#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tya h ASP 2 N 0.00 0.53 0.19 0.00 3.58 -1.97 -2.17 116.42 116.57 1tya h ASP 2 Ca 0.00 -0.70 0.01 0.00 0.42 0.00 0.00 57.03 56.75 1tya h ASP 2 Cb 0.00 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.86 1tya h ASP 2 CO 0.00 1.58 -0.23 0.25 -2.88 0.00 0.00 179.24 177.96 1tya h LEU 3 N 0.09 -0.63 -1.26 2.28 5.85 -1.99 0.28 115.31 119.93 1tya h LEU 3 Ca -0.27 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 1tya h LEU 3 Cb 2.06 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 43.29 1tya h LEU 3 CO 0.19 -0.33 0.35 0.25 -0.34 0.00 0.00 178.44 178.56 1tya h LEU 4 N -0.47 0.76 -0.82 2.25 5.85 -1.99 -0.43 115.31 120.47 1tya h LEU 4 Ca 0.01 -0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.57 1tya h LEU 4 Cb 0.46 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1tya h LEU 4 CO -0.08 0.61 -0.52 0.00 -0.34 0.00 0.00 178.44 178.10 1tya h ALA 5 N 1.52 0.98 -0.01 1.25 0.00 -0.78 -1.85 119.26 120.36 1tya h ALA 5 Ca 0.22 -0.48 -0.23 0.00 0.00 0.00 0.00 54.91 54.43 1tya h ALA 5 Cb 0.01 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.73 1tya h ALA 5 CO -0.04 0.65 -0.89 1.49 0.00 0.00 0.00 179.25 180.47 1tya h GLU 6 N 0.00 0.63 -0.26 0.00 4.81 0.17 -1.29 114.58 118.64 1tya h GLU 6 Ca -0.01 -0.65 0.02 0.00 -0.13 0.00 0.00 59.36 58.59 1tya h GLU 6 Cb 1.02 0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 1tya h GLU 6 CO 0.07 1.26 0.13 -0.07 -0.73 0.00 0.00 179.01 179.66 1tya h LEU 7 N 0.26 0.20 0.14 1.64 3.38 -0.90 -0.66 115.31 119.37 1tya h LEU 7 Ca -0.11 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.89 1tya h LEU 7 Cb 1.56 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 42.24 1tya h LEU 7 CO 0.18 0.15 -0.32 -0.61 0.09 0.00 0.00 178.44 177.93 1tya h GLN 8 N 0.28 -0.54 -0.82 1.13 5.75 -1.36 -0.24 115.11 119.31 1tya h GLN 8 Ca 0.11 0.04 0.16 0.00 -0.15 0.00 0.00 58.65 58.81 1tya h GLN 8 Cb 0.03 0.12 -0.10 0.00 1.07 0.00 0.00 27.48 28.60 1tya h GLN 8 CO -0.07 -0.36 0.37 2.35 -2.65 0.00 0.00 178.83 178.47 1tya h TRP 9 N -0.56 0.62 0.00 3.99 7.01 -0.61 -0.37 115.95 126.03 1tya h TRP 9 Ca 0.02 0.04 -0.07 0.00 2.11 0.00 0.00 58.89 60.99 1tya h TRP 9 Cb 0.58 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.48 1tya h TRP 9 CO -0.27 0.07 -0.33 0.00 -2.79 0.00 0.00 178.44 175.11 1tya h ARG 10 N 0.49 0.00 -0.24 2.65 3.08 -0.60 -3.48 114.38 116.28 1tya h ARG 10 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.52 1tya h ARG 10 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1tya h ARG 10 CO -0.43 0.33 0.00 0.41 -1.07 0.00 0.00 179.97 179.21 1tya n GLY 11 N -0.23 1.06 1.01 0.04 0.00 -0.15 -4.41 105.19 102.51 1tya n GLY 11 Ca -0.01 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.70 1tya n GLY 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tya n LEU 12 N -0.12 3.10 -4.19 0.99 4.77 -0.52 -4.61 117.00 116.42 1tya n LEU 12 Ca 0.00 -1.16 -0.37 0.00 -0.03 0.00 0.00 56.01 54.46 1tya n LEU 12 Cb 0.27 -0.09 -0.12 0.00 -2.33 0.00 0.00 43.42 41.15 1tya n LEU 12 CO 0.00 0.58 -0.23 -0.69 -1.33 0.00 0.00 177.39 175.72 1tya s VAL 13 N -1.82 3.47 -0.18 4.08 1.01 -1.26 -3.99 120.40 121.71 1tya s VAL 13 Ca 0.32 -1.58 -0.17 0.00 0.00 0.00 0.00 61.98 60.56 1tya s VAL 13 Cb 0.21 -3.15 -0.14 0.00 0.00 0.00 0.00 36.38 33.31 1tya s VAL 13 CO 0.31 -0.40 0.11 -1.13 0.00 0.00 0.00 175.10 173.99 1tya h ASN 14 N 8.13 0.00 -5.15 3.32 -1.24 -1.12 -3.46 115.58 116.06 1tya h ASN 14 Ca -0.19 -0.35 -0.10 0.00 0.71 0.00 0.00 56.30 56.37 1tya h ASN 14 Cb 1.06 0.00 -0.15 0.00 0.73 0.00 0.00 38.32 39.97 1tya h ASN 14 CO 0.64 1.20 -0.43 -1.10 -1.29 0.00 0.00 177.43 176.46 1tya s GLN 15 N -2.29 0.78 -0.10 6.67 -0.21 -1.22 -5.01 119.66 118.28 1tya s GLN 15 Ca -0.23 -0.95 -0.08 0.00 0.02 0.00 0.00 55.36 54.12 1tya s GLN 15 Cb 0.04 0.31 0.03 0.00 1.00 0.00 0.00 33.01 34.39 1tya s GLN 15 CO 0.46 -0.23 0.27 -0.08 -2.12 0.00 0.00 175.29 173.58 1tya s THR 16 N -3.65 -0.01 0.31 -0.19 -1.32 -1.26 -1.73 115.64 107.79 1tya s THR 16 Ca 0.04 0.03 0.02 0.00 -1.21 0.00 0.00 61.69 60.56 1tya s THR 16 Cb 0.04 -0.38 0.15 0.00 -1.51 0.00 0.00 72.50 70.80 1tya s THR 16 CO -0.10 0.01 1.85 0.71 -2.21 0.00 0.00 174.62 174.88 1tya h THR 17 N 4.97 1.21 -0.67 5.08 1.35 -1.57 -3.41 112.91 119.87 1tya h THR 17 Ca -0.29 -0.81 0.11 0.00 -0.55 0.00 0.00 66.41 64.87 1tya h THR 17 Cb 1.18 0.84 -0.20 0.00 -1.73 0.00 0.00 68.15 68.25 1tya h THR 17 CO 0.35 0.29 -0.22 -0.62 -0.25 0.00 0.00 175.52 175.06 1tya s ASP 18 N -6.67 -1.10 0.13 5.36 2.15 -1.26 -5.01 116.67 110.27 1tya s ASP 18 Ca -0.08 0.11 -0.14 0.00 0.43 0.00 0.00 52.55 52.86 1tya s ASP 18 Cb 0.15 1.68 -0.01 0.00 -0.30 0.00 0.00 42.92 44.45 1tya s ASP 18 CO 0.78 -0.20 1.59 -0.08 -0.17 0.00 0.00 175.17 177.09 1tya h GLU 19 N 7.62 0.73 -0.40 4.34 4.81 -1.97 -1.34 114.58 128.37 1tya h GLU 19 Ca -0.04 -0.22 -0.11 0.00 -0.13 0.00 0.00 59.36 58.86 1tya h GLU 19 Cb 1.18 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 1tya h GLU 19 CO 0.04 0.79 -0.21 -0.44 -0.73 0.00 0.00 179.01 178.45 1tya h ASP 20 N 0.57 0.79 -0.17 1.04 5.19 -1.98 0.73 116.42 122.59 1tya h ASP 20 Ca 0.12 -0.28 -0.02 0.00 -0.62 0.00 0.00 57.03 56.24 1tya h ASP 20 Cb 0.44 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.73 1tya h ASP 20 CO 0.02 0.98 0.04 1.23 -3.12 0.00 0.00 179.24 178.39 1tya h GLY 21 N 0.96 0.29 1.10 2.75 0.00 -1.99 -1.29 103.07 104.89 1tya h GLY 21 Ca 0.10 -0.18 -0.12 0.00 0.00 0.00 0.00 47.33 47.12 1tya h GLY 21 CO 0.06 0.17 -0.16 -2.00 0.00 0.00 0.00 176.54 174.60 1tya h LEU 22 N 0.07 1.02 -0.03 3.11 5.85 -1.12 -2.63 115.31 121.59 1tya h LEU 22 Ca 0.05 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1tya h LEU 22 Cb 0.27 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 1tya h LEU 22 CO 0.00 1.16 0.01 -0.09 -0.34 0.00 0.00 178.44 179.19 1tya h ARG 23 N 0.87 0.03 -0.22 1.25 2.43 -0.79 -0.83 114.38 117.12 1tya h ARG 23 Ca 0.12 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1tya h ARG 23 Cb 0.74 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.21 1tya h ARG 23 CO 0.06 0.02 -0.49 -0.22 -1.51 0.00 0.00 179.97 177.83 1tya h LYS 24 N 0.03 -0.47 -0.58 0.20 3.64 -1.19 -1.96 116.57 116.23 1tya h LYS 24 Ca 0.01 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1tya h LYS 24 Cb 0.00 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1tya h LYS 24 CO -0.01 -0.32 0.38 1.25 -2.27 0.00 0.00 179.45 178.48 1tya h LEU 25 N -0.49 0.65 -0.77 5.20 5.85 -1.36 -1.80 115.31 122.59 1tya h LEU 25 Ca 0.07 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.83 1tya h LEU 25 Cb 0.64 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 1tya h LEU 25 CO -0.47 0.47 0.46 -0.07 -0.34 0.00 0.00 178.44 178.49 1tya h LEU 26 N 0.77 0.72 -0.78 2.25 3.38 -0.87 -0.31 115.31 120.47 1tya h LEU 26 Ca 0.22 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.11 1tya h LEU 26 Cb -0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1tya h LEU 26 CO -0.06 0.47 -0.48 0.78 0.09 0.00 0.00 178.44 179.24 1tya h ASN 27 N 0.85 0.00 0.17 -0.43 -0.26 -1.00 -3.33 115.58 111.58 1tya h ASN 27 Ca 0.34 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 56.06 1tya h ASN 27 Cb 0.16 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.42 1tya h ASN 27 CO -0.17 0.48 -1.85 -0.62 -1.06 0.00 0.00 177.43 174.21 1tya n GLU 28 N -3.58 0.65 -4.08 0.81 1.02 -0.66 -5.05 120.64 109.75 1tya n GLU 28 Ca -0.00 -0.13 -0.10 0.00 -0.02 0.00 0.00 57.16 56.90 1tya n GLU 28 Cb 0.57 -1.57 -0.08 0.00 -0.02 0.00 0.00 31.44 30.34 1tya n GLU 28 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1tya s GLU 29 N -3.43 1.28 -0.28 3.49 2.02 -0.22 -5.08 118.70 116.47 1tya s GLU 29 Ca -0.07 -1.40 -0.25 0.00 0.02 0.00 0.00 54.97 53.27 1tya s GLU 29 Cb 0.13 0.35 0.00 0.00 0.10 0.00 0.00 34.13 34.71 1tya s GLU 29 CO 0.89 -0.46 0.88 -0.98 0.02 0.00 0.00 175.26 175.60 1tya s ARG 30 N -4.07 4.08 -0.10 1.61 1.04 -1.26 -4.61 118.95 115.64 1tya s ARG 30 Ca 0.28 0.87 -0.16 0.00 -1.04 0.00 0.00 55.73 55.68 1tya s ARG 30 Cb 0.04 -3.69 -0.05 0.00 -2.04 0.00 0.00 34.95 29.21 1tya s ARG 30 CO 0.08 -0.66 0.40 0.08 -0.04 0.00 0.00 175.30 175.15 1tya s VAL 31 N 3.07 5.19 -0.17 4.99 1.01 -1.26 -4.90 120.40 128.32 1tya s VAL 31 Ca 0.37 0.78 -0.20 0.00 0.00 0.00 0.00 61.98 62.94 1tya s VAL 31 Cb -0.14 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1tya s VAL 31 CO 0.11 0.41 0.57 -0.89 0.00 0.00 0.00 175.10 175.30 1tya s THR 32 N 0.12 5.08 0.15 3.92 2.01 -1.26 -0.66 115.64 125.01 1tya s THR 32 Ca 0.22 1.08 0.05 0.00 0.31 0.00 0.00 61.69 63.35 1tya s THR 32 Cb -0.15 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 1tya s THR 32 CO 0.09 0.18 -0.10 -1.48 -0.69 0.00 0.00 174.62 172.62 1tya s LEU 33 N 1.50 2.53 0.10 4.42 2.34 -0.34 -1.88 118.68 127.35 1tya s LEU 33 Ca 0.27 -1.01 -0.02 0.00 0.06 0.00 0.00 54.13 53.43 1tya s LEU 33 Cb -0.16 -0.36 -0.04 0.00 -0.56 0.00 0.00 46.19 45.08 1tya s LEU 33 CO 0.11 -0.32 0.04 -0.72 -1.06 0.00 0.00 176.35 174.40 1tya s TYR 34 N -3.31 0.67 -0.02 3.48 1.13 -1.02 -1.74 117.35 116.55 1tya s TYR 34 Ca 0.17 -1.11 -0.02 0.00 -1.41 0.00 0.00 57.07 54.70 1tya s TYR 34 Cb 0.02 -0.40 0.00 0.00 -1.10 0.00 0.00 41.96 40.49 1tya s TYR 34 CO 0.01 -0.48 0.05 0.00 -2.51 0.00 0.00 175.55 172.61 1tya s GLY 36 N -0.06 2.16 -0.08 0.00 0.00 -1.26 -1.70 107.32 106.38 1tya s GLY 36 Ca -0.01 -0.74 -0.03 0.00 0.00 0.00 0.00 44.72 43.94 1tya s GLY 36 CO 0.00 -0.59 0.11 -1.36 0.00 0.00 0.00 173.10 171.26 1tya s PHE 37 N -1.24 -0.04 -0.18 1.90 0.40 -0.25 -4.94 117.98 113.62 1tya s PHE 37 Ca 0.24 0.34 -0.09 0.00 -0.60 0.00 0.00 56.93 56.82 1tya s PHE 37 Cb -0.12 -0.40 -0.05 0.00 0.51 0.00 0.00 43.02 42.95 1tya s PHE 37 CO 0.15 -0.28 0.13 -0.51 0.70 0.00 0.00 175.22 175.40 1tya s ASP 38 N 2.23 6.21 -0.50 1.36 1.01 -1.26 0.40 116.67 126.11 1tya s ASP 38 Ca 0.04 0.27 -0.28 0.00 0.71 0.00 0.00 52.55 53.29 1tya s ASP 38 Cb -0.13 -2.07 0.01 0.00 1.01 0.00 0.00 42.92 41.74 1tya s ASP 38 CO -0.05 0.23 1.48 -2.84 0.21 0.00 0.00 175.17 174.20 1tya s PRO 39 N 0.04 3.33 0.00 8.23 0.02 -1.26 -4.67 135.00 140.69 1tya s PRO 39 Ca 0.09 0.70 0.00 0.00 0.02 0.00 0.00 61.00 61.81 1tya s PRO 39 Cb -0.11 -4.12 0.00 0.00 0.02 0.00 0.00 34.50 30.29 1tya s PRO 39 CO -0.01 -1.88 0.54 0.25 -0.33 0.00 0.00 177.00 175.57 1tya n THR 40 N 7.01 0.17 -3.83 0.99 -2.24 -1.26 -4.81 114.28 110.31 1tya n THR 40 Ca 0.15 -0.52 -0.05 0.00 -2.27 0.00 0.00 64.05 61.36 1tya n THR 40 Cb 0.49 1.02 0.01 0.00 -2.10 0.00 0.00 70.33 69.74 1tya n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tya s ALA 41 N -0.17 -1.36 -1.93 6.98 0.00 -1.26 -5.06 121.76 118.95 1tya s ALA 41 Ca 0.00 -0.31 0.11 0.00 0.00 0.00 0.00 51.96 51.76 1tya s ALA 41 Cb 0.00 0.71 0.33 0.00 0.00 0.00 0.00 23.12 24.16 1tya s ALA 41 CO 0.00 -1.04 1.26 -0.40 0.00 0.00 0.00 175.76 175.58 1tya n ASP 42 N -0.99 2.01 -3.60 0.00 5.75 -1.26 -4.85 116.55 113.62 1tya n ASP 42 Ca -0.05 -2.02 -0.16 0.00 -0.01 0.00 0.00 54.79 