#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oyr s ARG 2 N 0.00 3.85 0.27 2.12 0.52 -1.26 -4.99 118.95 119.46 1oyr s ARG 2 Ca 0.00 0.31 -0.00 0.00 -0.52 0.00 0.00 55.73 55.51 1oyr s ARG 2 Cb 0.00 -2.87 0.56 0.00 0.52 0.00 0.00 34.95 33.16 1oyr s ARG 2 CO 0.00 0.46 1.76 0.45 0.02 0.00 0.00 175.30 177.99 1oyr h HIS 3 N 3.29 0.77 -0.21 -0.53 3.86 -2.04 0.65 115.15 120.94 1oyr h HIS 3 Ca -0.48 0.03 0.06 0.00 -1.16 0.00 0.00 60.37 58.82 1oyr h HIS 3 Cb 1.18 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 29.43 1oyr h HIS 3 CO 0.64 0.17 0.19 -0.44 0.86 0.00 0.00 177.93 179.35 1oyr h ASP 4 N 0.61 0.00 0.00 2.45 3.32 -2.03 -3.44 116.42 117.34 1oyr h ASP 4 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 1oyr h ASP 4 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1oyr h ASP 4 CO -0.38 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.75 1oyr n GLY 5 N -1.47 0.87 3.74 2.75 0.00 0.23 -5.07 105.19 106.24 1oyr n GLY 5 Ca 0.02 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.36 1oyr n GLY 5 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1oyr s ARG 6 N -0.91 2.73 0.75 1.61 1.70 -1.25 -4.93 118.95 118.65 1oyr s ARG 6 Ca 0.00 -0.76 -0.13 0.00 -0.47 0.00 0.00 55.73 54.37 1oyr s ARG 6 Cb 0.00 -2.64 0.05 0.00 -0.57 0.00 0.00 34.95 31.79 1oyr s ARG 6 CO 0.00 0.55 1.14 -0.65 -1.08 0.00 0.00 175.30 175.26 1oyr s GLN 7 N -2.37 2.15 0.54 3.89 -1.52 -1.26 -4.03 119.66 117.06 1oyr s GLN 7 Ca 0.28 1.46 0.30 0.00 -1.95 0.00 0.00 55.36 55.45 1oyr s GLN 7 Cb -0.12 -1.86 1.47 0.00 -0.22 0.00 0.00 33.01 32.27 1oyr s GLN 7 CO 0.20 -1.77 1.90 1.12 -0.25 0.00 0.00 175.29 176.50 1oyr h HIS 8 N -0.71 0.00 -0.44 0.91 2.07 -1.95 -1.90 115.15 113.12 1oyr h HIS 8 Ca -0.45 0.00 -0.28 0.00 -2.85 0.00 0.00 60.37 56.79 1oyr h HIS 8 Cb 1.26 0.00 -0.18 0.00 2.57 0.00 0.00 27.41 31.06 1oyr h HIS 8 CO 0.53 0.00 -0.21 -0.40 -3.07 0.00 0.00 177.93 174.78 1oyr n ASP 9 N -4.21 3.30 -4.54 3.10 3.85 -1.26 -0.62 116.55 116.17 1oyr n ASP 9 Ca 0.16 -3.81 -0.34 0.00 -0.71 0.00 0.00 54.79 50.10 1oyr n ASP 9 Cb 0.87 -0.59 -0.12 0.00 -1.35 0.00 0.00 41.12 39.93 1oyr n ASP 9 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 1oyr s GLU 10 N -3.38 3.13 0.63 0.11 2.12 -0.72 -4.96 118.70 115.64 1oyr s GLU 10 Ca 0.47 -0.55 -0.09 0.00 0.36 0.00 0.00 54.97 55.16 1oyr s GLU 10 Cb 0.41 -2.71 0.00 0.00 0.26 0.00 0.00 34.13 32.09 1oyr s GLU 10 CO -0.01 0.48 0.99 -0.51 -0.54 0.00 0.00 175.26 175.67 1oyr s LEU 11 N -0.31 3.14 0.67 2.70 1.43 -1.26 -4.73 118.68 120.32 1oyr s LEU 11 Ca 0.04 1.00 -0.11 0.00 -1.03 0.00 0.00 54.13 54.03 1oyr s LEU 11 Cb -0.13 -3.85 -0.01 0.00 0.03 0.00 0.00 46.19 42.23 1oyr s LEU 11 CO 0.02 -1.10 1.06 -0.13 0.23 0.00 0.00 176.35 176.43 1oyr s ARG 12 N -5.14 3.17 0.19 1.70 0.52 -1.26 -4.95 118.95 113.17 1oyr s ARG 12 Ca 0.55 0.74 -0.32 0.00 -0.52 0.00 0.00 55.73 56.19 1oyr s ARG 12 Cb -0.11 -2.03 -0.11 0.00 0.52 0.00 0.00 34.95 33.22 1oyr s ARG 12 CO 0.49 -0.88 1.69 -2.14 0.02 0.00 0.00 175.30 174.48 1oyr s PRO 13 N -5.18 4.15 -0.07 3.54 0.02 -1.26 -4.68 135.00 131.52 1oyr s PRO 13 Ca 0.57 2.53 0.02 0.00 0.02 0.00 0.00 61.00 64.14 1oyr s PRO 13 Cb -0.12 -3.14 -0.03 0.00 0.02 0.00 0.00 34.50 31.23 1oyr s PRO 13 CO 0.54 -0.72 -0.12 0.42 -0.33 0.00 0.00 177.00 176.79 1oyr s ILE 14 N 1.30 3.28 0.02 2.83 1.01 -1.26 -1.75 121.20 126.62 1oyr s ILE 14 Ca 0.74 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.79 1oyr s ILE 14 Cb -0.48 -2.32 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 1oyr s ILE 14 CO 0.32 0.58 -0.09 -0.89 0.00 0.00 0.00 174.94 174.86 1oyr s THR 15 N -0.57 0.68 -0.29 2.92 2.01 -0.71 -5.01 115.64 114.67 1oyr s THR 15 Ca 0.08 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.44 1oyr s THR 15 Cb -0.12 -0.63 0.09 0.00 0.01 0.00 0.00 72.50 71.86 1oyr s THR 15 CO 0.02 -0.01 0.04 -0.36 -0.69 0.00 0.00 174.62 173.62 1oyr s PHE 16 N -0.61 2.45 -0.45 4.92 0.08 -1.26 -1.83 117.98 121.27 1oyr s PHE 16 Ca -0.01 -2.06 -0.21 0.00 0.12 0.00 0.00 56.93 54.77 1oyr s PHE 16 Cb -0.06 -1.98 0.03 0.00 -0.57 0.00 0.00 43.02 40.44 1oyr s PHE 16 CO 0.00 -0.86 0.69 -0.51 -0.10 0.00 0.00 175.22 174.45 1oyr s ASP 17 N 1.36 6.34 0.41 1.36 1.01 -0.95 -4.94 116.67 121.26 1oyr s ASP 17 Ca 0.05 -0.33 -0.16 0.00 0.71 0.00 0.00 52.55 52.82 1oyr s ASP 17 Cb -0.18 -2.34 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 1oyr s ASP 17 CO -0.14 -0.84 0.86 -0.76 0.21 0.00 0.00 175.17 174.50 1oyr s LEU 18 N 2.98 3.89 -1.56 1.23 1.43 -1.26 -1.61 118.68 123.78 1oyr s LEU 18 Ca 0.24 1.45 -0.01 0.00 -1.03 0.00 0.00 54.13 54.78 1oyr s LEU 18 Cb -0.14 -4.30 0.00 0.00 0.03 0.00 0.00 46.19 41.78 1oyr s LEU 18 CO 0.19 -0.37 0.12 0.47 0.23 0.00 0.00 176.35 177.00 1oyr n ASP 19 N -0.86 -5.39 -0.23 2.29 10.43 0.11 -4.88 116.55 118.01 1oyr n ASP 19 Ca 0.05 -0.03 0.03 0.00 2.57 0.00 0.00 54.79 57.42 1oyr n ASP 19 Cb 0.54 -4.48 0.13 0.00 1.84 0.00 0.00 41.12 39.15 1oyr n ASP 19 CO 0.00 0.00 0.00 0.15 -1.07 0.00 0.00 177.20 176.28 1oyr h PHE 20 N -0.26 0.00 -3.37 1.24 3.57 -1.69 -3.37 116.94 113.07 1oyr h PHE 20 Ca -0.45 0.05 -0.66 0.00 3.53 0.00 0.00 57.97 60.43 1oyr h PHE 20 Cb 1.33 0.11 -0.30 0.00 2.79 0.00 0.00 35.95 39.87 1oyr h PHE 20 CO 0.59 -0.18 -0.75 0.42 -2.23 0.00 0.00 178.31 176.16 1oyr s ILE 21 N -6.12 3.00 0.02 1.41 1.01 -1.26 -5.05 121.20 114.20 1oyr s ILE 21 Ca -0.13 -0.73 -0.04 0.00 0.00 0.00 0.00 60.65 59.74 1oyr s ILE 21 Cb 0.20 -2.40 -0.01 0.00 0.01 0.00 0.00 42.46 40.26 1oyr s ILE 21 CO 0.75 0.37 1.08 -1.28 0.00 0.00 0.00 174.94 175.85 1oyr h SER 22 N 8.06 -0.28 -0.99 3.58 0.87 -2.00 -3.31 113.55 119.48 1oyr h SER 22 Ca -0.40 0.04 0.17 0.00 -1.23 0.00 0.00 61.79 60.38 1oyr h SER 22 Cb 1.14 0.12 -0.17 0.00 -0.44 0.00 0.00 62.40 63.05 1oyr h SER 22 CO 0.60 -0.04 -0.32 1.41 -0.53 0.00 0.00 176.83 177.95 1oyr n HIS 23 N -3.21 0.19 -2.13 2.24 8.25 -1.26 -4.71 115.22 114.59 1oyr n HIS 23 Ca -0.00 1.21 -0.36 0.00 -0.26 0.00 0.00 57.72 58.31 1oyr n HIS 23 Cb 0.04 -0.97 0.02 0.00 1.12 0.00 0.00 29.99 30.20 1oyr n HIS 23 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1oyr s PRO 24 N -6.09 3.20 0.32 -0.41 0.04 -1.25 -4.92 135.00 125.90 1oyr s PRO 24 Ca -0.14 1.75 0.01 0.00 0.04 0.00 0.00 61.00 62.66 1oyr s PRO 24 Cb 0.23 -2.01 0.53 0.00 0.04 0.00 0.00 34.50 33.30 1oyr s PRO 24 CO 0.74 -1.00 1.90 0.93 0.04 0.00 0.00 177.00 179.61 1oyr h GLU 25 N 1.12 0.76 -4.35 4.56 3.07 -1.77 -3.40 114.58 114.58 1oyr h GLU 25 Ca -0.50 -0.11 -0.50 0.00 -0.50 0.00 0.00 59.36 57.75 1oyr h GLU 25 Cb 1.28 -0.14 -0.35 0.00 -0.84 0.00 0.00 28.75 28.71 1oyr h GLU 25 CO 0.56 0.63 -0.80 0.20 -1.40 0.00 0.00 179.01 178.20 1oyr s GLY 26 N -3.62 0.74 -0.10 -3.84 0.00 -0.77 -4.14 107.32 95.58 1oyr s GLY 26 Ca -0.09 -0.38 -0.04 0.00 0.00 0.00 0.00 44.72 44.20 1oyr s GLY 26 CO 0.78 0.39 0.20 -0.45 0.00 0.00 0.00 173.10 174.02 1oyr s SER 27 N 1.03 0.54 -0.01 1.64 0.15 -1.26 0.10 113.70 115.90 1oyr s SER 27 Ca -0.08 0.44 0.02 0.00 0.70 0.00 0.00 55.95 57.03 1oyr s SER 27 Cb -0.15 0.44 -0.00 0.00 -1.71 0.00 0.00 66.02 64.60 1oyr s SER 27 CO -0.00 -0.24 -0.07 -0.69 1.20 0.00 0.00 173.24 173.44 1oyr s VAL 28 N 2.28 0.53 -0.41 4.45 1.01 0.93 0.07 120.40 129.26 1oyr s VAL 28 Ca 0.02 -0.28 -0.06 0.00 0.00 0.00 0.00 61.98 61.66 1oyr s VAL 28 Cb -0.12 -0.46 0.10 0.00 0.00 0.00 0.00 36.38 35.90 1oyr s VAL 28 CO -0.07 0.15 0.23 -0.22 0.00 0.00 0.00 175.10 175.20 1oyr s LEU 29 N -0.10 5.19 -0.05 3.92 2.96 -0.63 0.06 118.68 130.02 1oyr s LEU 29 Ca 0.02 -1.78 -0.20 0.00 -0.22 0.00 0.00 54.13 51.95 1oyr s LEU 29 Cb -0.03 -1.90 -0.05 0.00 0.50 0.00 0.00 46.19 44.71 1oyr s LEU 29 CO -0.00 -0.55 0.57 -0.51 -1.32 0.00 0.00 176.35 174.54 1oyr s ILE 30 N 1.28 5.02 -0.18 6.68 2.07 -0.40 -2.24 121.20 133.43 1oyr s ILE 30 Ca 0.05 1.18 0.01 0.00 -1.41 0.00 0.00 60.65 60.48 1oyr s ILE 30 Cb -0.23 -3.91 0.03 0.00 0.13 0.00 0.00 42.46 38.48 1oyr s ILE 30 CO -0.01 0.37 -0.15 -0.89 -1.91 0.00 0.00 174.94 172.34 1oyr s THR 31 N 0.20 1.84 -0.49 4.00 2.01 -0.76 -1.39 115.64 121.05 1oyr s THR 31 Ca 0.30 -0.93 0.03 0.00 0.31 0.00 0.00 61.69 61.41 1oyr s THR 31 Cb -0.17 -1.75 0.13 0.00 0.01 0.00 0.00 72.50 70.71 1oyr s THR 31 CO 0.15 0.39 0.24 0.00 -0.69 0.00 0.00 174.62 