#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e93 s ARG 5 N 0.00 4.46 0.98 5.31 3.52 -1.26 -5.04 118.95 126.91 3e93 s ARG 5 Ca 0.00 1.19 -0.11 0.00 -0.13 0.00 0.00 55.73 56.68 3e93 s ARG 5 Cb 0.00 -3.49 0.18 0.00 -1.56 0.00 0.00 34.95 30.08 3e93 s ARG 5 CO 0.00 -0.11 1.10 -1.25 -0.81 0.00 0.00 175.30 174.23 3e93 s PRO 6 N 1.31 0.55 0.23 5.12 0.04 -1.26 -5.00 135.00 135.99 3e93 s PRO 6 Ca 0.45 1.17 -0.30 0.00 0.04 0.00 0.00 61.00 62.36 3e93 s PRO 6 Cb -0.19 -1.70 -0.09 0.00 0.04 0.00 0.00 34.50 32.57 3e93 s PRO 6 CO 0.21 -2.83 0.98 0.99 0.04 0.00 0.00 177.00 176.38 3e93 s THR 7 N -2.66 4.02 0.11 1.26 2.01 -1.26 -4.98 115.64 114.14 3e93 s THR 7 Ca 0.66 1.97 0.04 0.00 0.31 0.00 0.00 61.69 64.68 3e93 s THR 7 Cb -0.22 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 67.99 3e93 s THR 7 CO 0.60 0.45 0.05 -0.36 -0.69 0.00 0.00 174.62 174.67 3e93 s PHE 8 N -0.99 3.07 0.13 4.92 0.40 -1.26 -1.26 117.98 122.99 3e93 s PHE 8 Ca 0.43 -0.00 0.06 0.00 -0.60 0.00 0.00 56.93 56.81 3e93 s PHE 8 Cb -0.27 -1.54 -0.04 0.00 0.51 0.00 0.00 43.02 41.68 3e93 s PHE 8 CO 0.33 0.51 -0.13 1.52 0.70 0.00 0.00 175.22 178.15 3e93 s TYR 9 N -1.46 1.37 -0.04 0.36 1.13 -0.09 -4.88 117.35 113.73 3e93 s TYR 9 Ca 0.28 -0.61 0.01 0.00 -1.41 0.00 0.00 57.07 55.34 3e93 s TYR 9 Cb -0.11 -0.70 -0.03 0.00 -1.10 0.00 0.00 41.96 40.01 3e93 s TYR 9 CO 0.21 0.14 -0.04 1.03 -2.51 0.00 0.00 175.55 174.38 3e93 s ARG 10 N -2.99 2.76 0.07 -3.49 0.52 -1.26 -1.81 118.95 112.74 3e93 s ARG 10 Ca 0.11 -0.57 -0.10 0.00 -0.52 0.00 0.00 55.73 54.65 3e93 s ARG 10 Cb -0.03 -2.63 0.01 0.00 0.52 0.00 0.00 34.95 32.82 3e93 s ARG 10 CO 0.03 0.65 0.22 1.14 0.02 0.00 0.00 175.30 177.36 3e93 s GLN 11 N -1.13 0.81 -0.19 3.54 -2.07 -0.33 -4.99 119.66 115.30 3e93 s GLN 11 Ca 0.15 -0.77 -0.14 0.00 -1.82 0.00 0.00 55.36 52.78 3e93 s GLN 11 Cb -0.11 0.34 -0.04 0.00 -1.09 0.00 0.00 33.01 32.10 3e93 s GLN 11 CO 0.05 -0.26 0.32 -2.00 -1.32 0.00 0.00 175.29 172.08 3e93 s GLU 12 N -3.26 4.21 -0.36 9.60 2.12 -1.26 0.17 118.70 129.91 3e93 s GLU 12 Ca 0.00 0.10 0.02 0.00 0.36 0.00 0.00 54.97 55.45 3e93 s GLU 12 Cb 0.02 -3.48 0.11 0.00 0.26 0.00 0.00 34.13 31.04 3e93 s GLU 12 CO -0.08 0.11 0.12 -0.51 -0.54 0.00 0.00 175.26 174.36 3e93 s LEU 13 N 0.87 3.24 -1.08 2.70 1.43 0.23 -4.80 118.68 121.27 3e93 s LEU 13 Ca 0.17 -2.08 -0.09 0.00 -1.03 0.00 0.00 54.13 51.10 3e93 s LEU 13 Cb -0.14 -1.19 -0.05 0.00 0.03 0.00 0.00 46.19 44.85 3e93 s LEU 13 CO 0.06 -0.36 0.89 0.59 0.23 0.00 0.00 176.35 177.75 3e93 n ASN 14 N 4.29 -5.96 -3.58 2.29 5.03 -1.26 -3.18 115.26 112.89 3e93 n ASN 14 Ca 0.02 -0.77 -0.27 0.00 0.87 0.00 0.00 54.58 54.43 3e93 n ASN 14 Cb 0.40 -4.80 0.01 0.00 -1.02 0.00 0.00 39.78 34.37 3e93 n ASN 14 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3e93 n LYS 15 N -3.51 -4.28 -4.31 3.52 5.02 -1.26 -4.99 118.16 108.35 3e93 n LYS 15 Ca -0.09 0.56 -0.21 0.00 -2.02 0.00 0.00 58.31 56.55 3e93 n LYS 15 Cb 0.62 -5.36 -0.16 0.00 -0.02 0.00 0.00 35.03 30.11 3e93 n LYS 15 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3e93 s THR 16 N -3.11 0.73 -0.03 -0.18 2.01 -1.19 -5.13 115.64 108.73 3e93 s THR 16 Ca 0.51 -0.25 -0.30 0.00 0.31 0.00 0.00 61.69 61.96 3e93 s THR 16 Cb -0.26 -0.71 -0.03 0.00 0.01 0.00 0.00 72.50 71.51 3e93 s THR 16 CO 0.63 0.26 1.15 -0.63 -0.69 0.00 0.00 174.62 175.34 3e93 s ILE 17 N 0.78 4.36 -0.21 1.82 -1.09 -1.26 0.75 121.20 126.34 3e93 s ILE 17 Ca -0.12 1.68 -0.04 0.00 -2.23 0.00 0.00 60.65 59.94 3e93 s ILE 17 Cb -0.15 -4.08 -0.01 0.00 -1.58 0.00 0.00 42.46 36.65 3e93 s ILE 17 CO 0.01 0.04 -0.05 0.26 -1.23 0.00 0.00 174.94 173.97 3e93 s TRP 18 N 1.81 2.95 -0.31 3.97 0.52 0.13 -4.94 118.94 123.06 3e93 s TRP 18 Ca 0.55 -0.95 0.01 0.00 0.02 0.00 0.00 56.10 55.73 3e93 s TRP 18 Cb -0.24 -2.09 0.07 0.00 -1.15 0.00 0.00 33.47 30.06 3e93 s TRP 18 CO 0.24 -0.54 -0.01 -2.00 0.02 0.00 0.00 176.95 174.66 3e93 s GLU 19 N 1.42 2.09 0.12 4.98 2.12 -1.26 -1.19 118.70 126.98 3e93 s GLU 19 Ca 0.05 -1.50 0.06 0.00 0.36 0.00 0.00 54.97 53.94 3e93 s GLU 19 Cb -0.14 -3.13 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 3e93 s GLU 19 CO -0.03 -0.73 -0.14 0.14 -0.54 0.00 0.00 175.26 173.96 3e93 s VAL 20 N 1.10 1.29 0.45 3.70 -7.23 -0.75 -4.64 120.40 114.32 3e93 s VAL 20 Ca -0.01 -1.70 -0.24 0.00 -1.81 0.00 0.00 61.98 58.21 3e93 s VAL 20 Cb -0.20 -1.51 -0.09 0.00 0.56 0.00 0.00 36.38 35.14 3e93 s VAL 20 CO -0.04 -0.43 1.18 -2.65 -0.31 0.00 0.00 175.10 172.85 3e93 n PRO 21 N 0.54 1.65 -0.18 4.82 -0.02 -1.26 -0.91 135.00 139.65 3e93 n PRO 21 Ca -0.16 0.59 0.27 0.00 -2.02 0.00 0.00 63.50 62.18 3e93 n PRO 21 Cb 0.57 -2.29 0.69 0.00 -0.02 0.00 0.00 33.50 32.44 3e93 n PRO 21 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3e93 h GLU 22 N 1.72 0.07 -0.36 -0.52 5.08 -1.52 -1.55 114.58 117.50 3e93 h GLU 22 Ca -0.47 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 57.99 3e93 h GLU 22 Cb 1.31 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 3e93 h GLU 22 CO 0.58 0.04 0.27 0.07 -1.00 0.00 0.00 179.01 178.98 3e93 h ARG 23 N 0.07 0.00 -5.42 2.33 0.11 -1.89 -3.39 114.38 106.18 3e93 h ARG 23 Ca 0.43 0.00 -0.62 0.00 0.10 0.00 0.00 59.98 59.88 3e93 h ARG 23 Cb 1.58 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 32.54 3e93 h ARG 23 CO -0.04 0.00 0.08 0.71 0.10 0.00 0.00 179.97 180.82 3e93 s TYR 24 N -4.96 3.22 0.32 4.08 2.02 -0.58 -0.68 117.35 120.77 3e93 s TYR 24 Ca -0.05 0.54 0.08 0.00 -0.37 0.00 0.00 57.07 57.27 3e93 s TYR 24 Cb 0.18 -2.91 -0.06 0.00 -0.40 0.00 0.00 41.96 38.77 3e93 s TYR 24 CO 0.68 -0.43 -0.07 -0.65 -1.57 0.00 0.00 175.55 173.52 3e93 s GLN 25 N 2.50 1.71 -1.35 -0.62 -1.52 0.05 -4.84 119.66 115.59 3e93 s GLN 25 Ca 0.23 -1.89 -0.07 0.00 -1.95 0.00 0.00 55.36 51.69 3e93 s GLN 25 Cb -0.15 -1.43 0.02 0.00 -0.22 0.00 0.00 33.01 31.22 3e93 s GLN 25 CO 0.11 0.07 1.06 0.09 -0.25 0.00 0.00 175.29 176.37 3e93 n ASN 26 N -0.71 -4.57 -4.71 5.90 3.02 -1.26 -0.37 115.26 112.55 3e93 n ASN 26 Ca -0.05 -0.63 -0.42 0.00 -0.03 0.00 0.00 54.58 53.45 3e93 n ASN 26 Cb 0.64 -4.76 -0.03 0.00 -0.61 0.00 0.00 39.78 35.02 3e93 n ASN 26 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3e93 s LEU 27 N -7.02 4.37 -0.05 3.41 1.02 -1.26 -4.38 118.68 114.78 3e93 s LEU 27 Ca 0.41 2.77 -0.02 0.00 0.02 0.00 0.00 54.13 57.30 3e93 s LEU 27 Cb -0.19 -3.59 0.03 0.00 0.02 0.00 0.00 46.19 42.46 3e93 s LEU 27 CO 0.76 -0.93 0.04 -0.55 0.02 0.00 0.00 176.35 175.68 3e93 s SER 28 N 1.48 1.27 0.30 2.29 0.15 0.67 -4.96 113.70 114.90 3e93 s SER 28 Ca 0.74 0.01 -0.29 0.00 0.70 0.00 0.00 55.95 57.11 3e93 s SER 28 Cb -0.47 -0.25 -0.13 0.00 -1.71 0.00 0.00 66.02 63.46 3e93 s SER 28 CO 0.32 -0.22 1.37 -2.65 1.20 0.00 0.00 173.24 173.26 3e93 n PRO 29 N 5.19 2.16 0.00 5.44 -0.02 -1.26 0.02 135.00 146.52 3e93 n PRO 29 Ca -0.06 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 3e93 n PRO 29 Cb 0.50 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 3e93 n PRO 29 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3e93 n VAL 30 N 1.15 0.00 0.00 -1.45 0.24 0.33 -4.80 118.33 113.80 3e93 n VAL 30 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 3e93 n VAL 30 Cb 0.34 1.42 0.00 0.00 -1.47 0.00 0.00 33.84 34.13 3e93 n VAL 30 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3e93 n GLY 31 N 0.00 2.20 2.99 7.63 0.00 -1.20 -4.94 105.19 111.88 3e93 n GLY 31 Ca 0.00 0.10 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 3e93 n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3e93 s SER 32 N 0.00 0.02 0.14 1.61 0.15 -1.26 0.76 113.70 115.12 3e93 s SER 32 Ca 0.00 -0.08 -0.13 0.00 0.70 0.00 0.00 55.95 56.43 3e93 s SER 32 Cb 0.00 0.15 0.05 0.00 -1.71 0.00 0.00 66.02 64.51 3e93 s SER 32 CO 0.00 -0.17 0.65 0.61 1.20 0.00 0.00 173.24 175.54 3e93 n GLY 33 N 2.36 0.91 0.35 9.45 0.00 0.09 -4.99 105.19 113.34 3e93 n GLY 33 Ca -0.17 -1.09 0.07 0.00 0.00 0.00 0.00 46.02 44.83 3e93 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3e93 h ALA 34 N 2.00 1.74 -0.25 4.61 0.00 -1.80 -2.56 119.26 123.01 3e93 h ALA 34 Ca -0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3e93 h ALA 34 Cb 0.79 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3e93 h ALA 34 CO 0.25 0.16 0.00 0.66 0.00 0.00 0.00 179.25 180.31 3e93 n TYR 35 N -4.47 0.31 0.00 0.00 4.01 -0.21 -4.66 117.16 112.13 3e93 n TYR 35 Ca 0.09 -0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 3e93 n TYR 35 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 3e93 n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3e93 n GLY 36 N 1.38 0.25 3.17 2.72 0.00 -0.96 -1.92 105.19 109.82 3e93 n GLY 36 Ca 0.18 -1.43 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 3e93 n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3e93 s SER 37 N 0.00 0.10 -0.01 1.61 1.04 -0.81 -0.74 113.70 114.89 3e93 s SER 37 Ca 0.00 -0.49 0.04 0.00 0.48 0.00 0.00 55.95 55.99 3e93 s SER 37 Cb 0.00 0.28 -0.01 0.00 0.10 0.00 0.00 66.02 66.39 3e93 s SER 37 CO 0.00 -0.58 -0.14 -0.69 0.98 0.00 0.00 173.24 172.81 3e93 s VAL 38 N -2.88 1.14 -0.04 5.02 1.01 0.23 -1.31 120.40 123.57 3e93 s VAL 38 Ca -0.03 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.40 3e93 s VAL 38 Cb 0.00 -0.95 -0.01 0.00 0.00 0.00 0.00 36.38 35.43 3e93 s VAL 38 CO -0.06 0.32 -0.20 0.00 0.00 0.00 0.00 175.10 175.16 3e93 s ALA 40 N -0.22 3.28 0.26 0.00 0.00 0.10 -0.76 121.76 124.43 3e93 s ALA 40 Ca 0.01 0.86 -0.06 0.00 0.00 0.00 0.00 51.96 52.76 3e93 s ALA 40 Cb -0.11 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 3e93 s ALA 40 CO 0.01 -0.23 0.38 0.00 0.00 0.00 0.00 175.76 175.92 3e93 s ALA 41 N -1.34 0.46 -0.18 0.00 0.00 0.75 -0.24 121.76 121.21 3e93 s ALA 41 Ca 0.50 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 51.17 3e93 s ALA 41 Cb -0.29 1.19 0.01 0.00 0.00 0.00 0.00 23.12 24.03 3e93 s ALA 41 CO 0.37 -0.76 -0.17 0.12 0.00 0.00 0.00 175.76 175.31 3e93 s PHE 42 N -3.78 2.80 -0.65 0.00 5.36 0.50 -0.85 117.98 121.35 3e93 s PHE 42 Ca 0.29 -1.47 -0.23 0.00 -0.96 0.00 0.00 56.93 54.57 3e93 s PHE 42 Cb 0.02 -1.94 0.07 0.00 -0.34 0.00 0.00 43.02 40.83 3e93 s PHE 42 CO 0.13 -0.73 0.96 0.34 -1.46 0.00 0.00 175.22 174.46 3e93 s ASP 43 N 1.24 6.18 0.57 6.13 2.15 0.31 -0.77 116.67 132.49 3e93 s ASP 43 Ca 0.03 -0.96 0.34 0.00 0.43 0.00 0.00 52.55 52.39 3e93 s ASP 43 Cb -0.14 -2.42 1.70 0.00 -0.30 0.00 0.00 42.92 41.76 3e93 s ASP 43 CO -0.10 -1.42 2.13 0.71 -0.17 0.00 0.00 175.17 176.32 3e93 h THR 44 N 5.97 0.24 -0.33 1.71 1.35 -1.20 0.23 112.91 120.88 3e93 h THR 44 Ca -0.29 -0.39 -0.14 0.00 -0.55 0.00 0.00 66.41 65.04 3e93 h THR 44 Cb 1.07 1.30 -0.00 0.00 -1.73 0.00 0.00 68.15 68.79 3e93 h THR 44 CO 1.17 0.05 -0.35 0.50 -0.25 0.00 0.00 175.52 176.64 3e93 h LYS 45 N 0.00 0.82 -0.00 4.72 3.64 -1.90 -3.33 116.57 120.52 3e93 h LYS 45 Ca -0.00 -0.44 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 3e93 h LYS 45 Cb 0.30 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 3e93 h LYS 45 CO 0.01 1.08 -0.61 0.25 -2.27 0.00 0.00 179.45 177.90 3e93 n THR 46 N -4.15 0.00 -1.20 1.00 -2.24 -0.86 -4.97 114.28 101.86 3e93 n THR 46 Ca -0.03 -0.19 -0.07 0.00 -2.27 0.00 0.00 64.05 61.49 3e93 n THR 46 Cb 0.52 1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 69.74 3e93 n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3e93 n GLY 47 N 1.30 0.79 3.82 3.38 0.00 0.74 -5.02 105.19 110.19 3e93 n GLY 47 Ca 0.03 -0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 3e93 n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3e93 s LEU 48 N -1.55 4.49 -0.03 0.99 1.43 -1.18 -4.90 118.68 117.94 3e93 s LEU 48 Ca 0.00 1.23 -0.30 0.00 -1.03 0.00 0.00 54.13 54.03 3e93 s LEU 48 Cb 0.00 -2.96 -0.04 0.00 0.03 0.00 0.00 46.19 43.22 3e93 s LEU 48 CO 0.00 0.25 1.21 -0.13 0.23 0.00 0.00 176.35 177.91 3e93 s ARG 49 N -1.26 4.37 0.21 1.70 0.52 -1.26 -0.53 118.95 122.70 3e93 s ARG 49 Ca 0.30 1.72 0.07 0.00 -0.52 0.00 0.00 55.73 57.30 3e93 s ARG 49 Cb -0.19 -3.51 -0.05 0.00 0.52 0.00 0.00 34.95 31.72 3e93 s ARG 49 CO 0.19 -0.41 -0.11 0.14 0.02 0.00 0.00 175.30 175.12 3e93 s VAL 50 N 1.97 1.61 -0.12 3.52 -7.23 -0.03 -1.70 120.40 118.43 3e93 s VAL 50 Ca 0.57 -2.17 -0.02 0.00 -1.81 0.00 0.00 61.98 58.55 3e93 s VAL 50 Cb -0.26 -2.11 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 3e93 s VAL 50 CO 0.24 -0.54 -0.02 0.00 -0.31 0.00 0.00 175.10 174.46 3e93 s ALA 51 N -3.05 3.12 -0.19 1.32 0.00 -0.06 -0.18 121.76 122.72 3e93 s ALA 51 Ca 0.23 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.38 3e93 s ALA 51 Cb 0.01 -1.49 0.02 0.00 0.00 0.00 0.00 23.12 21.66 3e93 s ALA 51 CO 0.07 0.41 -0.18 0.08 0.00 0.00 0.00 175.76 176.14 3e93 s VAL 52 N -0.30 2.20 -0.27 0.00 1.01 0.06 -0.98 120.40 122.12 3e93 s VAL 52 Ca 0.05 -0.90 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 3e93 s VAL 52 Cb -0.12 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 3e93 s VAL 52 CO 0.02 0.52 0.11 -0.75 0.00 0.00 0.00 175.10 175.00 3e93 s LYS 53 N 1.31 3.66 -0.32 2.72 2.20 0.60 -1.15 119.74 128.76 3e93 s LYS 53 Ca 0.05 -0.49 -0.20 0.00 -0.36 0.00 0.00 55.97 54.97 3e93 s LYS 53 Cb -0.13 -3.44 -0.01 0.00 -1.51 0.00 0.00 37.83 32.74 3e93 s LYS 53 CO -0.12 -0.23 0.62 0.21 -0.36 0.00 0.00 175.35 175.47 3e93 s LYS 54 N 1.65 3.84 0.29 4.03 2.20 -0.43 -0.70 119.74 130.61 3e93 s LYS 54 Ca 0.06 0.21 -0.29 0.00 -0.36 0.00 0.00 55.97 55.59 3e93 s LYS 54 Cb -0.16 -3.75 -0.10 0.00 -1.51 0.00 0.00 37.83 32.31 3e93 s LYS 54 CO 0.06 -0.61 1.33 -0.51 -0.36 0.00 0.00 175.35 175.26 3e93 s LEU 55 N 2.61 4.42 -0.23 5.43 1.43 -0.71 -1.93 118.68 129.72 3e93 s LEU 55 Ca 0.24 2.62 -0.17 0.00 -1.03 0.00 0.00 54.13 55.79 3e93 s LEU 55 Cb -0.15 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.40 3e93 s LEU 55 CO 0.13 -0.56 0.47 -0.55 0.23 0.00 0.00 176.35 176.07 3e93 s SER 56 N -0.17 6.46 -1.16 2.29 0.15 -0.81 -4.46 113.70 116.01 3e93 s SER 56 Ca 0.52 0.54 -0.26 0.00 0.70 0.00 0.00 55.95 57.45 3e93 s SER 56 Cb -0.39 -2.26 0.02 0.00 -1.71 0.00 0.00 66.02 61.67 3e93 s SER 56 CO 0.48 -0.18 0.74 0.54 1.20 0.00 0.00 173.24 176.02 3e93 n ARG 57 N 4.97 -0.79 0.26 5.44 1.74 -1.26 -4.63 116.66 122.40 3e93 n ARG 57 Ca -0.06 0.31 0.12 0.00 -0.77 0.00 0.00 57.85 57.45 3e93 n ARG 57 Cb 0.50 -3.38 0.73 0.00 -1.02 0.00 0.00 32.46 29.30 3e93 n ARG 57 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3e93 h PRO 58 N -2.15 0.00 0.00 5.56 0.13 -1.83 -3.05 132.00 130.66 3e93 h PRO 58 Ca -0.68 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.43 3e93 h PRO 58 Cb 1.38 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.45 3e93 h PRO 58 CO 0.49 0.10 -0.47 1.19 -0.23 0.00 0.00 178.00 179.08 3e93 n PHE 59 N -3.81 0.00 0.24 1.56 3.72 -1.26 -2.62 117.46 115.28 3e93 n PHE 59 Ca -0.02 -1.18 0.11 0.00 -0.05 0.00 0.00 57.45 56.31 3e93 n PHE 59 Cb 0.20 -0.21 0.54 0.00 -0.94 0.00 0.00 39.48 39.08 3e93 n PHE 59 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 3e93 h GLN 60 N 0.74 0.00 -3.72 -1.08 3.07 -1.89 -3.45 115.11 108.78 3e93 h GLN 60 Ca -0.03 0.00 -0.07 0.00 0.09 0.00 0.00 58.65 58.64 3e93 h GLN 60 Cb 1.15 0.00 -0.10 0.00 0.08 0.00 0.00 27.48 28.61 3e93 h GLN 60 CO 0.01 0.18 -0.17 -1.54 0.09 0.00 0.00 178.83 177.41 3e93 s SER 61 N -6.13 -0.07 0.17 0.06 1.04 -1.26 -5.02 113.70 102.49 3e93 s SER 61 Ca -0.00 -0.93 -0.15 0.00 0.48 0.00 0.00 55.95 55.36 3e93 s SER 61 Cb 0.11 0.56 0.07 0.00 0.10 0.00 0.00 66.02 66.85 3e93 s SER 61 CO 0.62 -1.09 1.81 0.40 0.98 0.00 0.00 173.24 175.96 3e93 h ILE 62 N 2.31 1.06 -0.37 -1.02 2.04 -1.94 0.74 117.51 120.33 3e93 h ILE 62 Ca -0.27 -0.20 0.03 0.00 1.00 0.00 0.00 64.86 65.41 3e93 h ILE 62 Cb 1.25 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 3e93 h ILE 62 CO 0.38 0.11 0.19 0.40 0.00 0.00 0.00 178.15 179.22 3e93 h ILE 63 N 0.58 0.99 -0.26 -0.67 2.04 -1.97 -0.01 117.51 118.20 3e93 h ILE 63 Ca 0.18 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.90 3e93 h ILE 63 Cb -0.00 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3e93 h ILE 63 CO -0.07 0.07 0.10 0.45 0.00 0.00 0.00 178.15 178.69 3e93 h HIS 64 N 0.39 0.41 -0.79 1.37 3.86 -1.79 -1.69 115.15 116.91 3e93 h HIS 64 Ca 0.15 -0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 3e93 h HIS 64 Cb 0.05 -0.12 -0.04 0.00 1.06 0.00 0.00 27.41 28.37 3e93 h HIS 64 CO -0.10 0.43 0.45 0.00 0.86 0.00 0.00 177.93 179.57 3e93 h ALA 65 N 0.94 1.00 -0.30 2.45 0.00 -0.55 0.02 119.26 122.82 3e93 h ALA 65 Ca 0.09 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 3e93 h ALA 65 Cb 0.20 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3e93 h ALA 65 CO -0.01 0.50 -0.19 -0.22 0.00 0.00 0.00 179.25 179.33 3e93 h LYS 66 N 1.08 0.66 -0.80 0.00 3.64 -0.98 -1.68 116.57 118.49 3e93 h LYS 66 Ca 0.28 -0.31 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 3e93 h LYS 66 Cb 0.00 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.76 3e93 h LYS 66 CO -0.05 0.91 0.50 -0.09 -2.27 0.00 0.00 179.45 178.45 3e93 h ARG 67 N 0.41 0.92 0.21 1.90 2.43 -0.96 0.25 114.38 119.54 3e93 h ARG 67 Ca 0.06 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 3e93 h ARG 67 Cb 0.73 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 3e93 h ARG 67 CO 0.05 0.61 -0.12 1.15 -1.51 0.00 0.00 179.97 180.15 3e93 h THR 68 N 0.94 0.75 -0.46 0.20 2.02 -0.87 -0.57 112.91 114.93 3e93 h THR 68 Ca 0.34 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.56 3e93 h THR 68 Cb 0.09 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 3e93 h THR 68 CO -0.14 0.00 0.21 0.22 0.37 0.00 0.00 175.52 176.18 3e93 h TYR 69 N -0.31 0.38 -0.01 3.16 3.20 -1.02 -1.90 116.97 120.47 3e93 h TYR 69 Ca -0.02 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.90 3e93 h TYR 69 Cb 0.25 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 3e93 h TYR 69 CO -0.08 0.17 -0.26 -0.09 -1.64 0.00 0.00 178.16 176.27 3e93 h ARG 70 N 0.42 -0.38 -0.54 1.82 2.43 -0.31 -0.52 114.38 117.29 3e93 h ARG 70 Ca 0.21 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 3e93 h ARG 70 Cb 0.15 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 3e93 h ARG 70 CO -0.17 -0.25 0.36 1.49 -1.51 0.00 0.00 179.97 179.88 3e93 h GLU 71 N -0.40 0.70 -0.38 0.20 4.81 -1.01 -1.03 114.58 117.48 3e93 h GLU 71 Ca 0.07 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 3e93 h GLU 71 Cb 0.49 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 3e93 h GLU 71 CO -0.24 0.47 0.15 1.25 -0.73 0.00 0.00 179.01 179.91 3e93 h LEU 72 N 0.72 0.52 -0.78 1.64 5.85 -1.17 -0.59 115.31 121.50 3e93 h LEU 72 Ca 0.20 -0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.82 3e93 h LEU 72 Cb -0.07 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 40.76 3e93 h LEU 72 CO -0.05 0.54 0.46 0.03 -0.34 0.00 0.00 178.44 179.08 3e93 h ARG 73 N 0.46 0.80 -0.08 1.25 2.47 -1.00 -0.59 114.38 117.69 3e93 h ARG 73 Ca 0.13 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 58.78 3e93 h ARG 73 Cb 0.18 -0.18 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3e93 h ARG 73 CO -0.01 0.53 -0.03 1.25 0.56 0.00 0.00 179.97 182.27 3e93 h LEU 74 N 0.82 0.17 -1.22 3.04 6.46 -0.82 -2.45 115.31 121.31 3e93 h LEU 74 Ca 0.35 -0.40 -0.06 0.00 -0.12 0.00 0.00 57.88 57.65 3e93 h LEU 74 Cb 0.22 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.09 3e93 h LEU 74 CO -0.19 0.52 -0.12 -0.07 -0.62 0.00 0.00 178.44 177.96 3e93 h LEU 75 N -0.19 0.37 -1.36 2.25 3.38 -1.00 -1.78 115.31 116.98 3e93 h LEU 75 Ca 0.02 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 3e93 h LEU 75 Cb 0.46 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3e93 h LEU 75 CO 0.01 0.53 -0.31 0.11 0.09 0.00 0.00 178.44 178.87 3e93 h LYS 76 N 0.36 0.03 0.09 1.13 1.57 -0.99 -3.24 116.57 115.52 3e93 h LYS 76 Ca 0.07 -0.01 -0.29 0.00 -1.87 0.00 0.00 60.65 58.55 3e93 h LYS 76 Cb 0.44 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 3e93 h LYS 76 CO 0.03 0.33 -1.44 1.25 -0.57 0.00 0.00 179.45 179.04 3e93 h HIS 77 N 0.02 0.35 -2.95 -1.35 2.76 -0.86 -3.46 115.15 109.66 3e93 h HIS 77 Ca 0.00 -0.26 -0.56 0.00 -2.20 0.00 0.00 60.37 57.35 3e93 h HIS 77 Cb 0.55 -0.01 -0.05 0.00 1.55 0.00 0.00 27.41 29.45 3e93 h HIS 77 CO 0.00 1.28 1.15 -1.64 -1.30 0.00 0.00 177.93 177.42 3e93 s MET 78 N -2.63 3.40 -0.44 5.26 -1.94 -0.75 -4.93 119.30 117.26 3e93 s MET 78 Ca -0.07 0.97 0.02 0.00 -1.71 0.00 0.00 55.69 54.91 3e93 s MET 78 Cb 0.07 -4.11 0.15 0.00 2.01 0.00 0.00 34.83 32.95 3e93 s MET 78 CO 0.85 -1.79 0.28 0.15 -0.01 0.00 0.00 175.02 174.50 3e93 s LYS 79 N 5.37 1.18 -0.19 2.03 1.02 -1.26 -4.36 119.74 123.53 3e93 s LYS 79 Ca 0.65 -2.02 -0.20 0.00 0.02 0.00 0.00 55.97 54.42 3e93 s LYS 79 Cb -0.15 -2.04 0.05 0.00 -0.52 0.00 0.00 37.83 35.17 3e93 s LYS 79 CO 0.31 -1.23 0.56 -1.58 -0.92 0.00 0.00 175.35 172.48 3e93 s HIS 80 N 0.26 -0.60 0.54 3.18 2.46 -1.26 -5.06 115.29 114.82 3e93 s HIS 80 Ca 0.22 1.42 0.24 0.00 0.47 0.00 0.00 55.06 57.41 3e93 s HIS 80 Cb -0.16 0.22 1.44 0.00 -0.13 0.00 0.00 32.58 33.94 3e93 s HIS 80 CO -0.05 -0.32 2.05 0.93 -2.47 0.00 0.00 174.74 174.88 3e93 h GLU 81 N 5.06 0.00 -0.37 2.88 5.08 -1.98 -2.55 114.58 122.70 3e93 h GLU 81 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 3e93 h GLU 81 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3e93 h GLU 81 CO 0.18 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.28 3e93 n ASN 82 N -4.25 4.28 -3.86 1.42 5.03 -1.26 -4.74 115.26 111.88 3e93 n ASN 82 Ca 0.05 -2.85 -0.17 0.00 0.87 0.00 0.00 54.58 52.48 3e93 n ASN 82 Cb 0.43 -0.55 -0.16 0.00 -1.02 0.00 0.00 39.78 38.48 3e93 n ASN 82 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3e93 s VAL 83 N -2.54 0.28 0.29 2.41 1.01 -0.96 -0.20 120.40 120.69 3e93 s VAL 83 Ca 0.44 -0.02 -0.29 0.00 0.00 0.00 0.00 61.98 62.11 3e93 s VAL 83 Cb 0.33 -0.33 -0.13 0.00 0.00 0.00 0.00 36.38 36.25 3e93 s VAL 83 CO 0.13 0.15 1.25 0.00 0.00 0.00 0.00 175.10 176.62 3e93 n ILE 84 N 3.83 1.65 -4.51 2.22 0.13 -0.39 -4.43 119.36 117.86 3e93 n ILE 84 Ca -0.23 -0.41 -0.25 0.00 -1.10 0.00 0.00 62.75 60.75 3e93 n ILE 84 Cb 0.52 -1.36 -0.09 0.00 -0.84 0.00 0.00 39.64 37.87 3e93 n ILE 84 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 3e93 s GLY 85 N -0.19 2.51 -0.30 4.50 0.00 -1.26 -4.77 107.32 107.80 3e93 s GLY 85 Ca 0.61 -1.36 -0.08 0.00 0.00 0.00 0.00 44.72 43.89 3e93 s GLY 85 CO 0.58 -1.85 0.10 -2.27 0.00 0.00 0.00 173.10 169.66 3e93 s LEU 86 N -3.59 3.92 0.13 0.66 2.96 -1.24 -4.59 118.68 116.93 3e93 s LEU 86 Ca 0.25 -0.67 -0.05 0.00 -0.22 0.00 0.00 54.13 53.44 3e93 s LEU 86 Cb 0.04 -1.91 -0.09 0.00 0.50 0.00 0.00 46.19 44.73 3e93 s LEU 86 CO 0.14 -0.20 1.31 -0.07 -1.32 0.00 0.00 176.35 176.22 3e93 h LEU 87 N 8.26 0.57 -7.00 -0.68 3.38 -1.34 -3.41 115.31 115.09 3e93 h LEU 87 Ca -0.31 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 57.24 3e93 h LEU 87 Cb 1.13 -0.17 -0.17 0.00 0.09 0.00 0.00 40.66 41.54 3e93 h LEU 87 CO 0.61 1.23 0.36 -0.62 0.09 0.00 0.00 178.44 180.11 3e93 s ASP 88 N -7.08 -0.49 -0.06 -0.43 2.15 -1.08 -4.52 116.67 105.16 3e93 s ASP 88 Ca -0.06 0.26 -0.04 0.00 0.43 0.00 0.00 52.55 53.13 3e93 s ASP 88 Cb 0.09 0.46 0.03 0.00 -0.30 0.00 0.00 42.92 43.19 3e93 s ASP 88 CO 0.87 -0.65 0.16 0.54 -0.17 0.00 0.00 175.17 175.92 3e93 s VAL 89 N -2.40 -0.02 0.14 1.11 0.11 -1.26 -0.60 120.40 117.48 3e93 s VAL 89 Ca -0.01 0.07 -0.10 0.00 -2.93 0.00 0.00 61.98 59.01 3e93 s VAL 89 Cb -0.01 -0.24 0.00 0.00 -1.53 0.00 0.00 36.38 34.60 3e93 s VAL 89 CO -0.03 0.03 0.28 0.72 -3.33 0.00 0.00 175.10 172.77 3e93 s PHE 90 N 0.53 0.22 -0.01 1.54 -0.12 -0.68 -4.97 117.98 114.49 3e93 s PHE 90 Ca -0.04 -0.60 -0.01 0.00 -0.05 0.00 0.00 56.93 56.23 3e93 s PHE 90 Cb -0.05 0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.34 3e93 s PHE 90 CO -0.03 -0.67 0.03 -0.08 -0.05 0.00 0.00 175.22 174.42 3e93 s THR 91 N -3.91 0.02 -0.78 -4.49 -1.32 -1.26 -1.61 115.64 102.28 3e93 s THR 91 Ca 0.11 -0.13 0.20 0.00 -1.21 0.00 0.00 61.69 60.67 3e93 s THR 91 Cb 0.03 -0.09 0.20 0.00 -1.51 0.00 0.00 72.50 71.13 3e93 s THR 91 CO -0.05 -0.07 1.63 -2.65 -2.21 0.00 0.00 174.62 171.27 3e93 n PRO 92 N 2.84 0.10 -1.96 7.08 -0.02 -1.26 -4.84 135.00 136.94 3e93 n PRO 92 Ca -0.14 0.28 -0.41 0.00 -2.02 0.00 0.00 63.50 61.22 3e93 n PRO 92 Cb 