#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dk8 s VAL 18 N 0.00 0.45 0.05 0.00 0.11 -1.26 -4.29 120.40 115.46 3dk8 s VAL 18 Ca 0.00 0.01 -0.25 0.00 -2.93 0.00 0.00 61.98 58.81 3dk8 s VAL 18 Cb 0.00 -0.54 -0.06 0.00 -1.53 0.00 0.00 36.38 34.25 3dk8 s VAL 18 CO 0.00 0.24 0.76 0.00 -3.33 0.00 0.00 175.10 172.77 3dk8 s ALA 19 N 1.48 3.38 -0.05 1.54 0.00 -0.91 -4.90 121.76 122.29 3dk8 s ALA 19 Ca -0.02 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.22 3dk8 s ALA 19 Cb -0.13 -2.98 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 3dk8 s ALA 19 CO -0.03 0.09 -0.04 0.45 0.00 0.00 0.00 175.76 176.23 3dk8 s SER 20 N -0.15 4.88 0.20 0.00 0.15 -1.26 -0.94 113.70 116.58 3dk8 s SER 20 Ca 0.38 0.01 0.04 0.00 0.70 0.00 0.00 55.95 57.08 3dk8 s SER 20 Cb -0.21 -1.27 -0.05 0.00 -1.71 0.00 0.00 66.02 62.79 3dk8 s SER 20 CO 0.23 0.35 -0.05 -0.31 1.20 0.00 0.00 173.24 174.66 3dk8 s TYR 21 N -0.90 1.48 0.22 3.44 1.51 -0.50 -4.97 117.35 117.63 3dk8 s TYR 21 Ca 0.14 -0.84 0.06 0.00 -1.01 0.00 0.00 57.07 55.43 3dk8 s TYR 21 Cb -0.11 -0.82 0.18 0.00 -0.11 0.00 0.00 41.96 41.10 3dk8 s TYR 21 CO 0.04 0.04 1.51 -0.44 -1.11 0.00 0.00 175.55 175.58 3dk8 h ASP 22 N 2.58 0.16 -3.05 2.29 3.45 -1.06 -3.36 116.42 117.43 3dk8 h ASP 22 Ca -0.38 -0.11 -0.21 0.00 0.43 0.00 0.00 57.03 56.77 3dk8 h ASP 22 Cb 1.21 -0.05 -0.31 0.00 -0.56 0.00 0.00 39.33 39.62 3dk8 h ASP 22 CO 0.64 0.82 -0.51 -0.47 -1.57 0.00 0.00 179.24 178.15 3dk8 s TYR 23 N -3.49 -0.39 -0.17 4.55 5.04 -0.90 -3.71 117.35 118.30 3dk8 s TYR 23 Ca -0.02 0.90 -0.01 0.00 -2.44 0.00 0.00 57.07 55.50 3dk8 s TYR 23 Cb 0.12 -0.01 -0.00 0.00 0.35 0.00 0.00 41.96 42.42 3dk8 s TYR 23 CO 0.80 -0.31 -0.13 -0.51 -1.34 0.00 0.00 175.55 174.06 3dk8 s LEU 24 N 1.97 2.59 -0.18 6.97 1.43 -0.72 -1.82 118.68 128.92 3dk8 s LEU 24 Ca -0.03 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.62 3dk8 s LEU 24 Cb -0.11 -1.60 -0.00 0.00 0.03 0.00 0.00 46.19 44.50 3dk8 s LEU 24 CO -0.09 0.07 -0.11 -0.69 0.23 0.00 0.00 176.35 175.76 3dk8 s VAL 25 N 0.89 2.89 -0.47 -1.59 1.01 -0.13 -0.82 120.40 122.19 3dk8 s VAL 25 Ca -0.03 -0.67 -0.16 0.00 0.00 0.00 0.00 61.98 61.12 3dk8 s VAL 25 Cb -0.15 -2.26 0.07 0.00 0.00 0.00 0.00 36.38 34.03 3dk8 s VAL 25 CO -0.01 0.48 0.40 -0.63 0.00 0.00 0.00 175.10 175.35 3dk8 s ILE 26 N 1.09 5.22 0.00 2.22 1.01 0.37 -0.52 121.20 130.60 3dk8 s ILE 26 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 59.66 3dk8 s ILE 26 Cb -0.14 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.21 3dk8 s ILE 26 CO -0.03 -0.56 0.00 0.61 0.00 0.00 0.00 174.94 174.96 3dk8 n GLY 27 N 5.20 3.37 2.26 6.18 0.00 0.34 -0.62 105.19 121.91 3dk8 n GLY 27 Ca -0.12 -1.28 -0.30 0.00 0.00 0.00 0.00 46.02 44.32 3dk8 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dk8 n GLY 28 N 0.67 6.10 0.00 -0.02 0.00 -1.23 -4.14 105.19 106.56 3dk8 n GLY 28 Ca 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 46.02 43.49 3dk8 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dk8 n GLY 29 N -0.75 1.51 0.20 -0.02 0.00 -1.26 -0.65 105.19 104.21 3dk8 n GLY 29 Ca 0.51 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.45 3dk8 n GLY 29 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3dk8 h SER 30 N 0.00 -0.47 -0.33 1.61 0.02 -1.94 -0.10 113.55 112.33 3dk8 h SER 30 Ca 0.00 0.09 -0.07 0.00 -0.84 0.00 0.00 61.79 60.98 3dk8 h SER 30 Cb 0.00 0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 3dk8 h SER 30 CO 0.00 -0.19 -0.06 1.23 -1.14 0.00 0.00 176.83 176.67 3dk8 h GLY 31 N -0.16 0.68 0.87 -3.77 0.00 -1.87 -2.14 103.07 96.68 3dk8 h GLY 31 Ca 0.11 -0.55 -0.08 0.00 0.00 0.00 0.00 47.33 46.81 3dk8 h GLY 31 CO -0.27 0.50 -0.17 -1.33 0.00 0.00 0.00 176.54 175.26 3dk8 h GLY 32 N 0.42 0.60 0.81 4.60 0.00 -1.67 -1.31 103.07 106.51 3dk8 h GLY 32 Ca 0.09 -0.57 0.02 0.00 0.00 0.00 0.00 47.33 46.86 3dk8 h GLY 32 CO 0.03 0.52 -0.03 1.41 0.00 0.00 0.00 176.54 178.47 3dk8 h LEU 33 N 0.26 -0.10 -0.48 3.11 3.38 -1.08 -0.65 115.31 119.75 3dk8 h LEU 33 Ca 0.05 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 3dk8 h LEU 33 Cb 0.70 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 3dk8 h LEU 33 CO 0.05 -0.04 0.02 0.00 0.09 0.00 0.00 178.44 178.56 3dk8 h ALA 34 N 1.06 0.64 -0.34 1.53 0.00 -1.33 -0.95 119.26 119.87 3dk8 h ALA 34 Ca 0.04 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 3dk8 h ALA 34 Cb 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3dk8 h ALA 34 CO -0.09 0.42 -0.04 1.03 0.00 0.00 0.00 179.25 180.57 3dk8 h SER 35 N 0.69 0.63 -0.56 0.00 0.87 -1.11 -2.00 113.55 112.06 3dk8 h SER 35 Ca 0.14 -0.34 -0.02 0.00 -1.23 0.00 0.00 61.79 60.34 3dk8 h SER 35 Cb 0.47 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.24 3dk8 h SER 35 CO 0.02 0.82 0.29 0.00 -0.53 0.00 0.00 176.83 177.43 3dk8 h ALA 36 N 0.83 0.72 -0.70 6.23 0.00 -1.01 -0.67 119.26 124.67 3dk8 h ALA 36 Ca 0.09 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3dk8 h ALA 36 Cb 0.52 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3dk8 h ALA 36 CO 0.03 0.27 0.18 0.00 0.00 0.00 0.00 179.25 179.72 3dk8 h ARG 37 N 0.76 1.12 -0.29 0.00 3.08 -1.10 -0.78 114.38 117.16 3dk8 h ARG 37 Ca 0.20 -0.26 -0.17 0.00 0.07 0.00 0.00 59.98 59.81 3dk8 h ARG 37 Cb 0.08 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.98 3dk8 h ARG 37 CO -0.03 0.98 -0.50 -0.09 -1.07 0.00 0.00 179.97 179.26 3dk8 h ARG 38 N 1.05 0.83 -0.70 0.04 9.65 -1.14 -2.06 114.38 122.05 3dk8 h ARG 38 Ca 0.22 -0.50 0.00 0.00 -1.10 0.00 0.00 59.98 58.61 3dk8 h ARG 38 Cb 0.36 0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 28.95 3dk8 h ARG 38 CO 0.00 1.13 0.45 0.00 2.80 0.00 0.00 179.97 184.35 3dk8 h ALA 39 N 0.78 0.89 -0.76 2.80 0.00 -0.91 -2.42 119.26 119.64 3dk8 h ALA 39 Ca 0.03 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3dk8 h ALA 39 Cb 1.09 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3dk8 h ALA 39 CO 0.11 0.33 0.29 0.00 0.00 0.00 0.00 179.25 179.99 3dk8 h ALA 40 N 1.24 1.09 -0.66 0.00 0.00 -1.01 -1.49 119.26 118.43 3dk8 h ALA 40 Ca 0.25 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 55.07 3dk8 h ALA 40 Cb -0.08 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.37 3dk8 h ALA 40 CO -0.05 0.64 0.44 1.49 0.00 0.00 0.00 179.25 181.77 3dk8 h GLU 41 N 1.10 0.46 -0.05 0.00 4.81 -0.89 -0.98 114.58 119.03 3dk8 h GLU 41 Ca 0.25 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3dk8 h GLU 41 Cb 0.22 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.50 3dk8 h GLU 41 CO -0.02 0.30 0.00 1.28 -0.73 0.00 0.00 179.01 179.84 3dk8 n LEU 42 N -4.48 0.70 0.00 1.64 4.77 -0.65 -4.91 117.00 114.07 3dk8 n LEU 42 Ca 0.11 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 3dk8 n LEU 42 Cb 0.38 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 3dk8 n LEU 42 CO 0.33 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 3dk8 n GLY 43 N 0.98 0.36 3.77 -0.72 0.00 -0.37 -4.96 105.19 104.25 3dk8 n GLY 43 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3dk8 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk8 s ALA 44 N -2.00 3.46 -0.73 4.61 0.00 -0.66 -4.95 121.76 121.49 3dk8 s ALA 44 Ca 0.00 1.54 -0.26 0.00 0.00 0.00 0.00 51.96 53.24 3dk8 s ALA 44 Cb 0.00 -3.60 0.04 0.00 0.00 0.00 0.00 23.12 19.56 3dk8 s ALA 44 CO 0.00 -1.10 1.19 1.03 0.00 0.00 0.00 175.76 176.88 3dk8 s ARG 45 N -2.22 3.18 0.23 0.00 0.52 -1.26 -4.24 118.95 115.17 3dk8 s ARG 45 Ca 0.56 -0.45 0.11 0.00 -0.52 0.00 0.00 55.73 55.43 3dk8 s ARG 45 Cb -0.46 -4.23 -0.05 0.00 0.52 0.00 0.00 34.95 30.74 3dk8 s ARG 45 CO 0.61 -2.06 -0.18 0.00 0.02 0.00 0.00 175.30 173.69 3dk8 s ALA 46 N 5.22 2.73 0.01 2.13 0.00 -1.26 -0.43 121.76 130.17 3dk8 s ALA 46 Ca 0.32 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.59 3dk8 s ALA 46 Cb -0.10 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 3dk8 s ALA 46 CO 0.13 0.37 -0.02 0.00 0.00 0.00 0.00 175.76 176.24 3dk8 s ALA 47 N -2.01 0.11 -0.15 0.00 0.00 -0.76 -2.11 121.76 116.85 3dk8 s ALA 47 Ca 0.25 -0.33 -0.00 0.00 0.00 0.00 0.00 51.96 51.88 