174.71 1oyr s ALA 32 N 1.35 2.97 0.00 7.40 0.00 0.46 -1.74 121.76 132.21 1oyr s ALA 32 Ca 0.02 -3.04 0.00 0.00 0.00 0.00 0.00 51.96 48.95 1oyr s ALA 32 Cb -0.14 -2.07 0.00 0.00 0.00 0.00 0.00 23.12 20.90 1oyr s ALA 32 CO -0.11 -2.00 0.00 0.41 0.00 0.00 0.00 175.76 174.06 1oyr n GLY 33 N 3.31 2.30 0.83 0.00 0.00 -0.72 -1.79 105.19 109.12 1oyr n GLY 33 Ca 0.06 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.98 1oyr n GLY 33 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1oyr n ASN 34 N 9.69 2.74 -4.68 1.61 3.02 -1.26 -4.90 115.26 121.47 1oyr n ASN 34 Ca 0.00 -1.84 -0.40 0.00 -0.03 0.00 0.00 54.58 52.30 1oyr n ASN 34 Cb 0.00 -0.04 -0.05 0.00 -0.61 0.00 0.00 39.78 39.09 1oyr n ASN 34 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1oyr s THR 35 N -1.60 4.97 -0.09 3.41 2.01 -0.74 -4.40 115.64 119.20 1oyr s THR 35 Ca 0.25 1.45 0.01 0.00 0.31 0.00 0.00 61.69 63.71 1oyr s THR 35 Cb 0.17 -4.05 0.02 0.00 0.01 0.00 0.00 72.50 68.64 1oyr s THR 35 CO 0.25 0.13 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.66 1oyr s LYS 36 N 1.62 1.72 -0.02 4.92 1.02 0.69 -0.40 119.74 129.29 1oyr s LYS 36 Ca 0.35 -0.38 0.04 0.00 0.02 0.00 0.00 55.97 56.00 1oyr s LYS 36 Cb -0.17 -1.56 -0.00 0.00 -0.52 0.00 0.00 37.83 35.58 1oyr s LYS 36 CO 0.14 -0.10 -0.13 0.08 -0.92 0.00 0.00 175.35 174.42 1oyr s VAL 37 N 1.11 1.05 -0.32 3.17 1.01 -0.49 -1.42 120.40 124.51 1oyr s VAL 37 Ca -0.06 -0.54 -0.14 0.00 0.00 0.00 0.00 61.98 61.25 1oyr s VAL 37 Cb -0.14 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.31 1oyr s VAL 37 CO -0.02 0.31 0.30 -0.63 0.00 0.00 0.00 175.10 175.06 1oyr s ILE 38 N -0.08 5.23 -0.27 2.22 1.01 -0.39 -1.28 121.20 127.64 1oyr s ILE 38 Ca 0.01 0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.69 1oyr s ILE 38 Cb -0.08 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.69 1oyr s ILE 38 CO 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 174.94 174.96 1oyr s ASN 40 N 1.36 3.46 -0.17 0.00 0.02 -0.72 -0.05 114.94 118.85 1oyr s ASN 40 Ca -0.00 -0.42 -0.01 0.00 -1.02 0.00 0.00 52.86 51.41 1oyr s ASN 40 Cb -0.17 -1.06 -0.01 0.00 0.02 0.00 0.00 41.25 40.03 1oyr s ASN 40 CO -0.02 0.24 -0.10 0.00 0.02 0.00 0.00 177.10 177.24 1oyr s ALA 41 N -0.12 2.68 -0.09 0.60 0.00 0.29 -0.97 121.76 124.15 1oyr s ALA 41 Ca -0.04 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 50.94 1oyr s ALA 41 Cb -0.14 -1.39 0.01 0.00 0.00 0.00 0.00 23.12 21.60 1oyr s ALA 41 CO 0.04 -0.04 -0.17 -1.12 0.00 0.00 0.00 175.76 174.47 1oyr s SER 42 N 0.83 2.36 0.34 0.00 0.01 0.10 -1.85 113.70 115.48 1oyr s SER 42 Ca -0.03 -0.41 -0.05 0.00 1.31 0.00 0.00 55.95 56.76 1oyr s SER 42 Cb -0.15 -1.08 -0.05 0.00 0.21 0.00 0.00 66.02 64.95 1oyr s SER 42 CO 0.01 0.07 0.61 -0.69 0.41 0.00 0.00 173.24 173.65 1oyr s VAL 43 N 0.62 4.99 -0.30 3.43 1.01 -1.26 0.66 120.40 129.55 1oyr s VAL 43 Ca -0.14 0.08 -0.06 0.00 0.00 0.00 0.00 61.98 61.85 1oyr s VAL 43 Cb -0.16 -3.77 0.19 0.00 0.00 0.00 0.00 36.38 32.64 1oyr s VAL 43 CO 0.04 -0.45 0.91 -0.70 0.00 0.00 0.00 175.10 174.90 1oyr s GLU 44 N -3.85 0.27 -0.70 2.72 2.12 -0.39 -4.93 118.70 113.94 1oyr s GLU 44 Ca 0.45 0.28 -0.25 0.00 0.36 0.00 0.00 54.97 55.81 1oyr s GLU 44 Cb -0.10 0.13 -0.14 0.00 0.26 0.00 0.00 34.13 34.28 1oyr s GLU 44 CO 0.33 -0.49 2.45 -0.25 -0.54 0.00 0.00 175.26 176.75 1oyr n ASP 45 N 5.22 1.50 0.00 -1.70 8.00 -1.26 -1.75 116.55 126.56 1oyr n ASP 45 Ca 0.07 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 54.95 1oyr n ASP 45 Cb 0.56 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.27 1oyr n ASP 45 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1oyr n ARG 46 N 8.57 0.00 -3.88 -1.24 0.00 -1.22 -4.93 116.66 113.97 1oyr n ARG 46 Ca 0.47 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 58.24 1oyr n ARG 46 Cb 0.39 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.78 1oyr n ARG 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1oyr s VAL 47 N -2.00 0.14 0.02 5.15 -7.23 -1.26 -3.04 120.40 112.18 1oyr s VAL 47 Ca 0.00 -1.23 -0.00 0.00 -1.81 0.00 0.00 61.98 58.93 1oyr s VAL 47 Cb 0.00 -1.39 0.00 0.00 0.56 0.00 0.00 36.38 35.55 1oyr s VAL 47 CO 0.00 -0.64 0.01 -2.65 -0.31 0.00 0.00 175.10 171.51 1oyr n PRO 48 N -0.06 -1.84 0.04 4.82 -0.02 -1.26 -4.87 135.00 131.80 1oyr n PRO 48 Ca -0.14 -0.02 -0.12 0.00 -2.02 0.00 0.00 63.50 61.20 1oyr n PRO 48 Cb 0.62 -0.02 -0.06 0.00 -0.02 0.00 0.00 33.50 34.02 1oyr n PRO 48 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1oyr h PRO 49 N 0.00 -0.05 -0.94 0.52 0.13 -2.03 -3.25 132.00 126.38 1oyr h PRO 49 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1oyr h PRO 49 Cb 0.01 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.15 1oyr h PRO 49 CO 0.00 -0.03 0.00 1.97 -0.23 0.00 0.00 178.00 179.71 1oyr n PHE 50 N -5.13 0.00 -0.72 1.56 1.16 -1.26 -3.40 117.46 109.66 1oyr n PHE 50 Ca -0.06 -0.02 0.02 0.00 -1.87 0.00 0.00 57.45 55.52 1oyr n PHE 50 Cb 0.07 -0.10 0.03 0.00 -1.61 0.00 0.00 39.48 37.86 1oyr n PHE 50 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1oyr n LEU 51 N 0.05 1.32 -4.57 5.98 4.77 -1.22 -4.95 117.00 118.37 1oyr n LEU 51 Ca 0.00 -1.60 -0.49 0.00 -0.03 0.00 0.00 56.01 53.89 1oyr n LEU 51 Cb 0.24 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 1oyr n LEU 51 CO 0.00 0.39 1.67 0.54 -1.33 0.00 0.00 177.39 178.66 1oyr n ARG 52 N -0.51 1.62 -1.09 3.23 5.12 -1.22 -1.68 116.66 122.14 1oyr n ARG 52 Ca 0.03 0.52 -0.06 0.00 -1.93 0.00 0.00 57.85 56.41 1oyr n ARG 52 Cb 0.45 -2.64 -0.03 0.00 -1.16 0.00 0.00 32.46 29.08 1oyr n ARG 52 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1oyr n GLY 53 N 5.49 0.58 0.00 -0.13 0.00 -1.26 -4.79 105.19 105.08 1oyr n GLY 53 Ca 0.32 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.45 1oyr n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyr n GLY 54 N 0.46 -0.87 2.89 -0.02 0.00 -0.68 -4.84 105.19 102.13 1oyr n GLY 54 Ca -0.06 -0.13 -0.00 0.00 0.00 0.00 0.00 46.02 45.83 1oyr n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyr n GLY 55 N 0.56 0.06 3.59 -0.02 0.00 -1.26 -4.94 105.19 103.17 1oyr n GLY 55 Ca 0.15 -0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1oyr n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oyr s LYS 56 N -1.78 3.25 0.58 1.61 1.02 -1.26 -4.35 119.74 118.81 1oyr s LYS 56 Ca 0.00 -0.48 0.02 0.00 0.02 0.00 0.00 55.97 55.53 1oyr s LYS 56 Cb 0.00 -2.82 0.06 0.00 -0.52 0.00 0.00 37.83 34.55 1oyr s LYS 56 CO 0.00 0.50 0.82 0.20 -0.92 0.00 0.00 175.35 175.94 1oyr s GLY 57 N -0.33 1.81 0.24 -3.33 0.00 0.22 -4.38 107.32 101.56 1oyr s GLY 57 Ca 0.06 -1.48 0.04 0.00 0.00 0.00 0.00 44.72 43.34 1oyr s GLY 57 CO 0.02 -1.13 0.00 0.86 0.00 0.00 0.00 173.10 172.86 1oyr s TRP 58 N -2.82 1.61 -0.19 1.90 -0.00 -0.90 -4.83 118.94 113.71 1oyr s TRP 58 Ca 0.59 -0.92 -0.04 0.00 -0.00 0.00 0.00 56.10 55.74 1oyr s TRP 58 Cb -0.09 -0.95 0.09 0.00 -0.00 0.00 0.00 33.47 32.53 1oyr s TRP 58 CO 0.39 -0.03 0.26 0.42 -0.00 0.00 0.00 176.95 178.00 1oyr s ILE 59 N -3.40 -0.40 0.22 5.86 1.01 -1.26 -1.45 121.20 121.78 1oyr s ILE 59 Ca 0.29 0.01 0.09 0.00 0.00 0.00 0.00 60.65 61.04 1oyr s ILE 59 Cb 0.06 -0.63 -0.05 0.00 0.01 0.00 0.00 42.46 41.85 1oyr s ILE 59 CO 0.10 -0.10 -0.17 0.28 0.00 0.00 0.00 174.94 175.05 1oyr s THR 60 N 2.39 1.95 0.00 2.92 -1.32 -0.92 -4.81 115.64 115.85 1oyr s THR 60 Ca 0.06 -2.21 -0.03 0.00 -1.21 0.00 0.00 61.69 58.31 1oyr s THR 60 Cb -0.15 -2.07 -0.01 0.00 -1.51 0.00 0.00 72.50 68.76 1oyr s THR 60 CO -0.12 -0.49 0.05 0.00 -2.21 0.00 0.00 174.62 171.85 1oyr s ALA 61 N -2.66 -0.09 -0.00 11.08 0.00 -1.26 -1.54 121.76 127.28 1oyr s ALA 61 Ca 0.23 -0.22 0.07 0.00 0.00 0.00 0.00 51.96 52.04 1oyr s ALA 61 Cb -0.03 0.06 -0.02 0.00 0.00 0.00 0.00 23.12 23.13 1oyr s ALA 61 CO 0.09 -0.13 -0.22 -1.21 0.00 0.00 0.00 175.76 174.28 1oyr s GLU 62 N -0.98 1.75 -0.03 0.00 2.02 -0.12 -4.69 118.70 116.66 1oyr s GLU 62 Ca -0.11 -0.84 0.03 0.00 0.02 0.00 0.00 54.97 54.07 1oyr s GLU 62 Cb -0.06 -1.73 0.00 0.00 0.10 0.00 0.00 34.13 32.44 1oyr s GLU 62 CO 0.00 0.47 -0.10 -0.47 0.02 0.00 0.00 175.26 175.18 1oyr s TYR 63 N -0.58 1.08 0.07 1.61 6.14 -1.26 -1.29 117.35 123.12 1oyr s TYR 63 Ca 0.09 -0.29 -0.01 0.00 0.64 0.00 0.00 57.07 