 3.11 2.04 0.04 -0.65 117.51 123.54 2yxt h ILE 271 Ca 0.17 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 2yxt h ILE 271 Cb 0.15 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 2yxt h ILE 271 CO -0.02 0.32 0.22 1.56 0.00 0.00 0.00 178.15 180.23 2yxt h GLN 272 N 0.47 0.58 -0.42 2.37 4.20 -0.74 -2.07 115.11 119.49 2yxt h GLN 272 Ca 0.11 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2yxt h GLN 272 Cb 0.44 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 2yxt h GLN 272 CO 0.02 0.48 0.20 0.00 -0.67 0.00 0.00 178.83 178.85 2yxt h ALA 274 N 1.04 1.19 -0.32 0.00 0.00 -1.01 -2.04 119.26 118.13 2yxt h ALA 274 Ca 0.14 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 2yxt h ALA 274 Cb 0.13 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2yxt h ALA 274 CO -0.02 0.59 -0.29 0.87 0.00 0.00 0.00 179.25 180.41 2yxt h LYS 275 N 1.27 0.75 0.00 0.00 1.57 -1.17 0.13 116.57 119.12 2yxt h LYS 275 Ca 0.34 -0.39 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2yxt h LYS 275 Cb -0.14 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.18 2yxt h LYS 275 CO -0.07 1.01 0.00 0.00 -0.57 0.00 0.00 179.45 179.82 2yxt h ALA 276 N 0.73 1.00 0.00 3.86 0.00 -0.84 -3.04 119.26 120.96 2yxt h ALA 276 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.66 2yxt h ALA 276 Cb 0.86 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.60 2yxt h ALA 276 CO 0.07 0.00 -2.15 1.04 0.00 0.00 0.00 179.25 178.21 2yxt n GLN 277 N -2.69 0.63 -0.95 0.00 6.02 -0.80 -4.97 117.38 114.63 2yxt n GLN 277 Ca -0.02 0.10 -0.14 0.00 -0.01 0.00 0.00 57.00 56.93 2yxt n GLN 277 Cb 0.07 -1.41 0.10 0.00 1.02 0.00 0.00 30.24 30.01 2yxt n GLN 277 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2yxt n ALA 278 N -3.02 -0.68 -1.77 -1.58 0.00 0.41 -5.07 120.51 108.79 2yxt n ALA 278 Ca -0.35 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.26 2yxt n ALA 278 Cb 0.90 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 20.32 2yxt n ALA 278 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yxt n GLY 279 N 0.87 0.10 3.74 0.00 0.00 -1.26 -4.83 105.19 103.81 2yxt n GLY 279 Ca 0.08 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 43.85 2yxt n GLY 279 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yxt s GLU 280 N -2.36 4.65 0.00 1.61 2.56 -1.26 -3.08 118.70 120.82 2yxt s GLU 280 Ca 0.00 1.32 0.00 0.00 0.00 0.00 0.00 54.97 56.29 2yxt s GLU 280 Cb 0.00 -3.35 0.00 0.00 2.00 0.00 0.00 34.13 32.78 2yxt s GLU 280 CO 0.00 0.30 0.00 0.41 -0.56 0.00 0.00 175.26 175.41 2yxt n GLY 281 N 2.14 0.07 3.66 -1.50 0.00 -1.26 -4.94 105.19 103.37 2yxt n GLY 281 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2yxt n GLY 281 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yxt s VAL 282 N -1.18 5.35 -0.19 1.61 1.01 -1.18 -5.06 120.40 120.76 2yxt s VAL 