3dk8 s ALA 47 Cb -0.07 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 3dk8 s ALA 47 CO 0.13 -0.07 -0.13 0.08 0.00 0.00 0.00 175.76 175.77 3dk8 s VAL 48 N -0.77 2.92 -0.15 0.00 1.01 -0.14 -0.95 120.40 122.33 3dk8 s VAL 48 Ca -0.08 -0.69 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 3dk8 s VAL 48 Cb -0.05 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.04 3dk8 s VAL 48 CO -0.00 0.51 0.27 -0.69 0.00 0.00 0.00 175.10 175.19 3dk8 s VAL 49 N 0.65 5.31 -0.08 2.92 1.01 0.33 -0.69 120.40 129.85 3dk8 s VAL 49 Ca -0.07 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.38 3dk8 s VAL 49 Cb -0.15 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.67 3dk8 s VAL 49 CO 0.02 0.43 0.16 -0.70 0.00 0.00 0.00 175.10 175.02 3dk8 s GLU 50 N 0.17 0.07 0.24 2.72 2.56 -0.45 -0.50 118.70 123.51 3dk8 s GLU 50 Ca 0.16 0.49 0.23 0.00 0.00 0.00 0.00 54.97 55.85 3dk8 s GLU 50 Cb -0.13 -0.22 0.09 0.00 2.00 0.00 0.00 34.13 35.87 3dk8 s GLU 50 CO 0.04 -0.25 1.18 0.66 -0.56 0.00 0.00 175.26 176.33 3dk8 h SER 51 N 7.88 0.00 0.00 -1.70 4.64 -1.79 -1.98 113.55 120.59 3dk8 h SER 51 Ca -0.26 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3dk8 h SER 51 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3dk8 h SER 51 CO 0.26 0.01 0.00 1.41 -0.87 0.00 0.00 176.83 177.64 3dk8 n HIS 52 N -2.72 0.00 -4.38 4.77 8.25 -1.26 -4.68 115.22 115.20 3dk8 n HIS 52 Ca 0.01 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.13 3dk8 n HIS 52 Cb 0.54 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.53 3dk8 n HIS 52 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3dk8 s LYS 53 N 3.18 3.58 0.51 -0.41 1.02 -1.26 -5.05 119.74 121.32 3dk8 s LYS 53 Ca 0.00 -0.49 -0.22 0.00 0.02 0.00 0.00 55.97 55.27 3dk8 s LYS 53 Cb 0.00 -2.91 -0.07 0.00 -0.52 0.00 0.00 37.83 34.33 3dk8 s LYS 53 CO 0.00 0.31 1.22 1.28 -0.92 0.00 0.00 175.35 177.24 3dk8 n LEU 54 N 3.32 4.43 0.00 3.17 4.77 -1.26 -2.26 117.00 129.17 3dk8 n LEU 54 Ca -0.17 0.99 0.00 0.00 -0.03 0.00 0.00 56.01 56.79 3dk8 n LEU 54 Cb 0.53 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 3dk8 n LEU 54 CO 0.32 -0.95 0.00 0.61 -1.33 0.00 0.00 177.39 176.05 3dk8 n GLY 55 N 0.92 2.37 7.00 -0.72 0.00 0.18 -4.63 105.19 110.31 3dk8 n GLY 55 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3dk8 n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dk8 n GLY 56 N -2.00 1.83 0.25 -0.02 0.00 -0.96 -2.17 105.19 102.13 3dk8 n GLY 56 Ca 0.00 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 3dk8 n GLY 56 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3dk8 h THR 57 N 0.00 1.26 -0.16 2.61 2.02 -1.94 -2.03 112.91 114.67 3dk8 h THR 57 Ca 0.00 -1.00 0.05 0.00 0.77 0.00 0.00 66.41 66.24 3dk8 h THR 57 Cb 0.00 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 67.27 3dk8 h THR 57 CO 0.00 0.35 -0.25 0.00 0.37 0.00 0.00 175.52 175.99 3dk8 h VAL 59 N -0.31 1.37 0.06 0.00 2.07 -1.42 -1.46 116.25 116.56 3dk8 h VAL 59 Ca 0.11 -2.42 -0.38 0.00 0.82 0.00 0.00 66.70 64.83 3dk8 h VAL 59 Cb 0.47 2.84 -0.05 0.00 -1.52 0.00 0.00 31.29 33.04 3dk8 h VAL 59 CO -0.33 0.72 -2.24 0.59 0.02 0.00 0.00 177.57 176.32 3dk8 n ASN 60 N -3.96 1.93 -1.14 0.57 3.02 -0.77 -4.39 115.26 110.52 3dk8 n ASN 60 Ca -0.13 0.04 0.02 0.00 -0.03 0.00 0.00 54.58 54.47 3dk8 n ASN 60 Cb 0.89 -0.54 0.01 0.00 -0.61 0.00 0.00 39.78 39.52 3dk8 n ASN 60 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3dk8 n VAL 61 N -3.33 0.00 0.00 2.41 0.24 -0.56 -4.84 118.33 112.25 3dk8 n VAL 61 Ca -0.38 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.32 3dk8 n VAL 61 Cb 1.02 0.78 0.00 0.00 -1.47 0.00 0.00 33.84 34.17 3dk8 n VAL 61 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dk8 n GLY 62 N 0.30 4.51 0.39 7.63 0.00 0.61 -4.80 105.19 113.85 3dk8 n GLY 62 Ca 0.01 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.41 3dk8 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk8 h VAL 64 N 0.00 0.38 -0.12 0.00 2.07 -1.53 -1.17 116.25 115.87 3dk8 h VAL 64 Ca 0.20 -0.65 -0.06 0.00 0.82 0.00 0.00 66.70 67.02 3dk8 h VAL 64 Cb 0.44 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 3dk8 h VAL 64 CO -0.92 0.08 -0.18 1.55 0.02 0.00 0.00 177.57 178.13 3dk8 h PRO 65 N -1.00 0.20 -0.18 1.57 0.13 -1.74 -1.56 132.00 129.42 3dk8 h PRO 65 Ca -0.05 -0.05 0.02 0.00 -0.87 0.00 0.00 66.00 65.04 3dk8 h PRO 65 Cb 0.53 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.62 3dk8 h PRO 65 CO 0.09 0.38 0.07 -0.22 -0.23 0.00 0.00 178.00 178.09 3dk8 h LYS 66 N 0.19 0.16 -0.42 0.86 3.11 -1.14 -1.94 116.57 117.38 3dk8 h LYS 66 Ca 0.04 -0.01 -0.05 0.00 -2.81 0.00 0.00 60.65 57.81 3dk8 h LYS 66 Cb 0.43 -0.04 -0.02 0.00 -1.00 0.00 0.00 32.23 31.60 3dk8 h LYS 66 CO 0.03 0.11 0.04 -0.22 -2.81 0.00 0.00 179.45 176.60 3dk8 h LYS 67 N 0.17 0.66 -0.51 1.90 1.63 -0.43 0.15 116.57 120.13 3dk8 h LYS 67 Ca 0.08 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 3dk8 h LYS 67 Cb 0.04 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.55 3dk8 h LYS 67 CO -0.07 0.65 0.32 0.28 -3.45 0.00 0.00 179.45 177.18 3dk8 h VAL 68 N 0.63 1.14 -0.11 2.00 2.07 -1.13 0.32 116.25 121.18 3dk8 h VAL 68 Ca 0.14 -0.30 -0.10 0.00 0.82 0.00 0.00 66.70 67.26 3dk8 h VAL 68 Cb 0.33 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3dk8 h VAL 68 CO 0.01 0.14 -0.38 0.24 0.02 0.00 0.00 177.57 177.60 3dk8 h MET 69 N 0.68 0.22 -0.22 1.57 2.86 -0.62 -1.71 114.93 117.72 3dk8 h MET 69 Ca 0.18 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.70 3dk8 h MET 69 Cb -0.04 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 3dk8 h MET 69 CO -0.04 0.58 0.04 2.35 1.06 0.00 0.00 176.91 180.90 3dk8 h TRP 70 N 0.19 0.39 -0.85 -0.22 7.01 -0.27 -0.58 115.95 121.63 3dk8 h TRP 70 Ca 0.02 -0.05 0.09 0.00 2.11 0.00 0.00 58.89 61.06 3dk8 h TRP 70 Cb 0.76 -0.11 -0.06 0.00 -2.10 0.00 0.00 29.16 27.65 3dk8 h TRP 70 CO 0.01 0.50 0.55 -0.91 -2.79 0.00 0.00 178.44 175.81 3dk8 h ASN 71 N 0.17 0.75 -0.27 2.65 2.35 -0.71 0.33 115.58 120.85 3dk8 h ASN 71 Ca 0.07 0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.80 3dk8 h ASN 71 Cb 0.32 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 3dk8 h ASN 71 CO 0.00 0.45 0.02 0.74 -1.65 0.00 0.00 177.43 176.99 3dk8 h THR 72 N 0.83 1.24 -0.10 2.81 2.02 -0.93 -2.54 112.91 116.24 3dk8 h THR 72 Ca 0.39 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 3dk8 h THR 72 Cb 0.41 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 3dk8 h THR 72 CO -0.16 0.27 -0.04 0.00 0.37 0.00 0.00 175.52 175.95 3dk8 h ALA 73 N 0.84 1.74 -0.25 6.16 0.00 -0.40 0.19 119.26 127.54 3dk8 h ALA 73 Ca 0.08 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3dk8 h ALA 73 Cb 0.37 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3dk8 h ALA 73 CO 0.01 0.20 -0.19 0.28 0.00 0.00 0.00 179.25 179.55 3dk8 h VAL 74 N 0.15 1.24 -0.28 0.00 2.07 -0.66 -2.36 116.25 116.42 3dk8 h VAL 74 Ca 0.03 -1.