57.50 1oyr s TYR 63 Cb -0.09 -0.77 -0.04 0.00 0.42 0.00 0.00 41.96 41.49 1oyr s TYR 63 CO -0.00 -0.12 -0.02 -1.54 0.64 0.00 0.00 175.55 174.51 1oyr s SER 64 N 0.23 0.49 -0.16 4.32 1.04 -0.93 -4.90 113.70 113.79 1oyr s SER 64 Ca -0.04 -1.04 -0.01 0.00 0.48 0.00 0.00 55.95 55.34 1oyr s SER 64 Cb -0.10 0.21 0.04 0.00 0.10 0.00 0.00 66.02 66.28 1oyr s SER 64 CO 0.01 -0.62 -0.04 -0.32 0.98 0.00 0.00 173.24 173.25 1oyr s MET 65 N -3.94 1.32 0.31 4.02 1.75 -1.26 -1.63 119.30 119.86 1oyr s MET 65 Ca 0.10 -0.45 -0.29 0.00 -1.25 0.00 0.00 55.69 53.80 1oyr s MET 65 Cb 0.08 -1.91 -0.12 0.00 2.84 0.00 0.00 34.83 35.71 1oyr s MET 65 CO -0.08 -0.43 1.38 1.28 -0.65 0.00 0.00 175.02 176.53 1oyr n LEU 66 N 4.91 3.62 -0.31 4.11 4.77 -1.07 -4.86 117.00 128.17 1oyr n LEU 66 Ca -0.11 1.18 0.08 0.00 -0.03 0.00 0.00 56.01 57.13 1oyr n LEU 66 Cb 0.48 -1.49 0.17 0.00 -2.33 0.00 0.00 43.42 40.25 1oyr n LEU 66 CO 0.16 -0.35 0.62 -0.81 -1.33 0.00 0.00 177.39 175.68 1oyr n PRO 67 N 1.21 -0.08 -1.48 3.23 -0.04 -1.26 -0.37 135.00 136.21 1oyr n PRO 67 Ca 0.07 1.35 -0.29 0.00 -0.04 0.00 0.00 63.50 64.59 1oyr n PRO 67 Cb 0.35 -2.07 0.08 0.00 -0.04 0.00 0.00 33.50 31.82 1oyr n PRO 67 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1oyr n ARG 68 N -5.38 2.86 0.10 0.54 3.00 -1.26 -1.53 116.66 114.98 1oyr n ARG 68 Ca 0.16 -3.51 -0.01 0.00 -0.00 0.00 0.00 57.85 54.50 1oyr n ARG 68 Cb 0.52 -2.25 -0.03 0.00 0.00 0.00 0.00 32.46 30.70 1oyr n ARG 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1oyr h ALA 69 N 1.91 0.60 -2.33 5.13 0.00 -0.95 -3.46 119.26 120.17 1oyr h ALA 69 Ca 0.52 -0.67 -0.49 0.00 0.00 0.00 0.00 54.91 54.26 1oyr h ALA 69 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1oyr h ALA 69 CO 1.24 0.86 -0.15 -0.08 0.00 0.00 0.00 179.25 181.12 1oyr s THR 70 N -2.88 5.06 0.47 0.00 -1.32 -1.26 -1.27 115.64 114.44 1oyr s THR 70 Ca 0.02 -0.21 0.23 0.00 -1.21 0.00 0.00 61.69 60.52 1oyr s THR 70 Cb 0.08 -3.81 0.42 0.00 -1.51 0.00 0.00 72.50 67.68 1oyr s THR 70 CO 0.78 -0.49 1.89 -1.13 -2.21 0.00 0.00 174.62 173.46 1oyr h ASN 71 N 1.09 0.21 -4.15 8.08 -1.24 -1.88 -3.38 115.58 114.31 1oyr h ASN 71 Ca -0.49 0.02 -0.69 0.00 0.71 0.00 0.00 56.30 55.85 1oyr h ASN 71 Cb 1.21 -0.02 -0.31 0.00 0.73 0.00 0.00 38.32 39.93 1oyr h ASN 71 CO 0.63 0.09 -0.88 -1.58 -1.29 0.00 0.00 177.43 174.40 1oyr s GLN 72 N -5.22 2.45 -0.26 6.67 2.00 -1.26 -5.08 119.66 118.96 1oyr s GLN 72 Ca -0.07 -0.90 -0.29 0.00 -2.00 0.00 0.00 55.36 52.10 1oyr s GLN 72 Cb 0.22 -2.15 -0.03 0.00 0.80 0.00 0.00 33.01 31.86 1oyr s GLN 72 CO 0.77 0.43 1.78 0.50 -0.50 0.00 0.00 175.29 178.27 1oyr s ARG 73 N -0.28 3.52 0.13 1.67 3.52 -1.26 -4.84 118.95 121.40 1oyr s ARG 73 Ca 0.00 1.62 -0.18 0.00 -0.13 0.00 0.00 55.73 57.04 1oyr s ARG 73 Cb -0.13 -4.16 -0.07 0.00 -1.56 0.00 0.00 34.95 29.04 1oyr s ARG 73 CO 0.02 -1.64 0.60 0.95 -0.81 0.00 0.00 175.30 174.42 1oyr s THR 74 N 6.31 4.73 0.19 4.11 -4.23 -0.58 -4.99 115.64 121.19 1oyr s THR 74 Ca 0.79 1.12 -0.33 0.00 -1.18 0.00 0.00 61.69 62.09 1oyr s THR 74 Cb -0.25 -3.85 -0.14 0.00 1.34 0.00 0.00 72.50 69.61 1oyr s THR 74 CO 0.33 0.39 1.52 -0.38 -0.54 0.00 0.00 174.62 175.93 1oyr n ILE 75 N 1.23 0.37 -1.70 2.99 5.41 -1.26 -4.51 119.36 121.90 1oyr n ILE 75 Ca -0.07 -0.09 -0.44 0.00 1.00 0.00 0.00 62.75 63.15 1oyr n ILE 75 Cb 0.51 -1.52 -0.03 0.00 -0.71 0.00 0.00 39.64 37.89 1oyr n ILE 75 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1oyr n ARG 76 N 2.87 2.35 0.06 0.38 0.63 -1.26 -4.87 116.66 116.82 1oyr n ARG 76 Ca 0.15 0.84 0.09 0.00 -0.92 0.00 0.00 57.85 58.01 1oyr n ARG 76 Cb 0.30 -2.58 0.54 0.00 0.45 0.00 0.00 32.46 31.17 1oyr n ARG 76 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1oyr h GLU 77 N 5.01 0.28 -0.40 -0.14 4.81 -1.91 -1.73 114.58 120.50 1oyr h GLU 77 Ca -0.45 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 58.67 1oyr h GLU 77 Cb 1.25 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1oyr h GLU 77 CO 0.82 0.18 -0.13 0.77 -0.73 0.00 0.00 179.01 179.92 1oyr h SER 78 N 0.29 0.72 -0.65 1.04 0.02 -1.89 -2.88 113.55 110.19 1oyr h SER 78 Ca 0.15 -0.22 0.09 0.00 -0.84 0.00 0.00 61.79 60.97 1oyr h SER 78 Cb 0.24 -0.19 -0.07 0.00 0.14 0.00 0.00 62.40 62.52 1oyr h SER 78 CO -0.03 0.87 0.30 0.28 -1.14 0.00 0.00 176.83 177.10 1oyr h SER 79 N 0.66 0.36 -3.77 3.07 0.02 -1.68 -3.39 113.55 108.83 1oyr h SER 79 Ca 0.11 0.06 -0.50 0.00 -0.84 0.00 0.00 61.79 60.63 1oyr h SER 79 Cb 0.59 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.14 1oyr h SER 79 CO 0.04 0.21 0.42 -0.54 -1.14 0.00 0.00 176.83 175.82 1oyr s LYS 80 N -6.08 4.74 0.00 3.45 -0.14 -1.09 -4.91 119.74 115.72 1oyr s LYS 80 Ca -0.13 1.65 0.02 0.00 -1.36 0.00 0.00 55.97 56.16 1oyr s LYS 80 Cb 0.17 -3.24 0.11 0.00 -1.68 0.00 0.00 37.83 33.20 1oyr s LYS 80 CO 0.75 0.35 0.49 0.41 -0.76 0.00 0.00 175.35 176.59 1oyr n GLY 81 N 1.37 -0.37 3.23 -3.33 0.00 -1.26 -4.73 105.19 100.09 1oyr n GLY 81 Ca -0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 1oyr n GLY 81 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oyr s LYS 82 N -2.00 0.88 -0.00 1.61 -2.85 -1.26 -5.13 119.74 110.99 1oyr s LYS 82 Ca 0.03 -0.88 -0.23 0.00 -1.00 0.00 0.00 55.97 53.89 1oyr s LYS 82 Cb 0.01 0.36 -0.05 0.00 -2.06 0.00 0.00 37.83 36.10 1oyr s LYS 82 CO 0.02 -0.29 0.71 0.42 0.10 0.00 0.00 175.35 176.30 1oyr s ILE 83 N -3.74 4.87 1.13 3.79 1.01 -1.26 -4.78 121.20 122.23 1oyr s ILE 83 Ca 0.04 1.48 -0.13 0.00 0.00 0.00 0.00 60.65 62.04 1oyr s ILE 83 Cb 0.04 -4.05 0.26 0.00 0.01 0.00 0.00 42.46 38.72 1oyr s ILE 83 CO -0.11 0.34 1.04 -0.94 0.00 0.00 0.00 174.94 175.28 1oyr s SER 84 N 0.18 1.30 0.03 3.58 1.04 -1.26 -4.84 113.70 113.73 1oyr s SER 84 Ca 0.36 1.46 -0.25 0.00 0.48 0.00 0.00 55.95 58.00 1oyr s SER 84 Cb -0.19 -2.21 -0.17 0.00 0.10 0.00 0.00 66.02 63.54 1oyr s SER 84 CO 0.20 -3.99 1.44 1.23 0.98 0.00 0.00 173.24 173.10 1oyr h GLY 85 N -2.48 -0.20 -0.08 7.32 0.00 -1.99 -2.46 103.07 103.18 1oyr h GLY 85 Ca -0.60 0.08 0.04 0.00 0.00 0.00 0.00 47.33 46.84 1oyr h GLY 85 CO 0.52 -0.07 -0.49 3.21 0.00 0.00 0.00 176.54 179.70 1oyr h ARG 86 N -0.44 -0.53 -0.79 4.80 3.08 -1.98 0.64 114.38 119.16 1oyr h ARG 86 Ca -0.02 0.04 0.19 0.00 0.07 0.00 0.00 59.98 60.25 1oyr h ARG 86 Cb 0.35 0.12 -0.12 0.00 0.08 0.00 0.00 29.97 30.40 1oyr h ARG 86 CO 0.03 -0.35 0.20 1.15 -1.07 0.00 0.00 179.97 179.93 1oyr h THR 87 N -0.55 0.45 0.96 2.04 2.02 -1.90 0.46 112.91 116.39 1oyr h THR 87 Ca 0.05 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 67.10 1oyr h THR 87 Cb 0.66 0.17 0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1oyr h THR 87 CO -0.42 0.05 -0.48 -0.03 0.37 0.00 0.00 175.52 175.01 1oyr h MET 88 N 0.26 -1.26 -0.99 6.66 -1.53 -0.38 0.36 114.93 118.05 1oyr h MET 88 Ca 0.47 0.09 0.19 0.00 -3.44 0.00 0.00 59.70 57.01 1oyr h MET 88 Cb 0.85 0.29 -0.11 0.00 -0.55 0.00 0.00 31.60 32.07 1oyr h MET 88 CO -0.56 -0.84 0.59 1.49 0.14 0.00 0.00 176.91 177.73 1oyr h GLU 89 N -1.31 0.71 0.01 0.39 4.81 0.15 -2.81 114.58 116.52 1oyr h GLU 89 Ca -0.13 -0.04 -0.17 0.00 -0.13 0.00 0.00 59.36 58.89 1oyr h GLU 89 Cb 1.01 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 30.24 1oyr h GLU 89 CO 0.21 0.47 -0.66 0.82 -0.73 0.00 0.00 179.01 179.11 1oyr h ILE 90 N 0.73 1.42 -0.81 2.32 2.04 0.08 -3.06 117.51 120.23 1oyr h ILE 90 Ca 0.58 -2.14 0.08 0.00 1.00 0.00 0.00 64.86 64.38 1oyr h ILE 90 Cb 0.93 2.64 -0.07 0.00 -0.74 0.00 0.00 36.82 39.58 1oyr h ILE 90 CO -0.40 0.62 0.48 1.56 0.00 0.00 0.00 178.15 180.41 1oyr h GLN 91 N -0.09 0.81 -0.39 2.37 4.20 -0.68 -1.33 115.11 120.00 1oyr h GLN 91 Ca -0.09 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.49 1oyr h GLN 91 Cb 1.38 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 1oyr h GLN 91 CO 0.13 0.53 -0.08 0.00 -0.67 0.00 0.00 178.83 178.75 1oyr h ARG 92 N 0.83 0.75 -0.44 1.46 3.08 -1.63 -2.68 114.38 115.75 1oyr h ARG 92 Ca 0.38 -0.28 0.06 0.00 0.07 0.00 0.00 59.98 60.21 1oyr h ARG 92 Cb 0.28 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.24 1oyr h ARG 92 CO -0.22 0.88 0.16 1.25 -1.07 0.00 0.00 179.97 180.97 1oyr h LEU 93 N 0.56 0.16 -0.45 3.04 6.46 -1.24 0.90 115.31 124.74 1oyr h LEU 93 Ca 0.10 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.89 