282 Ca 0.00 0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.91 2yxt s VAL 282 Cb 0.00 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.85 2yxt s VAL 282 CO 0.00 0.34 1.33 -0.60 0.00 0.00 0.00 175.10 176.17 2yxt s ARG 283 N 1.05 4.13 0.62 2.72 3.52 -1.26 -4.20 118.95 125.53 2yxt s ARG 283 Ca 0.08 1.62 -0.19 0.00 -0.13 0.00 0.00 55.73 57.12 2yxt s ARG 283 Cb -0.13 -3.83 -0.02 0.00 -1.56 0.00 0.00 34.95 29.40 2yxt s ARG 283 CO 0.04 -0.85 1.23 -2.30 -0.81 0.00 0.00 175.30 172.62 2yxt n PRO 284 N 6.88 1.14 -1.67 5.12 -0.02 -1.26 -4.94 135.00 140.25 2yxt n PRO 284 Ca 0.15 0.44 -0.30 0.00 -2.02 0.00 0.00 63.50 61.77 2yxt n PRO 284 Cb 0.45 -2.46 0.06 0.00 -0.02 0.00 0.00 33.50 31.53 2yxt n PRO 284 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2yxt s SER 285 N -1.29 5.13 0.54 2.55 1.04 -1.26 -4.86 113.70 115.55 2yxt s SER 285 Ca 0.80 1.36 0.25 0.00 0.48 0.00 0.00 55.95 58.83 2yxt s SER 285 Cb -0.39 -2.18 1.41 0.00 0.10 0.00 0.00 66.02 64.96 2yxt s SER 285 CO 0.43 -1.57 2.02 -0.65 0.98 0.00 0.00 173.24 174.45 2yxt h PRO 286 N -0.81 0.00 -0.37 4.02 0.11 -1.95 -1.40 132.00 131.60 2yxt h PRO 286 Ca -0.45 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 2yxt h PRO 286 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2yxt h PRO 286 CO 0.60 0.00 -0.29 1.98 -0.21 0.00 0.00 178.00 180.08 2yxt h MET 287 N 0.00 0.84 0.00 1.05 -1.53 -1.97 -2.86 114.93 110.47 2yxt h MET 287 Ca 0.20 -0.42 0.00 0.00 -3.44 0.00 0.00 59.70 56.04 2yxt h MET 287 Cb 0.83 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.88 2yxt h MET 287 CO -0.00 1.06 0.00 1.96 0.14 0.00 0.00 176.91 180.06 2yxt h GLN 288 N 0.64 0.00 -0.07 0.39 4.20 -1.69 -3.09 115.11 115.49 2yxt h GLN 288 Ca 0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2yxt h GLN 288 Cb 0.87 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.65 2yxt h GLN 288 CO 0.08 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.52 2yxt n LEU 289 N -3.03 1.52 -4.75 1.46 4.77 -0.62 -4.13 117.00 112.22 2yxt n LEU 289 Ca 0.02 -0.55 -0.41 0.00 -0.03 0.00 0.00 56.01 55.04 2yxt n LEU 289 Cb 0.42 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.45 2yxt n LEU 289 CO 0.30 0.28 1.15 -1.61 -1.33 0.00 0.00 177.39 176.18 2yxt s GLU 290 N -1.93 4.21 0.21 3.23 0.41 -1.13 -4.69 118.70 119.01 2yxt s GLU 290 Ca 0.36 2.41 -0.32 0.00 -0.41 0.00 0.00 54.97 57.01 2yxt s GLU 290 Cb 0.20 -3.07 -0.15 0.00 -1.78 0.00 0.00 34.13 29.33 2yxt s GLU 290 CO 0.31 -0.49 1.26 1.28 -0.49 0.00 0.00 175.26 177.13 2yxt n LEU 291 N 2.14 2.24 -3.94 1.80 4.77 -1.26 -4.83 117.00 117.92 2yxt n LEU 291 Ca 0.07 1.14 -0.43 0.00 -0.03 0.00 0.00 56.01 56.77 2yxt n LEU 291 Cb 0.39 -1.