0.59 -1.66 -0.01 0.00 -0.02 0.00 0.00 33.50 32.39 3e93 n PRO 92 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3e93 s ALA 93 N -3.13 3.57 -0.98 3.55 0.00 -1.26 -4.94 121.76 118.58 3e93 s ALA 93 Ca 0.07 1.41 0.24 0.00 0.00 0.00 0.00 51.96 53.68 3e93 s ALA 93 Cb 0.11 -3.55 0.31 0.00 0.00 0.00 0.00 23.12 19.98 3e93 s ALA 93 CO 0.37 -0.83 1.28 0.54 0.00 0.00 0.00 175.76 177.11 3e93 n ARG 94 N 1.10 0.02 -3.91 0.00 3.00 -1.26 -4.97 116.66 110.64 3e93 n ARG 94 Ca 0.02 0.00 -0.09 0.00 -0.01 0.00 0.00 57.85 57.77 3e93 n ARG 94 Cb 0.40 -1.51 -0.06 0.00 0.00 0.00 0.00 32.46 31.30 3e93 n ARG 94 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 3e93 s SER 95 N -3.06 -0.07 0.29 0.55 1.04 -1.26 -5.03 113.70 106.16 3e93 s SER 95 Ca 0.10 -0.78 -0.01 0.00 0.48 0.00 0.00 55.95 55.74 3e93 s SER 95 Cb 0.17 0.51 0.48 0.00 0.10 0.00 0.00 66.02 67.28 3e93 s SER 95 CO 0.74 -0.99 1.90 0.25 0.98 0.00 0.00 173.24 176.12 3e93 h LEU 96 N 2.39 0.96 -1.31 2.42 5.85 -1.96 -2.43 115.31 121.24 3e93 h LEU 96 Ca -0.30 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.49 3e93 h LEU 96 Cb 1.24 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 42.03 3e93 h LEU 96 CO 0.43 0.61 0.50 -0.33 -0.34 0.00 0.00 178.44 179.31 3e93 h GLU 97 N 1.09 0.83 -0.38 1.25 3.07 -2.01 -2.00 114.58 116.44 3e93 h GLU 97 Ca 0.41 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 3e93 h GLU 97 Cb 0.20 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 3e93 h GLU 97 CO -0.16 0.55 0.00 -0.85 -1.40 0.00 0.00 179.01 177.15 3e93 n GLU 98 N -4.47 2.36 -2.22 2.33 0.28 -1.05 -4.96 120.64 112.91 3e93 n GLU 98 Ca 0.11 -2.15 -0.43 0.00 -0.16 0.00 0.00 57.16 54.53 3e93 n GLU 98 Cb 0.19 -1.43 -0.02 0.00 1.43 0.00 0.00 31.44 31.60 3e93 n GLU 98 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 3e93 s PHE 99 N -1.25 2.41 0.00 -1.84 5.36 -0.75 -4.72 117.98 117.19 3e93 s PHE 99 Ca 0.34 0.61 0.00 0.00 -0.96 0.00 0.00 56.93 56.92 3e93 s PHE 99 Cb 0.19 -3.73 0.00 0.00 -0.34 0.00 0.00 43.02 39.14 3e93 s PHE 99 CO 0.26 -2.73 0.00 0.09 -1.46 0.00 0.00 175.22 171.39 3e93 n ASN 100 N 7.00 0.00 -4.04 6.13 3.02 -1.26 -5.03 115.26 121.08 3e93 n ASN 100 Ca 0.16 0.00 -0.19 0.00 -0.03 0.00 0.00 54.58 54.51 3e93 n ASN 100 Cb 0.44 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.46 3e93 n ASN 100 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3e93 s ASP 101 N 0.00 1.17 -0.05 6.41 1.01 -1.26 -4.65 116.67 119.29 3e93 s ASP 101 Ca 0.00 -0.18 0.03 0.00 0.71 0.00 0.00 52.55 53.11 3e93 s ASP 101 Cb 0.00 -0.14 0.00 0.00 1.01 0.00 0.00 42.92 43.79 3e93 s ASP 101 CO 0.00 0.12 -0.14 -0.69 0.21 0.00 0.00 175.17 174.66 3e93 s VAL 102 N -0.21 1.26 -0.08 -1.27 1.01 -1.26 -4.51 120.40 115.34 3e93 s VAL 102 Ca 0.03 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.46 3e93 s VAL 102 Cb -0.04 -1.11 -0.00 0.00 0.00 0.00 0.00 36.38 35.23 3e93 s VAL 102 CO -0.00 0.38 -0.22 -0.31 0.00 0.00 0.00 175.10 174.95 3e93 s TYR 103 N 0.31 2.25 -0.09 5.22 1.51 -0.63 -1.73 117.35 124.20 3e93 s TYR 103 Ca -0.09 -0.82 0.02 0.00 -1.01 0.00 0.00 57.07 55.17 3e93 s TYR 103 Cb -0.13 -1.51 -0.02 0.00 -0.11 0.00 0.00 41.96 40.18 3e93 s TYR 103 CO 0.03 -0.32 -0.14 -0.51 -1.11 0.00 0.00 175.55 173.50 3e93 s LEU 104 N 0.24 2.72 -0.11 -1.29 1.43 0.12 -1.68 118.68 120.09 3e93 s LEU 104 Ca -0.13 -0.26 0.03 0.00 -1.03 0.00 0.00 54.13 52.75 3e93 s LEU 104 Cb -0.16 -1.58 0.00 0.00 0.03 0.00 0.00 46.19 44.49 3e93 s LEU 104 CO 0.06 0.26 -0.23 -0.69 0.23 0.00 0.00 176.35 175.99 3e93 s VAL 105 N -0.25 2.04 0.30 -1.59 1.01 0.23 -0.29 120.40 121.85 3e93 s VAL 105 Ca 0.01 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.03 3e93 s VAL 105 Cb -0.13 -1.78 -0.06 0.00 0.00 0.00 0.00 36.38 34.41 3e93 s VAL 105 CO 0.03 0.55 0.08 0.42 0.00 0.00 0.00 175.10 176.18 3e93 s THR 106 N 0.53 0.90 0.50 3.92 -4.23 -0.15 -0.85 115.64 116.26 3e93 s THR 106 Ca -0.14 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.15 3e93 s THR 106 Cb -0.17 -2.71 -0.08 0.00 1.34 0.00 0.00 72.50 70.87 3e93 s THR 106 CO 0.05 0.00 0.96 1.41 -0.54 0.00 0.00 174.62 176.50 3e93 n HIS 107 N -0.60 0.92 -2.79 3.99 8.25 -1.26 -0.88 115.22 122.84 3e93 n HIS 107 Ca -0.01 0.50 -0.42 0.00 -0.26 0.00 0.00 57.72 57.53 3e93 n HIS 107 Cb 0.66 -2.18 -0.03 0.00 1.12 0.00 0.00 29.99 29.56 3e93 n HIS 107 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3e93 s LEU 108 N -0.98 4.26 0.25 2.41 2.96 -0.69 -4.14 118.68 122.76 3e93 s LEU 108 Ca 0.68 1.42 -0.16 0.00 -0.22 0.00 0.00 54.13 55.85 3e93 s LEU 108 Cb -0.49 -3.41 -0.08 0.00 0.50 0.00 0.00 46.19 42.70 3e93 s LEU 108 CO 0.53 -0.36 0.69 -0.04 -1.32 0.00 0.00 176.35 175.85 3e93 s MET 109 N 1.71 4.07 0.00 1.98 -1.94 -1.26 -4.92 119.30 118.93 3e93 s MET 109 Ca 0.45 0.68 0.00 0.00 -1.71 0.00 0.00 55.69 55.11 3e93 s MET 109 Cb -0.18 -2.68 0.00 0.00 2.01 0.00 0.00 34.83 33.98 3e93 s MET 109 CO 0.18 0.30 0.00 0.41 -0.01 0.00 0.00 175.02 175.90 3e93 n GLY 110 N 0.20 0.28 3.83 -0.03 0.00 -1.26 -5.05 105.19 103.15 3e93 n GLY 110 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3e93 n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3e93 s ALA 111 N -4.00 3.07 0.49 4.61 0.00 -1.25 -4.92 121.76 119.76 3e93 s ALA 111 Ca 0.00 0.32 0.08 0.00 0.00 0.00 0.00 51.96 52.36 3e93 s ALA 111 Cb 0.00 -3.11 0.04 0.00 0.00 0.00 0.00 23.12 20.04 3e93 s ALA 111 CO 0.00 0.05 0.59 0.16 0.00 0.00 0.00 175.76 176.56 3e93 s ASP 112 N -2.41 5.20 0.54 0.00 1.47 -1.26 -0.86 116.67 119.35 3e93 s ASP 112 Ca 0.61 -0.75 0.32 0.00 1.18 0.00 0.00 52.55 53.91 3e93 s ASP 112 Cb -0.09 -0.16 1.43 0.00 -0.34 0.00 0.00 42.92 43.76 3e93 s ASP 112 CO 0.18 -0.99 2.02 0.25 0.68 0.00 0.00 175.17 177.31 3e93 h LEU 113 N 0.57 0.00 -0.08 2.11 5.85 -0.87 -2.21 115.31 120.68 3e93 h LEU 113 Ca -0.36 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.36 3e93 h LEU 113 Cb 1.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 3e93 h LEU 113 CO 0.48 0.07 0.05 0.78 -0.34 0.00 0.00 178.44 179.47 3e93 h ASN 114 N 0.00 0.10 -0.76 1.25 2.35 -1.86 -0.32 115.58 116.35 3e93 h ASN 114 Ca -0.00 -0.08 0.06 0.00 -0.55 0.00 0.00 56.30 55.73 3e93 h ASN 114 Cb 0.46 -0.03 -0.06 0.00 0.05 0.00 0.00 38.32 38.75 3e93 h ASN 114 CO 0.01 0.16 0.44 -1.13 -1.65 0.00 0.00 177.43 175.26 3e93 h ASN 115 N 0.04 0.68 0.35 5.81 -1.24 -1.78 0.82 115.58 120.27 3e93 h ASN 115 Ca 0.03 0.03 -0.02 0.00 0.71 0.00 0.00 56.30 57.05 3e93 h ASN 115 Cb 0.08 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.02 3e93 h ASN 115 CO -0.00 0.43 -0.17 0.40 -1.29 0.00 0.00 177.43 176.80 3e93 h ILE 116 N 0.81 0.67 -0.59 2.57 1.08 -1.27 -1.79 117.51 118.99 3e93 h ILE 116 Ca 0.34 -0.22 -0.04 0.00 -0.39 0.00 0.00 64.86 64.55 3e93 h ILE 116 Cb 0.19 0.78 -0.03 0.00 -3.07 0.00 0.00 36.82 34.70 3e93 h ILE 116 CO -0.18 0.04 0.22 0.58 -0.69 0.00 0.00 178.15 178.12 3e93 h VAL 117 N -0.59 1.21 -0.06 1.67 2.07 -0.87 0.81 116.25 120.49 3e93 h VAL 117 Ca -0.05 -0.69 -0.20 0.00 0.82 0.00 0.00 66.70 66.58 3e93 h VAL 117 Cb 0.43 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 3e93 h VAL 117 CO 0.08 0.27 -0.81 0.11 0.02 0.00 0.00 177.57 177.24 3e93 h LYS 118 N 0.84 0.45 0.00 1.57 1.57 -0.79 -3.39 116.57 116.82 3e93 h LYS 118 Ca 0.20 -0.40 -0.28 0.00 -1.87 0.00 0.00 60.65 58.29 3e93 h LYS 118 Cb 0.19 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.55 3e93 h LYS 118 CO -0.02 1.05 -2.06 0.00 -0.57 0.00 0.00 179.45 177.86 3e93 s GLN 120 N -2.37 3.00 -0.15 0.00 0.74 0.27 -5.08 119.66 116.06 3e93 s GLN 120 Ca -0.17 -0.64 -0.09 0.00 0.05 0.00 0.00 55.36 54.51 3e93 s GLN 120 Cb 0.06 -2.79 -0.04 0.00 1.10 0.00 0.00 33.01 31.33 3e93 s GLN 120 CO 0.52 0.57 0.15 0.21 -0.55 0.00 0.00 175.29 176.20 3e93 s LYS 121 N -2.43 3.80 -0.22 1.67 2.20 -1.26 -4.57 119.74 118.93 3e93 s LYS 121 Ca 0.30 -0.13 -0.08 0.00 -0.36 0.00 0.00 55.97 55.70 3e93 s LYS 121 Cb -0.12 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.86 3e93 s LYS 121 CO 0.23 0.55 0.10 -0.51 -0.36 0.00 0.00 175.35 175.37 3e93 s LEU 122 N -0.39 3.81 0.84 5.43 1.43 -1.26 -5.09 118.68 123.44 3e93 s LEU 122 Ca 0.13 0.00 -0.12 0.00 -1.03 0.00 0.00 54.13 53.11 3e93 s LEU 122 Cb -0.12 -2.00 0.10 0.00 0.03 0.00 0.00 46.19 44.19 3e93 s LEU 122 CO 0.02 0.07 1.15 0.42 0.23 0.00 0.00 176.35 178.24 3e93 s THR 123 N 1.00 2.24 0.30 5.49 -4.23 -1.26 -4.86 115.64 114.32 3e93 s THR 123 Ca 0.05 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.64 3e93 s THR 123 Cb -0.14 -2.95 0.16 0.00 1.34 0.00 0.00 72.50 70.91 3e93 s THR 123 CO 0.03 -0.10 1.85 -0.78 -0.54 0.00 0.00 174.62 175.08 3e93 h ASP 124 N -1.20 0.71 -0.72 3.99 3.58 -1.98 -1.04 116.42 119.76 3e93 h ASP 124 Ca -0.48 -0.12 0.01 0.00 0.42 0.00 0.00 57.03 56.87 3e93 h ASP 124 Cb 1.32 -0.18 -0.04 0.00 1.72 0.00 0.00 39.33 42.15 3e93 h ASP 124 CO 0.64 0.70 0.47 -0.78 -2.88 0.00 0.00 179.24 177.38 3e93 h ASP 125 N 0.74 0.80 -0.32 2.28 3.58 -1.99 0.27 116.42 121.78 3e93 h ASP 125 Ca 0.17 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.60 3e93 h ASP 125 Cb 0.27 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 3e93 h ASP 125 CO -0.00 0.57 0.21 0.45 -2.88 0.00 0.00 179.24 177.59 3e93 h HIS 126 N 0.95 0.40 -0.16 0.28 3.86 -1.67 -0.68 115.15 118.13 3e93 h HIS 126 Ca 0.27 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.49 3e93 h HIS 126 Cb -0.08 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.25 3e93 h HIS 126 CO -0.03 0.25 0.10 0.28 0.86 0.00 0.00 177.93 179.39 3e93 h VAL 127 N 0.43 1.06 -0.53 2.45 2.07 -0.86 -1.07 116.25 119.81 3e93 h VAL 127 Ca 0.12 -0.15 0.11 0.00 0.82 0.00 0.00 66.70 67.60 3e93 h VAL 127 Cb -0.05 0.88 -0.10 0.00 -1.52 0.00 0.00 31.29 30.50 3e93 h VAL 127 CO -0.03 0.06 -0.18 1.56 0.02 0.00 0.00 177.57 179.00 3e93 h GLN 128 N 0.19 -0.05 -0.36 1.57 4.20 -0.25 -1.33 115.11 119.08 3e93 h GLN 128 Ca 0.06 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 3e93 h GLN 128 Cb 0.01 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 3e93 h GLN 128 CO -0.01 -0.04 -0.13 0.35 -0.67 0.00 0.00 178.83 178.34 3e93 h PHE 129 N -0.06 0.81 0.09 2.96 3.57 -0.81 -0.71 116.94 122.79 3e93 h PHE 129 Ca 0.25 -0.19 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 3e93 h PHE 129 Cb 0.44 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.99 3e93 h PHE 129 CO -0.48 0.89 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.37 3e93 h LEU 130 N 0.50 -0.10 -0.77 0.59 3.38 -1.03 -1.89 115.31 115.99 3e93 h LEU 130 Ca 0.08 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 3e93 h LEU 130 Cb 0.65 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 3e93 h LEU 130 CO 0.04 0.25 0.40 0.40 0.09 0.00 0.00 178.44 179.63 3e93 h ILE 131 N -0.48 1.24 -0.62 1.22 1.08 -1.30 -2.01 117.51 116.64 3e93 h ILE 131 Ca -0.01 -0.62 0.11 0.00 -0.39 0.00 0.00 64.86 63.95 3e93 h ILE 131 Cb 0.40 0.24 -0.08 0.00 -3.07 0.00 0.00 36.82 34.30 3e93 h ILE 131 CO 0.02 0.27 0.18 0.22 -0.69 0.00 0.00 178.15 178.15 3e93 h TYR 132 N 1.07 0.29 -0.22 1.37 3.20 -1.06 -0.89 116.97 120.73 3e93 h TYR 132 Ca 0.27 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 62.02 3e93 h TYR 132 Cb 0.07 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 3e93 h TYR 132 CO 0.00 0.02 -0.49 1.96 -1.64 0.00 0.00 178.16 178.01 3e93 h GLN 133 N 0.32 0.59 -0.23 1.82 4.20 -1.00 -0.39 115.11 120.43 3e93 h GLN 133 Ca 0.33 -0.34 0.02 0.00 0.06 0.00 0.00 58.65 58.71 3e93 h GLN 133 Cb 0.47 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 3e93 h GLN 133 CO -0.38 0.95 0.10 0.82 -0.67 0.00 0.00 178.83 179.65 3e93 h ILE 134 N 0.47 0.98 -0.20 2.54 2.04 -0.93 -1.41 117.51 120.98 3e93 h ILE 134 Ca 0.02 -0.08 -0.13 0.00 1.00 0.00 0.00 64.86 65.68 3e93 h ILE 134 Cb 1.03 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 3e93 h ILE 134 CO 0.10 0.04 -0.41 -0.07 0.00 0.00 0.00 178.15 177.80 3e93 h LEU 135 N 0.22 0.51 -0.11 1.44 3.38 -1.00 0.24 115.31 120.00 3e93 h LEU 135 Ca 0.10 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 3e93 h LEU 135 Cb 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3e93 h LEU 135 CO -0.08 0.87 0.06 -0.09 0.09 