52.54 1tya n ASP 42 Cb 0.60 -0.26 -0.07 0.00 -1.03 0.00 0.00 41.12 40.36 1tya n ASP 42 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1tya s SER 43 N -0.97 -0.55 0.99 -1.12 0.15 -1.26 -4.70 113.70 106.24 1tya s SER 43 Ca 0.24 0.68 -0.16 0.00 0.70 0.00 0.00 55.95 57.42 1tya s SER 43 Cb 0.13 0.62 0.19 0.00 -1.71 0.00 0.00 66.02 65.26 1tya s SER 43 CO 0.16 -0.50 1.23 -0.76 1.20 0.00 0.00 173.24 174.57 1tya s LEU 44 N -0.94 2.15 0.33 3.45 1.43 -1.26 -4.95 118.68 118.89 1tya s LEU 44 Ca -0.10 0.52 0.04 0.00 -1.03 0.00 0.00 54.13 53.56 1tya s LEU 44 Cb -0.02 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.59 1tya s LEU 44 CO 0.07 -2.90 0.34 -1.38 0.23 0.00 0.00 176.35 172.71 1tya s HIS 45 N -3.57 1.52 -1.23 0.29 -3.43 -1.26 -2.86 115.29 104.75 1tya s HIS 45 Ca 0.70 -1.54 0.06 0.00 -0.80 0.00 0.00 55.06 53.48 1tya s HIS 45 Cb -0.08 -0.50 0.27 0.00 -1.43 0.00 0.00 32.58 30.84 1tya s HIS 45 CO 0.53 -0.96 1.10 0.44 -2.00 0.00 0.00 174.74 173.86 1tya n ILE 46 N -0.60 1.24 0.20 -5.38 -5.35 -0.90 -1.48 119.36 107.10 1tya n ILE 46 Ca 0.05 0.31 0.06 0.00 -0.27 0.00 0.00 62.75 62.90 1tya n ILE 46 Cb 0.62 -1.21 0.39 0.00 -1.74 0.00 0.00 39.64 37.70 1tya n ILE 46 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1tya h GLY 47 N 0.97 0.00 0.36 3.28 0.00 -1.95 -3.14 103.07 102.58 1tya h GLY 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1tya h GLY 47 CO 0.00 0.00 -1.31 1.42 0.00 0.00 0.00 176.54 176.65 1tya n HIS 48 N -3.68 0.21 -0.18 5.60 8.25 -0.55 -4.64 115.22 120.24 1tya n HIS 48 Ca -0.01 0.06 -0.05 0.00 -0.26 0.00 0.00 57.72 57.46 1tya n HIS 48 Cb 0.45 -0.43 0.04 0.00 1.12 0.00 0.00 29.99 31.17 1tya n HIS 48 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1tya h LEU 49 N 0.00 0.50 -0.60 2.41 3.38 -1.61 -2.43 115.31 116.97 1tya h LEU 49 Ca 0.00 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.05 1tya h LEU 49 Cb 0.80 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 1tya h LEU 49 CO 0.00 0.35 0.29 0.00 0.09 0.00 0.00 178.44 179.17 1tya h ALA 50 N 1.24 0.79 -0.04 1.53 0.00 -1.82 0.38 119.26 121.34 1tya h ALA 50 Ca 0.22 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1tya h ALA 50 Cb 0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1tya h ALA 50 CO -0.11 -0.08 0.01 0.00 0.00 0.00 0.00 179.25 179.08 1tya h ALA 51 N 1.35 0.05 0.25 0.00 0.00 -1.84 -1.70 119.26 117.36 1tya h ALA 51 Ca 0.28 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1tya h ALA 51 Cb 0.24 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1tya h ALA 51 CO -0.22 -0.36 -0.33 0.82 0.00 0.00 0.00 179.25 179.16 1tya h ILE 52 N -0.12 0.31 0.00 0.00 2.04 -1.23 -2.35 117.51 116.15 1tya h ILE 52 Ca 0.01 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.80 1tya h ILE 52 Cb 0.19 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 1tya h ILE 52 CO -0.00 0.00 -0.32 -0.07 0.00 0.00 0.00 178.15 177.76 1tya h LEU 53 N -0.64 0.00 -0.90 1.44 3.38 -0.97 -2.32 115.31 115.29 1tya h LEU 53 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1tya h LEU 53 Cb 0.61 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1tya h LEU 53 CO -0.11 0.32 -0.19 0.74 0.09 0.00 0.00 178.44 179.29 1tya h THR 54 N 0.00 1.26 -0.20 0.22 2.02 -1.09 -1.82 112.91 113.30 1tya h THR 54 Ca -0.00 -1.21 0.02 0.00 0.77 0.00 0.00 66.41 65.98 1tya h THR 54 Cb 0.64 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.26 1tya h THR 54 CO 0.04 0.40 0.08 0.24 0.37 0.00 0.00 175.52 176.65 1tya h MET 55 N 0.53 0.18 -0.54 6.66 2.86 -0.88 -1.28 114.93 122.45 1tya h MET 55 Ca 0.08 -0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.81 1tya h MET 55 Cb 0.63 -0.04 -0.08 0.00 0.06 0.00 0.00 31.60 32.17 1tya h MET 55 CO 0.04 0.12 0.07 -0.09 1.06 0.00 0.00 176.91 178.12 1tya h ARG 56 N 0.19 0.19 -0.78 1.72 2.43 -1.17 0.24 114.38 117.21 1tya h ARG 56 Ca 0.09 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1tya h ARG 56 Cb 0.04 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.51 1tya h ARG 56 CO -0.08 0.13 0.35 0.00 -1.51 0.00 0.00 179.97 178.86 1tya h ARG 57 N 0.20 1.13 -0.59 0.20 3.08 -1.09 -0.42 114.38 116.89 1tya h ARG 57 Ca 0.28 -0.18 -0.10 0.00 0.07 0.00 0.00 59.98 60.05 1tya h ARG 57 Cb 0.41 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1tya h ARG 57 CO -0.39 0.89 -0.02 0.74 -1.07 0.00 0.00 179.97 180.12 1tya h PHE 58 N 1.10 1.16 -0.28 3.04 -1.00 0.13 -2.81 116.94 118.28 1tya h PHE 58 Ca 0.26 -0.21 -0.00 0.00 2.81 0.00 0.00 57.97 60.84 1tya h PHE 58 Cb 0.15 -0.30 -0.01 0.00 3.61 0.00 0.00 35.95 39.40 1tya h PHE 58 CO 0.01 1.03 0.17 0.37 -1.61 0.00 0.00 178.31 178.29 1tya h GLN 59 N 0.96 0.38 -0.26 1.51 4.15 0.49 -1.59 115.11 120.74 1tya h GLN 59 Ca 0.17 -0.03 0.07 0.00 0.77 0.00 0.00 58.65 59.62 1tya h GLN 59 Cb 0.58 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.18 1tya h GLN 59 CO 0.03 0.29 0.19 1.96 -1.93 0.00 0.00 178.83 179.37 1tya h GLN 60 N 0.36 0.03 -0.38 1.69 4.20 -1.01 -0.70 115.11 119.31 1tya h GLN 60 Ca 0.10 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 1tya h GLN 60 Cb 0.00 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1tya h GLN 60 CO -0.02 0.02 0.00 0.00 -0.67 0.00 0.00 178.83 178.16 1tya n ALA 61 N -2.58 2.50 -0.85 3.87 0.00 -1.07 -4.90 120.51 117.48 1tya n ALA 61 Ca 0.03 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1tya n ALA 61 Cb 0.32 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1tya n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tya n GLY 62 N 0.97 0.58 3.94 0.00 0.00 -0.27 -5.08 105.19 105.33 1tya n GLY 62 Ca 0.11 -0.79 -0.23 0.00 0.00 0.00 0.00 46.02 45.11 1tya n GLY 62 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1tya s HIS 63 N -2.00 3.41 -0.42 1.61 3.76 -0.61 -4.72 115.29 116.32 1tya s HIS 63 Ca 0.00 0.00 -0.15 0.00 -0.15 0.00 0.00 55.06 54.76 1tya s HIS 63 Cb 0.00 -1.57 0.03 0.00 1.11 0.00 0.00 32.58 32.14 1tya s HIS 63 CO 0.00 0.47 0.33 0.50 -0.85 0.00 0.00 174.74 175.19 1tya s ARG 64 N -3.74 2.98 -0.01 1.40 3.52 0.17 -3.86 118.95 119.40 1tya s ARG 64 Ca 0.34 -1.04 -0.16 0.00 -0.13 0.00 0.00 55.73 54.75 1tya s ARG 64 Cb -0.09 -4.00 -0.06 0.00 -1.56 0.00 0.00 34.95 29.24 1tya s ARG 64 CO 0.28 -0.80 0.43 -1.25 -0.81 0.00 0.00 175.30 173.15 1tya s PRO 65 N 1.73 4.02 -0.17 5.12 0.04 -1.26 -1.20 135.00 143.27 1tya s PRO 65 Ca 0.06 0.44 0.01 0.00 0.04 0.00 0.00 61.00 61.55 1tya s PRO 65 Cb -0.19 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.10 1tya s PRO 65 CO 0.10 0.60 -0.20 0.42 0.04 0.00 0.00 177.00 177.96 1tya s ILE 66 N -0.79 2.03 -0.25 0.56 1.01 -0.71 -2.07 121.20 120.98 1tya s ILE 66 Ca 0.24 -0.93 -0.09 0.00 0.00 0.00 0.00 60.65 59.88 1tya s ILE 66 Cb -0.17 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.43 1tya s ILE 66 CO 0.13 0.54 0.12 0.00 0.00 0.00 0.00 174.94 175.73 1tya s ALA 67 N 1.25 3.39 -0.29 9.38 0.00 -0.70 -2.04 121.76 132.75 1tya s ALA 67 Ca 0.04 -1.02 -0.11 0.00 0.00 0.00 0.00 51.96 50.86 1tya s ALA 67 Cb -0.13 -2.23 -0.04 0.00 0.00 0.00 0.00 23.12 20.72 1tya s ALA 67 CO -0.12 -0.36 0.20 -1.17 0.00 0.00 0.00 175.76 174.31 1tya s LEU 68 N 1.38 4.10 -0.17 0.00 2.96 -0.69 -0.36 118.68 125.91 1tya s LEU 68 Ca 0.06 -0.07 -0.20 0.00 -0.22 0.00 0.00 54.13 53.71 1tya s LEU 68 Cb -0.15 -2.13 -0.03 0.00 0.50 0.00 0.00 46.19 44.38 1tya s LEU 68 CO 0.06 -0.08 0.57 -0.69 -1.32 0.00 0.00 176.35 174.89 1tya s VAL 69 N 1.76 5.08 -1.50 1.68 1.01 0.32 -1.09 120.40 127.67 1tya s VAL 69 Ca 0.07 1.09 -0.11 0.00 0.00 0.00 0.00 61.98 63.03 1tya s VAL 69 Cb -0.16 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 1tya s VAL 69 CO 0.11 0.19 2.67 0.61 0.00 0.00 0.00 175.10 178.67 1tya n GLY 70 N 3.65 4.16 0.33 4.51 0.00 0.16 -2.09 105.19 115.92 1tya n GLY 70 Ca -0.04 -1.47 -0.04 0.00 0.00 0.00 0.00 46.02 44.47 1tya n GLY 70 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1tya h GLY 71 N 8.15 1.23 0.00 -0.02 0.00 -1.91 0.87 103.07 111.40 1tya h GLY 71 Ca 0.75 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 47.56 1tya h GLY 71 CO 1.80 0.50 -0.00 0.00 0.00 0.00 0.00 176.54 178.84 1tya h ALA 72 N 1.27 -0.01 -0.47 3.60 0.00 -1.84 -3.37 119.26 118.44 1tya h ALA 72 Ca 0.30 -0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.35 1tya h ALA 72 Cb -0.04 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1tya h ALA 72 CO -0.06 -0.01 0.34 1.79 0.00 0.00 0.00 179.25 181.31 1tya h THR 73 N -0.61 0.77 0.00 0.00 1.35 -1.92 0.30 112.91 112.81 1tya h THR 73 Ca -0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.85 1tya h THR 73 Cb 0.00 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 67.18 1tya h THR 73 CO 0.00 0.00 0.00 1.23 -0.25 0.00 0.00 175.52 176.50 1tya h GLY 74 N 0.02 0.00 0.31 5.82 0.00 -0.99 -1.10 103.07 107.14 1tya h GLY 74 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1tya h GLY 74 CO -0.01 0.00 -0.34 1.04 0.00 0.00 0.00 176.54 177.23 1tya n LEU 75 N -2.37 0.98 -0.00 3.11 4.77 0.10 -4.50 117.00 119.08 1tya n LEU 75 Ca 0.00 -0.25 -0.04 0.00 -0.03 0.00 0.00 56.01 55.70 1tya n LEU 75 Cb 0.14 -0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 1tya n LEU 75 CO 0.16 0.19 -0.39 -0.38 -1.33 0.00 0.00 177.39 175.64 1tya n ILE 76 N -0.81 0.89 -0.05 -0.08 2.08 -0.62 -4.86 119.36 115.92 1tya n ILE 76 Ca 0.10 0.16 0.00 0.00 0.56 0.00 0.00 62.75 63.58 1tya n ILE 76 Cb 0.35 -1.69 0.00 0.00 -0.75 0.00 0.00 39.64 37.55 1tya n ILE 76 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1tya n GLY 77 N 2.85 0.24 3.64 7.39 0.00 -0.51 -4.61 105.19 114.19 1tya n GLY 77 Ca -0.07 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1tya n GLY 77 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tya s ASP 78 N -0.18 6.87 0.39 1.61 2.15 -1.26 -4.58 116.67 121.67 1tya s ASP 78 Ca 0.00 1.06 0.27 0.00 0.43 0.00 0.00 52.55 54.31 1tya s ASP 78 Cb 0.00 -2.46 0.89 0.00 -0.30 0.00 0.00 42.92 41.05 1tya s ASP 78 CO 0.00 -0.57 1.78 1.55 -0.17 0.00 0.00 175.17 177.76 1tya h PRO 79 N 7.70 0.00 -6.34 4.34 0.13 -1.92 -3.45 132.00 132.47 1tya h PRO 79 Ca -0.22 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.29 1tya h PRO 79 Cb 1.08 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.25 1tya h PRO 79 CO 0.90 0.00 0.93 0.43 -0.23 0.00 0.00 178.00 180.03 1tya n SER 80 N -2.74 3.10 -0.15 1.44 7.64 -1.26 -1.45 113.62 120.19 1tya n SER 80 Ca 0.03 1.03 -0.02 0.00 1.01 0.00 0.00 58.87 60.92 1tya n SER 80 Cb 0.38 -1.36 -0.01 0.00 -1.01 0.00 0.00 64.21 62.21 1tya n SER 80 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tya n GLY 81 N 3.89 0.39 3.37 0.23 0.00 -1.26 -4.99 105.19 106.82 1tya n GLY 81 Ca 0.21 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1tya n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tya s LYS 82 N -1.44 3.30 0.13 1.61 1.02 -0.53 -5.02 119.74 118.82 1tya s LYS 82 Ca 0.00 -0.70 0.24 0.00 0.02 0.00 0.00 55.97 55.53 1tya s LYS 82 Cb 0.00 -2.59 0.30 0.00 -0.52 0.00 0.00 37.83 35.01 1tya s LYS 82 CO 0.00 0.25 1.29 0.87 -0.92 0.00 0.00 175.35 176.83 1tya h LYS 83 