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.42 3dk8 h VAL 74 Cb 0.18 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3dk8 h VAL 74 CO 0.01 0.36 0.08 0.45 0.02 0.00 0.00 177.57 178.48 3dk8 h HIS 75 N 0.41 0.39 0.00 1.57 3.86 -0.56 0.70 115.15 121.51 3dk8 h HIS 75 Ca 0.07 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.25 3dk8 h HIS 75 Cb 0.57 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.91 3dk8 h HIS 75 CO 0.02 0.34 -0.05 0.66 0.86 0.00 0.00 177.93 179.75 3dk8 h SER 76 N 0.39 0.00 0.75 2.45 4.64 -1.07 -1.90 113.55 118.80 3dk8 h SER 76 Ca 0.10 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.16 3dk8 h SER 76 Cb 0.13 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.19 3dk8 h SER 76 CO -0.01 0.05 -1.31 -0.33 -0.87 0.00 0.00 176.83 174.37 3dk8 h GLU 77 N 0.00 0.04 -0.69 4.77 5.08 -0.83 -2.90 114.58 120.06 3dk8 h GLU 77 Ca -0.00 -0.08 0.13 0.00 -1.00 0.00 0.00 59.36 58.42 3dk8 h GLU 77 Cb 0.10 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.28 3dk8 h GLU 77 CO 0.01 0.86 0.20 0.74 -1.00 0.00 0.00 179.01 179.81 3dk8 h PHE 78 N 0.01 0.32 -0.72 4.33 0.05 -1.17 -1.28 116.94 118.49 3dk8 h PHE 78 Ca -0.14 0.04 0.05 0.00 3.82 0.00 0.00 57.97 61.74 3dk8 h PHE 78 Cb 1.89 -0.04 -0.05 0.00 2.00 0.00 0.00 35.95 39.75 3dk8 h PHE 78 CO 0.01 -0.01 0.43 1.98 -0.18 0.00 0.00 178.31 180.53 3dk8 h MET 79 N 0.32 0.78 -0.10 1.51 4.05 -1.29 -2.73 114.93 117.47 3dk8 h MET 79 Ca 0.37 -0.05 -0.11 0.00 -0.28 0.00 0.00 59.70 59.63 3dk8 h MET 79 Cb 0.58 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 31.19 3dk8 h MET 79 CO -0.43 0.52 -0.44 0.45 0.23 0.00 0.00 176.91 177.23 3dk8 h HIS 80 N 0.80 0.29 -0.10 1.39 3.86 -1.04 -3.14 115.15 117.22 3dk8 h HIS 80 Ca 0.31 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.43 3dk8 h HIS 80 Cb 0.13 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.53 3dk8 h HIS 80 CO -0.06 0.65 0.00 -0.25 0.86 0.00 0.00 177.93 179.13 3dk8 n ASP 81 N -4.00 1.70 -0.17 2.45 10.43 -1.00 -4.53 116.55 121.44 3dk8 n ASP 81 Ca -0.02 -1.63 -0.09 0.00 2.57 0.00 0.00 54.79 55.62 3dk8 n ASP 81 Cb 0.50 -0.06 0.01 0.00 1.84 0.00 0.00 41.12 43.41 3dk8 n ASP 81 CO 0.00 0.00 0.00 -0.74 -1.07 0.00 0.00 177.20 175.39 3dk8 h HIS 82 N 2.45 0.80 -0.59 1.24 2.76 -1.44 -1.86 115.15 118.51 3dk8 h HIS 82 Ca 0.00 -0.09 -0.09 0.00 -2.20 0.00 0.00 60.37 58.00 3dk8 h HIS 82 Cb 0.53 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.24 3dk8 h HIS 82 CO 0.06 0.71 0.03 0.00 -1.30 0.00 0.00 177.93 177.44 3dk8 h ALA 83 N 1.00 0.94 -0.15 5.26 0.00 -1.78 -2.14 119.26 122.39 3dk8 h ALA 83 Ca 0.16 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3dk8 h ALA 83 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3dk8 h ALA 83 CO -0.00 0.64 -0.00 -0.44 0.00 0.00 0.00 179.25 179.45 3dk8 h ASP 84 N 0.93 0.19 -0.25 0.00 3.45 -1.65 -1.82 116.42 117.26 3dk8 h ASP 84 Ca 0.17 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.62 3dk8 h ASP 84 Cb 0.49 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.22 3dk8 h ASP 84 CO 0.02 0.23 0.00 -1.22 -1.57 0.00 0.00 179.24 176.70 3dk8 n TYR 85 N -4.41 0.33 0.00 4.55 4.02 -0.82 -4.87 117.16 115.97 3dk8 n TYR 85 Ca -0.01 -0.17 0.00 0.00 -0.01 0.00 0.00 57.90 57.72 3dk8 n TYR 85 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 3dk8 n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dk8 n GLY 86 N 0.93 0.92 3.80 2.72 0.00 -0.68 -5.07 105.19 107.81 3dk8 n GLY 86 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 3dk8 n GLY 86 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dk8 s PHE 87 N -2.00 2.90 0.17 1.61 0.08 -0.85 -5.00 117.98 114.89 3dk8 s PHE 87 Ca 0.00 -0.26 -0.32 0.00 0.12 0.00 0.00 56.93 56.46 3dk8 s PHE 87 Cb 0.00 -1.62 -0.16 0.00 -0.57 0.00 0.00 43.02 40.67 3dk8 s PHE 87 CO 0.00 0.34 1.01 -2.30 -0.10 0.00 0.00 175.22 174.16 3dk8 n PRO 88 N -1.24 0.82 -2.05 0.24 -0.02 -1.26 -3.50 135.00 127.98 3dk8 n PRO 88 Ca -0.04 0.29 -0.39 0.00 -2.02 0.00 0.00 63.50 61.34 3dk8 n PRO 88 Cb 0.59 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 3dk8 n PRO 88 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3dk8 s SER 89 N -0.27 6.16 0.06 2.55 0.01 -1.26 -4.46 113.70 116.49 3dk8 s SER 89 Ca 0.72 2.61 -0.06 0.00 1.31 0.00 0.00 55.95 60.53 3dk8 s SER 89 Cb -0.90 -2.63 -0.01 0.00 0.21 0.00 0.00 66.02 62.68 3dk8 s SER 89 CO 0.55 -0.95 0.11 0.00 0.41 0.00 0.00 173.24 173.36 3dk8 n GLU 91 N 0.32 0.00 -3.97 0.00 2.13 -1.26 -4.72 120.64 113.14 3dk8 n GLU 91 Ca -0.16 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.40 3dk8 n GLU 91 Cb 0.60 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.27 3dk8 n GLU 91 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 3dk8 s GLY 92 N 0.00 2.36 -0.43 8.31 0.00 -1.26 -5.06 107.32 111.23 3dk8 s GLY 92 Ca 0.00 -1.63 -0.29 0.00 0.00 0.00 0.00 44.72 42.80 3dk8 s GLY 92 CO 0.00 -1.90 1.34 0.54 0.00 0.00 0.00 173.10 173.08 3dk8 s LYS 93 N -4.09 3.60 0.47 2.90 1.02 -1.26 -4.98 119.74 117.41 3dk8 s LYS 93 Ca 0.37 0.82 -0.22 0.00 0.02 0.00 0.00 55.97 56.96 3dk8 s LYS 93 Cb 0.00 -4.00 -0.10 0.00 -0.52 0.00 0.00 37.83 33.22 3dk8 s LYS 93 CO 0.22 -1.53 0.87 0.34 -0.92 0.00 0.00 175.35 174.32 3dk8 n PHE 94 N 8.59 0.61 -3.86 3.18 7.35 -1.26 -4.99 117.46 127.08 3dk8 n PHE 94 Ca 0.15 0.53 -0.34 0.00 -0.76 0.00 0.00 57.45 57.03 3dk8 n PHE 94 Cb 0.48 -2.14 -0.13 0.00 0.35 0.00 0.00 39.48 38.05 3dk8 n PHE 94 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 3dk8 s ASN 95 N -0.92 5.00 0.28 -2.13 3.84 -1.26 -4.99 114.94 114.77 3dk8 s ASN 95 Ca 0.66 -2.30 0.02 0.00 0.21 0.00 0.00 52.86 51.45 3dk8 s ASN 95 Cb -0.52 -1.75 0.63 0.00 -0.55 0.00 0.00 41.25 39.05 3dk8 s ASN 95 CO 0.55 -0.43 1.79 -0.25 -2.79 0.00 0.00 177.10 175.96 3dk8 h TRP 96 N 7.59 0.99 -0.52 0.43 2.91 -1.94 -2.09 115.95 123.31 3dk8 h TRP 96 Ca -0.08 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.01 3dk8 h TRP 96 Cb 1.01 -0.30 -0.03 0.00 -0.51 0.00 0.00 29.16 29.33 3dk8 h TRP 96 CO 0.54 0.27 0.35 -0.09 -1.03 0.00 0.00 178.44 178.48 3dk8 h ARG 97 N 0.77 0.57 0.06 2.65 2.43 -1.95 -0.91 114.38 118.01 3dk8 h ARG 97 Ca 0.52 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.65 3dk8 h ARG 97 Cb 0.72 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 3dk8 h ARG 97 CO -0.35 0.38 -0.03 0.28 -1.51 0.00 0.00 179.97 178.74 3dk8 h VAL 98 N 0.59 0.96 0.01 0.20 2.07 -1.77 -1.85 116.25 116.46 3dk8 h VAL 98 Ca 0.21 -0.06 -0.19 0.00 0.82 0.00 0.00 66.70 67.47 3dk8 h VAL 98 Cb 0.11 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3dk8 h VAL 98 CO -0.05 0.02 -0.89 -0.29 0.02 0.00 0.00 177.57 176.37 3dk8 h ILE 99 N -0.11 1.57 -0.48 4.57 6.09 -1.58 -2.90 117.51 124.68 3dk8 h ILE 99 Ca -0.01 -2.86 0.05 0.00 -1.37 0.00 0.00 64.86 60.67 3dk8 h ILE 99 Cb 0.09 2.58 -0.05 0.00 0.47 0.00 0.00 36.82 39.91 3dk8 h ILE 99 CO 0.01 0.82 0.21 0.50 -3.07 0.00 0.00 178.15 176.63 3dk8 h LYS 100 N 0.04 0.41 -0.53 2.19 3.64 -1.02 0.79 116.57 122.09 3dk8 h LYS 100 Ca -0.03 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.27 3dk8 h LYS 100 Cb 1.55 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 33.26 3dk8 h LYS 100 CO 0.13 0.27 0.12 1.49 -2.27 0.00 0.00 179.45 179.19 3dk8 h GLU 101 N 0.42 0.85 -0.52 1.90 4.22 -1.29 -0.53 114.58 119.63 3dk8 h GLU 101 Ca 0.22 -0.21 -0.10 0.00 0.08 0.00 0.00 59.36 59.35 3dk8 h GLU 101 Cb 0.17 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 3dk8 h GLU 101 CO -0.18 0.81 -0.08 0.87 -2.18 0.00 0.00 179.01 178.24 3dk8 h LYS 102 N 0.74 0.96 -0.24 1.92 1.57 -1.24 -1.56 116.57 118.72 3dk8 h LYS 102 Ca 0.17 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 3dk8 h LYS 102 Cb 0.35 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 3dk8 h LYS 102 CO 0.00 1.00 0.13 -0.09 -0.57 0.00 0.00 179.45 179.92 3dk8 h ARG 103 N 0.86 0.34 -0.77 3.15 2.43 -0.67 -1.85 114.38 117.88 3dk8 h ARG 103 Ca 0.14 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 3dk8 h ARG 103 Cb 0.62 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.07 3dk8 h ARG 103 CO 0.04 0.32 0.38 -0.44 -1.51 0.00 0.00 179.97 178.77 3dk8 h ASP 104 N 0.28 0.98 -0.60 -3.80 3.32 -0.95 -1.48 116.42 114.16 3dk8 h ASP 104 Ca 0.08 -0.10 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 3dk8 h ASP 104 Cb 0.08 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 3dk8 h ASP 104 CO -0.01 0.82 0.22 0.00 -1.72 0.00 0.00 179.24 178.54 3dk8 h ALA 105 N 1.34 0.79 -0.56 3.45 0.00 -1.06 -1.39 119.26 121.82 3dk8 h ALA 105 Ca 0.27 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3dk8 h ALA 105 Cb 0.09 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3dk8 h ALA 105 CO -0.04 0.43 0.35 -0.92 0.00 0.00 0.00 179.25 179.07 3dk8 h TYR 106 N 0.85 0.73 -0.53 0.00 3.20 -0.86 -0.60 116.97 119.76 3dk8 h TYR 106 Ca 0.20 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.11 3dk8 h TYR 106 Cb 0.25 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 3dk8 h TYR 106 CO 0.01 0.49 0.27 0.28 -1.64 0.00 0.00 178.16 177.58 3dk8 h VAL 107 N 0.76 0.97 -0.89 1.81 2.07 -1.04 -0.98 116.25 118.93 3dk8 h VAL 107 Ca 0.20 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 3dk8 h VAL 107 Cb -0.03 