0.00 0.00 178.44 179.28 3e93 h ARG 136 N 0.40 0.15 -0.31 1.13 2.43 -0.97 0.33 114.38 117.54 3e93 h ARG 136 Ca 0.03 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3e93 h ARG 136 Cb 0.89 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.40 3e93 h ARG 136 CO 0.08 0.20 0.19 0.78 -1.51 0.00 0.00 179.97 179.71 3e93 h GLY 137 N 0.07 0.45 1.01 2.80 0.00 -0.91 -2.83 103.07 103.65 3e93 h GLY 137 Ca 0.04 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 3e93 h GLY 137 CO -0.01 0.18 0.48 1.41 0.00 0.00 0.00 176.54 178.60 3e93 h LEU 138 N 0.40 0.95 -0.51 3.11 3.38 -0.40 -0.46 115.31 121.79 3e93 h LEU 138 Ca 0.11 -0.06 0.10 0.00 0.09 0.00 0.00 57.88 58.12 3e93 h LEU 138 Cb -0.01 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.42 3e93 h LEU 138 CO -0.02 0.73 0.03 0.50 0.09 0.00 0.00 178.44 179.77 3e93 h LYS 139 N 1.09 0.15 0.18 1.13 3.64 -0.23 0.30 116.57 122.83 3e93 h LYS 139 Ca 0.29 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.65 3e93 h LYS 139 Cb -0.05 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 3e93 h LYS 139 CO -0.05 0.10 -0.09 -0.92 -2.27 0.00 0.00 179.45 176.21 3e93 h TYR 140 N 0.15 -0.23 -0.32 1.91 5.03 -1.19 -1.49 116.97 120.84 3e93 h TYR 140 Ca 0.26 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.56 3e93 h TYR 140 Cb 0.38 0.08 -0.02 0.00 1.55 0.00 0.00 36.73 38.72 3e93 h TYR 140 CO -0.29 -0.13 0.20 0.82 -1.32 0.00 0.00 178.16 177.43 3e93 h ILE 141 N -0.26 1.10 -0.27 1.81 2.04 -0.50 -2.59 117.51 118.85 3e93 h ILE 141 Ca -0.03 -0.23 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 3e93 h ILE 141 Cb 0.20 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 3e93 h ILE 141 CO 0.04 0.10 -0.02 0.45 0.00 0.00 0.00 178.15 178.72 3e93 h HIS 142 N 0.42 0.43 0.00 1.37 3.86 -0.42 -1.91 115.15 118.90 3e93 h HIS 142 Ca 0.11 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 3e93 h HIS 142 Cb -0.01 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.34 3e93 h HIS 142 CO -0.04 0.45 -0.02 0.66 0.86 0.00 0.00 177.93 179.84 3e93 h SER 143 N 0.41 0.00 -0.37 2.45 4.64 -0.86 0.18 113.55 120.00 3e93 h SER 143 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3e93 h SER 143 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3e93 h SER 143 CO 0.01 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 3e93 n ALA 144 N -2.19 2.45 -3.83 5.18 0.00 -0.77 -4.75 120.51 116.60 3e93 n ALA 144 Ca -0.02 -0.80 -0.29 0.00 0.00 0.00 0.00 53.44 52.33 3e93 n ALA 144 Cb 0.13 -0.98 0.04 0.00 0.00 0.00 0.00 19.45 18.64 3e93 n ALA 144 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3e93 n ASP 145 N 0.92 -5.23 -4.62 0.00 8.00 0.65 -4.72 116.55 111.56 3e93 n ASP 145 Ca 0.17 -0.71 -0.34 0.00 0.71 0.00 0.00 54.79 54.62 3e93 n ASP 145 Cb 0.45 -4.20 -0.10 0.00 -0.02 0.00 0.00 41.12 37.25 3e93 n ASP 145 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3e93 s ILE 146 N -3.31 4.69 -0.18 0.53 1.01 -0.90 -5.03 121.20 118.02 3e93 s ILE 146 Ca 0.64 -0.07 -0.07 0.00 0.00 0.00 0.00 60.65 61.15 3e93 s ILE 146 Cb -0.31 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.01 3e93 s ILE 146 CO 0.80 0.46 0.05 -0.63 0.00 0.00 0.00 174.94 175.62 3e93 s ILE 147 N 0.41 4.70 0.01 2.92 1.01 -1.26 -3.77 121.20 125.21 3e93 s ILE 147 Ca 0.02 -0.07 -0.25 0.00 0.00 0.00 0.00 60.65 60.36 3e93 s ILE 147 Cb -0.13 -3.11 -0.16 0.00 0.01 0.00 0.00 42.46 39.08 3e93 s ILE 147 CO 0.01 0.47 1.17 -0.74 0.00 0.00 0.00 174.94 175.85 3e93 h HIS 148 N 6.62 -0.48 0.00 3.97 -0.00 -1.97 -3.47 115.15 119.83 3e93 h HIS 148 Ca -0.37 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 59.99 3e93 h HIS 148 Cb 1.17 0.16 0.00 0.00 -0.00 0.00 0.00 27.41 28.74 3e93 h HIS 148 CO 0.56 -0.15 0.00 -2.13 -0.00 0.00 0.00 177.93 176.21 3e93 n ARG 149 N -5.18 0.00 -2.39 5.26 0.63 -1.26 -4.75 116.66 108.97 3e93 n ARG 149 Ca -0.10 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.75 3e93 n ARG 149 Cb 0.28 -1.49 0.04 0.00 0.45 0.00 0.00 32.46 31.75 3e93 n ARG 149 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 3e93 n ASP 150 N 0.00 2.77 -4.72 6.15 2.03 -1.26 -4.96 116.55 116.57 3e93 n ASP 150 Ca 0.00 -2.72 -0.42 0.00 0.52 0.00 0.00 54.79 52.17 3e93 n ASP 150 Cb 0.00 -0.42 -0.03 0.00 -0.72 0.00 0.00 41.12 39.95 3e93 n ASP 150 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3e93 s LEU 151 N -3.52 4.38 0.04 -2.67 1.43 -1.26 -4.86 118.68 112.23 3e93 s LEU 151 Ca 0.37 2.35 -0.27 0.00 -1.03 0.00 0.00 54.13 55.55 3e93 s LEU 151 Cb 0.36 -3.59 0.09 0.00 0.03 0.00 0.00 46.19 43.08 3e93 s LEU 151 CO -0.02 -0.62 0.85 -1.59 0.23 0.00 0.00 176.35 175.20 3e93 s LYS 152 N 0.78 0.95 0.33 1.70 -2.85 -1.26 -4.79 119.74 114.60 3e93 s LYS 152 Ca 0.63 -0.38 0.10 0.00 -1.00 0.00 0.00 55.97 55.31 3e93 s LYS 152 Cb -0.37 0.42 0.87 0.00 -2.06 0.00 0.00 37.83 36.69 3e93 s LYS 152 CO 0.32 -0.42 1.76 -1.35 0.10 0.00 0.00 175.35 175.76 3e93 h PRO 153 N 2.00 0.60 0.00 1.78 0.11 -1.94 -0.86 132.00 133.69 3e93 h PRO 153 Ca -0.24 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3e93 h PRO 153 Cb 1.25 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3e93 h PRO 153 CO 0.31 0.40 0.00 0.66 -0.21 0.00 0.00 178.00 179.16 3e93 h SER 154 N 0.62 0.00 -0.58 -2.05 4.64 -1.95 -2.31 113.55 111.92 3e93 h SER 154 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 3e93 h SER 154 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3e93 h SER 154 CO -0.41 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.14 3e93 n ASN 155 N -2.78 4.17 -4.02 4.97 3.02 -0.33 -4.84 115.26 115.46 3e93 n ASN 155 Ca -0.00 -2.35 -0.31 0.00 -0.03 0.00 0.00 54.58 51.89 3e93 n ASN 155 Cb 0.20 -0.53 -0.16 0.00 -0.61 0.00 0.00 39.78 38.67 3e93 n ASN 155 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3e93 s LEU 156 N -1.61 2.20 -0.07 3.41 1.43 -0.89 -1.50 118.68 121.66 3e93 s LEU 156 Ca 0.45 -0.81 -0.11 0.00 -1.03 0.00 0.00 54.13 52.63 3e93 s LEU 156 Cb 0.28 -1.27 -0.05 0.00 0.03 0.00 0.00 46.19 45.19 3e93 s LEU 156 CO 0.22 -0.11 0.27 0.00 0.23 0.00 0.00 176.35 176.96 3e93 s ALA 157 N 1.39 3.77 -0.06 4.21 0.00 -0.58 -1.09 121.76 129.41 3e93 s ALA 157 Ca 0.00 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 51.51 3e93 s ALA 157 Cb -0.15 -2.19 0.03 0.00 0.00 0.00 0.00 23.12 20.81 3e93 s ALA 157 CO -0.09 0.51 -0.00 0.08 0.00 0.00 0.00 175.76 176.25 3e93 s VAL 158 N -0.89 0.33 0.81 0.00 1.01 -0.04 -1.27 120.40 120.35 3e93 s VAL 158 Ca 0.19 0.10 -0.09 0.00 0.00 0.00 0.00 61.98 62.18 3e93 s VAL 158 Cb -0.14 -0.46 0.18 0.00 0.00 0.00 0.00 36.38 35.96 3e93 s VAL 158 CO 0.08 0.23 1.11 -0.46 0.00 0.00 0.00 175.10 176.06 3e93 n ASN 159 N 4.78 0.62 0.25 3.32 0.23 -0.12 -3.90 115.26 120.44 3e93 n ASN 159 Ca -0.13 -1.73 0.13 0.00 -0.53 0.00 0.00 54.58 52.32 3e93 n ASN 159 Cb 0.50 -0.80 0.77 0.00 -2.08 0.00 0.00 39.78 38.18 3e93 n ASN 159 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3e93 h GLU 160 N 0.00 0.00 0.00 -3.83 4.39 -2.01 -3.36 114.58 109.77 3e93 h GLU 160 Ca -0.36 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.28 3e93 h GLU 160 Cb 1.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 3e93 h GLU 160 CO 0.31 0.00 -0.73 -0.25 -1.16 0.00 0.00 179.01 177.18 3e93 n ASP 161 N -4.17 1.83 0.00 1.42 8.00 -1.26 -5.24 116.55 117.14 3e93 n ASP 161 Ca -0.01 0.57 0.00 0.00 0.71 0.00 0.00 54.79 56.06 3e93 n ASP 161 Cb 0.16 -0.88 0.00 0.00 -0.02 0.00 0.00 41.12 40.38 3e93 n ASP 161 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3e93 n GLU 163 N -4.56 0.00 -4.73 -1.24 1.02 -1.26 -5.18 120.64 104.69 3e93 n GLU 163 Ca -0.13 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.75 3e93 n GLU 163 Cb 0.37 0.00 -0.14 0.00 -0.02 0.00 0.00 31.44 31.65 3e93 n GLU 163 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3e93 s LEU 164 N 0.00 2.14 -0.02 -4.62 0.20 -1.26 -0.95 118.68 114.17 3e93 s LEU 164 Ca 0.00 -0.49 0.04 0.00 0.69 0.00 0.00 54.13 54.37 3e93 s LEU 164 Cb 0.00 -1.00 -0.00 0.00 -0.43 0.00 0.00 46.19 44.76 3e93 s LEU 164 CO 0.00 0.18 -0.13 -0.54 -0.29 0.00 0.00 176.35 175.58 3e93 s LYS 165 N -1.01 1.18 -0.13 1.98 1.02 -0.40 -4.29 119.74 118.09 3e93 s LYS 165 Ca 0.08 -0.44 -0.24 0.00 0.02 0.00 0.00 55.97 55.39 3e93 s LYS 165 Cb -0.09 -1.09 -0.02 0.00 -0.52 0.00 0.00 37.83 36.11 3e93 s LYS 165 CO 0.01 0.21 0.75 0.42 -0.92 0.00 0.00 175.35 175.83 3e93 s ILE 166 N -0.06 4.97 0.27 2.17 1.01 0.71 -1.52 121.20 128.75 3e93 s ILE 166 Ca 0.00 1.49 0.05 0.00 0.00 0.00 0.00 60.65 62.19 3e93 s ILE 166 Cb -0.08 -4.07 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 3e93 s ILE 166 CO 0.00 0.12 0.16 0.00 0.00 0.00 0.00 174.94 175.23 3e93 n LEU 167 N 4.66 0.00 -3.74 2.97 -0.00 -0.56 -1.26 117.00 119.07 3e93 n LEU 167 Ca 0.01 -2.32 -0.29 0.00 -0.00 0.00 0.00 56.01 53.41 3e93 n LEU 167 Cb 0.50 1.03 -0.16 0.00 -0.00 0.00 0.00 43.42 44.79 3e93 n LEU 167 CO 0.47 -0.37 -0.35 -0.62 -0.00 0.00 0.00 177.39 176.51 3e93 s ASP 168 N -2.77 3.56 0.00 1.45 -1.08 -1.26 -4.75 116.67 111.81 3e93 s ASP 168 Ca 0.23 -1.26 0.15 0.00 -0.52 0.00 0.00 52.55 51.15 3e93 s ASP 168 Cb 0.01 -0.77 0.78 0.00 -1.46 0.00 0.00 42.92 41.48 3e93 s ASP 168 CO 0.16 -0.36 1.52 0.49 0.52 0.00 0.00 175.17 177.51 3e93 n PHE 169 N 4.93 0.08 -1.67 -5.34 3.72 -1.26 -4.90 117.46 113.02 3e93 n PHE 169 Ca -0.06 -0.04 -0.52 0.00 -0.05 0.00 0.00 57.45 56.78 3e93 n PHE 169 Cb 0.44 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.92 3e93 n PHE 169 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3e93 n GLY 170 N 0.84 1.17 0.58 1.37 0.00 -1.26 -5.11 105.19 102.77 3e93 n GLY 170 Ca 0.12 0.90 0.06 0.00 0.00 0.00 0.00 46.02 47.10 3e93 n GLY 170 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3e93 n LEU 171 N 6.54 2.30 0.00 0.99 4.77 -1.26 -5.00 117.00 125.34 3e93 n LEU 171 Ca 0.26 -3.36 0.00 0.00 -0.03 0.00 0.00 56.01 52.87 3e93 n LEU 171 Cb 0.23 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 3e93 n LEU 171 CO 0.76 1.09 0.00 0.41 -1.33 0.00 0.00 177.39 178.32 3e93 n THR 175 N -0.95 0.00 -0.15 -5.08 -1.04 -1.26 -1.04 114.28 104.76 3e93 n THR 175 Ca 0.16 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 62.06 3e93 n THR 175 Cb 0.73 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.23 3e93 n THR 175 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 3e93 h ASP 176 N 0.00 0.81 -1.00 8.00 3.32 -2.04 -3.13 116.42 122.37 3e93 h ASP 176 Ca 0.00 -0.35 0.16 0.00 0.02 0.00 0.00 57.03 56.86 3e93 h ASP 176 Cb 0.00 -0.22 -0.10 0.00 0.22 0.00 0.00 39.33 39.23 3e93 h ASP 176 CO 0.00 0.97 0.62 -0.78 -1.72 0.00 0.00 179.24 178.33 3e93 h ASP 177 N 0.64 0.85 0.59 6.45 3.58 -2.08 -1.97 116.42 124.50 3e93 h ASP 177 Ca 0.11 0.07 -0.03 0.00 0.42 0.00 0.00 57.03 57.61 3e93 h ASP 177 Cb 0.59 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.55 3e93 h ASP 177 CO 0.04 0.38 -0.14 -0.33 -2.88 0.00 0.00 179.24 176.31 3e93 h GLU 178 N 0.87 0.00 -0.26 0.28 5.08 -2.02 -1.84 114.58 116.70 3e93 h GLU 178 Ca 0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 3e93 h GLU 178 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 3e93 h GLU 178 CO -0.33 0.14 0.00 -1.33 -1.00 0.00 0.00 179.01 176.49 3e93 n MET 179 N -3.47 2.06 -3.25 2.33 2.81 -0.76 -4.71 117.12 112.13 3e93 n MET 179 Ca -0.01 -1.59 -0.38 0.00 -1.81 0.00 0.00 57.70 53.91 3e93 n MET 179 Cb 0.30 -1.44 -0.06 0.00 -0.71 0.00 0.00 33.22 31.31 3e93 n MET 179 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3e93 s THR 180 N -1.67 5.09 0.00 2.03 2.01 -0.69 -4.80 115.64 117.60 3e93 s THR 180 Ca 0.34 1.11 0.00 0.00 0.31 0.00 0.00 61.69 63.45 3e93 s THR 180 Cb 0.19 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.82 3e93 s THR 180 CO 0.28 0.35 0.00 0.61 -0.69 0.00 0.00 174.62 175.17 3e93 n GLY 181 N 2.97 -0.65 3.45 4.40 0.00 -1.26 -4.63 105.19 109.47 3e93 n GLY 181 Ca -0.06 -1.66 -0.44 0.00 0.00 0.00 0.00 46.02 43.86 3e93 n GLY 181 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3e93 s TYR 182 N 0.00 3.25 -0.06 1.61 5.04 -1.13 -3.55 117.35 122.51 3e93 s TYR 182 Ca 0.00 -1.64 -0.03 0.00 -2.44 0.00 0.00 57.07 52.96 3e93 s TYR 182 Cb 0.00 -4.29 0.03 0.00 