N 6.59 0.00 -5.02 1.68 1.57 -1.94 -3.47 116.57 115.98 1tya h LYS 83 Ca -0.27 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.15 1tya h LYS 83 Cb 1.21 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.30 1tya h LYS 83 CO 0.55 0.00 -0.76 -1.12 -0.57 0.00 0.00 179.45 177.54 1tya s SER 84 N -4.39 1.33 0.37 0.86 0.01 -1.26 -4.98 113.70 105.64 1tya s SER 84 Ca 0.05 -0.54 -0.28 0.00 1.31 0.00 0.00 55.95 56.49 1tya s SER 84 Cb 0.13 -0.03 -0.11 0.00 0.21 0.00 0.00 66.02 66.22 1tya s SER 84 CO 0.73 -0.10 1.36 1.21 0.41 0.00 0.00 173.24 176.85 1tya n GLU 85 N 1.51 2.29 -4.00 12.44 4.07 -1.26 -4.98 120.64 130.71 1tya n GLU 85 Ca -0.21 0.81 -0.21 0.00 -0.06 0.00 0.00 57.16 57.48 1tya n GLU 85 Cb 0.55 -2.47 -0.03 0.00 -0.06 0.00 0.00 31.44 29.43 1tya n GLU 85 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1tya s ARG 86 N -2.03 3.07 0.27 5.31 1.81 -1.26 -5.10 118.95 121.03 1tya s ARG 86 Ca 0.56 -0.99 -0.19 0.00 -1.72 0.00 0.00 55.73 53.39 1tya s ARG 86 Cb -0.52 -2.67 -0.09 0.00 -0.45 0.00 0.00 34.95 31.22 1tya s ARG 86 CO 0.62 0.36 0.76 0.95 -0.68 0.00 0.00 175.30 177.31 1tya s THR 87 N -2.11 4.56 -0.04 0.02 -4.23 -1.26 -5.03 115.64 107.56 1tya s THR 87 Ca 0.35 1.23 -0.30 0.00 -1.18 0.00 0.00 61.69 61.79 1tya s THR 87 Cb -0.08 -3.78 -0.02 0.00 1.34 0.00 0.00 72.50 69.96 1tya s THR 87 CO 0.27 0.05 0.99 -0.76 -0.54 0.00 0.00 174.62 174.63 1tya s LEU 88 N -2.37 4.32 0.42 4.79 1.43 -1.26 -5.04 118.68 120.97 1tya s LEU 88 Ca 0.48 1.62 0.00 0.00 -1.03 0.00 0.00 54.13 55.20 1tya s LEU 88 Cb -0.14 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.50 1tya s LEU 88 CO 0.20 -0.33 0.63 0.20 0.23 0.00 0.00 176.35 177.28 1tya s ASN 89 N 1.04 6.01 0.50 2.29 0.02 -1.26 -5.09 114.94 118.46 1tya s ASN 89 Ca 0.51 0.37 -0.17 0.00 -1.02 0.00 0.00 52.86 52.55 1tya s ASN 89 Cb -0.20 -1.73 -0.08 0.00 0.02 0.00 0.00 41.25 39.25 1tya s ASN 89 CO 0.24 -0.55 0.97 0.00 0.02 0.00 0.00 177.10 177.78 1tya s ALA 90 N -2.48 3.08 0.24 0.60 0.00 -1.26 -4.89 121.76 117.05 1tya s ALA 90 Ca 0.45 0.19 -0.05 0.00 0.00 0.00 0.00 51.96 52.55 1tya s ALA 90 Cb -0.10 -3.10 0.43 0.00 0.00 0.00 0.00 23.12 20.36 1tya s ALA 90 CO 0.38 -0.17 1.71 0.87 0.00 0.00 0.00 175.76 178.55 1tya h LYS 91 N 1.08 0.34 -0.19 0.00 1.79 -1.98 -0.98 116.57 116.63 1tya h LYS 91 Ca -0.47 -0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.01 1tya h LYS 91 Cb 1.18 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.73 1tya h LYS 91 CO 0.62 0.23 -0.01 0.93 -1.08 0.00 0.00 179.45 180.13 1tya h GLU 92 N 0.35 0.05 0.58 3.15 3.07 -1.98 0.59 114.58 120.39 1tya h GLU 92 Ca 0.40 -0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.23 1tya h GLU 92 Cb 0.63 -0.01 0.01 0.00 -0.84 0.00 0.00 28.75 28.53 1tya h GLU 92 CO -0.44 0.03 -0.28 1.15 -1.40 0.00 0.00 179.01 178.08 1tya h THR 93 N 0.05 0.40 -0.43 1.13 2.02 -1.61 -1.92 112.91 112.56 1tya h THR 93 Ca 0.09 -0.14 0.08 0.00 0.77 0.00 0.00 66.41 67.20 1tya h THR 93 Cb 0.12 0.46 -0.07 0.00 -1.74 0.00 0.00 68.15 66.92 1tya h THR 93 CO -0.16 0.02 0.03 0.58 0.37 0.00 0.00 175.52 176.36 1tya h VAL 94 N -0.87 0.70 -0.67 3.16 2.07 -1.07 -1.04 116.25 118.53 1tya h VAL 94 Ca -0.08 -0.05 0.10 0.00 0.82 0.00 0.00 66.70 67.50 1tya h VAL 94 Cb 0.63 0.55 -0.08 0.00 -1.52 0.00 0.00 31.29 30.87 1tya h VAL 94 CO 0.13 0.03 0.28 -0.08 0.02 0.00 0.00 177.57 177.95 1tya h GLU 95 N 0.14 0.46 -0.31 1.57 4.81 0.30 0.28 114.58 121.82 1tya h GLU 95 Ca 0.21 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.35 1tya h GLU 95 Cb 0.30 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1tya h GLU 95 CO -0.33 0.31 -0.06 0.00 -0.73 0.00 0.00 179.01 178.19 1tya h ALA 96 N 1.45 0.43 -0.32 2.92 0.00 -0.51 -3.13 119.26 120.09 1tya h ALA 96 Ca 0.34 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1tya h ALA 96 Cb 0.43 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1tya h ALA 96 CO -0.32 0.24 -0.17 -1.49 0.00 0.00 0.00 179.25 177.52 1tya h TRP 97 N 0.37 0.64 -0.72 0.00 6.55 -0.81 -3.11 115.95 118.86 1tya h TRP 97 Ca 0.08 -0.12 -0.01 0.00 0.95 0.00 0.00 58.89 59.79 1tya h TRP 97 Cb 0.54 -0.16 -0.03 0.00 -0.86 0.00 0.00 29.16 28.65 1tya h TRP 97 CO 0.05 0.72 0.41 0.77 -1.05 0.00 0.00 178.44 179.33 1tya h SER 98 N 0.53 0.88 -0.90 -3.49 0.02 -0.89 -2.77 113.55 106.92 1tya h SER 98 Ca 0.09 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1tya h SER 98 Cb 0.59 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.86 1tya h SER 98 CO 0.04 0.70 0.57 0.00 -1.14 0.00 0.00 176.83 177.01 1tya h ALA 99 N 1.44 1.31 0.00 3.77 0.00 -1.59 -0.83 119.26 123.37 1tya h ALA 99 Ca 0.26 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1tya h ALA 99 Cb 0.01 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.43 1tya h ALA 99 CO -0.04 0.61 -0.00 0.00 0.00 0.00 0.00 179.25 179.82 1tya h ARG 100 N 1.23 -0.01 -0.84 0.00 2.47 -1.54 -3.12 114.38 112.57 1tya h ARG 100 Ca 0.33 0.00 0.03 0.00 -1.26 0.00 0.00 59.98 59.08 1tya h ARG 100 Cb -0.10 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.17 1tya h ARG 100 CO -0.07 0.62 0.55 0.82 0.56 0.00 0.00 179.97 182.45 1tya h ILE 101 N -0.64 1.15 -0.60 2.04 2.04 -1.43 0.19 117.51 120.25 1tya h ILE 101 Ca -0.00 -0.37 0.06 0.00 1.00 0.00 0.00 64.86 65.55 1tya h ILE 101 Cb 0.63 -0.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.64 1tya h ILE 101 CO 0.00 0.20 0.32 0.50 0.00 0.00 0.00 178.15 179.16 1tya h LYS 102 N 1.07 0.57 0.66 2.37 3.64 -1.24 0.49 116.57 124.13 1tya h LYS 102 Ca 0.33 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.65 1tya h LYS 102 Cb -0.02 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1tya h LYS 102 CO -0.11 0.38 -0.32 0.93 -2.27 0.00 0.00 179.45 178.07 1tya h GLU 103 N 0.59 -0.85 -0.90 1.90 5.08 -0.66 -1.90 114.58 117.84 1tya h GLU 103 Ca 0.27 0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.73 1tya h GLU 103 Cb 0.19 0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 1tya h GLU 103 CO -0.18 -0.56 0.59 1.96 -1.00 0.00 0.00 179.01 179.81 1tya h GLN 104 N -0.90 1.09 0.33 2.33 4.20 -0.46 -2.79 115.11 118.91 1tya h GLN 104 Ca -0.09 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 1tya h GLN 104 Cb 0.68 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 1tya h GLN 104 CO 0.15 0.72 -0.34 -0.07 -0.67 0.00 0.00 178.83 178.61 1tya h LEU 105 N 1.12 -0.94 -1.50 1.46 3.38 0.28 -2.96 115.31 116.16 1tya h LEU 105 Ca 0.36 0.08 0.28 0.00 0.09 0.00 0.00 57.88 58.69 1tya h LEU 105 Cb 0.03 0.32 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 1tya h LEU 105 CO -0.11 -0.48 0.98 1.23 0.09 0.00 0.00 178.44 180.15 1tya h GLY 106 N -0.71 0.00 0.99 0.83 0.00 -1.06 -2.39 103.07 100.73 1tya h GLY 106 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 1tya h GLY 106 CO -0.07 0.00 0.28 3.21 0.00 0.00 0.00 176.54 179.96 1tya h ARG 107 N 0.00 0.85 -0.00 4.80 3.08 -1.61 -3.21 114.38 118.29 1tya h ARG 107 Ca 0.45 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1tya h ARG 107 Cb 2.40 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 32.30 1tya h ARG 107 CO -0.00 0.69 -0.13 1.19 -1.07 0.00 0.00 179.97 180.65 1tya n PHE 108 N -4.53 0.00 -4.45 3.04 3.72 -0.90 -4.92 117.46 109.43 1tya n PHE 108 Ca 0.04 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.19 1tya n PHE 108 Cb 0.13 -0.35 -0.10 0.00 -0.94 0.00 0.00 39.48 38.22 1tya n PHE 108 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1tya s LEU 109 N -2.82 2.64 -0.25 4.37 1.43 -1.21 -4.74 118.68 118.10 1tya s LEU 109 Ca 0.19 -0.97 -0.14 0.00 -1.03 0.00 0.00 54.13 52.18 1tya s LEU 109 Cb 0.19 -1.17 -0.04 0.00 0.03 0.00 0.00 46.19 45.20 1tya s LEU 109 CO 0.54 0.05 0.34 -0.62 0.23 0.00 0.00 176.35 176.89 1tya s ASP 110 N -3.42 6.27 0.00 2.29 2.15 -1.26 -4.95 116.67 117.76 1tya s ASP 110 Ca 0.29 0.31 0.14 0.00 0.43 0.00 0.00 52.55 53.72 1tya s ASP 110 Cb -0.06 -2.20 -0.09 0.00 -0.30 0.00 0.00 42.92 40.28 1tya s ASP 110 CO 0.15 -0.12 0.66 0.49 -0.17 0.00 0.00 175.17 176.18 1tya n PHE 111 N 4.95 0.00 0.06 -5.34 3.01 -1.26 -1.13 117.46 117.75 1tya n PHE 111 Ca -0.10 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.47 1tya n PHE 111 Cb 0.51 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.91 1tya n PHE 111 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1tya n GLU 112 N -0.86 0.63 -1.63 -1.08 1.02 -1.26 -4.77 120.64 112.69 1tya n GLU 112 Ca 0.04 0.01 -0.39 0.00 -0.02 0.00 0.00 57.16 56.79 1tya n GLU 112 Cb 0.25 -1.71 0.03 0.00 -0.02 0.00 0.00 31.44 29.99 1tya n GLU 112 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1tya n ALA 113 N -2.22 0.35 -3.27 0.62 0.00 -1.26 -4.98 120.51 109.75 1tya n ALA 113 Ca -0.02 0.11 -0.35 0.00 0.00 0.00 0.00 53.44 53.18 1tya n ALA 113 Cb 0.58 -2.12 -0.13 0.00 0.00 0.00 0.00 19.45 17.77 1tya n ALA 113 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1tya s ASP 114 N -0.98 4.48 0.00 0.00 2.15 -1.26 -3.64 116.67 117.42 1tya s ASP 114 Ca 0.70 -0.30 0.00 0.00 0.43 0.00 0.00 52.55 53.37 1tya s ASP 114 Cb -0.47 -1.76 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 1tya s ASP 114 CO 0.52 0.04 0.00 0.61 -0.17 0.00 0.00 175.17 176.17 1tya n GLY 115 N 4.36 3.18 2.73 2.66 0.00 -1.26 -4.84 105.19 112.02 1tya n GLY 115 Ca -0.18 -0.93 -0.06 0.00 0.00 0.00 0.00 46.02 44.85 1tya n GLY 115 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1tya n ASN 116 N 0.75 1.35 -4.78 1.61 6.94 -1.26 -4.93 115.26 114.93 1tya n ASN 116 Ca 0.00 -2.45 -0.34 0.00 -0.02 0.00 0.00 54.58 51.77 1tya n ASN 116 Cb 0.00 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 36.97 1tya n ASN 116 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1tya s PRO 117 N -3.22 3.34 0.95 -0.53 0.04 -1.24 -4.59 135.00 129.75 1tya s PRO 117 Ca 0.27 1.47 -0.14 0.00 0.04 0.00 0.00 61.00 62.63 1tya s PRO 117 Cb 0.41 -2.02 0.17 0.00 0.04 0.00 0.00 34.50 33.10 1tya s PRO 117 CO 0.01 -0.83 1.18 0.00 0.04 0.00 0.00 177.00 177.40 1tya s ALA 118 N -2.01 1.83 0.01 8.56 0.00 -0.28 -4.65 121.76 125.22 1tya s ALA 118 Ca 0.69 -0.77 -0.00 0.00 0.00 0.00 0.00 51.96 51.88 1tya s ALA 118 Cb -0.21 -2.94 -0.01 0.00 0.00 0.00 0.00 23.12 19.96 1tya s ALA 118 CO 0.29 -2.44 -0.01 0.15 0.00 0.00 0.00 175.76 173.76 1tya s LYS 119 N -5.49 0.20 -0.12 0.00 1.02 -0.88 -4.87 119.74 109.61 1tya s LYS 119 Ca 0.67 -0.36 0.01 0.00 0.02 0.00 0.00 55.97 56.31 1tya s LYS 119 Cb -0.11 0.07 -0.01 0.00 -0.52 0.00 0.00 37.83 37.26 1tya s LYS 119 CO 0.53 -0.03 -0.16 0.42 -0.92 0.00 0.00 175.35 175.19 1tya s ILE 120 N -0.90 2.79 0.13 2.17 1.01 -1.26 -1.72 121.20 123.43 1tya s ILE 120 Ca -0.10 -0.76 0.03 0.00 0.00 0.00 0.00 60.65 59.82 1tya s ILE 120 Cb -0.06 -2.14 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1tya s ILE 120 CO -0.01 0.54 -0.08 -0.54 0.00 0.00 0.00 174.94 174.85 1tya s LYS 121 N 0.28 0.99 -0.19 2.79 1.02 0.51 -4.93 119.74 120.21 1tya s LYS 121 Ca -0.12 -1.42 0.01 0.00 0.02 0.00 0.00 55.97 54.47 1tya s LYS 121 Cb -0.16 -0.44 0.03 0.00 -0.52 0.00 0.00 37.83 36.74 1tya s LYS 121 CO 0.06 0.02 -0.16 1.21 -0.92 0.00 0.00 175.35 175.56 1tya s ASN 122 N -3.13 3.38 0.00 2.83 3.84 -1.26 0.12 114.94 120.72 1tya s ASN 122 Ca 0.16 -0.81 0.12 0.00 0.21 0.00 0.00 52.86 52.54 1tya s ASN 122 Cb 0.04 -1.43 0.67 0.00 -0.55 0.00 0.00 41.25 39.98 1tya s ASN 122 CO -0.01 -0.06 1.24 -0.46 -2.79 0.00 0.00 177.10 175.02 1tya n ASN 123 N 4.61 0.00 0.16 -4.21 0.23 -0.89 -2.32 115.26 112.85 1tya n ASN 123 Ca -0.18 -0.12 0.01 0.00 -0.53 0.00 0.00 54.58 53.76 1tya n ASN 123 Cb 0.48 -0.15 0.30 0.00 -2.08 0.00 0.00 39.78 38.32 1tya n ASN 123 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 1tya h TYR 124 N 0.00 0.04 -0.81 -2.53 3.20 -1.88 0.92 116.97 115.91 1tya h TYR 124 Ca 0.00 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 61.96 1tya h TYR 124 Cb 0.06 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.27 1tya h TYR 124 CO 0.00 0.46 0.53 -0.44 -1.64 0.00 0.00 178.16 177.07 1tya h ASP 125 N 0.03 0.67 0.00 -2.11 3.32 -1.88 0.29 116.42 116.75 1tya h ASP 125 Ca -0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1tya h ASP 125 Cb 0.78 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1tya h ASP 125 CO 0.06 0.40 -1.14 -2.67 -1.72 0.00 0.00 179.24 174.17 1tya n TRP 126 N -4.51 0.00 -0.00 4.55 2.14 -1.10 -4.65 117.44 113.87 1tya n TRP 126 Ca 0.14 0.00 -0.16 0.00 2.07 0.00 0.00 57.50 59.55 1tya n TRP 126 Cb 0.33 -0.13 -0.14 0.00 -0.81 0.00 0.00 31.31 30.56 1tya n TRP 126 CO 0.00 0.00 0.00 -0.89 2.07 0.00 0.00 177.69 178.87 1tya n ILE 127 N -1.63 1.71 -0.24 -1.67 5.41 0.30 -4.23 119.36 119.01 1tya n ILE 127 Ca -0.01 -0.72 -0.10 0.00 1.00 0.00 0.00 62.75 62.92 1tya n ILE 127 Cb 0.16 -1.44 -0.08 0.00 -0.71 0.00 0.00 39.64 37.57 1tya n ILE 127 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1tya h GLY 128 N 2.12 -1.17 -0.39 7.39 0.00 -0.59 -1.83 103.07 108.60 1tya h GLY 128 Ca -0.36 0.81 0.00 0.00 0.00 0.00 0.00 47.33 47.78 1tya h GLY 128 CO 0.09 -0.18 0.00 -1.55 0.00 0.00 0.00 176.54 174.90 1tya n PRO 129 N -4.89 1.28 -3.06 4.80 -0.04 -1.26 -4.88 135.00 126.94 1tya n PRO 129 Ca -0.00 -0.43 -0.40 0.00 -0.04 0.00 0.00 63.50 62.63 1tya n PRO 129 Cb 0.25 -1.12 -0.05 0.00 -0.04 0.00 0.00 33.50 32.54 1tya n PRO 129 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1tya s LEU 130 N -1.06 4.35 0.24 1.53 2.96 -0.69 -5.04 118.68 120.97 1tya s LEU 130 Ca 0.10 1.21 -0.19 0.00 -0.22 0.00 0.00 54.13 55.03 1tya s LEU 130 Cb 0.05 -3.07 -0.08 0.00 0.50 0.00 0.00 46.19 43.58 1tya s LEU 130 CO 0.07 -0.07 0.74 1.51 -1.32 0.00 0.00 176.35 177.29 1tya s ASP 131 N 0.54 7.04 0.15 3.68 -4.77 -1.26 -4.98 116.67 117.07 1tya s ASP 131 Ca 0.37 1.42 -0.22 0.00 -3.30 0.00 0.00 52.55 50.82 1tya s ASP 131 Cb -0.18 -2.42 0.03 0.00 -1.09 0.00 0.00 42.92 39.26 1tya s ASP 131 CO 0.19 -0.01 1.64 1.62 0.70 0.00 0.00 175.17 179.31 1tya h VAL 132 N 2.63 0.43 -0.82 2.11 3.04 -1.99 -1.51 116.25 120.14 1tya h VAL 132 Ca -0.48 0.00 0.17 0.00 -1.01 0.00 0.00 66.70 65.39 1tya h VAL 132 Cb 1.19 0.43 -0.11 0.00 -2.01 0.00 0.00 31.29 30.79 1tya h VAL 132 CO 0.65 0.00 0.33 0.40 -1.01 0.00 0.00 177.57 177.94 1tya h ILE 133 N -0.22 0.57 -0.40 3.17 2.04 -1.99 0.69 117.51 121.37 1tya h ILE 133 Ca 0.14 -0.14 -0.05 0.00 1.00 0.00 0.00 64.86 65.81 1tya h ILE 133 Cb 0.43 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 1tya h ILE 133 CO -0.38 0.08 0.07 0.74 0.00 0.00 0.00 178.15 178.65 1tya h THR 134 N 0.42 1.24 0.08 -0.27 2.02 -1.75 -2.41 112.91 112.24 1tya h THR 134 Ca 0.48 -0.86 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 1tya h THR 134 Cb 0.81 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 1tya h THR 134 CO -0.47 0.30 -0.04 0.15 0.37 0.00 0.00 175.52 175.83 1tya h PHE 135 N 0.51 -0.10 -0.50 3.16 3.57 -0.25 0.25 116.94 123.59 1tya h PHE 135 Ca 0.12 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1tya h PHE 135 Cb 0.36 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 1tya h PHE 135 CO 0.02 0.17 0.31 -0.07 -2.23 0.00 0.00 178.31 176.51 1tya h LEU 136 N -0.37 0.58 0.00 0.59 3.38 -0.91 -1.79 115.31 116.78 1tya h LEU 136 Ca -0.01 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 1tya h LEU 136 Cb 0.32 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1tya h LEU 136 CO 0.02 0.44 -0.86 0.03 0.09 0.00 0.00 178.44 178.15 1tya h ARG 137 N 0.68 0.00 -0.06 1.13 3.08 -1.39 -2.86 114.38 114.95 1tya h ARG 137 Ca 0.18 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.13 1tya h ARG 137 Cb -0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1tya h ARG 137 CO -0.04 0.74 -0.41 -0.44 -1.07 0.00 0.00 179.97 178.76 1tya h ASP 138 N -1.00 0.14 0.00 7.04 5.19 -0.57 -3.07 116.42 124.15 1tya h ASP 138 Ca -0.21 -0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.14 1tya h ASP 138 Cb 1.03 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.50 1tya h ASP 138 CO -0.13 0.53 -0.63 0.52 -3.12 0.00 0.00 179.24 176.42 1tya n VAL 139 N -4.04 1.40 -0.32 -1.35 0.31 -0.73 -4.75 118.33 108.86 1tya n VAL 139 Ca -0.02 0.24 0.23 0.00 -0.01 0.00 0.00 64.34 64.78 1tya n VAL 139 Cb 0.46 -2.07 0.51 0.00 -0.91 0.00 0.00 33.84 31.83 1tya n VAL 139 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1tya h GLY 140 N -0.63 1.17 1.95 2.92 0.00 -1.31 -1.80 103.07 105.38 1tya h GLY 140 Ca 0.00 -0.20 0.01 0.00 0.00 0.00 0.00 47.33 47.13 1tya h GLY 140 CO 0.00 -0.12 0.02 1.70 0.00 0.00 0.00 176.54 178.14 1tya h LYS 141 N 0.39 0.00 0.00 4.80 1.63 -1.40 -2.02 116.57 119.97 1tya h LYS 141 Ca 0.58 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.38 1tya h LYS 141 Cb 1.49 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.12 1tya h LYS 141 CO -0.28 0.00 0.00 0.72 -3.45 0.00 0.00 179.45 176.44 1tya n HIS 142 N -4.43 0.43 -5.01 1.91 8.25 -0.68 -4.79 115.22 110.90 1tya n HIS 142 Ca -0.02 0.14 -0.29 0.00 -0.26 0.00 0.00 57.72 57.29 1tya n HIS 142 Cb 0.11 -0.73 -0.17 0.00 1.12 0.00 0.00 29.99 30.33 1tya n HIS 142 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1tya s PHE 143 N -3.09 2.10 0.04 4.41 0.08 -0.76 -4.96 117.98 115.79 1tya s PHE 143 Ca 0.09 -0.73 -0.16 0.00 0.12 0.00 0.00 56.93 56.25 1tya s PHE 143 Cb 0.13 -1.42 -0.06 0.00 -0.57 0.00 0.00 43.02 41.10 1tya s PHE 143 CO 0.46 -0.28 0.47 -1.54 -0.10 0.00 0.00 175.22 174.23 1tya s SER 144 N 0.21 6.89 0.55 1.36 1.04 -1.26 -4.98 113.70 117.50 1tya s SER 144 Ca -0.11 1.06 0.22 0.00 0.48 0.00 0.00 55.95 57.61 1tya s SER 144 Cb -0.15 -2.28 1.46 0.00 0.10 0.00 0.00 66.02 65.15 1tya s SER 144 CO 0.05 0.29 2.14 0.58 0.98 0.00 0.00 173.24 177.28 1tya h VAL 145 N 3.55 0.78 -0.02 5.02 2.07 -1.98 -1.74 116.25 123.92 1tya h VAL 145 Ca -0.51 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 66.86 1tya h VAL 145 Cb 1.22 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 1tya h VAL 145 CO 0.63 0.00 -0.67 -1.13 0.02 0.00 0.00 177.57 176.41 1tya h ASN 146 N 0.00 0.12 -0.20 0.57 -0.00 -1.99 -0.83 115.58 113.25 1tya h ASN 146 Ca 0.06 -0.07 -0.09 0.00 -0.00 0.00 0.00 56.30 56.19 1tya h ASN 146 Cb 0.25 -0.03 -0.00 0.00 -0.00 0.00 0.00 38.32 38.54 1tya h ASN 146 CO -0.00 0.75 -0.24 0.22 -0.00 0.00 0.00 177.43 178.16 1tya h TYR 147 N 0.07 0.62 0.00 0.67 3.20 -1.73 -3.30 116.97 116.50 1tya h TYR 147 Ca -0.01 -0.20 -0.19 0.00 3.14 0.00 0.00 58.73 61.47 1tya h TYR 147 Cb 1.19 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.32 1tya h TYR 147 CO 0.01 0.88 -0.86 0.52 -1.64 0.00 0.00 178.16 177.07 1tya h MET 148 N 0.17 0.13 0.00 1.82 0.00 -1.41 -3.33 114.93 112.32 1tya h MET 148 Ca 0.03 -0.15 -0.09 0.00 0.00 0.00 0.00 59.70 59.48 1tya h MET 148 Cb 0.80 0.04 -0.01 0.00 0.00 0.00 0.00 31.60 32.43 1tya h MET 148 CO 0.06 0.91 -0.45 0.52 0.00 0.00 0.00 176.91 177.95 1tya h MET 149 N 0.07 0.00 0.00 1.72 2.86 -1.23 -3.13 114.93 115.22 1tya h MET 149 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1tya h MET 149 Cb 1.49 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.15 1tya h MET 149 CO 0.13 0.45 0.00 0.00 1.06 0.00 0.00 176.91 178.54 1tya h ALA 150 N 1.55 1.00 -2.67 6.32 0.00 -1.66 -3.02 119.26 120.78 1tya h ALA 150 Ca -0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.38 1tya h ALA 150 Cb 0.92 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.76 1tya h ALA 150 CO 0.06 0.00 0.89 0.15 0.00 0.00 0.00 179.25 180.35 1tya s LYS 151 N -3.41 4.19 0.23 0.00 -0.14 -1.18 -4.73 119.74 114.70 1tya s LYS 151 Ca 0.05 2.45 -0.09 0.00 -1.36 0.00 0.00 55.97 57.01 1tya s LYS 151 Cb 0.08 -3.11 0.37 0.00 -1.68 0.00 0.00 37.83 33.49 1tya s LYS 151 CO 0.59 -0.62 1.64 1.49 -0.76 0.00 0.00 175.35 177.69 1tya h GLU 152 N 6.22 0.09 -0.94 1.68 4.57 -1.91 0.68 114.58 124.98 1tya h GLU 152 Ca -0.44 -0.01 0.13 0.00 -1.18 0.00 0.00 59.36 57.87 1tya h GLU 152 Cb 1.21 -0.02 -0.09 0.00 -0.16 0.00 0.00 28.75 29.69 1tya h GLU 152 CO 0.89 0.06 0.56 0.66 -1.18 0.00 0.00 179.01 180.00 1tya h SER 153 N 0.09 0.79 0.00 1.04 4.64 -1.90 -1.94 113.55 116.27 1tya h SER 153 Ca 0.37 0.06 -0.13 0.00 -0.47 0.00 0.00 61.79 61.63 1tya h SER 153 Cb 0.63 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 1tya h SER 153 CO -0.63 0.39 -0.85 0.58 -0.87 0.00 0.00 176.83 175.45 1tya h VAL 154 N 0.85 0.68 -0.90 0.95 2.07 -1.44 -3.37 116.25 115.09 1tya h VAL 154 Ca 0.49 -1.78 0.18 0.00 0.82 0.00 0.00 66.70 66.40 1tya h VAL 154 Cb 0.56 1.55 -0.17 0.00 -1.52 0.00 0.00 31.29 31.72 1tya h VAL 154 CO -0.30 0.23 -0.24 1.56 0.02 0.00 0.00 177.57 178.84 1tya h GLN 155 N -1.00 -0.01 0.00 1.57 1.08 0.44 1.20 115.11 118.40 1tya h GLN 155 Ca -0.19 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.01 1tya h GLN 155 Cb 0.97 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 1tya h GLN 155 CO -0.12 -0.00 0.21 -1.13 -0.95 0.00 0.00 178.83 176.84 1tya n SER 156 N -5.57 0.33 0.00 1.46 3.41 -0.73 -3.66 113.62 108.86 1tya n SER 156 Ca 0.13 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 1tya n SER 156 Cb 0.45 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 1tya n SER 156 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1tya n ARG 157 N -1.98 1.12 0.30 4.33 5.12 0.41 -4.81 116.66 121.14 1tya n ARG 157 Ca -0.01 -0.22 0.19 0.00 -1.93 0.00 0.00 57.85 55.88 1tya n ARG 157 Cb 0.23 -0.67 0.85 0.00 -1.16 0.00 0.00 32.46 31.71 1tya n ARG 157 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 1tya h ILE 158 N 0.22 0.02 0.07 0.55 5.03 -1.60 2.03 117.51 123.83 1tya h ILE 158 Ca 0.00 -0.37 -0.36 0.00 -0.12 0.00 0.00 64.86 64.01 1tya h ILE 158 Cb 0.11 1.36 -0.04 0.00 -3.03 0.00 0.00 36.82 35.22 1tya h ILE 158 CO 0.00 0.00 -2.09 -1.84 -0.68 0.00 0.00 178.15 173.54 1tya n GLU 159 N -3.10 0.70 -0.34 2.37 -0.00 -1.26 -3.82 120.64 115.20 1tya n GLU 159 Ca -0.01 0.26 -0.04 0.00 -0.00 0.00 0.00 57.16 57.38 1tya n GLU 159 Cb 0.24 -1.65 0.09 0.00 -0.00 0.00 0.00 31.44 30.12 1tya n GLU 159 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.13 178.92 1tya h THR 160 N -0.14 1.25 0.00 3.84 1.35 -1.83 -3.48 112.91 113.91 1tya h THR 160 Ca -0.48 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 1tya h THR 160 Cb 1.89 -0.