1oyr h LEU 93 Cb 0.59 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.53 1oyr h LEU 93 CO 0.04 0.13 0.20 0.40 -0.62 0.00 0.00 178.44 178.58 1oyr h ILE 94 N 0.33 1.19 -0.20 4.05 2.04 -1.20 -0.96 117.51 122.75 1oyr h ILE 94 Ca 0.21 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 1oyr h ILE 94 Cb 0.20 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1oyr h ILE 94 CO -0.21 0.22 -0.00 1.23 0.00 0.00 0.00 178.15 179.39 1oyr h GLY 95 N 0.59 0.38 0.49 5.37 0.00 -1.12 -1.87 103.07 106.90 1oyr h GLY 95 Ca 0.15 -0.28 0.07 0.00 0.00 0.00 0.00 47.33 47.27 1oyr h GLY 95 CO -0.02 0.26 0.14 -0.09 0.00 0.00 0.00 176.54 176.83 1oyr h ARG 96 N 0.11 0.29 0.67 4.80 2.43 -0.75 -1.93 114.38 119.99 1oyr h ARG 96 Ca 0.06 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 1oyr h ARG 96 Cb 0.40 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1oyr h ARG 96 CO 0.01 0.19 -0.35 0.00 -1.51 0.00 0.00 179.97 178.32 1oyr h ALA 97 N 1.34 -0.94 -0.75 2.80 0.00 -1.04 -2.88 119.26 117.79 1oyr h ALA 97 Ca 0.23 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.02 1oyr h ALA 97 Cb 0.27 0.39 -0.07 0.00 0.00 0.00 0.00 17.79 18.38 1oyr h ALA 97 CO -0.26 -1.03 0.42 -0.07 0.00 0.00 0.00 179.25 178.30 1oyr h LEU 98 N -0.93 0.60 -1.73 0.00 3.38 -1.22 -1.87 115.31 113.54 1oyr h LEU 98 Ca -0.09 0.04 0.06 0.00 0.09 0.00 0.00 57.88 57.98 1oyr h LEU 98 Cb 0.73 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1oyr h LEU 98 CO 0.13 0.36 0.29 0.03 0.09 0.00 0.00 178.44 179.34 1oyr h ARG 99 N 0.73 0.32 0.00 1.13 3.08 -1.27 -2.15 114.38 116.23 1oyr h ARG 99 Ca 0.35 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.38 1oyr h ARG 99 Cb 0.29 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1oyr h ARG 99 CO -0.22 0.21 0.00 0.00 -1.07 0.00 0.00 179.97 178.89 1oyr n ALA 100 N -2.52 1.12 -1.69 0.04 0.00 -0.70 -2.29 120.51 114.46 1oyr n ALA 100 Ca 0.06 0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.59 1oyr n ALA 100 Cb 0.26 -1.11 0.12 0.00 0.00 0.00 0.00 19.45 18.72 1oyr n ALA 100 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1oyr n VAL 101 N -1.69 1.32 -3.99 0.00 0.24 -0.81 -5.01 118.33 108.38 1oyr n VAL 101 Ca 0.00 -1.99 -0.19 0.00 -2.04 0.00 0.00 64.34 60.12 1oyr n VAL 101 Cb 0.04 0.13 -0.17 0.00 -1.47 0.00 0.00 33.84 32.37 1oyr n VAL 101 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1oyr s VAL 102 N -1.96 0.36 -0.98 3.34 1.01 -0.97 -0.64 120.40 120.55 1oyr s VAL 102 Ca 0.29 0.01 -0.23 0.00 0.00 0.00 0.00 61.98 62.05 1oyr s VAL 102 Cb 0.29 -0.44 0.00 0.00 0.00 0.00 0.00 36.38 36.23 1oyr s VAL 102 CO -0.05 0.20 1.70 -0.62 0.00 0.00 0.00 175.10 176.33 1oyr s ASP 103 N 1.17 5.85 0.63 3.32 -1.08 -0.29 -4.80 116.67 121.47 1oyr s ASP 103 Ca -0.07 -1.15 0.27 0.00 -0.52 0.00 0.00 52.55 51.08 1oyr s ASP 103 Cb -0.14 -2.57 1.43 0.00 -1.46 0.00 0.00 42.92 40.19 1oyr s ASP 103 CO -0.02 -2.11 1.82 -0.07 0.52 0.00 0.00 175.17 175.32 1oyr h LEU 104 N 15.25 0.00 0.01 -1.34 3.38 -1.89 -0.49 115.31 130.23 1oyr h LEU 104 Ca 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1oyr h LEU 104 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1oyr h LEU 104 CO 1.32 0.00 -0.01 -0.08 0.09 0.00 0.00 178.44 179.77 1oyr h GLU 105 N 0.00 -0.02 0.00 1.13 4.81 -1.87 0.44 114.58 119.07 1oyr h GLU 105 Ca 0.10 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1oyr h GLU 105 Cb 1.04 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.43 1oyr h GLU 105 CO -0.00 0.76 -0.03 0.87 -0.73 0.00 0.00 179.01 179.88 1oyr h LYS 106 N -0.88 0.00 -0.29 1.92 1.57 -1.41 -2.25 116.57 115.22 1oyr h LYS 106 Ca -0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1oyr h LYS 106 Cb 0.79 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1oyr h LYS 106 CO 0.00 0.03 -0.32 1.25 -0.57 0.00 0.00 179.45 179.84 1oyr h LEU 107 N 0.00 0.66 0.00 2.94 5.85 -1.40 -3.45 115.31 119.91 1oyr h LEU 107 Ca -0.00 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1oyr h LEU 107 Cb 0.11 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1oyr h LEU 107 CO 0.00 0.93 0.00 0.61 -0.34 0.00 0.00 178.44 179.65 1oyr n GLY 108 N -0.13 -0.85 1.70 3.75 0.00 -0.85 -4.59 105.19 104.23 1oyr n GLY 108 Ca -0.01 -2.20 -0.09 0.00 0.00 0.00 0.00 46.02 43.72 1oyr n GLY 108 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1oyr n GLU 109 N -0.09 2.50 -2.48 1.61 2.13 -1.26 0.71 120.64 123.75 1oyr n GLU 109 Ca 0.00 -2.08 -0.24 0.00 0.66 0.00 0.00 57.16 55.50 1oyr n GLU 109 Cb 0.00 -1.88 0.09 0.00 0.27 0.00 0.00 31.44 29.92 1oyr n GLU 109 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1oyr s ARG 110 N -2.23 1.88 -0.04 5.31 1.70 -1.26 -3.39 118.95 120.92 1oyr s ARG 110 Ca 0.38 -0.83 0.02 0.00 -0.47 0.00 0.00 55.73 54.83 1oyr s ARG 110 Cb 0.31 -2.30 0.02 0.00 -0.57 0.00 0.00 34.95 32.41 1oyr s ARG 110 CO 0.09 -1.32 -0.06 -0.08 -1.08 0.00 0.00 175.30 172.84 1oyr s THR 111 N -3.13 0.65 -0.26 4.99 -1.32 -0.72 -2.12 115.64 113.73 1oyr s THR 111 Ca 0.64 -0.22 -0.09 0.00 -1.21 0.00 0.00 61.69 60.80 1oyr s THR 111 Cb -0.07 -0.63 -0.04 0.00 -1.51 0.00 0.00 72.50 70.24 1oyr s THR 111 CO 0.44 0.24 0.13 -0.63 -2.21 0.00 0.00 174.62 172.59 1oyr s ILE 112 N 0.65 4.84 -0.25 5.08 1.01 -0.53 -1.26 121.20 130.74 1oyr s ILE 112 Ca -0.10 0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.45 1oyr s ILE 112 Cb -0.13 -3.29 -0.05 0.00 0.01 0.00 0.00 42.46 39.01 1oyr s ILE 112 CO 0.01 0.30 0.21 0.26 0.00 0.00 0.00 174.94 175.71 1oyr s TRP 113 N 1.66 3.29 -0.22 3.97 0.52 0.21 -2.18 118.94 126.19 1oyr s TRP 113 Ca 0.07 0.25 -0.05 0.00 0.02 0.00 0.00 56.10 56.38 1oyr s TRP 113 Cb -0.15 -2.35 -0.02 0.00 -1.15 0.00 0.00 33.47 29.80 1oyr s TRP 113 CO 0.07 -0.03 -0.01 0.42 0.02 0.00 0.00 176.95 177.42 1oyr s ILE 114 N 1.37 3.72 -0.26 2.03 -1.09 -0.59 0.01 121.20 126.39 1oyr s ILE 114 Ca 0.09 -0.38 -0.01 0.00 -2.23 0.00 0.00 60.65 58.12 1oyr s ILE 114 Cb -0.15 -2.70 0.03 0.00 -1.58 0.00 0.00 42.46 38.07 1oyr s ILE 114 CO 0.07 0.41 -0.06 -1.81 -1.23 0.00 0.00 174.94 172.32 1oyr s ASP 115 N 1.39 4.39 -0.41 3.58 1.01 -0.14 -0.94 116.67 125.54 1oyr s ASP 115 Ca 0.05 -0.98 -0.07 0.00 0.71 0.00 0.00 52.55 52.26 1oyr s ASP 115 Cb -0.15 -1.66 0.09 0.00 1.01 0.00 0.00 42.92 42.21 1oyr s ASP 115 CO -0.00 -0.15 0.22 0.00 0.21 0.00 0.00 175.17 175.45 1oyr s ASP 117 N 1.98 4.67 -0.23 0.00 1.01 -0.50 -2.19 116.67 121.40 1oyr s ASP 117 Ca 0.03 -0.85 -0.29 0.00 0.71 0.00 0.00 52.55 52.15 1oyr s ASP 117 Cb -0.23 -1.75 0.01 0.00 1.01 0.00 0.00 42.92 41.96 1oyr s ASP 117 CO -0.00 -0.16 1.11 -0.69 0.21 0.00 0.00 175.17 175.64 1oyr s VAL 118 N 1.38 4.53 -0.30 -1.27 1.01 -0.65 -1.26 120.40 123.84 1oyr s VAL 118 Ca 0.01 1.83 0.22 0.00 0.00 0.00 0.00 61.98 64.03 1oyr s VAL 118 Cb -0.17 -4.25 -0.20 0.00 0.00 0.00 0.00 36.38 31.76 1oyr s VAL 118 CO -0.02 -0.24 0.78 2.30 0.00 0.00 0.00 175.10 177.92 1oyr n ILE 119 N 5.48 0.18 -3.64 2.22 -5.35 -0.51 -2.60 119.36 115.14 1oyr n ILE 119 Ca 0.13 -0.41 -0.10 0.00 -0.27 0.00 0.00 62.75 62.09 1oyr n ILE 119 Cb 0.46 0.05 -0.11 0.00 -1.74 0.00 0.00 39.64 38.30 1oyr n ILE 119 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1oyr s GLN 120 N -3.36 0.26 -0.14 6.28 0.74 -1.09 -4.56 119.66 117.78 1oyr s GLN 120 Ca -0.02 0.89 -0.02 0.00 0.05 0.00 0.00 55.36 56.25 1oyr s GLN 120 Cb 0.13 0.12 -0.02 0.00 1.10 0.00 0.00 33.01 34.34 1oyr s GLN 120 CO 0.85 -0.30 -0.08 0.00 -0.55 0.00 0.00 175.29 175.22 1oyr s ALA 121 N 2.53 2.84 -0.32 1.58 0.00 -0.40 -0.22 121.76 127.77 1oyr s ALA 121 Ca 0.00 -0.85 0.16 0.00 0.00 0.00 0.00 51.96 51.28 1oyr s ALA 121 Cb -0.12 -1.40 0.45 0.00 0.00 0.00 0.00 23.12 22.04 1oyr s ALA 121 CO -0.11 0.24 1.30 -3.47 0.00 0.00 0.00 175.76 173.72 1oyr n ASP 122 N 3.50 -0.18 0.00 0.00 2.03 -1.26 -4.68 116.55 115.95 1oyr n ASP 122 Ca -0.18 -2.26 0.00 0.00 0.52 0.00 0.00 54.79 52.88 1oyr n ASP 122 Cb 0.53 0.20 0.00 0.00 -0.72 0.00 0.00 41.12 41.13 1oyr n ASP 122 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1oyr n GLY 123 N -0.90 0.44 3.59 0.27 0.00 -1.26 -1.79 105.19 105.54 1oyr n GLY 123 Ca -0.04 -1.54 -0.22 0.00 0.00 0.00 0.00 46.02 44.22 1oyr n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyr n GLY 124 N 0.86 -0.45 0.09 -0.02 0.00 -1.26 -4.78 105.19 99.63 1oyr n GLY 124 Ca 0.00 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 1oyr n GLY 124 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1oyr h THR 125 N -2.26 1.32 -0.07 2.61 1.35 -1.95 -2.49 112.91 111.42 1oyr h THR 125 Ca -0.58 -3.01 0.01 0.00 -0.55 0.00 0.00 66.41 62.28 1oyr h THR 125 Cb 1.36 2.76 -0.01 0.00 -1.73 0.00 0.00 68.15 70.53 1oyr h THR 125 CO 0.55 0.82 -0.00 -0.09 -0.25 0.00 0.00 175.52 176.55 1oyr h ARG 126 N 0.04 0.02 -0.02 4.72 2.43 -2.00 -1.06 114.38 118.51 1oyr h ARG 126 Ca -0.17 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 58.93 1oyr h ARG 126 Cb 1.94 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.49 1oyr h ARG 126 CO 0.15 0.01 -0.27 1.79 -1.51 0.00 0.00 179.97 180.14 1oyr h THR 127 N 0.02 1.50 -0.94 0.20 1.35 -1.92 -3.12 112.91 110.00 1oyr h THR 127 Ca 0.03 -1.84 0.20 0.00 -0.55 0.00 0.00 66.41 64.25 1oyr h THR 127 Cb 0.04 2.59 -0.08 0.00 -1.73 0.00 0.00 68.15 68.97 1oyr h THR 127 CO -0.06 0.51 0.61 0.00 -0.25 0.00 0.00 175.52 176.33 1oyr h ALA 128 N 0.33 2.04 -0.09 6.62 0.00 -1.41 -0.18 119.26 126.56 1oyr h ALA 128 Ca -0.03 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1oyr h ALA 128 Cb 0.98 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1oyr h ALA 128 CO 0.05 -0.35 0.04 0.77 0.00 0.00 0.00 179.25 179.76 1oyr h SER 129 N 0.52 0.13 -0.18 0.00 0.02 -1.18 -1.95 113.55 110.91 1oyr h SER 129 Ca 0.50 -0.15 0.01 0.00 -0.84 0.00 0.00 61.79 61.30 1oyr h SER 129 Cb 1.09 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.58 1oyr h SER 129 CO -0.24 0.25 0.11 0.40 -1.14 0.00 0.00 176.83 176.21 1oyr h ILE 130 N -0.00 1.03 -0.52 3.27 2.04 -1.02 0.40 117.51 122.70 1oyr h ILE 130 Ca 0.03 -0.08 0.09 0.00 1.00 0.00 0.00 64.86 65.90 1oyr h ILE 130 Cb 0.16 0.79 -0.07 0.00 -0.74 0.00 0.00 36.82 36.95 1oyr h ILE 130 CO -0.00 0.04 0.12 0.74 0.00 0.00 0.00 178.15 179.05 1oyr h THR 131 N 0.22 0.72 0.00 -0.27 2.02 -1.10 -1.82 112.91 112.69 1oyr h THR 131 Ca 0.07 -0.09 -0.18 0.00 0.77 0.00 0.00 66.41 66.97 1oyr h THR 131 Cb -0.01 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 66.81 1oyr h THR 131 CO -0.03 0.05 -0.87 1.23 0.37 0.00 0.00 175.52 176.27 1oyr h GLY 132 N 0.27 0.00 1.77 2.16 0.00 -1.11 -3.21 103.07 102.95 1oyr h GLY 132 Ca 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.58 1oyr h GLY 132 CO -0.33 0.00 0.07 0.00 0.00 0.00 0.00 176.54 176.29 1oyr h ALA 133 N 1.13 1.72 0.58 3.60 0.00 0.41 -1.54 119.26 125.17 1oyr h ALA 133 Ca -0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1oyr h ALA 133 Cb 1.64 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.34 1oyr h ALA 133 CO 0.11 0.22 -0.28 0.35 0.00 0.00 0.00 179.25 179.65 1oyr h PHE 134 N 0.30 -0.73 -0.86 0.00 3.57 -1.35 -1.21 116.94 116.67 1oyr h PHE 134 Ca 0.08 -0.02 0.17 0.00 3.53 0.00 0.00 57.97 61.73 1oyr h PHE 134 Cb 0.09 0.24 -0.16 0.00 2.79 0.00 0.00 35.95 38.91 1oyr h PHE 134 CO 0.00 -0.45 -0.20 -0.07 -2.23 0.00 0.00 178.31 175.36 1oyr h LEU 135 N -1.04 -0.78 -0.02 0.59 3.38 -1.52 0.49 115.31 116.40 1oyr h LEU 135 Ca -0.08 0.26 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1oyr h LEU 135 Cb 0.60 0.53 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1oyr h LEU 135 CO 0.13 -0.28 -0.03 0.00 0.09 0.00 0.00 178.44 178.35 1oyr h ALA 136 N 1.86 -0.01 -0.84 1.53 0.00 -1.28 -0.83 119.26 119.70 1oyr h ALA 136 Ca 0.42 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.36 1oyr h ALA 136 Cb 0.64 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 1oyr h ALA 136 CO -0.88 -0.52 0.56 1.98 0.00 0.00 0.00 179.25 180.39 1oyr h MET 137 N -0.04 1.05 0.40 0.00 1.85 0.50 -0.74 114.93 117.96 1oyr h MET 137 Ca 0.02 -0.06 -0.02 0.00 -0.61 0.00 0.00 59.70 59.03 1oyr h MET 137 Cb 0.07 -0.24 0.00 0.00 0.43 0.00 0.00 31.60 31.86 1oyr h MET 137 CO -0.05 0.69 -0.19 0.00 -0.40 0.00 0.00 176.91 176.96 1oyr h ALA 138 N 1.50 -0.54 -0.67 0.39 0.00 0.43 -0.44 119.26 119.92 1oyr h ALA 138 Ca 0.33 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1oyr h ALA 138 Cb -0.02 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1oyr h ALA 138 CO -0.09 -0.80 0.38 0.82 0.00 0.00 0.00 179.25 179.56 1oyr h ILE 139 N -0.54 0.99 -0.11 0.00 2.04 -0.68 1.64 117.51 120.85 1oyr h ILE 139 Ca -0.05 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1oyr h ILE 139 Cb 0.41 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1oyr h ILE 139 CO 0.09 0.13 0.07 0.00 0.00 0.00 0.00 178.15 178.44 1oyr h ALA 140 N 1.34 0.14 -0.34 1.87 0.00 -0.93 -1.09 119.26 120.24 1oyr h ALA 140 Ca 0.29 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.06 1oyr h ALA 140 Cb 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1oyr h ALA 140 CO -0.17 -0.38 -0.37 0.82 0.00 0.00 0.00 179.25 179.15 1oyr h ILE 141 N 0.14 1.28 -0.47 0.00 2.04 -0.47 -2.50 117.51 117.54 1oyr h ILE 141 Ca 0.04 -1.54 0.06 0.00 1.00 0.00 0.00 64.86 64.43 1oyr h ILE 141 Cb -0.01 1.42 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 1oyr h ILE 141 CO -0.02 0.50 0.17 1.23 0.00 0.00 0.00 178.15 180.04 1oyr h GLY 142 N 0.91 0.62 0.73 5.37 0.00 0.28 0.07 103.07 111.05 1oyr h GLY 142 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1oyr h GLY 142 CO 0.08 0.03 -0.02 0.58 0.00 0.00 0.00 176.54 177.21 1oyr n LYS 143 N -5.00 1.05 0.03 4.80 2.85 -0.45 -2.46 118.16 118.99 1oyr n LYS 143 Ca 0.04 -0.23 -0.06 0.00 -1.05 0.00 0.00 58.31 57.01 1oyr n LYS 143 Cb 0.18 -1.50 -0.11 0.00 -0.65 0.00 0.00 35.03 32.95 1oyr n LYS 143 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1oyr h LEU 144 N 0.57 0.00 0.46 -5.58 5.85 -0.54 -3.29 115.31 112.78 1oyr h LEU 144 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1oyr h LEU 144 Cb 0.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1oyr h LEU 144 CO 0.00 0.93 -0.22 0.40 -0.34 0.00 0.00 178.44 179.21 1oyr h ILE 145 N 0.00 0.36 -0.22 4.05 2.04 -1.02 -1.84 117.51 120.87 1oyr h ILE 145 Ca -0.12 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.24 1oyr h ILE 145 Cb 1.82 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 38.39 1oyr h ILE 145 CO 0.10 0.06 -0.13 0.29 0.00 0.00 0.00 178.15 178.47 1oyr n LYS 146 N -5.22 -0.10 0.00 2.37 4.76 -1.19 0.14 118.16 118.92 1oyr n LYS 146 Ca -0.10 1.04 0.00 0.00 -2.87 0.00 0.00 58.31 56.38 1oyr n LYS 146 Cb 0.30 -1.56 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 1oyr n LYS 146 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1oyr n ALA 147 N -3.02 1.37 -3.87 7.82 0.00 -1.24 -4.76 120.51 116.82 1oyr n ALA 147 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.20 1oyr n ALA 147 Cb 0.06 -0.94 -0.00 0.00 0.00 0.00 0.00 19.45 18.56 1oyr n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oyr n GLY 148 N -0.39 -0.30 0.00 0.00 0.00 0.38 -4.86 105.19 100.02 1oyr n GLY 148 Ca 0.00 0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.29 1oyr n GLY 148 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1oyr n THR 149 N -4.35 0.02 -3.75 2.61 -1.04 -0.69 -4.88 114.28 102.20 1oyr n THR 149 Ca -0.29 -0.07 -0.13 0.00 -2.04 0.00 0.00 64.05 61.51 1oyr n THR 149 Cb 0.68 0.71 -0.09 0.00 -1.82 0.00 0.00 70.33 69.80 1oyr n THR 149 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 1oyr s ILE 150 N -3.07 0.03 -0.06 12.58 -4.36 -1.25 -5.04 121.20 120.03 1oyr s ILE 150 Ca 0.06 -0.25 0.00 0.00 -0.26 0.00 0.00 60.65 60.21 1oyr s ILE 150 Cb 0.16 -0.59 -0.26 0.00 1.25 0.00 0.00 42.46 43.03 1oyr s ILE 150 CO 0.84 -0.14 0.60 0.11 0.24 0.00 0.00 174.94 176.59 1oyr h LYS 151 N 4.58 0.18 -6.71 0.37 1.57 -1.90 -3.43 116.57 111.24 1oyr h LYS 151 Ca -0.28 -0.31 -0.67 0.00 -1.87 0.00 0.00 60.65 57.51 1oyr h LYS 151 Cb 1.18 0.12 -0.19 0.00 0.08 0.00 0.00 32.23 33.42 1oyr h LYS 151 CO 0.34 0.97 -0.80 0.95 -0.57 0.00 0.00 179.45 180.34 1oyr s THR 152 N -2.59 2.79 -0.42 -0.16 -4.23 -1.26 -5.10 115.64 104.67 1oyr s THR 152 Ca -0.13 -1.57 -0.29 0.00 -1.18 0.00 0.00 61.69 58.52 1oyr s THR 152 Cb 0.07 -2.29 0.02 0.00 1.34 0.00 0.00 72.50 71.64 1oyr s THR 152 CO 0.81 0.07 1.31 0.21 -0.54 0.00 0.00 174.62 176.48 1oyr s ASN 153 N -2.23 6.48 0.48 3.99 2.47 -1.26 -4.87 114.94 119.99 1oyr s ASN 153 Ca 0.18 0.75 0.23 0.00 0.42 0.00 0.00 52.86 54.45 1oyr s ASN 153 Cb -0.10 -2.54 1.20 0.00 -1.45 0.00 0.00 41.25 38.35 1oyr s ASN 153 CO 0.10 -1.33 1.99 -0.65 -3.72 0.00 0.00 177.10 173.49 1oyr h PRO 154 N 10.04 0.00 -6.26 0.43 0.11 -1.89 -3.44 132.00 130.99 1oyr h PRO 154 Ca -0.26 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.30 1oyr h PRO 154 Cb 1.