0.35 0.00 0.00 41.96 38.05 3e93 s TYR 182 CO 0.00 -1.46 0.14 0.14 -1.34 0.00 0.00 175.55 173.04 3e93 s VAL 183 N 2.31 -0.03 -0.25 3.14 -7.23 -1.26 -5.02 120.40 112.06 3e93 s VAL 183 Ca 0.36 0.11 0.24 0.00 -1.81 0.00 0.00 61.98 60.88 3e93 s VAL 183 Cb -0.04 -0.22 0.25 0.00 0.56 0.00 0.00 36.38 36.92 3e93 s VAL 183 CO -0.06 0.05 1.74 0.00 -0.31 0.00 0.00 175.10 176.51 3e93 h ALA 184 N 6.76 1.00 0.00 1.32 0.00 -1.94 -2.34 119.26 124.06 3e93 h ALA 184 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3e93 h ALA 184 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3e93 h ALA 184 CO 0.42 0.00 0.00 1.79 0.00 0.00 0.00 179.25 181.46 3e93 h THR 185 N 0.00 0.00 0.00 0.00 1.35 -1.96 -3.18 112.91 109.13 3e93 h THR 185 Ca 0.00 -0.15 -0.01 0.00 -0.55 0.00 0.00 66.41 65.71 3e93 h THR 185 Cb 0.17 0.83 -0.00 0.00 -1.73 0.00 0.00 68.15 67.42 3e93 h THR 185 CO 0.00 0.00 -1.13 -1.14 -0.25 0.00 0.00 175.52 173.00 3e93 n ARG 186 N -2.40 0.54 0.30 4.72 0.63 -0.89 -4.79 116.66 114.78 3e93 n ARG 186 Ca 0.00 -0.02 0.16 0.00 -0.92 0.00 0.00 57.85 57.07 3e93 n ARG 186 Cb 0.15 -1.06 0.93 0.00 0.45 0.00 0.00 32.46 32.93 3e93 n ARG 186 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 3e93 h TRP 187 N 0.00 0.00 -0.05 -0.14 6.55 -1.52 -2.24 115.95 118.56 3e93 h TRP 187 Ca -0.01 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.83 3e93 h TRP 187 Cb 0.26 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.56 3e93 h TRP 187 CO 0.00 0.01 0.00 0.66 -1.05 0.00 0.00 178.44 178.06 3e93 n TYR 188 N -3.74 0.03 -2.65 0.49 4.01 -1.26 -4.56 117.16 109.47 3e93 n TYR 188 Ca -0.03 -0.01 -0.40 0.00 -0.16 0.00 0.00 57.90 57.30 3e93 n TYR 188 Cb 0.10 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.07 3e93 n TYR 188 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3e93 s ARG 189 N -1.75 4.75 0.39 -0.72 0.52 -0.84 -3.75 118.95 117.54 3e93 s ARG 189 Ca 0.25 1.59 -0.27 0.00 -0.52 0.00 0.00 55.73 56.78 3e93 s ARG 189 Cb 0.18 -3.20 -0.11 0.00 0.52 0.00 0.00 34.95 32.34 3e93 s ARG 189 CO 0.27 0.39 1.44 0.00 0.02 0.00 0.00 175.30 177.42 3e93 n ALA 190 N 1.30 2.14 -0.15 2.13 0.00 -1.26 -4.81 120.51 119.86 3e93 n ALA 190 Ca -0.01 0.32 0.01 0.00 0.00 0.00 0.00 53.44 53.76 3e93 n ALA 190 Cb 0.46 -2.39 0.29 0.00 0.00 0.00 0.00 19.45 17.82 3e93 n ALA 190 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3e93 h PRO 191 N 2.74 0.84 0.00 0.00 0.13 -1.95 -1.27 132.00 132.50 3e93 h PRO 191 Ca -0.50 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 64.57 3e93 h PRO 191 Cb 1.25 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 3e93 h PRO 191 CO 0.63 0.57 -0.02 1.05 -0.23 0.00 0.00 178.00 180.01 3e93 h GLU 192 N 0.86 0.00 0.17 0.86 9.09 -1.91 -0.80 114.58 122.86 3e93 h GLU 192 Ca 0.23 0.00 -0.36 0.00 0.05 0.00 0.00 59.36 59.28 3e93 h GLU 192 Cb -0.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.03 3e93 h GLU 192 CO -0.05 0.02 -1.84 -0.84 0.05 0.00 0.00 179.01 176.35 3e93 h ILE 193 N 0.00 0.83 -1.00 -1.06 3.07 -1.66 -0.33 117.51 117.36 3e93 h ILE 193 Ca -0.00 -2.46 0.17 0.00 1.55 0.00 0.00 64.86 64.12 3e93 h ILE 193 Cb 0.03 2.67 -0.10 0.00 -0.27 0.00 0.00 36.82 39.16 3e93 h ILE 193 CO 0.00 0.87 0.62 -0.03 -1.05 0.00 0.00 178.15 178.56 3e93 h MET 194 N 0.10 0.78 -0.27 0.16 4.05 -1.03 -2.83 114.93 115.89 3e93 h MET 194 Ca -0.37 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.00 3e93 h MET 194 Cb 2.08 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 32.70 3e93 h MET 194 CO 0.15 0.52 0.00 1.28 0.23 0.00 0.00 176.91 179.09 3e93 n LEU 195 N -4.70 2.91 -3.84 3.39 4.77 -0.33 -5.01 117.00 114.19 3e93 n LEU 195 Ca 0.22 -2.19 -0.29 0.00 -0.03 0.00 0.00 56.01 53.72 3e93 n LEU 195 Cb 0.52 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 41.37 3e93 n LEU 195 CO 0.24 0.69 -0.16 -3.20 -1.33 0.00 0.00 177.39 173.62 3e93 n ASN 196 N 0.13 -2.45 0.02 -1.43 2.85 -0.92 -4.90 115.26 108.56 3e93 n ASN 196 Ca 0.11 -1.02 -0.06 0.00 -0.11 0.00 0.00 54.58 53.51 3e93 n ASN 196 Cb 0.48 -3.17 0.12 0.00 1.24 0.00 0.00 39.78 38.45 3e93 n ASN 196 CO 0.00 0.00 0.00 -0.50 -2.11 0.00 0.00 177.26 174.65 3e93 h TRP 197 N -1.90 0.56 -1.52 1.20 6.55 -1.35 -3.43 115.95 116.06 3e93 h TRP 197 Ca -0.65 -0.17 0.31 0.00 0.95 0.00 0.00 58.89 59.33 3e93 h TRP 197 Cb 1.37 -0.12 -0.12 0.00 -0.86 0.00 0.00 29.16 29.44 3e93 h TRP 197 CO 0.42 0.84 0.80 0.00 -1.05 0.00 0.00 178.44 179.45 3e93 s MET 198 N -4.12 0.46 -0.06 0.49 0.23 -1.26 -2.00 119.30 113.03 3e93 s MET 198 Ca -0.06 -0.25 -0.32 0.00 -1.03 0.00 0.00 55.69 54.02 3e93 s MET 198 Cb 0.12 0.16 -0.10 0.00 -1.53 0.00 0.00 34.83 33.48 3e93 s MET 198 CO 0.81 -0.21 1.97 1.58 -2.03 0.00 0.00 175.02 177.14 3e93 n HIS 199 N -0.48 2.34 -2.95 3.16 -0.00 -1.26 -4.91 115.22 111.12 3e93 n HIS 199 Ca -0.08 -0.15 -0.18 0.00 -0.00 0.00 0.00 57.72 57.30 3e93 n HIS 199 Cb 0.63 -2.72 0.02 0.00 -0.00 0.00 0.00 29.99 27.91 3e93 n HIS 199 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 3e93 s TYR 200 N 4.78 2.84 0.00 1.57 -0.85 -1.26 -5.12 117.35 119.31 3e93 s TYR 200 Ca 0.93 -0.29 0.00 0.00 -0.52 0.00 0.00 57.07 57.19 3e93 s TYR 200 Cb -0.57 -2.45 0.00 0.00 0.38 0.00 0.00 41.96 39.33 3e93 s TYR 200 CO 0.46 -0.50 0.00 0.27 -1.52 0.00 0.00 175.55 174.26 3e93 n ASN 201 N -1.96 0.00 0.32 -0.18 0.23 -1.26 -5.04 115.26 107.37 3e93 n ASN 201 Ca 0.07 -0.50 0.19 0.00 -0.53 0.00 0.00 54.58 53.81 3e93 n ASN 201 Cb 0.59 0.00 1.08 0.00 -2.08 0.00 0.00 39.78 39.37 3e93 n ASN 201 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 3e93 h GLN 202 N 0.00 0.00 -0.03 -3.83 3.07 -2.00 -1.60 115.11 110.73 3e93 h GLN 202 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 58.65 58.75 3e93 h GLN 202 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.56 3e93 h GLN 202 CO 0.00 0.00 0.07 1.79 0.09 0.00 0.00 178.83 180.78 3e93 h THR 203 N 0.00 0.20 -0.86 1.86 1.35 -1.96 -0.96 112.91 112.54 3e93 h THR 203 Ca -0.00 0.00 0.12 0.00 -0.55 0.00 0.00 66.41 65.98 3e93 h THR 203 Cb 0.00 0.94 -0.06 0.00 -1.73 0.00 0.00 68.15 67.30 3e93 h THR 203 CO 0.00 0.00 0.56 -0.37 -0.25 0.00 0.00 175.52 175.46 3e93 h VAL 204 N 0.00 0.90 -0.06 6.82 -1.51 -1.67 -1.69 116.25 119.04 3e93 h VAL 204 Ca 0.01 -0.25 -0.10 0.00 -1.23 0.00 0.00 66.70 65.13 3e93 h VAL 204 Cb 0.15 0.09 -0.01 0.00 -2.13 0.00 0.00 31.29 29.39 3e93 h VAL 204 CO -0.00 0.14 -0.41 0.44 -1.23 0.00 0.00 177.57 176.50 3e93 h ASP 205 N 0.74 0.13 -0.21 4.19 3.32 -1.41 -2.80 116.42 120.38 3e93 h ASP 205 Ca 0.41 -0.05 -0.11 0.00 0.02 0.00 0.00 57.03 57.31 3e93 h ASP 205 Cb 0.57 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 3e93 h ASP 205 CO -0.18 0.53 -0.23 0.40 -1.72 0.00 0.00 179.24 178.04 3e93 h ILE 206 N 0.10 1.27 -0.18 0.35 1.08 -1.43 -1.85 117.51 116.86 3e93 h ILE 206 Ca 0.01 -1.32 0.04 0.00 -0.39 0.00 0.00 64.86 63.21 3e93 h ILE 206 Cb 0.77 1.26 -0.04 0.00 -3.07 0.00 0.00 36.82 35.74 3e93 h ILE 206 CO 0.06 0.43 -0.10 -0.25 -0.69 0.00 0.00 178.15 177.60 3e93 h TRP 207 N 0.59 -0.24 -0.98 1.37 2.91 -1.34 -1.36 115.95 116.91 3e93 h TRP 207 Ca 0.08 0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.20 3e93 h TRP 207 Cb 0.71 0.13 -0.07 0.00 -0.51 0.00 0.00 29.16 29.43 3e93 h TRP 207 CO 0.03 -0.15 0.63 0.77 -1.03 0.00 0.00 178.44 178.68 3e93 h SER 208 N -0.09 0.99 -0.55 2.65 0.02 -1.31 -1.49 113.55 113.76 3e93 h SER 208 Ca 0.10 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.01 3e93 h SER 208 Cb 0.24 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 3e93 h SER 208 CO -0.23 0.61 0.13 0.58 -1.14 0.00 0.00 176.83 176.78 3e93 h VAL 209 N 1.11 1.25 -0.56 2.27 2.07 -0.91 -1.11 116.25 120.36 3e93 h VAL 209 Ca 0.44 -0.89 0.08 0.00 0.82 0.00 0.00 66.70 67.15 3e93 h VAL 209 Cb 0.23 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 30.70 3e93 h VAL 209 CO -0.19 0.33 0.19 1.23 0.02 0.00 0.00 177.57 179.15 3e93 h GLY 210 N 0.78 0.76 1.00 2.17 0.00 -0.35 0.13 103.07 107.56 3e93 h GLY 210 Ca 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 3e93 h GLY 210 CO 0.00 -0.02 0.32 0.00 0.00 0.00 0.00 176.54 176.84 3e93 h ILE 212 N 0.86 1.19 -0.40 0.00 2.04 -0.76 -2.20 117.51 118.23 3e93 h ILE 212 Ca 0.22 -0.55 0.04 0.00 1.00 0.00 0.00 64.86 65.57 3e93 h ILE 212 Cb 0.09 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.68 3e93 h ILE 212 CO -0.03 0.14 0.16 -0.03 0.00 0.00 0.00 178.15 178.39 3e93 h MET 213 N -0.23 0.32 -0.82 2.37 4.05 -0.64 0.59 114.93 120.56 3e93 h MET 213 Ca 0.00 -0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.47 3e93 h MET 213 Cb 0.24 -0.07 -0.06 0.00 -0.80 0.00 0.00 31.60 30.90 3e93 h MET 213 CO 0.00 0.21 0.50 0.00 0.23 0.00 0.00 176.91 177.86 3e93 h ALA 214 N 1.24 1.13 -0.19 0.39 0.00 -1.22 -1.66 119.26 118.95 3e93 h ALA 214 Ca 0.18 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 3e93 h ALA 214 Cb 0.14 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3e93 h ALA 214 CO -0.16 0.22 -0.30 1.49 0.00 0.00 0.00 179.25 180.50 3e93 h GLU 215 N 0.91 0.37 -0.40 0.00 4.81 -0.60 -1.03 114.58 118.64 3e93 h GLU 215 Ca 0.36 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.36 3e93 h GLU 215 Cb 0.19 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3e93 h GLU 215 CO -0.18 0.64 -0.10 -0.07 -0.73 0.00 0.00 179.01 178.57 3e93 h LEU 216 N 0.33 0.70 -0.33 1.64 3.38 -0.17 0.17 115.31 121.03 3e93 h LEU 216 Ca 0.04 -0.20 -0.18 0.00 0.09 0.00 0.00 57.88 57.63 3e93 h LEU 216 Cb 0.70 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 3e93 h LEU 216 CO 0.05 0.83 -0.54 -0.07 0.09 0.00 0.00 178.44 178.81 3e93 h LEU 217 N 0.65 0.95 0.00 1.67 3.38 -0.92 -3.35 115.31 117.69 3e93 h LEU 217 Ca 0.11 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.58 3e93 h LEU 217 Cb 0.56 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3e93 h LEU 217 CO 0.03 1.30 -1.68 0.35 0.09 0.00 0.00 178.44 178.53 3e93 n THR 218 N -4.01 0.00 -0.98 0.22 -2.24 -0.43 -4.98 114.28 101.87 3e93 n THR 218 Ca -0.04 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3e93 n THR 218 Cb 0.62 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 3e93 n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3e93 n GLY 219 N 1.41 0.58 3.11 3.38 0.00 0.57 -5.03 105.19 109.22 3e93 n GLY 219 Ca -0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 3e93 n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3e93 s ARG 220 N -0.20 0.70 0.32 1.61 1.81 -1.22 -4.97 118.95 116.99 3e93 s ARG 220 Ca 0.00 -0.81 -0.29 0.00 -1.72 0.00 0.00 55.73 52.91 3e93 s ARG 220 Cb 0.00 -0.61 -0.11 0.00 -0.45 0.00 0.00 34.95 33.78 3e93 s ARG 220 CO 0.00 0.13 1.57 0.99 -0.68 0.00 0.00 175.30 177.31 3e93 s THR 221 N -1.20 2.05 -0.02 0.02 2.01 -1.26 -4.12 115.64 113.12 3e93 s THR 221 Ca -0.05 0.04 -0.23 0.00 0.31 0.00 0.00 61.69 61.76 3e93 s THR 221 Cb -0.09 -3.03 -0.20 0.00 0.01 0.00 0.00 72.50 69.19 3e93 s THR 221 CO 0.01 0.01 1.17 0.25 -0.69 0.00 0.00 174.62 175.37 3e93 h LEU 222 N 4.35 0.23 -6.14 4.42 5.85 -1.92 -3.39 115.31 118.71 3e93 h LEU 222 Ca -0.48 -0.63 -0.59 0.00 0.84 0.00 0.00 57.88 57.02 3e93 h LEU 222 Cb 1.23 -0.07 -0.41 0.00 0.37 0.00 0.00 40.66 41.78 3e93 h LEU 222 CO 0.75 0.82 -0.76 0.49 -0.34 0.00 0.00 178.44 179.40 3e93 n PHE 223 N -4.59 2.32 -1.71 1.25 3.72 -1.26 -5.00 117.46 112.19 3e93 n PHE 223 Ca -0.08 -3.96 -0.42 0.00 -0.05 0.00 0.00 57.45 52.94 3e93 n PHE 223 Cb 0.41 -0.49 -0.00 0.00 -0.94 0.00 0.00 39.48 38.46 3e93 n PHE 223 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3e93 n PRO 224 N 1.05 2.99 -1.91 -1.08 -0.04 -1.26 -4.66 135.00 130.08 3e93 n PRO 224 Ca 0.27 -2.61 -0.40 0.00 -0.04 0.00 0.00 63.50 60.73 3e93 n PRO 224 Cb 0.45 -3.21 0.01 0.00 -0.04 0.00 0.00 33.50 30.70 3e93 n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3e93 s GLY 225 N 2.95 2.92 0.00 0.55 0.00 -1.26 -4.90 107.32 107.58 3e93 s GLY 225 Ca 0.49 1.36 0.25 0.00 0.00 0.00 0.00 44.72 46.82 3e93 s GLY 225 CO -0.08 1.96 1.81 -1.30 0.00 0.00 0.00 173.10 175.49 3e93 n THR 226 N -0.04 0.27 -3.84 0.90 -2.24 -1.26 -4.23 114.28 103.83 3e93 n THR 226 Ca 0.04 0.07 0.02 0.00 -2.27 0.00 0.00 64.05 61.91 3e93 n THR 226 Cb 