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1tya h THR 160 CO -0.03 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 176.12 1tya n GLY 161 N -1.20 2.55 3.54 5.82 0.00 0.69 -5.03 105.19 111.56 1tya n GLY 161 Ca 0.10 -1.69 -0.05 0.00 0.00 0.00 0.00 46.02 44.38 1tya n GLY 161 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1tya s ILE 162 N -1.69 -0.52 1.00 -0.61 2.07 -1.25 -4.69 121.20 115.51 1tya s ILE 162 Ca 0.00 0.04 -0.12 0.00 -1.41 0.00 0.00 60.65 59.16 1tya s ILE 162 Cb 0.00 -0.90 0.19 0.00 0.13 0.00 0.00 42.46 41.88 1tya s ILE 162 CO 0.00 0.02 1.08 -0.94 -1.91 0.00 0.00 174.94 173.19 1tya s SER 163 N 2.29 2.45 0.41 4.50 1.04 -1.26 -4.87 113.70 118.26 1tya s SER 163 Ca -0.07 1.58 0.15 0.00 0.48 0.00 0.00 55.95 58.09 1tya s SER 163 Cb -0.09 -2.24 0.87 0.00 0.10 0.00 0.00 66.02 64.66 1tya s SER 163 CO -0.18 -3.29 1.89 0.15 0.98 0.00 0.00 173.24 172.79 1tya h PHE 164 N -2.00 0.00 0.19 5.02 3.04 -2.02 -2.42 116.94 118.76 1tya h PHE 164 Ca -0.53 0.00 0.01 0.00 3.98 0.00 0.00 57.97 61.43 1tya h PHE 164 Cb 1.30 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 39.77 1tya h PHE 164 CO 0.37 0.30 -0.52 1.15 -2.02 0.00 0.00 178.31 177.59 1tya h THR 165 N 0.00 0.00 -0.10 4.41 2.02 -1.95 -0.79 112.91 116.49 1tya h THR 165 Ca -0.00 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.05 1tya h THR 165 Cb 0.56 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1tya h THR 165 CO 0.04 0.00 -0.51 -0.33 0.37 0.00 0.00 175.52 175.09 1tya h GLU 166 N -0.79 0.28 0.00 6.66 5.08 -1.79 -2.86 114.58 121.16 1tya h GLU 166 Ca -0.02 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.15 1tya h GLU 166 Cb 0.77 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1tya h GLU 166 CO -0.24 0.73 -0.14 0.35 -1.00 0.00 0.00 179.01 178.71 1tya h PHE 167 N 0.22 0.00 0.00 4.33 3.57 -0.99 -2.39 116.94 121.69 1tya h PHE 167 Ca 0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1tya h PHE 167 Cb 0.98 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.72 1tya h PHE 167 CO 0.02 0.14 -0.48 0.77 -2.23 0.00 0.00 178.31 176.54 1tya h SER 168 N 0.00 0.00 -0.94 0.41 0.02 -1.01 -3.38 113.55 108.65 1tya h SER 168 Ca -0.00 -0.01 0.19 0.00 -0.84 0.00 0.00 61.79 61.13 1tya h SER 168 Cb 0.26 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 62.62 1tya h SER 168 CO 0.02 0.00 -0.24 0.22 -1.14 0.00 0.00 176.83 175.69 1tya h TYR 169 N 0.00 -0.53 -0.73 3.45 5.03 -1.20 0.15 116.97 123.15 1tya h TYR 169 Ca 0.00 0.09 0.16 0.00 2.58 0.00 0.00 58.73 61.55 1tya h TYR 169 Cb 0.99 0.38 -0.04 0.00 1.55 0.00 0.00 36.73 39.60 1tya h TYR 169 CO 0.00 -0.40 0.49 0.00 -1.32 0.00 0.00 178.16 176.93 1tya h MET 170 N -0.00 0.31 -0.54 1.82 -0.00 -1.77 -1.92 114.93 112.83 1tya h MET 170 Ca 0.44 -0.02 -0.00 0.00 -0.00 0.00 0.00 59.70 60.12 1tya h MET 170 Cb 0.68 -0.07 -0.03 0.00 -0.00 0.00 0.00 31.60 32.19 1tya h MET 170 CO -0.97 0.21 0.32 0.52 -0.00 0.00 0.00 176.91 176.99 1tya h MET 171 N 0.32 0.73 0.31 -0.10 2.86 -1.00 0.50 114.93 118.55 1tya h MET 171 Ca 0.36 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.92 1tya h MET 171 Cb 0.94 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 32.44 1tya h MET 171 CO -0.10 0.54 -0.19 -0.07 1.06 0.00 0.00 176.91 178.15 1tya h LEU 172 N 0.72 -0.47 -0.58 1.22 3.38 -1.42 0.57 115.31 118.73 1tya h LEU 172 Ca 0.19 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 1tya h LEU 172 Cb -0.00 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1tya h LEU 172 CO -0.03 -0.30 0.06 -0.61 0.09 0.00 0.00 178.44 177.64 1tya h GLN 173 N -0.48 0.99 -0.43 1.13 4.15 -1.40 -0.44 115.11 118.63 1tya h GLN 173 Ca -0.03 -0.29 0.09 0.00 0.77 0.00 0.00 58.65 59.19 1tya h GLN 173 Cb 0.39 -0.10 -0.08 0.00 0.21 0.00 0.00 27.48 27.90 1tya h GLN 173 CO 0.03 0.96 -0.07 0.00 -1.93 0.00 0.00 178.83 177.82 1tya h ALA 174 N 0.99 0.33 -0.92 3.38 0.00 0.75 -1.53 119.26 122.26 1tya h ALA 174 Ca 0.17 0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.24 1tya h ALA 174 Cb 0.47 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1tya h ALA 174 CO 0.02 -0.43 0.59 -0.92 0.00 0.00 0.00 179.25 178.51 1tya h TYR 175 N 0.03 1.17 -0.43 0.00 3.20 0.57 -2.83 116.97 118.69 1tya h TYR 175 Ca 0.21 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.16 1tya h TYR 175 Cb 0.32 -0.39 -0.05 0.00 1.54 0.00 0.00 36.73 38.14 1tya h TYR 175 CO -0.35 0.75 0.12 -0.44 -1.64 0.00 0.00 178.16 176.60 1tya h ASP 176 N 1.25 0.09 -0.99 -2.11 3.32 -0.06 -1.35 116.42 116.57 1tya h ASP 176 Ca 0.33 0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.48 1tya h ASP 176 Cb -0.12 0.06 -0.06 0.00 0.22 0.00 0.00 39.33 39.44 1tya h ASP 176 CO -0.07 0.09 0.65 0.15 -1.72 0.00 0.00 179.24 178.33 1tya h PHE 177 N 0.27 1.22 -0.46 4.55 3.04 -1.23 -2.07 116.94 122.25 1tya h PHE 177 Ca 0.20 0.03 -0.09 0.00 3.98 0.00 0.00 57.97 62.09 1tya h PHE 177 Cb 0.22 -0.41 -0.02 0.00 2.56 0.00 0.00 35.95 38.31 1tya h PHE 177 CO -0.18 0.71 -0.06 1.25 -2.02 0.00 0.00 178.31 178.01 1tya h LEU 178 N 1.26 0.85 -0.53 0.59 5.85 -1.22 0.60 115.31 122.72 1tya h LEU 178 Ca 0.39 -0.34 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1tya h LEU 178 Cb -0.01 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 1tya h LEU 178 CO -0.12 0.99 0.13 0.03 -0.34 0.00 0.00 178.44 179.13 1tya h ARG 179 N 0.70 0.84 -0.19 1.25 2.47 -0.92 -1.24 114.38 117.29 1tya h ARG 179 Ca 0.12 -0.20 -0.16 0.00 -1.26 0.00 0.00 59.98 58.48 1tya h ARG 179 Cb 0.59 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.79 1tya h ARG 179 CO 0.04 0.80 -0.54 -0.07 0.56 0.00 0.00 179.97 180.76 1tya h LEU 180 N 0.74 0.61 -0.26 3.04 3.38 -1.38 0.20 115.31 121.64 1tya h LEU 180 Ca 0.17 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1tya h LEU 180 Cb 0.34 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1tya h LEU 180 CO 0.00 1.03 0.08 0.22 0.09 0.00 0.00 178.44 179.87 1tya h TYR 181 N 0.43 0.42 0.06 1.13 5.03 -0.77 -1.41 116.97 121.86 1tya h TYR 181 Ca 0.01 -0.04 -0.00 0.00 2.58 0.00 0.00 58.73 61.28 1tya h TYR 181 Cb 1.08 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 39.23 1tya h TYR 181 CO 0.04 0.46 -0.03 0.93 -1.32 0.00 0.00 178.16 178.25 1tya h GLU 182 N 0.26 -0.08 0.00 1.82 5.08 -0.98 -2.90 114.58 117.78 1tya h GLU 182 Ca 0.09 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1tya h GLU 182 Cb 0.24 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1tya h GLU 182 CO -0.00 0.52 -0.24 1.79 -1.00 0.00 0.00 179.01 180.07 1tya h THR 183 N -0.81 0.00 0.00 1.13 1.35 -0.71 -3.37 112.91 110.50 1tya h THR 183 Ca -0.01 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 1tya h THR 183 Cb 0.63 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 1tya h THR 183 CO 0.01 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.66 1tya n GLU 184 N -2.41 0.67 -1.98 4.72 -0.58 -0.60 -5.02 120.64 115.45 1tya n GLU 184 Ca 0.04 -0.72 -0.18 0.00 -0.42 0.00 0.00 57.16 55.88 1tya n GLU 184 Cb 0.46 -0.80 -0.04 0.00 -0.57 0.00 0.00 31.44 30.49 1tya n GLU 184 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tya n GLY 185 N -0.16 0.55 3.64 0.62 0.00 -1.06 -4.86 105.19 103.92 1tya n GLY 185 Ca 0.00 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1tya n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tya n ARG 187 N 7.46 0.57 -3.78 0.00 5.12 -0.79 -4.11 116.66 121.13 1tya n ARG 187 Ca 0.18 -1.08 -0.13 0.00 -1.93 0.00 0.00 57.85 54.89 1tya n ARG 187 Cb 0.44 -1.12 -0.13 0.00 -1.16 0.00 0.00 32.46 30.49 1tya n ARG 187 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1tya s LEU 188 N -0.62 0.96 -0.02 0.55 2.96 -1.19 -0.34 118.68 120.98 1tya s LEU 188 Ca 0.08 0.41 0.06 0.00 -0.22 0.00 0.00 54.13 54.46 1tya s LEU 188 Cb 0.05 0.63 -0.01 0.00 0.50 0.00 0.00 46.19 47.36 1tya s LEU 188 CO 0.08 -0.11 -0.19 -1.58 -1.32 0.00 0.00 176.35 173.24 1tya s GLN 189 N 0.57 1.55 0.28 1.98 0.74 -0.94 -2.43 119.66 121.40 1tya s GLN 189 Ca -0.04 -0.66 0.07 0.00 0.05 0.00 0.00 55.36 54.78 1tya s GLN 189 Cb -0.05 -1.48 -0.06 0.00 1.10 0.00 0.00 33.01 32.52 1tya s GLN 189 CO -0.03 0.39 -0.07 0.96 -0.55 0.00 0.00 175.29 175.99 1tya s ILE 190 N -0.39 1.70 -0.04 -2.34 -4.36 -0.78 -2.29 121.20 112.69 1tya s ILE 190 Ca 0.06 -2.14 -0.29 0.00 -0.26 0.00 0.00 60.65 58.02 1tya s ILE 190 Cb -0.08 -2.42 0.10 0.00 1.25 0.00 0.00 42.46 41.31 1tya s ILE 190 CO -0.00 -0.32 1.31 -0.83 0.24 0.00 0.00 174.94 175.34 1tya s GLY 191 N -3.44 -0.19 1.11 6.27 0.00 -0.70 -4.43 107.32 105.93 1tya s GLY 191 Ca 0.29 0.17 -0.16 0.00 0.00 0.00 0.00 44.72 45.02 1tya s GLY 191 CO 0.12 5.11 1.12 -0.32 0.00 0.00 0.00 173.10 179.12 1tya s GLY 192 N -3.72 1.58 0.26 0.20 0.00 -1.26 0.44 107.32 104.83 1tya s GLY 192 Ca 0.28 -0.74 -0.01 0.00 0.00 0.00 0.00 44.72 44.25 1tya s GLY 192 CO -0.02 0.03 1.73 1.76 0.00 0.00 0.00 173.10 176.60 1tya h SER 193 N -2.25 0.35 0.72 1.64 0.02 -0.88 -2.39 113.55 110.75 1tya h SER 193 Ca -0.49 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1tya h SER 193 Cb 1.31 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.93 1tya h SER 193 CO 0.44 0.10 0.00 -0.90 -1.14 0.00 0.00 176.83 175.33 1tya n ASP 194 N -4.99 0.18 -0.38 3.07 5.68 -1.26 -3.46 116.55 115.39 1tya n ASP 194 Ca 0.17 0.54 0.13 0.00 -0.50 0.00 0.00 54.79 55.13 1tya n ASP 194 Cb 0.50 -0.58 0.42 0.00 -1.14 0.00 0.00 41.12 40.32 1tya n ASP 194 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1tya n GLN 195 N -1.69 1.27 -0.12 0.11 1.13 -0.90 -4.55 117.38 112.62 1tya n GLN 195 Ca 0.04 -0.77 -0.05 0.00 -1.94 0.00 0.00 57.00 54.28 1tya n GLN 195 Cb 0.24 -1.48 0.01 0.00 0.11 0.00 0.00 30.24 29.12 1tya n GLN 195 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 1tya h TRP 196 N 1.88 -0.40 -0.62 1.08 2.91 -1.73 -1.41 115.95 117.65 1tya h TRP 196 Ca 0.00 0.04 0.07 0.00 1.13 0.00 0.00 58.89 60.13 1tya h TRP 196 Cb 0.53 0.24 -0.06 0.00 -0.51 0.00 0.00 29.16 29.36 1tya h TRP 196 CO 0.00 -0.25 0.31 0.78 -1.03 0.00 0.00 178.44 178.25 1tya h GLY 197 N -0.08 0.90 1.66 2.65 0.00 -1.90 0.90 103.07 107.20 1tya h GLY 197 Ca 0.20 -0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1tya h GLY 197 CO -0.47 0.08 -0.33 3.43 0.00 0.00 0.00 176.54 179.26 1tya h ASN 198 N 0.56 0.40 0.12 0.19 2.35 -1.76 -1.54 115.58 115.89 1tya h ASN 198 Ca 0.29 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 1tya h ASN 198 Cb 0.26 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1tya h ASN 198 CO -0.22 0.71 -0.06 0.40 -1.65 0.00 0.00 177.43 176.61 1tya h ILE 199 N 0.34 1.05 -0.15 2.81 2.04 -0.79 -2.63 117.51 120.18 1tya h ILE 199 Ca 0.04 -1.20 -0.02 0.00 1.00 0.00 0.00 64.86 64.68 1tya h ILE 199 Cb 0.74 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.56 1tya h ILE 199 CO 0.06 0.26 -0.00 0.71 0.00 0.00 0.00 178.15 179.18 1tya h THR 200 N -0.77 1.10 -0.64 -0.27 1.35 -0.85 -0.84 112.91 111.99 1tya h THR 200 Ca -0.02 -0.39 -0.07 0.00 -0.55 0.00 0.00 66.41 65.39 1tya h THR 200 Cb 0.55 1.00 -0.03 0.00 -1.73 0.00 0.00 68.15 67.94 1tya