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 2yxt n LEU 291 CO 0.62 -0.95 2.09 0.54 -1.33 0.00 0.00 177.39 178.35 2yxt n ARG 292 N 1.80 3.37 0.27 3.23 5.12 -1.26 -4.77 116.66 124.42 2yxt n ARG 292 Ca 0.13 -3.31 -0.15 0.00 -1.93 0.00 0.00 57.85 52.59 2yxt n ARG 292 Cb 0.28 -3.06 -0.08 0.00 -1.16 0.00 0.00 32.46 28.44 2yxt n ARG 292 CO 0.00 0.00 0.00 1.98 -1.93 0.00 0.00 177.63 177.68 2yxt h MET 293 N 6.06 -0.66 -0.38 5.56 4.05 -1.92 -3.07 114.93 124.58 2yxt h MET 293 Ca 0.44 0.05 -0.08 0.00 -0.28 0.00 0.00 59.70 59.82 2yxt h MET 293 Cb 0.67 0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 31.60 2yxt h MET 293 CO 1.64 -0.36 -0.10 0.28 0.23 0.00 0.00 176.91 178.60 2yxt h VAL 294 N -0.90 1.24 0.00 -5.77 2.07 -2.01 -2.43 116.25 108.46 2yxt h VAL 294 Ca -0.07 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 66.37 2yxt h VAL 294 Cb 0.60 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2yxt h VAL 294 CO 0.12 0.36 0.00 0.00 0.02 0.00 0.00 177.57 178.07 2yxt n GLN 295 N -4.19 0.19 -0.56 1.57 3.00 -1.25 -3.02 117.38 113.12 2yxt n GLN 295 Ca 0.01 0.34 0.10 0.00 -0.01 0.00 0.00 57.00 57.44 2yxt n GLN 295 Cb 0.34 -1.81 0.34 0.00 0.00 0.00 0.00 30.24 29.11 2yxt n GLN 295 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2yxt n SER 296 N -2.15 4.56 -0.31 1.08 7.64 -0.92 -4.62 113.62 118.91 2yxt n SER 296 Ca 0.03 -2.38 0.17 0.00 1.01 0.00 0.00 58.87 57.71 2yxt n SER 296 Cb 0.28 -0.55 0.36 0.00 -1.01 0.00 0.00 64.21 63.28 2yxt n SER 296 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2yxt h LYS 297 N 3.99 0.24 0.00 1.43 3.64 -1.59 0.63 116.57 124.91 2yxt h LYS 297 Ca 0.00 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.23 2yxt h LYS 297 Cb 1.36 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 2yxt h LYS 297 CO 0.19 0.16 -0.65 0.00 -2.27 0.00 0.00 179.45 176.87 2yxt h ARG 298 N 0.24 0.00 -0.02 1.90 2.47 -1.89 -1.46 114.38 115.61 2yxt h ARG 298 Ca 0.62 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 59.24 2yxt h ARG 298 Cb 1.33 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.63 2yxt h ARG 298 CO -0.65 0.65 -0.49 -0.44 0.56 0.00 0.00 179.97 179.61 2yxt h ASP 299 N 0.00 0.06 -0.06 7.04 3.32 -1.21 -2.03 116.42 123.54 2yxt h ASP 299 Ca -0.01 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 2yxt h ASP 299 Cb 1.17 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 40.71 2yxt h ASP 299 CO 0.08 0.54 -0.37 0.40 -1.72 0.00 0.00 179.24 178.18 2yxt h ILE 300 N 0.05 1.43 -0.93 0.35 2.04 -0.74 -2.09 117.51 117.61 2yxt h ILE 300 Ca -0.00 -1.79 0.00 0.00 1.00 0.00 0.00 64.86 64.07 2yxt h ILE 300 Cb 0.88 2.37 -0.05 0.00 -0.74 0.00 0.00 36.82 39.29 2yxt h ILE 300 CO 0.07 0.52 0.60 -0.33 0.00 0.00 0.00 178.15 179.00 2yxt h GLU 301 N -0.14 1.24 -1.32 2.37 5.08 -1.14 -3.40 114.58 117.27 2yxt h GLU 301 Ca -0.03 -0.09 -0.25 0.00 -1.00 0.00 0.00 59.36 58.00 2yxt h GLU 301 Cb 1.03 -0.27 -0.21 0.00 0.50 0.00 0.00 28.75 29.80 2yxt h GLU 301 CO 0.08 0.84 -0.60 0.34 -1.00 0.00 0.00 179.01 178.66 2yxt s ASP 302 N -6.09 -0.76 0.21 1.42 2.15 -0.78 -5.06 116.67 107.77 2yxt s ASP 302 Ca -0.13 -1.99 -0.30 0.00 0.43 0.00 0.00 52.55 50.56 2yxt s ASP 302 Cb 0.17 1.36 -0.09 0.00 -0.30 0.00 0.00 42.92 44.06 2yxt s ASP 302 CO 0.81 -0.09 1.23 -2.16 -0.17 0.00 0.00 175.17 174.79 2yxt s PRO 303 N 0.75 4.47 0.02 4.34 0.04 -0.78 -4.69 135.00 139.14 2yxt s PRO 303 Ca 0.30 1.95 -0.30 0.00 0.04 0.00 0.00 61.00 62.98 2yxt s PRO 303 Cb 0.00 -3.21 -0.06 0.00 0.04 0.00 0.00 34.50 31.28 2yxt s PRO 303 CO -0.08 -0.10 1.38 -2.00 0.04 0.00 0.00 177.00 176.24 2yxt s GLU 304 N -0.51 4.30 0.03 4.56 2.12 -1.26 -4.95 118.70 122.99 2yxt s GLU 304 Ca 0.52 1.97 -0.30 0.00 0.36 0.00 0.00 54.97 57.52 2yxt s GLU 304 Cb -0.34 -3.51 -0.08 0.00 0.26 0.00 0.00 34.13 30.46 2yxt s GLU 304 CO 0.39 -0.53 1.79 0.42 -0.54 0.00 0.00 175.26 176.79 2yxt s ILE 305 N 2.12 3.14 -0.06 -3.70 -1.09 -1.26 -4.85 121.20 115.50 2yxt s ILE 305 Ca 0.64 0.34 0.09 0.00 -2.23 0.00 0.00 60.65 59.48 2yxt s ILE 305 Cb -0.32 -3.22 0.13 0.00 -1.58 0.00 0.00 42.46 37.47 2yxt s ILE 305 CO 0.27 -0.02 1.01 1.33 -1.23 0.00 0.00 174.94 176.30 2yxt n VAL 306 N 5.25 1.04 -3.90 2.92 0.24 -1.26 -5.01 118.33 117.61 2yxt n VAL 306 Ca 0.18 -1.21 -0.11 0.00 -2.04 0.00 0.00 64.34 61.16 2yxt n VAL 306 Cb 0.41 0.22 -0.10 0.00 -1.47 0.00 0.00 33.84 32.90 2yxt n VAL 306 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2yxt s VAL 307 N -1.48 0.09 -0.08 3.34 -7.23 -1.26 -5.05 120.40 108.72 2yxt s VAL 307 Ca 0.14 -0.78 0.04 0.00 -1.81 0.00 0.00 61.98 59.57 2yxt s VAL 307 Cb 0.13 -0.46 0.00 0.00 0.56 0.00 0.00 36.38 36.61 2yxt s VAL 307 CO 0.01 -0.43 -0.19 -1.10 -0.31 0.00 0.00 175.10 173.08 2yxt s GLN 308 N -1.56 2.43 -0.00 4.82 -1.52 -1.26 -4.92 119.66 117.64 2yxt s GLN 308 Ca -0.14 -0.69 -0.16 0.00 -1.95 0.00 0.00 55.36 52.42 2yxt s GLN 308 Cb -0.07 -1.91 -0.06 0.00 -0.22 0.00 0.00 33.01 30.76 2yxt s GLN 308 CO 0.00 0.14 0.44 0.00 -0.25 0.00 0.00 175.29 175.63 2yxt s ALA 309 N 0.40 3.65 -0.18 6.09 0.00 -1.26 -4.71 121.76 125.76 2yxt s ALA 309 Ca -0.15 -0.18 -0.08 0.00 0.00 0.00 0.00 51.96 51.55 2yxt s ALA 309 Cb -0.16 -2.46 -0.04 0.00 0.00 0.00 0.00 23.12 20.46 2yxt s ALA 309 CO 0.06 0.41 0.09 0.95 0.00 0.00 0.00 175.76 177.27 2yxt s THR 310 N -0.88 5.03 -0.12 0.00 -4.23 0.15 -4.91 115.64 110.68 2yxt s THR 310 Ca 0.25 0.05 -0.30 0.00 -1.18 0.00 0.00 61.69 60.51 2yxt s THR 310 Cb -0.17 -3.26 -0.02 0.00 1.34 0.00 0.00 72.50 70.39 2yxt s THR 310 CO 0.14 0.48 1.22 -0.69 -0.54 0.00 0.00 174.62 175.22 2yxt s VAL 311 N 0.16 4.31 -2.16 2.29 1.01 -1.26 -0.57 120.40 124.16 2yxt s VAL 311 Ca 0.06 1.60 0.31 0.00 0.00 0.00 0.00 61.98 63.95 2yxt s VAL 311 Cb -0.12 -4.03 0.79 0.00 0.00 0.00 0.00 36.38 33.02 2yxt s VAL 311 CO -0.00 -0.08 2.07 0.18 0.00 0.00 0.00 175.10 177.27