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 3dk8 h VAL 107 CO -0.04 0.10 0.55 0.28 0.02 0.00 0.00 177.57 178.48 3dk8 h SER 108 N 0.53 1.06 -0.85 0.57 0.02 -0.75 0.05 113.55 114.18 3dk8 h SER 108 Ca 0.23 -0.06 0.02 0.00 -0.84 0.00 0.00 61.79 61.14 3dk8 h SER 108 Cb 0.13 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.35 3dk8 h SER 108 CO -0.15 0.80 0.55 0.03 -1.14 0.00 0.00 176.83 176.93 3dk8 h ARG 109 N 1.22 1.07 -0.48 3.45 3.08 -0.35 -2.24 114.38 120.14 3dk8 h ARG 109 Ca 0.32 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 60.20 3dk8 h ARG 109 Cb -0.07 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.72 3dk8 h ARG 109 CO -0.06 0.71 -0.15 -0.07 -1.07 0.00 0.00 179.97 179.33 3dk8 h LEU 110 N 1.10 0.91 -0.75 3.04 3.38 -0.61 -1.56 115.31 120.82 3dk8 h LEU 110 Ca 0.33 -0.30 0.06 0.00 0.09 0.00 0.00 57.88 58.05 3dk8 h LEU 110 Cb -0.06 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.39 3dk8 h LEU 110 CO -0.09 1.05 0.45 0.78 0.09 0.00 0.00 178.44 180.71 3dk8 h ASN 111 N 0.80 0.69 -0.60 -0.43 -0.26 -0.69 -0.82 115.58 114.27 3dk8 h ASN 111 Ca 0.12 0.02 -0.10 0.00 -0.56 0.00 0.00 56.30 55.78 3dk8 h ASN 111 Cb 0.68 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.80 3dk8 h ASN 111 CO 0.05 0.44 -0.03 0.00 -1.06 0.00 0.00 177.43 176.83 3dk8 h ALA 112 N 1.37 0.81 -0.19 -0.83 0.00 -1.11 -2.05 119.26 117.25 3dk8 h ALA 112 Ca 0.33 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3dk8 h ALA 112 Cb 0.17 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3dk8 h ALA 112 CO -0.17 0.68 0.08 0.82 0.00 0.00 0.00 179.25 180.65 3dk8 h ILE 113 N 0.97 1.16 -0.14 0.00 2.04 -0.83 -1.81 117.51 118.90 3dk8 h ILE 113 Ca 0.17 -0.47 -0.12 0.00 1.00 0.00 0.00 64.86 65.44 3dk8 h ILE 113 Cb 0.60 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 3dk8 h ILE 113 CO 0.04 0.15 -0.42 1.88 0.00 0.00 0.00 178.15 179.80 3dk8 h TYR 114 N 0.17 0.38 -0.40 1.37 -1.99 -1.09 0.60 116.97 116.01 3dk8 h TYR 114 Ca 0.07 -0.11 0.03 0.00 2.00 0.00 0.00 58.73 60.72 3dk8 h TYR 114 Cb 0.16 -0.08 -0.04 0.00 2.00 0.00 0.00 36.73 38.77 3dk8 h TYR 114 CO -0.01 0.70 0.19 0.37 -0.00 0.00 0.00 178.16 179.40 3dk8 h GLN 115 N 0.27 0.38 -0.48 4.88 4.15 -1.29 -2.38 115.11 120.64 3dk8 h GLN 115 Ca 0.02 -0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 3dk8 h GLN 115 Cb 0.86 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.44 3dk8 h GLN 115 CO 0.07 0.25 0.03 -0.97 -1.93 0.00 0.00 178.83 176.28 3dk8 h ASN 116 N 0.39 0.75 -0.91 -0.69 -0.00 -0.84 -1.57 115.58 112.72 3dk8 h ASN 116 Ca 0.17 -0.17 0.02 0.00 -0.00 0.00 0.00 56.30 56.32 3dk8 h ASN 116 Cb 0.10 -0.20 -0.05 0.00 -0.00 0.00 0.00 38.32 38.17 3dk8 h ASN 116 CO -0.13 0.80 0.60 0.78 -0.00 0.00 0.00 177.43 179.48 3dk8 h ASN 117 N 0.74 1.02 -0.08 1.15 -0.26 -0.60 0.54 115.58 118.09 3dk8 h ASN 117 Ca 0.15 -0.02 -0.03 0.00 -0.56 0.00 0.00 56.30 55.84 3dk8 h ASN 117 Cb 0.41 -0.25 -0.00 0.00 -1.06 0.00 0.00 38.32 37.42 3dk8 h ASN 117 CO 0.01 0.73 -0.06 -0.07 -1.06 0.00 0.00 177.43 176.98 3dk8 h LEU 118 N 1.20 0.19 -0.53 1.61 3.38 -1.01 -2.84 115.31 117.31 3dk8 h LEU 118 Ca 0.34 -0.46 0.03 0.00 0.09 0.00 0.00 57.88 57.88 3dk8 h LEU 118 Cb -0.09 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 3dk8 h LEU 118 CO -0.08 0.61 0.30 0.74 0.09 0.00 0.00 178.44 180.10 3dk8 h THR 119 N -0.23 1.02 0.00 0.22 2.02 -0.97 -1.29 112.91 113.69 3dk8 h THR 119 Ca 0.01 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 66.95 3dk8 h THR 119 Cb 0.55 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 3dk8 h THR 119 CO 0.02 0.11 -0.18 0.11 0.37 0.00 0.00 175.52 175.94 3dk8 h LYS 120 N 0.59 0.00 -0.02 6.66 1.57 -0.96 -1.12 116.57 123.30 3dk8 h LYS 120 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 3dk8 h LYS 120 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 3dk8 h LYS 120 CO -0.12 0.18 0.00 0.43 -0.57 0.00 0.00 179.45 179.37 3dk8 n SER 121 N -3.76 1.28 -3.06 0.86 7.64 -0.79 -4.94 113.62 110.85 3dk8 n SER 121 Ca -0.02 -1.43 -0.21 0.00 1.01 0.00 0.00 58.87 58.22 3dk8 n SER 121 Cb 0.29 -0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.54 3dk8 n SER 121 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3dk8 n HIS 122 N 0.00 -2.22 -3.46 1.43 8.25 -0.42 -4.95 115.22 113.85 3dk8 n HIS 122 Ca 0.20 0.69 -0.38 0.00 -0.26 0.00 0.00 57.72 57.97 3dk8 n HIS 122 Cb 0.32 -4.49 -0.08 0.00 1.12 0.00 0.00 29.99 26.85 3dk8 n HIS 122 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3dk8 s ILE 123 N -3.21 5.23 0.30 1.59 1.01 -0.56 -4.71 121.20 120.86 3dk8 s ILE 123 Ca 0.40 0.53 -0.29 0.00 0.00 0.00 0.00 60.65 61.29 3dk8 s ILE 123 Cb -0.18 -3.66 -0.10 0.00 0.01 0.00 0.00 42.46 38.53 3dk8 s ILE 123 CO 0.50 0.25 1.26 -0.70 0.00 0.00 0.00 174.94 176.24 3dk8 s GLU 124 N 1.48 4.42 -0.24 2.79 2.12 -0.90 -4.33 118.70 124.04 3dk8 s GLU 124 Ca 0.15 2.11 -0.07 0.00 0.36 0.00 0.00 54.97 57.51 3dk8 s GLU 124 Cb -0.15 -3.11 -0.03 0.00 0.26 0.00 0.00 34.13 31.10 3dk8 s GLU 124 CO 0.08 -0.11 0.07 0.42 -0.54 0.00 0.00 175.26 175.18 3dk8 s ILE 125 N -1.00 4.37 -0.33 -3.70 1.01 -1.26 -0.97 121.20 119.32 3dk8 s ILE 125 Ca 0.49 -0.15 -0.09 0.00 0.00 0.00 0.00 60.65 60.89 3dk8 s ILE 125 Cb -0.38 -3.04 0.01 0.00 0.01 0.00 0.00 42.46 39.07 3dk8 s ILE 125 CO 0.49 0.35 0.15 -0.63 0.00 0.00 0.00 174.94 175.30 3dk8 s ILE 126 N 1.47 4.40 -0.27 2.92 1.01 0.14 -4.98 121.20 125.88 3dk8 s ILE 126 Ca 0.06 -0.70 -0.20 0.00 0.00 0.00 0.00 60.65 59.81 3dk8 s ILE 126 Cb -0.15 -3.35 -0.02 0.00 0.01 0.00 0.00 42.46 38.96 3dk8 s ILE 126 CO 0.04 -0.06 0.60 -0.13 0.00 0.00 0.00 174.94 175.38 3dk8 s ARG 127 N 1.55 4.04 0.00 2.79 1.81 -1.26 -1.34 118.95 126.54 3dk8 s ARG 127 Ca 0.03 0.43 0.00 0.00 -1.72 0.00 0.00 55.73 54.46 3dk8 s ARG 127 Cb -0.18 -3.67 0.00 0.00 -0.45 0.00 0.00 34.95 30.65 3dk8 s ARG 127 CO 0.05 -0.44 0.00 0.41 -0.68 0.00 0.00 175.30 174.64 3dk8 n GLY 128 N 4.29 -0.46 3.61 -3.53 0.00 -0.75 -4.90 105.19 103.45 3dk8 n GLY 128 Ca -0.02 -1.69 -0.40 0.00 0.00 0.00 0.00 46.02 43.92 3dk8 n GLY 128 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3dk8 s HIS 129 N -1.59 3.25 0.18 1.61 2.46 -1.26 -2.56 115.29 117.38 3dk8 s HIS 129 Ca 0.00 0.48 -0.22 0.00 0.47 0.00 0.00 55.06 55.79 3dk8 s HIS 129 Cb 0.00 -2.64 -0.08 0.00 -0.13 0.00 0.00 32.58 29.73 3dk8 s HIS 129 CO 0.00 -0.26 0.73 0.00 -2.47 0.00 0.00 174.74 172.74 3dk8 s ALA 130 N 2.17 3.45 0.02 1.58 0.00 -1.26 -4.37 121.76 123.36 3dk8 s ALA 130 Ca 0.17 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.38 3dk8 s ALA 130 Cb -0.16 -2.86 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 3dk8 s ALA 130 CO 0.10 0.32 -0.04 0.00 0.00 0.00 0.00 175.76 176.14 3dk8 s ALA 131 N -1.31 0.19 0.58 0.00 0.00 -0.91 -4.69 121.76 115.62 3dk8 s ALA 131 Ca 0.38 -0.60 -0.18 0.00 0.00 0.00 0.00 51.96 51.56 3dk8 s ALA 131 Cb -0.20 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 3dk8 s ALA 131 CO 0.23 -0.13 1.10 -0.06 0.00 0.00 0.00 175.76 176.90 3dk8 s PHE 132 N -1.41 2.73 0.51 0.00 0.40 -0.26 -0.90 117.98 119.05 3dk8 s PHE 132 Ca -0.15 1.55 0.08 0.00 -0.60 0.00 0.00 56.93 57.81 3dk8 s PHE 132 Cb -0.10 -3.19 0.04 0.00 0.51 0.00 0.00 43.02 40.28 3dk8 s PHE 132 CO -0.01 -1.47 0.56 0.95 0.70 0.00 0.00 175.22 175.95 3dk8 s THR 133 N -2.07 2.24 -2.14 0.64 -4.23 -0.40 -4.76 115.64 104.91 3dk8 s THR 133 Ca 0.69 -1.22 0.17 0.00 -1.18 0.00 0.00 61.69 60.16 3dk8 s THR 133 Cb -0.21 -2.46 0.43 0.00 1.34 0.00 0.00 72.50 71.60 3dk8 s THR 133 CO 0.32 0.00 1.53 -1.20 -0.54 0.00 0.00 174.62 174.73 3dk8 n SER 134 N -1.89 1.04 -4.68 3.99 7.64 -1.26 -4.63 113.62 113.82 3dk8 n SER 134 Ca 0.07 -1.67 -0.45 0.00 1.01 0.00 0.00 58.87 57.83 3dk8 n SER 134 Cb 0.62 -0.08 -0.04 0.00 -1.01 0.00 0.00 64.21 63.70 3dk8 n SER 134 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3dk8 n ASP 135 N -0.07 3.55 -0.29 6.43 10.43 -1.26 -4.86 116.55 130.48 3dk8 n ASP 135 Ca 0.14 1.04 0.08 0.00 2.57 0.00 0.00 54.79 58.61 3dk8 n ASP 135 Cb 0.22 -1.47 0.30 0.00 1.84 0.00 0.00 41.12 42.01 3dk8 n ASP 135 CO 0.00 0.00 0.00 -0.65 -1.07 0.00 