h THR 200 CO 0.03 0.13 0.13 0.00 -0.25 0.00 0.00 175.52 175.55 1tya h ALA 201 N 1.80 1.02 -0.38 6.62 0.00 -1.27 0.97 119.26 128.02 1tya h ALA 201 Ca 0.05 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 1tya h ALA 201 Cb 0.15 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1tya h ALA 201 CO 0.00 0.63 -0.09 0.78 0.00 0.00 0.00 179.25 180.57 1tya h GLY 202 N 1.04 0.71 1.30 0.00 0.00 -0.80 -0.14 103.07 105.19 1tya h GLY 202 Ca 0.20 -0.51 -0.13 0.00 0.00 0.00 0.00 47.33 46.89 1tya h GLY 202 CO 0.01 0.47 -0.32 1.41 0.00 0.00 0.00 176.54 178.11 1tya h LEU 203 N 0.61 0.81 -0.26 3.11 3.38 -0.71 -0.87 115.31 121.38 1tya h LEU 203 Ca 0.11 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1tya h LEU 203 Cb 0.52 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1tya h LEU 203 CO 0.03 1.07 0.02 -0.08 0.09 0.00 0.00 178.44 179.56 1tya h GLU 204 N 0.66 0.45 -0.39 1.13 4.57 -0.52 -0.29 114.58 120.18 1tya h GLU 204 Ca 0.07 -0.13 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1tya h GLU 204 Cb 0.85 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.38 1tya h GLU 204 CO 0.07 0.60 0.25 1.25 -1.18 0.00 0.00 179.01 180.00 1tya h LEU 205 N 0.24 0.46 0.31 1.64 5.85 -0.86 -0.66 115.31 122.29 1tya h LEU 205 Ca 0.08 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1tya h LEU 205 Cb 0.38 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1tya h LEU 205 CO 0.01 0.34 -0.15 0.40 -0.34 0.00 0.00 178.44 178.70 1tya h ILE 206 N 0.53 0.69 -0.25 4.05 2.04 -1.01 -2.01 117.51 121.54 1tya h ILE 206 Ca 0.14 -0.01 0.06 0.00 1.00 0.00 0.00 64.86 66.06 1tya h ILE 206 Cb -0.04 0.70 -0.07 0.00 -0.74 0.00 0.00 36.82 36.66 1tya h ILE 206 CO -0.03 0.00 -0.29 -0.09 0.00 0.00 0.00 178.15 177.75 1tya h ARG 207 N -0.43 -0.28 0.00 2.37 2.43 -0.95 0.11 114.38 117.63 1tya h ARG 207 Ca -0.04 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1tya h ARG 207 Cb 0.33 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1tya h ARG 207 CO 0.07 -0.19 0.00 1.63 -1.51 0.00 0.00 179.97 179.97 1tya n LYS 208 N -5.40 0.15 -0.02 0.20 5.02 -0.26 0.57 118.16 118.43 1tya n LYS 208 Ca -0.01 0.44 0.04 0.00 -2.02 0.00 0.00 58.31 56.76 1tya n LYS 208 Cb 0.31 -1.82 -0.10 0.00 -0.02 0.00 0.00 35.03 33.40 1tya n LYS 208 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1tya n THR 209 N -2.12 0.16 0.00 -0.18 -1.04 -0.77 -4.81 114.28 105.52 1tya n THR 209 Ca 0.02 -0.33 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 1tya n THR 209 Cb 0.18 0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.73 1tya n THR 209 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1tya n LYS 210 N -2.03 0.00 -2.49 -2.82 4.76 0.31 -5.09 118.16 110.79 1tya n LYS 210 Ca -0.06 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.36 1tya n LYS 210 Cb 0.44 -0.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.96 1tya n LYS 210 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1tya n GLY 211 N 3.14 -3.16 0.00 0.72 0.00 0.19 -5.04 105.19 101.05 1tya n GLY 211 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1tya n GLY 211 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1tya n ARG 214 N 0.28 0.00 -4.27 1.61 1.85 -1.26 -4.94 116.66 109.93 1tya n ARG 214 Ca 0.03 0.00 -0.16 0.00 -1.00 0.00 0.00 57.85 56.72 1tya n ARG 214 Cb 0.11 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.42 1tya n ARG 214 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1tya s ALA 215 N -0.99 1.59 0.28 2.89 0.00 -1.26 -4.87 121.76 119.40 1tya s ALA 215 Ca 0.00 -1.48 0.02 0.00 0.00 0.00 0.00 51.96 50.50 1tya s ALA 215 Cb 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.06 1tya s ALA 215 CO 0.00 -0.01 0.10 -0.06 0.00 0.00 0.00 175.76 175.79 1tya s PHE 216 N -2.97 1.60 -0.03 0.00 0.40 0.53 -4.99 117.98 112.52 1tya s PHE 216 Ca 0.16 -1.19 -0.03 0.00 -0.60 0.00 0.00 56.93 55.27 1tya s PHE 216 Cb 0.00 -0.94 0.01 0.00 0.51 0.00 0.00 43.02 42.60 1tya s PHE 216 CO 0.03 -0.33 0.08 0.20 0.70 0.00 0.00 175.22 175.89 1tya s GLY 217 N -3.35 -0.05 -0.02 4.36 0.00 -1.26 -2.22 107.32 104.78 1tya s GLY 217 Ca 0.37 0.18 0.01 0.00 0.00 0.00 0.00 44.72 45.28 1tya s GLY 217 CO 0.14 0.15 -0.04 -2.27 0.00 0.00 0.00 173.10 171.08 1tya s LEU 218 N -0.05 1.71 0.06 0.66 0.20 -0.97 -1.25 118.68 119.03 1tya s LEU 218 Ca -0.01 -0.08 0.09 0.00 0.69 0.00 0.00 54.13 54.82 1tya s LEU 218 Cb -0.01 -0.28 -0.03 0.00 -0.43 0.00 0.00 46.19 45.44 1tya s LEU 218 CO 0.00 0.01 -0.26 0.42 -0.29 0.00 0.00 176.35 176.23 1tya s THR 219 N 0.31 2.12 0.06 3.68 -4.23 -0.70 -1.73 115.64 115.14 1tya s THR 219 Ca -0.03 -1.44 -0.10 0.00 -1.18 0.00 0.00 61.69 58.94 1tya s THR 219 Cb -0.07 -1.82 -0.06 0.00 1.34 0.00 0.00 72.50 71.89 1tya s THR 219 CO -0.00 0.30 0.37 -0.63 -0.54 0.00 0.00 174.62 174.12 1tya s ILE 220 N -0.85 5.13 0.60 2.99 -1.09 0.17 -0.56 121.20 127.59 1tya s ILE 220 Ca 0.12 0.43 -0.14 0.00 -2.23 0.00 0.00 60.65 58.83 1tya s ILE 220 Cb -0.10 -3.63 -0.04 0.00 -1.58 0.00 0.00 42.46 37.11 1tya s ILE 220 CO 0.03 0.33 1.03 -2.16 -1.23 0.00 0.00 174.94 172.94 1tya s PRO 221 N -1.79 3.53 0.21 2.79 0.04 -1.26 -0.20 135.00 138.31 1tya s PRO 221 Ca 0.31 0.94 -0.32 0.00 0.04 0.00 0.00 61.00 61.97 1tya s PRO 221 Cb -0.14 -2.07 -0.11 0.00 0.04 0.00 0.00 34.50 32.22 1tya s PRO 221 CO 0.17 -0.62 1.65 -1.17 0.04 0.00 0.00 177.00 177.07 1tya s LEU 222 N -4.77 4.37 -0.04 -3.56 0.20 -1.26 -4.77 118.68 108.85 1tya s LEU 222 Ca 0.58 2.80 -0.30 0.00 0.69 0.00 0.00 54.13 57.90 1tya s LEU 222 Cb -0.12 -3.60 -0.05 0.00 -0.43 0.00 0.00 46.19 41.99 1tya s LEU 222 CO 0.44 -0.91 1.42 -0.69 -0.29 0.00 0.00 176.35 176.31 1tya s VAL 223 N 0.96 3.81 0.37 1.68 1.01 -1.26 -5.00 120.40 121.97 1tya s VAL 223 Ca 0.71 1.12 0.03 0.00 0.00 0.00 0.00 61.98 63.84 1tya s VAL 223 Cb -0.47 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 1tya s VAL 223 CO 0.34 -0.04 0.55 0.42 0.00 0.00 0.00 175.10 176.37 1tya s THR 224 N 2.91 4.38 0.02 3.92 -4.23 -1.26 -4.37 115.64 117.01 1tya s THR 224 Ca 0.64 -0.71 0.07 0.00 -1.18 0.00 0.00 61.69 60.50 1tya s THR 224 Cb -0.30 -3.57 -0.02 0.00 1.34 0.00 0.00 72.50 69.95 1tya s THR 224 CO 0.25 -0.32 -0.21 -0.54 -0.54 0.00 0.00 174.62 173.26 1tya s LYS 225 N -4.32 1.53 0.35 3.99 1.02 -1.26 -4.94 119.74 116.12 1tya s LYS 225 Ca 0.44 -0.85 0.14 0.00 0.02 0.00 0.00 55.97 55.73 1tya s LYS 225 Cb -0.10 -1.57 0.66 0.00 -0.52 0.00 0.00 37.83 36.31 1tya s LYS 225 CO 0.34 0.41 1.76 0.00 -0.92 0.00 0.00 175.35 176.95 1tya h ALA 226 N 5.23 1.18 0.00 5.17 0.00 -1.93 -2.80 119.26 126.11 1tya h ALA 226 Ca -0.41 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.11 1tya h ALA 226 Cb 1.15 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1tya h ALA 226 CO 0.46 0.53 0.00 -0.40 0.00 0.00 0.00 179.25 179.84 1tya n ASP 227 N -3.87 0.00 -0.56 0.00 5.75 -1.26 -4.92 116.55 111.69 1tya n ASP 227 Ca -0.01 0.46 -0.06 0.00 -0.01 0.00 0.00 54.79 55.17 1tya n ASP 227 Cb 0.47 -0.49 -0.01 0.00 -1.03 0.00 0.00 41.12 40.07 1tya n ASP 227 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tya n GLY 228 N 1.04 0.47 4.02 6.12 0.00 -1.06 -5.04 105.19 110.74 1tya n GLY 228 Ca 0.06 -0.72 -0.19 0.00 0.00 0.00 0.00 46.02 45.17 1tya n GLY 228 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tya s THR 229 N -2.26 2.39 -0.38 2.61 -4.23 -1.26 -5.02 115.64 107.50 1tya s THR 229 Ca 0.00 -0.95 -0.29 0.00 -1.18 0.00 0.00 61.69 59.27 1tya s THR 229 Cb 0.00 -2.44 0.02 0.00 1.34 0.00 0.00 72.50 71.42 1tya s THR 229 CO 0.00 0.00 1.15 -0.75 -0.54 0.00 0.00 174.62 174.48 1tya s LYS 230 N -4.62 3.90 0.26 3.99 2.47 -1.26 -4.40 119.74 120.08 1tya s LYS 230 Ca 0.60 0.92 -0.31 0.00 -1.56 0.00 0.00 55.97 55.62 1tya s LYS 230 Cb -0.07 -3.83 -0.13 0.00 -1.46 0.00 0.00 37.83 32.34 1tya s LYS 230 CO 0.38 -1.14 1.48 0.34 0.16 0.00 0.00 175.35 176.57 1tya n PHE 231 N 7.42 2.40 -0.15 4.03 7.35 -1.26 -0.67 117.46 136.59 1tya n PHE 231 Ca 0.13 0.37 0.00 0.00 -0.76 0.00 0.00 57.45 57.18 1tya n PHE 231 Cb 0.48 -2.51 0.00 0.00 0.35 0.00 0.00 39.48 37.80 1tya n PHE 231 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1tya n GLY 232 N 2.18 2.10 3.53 7.13 0.00 -1.26 -4.98 105.19 113.90 1tya n GLY 232 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1tya n GLY 232 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tya s LYS 233 N -0.20 3.58 0.45 1.61 0.00 0.16 -4.41 119.74 120.92 1tya s LYS 233 Ca 0.00 -1.25 0.03 0.00 0.00 0.00 0.00 55.97 54.76 1tya s LYS 233 Cb 0.00 -5.21 0.01 0.00 0.00 0.00 0.00 37.83 32.62 1tya s LYS 233 CO 0.00 -2.10 0.64 0.99 0.00 0.00 0.00 175.35 174.88 1tya s THR 234 N 4.45 3.46 0.07 3.79 2.01 -1.26 -4.88 115.64 123.27 1tya s THR 234 Ca 0.42 -0.74 0.16 0.00 0.31 0.00 0.00 61.69 61.85 1tya s THR 234 Cb -0.02 -3.24 0.07 0.00 0.01 0.00 0.00 72.50 69.32 1tya s THR 234 CO -0.09 -0.14 1.59 1.05 -0.69 0.00 0.00 174.62 176.34 1tya h GLU 235 N 0.45 0.00 -0.07 4.92 9.09 -2.02 -2.87 114.58 124.08 1tya h GLU 235 Ca -0.44 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 58.86 1tya h GLU 235 Cb 1.27 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.36 1tya h GLU 235 CO 0.53 0.49 -0.45 0.66 0.05 0.00 0.00 179.01 180.29 1tya h SER 236 N 0.00 0.18 -5.00 3.06 4.64 -1.98 -3.50 113.55 110.95 1tya h SER 236 Ca -0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1tya h SER 236 Cb 1.15 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1tya h SER 236 CO 0.06 0.61 0.00 0.61 -0.87 0.00 0.00 176.83 177.24 1tya n GLY 237 N -0.13 -0.78 3.58 -0.77 0.00 -1.08 -5.05 105.19 100.95 1tya n GLY 237 Ca -0.02 -2.22 -0.41 0.00 0.00 0.00 0.00 46.02 43.37 1tya n GLY 237 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1tya n THR 238 N -0.22 2.40 -3.13 2.61 -1.04 -1.26 -4.19 114.28 109.45 1tya n THR 238 Ca 0.00 -0.50 -0.45 0.00 -2.04 0.00 0.00 64.05 61.06 1tya n THR 238 Cb 0.00 -1.05 -0.04 0.00 -1.82 0.00 0.00 70.33 67.42 1tya n THR 238 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1tya s ILE 239 N -1.31 4.93 0.69 12.58 -1.09 -1.26 -4.91 121.20 130.82 1tya s ILE 239 Ca 0.64 -1.25 -0.11 0.00 -2.23 0.00 0.00 60.65 57.71 1tya s ILE 239 Cb -0.56 -4.50 0.01 0.00 -1.58 0.00 0.00 42.46 35.83 1tya s ILE 239 CO 0.56 -1.13 1.07 0.26 -1.23 0.00 0.00 174.94 174.47 1tya s TRP 240 N 2.33 3.32 -1.53 3.97 0.52 -1.26 -2.12 118.94 124.17 1tya s TRP 240 Ca 0.13 0.99 0.24 0.00 0.02 0.00 0.00 56.10 57.49 1tya s TRP 240 Cb -0.21 -3.02 0.37 0.00 -1.15 0.00 0.00 33.47 29.46 1tya s TRP 240 CO 0.03 -1.12 1.32 1.28 0.02 0.00 0.00 176.95 178.48 1tya n LEU 241 N -2.94 1.13 -4.64 2.99 4.77 -1.13 -4.63 117.00 112.55 1tya n LEU 241 Ca 0.07 -0.35 -0.40 0.00 -0.03 0.00 0.00 56.01 55.29 1tya n LEU 241 Cb 0.57 -0.10 -0.07 0.00 -2.33 0.00 0.00 43.42 41.49 1tya n LEU 241 CO 0.57 0.23 0.34 -0.62 -1.33 0.00 0.00 177.39 176.57 1tya s ASP 242 N -2.69 6.57 0.00 -1.43 -1.08 -1.26 -4.93 116.67 111.84 1tya s ASP 242 Ca 0.17 0.70 0.12 0.00 -0.52 0.00 0.00 52.55 53.01 1tya s ASP 242 Cb 0.18 -2.32 0.51 0.00 -1.46 0.00 0.00 42.92 39.83 1tya s ASP 