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1oyr h PRO 154 CO 1.09 0.19 1.20 0.42 -0.21 0.00 0.00 178.00 180.69 1oyr s ILE 155 N -4.18 3.35 -1.29 4.15 1.01 -1.26 -1.14 121.20 121.84 1oyr s ILE 155 Ca -0.03 0.41 0.19 0.00 0.00 0.00 0.00 60.65 61.22 1oyr s ILE 155 Cb 0.13 -3.30 0.67 0.00 0.01 0.00 0.00 42.46 39.97 1oyr s ILE 155 CO 0.63 -0.08 1.58 0.35 0.00 0.00 0.00 174.94 177.42 1oyr n THR 156 N 5.98 1.60 0.00 2.92 -2.24 0.18 -4.97 114.28 117.76 1oyr n THR 156 Ca 0.20 -1.17 0.00 0.00 -2.27 0.00 0.00 64.05 60.81 1oyr n THR 156 Cb 0.43 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 1oyr n THR 156 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1oyr n ASP 157 N 1.16 0.00 -4.90 3.42 -0.08 -1.25 -5.01 116.55 109.89 1oyr n ASP 157 Ca 0.25 0.00 -0.29 0.00 -1.51 0.00 0.00 54.79 53.23 1oyr n ASP 157 Cb 0.80 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 44.22 1oyr n ASP 157 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1oyr s PHE 158 N -2.00 3.47 0.03 -0.67 0.08 -1.26 -4.93 117.98 112.70 1oyr s PHE 158 Ca 0.00 0.65 0.02 0.00 0.12 0.00 0.00 56.93 57.73 1oyr s PHE 158 Cb 0.00 -2.11 -0.02 0.00 -0.57 0.00 0.00 43.02 40.33 1oyr s PHE 158 CO 0.00 0.22 -0.08 -1.17 -0.10 0.00 0.00 175.22 174.09 1oyr s LEU 159 N -3.37 2.18 0.10 -0.37 2.96 -1.26 -2.09 118.68 116.83 1oyr s LEU 159 Ca 0.44 -0.41 -0.26 0.00 -0.22 0.00 0.00 54.13 53.68 1oyr s LEU 159 Cb -0.11 -0.24 0.08 0.00 0.50 0.00 0.00 46.19 46.42 1oyr s LEU 159 CO 0.28 -0.10 0.85 0.00 -1.32 0.00 0.00 176.35 176.05 1oyr s ALA 160 N -0.97 -1.67 0.17 5.97 0.00 -1.09 -4.75 121.76 119.42 1oyr s ALA 160 Ca -0.05 0.49 -0.09 0.00 0.00 0.00 0.00 51.96 52.31 1oyr s ALA 160 Cb -0.07 0.62 -0.01 0.00 0.00 0.00 0.00 23.12 23.65 1oyr s ALA 160 CO 0.00 -0.86 0.29 0.00 0.00 0.00 0.00 175.76 175.20 1oyr s ALA 161 N -3.36 -0.00 -0.18 0.00 0.00 -1.26 -2.07 121.76 114.88 1oyr s ALA 161 Ca 0.07 -0.88 -0.28 0.00 0.00 0.00 0.00 51.96 50.87 1oyr s ALA 161 Cb -0.02 0.87 0.10 0.00 0.00 0.00 0.00 23.12 24.08 1oyr s ALA 161 CO -0.04 -0.65 0.89 -1.50 0.00 0.00 0.00 175.76 174.45 1oyr s ILE 162 N -3.97 0.00 0.39 0.00 1.10 -0.56 -4.70 121.20 113.47 1oyr s ILE 162 Ca 0.17 0.00 -0.04 0.00 -0.51 0.00 0.00 60.65 60.27 1oyr s ILE 162 Cb 0.03 -1.00 -0.04 0.00 0.15 0.00 0.00 42.46 41.60 1oyr s ILE 162 CO 0.00 0.00 0.66 -0.94 -2.11 0.00 0.00 174.94 172.56 1oyr s SER 163 N -0.57 6.35 0.05 4.50 1.04 -1.26 -1.78 113.70 122.03 1oyr s SER 163 Ca -0.03 0.78 -0.21 0.00 0.48 0.00 0.00 55.95 56.97 1oyr s SER 163 Cb -0.02 -2.17 0.05 0.00 0.10 0.00 0.00 66.02 63.97 1oyr s SER 163 CO 0.02 -0.39 0.48 0.54 0.98 0.00 0.00 173.24 174.87 1oyr s VAL 164 N -2.42 0.04 0.16 5.02 0.11 -0.55 -1.27 120.40 121.47 1oyr s VAL 164 Ca 0.45 -0.33 -0.15 0.00 -2.93 0.00 0.00 61.98 59.02 1oyr s VAL 164 Cb -0.10 -0.98 0.05 0.00 -1.53 0.00 0.00 36.38 33.83 1oyr s VAL 164 CO 0.37 -0.18 0.72 0.61 -3.33 0.00 0.00 175.10 173.30 1oyr n GLY 165 N 0.40 0.86 3.15 6.54 0.00 -0.67 -1.81 105.19 113.65 1oyr n GLY 165 Ca -0.18 -1.10 -0.31 0.00 0.00 0.00 0.00 46.02 44.42 1oyr n GLY 165 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oyr s ILE 166 N -2.22 1.88 -0.25 -0.61 1.01 -0.84 -0.81 121.20 119.36 1oyr s ILE 166 Ca 0.16 -0.88 -0.08 0.00 0.00 0.00 0.00 60.65 59.84 1oyr s ILE 166 Cb -0.02 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 1oyr s ILE 166 CO 0.05 0.52 0.10 -0.62 0.00 0.00 0.00 174.94 174.99 1oyr s ASP 167 N 0.73 5.47 0.15 3.58 2.15 -0.50 -0.61 116.67 127.64 1oyr s ASP 167 Ca -0.10 -0.11 0.04 0.00 0.43 0.00 0.00 52.55 52.81 1oyr s ASP 167 Cb -0.16 -1.99 0.45 0.00 -0.30 0.00 0.00 42.92 40.93 1oyr s ASP 167 CO 0.01 -0.01 0.72 1.17 -0.17 0.00 0.00 175.17 176.89 1oyr n LYS 168 N 4.76 -0.03 -3.06 4.34 3.00 -1.26 -1.21 118.16 124.69 1oyr n LYS 168 Ca -0.16 0.66 -0.24 0.00 -0.00 0.00 0.00 58.31 58.57 1oyr n LYS 168 Cb 0.52 -1.10 -0.04 0.00 0.00 0.00 0.00 35.03 34.40 1oyr n LYS 168 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1oyr n GLU 169 N -4.32 2.40 0.00 1.64 1.02 -1.26 -4.67 120.64 115.46 1oyr n GLU 169 Ca 0.13 -4.34 0.00 0.00 -0.02 0.00 0.00 57.16 52.93 1oyr n GLU 169 Cb 0.44 -2.04 0.00 0.00 -0.02 0.00 0.00 31.44 29.82 1oyr n GLU 169 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1oyr n GLN 170 N 0.07 0.00 0.00 3.49 7.27 -0.37 -5.16 117.38 122.68 1oyr n GLN 170 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.36 1oyr n GLN 170 Cb 0.48 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.13 1oyr n GLN 170 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1oyr n GLY 171 N 0.00 0.20 3.71 1.69 0.00 -0.35 -4.84 105.19 105.61 1oyr n GLY 171 Ca 0.00 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1oyr n GLY 171 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1oyr n ILE 172 N 0.00 1.43 -3.99 -0.61 5.41 -1.26 -1.41 119.36 118.93 1oyr n ILE 172 Ca 0.00 -0.36 -0.17 0.00 1.00 0.00 0.00 62.75 63.23 1oyr n ILE 172 Cb 0.00 -1.71 -0.16 0.00 -0.71 0.00 0.00 39.64 37.06 1oyr n ILE 172 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1oyr s LEU 173 N -0.70 1.40 -0.18 1.39 1.43 0.01 -4.83 118.68 117.20 1oyr s LEU 173 Ca 0.61 -0.05 -0.09 0.00 -1.03 0.00 0.00 54.13 53.57 1oyr s LEU 173 Cb -0.56 -0.24 -0.05 0.00 0.03 0.00 0.00 46.19 45.38 1oyr s LEU 173 CO 0.55 -0.06 0.14 -0.22 0.23 0.00 0.00 176.35 176.99 1oyr s LEU 174 N 0.73 4.26 -0.71 1.79 2.96 0.21 -1.67 118.68 126.24 1oyr s LEU 174 Ca -0.08 0.30 -0.01 0.00 -0.22 0.00 0.00 54.13 54.12 1oyr s LEU 174 Cb -0.11 -2.09 0.00 0.00 0.50 0.00 0.00 46.19 44.49 1oyr s LEU 174 CO -0.01 0.24 0.69 -0.67 -1.32 0.00 0.00 176.35 175.28 1oyr n ASP 175 N 3.10 -7.79 -4.71 3.68 4.64 -0.40 -4.64 116.55 110.42 1oyr n ASP 175 Ca -0.17 -0.03 -0.30 0.00 -1.38 0.00 0.00 54.79 52.91 1oyr n ASP 175 Cb 0.53 -5.29 0.14 0.00 -1.04 0.00 0.00 41.12 35.45 1oyr n ASP 175 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 1oyr s LEU 176 N -3.89 2.45 0.00 -2.67 1.43 -1.26 -4.80 118.68 109.94 1oyr s LEU 176 Ca 0.02 1.67 0.00 0.00 -1.03 0.00 0.00 54.13 54.80 1oyr s LEU 176 Cb -0.01 -4.13 0.00 0.00 0.03 0.00 0.00 46.19 42.08 1oyr s LEU 176 CO 0.75 -2.63 0.02 -0.46 0.23 0.00 0.00 176.35 174.25 1oyr n ASN 177 N -3.90 2.89 -0.24 2.29 0.23 -1.26 -4.21 115.26 111.06 1oyr n ASN 177 Ca 0.08 -2.46 0.01 0.00 -0.53 0.00 0.00 54.58 51.68 1oyr n ASN 177 Cb 0.54 0.22 0.13 0.00 -2.08 0.00 0.00 39.78 38.59 1oyr n ASN 177 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 1oyr h TYR 178 N 1.14 0.59 -0.13 -2.53 3.20 -1.66 0.33 116.97 117.92 1oyr h TYR 178 Ca -0.28 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.61 1oyr h TYR 178 Cb 0.84 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1oyr h TYR 178 CO 0.00 0.20 0.03 1.49 -1.64 0.00 0.00 178.16 178.24 1oyr h GLU 179 N 0.56 0.20 0.17 1.82 4.81 -1.96 -1.12 114.58 119.07 1oyr h GLU 179 Ca 0.35 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 1oyr h GLU 179 Cb 0.38 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1oyr h GLU 179 CO -0.28 0.36 -0.08 0.93 -0.73 0.00 0.00 179.01 179.21 1oyr h GLU 180 N 0.01 -0.23 -0.26 1.92 5.08 -1.82 -2.70 114.58 116.57 1oyr h GLU 180 Ca 0.04 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.49 1oyr h GLU 180 Cb 0.25 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1oyr h GLU 180 CO 0.00 0.05 0.24 0.22 -1.00 0.00 0.00 179.01 178.52 1oyr h ASP 181 N -0.50 0.00 0.21 1.42 -0.00 -0.37 -0.14 116.42 117.04 1oyr h ASP 181 Ca -0.02 0.00 -0.18 0.00 -0.00 0.00 0.00 57.03 56.82 1oyr h ASP 181 Cb 0.38 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.71 1oyr h ASP 181 CO 0.04 0.00 -0.72 -1.28 -0.00 0.00 0.00 179.24 177.28 1oyr h SER 182 N 0.00 0.52 -0.02 2.28 0.87 -0.89 -3.32 113.55 112.99 1oyr h SER 182 Ca 0.13 -0.34 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1oyr h SER 182 Cb 0.60 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.41 1oyr h SER 182 CO -0.00 1.08 -0.03 -1.54 -0.53 0.00 0.00 176.83 175.80 1oyr n SER 183 N -3.85 2.12 -4.77 6.23 3.41 -0.66 -5.01 113.62 111.10 1oyr n SER 183 Ca -0.04 -1.56 -0.35 0.00 -0.26 0.00 0.00 58.87 56.66 1oyr n SER 183 Cb 0.70 0.06 0.03 0.00 -0.26 0.00 0.00 64.21 64.73 1oyr n SER 183 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oyr s ALA 184 N -1.26 2.57 -0.02 7.33 0.00 -0.15 -4.69 121.76 125.53 1oyr s ALA 184 Ca 0.16 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.92 1oyr s ALA 184 Cb 0.12 -3.37 -0.25 0.00 0.00 0.00 0.00 23.12 19.62 1oyr s ALA 184 CO 0.20 -1.05 0.75 0.93 0.00 0.00 0.00 175.76 176.59 1oyr h GLU 185 N 0.71 0.14 -4.16 0.00 5.08 -1.21 -3.44 114.58 111.70 1oyr h GLU 185 Ca -0.49 -0.25 -0.60 0.00 -1.00 0.00 0.00 59.36 57.02 1oyr h GLU 185 Cb 1.27 0.09 -0.39 0.00 0.50 0.00 0.00 28.75 30.22 1oyr h GLU 185 CO 0.55 0.91 -0.77 0.08 -1.00 0.00 0.00 179.01 178.79 1oyr s VAL 186 N -2.61 1.41 0.43 3.13 1.01 -1.22 -2.28 120.40 120.27 1oyr s VAL 186 Ca -0.09 -1.36 -0.12 0.00 0.00 0.00 0.00 61.98 60.41 1oyr s VAL 186 Cb 0.07 -1.82 -0.07 0.00 0.00 0.00 0.00 36.38 34.56 1oyr s VAL 186 CO 0.83 -0.30 0.82 -0.62 0.00 0.00 0.00 175.10 175.83 1oyr s ASP 187 N 1.41 6.56 -0.30 3.32 -1.08 -0.83 -1.99 116.67 123.76 1oyr s ASP 187 Ca 0.00 1.25 -0.13 0.00 -0.52 0.00 0.00 52.55 53.15 1oyr s ASP 187 Cb -0.18 -2.37 0.18 0.00 -1.46 0.00 0.00 42.92 39.08 1oyr s ASP 187 CO -0.10 -0.44 1.04 -0.32 0.52 0.00 0.00 175.17 175.86 1oyr s MET 188 N -3.87 0.20 -0.01 4.34 1.75 -0.75 -2.05 119.30 118.91 1oyr s MET 188 Ca 0.53 0.37 -0.19 0.00 -1.25 0.00 0.00 55.69 55.16 1oyr s MET 188 Cb -0.10 0.21 -0.05 0.00 2.84 0.00 0.00 34.83 37.72 1oyr s MET 188 CO 0.31 -0.21 0.53 -0.80 -0.65 0.00 0.00 175.02 174.19 1oyr s ASN 189 N 2.91 6.89 -0.05 1.11 0.01 0.00 -1.49 114.94 124.32 1oyr s ASN 189 Ca -0.00 1.06 0.02 0.00 -0.71 0.00 0.00 52.86 53.23 1oyr s ASN 189 Cb -0.10 -2.32 0.01 0.00 0.41 0.00 0.00 41.25 39.25 1oyr s ASN 189 CO -0.12 0.16 -0.10 -0.69 -1.51 0.00 0.00 177.10 174.84 1oyr s VAL 190 N -0.36 0.91 -0.15 1.60 1.01 -0.73 -1.81 120.40 120.85 1oyr s VAL 190 Ca 0.28 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1oyr s VAL 190 Cb -0.17 -0.85 0.03 0.00 0.00 0.00 0.00 36.38 35.39 1oyr s VAL 190 CO 0.15 0.30 -0.11 -0.63 0.00 0.00 0.00 175.10 174.81 1oyr s ILE 191 N 0.65 1.44 0.41 2.22 1.01 -0.82 -1.49 121.20 124.61 1oyr s ILE 191 Ca -0.12 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 59.92 1oyr s ILE 191 Cb -0.14 -1.43 -0.02 0.00 0.01 0.00 0.00 42.46 40.87 1oyr s ILE 191 CO 0.02 0.34 0.12 -0.04 0.00 0.00 0.00 174.94 175.38 1oyr s MET 192 N 1.52 1.94 0.46 2.79 -1.94 -0.88 -0.74 119.30 122.45 1oyr s MET 192 Ca 0.03 -2.18 0.07 0.00 -1.71 0.00 0.00 55.69 51.90 1oyr s MET 192 Cb -0.14 -0.69 -0.01 0.00 2.01 0.00 0.00 34.83 36.01 1oyr s MET 192 CO -0.09 -0.46 0.33 0.95 -0.01 0.00 0.00 175.02 175.74 1oyr s THR 193 N -3.19 2.17 0.32 2.05 -4.23 -0.51 -2.67 115.64 109.59 1oyr s THR 193 Ca 0.23 -1.50 0.02 0.00 -1.18 0.00 0.00 61.69 59.26 1oyr s THR 193 Cb 0.03 -2.68 0.18 0.00 1.34 0.00 0.00 72.50 71.37 1oyr s THR 193 CO 0.14 0.00 1.89 1.23 -0.54 0.00 0.00 174.62 177.34 1oyr h GLY 194 N 1.04 0.76 -0.58 3.99 0.00 -1.77 -1.60 103.07 104.91 1oyr h GLY 194 Ca -0.40 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.53 1oyr h GLY 194 CO 0.61 0.37 0.00 -1.14 0.00 0.00 0.00 176.54 176.38 1oyr n SER 195 N -4.32 0.37 -2.30 0.19 3.41 -1.26 -4.84 113.62 104.88 1oyr n SER 195 Ca 0.03 -1.29 -0.20 0.00 -0.26 0.00 0.00 58.87 57.15 1oyr n SER 195 Cb 0.18 -0.19 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 1oyr n SER 195 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oyr n GLY 196 N 0.16 -0.46 3.71 5.00 0.00 -0.60 -5.01 105.19 107.99 1oyr n GLY 196 Ca 0.00 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 1oyr n GLY 196 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oyr s ARG 197 N -5.01 2.48 0.03 1.61 0.52 -1.26 -4.90 118.95 112.42 1oyr s ARG 197 Ca 0.00 -1.33 -0.18 0.00 -0.52 0.00 0.00 55.73 53.70 1oyr s ARG 197 Cb -0.00 -2.28 -0.06 0.00 0.52 0.00 0.00 34.95 33.13 1oyr s ARG 197 CO 0.01 0.34 0.52 -0.06 0.02 0.00 0.00 175.30 176.12 1oyr s PHE 198 N -2.28 3.74 -0.19 -0.53 0.40 -1.26 -1.42 117.98 116.44 1oyr s PHE 198 Ca 0.33 1.15 0.03 0.00 -0.60 0.00 0.00 56.93 57.83 1oyr s PHE 198 Cb -0.06 -2.45 -0.13 0.00 0.51 0.00 0.00 43.02 40.88 1oyr s PHE 198 CO 0.22 0.54 -0.14 0.28 0.70 0.00 0.00 175.22 176.81 1oyr n VAL 199 N 2.04 1.09 -3.58 -0.44 0.31 0.08 -4.94 118.33 112.88 1oyr n VAL 199 Ca -0.11 -0.44 -0.16 0.00 -0.01 0.00 0.00 64.34 63.62 1oyr n VAL 199 Cb 0.51 -1.11 -0.07 0.00 -0.91 0.00 0.00 33.84 32.27 1oyr n VAL 199 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1oyr s GLU 200 N -2.38 0.93 -0.07 5.55 2.12 -1.09 -5.02 118.70 118.73 1oyr s GLU 200 Ca -0.24 0.69 -0.00 0.00 0.36 0.00 0.00 54.97 55.79 1oyr s GLU 200 Cb 0.06 0.45 0.02 0.00 0.26 0.00 0.00 34.13 34.93 1oyr s GLU 200 CO 0.46 -0.19 -0.04 -1.17 -0.54 0.00 0.00 175.26 173.78 1oyr s LEU 201 N -0.27 0.99 -0.25 2.70 2.96 -1.26 -1.95 118.68 121.61 1oyr s LEU 201 Ca -0.05 -0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 53.68 1oyr s LEU 201 Cb -0.03 -0.56 0.08 0.00 0.50 0.00 0.00 46.19 46.18 1oyr s LEU 201 CO 0.05 -0.12 0.06 -1.58 -1.32 0.00 0.00 176.35 173.43 1oyr s GLN 202 N 1.55 0.68 -0.05 1.98 0.74 -0.75 -5.04 119.66 118.78 1oyr s GLN 202 Ca -0.00 -0.69 0.05 0.00 0.05 0.00 0.00 55.36 54.76 1oyr s GLN 202 Cb -0.13 -2.01 -0.00 0.00 1.10 0.00 0.00 33.01 31.97 1oyr s GLN 202 CO -0.04 -0.80 -0.18 0.20 -0.55 0.00 0.00 175.29 173.92 1oyr s GLY 203 N 1.77 0.98 -0.03 2.59 0.00 -1.26 -0.82 107.32 110.55 1oyr s GLY 203 Ca 0.03 -0.74 -0.01 0.00 0.00 0.00 0.00 44.72 44.00 1oyr s GLY 203 CO -0.17 -0.39 0.05 -1.08 0.00 0.00 0.00 173.10 171.52 1oyr s THR 204 N 0.02 -0.08 -0.70 0.90 -1.32 -0.87 -5.01 115.64 108.58 1oyr s THR 204 Ca -0.04 0.27 -0.16 0.00 -1.21 0.00 0.00 61.69 60.55 1oyr s THR 204 Cb -0.12 -0.12 0.16 0.00 -1.51 0.00 0.00 72.50 70.90 1oyr s THR 204 CO 0.02 0.11 0.71 -0.83 -2.21 0.00 0.00 174.62 172.43 1oyr s GLY 205 N 1.41 2.20 -0.02 6.08 0.00 -1.26 -1.96 107.32 113.77 1oyr s GLY 205 Ca -0.05 -2.77 -0.20 0.00 0.00 0.00 0.00 44.72 41.70 1oyr s GLY 205 CO -0.03 1.40 0.82 -2.09 0.00 0.00 0.00 173.10 173.20 1oyr h GLU 206 N 8.56 -0.69 0.00 2.90 4.81 -1.80 -3.40 114.58 124.96 1oyr h GLU 206 Ca -0.11 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1oyr h GLU 206 Cb 1.07 0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1oyr h GLU 206 CO 0.96 -0.46 0.00 0.39 -0.73 0.00 0.00 179.01 179.17 1oyr n GLU 207 N -5.25 0.00 0.00 1.92 -0.58 -1.20 -4.95 120.64 110.58 1oyr n GLU 207 Ca -0.09 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 1oyr n GLU 207 Cb 0.28 -0.94 0.00 0.00 -0.57 0.00 0.00 31.44 30.21 1oyr n GLU 207 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1oyr n ALA 208 N -0.69 0.00 -2.49 0.62 0.00 -1.26 -5.13 120.51 111.55 1oyr n ALA 208 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1oyr n ALA 208 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1oyr n ALA 208 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1oyr s THR 209 N 3.28 0.16 0.35 0.00 -4.23 -1.26 -4.56 115.64 109.37 1oyr s THR 209 Ca 0.00 -1.30 0.08 0.00 -1.18 0.00 0.00 61.69 59.29 1oyr s THR 209 Cb 0.00 -1.26 -0.04 0.00 1.34 0.00 0.00 72.50 72.54 1oyr s THR 209 CO 0.00 -0.72 0.12 0.72 -0.54 0.00 0.00 174.62 174.20 1oyr s PHE 210 N -3.52 2.67 0.44 3.99 -0.71 -1.26 -5.07 117.98 114.52 1oyr s PHE 210 Ca 0.03 -0.41 0.07 0.00 -1.04 0.00 0.00 56.93 55.58 1oyr s PHE 210 Cb 0.04 -1.64 -0.03 0.00 -1.21 0.00 0.00 43.02 40.18 1oyr s PHE 210 CO -0.09 0.35 0.27 -1.54 -1.34 0.00 0.00 175.22 172.87 1oyr s SER 211 N -3.83 4.64 0.51 1.98 1.04 -1.26 -4.95 113.70 111.83 1oyr s SER 211 Ca 0.37 -1.01 0.20 0.00 0.48 0.00 0.00 55.95 55.99 1oyr s SER 211 Cb -0.02 -0.35 1.27 0.00 0.10 0.00 0.00 66.02 67.03 1oyr s SER 211 CO 0.22 -0.67 2.04 0.03 0.98 0.00 0.00 173.24 175.84 1oyr h ARG 212 N 1.20 0.09 0.03 4.02 2.47 -2.01 0.12 114.38 120.30 1oyr h ARG 212 Ca -0.41 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.30 1oyr h ARG 212 Cb 1.27 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.57 1oyr