0.00 177.20 175.48 3dk8 h PRO 136 N 7.31 0.85 -6.18 -0.24 0.11 -1.95 -3.35 132.00 128.55 3dk8 h PRO 136 Ca -0.46 -0.05 -0.57 0.00 0.11 0.00 0.00 66.00 65.04 3dk8 h PRO 136 Cb 1.24 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 32.12 3dk8 h PRO 136 CO 0.92 0.56 0.93 0.21 -0.21 0.00 0.00 178.00 180.41 3dk8 s LYS 137 N -5.81 4.17 0.06 1.05 2.20 -1.26 -4.95 119.74 115.20 3dk8 s LYS 137 Ca -0.11 1.62 -0.35 0.00 -0.36 0.00 0.00 55.97 56.77 3dk8 s LYS 137 Cb 0.21 -3.80 -0.14 0.00 -1.51 0.00 0.00 37.83 32.60 3dk8 s LYS 137 CO 0.79 -0.79 1.64 -2.30 -0.36 0.00 0.00 175.35 174.34 3dk8 n PRO 138 N 6.76 1.98 -3.80 4.03 -0.02 -1.26 -4.95 135.00 137.74 3dk8 n PRO 138 Ca 0.14 0.72 -0.12 0.00 -2.02 0.00 0.00 63.50 62.22 3dk8 n PRO 138 Cb 0.45 -2.49 -0.10 0.00 -0.02 0.00 0.00 33.50 31.34 3dk8 n PRO 138 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3dk8 s THR 139 N 1.88 0.03 0.25 3.45 2.01 -1.26 -4.16 115.64 117.84 3dk8 s THR 139 Ca 0.84 -0.29 0.11 0.00 0.31 0.00 0.00 61.69 62.67 3dk8 s THR 139 Cb -0.74 -0.44 -0.05 0.00 0.01 0.00 0.00 72.50 71.29 3dk8 s THR 139 CO 0.44 -0.16 -0.18 0.27 -0.69 0.00 0.00 174.62 174.31 3dk8 s ILE 140 N -0.60 2.63 -0.05 1.82 -4.36 -0.29 -1.28 121.20 119.07 3dk8 s ILE 140 Ca -0.07 -2.18 0.06 0.00 -0.26 0.00 0.00 60.65 58.20 3dk8 s ILE 140 Cb -0.04 -2.35 -0.01 0.00 1.25 0.00 0.00 42.46 41.31 3dk8 s ILE 140 CO 0.02 -0.30 -0.22 -0.70 0.24 0.00 0.00 174.94 173.98 3dk8 s GLU 141 N -3.25 2.16 -0.10 0.37 2.12 -0.08 -1.01 118.70 118.91 3dk8 s GLU 141 Ca 0.27 -0.79 -0.02 0.00 0.36 0.00 0.00 54.97 54.80 3dk8 s GLU 141 Cb -0.06 -1.89 0.04 0.00 0.26 0.00 0.00 34.13 32.47 3dk8 s GLU 141 CO 0.14 0.36 0.01 0.08 -0.54 0.00 0.00 175.26 175.30 3dk8 s VAL 142 N -0.17 0.45 -1.55 3.70 1.01 -0.16 -2.14 120.40 121.54 3dk8 s VAL 142 Ca -0.01 -0.07 -0.14 0.00 0.00 0.00 0.00 61.98 61.76 3dk8 s VAL 142 Cb -0.12 -0.69 0.09 0.00 0.00 0.00 0.00 36.38 35.67 3dk8 s VAL 142 CO 0.02 0.15 0.95 -1.20 0.00 0.00 0.00 175.10 175.02 3dk8 n SER 143 N 5.11 -4.46 0.00 3.32 7.64 -1.26 -1.36 113.62 122.61 3dk8 n SER 143 Ca -0.08 -0.82 0.00 0.00 1.01 0.00 0.00 58.87 58.98 3dk8 n SER 143 Cb 0.49 -3.71 0.00 0.00 -1.01 0.00 0.00 64.21 59.98 3dk8 n SER 143 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dk8 n GLY 144 N -1.65 0.81 3.58 0.23 0.00 -1.26 -5.02 105.19 101.88 3dk8 n GLY 144 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3dk8 n GLY 144 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dk8 s LYS 145 N -0.02 2.64 -0.00 1.61 2.20 -0.47 -5.10 119.74 120.61 3dk8 s LYS 145 Ca 0.00 -0.64 0.01 0.00 -0.36 0.00 0.00 55.97 54.98 3dk8 s LYS 145 Cb 0.00 -2.54 -0.04 0.00 -1.51 0.00 0.00 37.83 33.75 3dk8 s LYS 145 CO 0.00 0.63 0.02 0.15 -0.36 0.00 0.00 175.35 175.79 3dk8 s LYS 146 N -1.08 2.85 0.01 4.03 1.02 -1.26 -0.98 119.74 124.32 3dk8 s LYS 146 Ca 0.14 -0.58 0.01 0.00 0.02 0.00 0.00 55.97 55.57 3dk8 s LYS 146 Cb -0.11 -2.71 -0.01 0.00 -0.52 0.00 0.00 37.83 34.48 3dk8 s LYS 146 CO 0.04 0.63 -0.04 0.71 -0.92 0.00 0.00 175.35 175.77 3dk8 s TYR 147 N -1.10 0.39 0.06 3.18 2.02 -0.18 -2.15 117.35 119.56 3dk8 s TYR 147 Ca 0.20 -0.19 -0.01 0.00 -0.37 0.00 0.00 57.07 56.70 3dk8 s TYR 147 Cb -0.12 -0.24 -0.04 0.00 -0.40 0.00 0.00 41.96 41.16 3dk8 s TYR 147 CO 0.11 -0.04 -0.03 -0.08 -1.57 0.00 0.00 175.55 173.94 3dk8 s THR 148 N -0.48 0.26 0.08 -0.71 -1.32 -0.11 -1.14 115.64 112.23 3dk8 s THR 148 Ca -0.03 -1.83 -0.26 0.00 -1.21 0.00 0.00 61.69 58.37 3dk8 s THR 148 Cb -0.04 -1.59 0.08 0.00 -1.51 0.00 0.00 72.50 69.44 3dk8 s THR 148 CO -0.00 -0.94 0.67 0.00 -2.21 0.00 0.00 174.62 172.14 3dk8 s ALA 149 N -3.90 -1.68 -0.84 11.08 0.00 -1.26 -1.41 121.76 123.75 3dk8 s ALA 149 Ca 0.09 0.77 0.21 0.00 0.00 0.00 0.00 51.96 53.02 3dk8 s ALA 149 Cb 0.08 0.59 0.84 0.00 0.00 0.00 0.00 23.12 24.63 3dk8 s ALA 149 CO -0.08 -0.66 1.64 -0.35 0.00 0.00 0.00 175.76 176.31 3dk8 n PRO 150 N -0.07 0.07 -3.76 0.00 -0.04 -1.26 -4.55 135.00 125.41 3dk8 n PRO 150 Ca -0.16 0.25 -0.24 0.00 -0.04 0.00 0.00 63.50 63.31 3dk8 n PRO 150 Cb 0.63 -1.62 -0.17 0.00 -0.04 0.00 0.00 33.50 32.29 3dk8 n PRO 150 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3dk8 s HIS 151 N -3.09 0.70 -0.12 0.54 3.76 -1.24 -4.47 115.29 111.36 3dk8 s HIS 151 Ca 0.08 -0.28 0.01 0.00 -0.15 0.00 0.00 55.06 54.72 3dk8 s HIS 151 Cb 0.11 -0.83 0.02 0.00 1.11 0.00 0.00 32.58 32.99 3dk8 s HIS 151 CO 0.38 -0.38 -0.14 0.42 -0.85 0.00 0.00 174.74 174.16 3dk8 s ILE 152 N 1.96 1.49 -0.22 0.60 1.01 -0.11 -1.75 121.20 124.19 3dk8 s ILE 152 Ca 0.04 -0.62 -0.08 0.00 0.00 0.00 0.00 60.65 59.99 3dk8 s ILE 152 Cb -0.13 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 3dk8 s ILE 152 CO -0.06 0.44 0.10 -0.22 0.00 0.00 0.00 174.94 175.20 3dk8 s LEU 153 N 1.19 3.79 -0.37 2.97 2.96 0.00 -1.16 118.68 128.05 3dk8 s LEU 153 Ca -0.02 -0.00 -0.19 0.00 -0.22 0.00 0.00 54.13 53.70 3dk8 s LEU 153 Cb -0.14 -2.00 0.00 0.00 0.50 0.00 0.00 46.19 44.56 3dk8 s LEU 153 CO -0.05 0.07 0.54 -0.63 -1.32 0.00 0.00 176.35 174.96 3dk8 s ILE 154 N 1.00 4.98 -0.36 6.68 1.01 0.18 -0.48 121.20 134.21 3dk8 s ILE 154 Ca 0.05 0.25 0.14 0.00 0.00 0.00 0.00 60.65 61.09 3dk8 s ILE 154 Cb -0.14 -4.02 0.41 0.00 0.01 0.00 0.00 42.46 38.71 3dk8 s ILE 154 CO 0.03 -0.31 0.88 0.00 0.00 0.00 0.00 174.94 175.54 3dk8 n ALA 155 N 5.85 3.06 1.36 9.38 0.00 0.21 -2.23 120.51 138.13 3dk8 n ALA 155 Ca -0.04 -3.41 0.13 0.00 0.00 0.00 0.00 53.44 50.12 3dk8 n ALA 155 Cb 0.48 -0.90 0.40 0.00 0.00 0.00 0.00 19.45 19.44 3dk8 n ALA 155 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3dk8 n THR 156 N 0.03 0.00 -4.66 0.00 -2.24 -1.21 -4.30 114.28 101.89 3dk8 n THR 156 Ca 0.19 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 3dk8 n THR 156 Cb 0.72 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.70 3dk8 n THR 156 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dk8 n GLY 157 N 1.23 0.35 0.00 3.38 0.00 -1.26 -4.55 105.19 104.34 3dk8 n GLY 157 Ca 0.17 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3dk8 n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dk8 n GLY 158 N 0.00 3.94 3.48 -0.02 0.00 -1.26 -0.81 105.19 110.51 3dk8 n GLY 158 Ca 0.00 -1.41 -0.10 0.00 0.00 0.00 0.00 46.02 44.51 3dk8 n GLY 158 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3dk8 s MET 159 N -0.90 1.32 0.47 1.61 0.23 0.25 -4.76 119.30 117.50 3dk8 s MET 159 Ca 0.00 -0.83 -0.23 0.00 -1.03 0.00 0.00 55.69 53.60 3dk8 s MET 159 Cb 0.00 0.51 -0.07 0.00 -1.53 0.00 0.00 34.83 33.74 3dk8 s MET 159 CO 0.00 -0.55 1.23 -2.14 -2.03 0.00 0.00 175.02 171.53 3dk8 s PRO 160 N -3.86 3.68 0.26 3.16 0.02 -1.26 -0.54 135.00 136.45 3dk8 s PRO 160 Ca 0.08 1.94 -0.28 0.00 0.02 0.00 0.00 61.00 62.76 3dk8 s PRO 160 Cb -0.00 -2.45 -0.09 0.00 0.02 0.00 0.00 34.50 31.98 3dk8 s PRO 160 CO -0.05 -0.66 0.92 0.45 -0.33 0.00 0.00 177.00 177.33 3dk8 s SER 161 N -1.16 7.51 0.03 2.53 0.15 -0.14 -4.68 113.70 117.94 3dk8 s SER 161 Ca 0.64 1.87 0.06 0.00 0.70 0.00 0.00 55.95 59.22 3dk8 s SER 161 Cb -0.33 -2.58 -0.02 0.00 -1.71 0.00 0.00 66.02 61.38 3dk8 s SER 161 CO 0.40 0.09 -0.17 -0.89 1.20 0.00 0.00 173.24 173.87 3dk8 s THR 162 N -1.33 1.36 0.61 6.45 2.01 -1.26 -4.62 115.64 118.87 3dk8 s THR 162 Ca 0.44 -1.02 -0.19 0.00 0.31 0.00 0.00 61.69 61.22 3dk8 s THR 162 Cb -0.23 -1.19 -0.02 0.00 0.01 0.00 0.00 72.50 71.06 3dk8 s THR 162 CO 0.28 0.15 1.31 -2.84 -0.69 0.00 0.00 174.62 172.83 3dk8 s PRO 163 N -1.02 2.76 0.41 4.92 0.02 -1.26 -4.99 135.00 135.84 3dk8 s PRO 163 Ca 0.05 2.10 -0.23 0.00 0.02 0.00 0.00 61.00 62.94 3dk8 s PRO 163 Cb -0.08 -1.97 -0.10 0.00 0.02 0.00 0.00 34.50 32.37 3dk8 s PRO 163 CO 0.01 -1.44 0.99 -1.01 -0.33 0.00 0.00 177.00 175.22 3dk8 s HIS 164 N -1.38 3.32 0.44 6.54 3.76 -1.26 -4.74 115.29 121.97 3dk8 s HIS 164 Ca 0.79 1.65 0.10 0.00 -0.15 0.00 0.00 55.06 57.45 3dk8 s HIS 164 Cb -0.38 -2.99 0.99 0.00 1.11 0.00 0.00 32.58 31.32 3dk8 s HIS 164 CO 0.41 -0.33 2.07 1.49 -0.85 0.00 0.00 174.74 177.54 3dk8 h GLU 165 N 2.28 0.38 0.00 1.40 4.57 -1.95 -0.57 114.58 120.70 3dk8 h GLU 165 