242 CO 0.63 -0.30 1.36 2.29 0.52 0.00 0.00 175.17 179.66 1tya n LYS 243 N 5.39 0.03 0.00 4.34 2.85 -1.25 -1.22 118.16 128.30 1tya n LYS 243 Ca -0.02 0.28 0.11 0.00 -1.05 0.00 0.00 58.31 57.63 1tya n LYS 243 Cb 0.49 -1.50 0.04 0.00 -0.65 0.00 0.00 35.03 33.41 1tya n LYS 243 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1tya n GLU 244 N -1.46 0.03 -0.10 -1.58 1.02 -1.26 -3.58 120.64 113.71 1tya n GLU 244 Ca 0.03 -0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.01 1tya n GLU 244 Cb 0.13 -1.51 -0.09 0.00 -0.02 0.00 0.00 31.44 29.95 1tya n GLU 244 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1tya n LYS 245 N -1.55 0.48 -3.78 3.49 5.02 -0.52 -4.89 118.16 116.42 1tya n LYS 245 Ca 0.04 0.14 -0.29 0.00 -2.02 0.00 0.00 58.31 56.18 1tya n LYS 245 Cb 0.34 -1.36 -0.16 0.00 -0.02 0.00 0.00 35.03 33.84 1tya n LYS 245 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1tya s THR 246 N -2.39 0.88 0.71 -0.18 2.01 -0.36 -4.92 115.64 111.39 1tya s THR 246 Ca -0.28 -1.04 -0.15 0.00 0.31 0.00 0.00 61.69 60.54 1tya s THR 246 Cb 0.08 -1.45 0.03 0.00 0.01 0.00 0.00 72.50 71.17 1tya s THR 246 CO 0.43 -0.38 1.18 -0.94 -0.69 0.00 0.00 174.62 174.23 1tya s SER 247 N 1.66 4.44 0.41 3.53 1.04 -1.23 -3.92 113.70 119.63 1tya s SER 247 Ca 0.02 2.25 0.16 0.00 0.48 0.00 0.00 55.95 58.87 1tya s SER 247 Cb -0.18 -2.58 1.04 0.00 0.10 0.00 0.00 66.02 64.41 1tya s SER 247 CO -0.14 -2.09 1.85 -0.65 0.98 0.00 0.00 173.24 173.19 1tya h PRO 248 N -0.21 0.44 -0.27 4.02 0.11 -1.91 0.11 132.00 134.28 1tya h PRO 248 Ca -0.47 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1tya h PRO 248 Cb 1.28 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1tya h PRO 248 CO 0.51 0.29 -0.01 -0.92 -0.21 0.00 0.00 178.00 177.66 1tya h TYR 249 N 0.45 0.53 -0.51 0.65 3.20 -1.90 -0.39 116.97 119.00 1tya h TYR 249 Ca 0.48 -0.09 -0.13 0.00 3.14 0.00 0.00 58.73 62.13 1tya h TYR 249 Cb 1.12 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.24 1tya h TYR 249 CO -0.00 0.64 -0.17 0.93 -1.64 0.00 0.00 178.16 177.91 1tya h GLU 250 N 0.26 1.02 0.35 1.82 5.08 -1.46 0.18 114.58 121.83 1tya h GLU 250 Ca 0.08 -0.41 -0.01 0.00 -1.00 0.00 0.00 59.36 58.01 1tya h GLU 250 Cb 0.43 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1tya h GLU 250 CO 0.02 1.10 -0.23 0.35 -1.00 0.00 0.00 179.01 179.24 1tya h PHE 251 N 0.89 -0.61 -0.48 4.33 3.57 -0.80 0.38 116.94 124.22 1tya h PHE 251 Ca 0.12 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.68 1tya h PHE 251 Cb 0.75 0.22 -0.05 0.00 2.79 0.00 0.00 35.95 39.66 1tya h PHE 251 CO 0.05 -0.36 0.18 -0.92 -2.23 0.00 0.00 178.31 175.03 1tya h TYR 252 N -0.57 0.32 -0.68 0.41 3.20 -0.96 -2.24 116.97 116.45 1tya h TYR 252 Ca -0.03 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 1tya h TYR 252 Cb 0.48 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.65 1tya h TYR 252 CO -0.11 0.12 0.17 1.96 -1.64 0.00 0.00 178.16 178.66 1tya h GLN 253 N 0.36 1.09 -0.33 1.82 1.08 -0.74 -1.18 115.11 117.21 1tya h GLN 253 Ca 0.22 -0.26 0.07 0.00 -1.45 0.00 0.00 58.65 57.24 1tya h GLN 253 Cb 0.22 -0.14 -0.08 0.00 -0.05 0.00 0.00 27.48 27.43 1tya h GLN 253 CO -0.22 0.96 -0.19 0.35 -0.95 0.00 0.00 178.83 178.79 1tya h PHE 254 N 1.02 -0.47 -0.37 2.96 3.57 -0.31 -1.05 116.94 122.29 1tya h PHE 254 Ca 0.21 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.70 1tya h PHE 254 Cb 0.36 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 1tya h PHE 254 CO 0.03 -0.26 0.02 -1.49 -2.23 0.00 0.00 178.31 174.37 1tya h TRP 255 N -0.14 0.69 -0.33 0.41 4.06 -1.36 -3.07 115.95 116.22 1tya h TRP 255 Ca 0.17 -0.11 0.04 0.00 2.06 0.00 0.00 58.89 61.05 1tya h TRP 255 Cb 0.40 -0.18 -0.02 0.00 -1.00 0.00 0.00 29.16 28.36 1tya h TRP 255 CO -0.39 0.72 0.22 0.97 -3.56 0.00 0.00 178.44 176.40 1tya h ILE 256 N 0.46 0.98 -0.05 1.49 2.10 -0.73 -0.56 117.51 121.21 1tya h ILE 256 Ca 0.11 -0.10 0.00 0.00 1.08 0.00 0.00 64.86 65.95 1tya h ILE 256 Cb 0.43 0.68 0.00 0.00 -1.09 0.00 0.00 36.82 36.84 1tya h ILE 256 CO 0.01 0.05 0.00 0.59 -1.08 0.00 0.00 178.15 177.73 1tya n ASN 257 N -4.49 0.76 -4.76 2.19 5.03 -0.44 -4.86 115.26 108.69 1tya n ASN 257 Ca 0.03 -2.03 -0.41 0.00 0.87 0.00 0.00 54.58 53.04 1tya n ASN 257 Cb 0.20 -0.24 -0.02 0.00 -1.02 0.00 0.00 39.78 38.69 1tya n ASN 257 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1tya s THR 258 N -1.58 2.83 0.34 3.41 2.01 -0.22 -4.95 115.64 117.48 1tya s THR 258 Ca 0.04 0.76 -0.27 0.00 0.31 0.00 0.00 61.69 62.53 1tya s THR 258 Cb 0.02 -3.49 -0.09 0.00 0.01 0.00 0.00 72.50 68.96 1tya s THR 258 CO 0.02 0.15 1.12 -0.62 -0.69 0.00 0.00 174.62 174.60 1tya s ASP 259 N -0.13 6.91 0.37 3.53 -1.08 -1.26 -4.79 116.67 120.22 1tya s ASP 259 Ca 0.53 2.26 0.17 0.00 -0.52 0.00 0.00 52.55 54.99 1tya s ASP 259 Cb -0.39 -2.62 1.09 0.00 -1.46 0.00 0.00 42.92 39.54 1tya s ASP 259 CO 0.47 -0.40 1.71 0.44 0.52 0.00 0.00 175.17 177.92 1tya h ASP 260 N 3.15 0.50 -0.35 -0.34 3.32 -1.99 0.73 116.42 121.44 1tya h ASP 260 Ca -0.48 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.68 1tya h ASP 260 Cb 1.22 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.82 1tya h ASP 260 CO 0.64 -0.01 0.15 0.03 -1.72 0.00 0.00 179.24 178.34 1tya h ARG 261 N 0.38 0.58 0.02 3.56 3.08 -2.03 -3.32 114.38 116.66 1tya h ARG 261 Ca 0.68 -0.08 -0.37 0.00 0.07 0.00 0.00 59.98 60.28 1tya h ARG 261 Cb 1.63 -0.11 -0.06 0.00 0.08 0.00 0.00 29.97 31.51 1tya h ARG 261 CO -0.45 0.50 -2.32 -0.25 -1.07 0.00 0.00 179.97 176.38 1tya n ASP 262 N -4.37 1.27 -0.29 7.04 8.00 0.24 -4.70 116.55 123.73 1tya n ASP 262 Ca 0.03 -0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.64 1tya n ASP 262 Cb 0.16 0.01 0.22 0.00 -0.02 0.00 0.00 41.12 41.49 1tya n ASP 262 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1tya n VAL 263 N -3.11 -0.35 0.05 2.53 3.14 -0.13 -0.65 118.33 119.81 1tya n VAL 263 Ca -0.37 1.85 -0.03 0.00 -2.96 0.00 0.00 64.34 62.83 1tya n VAL 263 Cb 1.06 -2.68 0.20 0.00 -1.06 0.00 0.00 33.84 31.36 1tya n VAL 263 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 1tya h ILE 264 N 0.00 1.29 -0.38 1.55 1.08 -1.84 -1.49 117.51 117.72 1tya h ILE 264 Ca 0.49 -1.45 -0.14 0.00 -0.39 0.00 0.00 64.86 63.37 1tya h ILE 264 Cb 0.96 1.57 -0.01 0.00 -3.07 0.00 0.00 36.82 36.27 1tya h ILE 264 CO -0.80 0.44 -0.31 -0.09 -0.69 0.00 0.00 178.15 176.70 1tya h ARG 265 N 0.31 0.85 -0.22 2.37 2.43 -1.19 -3.05 114.38 115.88 1tya h ARG 265 Ca 0.03 -0.40 -0.12 0.00 -0.81 0.00 0.00 59.98 58.69 1tya h ARG 265 Cb 0.79 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.32 1tya h ARG 265 CO 0.06 1.04 -0.37 1.88 -1.51 0.00 0.00 179.97 181.07 1tya h TYR 266 N 0.71 0.56 -0.46 2.20 -1.99 -1.14 -1.54 116.97 115.32 1tya h TYR 266 Ca 0.08 -0.15 -0.10 0.00 2.00 0.00 0.00 58.73 60.56 1tya h TYR 266 Cb 0.87 -0.13 -0.02 0.00 2.00 0.00 0.00 36.73 39.46 1tya h TYR 266 CO 0.05 0.79 -0.11 -0.07 -0.00 0.00 0.00 178.16 178.81 1tya h LEU 267 N 0.41 0.83 -0.32 3.88 3.38 -1.26 -0.70 115.31 121.52 1tya h LEU 267 Ca 0.04 -0.25 -0.15 0.00 0.09 0.00 0.00 57.88 57.61 1tya h LEU 267 Cb 0.83 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1tya h LEU 267 CO 0.07 0.96 -0.37 0.11 0.09 0.00 0.00 178.44 179.30 1tya h LYS 268 N 0.75 0.82 0.06 1.13 1.57 -1.44 -2.26 116.57 117.20 1tya h LYS 268 Ca 0.12 -0.45 -0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1tya h LYS 268 Cb 0.61 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1tya h LYS 268 CO 0.04 1.08 -0.03 1.88 -0.57 0.00 0.00 179.45 181.85 1tya h TYR 269 N 0.59 -0.08 -0.23 -1.35 -1.99 -1.12 -3.40 116.97 109.40 1tya h TYR 269 Ca 0.05 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.77 1tya h TYR 269 Cb 0.95 0.03 0.00 0.00 2.00 0.00 0.00 36.73 39.71 1tya h TYR 269 CO 0.07 0.52 0.00 1.19 -0.00 0.00 0.00 178.16 179.94 1tya n PHE 270 N -4.80 0.28 -4.40 4.88 3.72 -0.28 -4.90 117.46 111.96 1tya n PHE 270 Ca -0.08 -0.14 -0.21 0.00 -0.05 0.00 0.00 57.45 56.97 1tya n PHE 270 Cb 0.31 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.75 1tya n PHE 270 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1tya s THR 271 N -1.72 2.01 -0.29 4.37 -4.23 -0.85 -4.77 115.64 110.16 1tya s THR 271 Ca 0.35 -2.27 0.15 0.00 -1.18 0.00 0.00 61.69 58.73 1tya s THR 271 Cb 0.21 -2.20 0.78 0.00 1.34 0.00 0.00 72.50 72.64 1tya s THR 271 CO 0.31 -0.48 1.71 0.49 -0.54 0.00 0.00 174.62 176.10 1tya n PHE 272 N -0.50 1.92 -2.42 3.99 3.01 -1.26 -4.81 117.46 117.38 1tya n PHE 272 Ca -0.07 -0.74 -0.37 0.00 1.01 0.00 0.00 57.45 57.29 1tya n PHE 272 Cb 0.61 -0.48 -0.03 0.00 -0.01 0.00 0.00 39.48 39.57 1tya n PHE 272 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1tya s LEU 273 N -2.72 4.10 1.15 4.37 1.43 -1.26 -5.04 118.68 120.71 1tya s LEU 273 Ca 0.53 2.16 -0.18 0.00 -1.03 0.00 0.00 54.13 55.61 1tya s LEU 273 Cb 0.40 -4.18 0.27 0.00 0.03 0.00 0.00 46.19 42.71 1tya s LEU 273 CO 0.16 -0.65 1.14 -0.94 0.23 0.00 0.00 176.35 176.28 1tya s SER 274 N -1.45 1.38 0.09 2.29 1.04 -1.26 -4.79 113.70 111.00 1tya s SER 274 Ca 0.60 0.61 -0.17 0.00 0.48 0.00 0.00 55.95 57.47 1tya s SER 274 Cb -0.25 -0.86 -0.08 0.00 0.10 0.00 0.00 66.02 64.93 1tya s SER 274 CO 0.31 -3.84 1.48 0.50 0.98 0.00 0.00 173.24 172.67 1tya h LYS 275 N -2.39 0.55 -0.22 4.02 3.64 -1.98 -0.83 116.57 119.37 1tya h LYS 275 Ca -0.45 -0.22 -0.08 0.00 -1.27 0.00 0.00 60.65 58.63 1tya h LYS 275 Cb 1.29 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1tya h LYS 275 CO 0.37 0.77 -0.19 0.93 -2.27 0.00 0.00 179.45 179.06 1tya h GLU 276 N 0.31 0.39 0.04 1.90 3.07 -1.98 0.89 114.58 119.20 1tya h GLU 276 Ca 0.07 -0.12 -0.23 0.00 -0.50 0.00 0.00 59.36 58.58 1tya h GLU 276 Cb 0.57 -0.04 0.02 0.00 -0.84 0.00 0.00 28.75 28.47 1tya h GLU 276 CO 0.03 0.57 -0.91 0.93 -1.40 0.00 0.00 179.01 178.23 1tya h GLU 277 N 0.36 0.54 -0.72 2.33 5.08 -1.87 -2.92 114.58 117.39 1tya h GLU 277 Ca 0.06 -0.64 -0.06 0.00 -1.00 0.00 0.00 59.36 57.72 1tya h GLU 277 Cb 0.54 0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 1tya h GLU 277 CO 0.04 1.25 0.20 0.82 -1.00 0.00 0.00 179.01 180.32 1tya h ILE 278 N 0.11 1.26 -0.16 3.13 2.04 -0.73 -1.95 117.51 121.21 1tya h ILE 278 Ca -0.13 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 1tya h ILE 278 Cb 1.61 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 1tya h ILE 278 CO 0.18 0.36 0.07 -0.33 0.00 0.00 0.00 178.15 178.43 1tya h GLU 279 N 1.07 0.23 -0.70 2.37 5.08 0.73 -2.44 114.58 120.92 1tya h GLU 279 Ca 0.23 -0.04 0.14 0.00 -1.00 0.00 0.00 59.36 58.69 1tya h GLU 279 Cb 0.34 -0.04 -0.10 0.00 0.50 0.00 0.00 28.75 29.45 1tya h GLU 279 CO -0.00 0.29 0.18 0.00 -1.00 0.00 0.00 179.01 178.48 1tya h ALA 280 N 0.93 0.89 0.00 3.43 0.00 -1.30 0.27 119.26 123.48 1tya h ALA 280 Ca 0.05 0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1tya h ALA 280 Cb 0.14 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1tya h ALA 280 CO -0.01 -0.31 -0.23 -0.07 0.00 0.00 0.00 179.25 178.64 1tya h LEU 281 N 0.30 0.00 -0.45 0.00 3.38 -1.22 -0.55 115.31 116.77 1tya h LEU 281 Ca 0.38 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.24 1tya h LEU 281 Cb 0.62 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1tya h LEU 281 CO -0.46 0.23 -0.17 -0.08 0.09 0.00 0.00 178.44 178.05 1tya h GLU 282 N 0.00 0.90 -0.20 1.13 4.81 0.01 0.33 114.58 121.56 1tya h GLU 282 Ca -0.00 -0.37 -0.18 0.00 -0.13 0.00 0.00 59.36 58.67 1tya h GLU 282 Cb 0.51 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1tya h GLU 282 CO 0.03 1.03 -0.59 1.96 -0.73 0.00 0.00 179.01 180.70 1tya h GLN 283 N 0.74 0.76 -0.00 1.92 7.50 -1.01 -1.73 115.11 123.29 1tya h GLN 283 Ca 0.11 -0.55 -0.09 0.00 0.50 0.00 0.00 58.65 58.62 1tya h GLN 283 Cb 0.73 0.09 -0.01 0.00 0.05 0.00 0.00 27.48 28.33 1tya h GLN 283 CO 0.06 1.17 -0.41 0.93 -1.50 0.00 0.00 178.83 179.08 1tya h GLU 284 N 0.49 0.01 -0.20 1.46 5.08 -1.00 0.13 114.58 120.55 1tya h GLU 284 Ca -0.02 -0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 1tya h GLU 284 Cb 1.21 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1tya h GLU 284 CO 0.13 0.41 -0.37 1.25 -1.00 0.00 0.00 179.01 179.43 1tya h LEU 285 N 0.01 0.46 0.09 1.33 5.85 -0.14 0.14 115.31 123.05 1tya h LEU 285 Ca -0.00 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 1tya h LEU 285 Cb 0.72 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.63 1tya h LEU 285 CO 0.05 0.79 -0.05 -0.09 -0.34 0.00 0.00 178.44 178.81 1tya h ARG 286 N 0.37 -0.12 0.01 1.25 2.43 -0.57 -3.21 114.38 114.54 1tya h ARG 286 Ca 0.04 0.01 -0.19 0.00 -0.81 0.00 0.00 59.98 59.02 1tya h ARG 286 Cb 0.83 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.39 1tya h ARG 286 CO 0.07 0.39 -0.88 0.93 -1.51 0.00 0.00 179.97 178.97 1tya h GLU 287 N -0.76 0.12 -1.52 0.20 3.07 -0.78 -3.41 114.58 111.50 1tya h GLU 287 Ca -0.01 -0.13 -0.46 0.00 -0.50 0.00 0.00 59.36 58.25 1tya h GLU 287 Cb 0.57 0.04 -0.33 0.00 -0.84 0.00 0.00 28.75 28.19 1tya h GLU 287 CO 0.02 0.92 -0.98 0.00 -1.40 0.00 0.00 179.01 177.57 1tya n ALA 288 N -2.43 1.47 0.70 3.43 0.00 0.03 -5.01 120.51 118.70 1tya n ALA 288 Ca -0.02 -2.93 0.08 0.00 0.00 0.00 0.00 53.44 50.56 1tya n ALA 288 Cb 0.82 -0.95 0.38 0.00 0.00 0.00 0.00 19.45 19.70 1tya n ALA 288 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1tya n PRO 289 N 1.17 0.17 0.03 0.00 -0.04 -1.21 -2.42 135.00 132.70 1tya n PRO 289 Ca 0.19 0.16 0.11 0.00 -0.04 0.00 0.00 63.50 63.92 1tya n PRO 289 Cb 0.58 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.60 1tya n PRO 289 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1tya n GLU 290 N -1.34 0.28 -0.16 0.54 4.71 -1.26 -3.87 120.64 119.55 1tya n GLU 290 Ca 0.07 0.01 -0.10 0.00 -0.01 0.00 0.00 57.16 57.13 1tya n GLU 290 Cb 0.14 -1.61 -0.00 0.00 -1.01 0.00 0.00 31.44 28.96 1tya n GLU 290 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 1tya h LYS 291 N 0.00 0.77 -2.85 3.49 6.56 -1.87 -3.48 116.57 119.20 1tya h LYS 291 Ca 0.00 -0.23 -0.19 0.00 -1.06 0.00 0.00 60.65 59.17 1tya h LYS 291 Cb 0.73 -0.08 0.05 0.00 -0.57 0.00 0.00 32.23 32.36 1tya h LYS 291 CO 0.00 0.82 -0.31 0.54 -2.06 0.00 0.00 179.45 178.44 1tya n ARG 292 N -4.42 -3.07 -0.24 3.15 5.12 -1.25 -4.96 116.66 110.99 1tya n ARG 292 Ca 0.00 0.41 -0.07 0.00 -1.93 0.00 0.00 57.85 56.27 1tya n ARG 292 Cb 0.28 -4.21 0.06 0.00 -1.16 0.00 0.00 32.46 27.44 1tya n ARG 292 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1tya h ALA 293 N 0.48 0.97 -0.34 7.54 0.00 -1.91 -1.31 119.26 124.69 1tya h ALA 293 Ca -0.26 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.23 1tya h ALA 293 Cb 1.17 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1tya h ALA 293 CO 0.27 0.66 -0.46 0.00 0.00 0.00 0.00 179.25 179.72 1tya h ALA 294 N 1.12 0.53 -0.56 0.00 0.00 -1.93 -1.99 119.26 116.43 1tya h ALA 294 Ca 0.22 -0.48 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 1tya h ALA 294 Cb 0.38 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1tya h ALA 294 CO 0.00 0.68 0.10 1.96 0.00 0.00 0.00 179.25 181.99 1tya h GLN 295 N 0.72 0.92 -0.03 0.00 7.50 -1.88 -1.38 115.11 120.96 1tya h GLN 295 Ca 0.04 -0.24 -0.21 0.00 0.50 0.00 0.00 58.65 58.73 1tya h GLN 295 Cb 1.06 -0.11 0.00 0.00 0.05 0.00 0.00 27.48 28.48 1tya h GLN 295 CO 0.11 0.88 -0.86 0.87 -1.50 0.00 0.00 178.83 178.33 1tya h LYS 296 N 0.82 0.43 -0.90 1.46 6.56 -1.23 -2.56 116.57 121.14 1tya h LYS 296 Ca 0.17 -0.42 0.01 0.00 -1.06 0.00 0.00 60.65 59.35 1tya h LYS 296 Cb 0.40 0.11 -0.04 0.00 -0.57 0.00 0.00 32.23 32.13 1tya h LYS 296 CO 0.01 1.07 0.59 1.15 -2.06 0.00 0.00 179.45 180.21 1tya h THR 297 N 0.26 1.24 0.78 -0.16 2.02 -1.23 -0.29 112.91 115.53 1tya h THR 297 Ca -0.06 -0.44 -0.04 0.00 0.77 0.00 0.00 66.41 66.64 1tya h THR 297 Cb 1.48 -0.08 0.01 0.00 -1.74 0.00 0.00 68.15 67.81 1tya h THR 297 CO 0.15 0.23 -0.38 0.25 0.37 0.00 0.00 175.52 176.14 1tya h LEU 298 N 1.23 -0.89 -0.66 2.58 5.85 -1.21 -2.47 115.31 119.74 1tya h LEU 298 Ca 0.33 0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.19 1tya h LEU 298 Cb -0.13 0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.04 1tya h LEU 298 CO -0.07 -0.56 0.20 0.00 -0.34 0.00 0.00 178.44 177.67 1tya h ALA 299 N -1.07 0.84 -0.38 1.25 0.00 -1.28 0.79 119.26 119.42 1tya h ALA 299 Ca -0.11 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1tya h ALA 299 Cb 0.82 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1tya h ALA 299 CO 0.18 -0.26 0.02 0.93 0.00 0.00 0.00 179.25 180.11 1tya h GLU 300 N 0.34 0.66 0.25 0.00 5.08 -1.08 -1.10 114.58 118.73 1tya h GLU 300 Ca 0.35 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1tya h GLU 300 Cb 0.52 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1tya h GLU 300 CO -0.40 0.75 -0.12 0.93 -1.00 0.00 0.00 179.01 179.17 1tya h GLU 301 N 0.48 -0.33 -0.20 2.33 4.39 -1.02 -1.98 114.58 118.26 1tya h GLU 301 Ca 0.11 0.02 -0.17 0.00 0.34 0.00 0.00 59.36 59.66 1tya h GLU 301 Cb 0.44 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 1tya h GLU 301 CO 0.02 -0.13 -0.53 0.28 -1.16 0.00 0.00 179.01 177.48 1tya h VAL 302 N -0.46 1.31 -0.92 3.13 2.07 -0.89 -2.52 116.25 117.97 1tya h VAL 302 Ca -0.03 -1.75 -0.01 0.00 0.82 0.00 0.00 66.70 65.73 1tya h VAL 302 Cb 0.35 1.88 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 1tya h VAL 302 CO 0.06 0.55 0.55 0.74 0.02 0.00 0.00 177.57 179.49 1tya h THR 303 N 0.42 1.25 -0.53 2.57 2.02 -1.24 -1.40 112.91 116.00 1tya h THR 303 Ca -0.01 -0.56 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 1tya h THR 303 Cb 1.15 -0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1tya h THR 303 CO 0.11 0.27 0.29 0.11 0.37 0.00 0.00 175.52 176.67 1tya h LYS 304 N 1.27 0.75 0.68 6.66 1.57 -1.34 0.97 116.57 127.13 1tya h LYS 304 Ca 0.33 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.99 1tya h LYS 304 Cb -0.05 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1tya h LYS 304 CO -0.06 0.59 -0.49 -0.07 -0.57 0.00 0.00 179.45 178.85 1tya h LEU 305 N 0.72 -1.27 -0.01 2.94 3.38 -1.06 0.17 115.31 120.18 1tya h LEU 305 Ca 0.19 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1tya h LEU 305 Cb 0.06 0.39 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1tya h LEU 305 CO -0.03 -0.71 -0.05 0.58 0.09 0.00 0.00 178.44 178.32 1tya h VAL 306 N -1.12 1.55 0.00 1.22 2.07 -1.23 -3.41 116.25 115.33 1tya h VAL 306 Ca -0.09 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 65.76 1tya h VAL 306 Cb 0.92 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 33.34 1tya h VAL 306 CO 0.04 0.44 -1.44 1.41 0.02 0.00 0.00 177.57 178.04 1tya n HIS 307 N -4.71 0.00 0.00 1.57 8.25 0.33 -5.08 115.22 115.59 1tya n HIS 307 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 1tya n HIS 307 Cb 0.37 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.22 1tya n HIS 307 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1tya n GLY 308 N 1.64 0.09 0.31 -1.41 0.00 0.59 -4.50 105.19 101.91 1tya n GLY 308 Ca -0.02 -1.70 0.13 0.00 0.00 0.00 0.00 46.02 44.43 1tya n GLY 308 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1tya h GLU 309 N 0.00 0.24 -0.45 1.61 4.39 -1.88 -0.39 114.58 118.10 1tya h GLU 309 Ca 0.00 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.58 1tya h GLU 309 Cb 0.00 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1tya h GLU 309 CO 0.00 0.16 -0.13 0.93 -1.16 0.00 0.00 179.01 178.81 1tya h GLU 310 N 0.25 0.89 -0.78 2.33 4.39 -1.98 0.24 114.58 119.91 1tya h GLU 310 Ca 0.55 -0.35 -0.04 0.00 0.34 0.00 0.00 59.36 59.86 1tya h GLU 310 Cb 1.10 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.67 1tya h GLU 310 CO -0.62 0.99 0.34 0.00 -1.16 0.00 0.00 179.01 178.56 1tya h ALA 311 N 0.87 1.01 -0.30 3.43 0.00 -1.59 -0.79 119.26 121.89 1tya h ALA 311 Ca 0.11 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1tya h ALA 311 Cb 0.68 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1tya h ALA 311 CO 0.05 0.62 0.05 1.25 0.00 0.00 0.00 179.25 181.21 1tya h LEU 312 N 1.12 0.47 -0.93 0.00 5.85 -0.74 -2.09 115.31 118.99 1tya h LEU 312 Ca 0.26 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.77 1tya h LEU 312 Cb 0.18 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 1tya h LEU 312 CO -0.03 0.61 0.60 0.03 -0.34 0.00 0.00 178.44 179.31 1tya h ARG 313 N 0.32 1.11 -0.03 1.25 3.08 -0.17 -1.10 114.38 118.84 1tya h ARG 313 Ca 0.09 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1tya h ARG 313 Cb 0.34 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 1tya h ARG 313 CO 0.01 0.74 0.00 1.96 -1.07 0.00 0.00 179.97 181.60 1tya h GLN 314 N 1.15 0.05 -0.70 0.04 4.20 -1.04 -1.93 115.11 116.88 1tya h GLN 314 Ca 0.37 -0.01 0.11 0.00 0.06 0.00 0.00 58.65 59.18 1tya h GLN 314 Cb 0.03 -0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.73 1tya h GLN 314 CO -0.13 0.32 0.30 0.00 -0.67 0.00 0.00 178.83 178.66 1tya h ALA 315 N 0.72 0.95 -0.15 3.87 0.00 -0.90 0.81 119.26 124.57 1tya h ALA 315 Ca 0.01 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1tya h ALA 315 Cb 0.30 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1tya h ALA 315 CO 0.00 -0.14 -0.17 0.82 0.00 0.00 0.00 179.25 179.77 1tya h ILE 316 N 0.50 1.35 -0.22 0.00 2.04 -1.23 -0.96 117.51 118.99 1tya h ILE 316 Ca 0.36 -1.35 -0.15 0.00 1.00 0.00 0.00 64.86 64.72 1tya h ILE 316 Cb 0.45 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 1tya h ILE 316 CO -0.32 0.40 -0.48 0.08 0.00 0.00 0.00 178.15 177.83 1tya h ARG 317 N 0.01 0.57 -0.19 2.37 0.11 -0.94 -2.53 114.38 113.78 1tya h ARG 317 Ca 0.02 -0.33 -0.06 0.00 0.10 0.00 0.00 59.98 59.71 1tya h ARG 317 Cb 0.71 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.80 1tya h ARG 317 CO 0.04 0.93 -0.16 0.82 0.10 0.00 0.00 179.97 181.70 1tya h ILE 318 N 0.46 1.21 0.00 0.08 2.04 0.66 -3.51 117.51 118.44 1tya h ILE 318 Ca 0.02 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1tya h ILE 318 Cb 1.01 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 38.34 1tya h ILE 318 CO 0.09 0.29 0.00 -1.20 0.00 0.00 0.00 178.15 177.34