h ARG 212 CO 0.64 0.06 -0.01 1.49 0.56 0.00 0.00 179.97 182.71 1oyr h GLU 213 N 0.09 -0.04 0.01 0.04 4.81 -1.99 -2.27 114.58 115.23 1oyr h GLU 213 Ca 0.17 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.44 1oyr h GLU 213 Cb 0.57 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.91 1oyr h GLU 213 CO -0.02 0.48 -0.32 -0.44 -0.73 0.00 0.00 179.01 177.98 1oyr h ASP 214 N -0.57 -0.96 -0.45 1.04 3.45 -1.71 -2.05 116.42 115.17 1oyr h ASP 214 Ca -0.00 0.12 0.07 0.00 0.43 0.00 0.00 57.03 57.65 1oyr h ASP 214 Cb 0.53 0.38 -0.09 0.00 -0.56 0.00 0.00 39.33 39.59 1oyr h ASP 214 CO 0.01 -0.38 -0.47 0.25 -1.57 0.00 0.00 179.24 177.07 1oyr h LEU 215 N -0.48 -1.59 -2.39 1.55 5.85 -1.03 0.49 115.31 117.72 1oyr h LEU 215 Ca 0.06 0.23 0.03 0.00 0.84 0.00 0.00 57.88 59.04 1oyr h LEU 215 Cb 0.56 0.68 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 1oyr h LEU 215 CO -0.26 -0.37 0.14 0.78 -0.34 0.00 0.00 178.44 178.39 1oyr h ASN 216 N -0.33 0.00 0.27 1.25 2.35 -1.15 0.43 115.58 118.42 1oyr h ASN 216 Ca 0.13 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1oyr h ASN 216 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.96 1oyr h ASN 216 CO -0.61 0.00 -0.13 1.23 -1.65 0.00 0.00 177.43 176.27 1oyr h GLY 217 N 0.00 -0.38 0.55 2.83 0.00 0.65 -2.62 103.07 104.10 1oyr h GLY 217 Ca 0.04 0.14 0.03 0.00 0.00 0.00 0.00 47.33 47.55 1oyr h GLY 217 CO -0.00 -0.14 -0.15 1.41 0.00 0.00 0.00 176.54 177.66 1oyr h LEU 218 N -0.94 -0.45 -0.86 3.11 3.38 -0.22 -1.54 115.31 117.79 1oyr h LEU 218 Ca -0.04 0.08 0.14 0.00 0.09 0.00 0.00 57.88 58.15 1oyr h LEU 218 Cb 0.49 0.20 -0.09 0.00 0.09 0.00 0.00 40.66 41.35 1oyr h LEU 218 CO 0.06 -0.20 0.45 -0.07 0.09 0.00 0.00 178.44 178.77 1oyr h LEU 219 N -0.22 0.56 -0.79 1.67 3.38 -1.05 0.21 115.31 119.07 1oyr h LEU 219 Ca 0.07 0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 1oyr h LEU 219 Cb 0.32 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1oyr h LEU 219 CO -0.19 0.24 -0.05 1.23 0.09 0.00 0.00 178.44 179.76 1oyr h GLY 220 N 0.65 0.94 0.63 0.83 0.00 -1.02 -0.81 103.07 104.28 1oyr h GLY 220 Ca 0.47 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 1oyr h GLY 220 CO -0.35 0.63 -0.07 -2.00 0.00 0.00 0.00 176.54 174.74 1oyr h LEU 221 N 0.79 0.19 -0.10 3.11 5.85 -0.13 -2.78 115.31 122.25 1oyr h LEU 221 Ca 0.14 -0.49 0.04 0.00 0.84 0.00 0.00 57.88 58.41 1oyr h LEU 221 Cb 0.54 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1oyr h LEU 221 CO 0.03 0.64 -0.14 0.00 -0.34 0.00 0.00 178.44 178.63 1oyr h ALA 222 N 0.56 -0.08 -0.83 1.25 0.00 -0.59 -1.53 119.26 118.04 1oyr h ALA 222 Ca 0.01 0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.13 1oyr h ALA 222 Cb 0.58 0.27 -0.11 0.00 0.00 0.00 0.00 17.79 18.54 1oyr h ALA 222 CO 0.02 -0.60 0.36 1.49 0.00 0.00 0.00 179.25 180.52 1oyr h GLU 223 N -0.18 0.46 -0.09 0.00 4.81 -1.17 0.96 114.58 119.37 1oyr h GLU 223 Ca 0.08 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1oyr h GLU 223 Cb 0.30 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1oyr h GLU 223 CO -0.20 0.30 0.06 -0.22 -0.73 0.00 0.00 179.01 178.22 1oyr h LYS 224 N 0.47 0.12 -0.38 1.92 3.11 -1.02 -2.21 116.57 118.59 1oyr h LYS 224 Ca 0.48 -0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 58.29 1oyr h LYS 224 Cb 0.78 -0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.97 1oyr h LYS 224 CO -0.44 0.11 0.19 0.78 -2.81 0.00 0.00 179.45 177.28 1oyr h GLY 225 N 0.10 0.59 0.90 5.01 0.00 -0.29 -2.68 103.07 106.70 1oyr h GLY 225 Ca 0.03 -0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.11 1oyr h GLY 225 CO -0.01 0.27 0.64 -2.22 0.00 0.00 0.00 176.54 175.23 1oyr h ILE 226 N 0.48 1.18 -0.83 2.60 2.04 -0.75 0.04 117.51 122.28 1oyr h ILE 226 Ca 0.13 -0.43 -0.04 0.00 1.00 0.00 0.00 64.86 65.53 1oyr h ILE 226 Cb 0.11 -0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 35.97 1oyr h ILE 226 CO -0.02 0.23 0.37 1.56 0.00 0.00 0.00 178.15 180.29 1oyr h GLN 227 N 1.25 1.21 -0.85 2.37 1.08 -1.28 0.98 115.11 119.86 1oyr h GLN 227 Ca 0.39 -0.19 -0.01 0.00 -1.45 0.00 0.00 58.65 57.38 1oyr h GLN 227 Cb -0.02 -0.21 -0.04 0.00 -0.05 0.00 0.00 27.48 27.16 1oyr h GLN 227 CO -0.12 0.95 0.50 1.49 -0.95 0.00 0.00 178.83 180.70 1oyr h GLU 228 N 1.19 1.17 -0.21 1.46 4.81 -0.89 -2.40 114.58 119.71 1oyr h GLU 228 Ca 0.28 -0.11 -0.05 0.00 -0.13 0.00 0.00 59.36 59.34 1oyr h GLU 228 Cb 0.16 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1oyr h GLU 228 CO -0.03 0.83 -0.08 -0.07 -0.73 0.00 0.00 179.01 178.93 1oyr h LEU 229 N 1.18 0.43 -2.25 1.64 3.38 0.15 -3.04 115.31 116.80 1oyr h LEU 229 Ca 0.30 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1oyr h LEU 229 Cb -0.02 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1oyr h LEU 229 CO -0.05 0.73 -0.05 0.40 0.09 0.00 0.00 178.44 179.56 1oyr h ILE 230 N 0.13 0.57 0.63 1.22 2.04 -0.52 -1.18 117.51 120.41 1oyr h ILE 230 Ca 0.05 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 1oyr h ILE 230 Cb 0.56 1.12 0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1oyr h ILE 230 CO 0.03 0.05 -0.30 0.44 0.00 0.00 0.00 178.15 178.36 1oyr h ASP 231 N 0.00 -0.71 -1.10 1.72 3.32 -1.33 0.27 116.42 118.58 1oyr h ASP 231 Ca -0.00 0.02 0.31 0.00 0.02 0.00 0.00 57.03 57.38 1oyr h ASP 231 Cb 0.12 0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.79 1oyr h ASP 231 CO 0.01 -0.35 0.76 0.11 -1.72 0.00 0.00 179.24 178.05 1oyr h LYS 232 N -1.17 0.13 -0.42 3.56 1.57 -1.43 0.75 116.57 119.57 1oyr h LYS 232 Ca -0.09 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.56 1oyr h LYS 232 Cb 0.65 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1oyr h LYS 232 CO 0.14 0.09 -0.24 0.37 -0.57 0.00 0.00 179.45 179.24 1oyr h GLN 233 N 0.14 0.90 -0.06 3.15 4.15 -0.89 -2.89 115.11 119.61 1oyr h GLN 233 Ca 0.56 -0.41 -0.01 0.00 0.77 0.00 0.00 58.65 59.56 1oyr h GLN 233 Cb 1.94 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 29.61 1oyr h GLN 233 CO -0.11 1.06 -0.00 0.87 -1.93 0.00 0.00 178.83 178.72 1oyr h LYS 234 N 0.72 0.11 0.55 1.69 1.57 0.27 -1.95 116.57 119.52 1oyr h LYS 234 Ca 0.09 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1oyr h LYS 234 Cb 0.81 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.12 1oyr h LYS 234 CO 0.07 0.39 -0.26 1.05 -0.57 0.00 0.00 179.45 180.13 1oyr h GLU 235 N -0.19 -0.71 -0.06 3.15 4.11 -1.49 0.30 114.58 119.69 1oyr h GLU 235 Ca 0.02 0.05 0.04 0.00 0.07 0.00 0.00 59.36 59.53 1oyr h GLU 235 Cb 0.35 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.70 1oyr h GLU 235 CO 0.00 -0.45 -0.42 0.28 0.07 0.00 0.00 179.01 178.50 1oyr h VAL 236 N -0.78 0.15 -0.60 -1.06 2.07 -1.59 -0.86 116.25 113.59 1oyr h VAL 236 Ca -0.07 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.53 1oyr h VAL 236 Cb 0.58 0.15 -0.07 0.00 -1.52 0.00 0.00 31.29 30.44 1oyr h VAL 236 CO 0.12 0.00 0.24 0.25 0.02 0.00 0.00 177.57 178.20 1oyr h LEU 237 N -0.53 0.27 0.00 2.57 5.85 -1.36 -3.43 115.31 118.68 1oyr h LEU 237 Ca 0.06 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1oyr h LEU 237 Cb 0.64 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1oyr h LEU 237 CO -0.35 0.16 0.00 0.61 -0.34 0.00 0.00 178.44 178.52 1oyr n GLY 238 N -1.29 0.49 0.11 3.75 0.00 0.09 -1.87 105.19 106.48 1oyr n GLY 238 Ca 0.08 0.40 -0.13 0.00 0.00 0.00 0.00 46.02 46.37 1oyr n GLY 238 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oyr n ASP 239 N 2.35 0.99 -0.01 1.61 10.43 -1.26 -4.45 116.55 126.21 1oyr n ASP 239 Ca 0.00 0.15 0.15 0.00 2.57 0.00 0.00 54.79 57.66 1oyr n ASP 239 Cb 0.00 0.10 0.24 0.00 1.84 0.00 0.00 41.12 43.29 1oyr n ASP 239 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1oyr n SER 240 N -3.06 0.00 -3.76 -2.24 7.64 -0.78 -4.07 113.62 107.35 1oyr n SER 240 Ca -0.30 0.59 -0.13 0.00 1.01 0.00 0.00 58.87 60.04 1oyr n SER 240 Cb 1.08 -0.14 -0.14 0.00 -1.01 0.00 0.00 64.21 64.00 1oyr n SER 240 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1oyr s LEU 241 N -5.49 0.77 0.00 -3.43 2.96 -1.26 -4.07 118.68 108.16 1oyr s LEU 241 Ca -0.01 0.35 0.09 0.00 -0.22 0.00 0.00 54.13 54.34 1oyr s LEU 241 Cb 0.08 0.47 0.54 0.00 0.50 0.00 0.00 46.19 47.78 1oyr s LEU 241 CO 0.26 -0.14 0.98 -0.81 -1.32 0.00 0.00 176.35 175.33