Ca -0.48 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 57.65 3dk8 h GLU 165 Cb 1.20 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.70 3dk8 h GLU 165 CO 0.62 0.25 -0.11 0.66 -1.18 0.00 0.00 179.01 179.25 3dk8 h SER 166 N 0.39 0.00 0.05 1.04 4.64 -2.00 -2.81 113.55 114.87 3dk8 h SER 166 Ca 0.13 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.15 3dk8 h SER 166 Cb 0.05 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.11 3dk8 h SER 166 CO -0.03 0.11 -1.68 1.67 -0.87 0.00 0.00 176.83 176.03 3dk8 n GLN 167 N -3.70 0.64 -3.64 4.77 7.27 -0.36 -4.81 117.38 117.56 3dk8 n GLN 167 Ca -0.02 0.42 -0.29 0.00 0.07 0.00 0.00 57.00 57.18 3dk8 n GLN 167 Cb 0.22 -1.71 -0.13 0.00 2.41 0.00 0.00 30.24 31.04 3dk8 n GLN 167 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 3dk8 s ILE 168 N -2.45 0.99 0.30 1.69 1.01 -0.39 -4.95 121.20 117.40 3dk8 s ILE 168 Ca -0.27 -2.23 -0.30 0.00 0.00 0.00 0.00 60.65 57.85 3dk8 s ILE 168 Cb 0.07 -1.70 -0.11 0.00 0.01 0.00 0.00 42.46 40.72 3dk8 s ILE 168 CO 0.65 -0.91 1.59 -2.16 0.00 0.00 0.00 174.94 174.11 3dk8 s PRO 169 N 0.65 4.11 0.00 2.79 0.04 -1.06 -1.71 135.00 139.82 3dk8 s PRO 169 Ca 0.17 2.59 0.00 0.00 0.04 0.00 0.00 61.00 63.80 3dk8 s PRO 169 Cb -0.24 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.29 3dk8 s PRO 169 CO -0.01 -0.63 0.00 0.41 0.04 0.00 0.00 177.00 176.81 3dk8 n GLY 170 N 1.99 0.79 0.31 0.56 0.00 -1.26 -1.01 105.19 106.58 3dk8 n GLY 170 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 3dk8 n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk8 h ALA 171 N 0.00 2.17 0.00 4.61 0.00 -1.61 -0.47 119.26 123.96 3dk8 h ALA 171 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dk8 h ALA 171 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3dk8 h ALA 171 CO 0.00 -0.26 0.00 -1.13 0.00 0.00 0.00 179.25 177.86 3dk8 n SER 172 N -4.44 0.18 0.19 0.00 3.41 -1.26 -1.52 113.62 110.17 3dk8 n SER 172 Ca 0.02 0.56 0.14 0.00 -0.26 0.00 0.00 58.87 59.33 3dk8 n SER 172 Cb 0.29 -0.59 0.45 0.00 -0.26 0.00 0.00 64.21 64.11 3dk8 n SER 172 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3dk8 h LEU 173 N 0.00 0.00-10.61 1.04 3.38 -1.47 -3.44 115.31 104.21 3dk8 h LEU 173 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 3dk8 h LEU 173 Cb 0.15 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.00 3dk8 h LEU 173 CO 0.00 0.00 0.41 -0.83 0.09 0.00 0.00 178.44 178.11 3dk8 s GLY 174 N -3.88 1.59 0.46 0.83 0.00 -0.58 -4.80 107.32 100.94 3dk8 s GLY 174 Ca 0.05 -0.62 0.05 0.00 0.00 0.00 0.00 44.72 44.20 3dk8 s GLY 174 CO 0.54 -0.14 0.05 -0.26 0.00 0.00 0.00 173.10 173.30 3dk8 s ILE 175 N -3.55 1.69 0.22 0.90 -4.36 0.24 -4.98 121.20 111.36 3dk8 s ILE 175 Ca 0.62 -1.93 0.01 0.00 -0.26 0.00 0.00 60.65 59.08 3dk8 s ILE 175 Cb -0.11 -2.62 -0.00 0.00 1.25 0.00 0.00 42.46 40.97 3dk8 s ILE 175 CO 0.49 0.00 0.02 0.35 0.24 0.00 0.00 174.94 176.04 3dk8 n THR 176 N -1.16 0.00 -0.03 8.37 -2.24 -1.26 -0.47 114.28 117.48 3dk8 n THR 176 Ca -0.10 -1.11 0.17 0.00 -2.27 0.00 0.00 64.05 60.74 3dk8 n THR 176 Cb 0.67 0.27 0.61 0.00 -2.10 0.00 0.00 70.33 69.78 3dk8 n THR 176 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3dk8 h SER 177 N 0.61 0.15 -0.21 3.42 4.64 -1.97 -0.58 113.55 119.60 3dk8 h SER 177 Ca -0.18 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3dk8 h SER 177 Cb 0.58 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 3dk8 h SER 177 CO 0.30 0.08 0.14 0.44 -0.87 0.00 0.00 176.83 176.92 3dk8 h ASP 178 N 0.16 0.25 0.33 4.97 3.32 -1.95 -2.44 116.42 121.05 3dk8 h ASP 178 Ca 0.26 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.23 3dk8 h ASP 178 Cb 0.83 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 3dk8 h ASP 178 CO -0.04 0.21 -0.27 1.23 -1.72 0.00 0.00 179.24 178.65 3dk8 h GLY 179 N 0.28 0.00 0.47 2.75 0.00 -1.54 -2.60 103.07 102.42 3dk8 h GLY 179 Ca 0.08 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.51 3dk8 h GLY 179 CO -0.02 0.00 0.41 -2.75 0.00 0.00 0.00 176.54 174.19 3dk8 h PHE 180 N 0.00 0.74 0.00 5.60 3.04 -0.72 -0.98 116.94 124.62 3dk8 h PHE 180 Ca -0.00 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.98 3dk8 h PHE 180 Cb 0.51 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 38.80 3dk8 h PHE 180 CO 0.00 0.27 0.00 1.19 -2.02 0.00 0.00 178.31 177.75 3dk8 n PHE 181 N -4.81 0.00 0.69 0.41 3.72 -0.99 -2.28 117.46 114.19 3dk8 n PHE 181 Ca 0.13 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.63 3dk8 n PHE 181 Cb 0.29 -0.10 -0.13 0.00 -0.94 0.00 0.00 39.48 38.60 3dk8 n PHE 181 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3dk8 n GLN 182 N -1.10 0.34 -1.67 -1.08 1.13 -0.43 -5.00 117.38 109.58 3dk8 n GLN 182 Ca 0.19 -0.06 -0.45 0.00 -1.94 0.00 0.00 57.00 54.75 3dk8 n GLN 182 Cb 0.15 -1.48 -0.03 0.00 0.11 0.00 0.00 30.24 28.99 3dk8 n GLN 182 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3dk8 n LEU 183 N -1.70 3.12 -0.21 1.08 4.77 -0.88 -4.90 117.00 118.28 3dk8 n LEU 183 Ca 0.02 1.13 0.08 0.00 -0.03 0.00 0.00 56.01 57.21 3dk8 n LEU 183 Cb 0.39 -1.43 -0.04 0.00 -2.33 0.00 0.00 43.42 40.01 3dk8 n LEU 183 CO 0.42 -0.45 0.14 -0.62 -1.33 0.00 0.00 177.39 175.55 3dk8 n GLU 184 N 2.22 1.79 -3.92 3.23 1.02 -1.26 -4.98 120.64 118.74 3dk8 n GLU 184 Ca 0.12 -0.47 -0.09 0.00 -0.02 0.00 0.00 57.16 56.70 3dk8 n GLU 184 Cb 0.31 -1.25 -0.09 0.00 -0.02 0.00 0.00 31.44 30.39 3dk8 n GLU 184 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3dk8 s GLU 185 N -2.13 0.69 -0.03 3.49 0.41 -1.26 -4.25 118.70 115.61 3dk8 s GLU 185 Ca 0.10 -0.87 -0.30 0.00 -0.41 0.00 0.00 54.97 53.49 3dk8 s GLU 185 Cb 0.12 0.27 -0.05 0.00 -1.78 0.00 0.00 34.13 32.69 3dk8 s GLU 185 CO 0.50 -0.19 1.52 -1.17 -0.49 0.00 0.00 175.26 175.43 3dk8 s LEU 186 N -2.47 4.31 0.36 1.80 2.96 -1.26 -4.99 118.68 119.39 3dk8 s LEU 186 Ca -0.00 2.16 -0.28 0.00 -0.22 0.00 0.00 54.13 55.79 3dk8 s LEU 186 Cb 0.02 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 43.06 3dk8 s LEU 186 CO -0.07 -0.83 1.35 -2.84 -1.32 0.00 0.00 176.35 172.64 3dk8 s PRO 187 N 3.18 4.19 0.18 0.98 0.02 -1.26 -4.92 135.00 137.38 3dk8 s PRO 187 Ca 0.68 2.30 -0.06 0.00 0.02 0.00 0.00 61.00 63.93 3dk8 s PRO 187 Cb -0.32 -2.97 0.08 0.00 0.02 0.00 0.00 34.50 31.31 3dk8 s PRO 187 CO 0.27 -0.35 1.53 0.78 -0.33 0.00 0.00 177.00 178.89 3dk8 h GLY 188 N 3.11 0.81 -6.88 0.52 0.00 -1.94 -3.40 103.07 95.30 3dk8 h GLY 188 Ca -0.50 -0.83 -0.47 0.00 0.00 0.00 0.00 47.33 45.53 3dk8 h GLY 188 CO 0.64 0.75 -0.78 -1.60 0.00 0.00 0.00 176.54 175.55 3dk8 s ARG 189 N -4.29 0.93 -0.02 4.80 6.06 -1.26 -1.16 118.95 124.02 3dk8 s ARG 189 Ca -0.09 -0.02 0.07 0.00 -2.50 0.00 0.00 55.73 53.19 3dk8 s ARG 189 Cb 0.12 -1.18 -0.02 0.00 0.06 0.00 0.00 34.95 33.93 3dk8 s ARG 189 CO 0.85 -0.28 -0.23 -1.12 -2.50 0.00 0.00 175.30 172.01 3dk8 s SER 190 N 1.85 2.75 -0.17 -2.12 0.01 -0.20 -0.74 113.70 115.08 3dk8 s SER 190 Ca 0.05 -0.43 0.00 0.00 1.31 0.00 0.00 55.95 56.88 3dk8 s SER 190 Cb -0.12 -0.30 0.03 0.00 0.21 0.00 0.00 66.02 65.84 3dk8 s SER 190 CO -0.06 0.29 -0.10 -0.69 0.41 0.00 0.00 173.24 173.08 3dk8 s VAL 191 N -0.56 1.44 -0.19 3.43 1.01 0.05 -1.07 120.40 124.51 3dk8 s VAL 191 Ca 0.09 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.26 3dk8 s VAL 191 Cb -0.09 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 3dk8 s VAL 191 CO -0.01 0.28 0.07 -0.63 0.00 0.00 0.00 175.10 174.81 3dk8 s ILE 192 N 1.51 4.80 -0.25 2.22 1.09 -0.05 -0.98 121.20 129.54 3dk8 s ILE 192 Ca 0.02 -0.03 -0.07 0.00 -1.10 0.00 0.00 60.65 59.47 3dk8 s ILE 192 Cb -0.15 -3.18 -0.03 0.00 -1.06 0.00 0.00 42.46 38.05 3dk8 s ILE 192 CO -0.09 0.44 0.06 -0.69 -0.10 0.00 0.00 174.94 174.56 3dk8 s VAL 193 N 0.55 4.23 0.00 2.92 1.01 0.19 -0.37 120.40 128.93 3dk8 s VAL 193 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.81 3dk8 s VAL 193 Cb -0.13 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.28 3dk8 s VAL 193 CO 0.01 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.06 3dk8 n GLY 194 N 4.91 3.70 0.00 4.51 0.00 -0.65 -0.40 105.19 117.28 