0.43 -0.64 0.01 0.00 -2.10 0.00 0.00 70.33 68.02 3e93 n THR 226 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3e93 s ASP 227 N -2.94 -0.02 0.24 3.42 1.47 -1.23 -2.83 116.67 114.78 3e93 s ASP 227 Ca 0.14 -0.18 -0.06 0.00 1.18 0.00 0.00 52.55 53.63 3e93 s ASP 227 Cb 0.16 0.15 0.33 0.00 -0.34 0.00 0.00 42.92 43.23 3e93 s ASP 227 CO 0.45 -0.29 1.83 0.45 0.68 0.00 0.00 175.17 178.28 3e93 h HIS 228 N 2.00 0.87 -0.04 2.11 3.86 -1.87 -0.48 115.15 121.60 3e93 h HIS 228 Ca -0.26 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 58.93 3e93 h HIS 228 Cb 1.19 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.39 3e93 h HIS 228 CO 0.99 0.41 -0.18 0.82 0.86 0.00 0.00 177.93 180.83 3e93 h ILE 229 N 0.84 1.46 -0.87 2.45 1.08 -1.99 -0.85 117.51 119.63 3e93 h ILE 229 Ca 0.36 -1.64 0.05 0.00 -0.39 0.00 0.00 64.86 63.25 3e93 h ILE 229 Cb 0.24 2.42 -0.06 0.00 -3.07 0.00 0.00 36.82 36.35 3e93 h ILE 229 CO -0.20 0.45 0.55 -0.78 -0.69 0.00 0.00 178.15 177.48 3e93 h ASP 230 N -0.36 0.89 -0.41 1.72 3.58 -1.92 -0.81 116.42 119.10 3e93 h ASP 230 Ca -0.01 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.41 3e93 h ASP 230 Cb 0.83 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.68 3e93 h ASP 230 CO 0.04 0.58 0.13 -0.61 -2.88 0.00 0.00 179.24 176.50 3e93 h GLN 231 N 1.03 0.64 -0.67 0.28 4.15 -0.98 -1.05 115.11 118.50 3e93 h GLN 231 Ca 0.37 -0.14 0.09 0.00 0.77 0.00 0.00 58.65 59.74 3e93 h GLN 231 Cb 0.11 -0.09 -0.07 0.00 0.21 0.00 0.00 27.48 27.64 3e93 h GLN 231 CO -0.15 0.64 0.33 1.25 -1.93 0.00 0.00 178.83 178.96 3e93 h LEU 232 N 0.52 0.42 -0.63 -2.39 5.85 -0.79 -1.27 115.31 117.03 3e93 h LEU 232 Ca 0.13 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 3e93 h LEU 232 Cb 0.26 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 3e93 h LEU 232 CO -0.00 0.25 0.31 0.11 -0.34 0.00 0.00 178.44 178.77 3e93 h LYS 233 N 0.57 0.90 -0.54 1.25 1.57 -0.75 0.62 116.57 120.18 3e93 h LYS 233 Ca 0.33 -0.12 0.04 0.00 -1.87 0.00 0.00 60.65 59.02 3e93 h LYS 233 Cb 0.34 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 3e93 h LYS 233 CO -0.26 0.71 0.30 -0.07 -0.57 0.00 0.00 179.45 179.56 3e93 h LEU 234 N 0.86 0.45 0.21 2.94 3.38 -0.77 -1.12 115.31 121.27 3e93 h LEU 234 Ca 0.22 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 3e93 h LEU 234 Cb 0.10 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3e93 h LEU 234 CO -0.03 0.31 -0.10 0.40 0.09 0.00 0.00 178.44 179.11 3e93 h ILE 235 N 0.58 0.80 -0.01 1.22 2.04 -0.71 -3.01 117.51 118.42 3e93 h ILE 235 Ca 0.23 -0.04 -0.08 0.00 1.00 0.00 0.00 64.86 65.98 3e93 h ILE 235 Cb 0.10 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3e93 h ILE 235 CO -0.14 0.01 -0.36 -0.07 0.00 0.00 0.00 178.15 177.59 3e93 h LEU 236 N -0.30 0.02 -1.42 1.44 3.38 -0.78 -0.52 115.31 117.13 3e93 h LEU 236 Ca -0.03 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.96 3e93 h LEU 236 Cb 0.23 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3e93 h LEU 236 CO 0.05 0.38 0.41 -0.09 0.09 0.00 0.00 178.44 179.28 3e93 h ARG 237 N 0.02 0.74 0.00 1.13 2.43 -1.10 0.66 114.38 118.26 3e93 h ARG 237 Ca -0.00 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.03 3e93 h ARG 237 Cb 0.64 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 3e93 h ARG 237 CO 0.05 0.49 -0.54 1.25 -1.51 0.00 0.00 179.97 179.71 3e93 h LEU 238 N 0.77 0.00 0.00 3.80 5.85 -1.21 -3.39 115.31 121.13 3e93 h LEU 238 Ca 0.24 -0.65 0.00 0.00 0.84 0.00 0.00 57.88 58.31 3e93 h LEU 238 Cb 0.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3e93 h LEU 238 CO -0.06 1.14 -0.81 1.33 -0.34 0.00 0.00 178.44 179.69 3e93 n VAL 239 N -4.55 0.00 0.00 1.05 0.24 -0.28 -0.52 118.33 114.27 3e93 n VAL 239 Ca -0.18 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 3e93 n VAL 239 Cb 0.50 0.68 0.00 0.00 -1.47 0.00 0.00 33.84 33.55 3e93 n VAL 239 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3e93 n GLY 240 N 1.49 1.32 3.77 7.63 0.00 0.22 -4.06 105.19 115.57 3e93 n GLY 240 Ca 0.04 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 3e93 n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3e93 s THR 241 N -2.71 2.98 0.61 2.61 -4.23 -0.57 -4.69 115.64 109.63 3e93 s THR 241 Ca 0.00 0.61 -0.18 0.00 -1.18 0.00 0.00 61.69 60.94 3e93 s THR 241 Cb 0.00 -3.25 -0.03 0.00 1.34 0.00 0.00 72.50 70.57 3e93 s THR 241 CO 0.00 -0.13 1.24 -2.16 -0.54 0.00 0.00 174.62 173.03 3e93 s PRO 242 N -3.29 2.81 0.75 3.99 0.04 -1.26 -4.85 135.00 133.19 3e93 s PRO 242 Ca 0.74 1.91 -0.04 0.00 0.04 0.00 0.00 61.00 63.65 3e93 s PRO 242 Cb -0.26 -1.90 0.13 0.00 0.04 0.00 0.00 34.50 32.51 3e93 s PRO 242 CO 0.29 -1.35 1.05 0.20 0.04 0.00 0.00 177.00 177.22 3e93 s GLY 243 N -1.53 1.76 0.32 0.56 0.00 -1.26 -4.90 107.32 102.27 3e93 s GLY 243 Ca 0.79 -1.51 0.04 0.00 0.00 0.00 0.00 44.72 44.04 3e93 s GLY 243 CO 0.36 -0.94 1.86 0.00 0.00 0.00 0.00 173.10 174.37 3e93 h ALA 244 N -0.71 1.65 -0.28 3.20 0.00 -1.98 -0.74 119.26 120.40 3e93 h ALA 244 Ca -0.39 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3e93 h ALA 244 Cb 1.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3e93 h ALA 244 CO 0.43 0.12 0.14 1.49 0.00 0.00 0.00 179.25 181.42 3e93 h GLU 245 N 0.87 0.40 -0.28 0.00 4.81 -2.00 -1.37 114.58 117.00 3e93 h GLU 245 Ca 0.46 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 59.45 3e93 h GLU 245 Cb 0.55 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.86 3e93 h GLU 245 CO -0.23 0.38 -0.56 1.25 -0.73 0.00 0.00 179.01 179.13 3e93 h LEU 246 N 0.32 0.98 -0.55 1.64 5.85 -1.86 -3.25 115.31 118.44 3e93 h LEU 246 Ca 0.10 -0.54 0.07 0.00 0.84 0.00 0.00 57.88 58.34 3e93 h LEU 246 Cb 0.11 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 3e93 h LEU 246 CO -0.01 1.34 0.24 -0.07 -0.34 0.00 0.00 178.44 179.59 3e93 h LEU 247 N 0.66 0.30 -2.47 2.25 3.38 -0.87 0.00 115.31 118.56 3e93 h LEU 247 Ca 0.01 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3e93 h LEU 247 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 3e93 h LEU 247 CO 0.12 0.20 -0.01 0.07 0.09 0.00 0.00 178.44 178.92 3e93 h LYS 248 N 0.46 0.00 0.00 1.13 2.10 -1.29 -1.30 116.57 117.67 3e93 h LYS 248 Ca 0.26 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.91 3e93 h LYS 248 Cb 0.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 3e93 h LYS 248 CO -0.22 0.01 -0.11 0.87 -2.00 0.00 0.00 179.45 178.00 3e93 h LYS 249 N 0.00 0.00 -6.34 0.07 1.57 -1.04 -3.42 116.57 107.41 3e93 h LYS 249 Ca -0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 3e93 h LYS 249 Cb 0.17 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.41 3e93 h LYS 249 CO 0.00 0.00 1.09 0.42 -0.57 0.00 0.00 179.45 180.39 3e93 s ILE 250 N -3.17 3.71 -0.11 1.86 1.01 -0.49 -4.83 121.20 119.17 3e93 s ILE 250 Ca 0.08 0.44 0.20 0.00 0.00 0.00 0.00 60.65 61.38 3e93 s ILE 250 Cb 0.09 -4.77 0.19 0.00 0.01 0.00 0.00 42.46 37.98 3e93 s ILE 250 CO 0.65 -1.68 1.63 0.77 0.00 0.00 0.00 174.94 176.31 3e93 h SER 251 N 10.57 0.00 -2.87 3.58 4.64 -1.66 -3.41 113.55 124.41 3e93 h SER 251 Ca -0.27 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.47 3e93 h SER 251 Cb 1.06 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.12 3e93 h SER 251 CO 1.26 0.28 1.17 -0.55 -0.87 0.00 0.00 176.83 178.13 3e93 s SER 252 N -6.28 6.17 0.39 4.97 0.15 -0.94 -4.85 113.70 113.30 3e93 s SER 252 Ca 0.03 1.27 0.14 0.00 0.70 0.00 0.00 55.95 58.09 3e93 s SER 252 Cb 0.08 -2.53 0.79 0.00 -1.71 0.00 0.00 66.02 62.65 3e93 s SER 252 CO 0.68 -1.49 1.86 -0.33 1.20 0.00 0.00 173.24 175.17 3e93 h GLU 253 N 11.61 0.00 0.07 5.44 5.08 -1.92 -2.13 114.58 132.72 3e93 h GLU 253 Ca -0.32 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 3e93 h GLU 253 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3e93 h GLU 253 CO 1.04 0.33 -0.03 1.03 -1.00 0.00 0.00 179.01 180.37 3e93 h SER 254 N 0.00 -0.08 -0.57 1.42 0.87 -1.95 -1.83 113.55 111.42 3e93 h SER 254 Ca -0.00 -0.19 -0.09 0.00 -1.23 0.00 0.00 61.79 60.28 3e93 h SER 254 Cb 0.59 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.55 3e93 h SER 254 CO 0.04 0.15 0.03 0.00 -0.53 0.00 0.00 176.83 176.52 3e93 h ALA 255 N 0.61 0.93 -0.29 6.23 0.00 -1.90 -1.87 119.26 122.98 3e93 h ALA 255 Ca -0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3e93 h ALA 255 Cb 0.26 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3e93 h ALA 255 CO 0.02 0.65 0.14 -0.09 0.00 0.00 0.00 179.25 179.96 3e93 h ARG 256 N 0.93 0.42 -0.37 0.00 2.43 -1.38 -0.82 114.38 115.59 3e93 h ARG 256 Ca 0.17 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 3e93 h ARG 256 Cb 0.50 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.96 3e93 h ARG 256 CO 0.02 0.39 -0.13 -0.97 -1.51 0.00 0.00 179.97 177.78 3e93 h ASN 257 N 0.34 0.64 -0.15 -3.80 -1.24 -1.22 -2.33 115.58 107.82 3e93 h ASN 257 Ca 0.10 -0.18 -0.01 0.00 0.71 0.00 0.00 56.30 56.91 3e93 h ASN 257 Cb 0.11 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.98 3e93 h ASN 257 CO -0.01 0.79 0.05 0.22 -1.29 0.00 0.00 177.43 177.19 3e93 h TYR 258 N 0.59 0.24 -0.06 0.67 3.20 -1.00 -3.19 116.97 117.42 3e93 h TYR 258 Ca 0.10 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.86 3e93 h TYR 258 Cb 0.56 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 3e93 h TYR 258 CO 0.02 0.35 -0.37 0.97 -1.64 0.00 0.00 178.16 177.50 3e93 h ILE 259 N 0.06 1.28 0.00 1.81 2.10 -0.94 -0.88 117.51 120.94 3e93 h ILE 259 Ca 0.05 -1.34 0.00 0.00 1.08 0.00 0.00 64.86 64.65 3e93 h ILE 259 Cb 0.22 1.65 0.00 0.00 -1.09 0.00 0.00 36.82 37.60 3e93 h ILE 259 CO -0.00 0.39 0.00 0.00 -1.08 0.00 0.00 178.15 177.46 3e93 n GLN 260 N -4.08 0.07 0.03 2.19 6.02 -0.90 -2.38 117.38 118.34 3e93 n GLN 260 Ca -0.02 0.42 0.12 0.00 -0.01 0.00 0.00 57.00 57.52 3e93 n GLN 260 Cb 0.42 -1.67 0.32 0.00 1.02 0.00 0.00 30.24 30.33 3e93 n GLN 260 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 3e93 n SER 261 N -1.81 0.49 -4.77 1.08 3.41 -0.33 -4.88 113.62 106.81 3e93 n SER 261 Ca 0.01 0.10 -0.39 0.00 -0.26 0.00 0.00 58.87 58.34 3e93 n SER 261 Cb 0.12 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 63.98 3e93 n SER 261 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3e93 s LEU 262 N -3.53 4.53 0.14 1.04 1.43 -1.00 -5.01 118.68 116.27 3e93 s LEU 262 Ca 0.10 1.77 -0.31 0.00 -1.03 0.00 0.00 54.13 54.66 3e93 s LEU 262 Cb 0.16 -3.61 -0.11 0.00 0.03 0.00 0.00 46.19 42.66 3e93 s LEU 262 CO 0.66 0.11 1.82 0.41 0.23 0.00 0.00 176.35 179.58 3e93 n THR 263 N 1.22 0.30 -1.91 5.49 -1.04 -1.26 -4.93 114.28 112.16 3e93 n THR 263 Ca -0.02 -0.05 -0.39 0.00 -2.04 0.00 0.00 64.05 61.54 3e93 n THR 263 Cb 0.49 -2.09 0.01 0.00 -1.82 0.00 0.00 70.33 66.91 3e93 n THR 263 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 3e93 s GLN 264 N 2.46 3.73 -0.00 -2.82 -0.21 -1.26 -4.92 119.66 116.63 3e93 s GLN 264 Ca 0.81 2.27 0.00 0.00 0.02 0.00 0.00 55.36 58.46 3e93 s GLN 264 Cb -0.49 -2.63 0.00 0.00 1.00 0.00 0.00 33.01 30.89 3e93 s GLN 264 CO 0.37 -0.73 -0.01 -1.64 -2.12 0.00 0.00 175.29 171.15 3e93 s MET 265 N -2.44 0.10 0.60 2.91 -1.94 -1.26 -4.98 119.30 112.29 3e93 s MET 265 Ca 0.61 -0.04 -0.11 0.00 -1.71 0.00 0.00 55.69 54.44 3e93 s MET 265 Cb -0.41 -0.11 -0.04 0.00 2.01 0.00 0.00 34.83 36.28 3e93 s MET 265 CO 0.52 0.02 1.01 -1.25 -0.01 0.00 0.00 175.02 175.30 3e93 s PRO 266 N 0.02 3.63 0.20 2.03 0.04 -1.26 -1.52 135.00 138.14 3e93 s PRO 266 Ca 0.00 0.73 -0.33 0.00 0.04 0.00 0.00 61.00 61.44 3e93 s PRO 266 Cb -0.01 -2.11 -0.13 0.00 0.04 0.00 0.00 34.50 32.29 3e93 s PRO 266 CO -0.00 -0.51 1.60 1.17 0.04 0.00 0.00 177.00 179.30 3e93 n LYS 267 N -2.59 2.36 -1.45 4.56 4.81 -1.26 -4.03 118.16 120.57 3e93 n LYS 267 Ca 0.06 0.85 -0.30 0.00 -0.87 0.00 0.00 58.31 58.04 3e93 n LYS 267 Cb 0.54 -2.63 0.10 0.00 0.02 0.00 0.00 35.03 33.06 3e93 n LYS 267 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 3e93 s MET 268 N 0.68 2.02 -0.34 1.64 -1.94 0.32 -4.91 119.30 116.77 3e93 s MET 268 Ca 0.75 0.76 -0.29 0.00 -1.71 0.00 0.00 55.69 55.20 3e93 s MET 268 Cb -0.61 -1.90 0.01 0.00 2.01 0.00 0.00 34.83 34.34 3e93 s MET 268 CO 0.39 -1.70 1.22 1.21 -0.01 0.00 0.00 175.02 176.13 3e93 s ASN 269 N -3.74 6.73 0.29 3.03 3.84 -1.26 -4.91 114.94 118.91 3e93 s ASN 269 Ca 0.61 1.03 0.11 0.00 0.21 0.00 0.00 52.86 54.82 3e93 s ASN 269 Cb -0.15 -2.54 0.42 0.00 -0.55 0.00 0.00 41.25 38.43 3e93 s ASN 269 CO 0.55 -1.07 1.65 -0.26 -2.79 0.00 0.00 177.10 175.18 3e93 h PHE 270 N 9.00 0.00 0.00 0.43 -1.00 -1.94 -2.08 116.94 121.35 3e93 h PHE 270 Ca -0.24 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.52 3e93 h PHE 270 Cb 1.08 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.64 3e93 h PHE 270 CO 0.89 0.57 -0.09 0.00 -1.61 0.00 0.00 178.31 178.07 3e93 h ALA 271 N 1.43 1.57 0.00 2.45 0.00 -1.91 0.16 119.26 122.96 3e93 h ALA 271 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3e93 h ALA 271 Cb 1.