3dk8 n GLY 194 Ca -0.16 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.27 3dk8 n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk8 n ALA 195 N -1.95 1.14 -2.37 4.61 0.00 -1.26 -4.58 120.51 116.10 3dk8 n ALA 195 Ca 0.00 -0.50 -0.11 0.00 0.00 0.00 0.00 53.44 52.83 3dk8 n ALA 195 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 3dk8 n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dk8 n GLY 196 N -0.11 0.59 0.31 0.00 0.00 -1.26 -0.81 105.19 103.91 3dk8 n GLY 196 Ca 0.00 -1.98 -0.02 0.00 0.00 0.00 0.00 46.02 44.02 3dk8 n GLY 196 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3dk8 h TYR 197 N -0.55 0.87 -0.44 1.61 -0.00 -1.98 -1.50 116.97 114.98 3dk8 h TYR 197 Ca -0.17 -0.07 -0.04 0.00 0.00 0.00 0.00 58.73 58.46 3dk8 h TYR 197 Cb 0.61 -0.26 -0.02 0.00 0.00 0.00 0.00 36.73 37.06 3dk8 h TYR 197 CO 0.00 0.70 0.12 0.82 -0.00 0.00 0.00 178.16 179.80 3dk8 h ILE 198 N 0.83 1.23 -0.51 -0.90 2.04 -1.95 -0.37 117.51 117.88 3dk8 h ILE 198 Ca 0.19 -0.79 0.02 0.00 1.00 0.00 0.00 64.86 65.28 3dk8 h ILE 198 Cb 0.24 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 3dk8 h ILE 198 CO -0.01 0.28 0.32 0.00 0.00 0.00 0.00 178.15 178.74 3dk8 h ALA 199 N 0.97 0.66 -0.33 1.87 0.00 -1.69 -0.58 119.26 120.16 3dk8 h ALA 199 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3dk8 h ALA 199 Cb 0.30 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3dk8 h ALA 199 CO -0.00 0.04 0.21 0.28 0.00 0.00 0.00 179.25 179.78 3dk8 h VAL 200 N 0.64 1.10 -0.34 0.00 2.07 -1.06 -1.09 116.25 117.56 3dk8 h VAL 200 Ca 0.20 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 3dk8 h VAL 200 Cb -0.02 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 3dk8 h VAL 200 CO -0.07 0.10 0.02 -0.33 0.02 0.00 0.00 177.57 177.31 3dk8 h GLU 201 N 0.44 0.59 -0.46 1.57 5.08 -0.80 -1.55 114.58 119.45 3dk8 h GLU 201 Ca 0.12 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 3dk8 h GLU 201 Cb -0.02 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 3dk8 h GLU 201 CO -0.02 0.69 0.04 0.52 -1.00 0.00 0.00 179.01 179.24 3dk8 h MET 202 N 0.41 0.79 -0.72 2.33 2.86 -1.00 -1.48 114.93 118.12 3dk8 h MET 202 Ca 0.10 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 3dk8 h MET 202 Cb 0.41 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 3dk8 h MET 202 CO 0.01 0.82 0.43 0.00 1.06 0.00 0.00 176.91 179.23 3dk8 h ALA 203 N 0.94 0.92 -0.58 6.32 0.00 -1.13 -1.07 119.26 124.65 3dk8 h ALA 203 Ca 0.14 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3dk8 h ALA 203 Cb 0.44 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3dk8 h ALA 203 CO 0.02 0.39 0.00 0.78 0.00 0.00 0.00 179.25 180.44 3dk8 h GLY 204 N 0.98 1.09 0.71 0.00 0.00 -1.10 -0.83 103.07 103.92 3dk8 h GLY 204 Ca 0.26 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 3dk8 h GLY 204 CO -0.05 0.72 -0.00 -2.22 0.00 0.00 0.00 176.54 174.99 3dk8 h ILE 205 N 0.93 1.25 -0.84 2.60 2.04 -1.08 -1.48 117.51 120.93 3dk8 h ILE 205 Ca 0.17 -0.77 -0.03 0.00 1.00 0.00 0.00 64.86 65.22 3dk8 h ILE 205 Cb 0.53 1.69 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 3dk8 h ILE 205 CO 0.03 0.21 0.39 -0.07 0.00 0.00 0.00 178.15 178.71 3dk8 h LEU 206 N -0.22 1.11 -0.29 1.44 3.38 -1.11 -1.89 115.31 117.72 3dk8 h LEU 206 Ca 0.01 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 3dk8 h LEU 206 Cb 0.33 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3dk8 h LEU 206 CO 0.00 0.94 -0.13 -1.28 0.09 0.00 0.00 178.44 178.07 3dk8 h SER 207 N 1.20 0.61 -0.72 -0.43 0.87 -1.16 -0.54 113.55 113.39 3dk8 h SER 207 Ca 0.29 -0.40 0.05 0.00 -1.23 0.00 0.00 61.79 60.50 3dk8 h SER 207 Cb 0.14 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.89 3dk8 h SER 207 CO -0.03 0.88 0.47 0.00 -0.53 0.00 0.00 176.83 177.61 3dk8 h ALA 208 N 0.76 1.66 -0.01 6.23 0.00 -1.03 -2.01 119.26 124.85 3dk8 h ALA 208 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3dk8 h ALA 208 Cb 0.64 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3dk8 h ALA 208 CO 0.04 0.25 -0.02 1.28 0.00 0.00 0.00 179.25 180.80 3dk8 n LEU 209 N -4.47 0.76 0.00 0.00 4.77 -0.73 -4.80 117.00 112.53 3dk8 n LEU 209 Ca 0.10 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 3dk8 n LEU 209 Cb 0.18 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 3dk8 n LEU 209 CO 0.34 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 3dk8 n GLY 210 N 1.13 0.91 3.77 -0.72 0.00 -0.76 -4.83 105.19 104.69 3dk8 n GLY 210 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 3dk8 n GLY 210 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dk8 s SER 211 N -0.87 6.75 -0.61 1.61 0.15 -0.24 -4.97 113.70 115.51 3dk8 s SER 211 Ca 0.00 2.23 -0.28 0.00 0.70 0.00 0.00 55.95 58.60 3dk8 s SER 211 Cb 0.00 -2.61 0.03 0.00 -1.71 0.00 0.00 66.02 61.73 3dk8 s SER 211 CO 0.00 -0.51 1.26 -0.75 1.20 0.00 0.00 173.24 174.44 3dk8 s LYS 212 N -2.19 3.39 -0.06 5.44 2.20 -0.31 -4.27 119.74 123.93 3dk8 s LYS 212 Ca 0.55 0.18 0.04 0.00 -0.36 0.00 0.00 55.97 56.37 3dk8 s LYS 212 Cb -0.28 -4.08 -0.02 0.00 -1.51 0.00 0.00 37.83 31.94 3dk8 s LYS 212 CO 0.35 -1.85 -0.18 0.99 -0.36 0.00 0.00 175.35 174.30 3dk8 s THR 213 N 5.40 2.74 0.07 3.43 2.01 -1.26 -1.04 115.64 127.00 3dk8 s THR 213 Ca 0.43 -0.82 0.09 0.00 0.31 0.00 0.00 61.69 61.70 3dk8 s THR 213 Cb -0.08 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.33 3dk8 s THR 213 CO 0.23 0.57 -0.25 -0.44 -0.69 0.00 0.00 174.62 174.04 3dk8 s SER 214 N -0.37 3.07 -0.19 3.53 0.01 -0.24 -1.57 113.70 117.94 3dk8 s SER 214 Ca 0.03 -0.62 0.01 0.00 1.31 0.00 0.00 55.95 56.68 3dk8 s SER 214 Cb -0.12 -0.25 0.03 0.00 0.21 0.00 0.00 66.02 65.89 3dk8 s SER 214 CO 0.02 0.22 -0.16 -0.22 0.41 0.00 0.00 173.24 173.51 3dk8 s LEU 215 N -1.45 2.32 -0.28 2.44 2.96 0.17 -0.87 118.68 123.97 3dk8 s LEU 215 Ca 0.11 -0.80 -0.10 0.00 -0.22 0.00 0.00 54.13 53.12 3dk8 s LEU 215 Cb -0.10 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.15 3dk8 s LEU 215 CO 0.03 -0.07 0.17 -0.32 -1.32 0.00 0.00 176.35 174.84 3dk8 s MET 216 N 1.31 3.82 0.09 1.98 -2.45 0.50 -0.56 119.30 123.98 3dk8 s MET 216 Ca 0.01 -0.40 0.07 0.00 -1.25 0.00 0.00 55.69 54.12 3dk8 s MET 216 Cb -0.15 -3.60 -0.03 0.00 1.25 0.00 0.00 34.83 32.30 3dk8 s MET 216 CO -0.10 -0.22 -0.19 0.96 1.05 0.00 0.00 175.02 176.52 3dk8 s ILE 217 N 1.72 1.55 -0.14 10.11 -4.36 -0.47 -1.63 121.20 127.98 3dk8 s ILE 217 Ca 0.07 -1.43 0.24 0.00 -0.26 0.00 0.00 60.65 59.27 3dk8 s ILE 217 Cb -0.16 -1.42 0.28 0.00 1.25 0.00 0.00 42.46 42.41 3dk8 s ILE 217 CO 0.09 -0.06 1.71 0.03 0.24 0.00 0.00 174.94 176.95 3dk8 h ARG 218 N 4.24 0.00 0.00 0.37 3.08 -1.85 -0.56 114.38 119.66 3dk8 h ARG 218 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.61 3dk8 h ARG 218 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 3dk8 h ARG 218 CO 0.40 0.14 0.00 0.72 -1.07 0.00 0.00 179.97 180.17 3dk8 n HIS 219 N -3.18 0.00 0.04 3.04 8.25 -1.26 -3.82 115.22 118.28 3dk8 n HIS 219 Ca 0.02 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.59 3dk8 n HIS 219 Cb 0.50 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.51 3dk8 n HIS 219 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 3dk8 n ASP 220 N 0.00 0.35 -4.03 0.41 3.85 -1.26 -0.97 116.55 114.90 3dk8 n ASP 220 Ca 0.00 0.14 -0.08 0.00 -0.71 0.00 0.00 54.79 54.14 3dk8 n ASP 220 Cb 0.00 1.35 -0.10 0.00 -1.35 0.00 0.00 41.12 41.02 3dk8 n ASP 220 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3dk8 s LYS 221 N -3.45 0.51 0.62 0.11 1.02 -1.26 -4.96 119.74 112.33 3dk8 s LYS 221 Ca -0.05 -0.96 -0.06 0.00 0.02 0.00 0.00 55.97 54.92 3dk8 s LYS 221 Cb 0.12 0.18 0.02 0.00 -0.52 0.00 0.00 37.83 37.63 3dk8 s LYS 221 CO 0.86 -0.10 0.94 0.14 -0.92 0.00 0.00 175.35 176.27 3dk8 s VAL 222 N -2.95 3.33 -1.38 3.17 -7.23 -1.26 -4.54 120.40 109.55 3dk8 s VAL 222 Ca -0.02 -0.03 -0.06 0.00 -1.81 0.00 0.00 61.98 60.06 3dk8 s VAL 222 Cb 0.01 -3.35 0.03 0.00 0.56 0.00 0.00 36.38 33.63 3dk8 s VAL 222 CO -0.06 -0.37 0.92 0.18 -0.31 0.00 0.00 175.10 175.45 3dk8 n LEU 223 N -2.69 -3.10 0.30 1.32 4.77 0.01 -4.50 