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3e93 h ALA 271 CO 0.07 0.12 -0.45 0.09 0.00 0.00 0.00 179.25 179.08 3e93 n ASN 272 N -4.03 0.45 -0.05 0.00 3.02 -0.80 -3.76 115.26 110.09 3e93 n ASN 272 Ca -0.02 -0.13 -0.21 0.00 -0.03 0.00 0.00 54.58 54.18 3e93 n ASN 272 Cb 0.18 0.15 -0.13 0.00 -0.61 0.00 0.00 39.78 39.37 3e93 n ASN 272 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3e93 n VAL 273 N -1.55 1.66 -2.94 2.41 0.31 -0.68 -4.56 118.33 112.99 3e93 n VAL 273 Ca 0.06 -0.51 -0.38 0.00 -0.01 0.00 0.00 64.34 63.50 3e93 n VAL 273 Cb 0.34 -1.73 -0.01 0.00 -0.91 0.00 0.00 33.84 31.53 3e93 n VAL 273 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3e93 n PHE 274 N -3.66 2.81 -1.71 3.52 3.72 0.49 -5.03 117.46 117.59 3e93 n PHE 274 Ca -0.37 -2.95 -0.43 0.00 -0.05 0.00 0.00 57.45 53.65 3e93 n PHE 274 Cb 0.96 -1.05 -0.03 0.00 -0.94 0.00 0.00 39.48 38.42 3e93 n PHE 274 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3e93 n ILE 275 N 0.63 0.09 -0.47 4.37 5.41 -1.25 -1.76 119.36 126.38 3e93 n ILE 275 Ca 0.34 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 64.07 3e93 n ILE 275 Cb 0.33 -1.96 0.00 0.00 -0.71 0.00 0.00 39.64 37.30 3e93 n ILE 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3e93 n GLY 276 N 3.97 1.86 3.77 7.39 0.00 -1.26 -5.01 105.19 115.90 3e93 n GLY 276 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 3e93 n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3e93 s ALA 277 N -3.40 2.84 -0.30 4.61 0.00 -0.72 -4.91 121.76 119.88 3e93 s ALA 277 Ca 0.00 0.88 -0.42 0.00 0.00 0.00 0.00 51.96 52.43 3e93 s ALA 277 Cb 0.00 -3.37 -0.17 0.00 0.00 0.00 0.00 23.12 19.58 3e93 s ALA 277 CO 0.00 -0.71 1.67 -1.71 0.00 0.00 0.00 175.76 175.01 3e93 n ASN 278 N -0.88 2.01 -0.24 0.00 2.85 -1.26 -4.82 115.26 112.92 3e93 n ASN 278 Ca 0.09 1.11 0.29 0.00 -0.11 0.00 0.00 54.58 55.96 3e93 n ASN 278 Cb 0.49 -1.08 0.69 0.00 1.24 0.00 0.00 39.78 41.13 3e93 n ASN 278 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3e93 h PRO 279 N 6.43 0.07 -0.21 1.20 0.11 -1.97 0.61 132.00 138.24 3e93 h PRO 279 Ca -0.46 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 3e93 h PRO 279 Cb 1.33 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 3e93 h PRO 279 CO 0.95 0.05 -0.38 -0.07 -0.21 0.00 0.00 178.00 178.33 3e93 h LEU 280 N 0.07 0.50 -0.64 2.35 3.38 -1.99 -1.27 115.31 117.70 3e93 h LEU 280 Ca 0.49 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 58.16 3e93 h LEU 280 Cb 1.81 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.40 3e93 h LEU 280 CO -0.05 0.83 0.06 0.00 0.09 0.00 0.00 178.44 179.37 3e93 h ALA 281 N 1.20 0.86 -0.28 1.53 0.00 -1.27 -1.04 119.26 120.26 3e93 h ALA 281 Ca 0.04 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.68 3e93 h ALA 281 Cb 0.84 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3e93 h ALA 281 CO 0.07 0.66 0.13 0.28 0.00 0.00 0.00 179.25 180.39 3e93 h VAL 282 N 1.01 0.99 -0.28 0.00 2.07 -0.95 -0.76 116.25 118.32 3e93 h VAL 282 Ca 0.19 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.63 3e93 h VAL 282 Cb 0.50 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 3e93 h VAL 282 CO 0.02 0.05 0.13 -0.78 0.02 0.00 0.00 177.57 177.02 3e93 h ASP 283 N 0.28 0.20 -0.30 0.57 3.58 -1.11 -1.47 116.42 118.17 3e93 h ASP 283 Ca 0.11 0.01 0.01 0.00 0.42 0.00 0.00 57.03 57.59 3e93 h ASP 283 Cb 0.04 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.05 3e93 h ASP 283 CO -0.08 0.15 0.18 0.25 -2.88 0.00 0.00 179.24 176.86 3e93 h LEU 284 N 0.28 0.29 -1.01 2.28 5.85 -0.94 -2.04 115.31 120.03 3e93 h LEU 284 Ca 0.11 0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.91 3e93 h LEU 284 Cb 0.04 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 40.94 3e93 h LEU 284 CO -0.08 0.21 0.65 -0.07 -0.34 0.00 0.00 178.44 178.81 3e93 h LEU 285 N 0.37 1.03 -1.47 2.25 3.38 -0.87 -0.47 115.31 119.52 3e93 h LEU 285 Ca 0.12 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3e93 h LEU 285 Cb -0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3e93 h LEU 285 CO -0.05 0.65 -0.02 -0.33 0.09 0.00 0.00 178.44 178.77 3e93 h GLU 286 N 1.16 0.31 0.00 1.13 5.08 -0.78 0.69 114.58 122.16 3e93 h GLU 286 Ca 0.44 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.72 3e93 h GLU 286 Cb 0.20 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 3e93 h GLU 286 CO -0.18 0.36 -0.30 0.87 -1.00 0.00 0.00 179.01 178.75 3e93 h LYS 287 N 0.30 0.00 0.08 2.33 1.57 -0.44 -3.36 116.57 117.06 3e93 h LYS 287 Ca 0.07 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.58 3e93 h LYS 287 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3e93 h LYS 287 CO 0.01 0.09 -1.43 0.52 -0.57 0.00 0.00 179.45 178.07 3e93 h MET 288 N 0.00 0.18 -2.80 3.15 2.86 -0.71 -1.42 114.93 116.19 3e93 h MET 288 Ca -0.01 -0.31 -0.74 0.00 -2.06 0.00 0.00 59.70 56.59 3e93 h MET 288 Cb 1.08 0.11 -0.11 0.00 0.06 0.00 0.00 31.60 32.75 3e93 h MET 288 CO 0.01 1.15 2.54 1.28 1.06 0.00 0.00 176.91 182.94 3e93 n LEU 289 N -3.99 7.93 -4.54 1.22 4.77 0.19 -4.40 117.00 118.17 3e93 n LEU 289 Ca -0.27 -4.79 -0.34 0.00 -0.03 0.00 0.00 56.01 50.58 3e93 n LEU 289 Cb 0.86 -1.40 -0.11 0.00 -2.33 0.00 0.00 43.42 40.43 3e93 n LEU 289 CO 0.36 1.96 -0.33 -0.69 -1.33 0.00 0.00 177.39 177.35 3e93 s VAL 290 N -0.52 4.08 0.12 4.08 1.01 -1.26 -4.90 120.40 123.01 3e93 s VAL 290 Ca 0.54 -0.29 -0.17 0.00 0.00 0.00 0.00 61.98 62.06 3e93 s VAL 290 Cb 0.17 -2.79 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 3e93 s VAL 290 CO -0.08 0.50 1.63 0.25 0.00 0.00 0.00 175.10 177.40 3e93 h LEU 291 N 6.50 0.52 -8.77 3.92 5.85 -1.92 -3.39 115.31 118.03 3e93 h LEU 291 Ca -0.34 -0.21 -0.56 0.00 0.84 0.00 0.00 57.88 57.60 3e93 h LEU 291 Cb 1.19 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 3e93 h LEU 291 CO 0.63 0.60 1.23 -0.62 -0.34 0.00 0.00 178.44 179.94 3e93 s ASP 292 N -5.89 5.91 0.50 1.25 -1.08 -1.26 -4.89 116.67 111.21 3e93 s ASP 292 Ca -0.13 0.97 0.17 0.00 -0.52 0.00 0.00 52.55 53.04 3e93 s ASP 292 Cb 0.09 -2.53 1.24 0.00 -1.46 0.00 0.00 42.92 40.26 3e93 s ASP 292 CO 0.75 -1.76 2.10 0.77 0.52 0.00 0.00 175.17 177.55 3e93 h SER 293 N 12.60 0.00 -0.37 -0.34 4.64 -1.97 0.22 113.55 128.33 3e93 h SER 293 Ca -0.30 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.12 3e93 h SER 293 Cb 1.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 3e93 h SER 293 CO 1.08 0.08 0.30 0.44 -0.87 0.00 0.00 176.83 177.87 3e93 h ASP 294 N 0.00 0.00 -0.02 4.97 3.32 -1.94 -2.97 116.42 119.77 3e93 h ASP 294 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3e93 h ASP 294 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3e93 h ASP 294 CO 0.01 0.00 -0.05 0.29 -1.72 0.00 0.00 179.24 177.77 3e93 n LYS 295 N -4.17 1.63 -2.28 3.56 5.02 0.06 -4.97 118.16 117.01 3e93 n LYS 295 Ca 0.06 -1.53 -0.38 0.00 -2.02 0.00 0.00 58.31 54.44 3e93 n LYS 295 Cb 0.48 -1.36 -0.02 0.00 -0.02 0.00 0.00 35.03 34.11 3e93 n LYS 295 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3e93 s ARG 296 N -1.66 4.00 0.51 1.97 0.52 -1.13 -4.99 118.95 118.19 3e93 s ARG 296 Ca 0.21 1.83 -0.23 0.00 -0.52 0.00 0.00 55.73 57.02 3e93 s ARG 296 Cb 0.16 -2.63 -0.06 0.00 0.52 0.00 0.00 34.95 32.93 3e93 s ARG 296 CO 0.27 -0.36 1.40 -1.50 0.02 0.00 0.00 175.30 175.13 3e93 s ILE 297 N -1.44 2.01 0.54 1.52 2.07 -0.53 -5.04 121.20 120.33 3e93 s ILE 297 Ca 0.58 0.01 0.01 0.00 -1.41 0.00 0.00 60.65 59.84 3e93 s ILE 297 Cb -0.30 -3.01 0.03 0.00 0.13 0.00 0.00 42.46 39.31 3e93 s ILE 297 CO 0.38 0.00 0.77 0.42 -1.91 0.00 0.00 174.94 174.60 3e93 s THR 298 N -1.25 2.90 0.19 4.00 -4.23 -1.26 -4.91 115.64 111.08 3e93 s THR 298 Ca 0.68 -0.61 -0.12 0.00 -1.18 0.00 0.00 61.69 60.45 3e93 s THR 298 Cb -0.42 -3.09 0.10 0.00 1.34 0.00 0.00 72.50 70.43 3e93 s THR 298 CO 0.52 -0.07 1.84 0.00 -0.54 0.00 0.00 174.62 176.37 3e93 h ALA 299 N 0.10 0.78 -0.66 3.99 0.00 -1.94 0.20 119.26 121.74 3e93 h ALA 299 Ca -0.43 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 3e93 h ALA 299 Cb 1.29 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 3e93 h ALA 299 CO 0.53 0.14 0.15 0.00 0.00 0.00 0.00 179.25 180.07 3e93 h ALA 300 N 1.25 0.87 -0.37 0.00 0.00 -1.93 -2.12 119.26 116.97 3e93 h ALA 300 Ca 0.24 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 3e93 h ALA 300 Cb -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3e93 h ALA 300 CO -0.08 0.60 0.04 1.96 0.00 0.00 0.00 179.25 181.77 3e93 h GLN 301 N 0.99 0.62 -0.33 0.00 4.20 -1.88 -3.18 115.11 115.53 3e93 h GLN 301 Ca 0.21 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 3e93 h GLN 301 Cb 0.38 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 3e93 h GLN 301 CO 0.00 0.70 0.01 0.00 -0.67 0.00 0.00 178.83 178.88 3e93 h ALA 302 N 0.90 1.41 -0.23 3.87 0.00 -0.66 -1.56 119.26 122.99 3e93 h ALA 302 Ca 0.11 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.90 3e93 h ALA 302 Cb 0.39 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3e93 h ALA 302 CO 0.01 0.42 0.22 -0.07 0.00 0.00 0.00 179.25 179.82 3e93 h LEU 303 N 0.49 0.00 -1.72 0.00 3.38 -1.37 -0.43 115.31 115.65 3e93 h LEU 303 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3e93 h LEU 303 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3e93 h LEU 303 CO 0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.54 3e93 n ALA 304 N -2.42 2.48 -1.77 1.53 0.00 -0.59 -4.74 120.51 115.00 3e93 n ALA 304 Ca 0.03 -0.72 -0.39 0.00 0.00 0.00 0.00 53.44 52.36 3e93 n ALA 304 Cb 0.36 -0.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.83 3e93 n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3e93 s HIS 305 N -1.78 3.07 0.57 0.00 5.04 -0.17 -4.92 115.29 117.10 3e93 s HIS 305 Ca 0.34 1.51 0.28 0.00 -1.54 0.00 0.00 55.06 55.65 3e93 s HIS 305 Cb 0.21 -3.50 1.74 0.00 0.04 0.00 0.00 32.58 31.06 3e93 s HIS 305 CO 0.30 -1.51 2.23 0.00 -2.34 0.00 0.00 174.74 173.42 3e93 h ALA 306 N 2.96 1.57 -1.01 1.58 0.00 -1.91 -1.69 119.26 120.76 3e93 h ALA 306 Ca -0.49 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 54.67 3e93 h ALA 306 Cb 1.23 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 3e93 h ALA 306 CO 0.64 0.01 0.66 -0.92 0.00 0.00 0.00 179.25 179.63 3e93 h TYR 307 N 0.00 0.60 -0.55 0.00 3.20 -1.91 -1.95 116.97 116.36 3e93 h TYR 307 Ca -0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3e93 h TYR 307 Cb 0.02 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.11 3e93 h TYR 307 CO 0.00 0.09 0.00 1.19 -1.64 0.00 0.00 178.16 177.80 3e93 n PHE 308 N -4.57 1.92 -0.34 -3.82 3.72 -0.63 -4.67 117.46 109.07 3e93 n PHE 308 Ca 0.24 -0.67 0.18 0.00 -0.05 0.00 0.00 57.45 57.14 3e93 n PHE 308 Cb 0.83 -0.47 0.40 0.00 -0.94 0.00 0.00 39.48 39.31 3e93 n PHE 308 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3e93 h ALA 309 N 3.93 1.86 0.00 4.37 0.00 -1.47 0.92 119.26 128.87 3e93 h ALA 309 Ca 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3e93 h ALA 309 Cb 1.85 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.63 3e93 h ALA 309 CO 0.44 -0.29 -0.24 0.37 0.00 0.00 0.00 179.25 179.53 3e93 h GLN 310 N 0.58 0.00 0.00 0.00 5.75 -1.85 -3.33 115.11 116.27 3e93 h GLN 310 Ca 0.62 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.95 3e93 h GLN 310 Cb 1.21 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.72 3e93 h GLN 310 CO -0.42 0.24 -1.65 0.66 -2.65 0.00 0.00 178.83 175.02 3e93 n TYR 311 N -3.61 0.00 -1.67 3.99 4.01 -0.38 -5.01 117.16 114.49 3e93 n TYR 311 Ca -0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.30 3e93 n TYR 311 Cb 0.38 -0.47 -0.03 0.00 -0.31 0.00 0.00 39.34 38.91 3e93 n TYR 311 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 3e93 n HIS 312 N -2.35 2.51 -3.74 -0.72 -0.00 0.18 -4.96 115.22 106.14 3e93 n HIS 312 Ca -0.15 -0.29 -0.29 0.00 0.46 0.00 0.00 57.72 57.44 3e93 n HIS 312 Cb 0.80 -2.78 -0.15 0.00 -0.12 0.00 0.00 29.99 27.74 3e93 n HIS 312 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 3e93 s ASP 313 N 4.13 3.72 0.05 0.26 -1.08 -1.26 -4.98 116.67 117.51 3e93 s ASP 313 Ca 0.88 -1.39 0.10 0.00 -0.52 0.00 0.00 52.55 51.63 3e93 s ASP 313 Cb -0.48 -0.80 0.45 0.00 -1.46 0.00 0.00 42.92 40.62 3e93 s ASP 313 CO 0.43 -0.37 1.31 -0.81 0.52 0.00 0.00 175.17 176.24 3e93 n PRO 314 N 4.90 0.03 -0.08 4.34 -0.04 -1.26 -0.93 135.00 141.95 3e93 n PRO 314 Ca -0.05 0.41 0.12 0.00 -0.04 0.00 0.00 63.50 63.94 3e93 n PRO 314 Cb 0.43 -1.58 0.19 0.00 -0.04 0.00 0.00 33.50 32.51 3e93 n PRO 314 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3e93 n ASP 315 N -1.64 3.01 -2.60 3.54 8.00 -1.26 -4.22 116.55 121.38 3e93 n ASP 315 Ca 0.01 -1.95 -0.04 0.00 0.71 0.00 0.00 54.79 53.52 3e93 n ASP 315 Cb 0.09 -0.10 0.04 0.00 -0.02 0.00 0.00 41.12 41.13 3e93 n ASP 315 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3e93 n ASP 316 N 1.27 2.17 -3.34 -2.24 2.03 -0.11 -4.88 116.55 111.44 3e93 n ASP 316 Ca 0.17 -2.36 -0.26 0.00 0.52 0.00 0.00 54.79 52.85 3e93 n ASP 316 Cb 0.57 -0.45 -0.08 0.00 -0.72 0.00 0.00 41.12 40.45 3e93 n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3e93 n GLU 317 N -0.57 2.04 -2.10 -0.67 1.02 -1.20 -4.90 120.64 114.26 3e93 n GLU 317 Ca 0.14 -4.27 -0.34 0.00 -0.02 0.00 0.00 57.16 52.67 3e93 n GLU 317 Cb 0.85 -1.96 0.01 0.00 -0.02 0.00 0.00 31.44 30.32 3e93 n GLU 317 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3e93 s PRO 318 N -2.15 3.22 0.37 3.49 0.04 -1.26 -4.97 135.00 133.75 3e93 s PRO 318 Ca 0.39 1.45 0.07 0.00 0.04 0.00 0.00 61.00 62.95 3e93 s PRO 318 Cb 0.16 -2.00 -0.00 0.00 0.04 0.00 0.00 34.50 32.70 3e93 s PRO 318 CO -0.04 -0.92 0.51 0.14 0.04 0.00 0.00 177.00 176.73 3e93 s VAL 319 N -2.08 3.57 0.34 -0.36 -7.23 -1.26 -4.22 120.40 109.16 3e93 s VAL 319 Ca 0.69 -1.00 -0.16 0.00 -1.81 0.00 0.00 61.98 59.70 3e93 s VAL 319 Cb -0.21 -3.22 -0.09 0.00 0.56 0.00 0.00 36.38 33.42 3e93 s VAL 319 CO 0.32 -0.08 0.77 0.00 -0.31 0.00 0.00 175.10 175.80 3e93 s ALA 320 N -2.26 3.27 0.69 1.32 0.00 -1.26 -5.02 121.76 118.50 3e93 s ALA 320 Ca 0.50 0.10 -0.17 0.00 0.00 0.00 0.00 51.96 52.39 3e93 s ALA 320 Cb -0.10 -2.83 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 3e93 s ALA 320 CO 0.32 0.29 0.87 -0.25 0.00 0.00 0.00 175.76 176.99 3e93 n ASP 321 N -0.43 0.17 -4.58 0.00 8.00 -1.26 -4.82 116.55 113.64 3e93 n ASP 321 Ca 0.04 0.68 -0.49 0.00 0.71 0.00 0.00 54.79 55.73 3e93 n ASP 321 Cb 0.53 -1.36 -0.04 0.00 -0.02 0.00 0.00 41.12 40.23 3e93 n ASP 321 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3e93 n PRO 322 N -1.40 1.14 -4.00 -0.24 -0.02 -1.26 -4.85 135.00 124.37 3e93 n PRO 322 Ca 0.13 0.41 -0.34 0.00 -2.02 0.00 0.00 63.50 61.68 3e93 n PRO 322 Cb 0.49 -1.92 -0.15 0.00 -0.02 0.00 0.00 33.50 31.90 3e93 n PRO 322 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3e93 s TYR 323 N -0.09 3.12 -0.58 6.00 5.04 -1.26 -5.07 117.35 124.51 3e93 s TYR 323 Ca 0.75 -1.82 -0.25 0.00 -2.44 0.00 0.00 57.07 53.30 3e93 s TYR 323 Cb -0.87 -2.02 0.04 0.00 0.35 0.00 0.00 41.96 39.46 3e93 s TYR 323 CO 0.51 -0.79 1.05 0.34 -1.34 0.00 0.00 175.55 175.32 3e93 s ASP 324 N 1.25 6.35 -0.43 4.32 -1.08 -1.26 -4.88 116.67 120.94 3e93 s ASP 324 Ca -0.03 -0.27 0.04 0.00 -0.52 0.00 0.00 52.55 51.78 3e93 s ASP 324 Cb -0.18 -2.48 0.49 0.00 -1.46 0.00 0.00 42.92 39.29 3e93 s ASP 324 CO -0.05 -1.37 1.61 0.00 0.52 0.00 0.00 175.17 175.88 3e93 n GLN 325 N 7.93 2.72 0.22 4.34 10.64 -1.26 -4.69 117.38 137.28 3e93 n GLN 325 Ca 0.03 -3.53 0.15 0.00 -1.83 0.00 0.00 57.00 51.83 3e93 n GLN 325 Cb 0.48 -2.15 0.80 0.00 -0.86 0.00 0.00 30.24 28.51 3e93 n GLN 325 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3e93 h SER 326 N 1.71 0.00 -0.13 2.61 4.64 -2.03 -1.33 113.55 119.03 3e93 h SER 326 Ca 0.43 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.79 3e93 h SER 326 Cb 1.44 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.53 3e93 h SER 326 CO 0.97 0.00 0.14 2.19 -0.87 0.00 0.00 176.83 179.26 3e93 h PHE 327 N 0.00 0.00 -0.13 4.77 -5.15 -1.96 -2.46 116.94 112.02 3e93 h PHE 327 Ca 0.07 0.00 0.02 0.00 -0.20 0.00 0.00 57.97 57.85 3e93 h PHE 327 Cb 0.33 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.49 3e93 h PHE 327 CO 0.00 0.00 0.09 0.93 -2.00 0.00 0.00 178.31 177.33 3e93 h GLU 328 N 0.00 0.10 -0.54 6.09 4.39 -1.63 -1.42 114.58 121.57 3e93 h GLU 328 Ca 0.06 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.76 3e93 h GLU 328 Cb 0.33 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 3e93 h GLU 328 CO -0.00 0.07 0.00 -1.13 -1.16 0.00 0.00 179.01 176.79 3e93 n SER 329 N -4.51 3.68 -4.79 1.42 3.41 -0.93 -4.95 113.62 106.94 3e93 n SER 329 Ca -0.01 -2.00 -0.38 0.00 -0.26 0.00 0.00 58.87 56.22 3e93 n SER 329 Cb 0.13 -0.36 -0.06 0.00 -0.26 0.00 0.00 64.21 63.67 3e93 n SER 329 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3e93 s ARG 330 N -1.29 4.15 -0.27 4.33 3.52 -0.54 -5.07 118.95 123.78 3e93 s ARG 330 Ca 0.43 0.57 -0.08 0.00 -0.13 0.00 0.00 55.73 56.52 3e93 s ARG 330 Cb 0.24 -3.29 -0.03 0.00 -1.56 0.00 0.00 34.95 30.32 3e93 s ARG 330 CO 0.33 0.52 0.11 -0.51 -0.81 0.00 0.00 175.30 174.94 3e93 s ASP 331 N -0.62 5.38 0.15 -2.12 1.01 -1.26 -5.03 116.67 114.18 3e93 s ASP 331 Ca 0.27 -0.24 0.02 0.00 0.71 0.00 0.00 52.55 53.31 3e93 s ASP 331 Cb -0.18 -1.98 -0.04 0.00 1.01 0.00 0.00 42.92 41.73 3e93 s ASP 331 CO 0.15 -0.07 -0.04 -0.76 0.21 0.00 0.00 175.17 174.65 3e93 s LEU 332 N 1.64 2.35 0.67 1.23 1.43 -1.26 -5.15 118.68 119.58 3e93 s LEU 332 Ca 0.06 -1.08 -0.11 0.00 -1.03 0.00 0.00 54.13 51.97 3e93 s LEU 332 Cb -0.16 -0.14 -0.01 0.00 0.03 0.00 0.00 46.19 45.91 3e93 s LEU 332 CO 0.06 -0.48 1.06 -0.76 0.23 0.00 0.00 176.35 176.45 3e93 s LEU 333 N -3.14 3.09 0.18 1.79 1.43 -1.26 -4.86 118.68 115.92 3e93 s LEU 333 Ca 0.19 1.40 -0.18 0.00 -1.03 0.00 0.00 54.13 54.50 3e93 s LEU 333 Cb 0.05 -4.32 0.14 0.00 0.03 0.00 0.00 46.19 42.08 3e93 s LEU 333 CO 0.01 -1.18 1.62 0.40 0.23 0.00 0.00 176.35 177.43 3e93 h ILE 334 N -0.54 0.35 0.00 -0.59 2.04 -1.93 -1.05 117.51 115.80 3e93 h ILE 334 Ca -0.44 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.37 3e93 h ILE 334 Cb 1.21 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 3e93 h ILE 334 CO 0.61 0.00 -0.20 0.44 0.00 0.00 0.00 178.15 179.00 3e93 h ASP 335 N -0.11 0.00 -0.11 1.72 3.32 -1.95 0.12 116.42 119.40 3e93 h ASP 335 Ca 0.23 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.15 3e93 h ASP 335 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 3e93 h ASP 335 CO -0.56 0.20 -0.43 -0.33 -1.72 0.00 0.00 179.24 176.40 3e93 h GLU 336 N 0.00 0.49 -0.92 3.56 5.08 -1.61 -0.21 114.58 120.97 3e93 h GLU 336 Ca -0.00 -0.38 0.03 0.00 -1.00 0.00 0.00 59.36 58.01 3e93 h GLU 336 Cb 0.41 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.68 3e93 h GLU 336 CO 0.03 1.01 0.60 -1.49 -1.00 0.00 0.00 179.01 178.15 3e93 h TRP 337 N 0.09 1.13 -0.37 4.33 4.06 -0.81 -1.53 115.95 122.86 3e93 h TRP 337 Ca -0.02 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 3e93 h TRP 337 Cb 1.07 -0.38 -0.02 0.00 -1.00 0.00 0.00 29.16 28.83 3e93 h TRP 337 CO 0.11 0.67 0.17 -0.22 -3.56 0.00 0.00 178.44 175.61 3e93 h LYS 338 N 1.18 0.53 -0.57 0.49 3.64 -0.70 -0.82 116.57 120.31 3e93 h LYS 338 Ca 0.36 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.58 3e93 h LYS 338 Cb -0.03 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 3e93 h LYS 338 CO -0.11 0.47 0.02 1.03 -2.27 0.00 0.00 179.45 178.60 3e93 h SER 339 N 0.45 0.94 -0.62 4.20 0.87 -0.90 -0.24 113.55 118.26 3e93 h SER 339 Ca 0.13 -0.24 -0.01 0.00 -1.23 0.00 0.00 61.79 60.43 3e93 h SER 339 Cb 0.12 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 61.80 3e93 h SER 339 CO -0.02 0.99 0.35 -0.07 -0.53 0.00 0.00 176.83 177.55 3e93 h LEU 340 N 0.90 0.77 -0.54 2.23 3.38 -1.10 -1.62 115.31 119.33 3e93 h LEU 340 Ca 0.17 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 3e93 h LEU 340 Cb 0.49 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3e93 h LEU 340 CO 0.02 0.64 0.18 0.74 0.09 0.00 0.00 178.44 180.11 3e93 h THR 341 N 0.84 1.23 -0.22 0.22 2.02 -0.88 -2.48 112.91 113.64 3e93 h THR 341 Ca 0.22 -0.76 0.03 0.00 0.77 0.00 0.00 66.41 66.67 3e93 h THR 341 Cb 0.03 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 3e93 h THR 341 CO -0.04 0.28 0.02 0.22 0.37 0.00 0.00 175.52 176.38 3e93 h TYR 342 N 0.74 0.03 -0.80 3.16 3.20 -0.81 -1.14 116.97 121.36 3e93 h TYR 342 Ca 0.17 0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.22 3e93 h TYR 342 Cb 0.26 0.02 -0.10 0.00 1.54 0.00 0.00 36.73 38.45 3e93 h TYR 342 CO 0.01 -0.01 0.34 -0.44 -1.64 0.00 0.00 178.16 176.43 3e93 h ASP 343 N 0.10 0.34 -0.01 -2.11 3.32 -1.17 -1.70 116.42 115.19 3e93 h ASP 343 Ca 0.10 0.11 -0.13 0.00 0.02 0.00 0.00 57.03 57.14 3e93 h ASP 343 Cb 0.12 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 3e93 h ASP 343 CO -0.15 0.11 -0.40 -0.33 -1.72 0.00 0.00 179.24 176.75 3e93 h GLU 344 N 0.47 0.52 -0.08 3.56 4.39 -0.89 -1.81 114.58 120.74 3e93 h GLU 344 Ca 0.45 -0.26 -0.00 0.00 0.34 0.00 0.00 59.36 59.89 3e93 h GLU 344 Cb 0.70 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.35 3e93 h GLU 344 CO -0.42 0.83 0.04 0.28 -1.16 0.00 0.00 179.01 178.58 3e93 h VAL 345 N 0.43 1.08 0.00 3.13 2.07 -0.56 -3.03 116.25 119.37 3e93 h VAL 345 Ca 0.04 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 3e93 h VAL 345 Cb 0.88 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3e93 h VAL 345 CO 0.08 0.07 -0.01 0.16 0.02 0.00 0.00 177.57 177.88 3e93 h ILE 346 N 0.04 0.02 -0.01 4.57 3.07 -1.20 -2.87 117.51 121.13 3e93 h ILE 346 Ca 0.03 -0.88 0.00 0.00 1.55 0.00 0.00 64.86 65.55 3e93 h ILE 346 Cb 0.08 1.87 0.00 0.00 -0.27 0.00 0.00 36.82 38.49 3e93 h ILE 346 CO -0.00 0.01 -0.17 -1.54 -1.05 0.00 0.00 178.15 175.39 3e93 n SER 347 N -3.10 0.78 -4.77 2.16 3.41 -0.69 -4.96 113.62 106.45 3e93 n SER 347 Ca 0.03 -0.77 -0.41 0.00 -0.26 0.00 0.00 58.87 57.46 3e93 n SER 347 Cb 0.47 0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 3e93 n SER 347 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3e93 s PHE 348 N -2.46 2.67 -0.14 7.33 5.36 -1.09 -5.01 117.98 124.64 3e93 s PHE 348 Ca 0.27 1.01 0.01 0.00 -0.96 0.00 0.00 56.93 57.25 3e93 s PHE 348 Cb 0.20 -4.04 0.02 0.00 -0.34 0.00 0.00 43.02 38.86 3e93 s PHE 348 CO 0.49 -3.23 -0.14 0.08 -1.46 0.00 0.00 175.22 170.96 3e93 s VAL 349 N -0.64 1.51 0.85 3.12 1.01 -1.26 -5.07 120.40 119.92 3e93 s VAL 349 Ca 0.57 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 3e93 s VAL 349 Cb -0.47 -1.42 0.11 0.00 0.00 0.00 0.00 36.38 34.60 3e93 s VAL 349 CO 0.56 0.45 1.14 -2.16 0.00 0.00 0.00 175.10 175.09 3e93 s PRO 350 N 1.42 1.50 0.21 2.72 0.04 -1.26 -4.92 135.00 134.71 3e93 s PRO 350 Ca 0.03 1.47 -0.32 0.00 0.04 0.00 0.00 61.00 62.22 3e93 s PRO 350 Cb -0.13 -1.79 -0.13 0.00 0.04 0.00 0.00 34.50 32.49 3e93 s PRO 350 CO -0.09 -2.26 1.53 -2.30 0.04 0.00 0.00 177.00 173.92 3e93 n PRO 351 N -3.84 2.21 -1.13 0.56 -0.02 -1.26 -4.96 135.00 126.56 3e93 n PRO 351 Ca 0.11 0.79 -0.31 0.00 -2.02 0.00 0.00 63.50 62.08 3e93 n PRO 351 Cb 0.52 -2.53 0.12 0.00 -0.02 0.00 0.00 33.50 31.59 3e93 n PRO 351 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3e93 s PRO 352 N 0.32 1.71 0.00 0.52 0.04 -1.26 -5.15 135.00 131.17 3e93 s PRO 352 Ca 0.73 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.90 3e93 s PRO 352 Cb -0.64 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.07 3e93 s PRO 352 CO 0.43 -2.02 0.00 -0.11 0.04 0.00 0.00 177.00 175.34