117.00 113.12 3dk8 n LEU 223 Ca 0.05 -0.73 0.19 0.00 -0.03 0.00 0.00 56.01 55.50 3dk8 n LEU 223 Cb 0.58 -2.76 0.93 0.00 -2.33 0.00 0.00 43.42 39.84 3dk8 n LEU 223 CO 0.53 0.47 1.08 0.03 -1.33 0.00 0.00 177.39 178.16 3dk8 h ARG 224 N -2.09 0.00 -0.00 3.23 3.08 -1.80 -1.01 114.38 115.79 3dk8 h ARG 224 Ca -0.59 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.46 3dk8 h ARG 224 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.41 3dk8 h ARG 224 CO 0.59 0.01 -0.02 -1.13 -1.07 0.00 0.00 179.97 178.35 3dk8 n SER 225 N -3.14 0.02 -4.86 7.04 3.41 -1.26 -4.84 113.62 109.99 3dk8 n SER 225 Ca -0.01 0.47 -0.26 0.00 -0.26 0.00 0.00 58.87 58.81 3dk8 n SER 225 Cb 0.20 -0.47 0.08 0.00 -0.26 0.00 0.00 64.21 63.76 3dk8 n SER 225 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3dk8 s PHE 226 N -3.00 2.75 0.44 7.33 0.40 -0.38 -5.01 117.98 120.51 3dk8 s PHE 226 Ca 0.14 0.41 -0.24 0.00 -0.60 0.00 0.00 56.93 56.65 3dk8 s PHE 226 Cb 0.19 -3.28 -0.10 0.00 0.51 0.00 0.00 43.02 40.34 3dk8 s PHE 226 CO 0.54 -1.55 1.01 -3.47 0.70 0.00 0.00 175.22 172.45 3dk8 n ASP 227 N -3.01 1.23 -0.27 1.36 2.03 -1.26 -4.70 116.55 111.93 3dk8 n ASP 227 Ca 0.09 1.01 0.15 0.00 0.52 0.00 0.00 54.79 56.55 3dk8 n ASP 227 Cb 0.60 -1.36 0.42 0.00 -0.72 0.00 0.00 41.12 40.07 3dk8 n ASP 227 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3dk8 h SER 228 N 1.43 0.58 -0.87 1.67 4.64 -1.92 -0.38 113.55 118.69 3dk8 h SER 228 Ca -0.45 0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 60.89 3dk8 h SER 228 Cb 1.34 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.33 3dk8 h SER 228 CO 0.56 0.26 0.44 -0.03 -0.87 0.00 0.00 176.83 177.19 3dk8 h MET 229 N 0.59 1.23 -0.18 4.77 -1.53 -2.00 -1.53 114.93 116.29 3dk8 h MET 229 Ca 0.47 -0.16 -0.07 0.00 -3.44 0.00 0.00 59.70 56.50 3dk8 h MET 229 Cb 0.91 -0.23 -0.00 0.00 -0.55 0.00 0.00 31.60 31.73 3dk8 h MET 229 CO -0.22 0.92 -0.15 0.82 0.14 0.00 0.00 176.91 178.43 3dk8 h ILE 230 N 1.23 1.33 -0.44 1.77 1.08 -1.47 -0.73 117.51 120.27 3dk8 h ILE 230 Ca 0.30 -1.28 0.06 0.00 -0.39 0.00 0.00 64.86 63.55 3dk8 h ILE 230 Cb 0.08 1.77 -0.05 0.00 -3.07 0.00 0.00 36.82 35.55 3dk8 h ILE 230 CO -0.04 0.38 0.16 -1.28 -0.69 0.00 0.00 178.15 176.68 3dk8 h SER 231 N 0.08 0.16 0.11 1.72 0.87 -1.07 0.10 113.55 115.53 3dk8 h SER 231 Ca 0.03 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 3dk8 h SER 231 Cb 0.67 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 3dk8 h SER 231 CO 0.04 0.13 -0.05 0.74 -0.53 0.00 0.00 176.83 177.15 3dk8 h THR 232 N 0.33 0.96 -0.57 2.23 2.02 -1.27 -2.76 112.91 113.84 3dk8 h THR 232 Ca 0.21 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 67.09 3dk8 h THR 232 Cb 0.20 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 3dk8 h THR 232 CO -0.21 0.06 0.19 -1.13 0.37 0.00 0.00 175.52 174.80 3dk8 h ASN 233 N -0.26 0.83 -0.75 4.18 -1.24 -0.89 -2.02 115.58 115.42 3dk8 h ASN 233 Ca -0.02 -0.20 -0.04 0.00 0.71 0.00 0.00 56.30 56.75 3dk8 h ASN 233 Cb 0.21 -0.22 -0.03 0.00 0.73 0.00 0.00 38.32 39.01 3dk8 h ASN 233 CO 0.02 0.81 0.31 0.00 -1.29 0.00 0.00 177.43 177.28 3dk8 h THR 235 N 1.08 1.15 -0.63 0.00 2.02 -1.25 -1.15 112.91 114.12 3dk8 h THR 235 Ca 0.25 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 3dk8 h THR 235 Cb 0.20 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 3dk8 h THR 235 CO -0.02 0.15 0.35 -0.33 0.37 0.00 0.00 175.52 176.04 3dk8 h GLU 236 N 0.41 0.88 -0.58 6.66 5.08 -1.06 -2.22 114.58 123.75 3dk8 h GLU 236 Ca 0.12 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 3dk8 h GLU 236 Cb 0.09 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3dk8 h GLU 236 CO -0.02 0.66 0.06 0.93 -1.00 0.00 0.00 179.01 179.64 3dk8 h GLU 237 N 0.86 0.96 -0.11 2.33 4.39 -0.81 -0.09 114.58 122.11 3dk8 h GLU 237 Ca 0.22 -0.26 0.02 0.00 0.34 0.00 0.00 59.36 59.69 3dk8 h GLU 237 Cb 0.04 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 3dk8 h GLU 237 CO -0.04 0.91 -0.04 -0.07 -1.16 0.00 0.00 179.01 178.61 3dk8 h LEU 238 N 0.89 -0.14 -0.71 1.33 3.38 -1.03 -1.27 115.31 117.77 3dk8 h LEU 238 Ca 0.18 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 3dk8 h LEU 238 Cb 0.45 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 3dk8 h LEU 238 CO 0.02 -0.06 0.36 -0.33 0.09 0.00 0.00 178.44 178.52 3dk8 h GLU 239 N -0.03 1.00 0.00 1.13 5.08 -1.07 -1.74 114.58 118.96 3dk8 h GLU 239 Ca 0.06 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 3dk8 h GLU 239 Cb 0.11 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 3dk8 h GLU 239 CO -0.12 0.77 -0.15 -0.91 -1.00 0.00 0.00 179.01 177.59 3dk8 h ASN 240 N 0.98 0.00 -0.07 1.42 2.35 -0.76 -1.28 115.58 118.22 3dk8 h ASN 240 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 3dk8 h ASN 240 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 3dk8 h ASN 240 CO -0.04 0.15 0.00 0.00 -1.65 0.00 0.00 177.43 175.90 3dk8 n ALA 241 N -2.31 2.57 -0.07 -0.83 0.00 -0.50 -4.92 120.51 114.45 3dk8 n ALA 241 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.03 3dk8 n ALA 241 Cb 0.27 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3dk8 n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dk8 n GLY 242 N 1.08 0.65 3.69 0.00 0.00 -0.48 -4.91 105.19 105.21 3dk8 n GLY 242 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3dk8 n GLY 242 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dk8 s VAL 243 N -2.10 4.68 -0.42 1.61 1.01 -0.71 -4.68 120.40 119.78 3dk8 s VAL 243 Ca 0.00 1.95 -0.29 0.00 0.00 0.00 0.00 61.98 63.64 3dk8 s VAL 243 Cb 0.00 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 32.15 3dk8 s VAL 243 CO 0.00 0.01 1.21 -0.70 0.00 0.00 0.00 175.10 175.62 3dk8 s GLU 244 N 2.03 3.76 -0.38 2.72 2.12 -0.61 -3.94 118.70 124.41 3dk8 s GLU 244 Ca 0.50 0.81 -0.18 0.00 0.36 0.00 0.00 54.97 56.46 3dk8 s GLU 244 Cb -0.20 -3.91 0.00 0.00 0.26 0.00 0.00 34.13 30.29 3dk8 s GLU 244 CO 0.19 -1.32 0.48 0.08 -0.54 0.00 0.00 175.26 174.15 3dk8 s VAL 245 N 4.56 5.04 -0.65 3.70 1.01 -1.26 -0.66 120.40 132.14 3dk8 s VAL 245 Ca 0.52 0.09 -0.20 0.00 0.00 0.00 0.00 61.98 62.39 3dk8 s VAL 245 Cb -0.11 -3.99 0.10 0.00 0.00 0.00 0.00 36.38 32.39 3dk8 s VAL 245 CO 0.28 -0.29 0.82 -0.76 0.00 0.00 0.00 175.10 175.15 3dk8 s LEU 246 N 2.31 5.12 0.38 3.92 1.43 0.28 -4.97 118.68 127.15 3dk8 s LEU 246 Ca 0.16 -1.40 -0.16 0.00 -1.03 0.00 0.00 54.13 51.70 3dk8 s LEU 246 Cb -0.16 -2.34 -0.09 0.00 0.03 0.00 0.00 46.19 43.63 3dk8 s LEU 246 CO 0.14 -1.19 0.82 -0.54 0.23 0.00 0.00 176.35 175.81 3dk8 s LYS 247 N 3.00 4.03 -1.53 1.70 1.02 -1.26 -1.37 119.74 125.33 3dk8 s LYS 247 Ca 0.17 0.79 -0.12 0.00 0.02 0.00 0.00 55.97 56.82 3dk8 s LYS 247 Cb -0.20 -2.33 0.08 0.00 -0.52 0.00 0.00 37.83 34.86 3dk8 s LYS 247 CO 0.05 0.05 0.87 1.19 -0.92 0.00 0.00 175.35 176.59 3dk8 n PHE 248 N -0.65 -2.09 -4.58 3.18 3.01 -0.14 -4.70 117.46 111.48 3dk8 n PHE 248 Ca 0.05 0.86 -0.22 0.00 1.01 0.00 0.00 57.45 59.15 3dk8 n PHE 248 Cb 0.54 -3.80 -0.14 0.00 -0.01 0.00 0.00 39.48 36.06 3dk8 n PHE 248 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 3dk8 s SER 249 N -3.52 1.84 0.00 4.37 0.01 -0.29 -0.83 113.70 115.28 3dk8 s SER 249 Ca 0.55 -0.37 -0.02 0.00 1.31 0.00 0.00 55.95 57.43 3dk8 s SER 249 Cb -0.28 -0.17 -0.01 0.00 0.21 0.00 0.00 66.02 65.77 3dk8 s SER 249 CO 0.85 0.13 0.02 -1.10 0.41 0.00 0.00 173.24 173.56 3dk8 s GLN 250 N -0.73 0.21 -0.02 12.44 -0.21 -0.45 -3.99 119.66 126.92 3dk8 s GLN 250 Ca 0.05 -0.28 -0.28 0.00 0.02 0.00 0.00 55.36 54.87 3dk8 s GLN 250 Cb -0.07 0.08 -0.03 0.00 1.00 0.00 0.00 33.01 33.99 3dk8 s GLN 250 CO 0.00 -0.04 0.92 0.08 -2.12 0.00 0.00 175.29 174.13 3dk8 s VAL 251 N -0.77 4.91 -0.18 1.09 1.01 -1.26 -0.73 120.40 124.46 3dk8 s VAL 251 Ca -0.08 1.91 0.16 0.00 0.00 0.00 0.00 61.98 63.96 3dk8 s VAL 251 Cb -0.05 -4.25 -0.24 0.00 0.00 0.00 0.00 36.38 31.83 3dk8 s VAL 251 CO -0.00 0.17 0.13 1.17 0.00 0.00 0.00 175.10 176.56 3dk8 n LYS 252 N 3.96 0.68 -3.51 2.72 4.81 0.83 -4.93 118.16 122.72 3dk8 n LYS 252 Ca 0.05 0.05 -0.12 0.00 -0.87 0.00 0.00 58.31 57.41 3dk8 n LYS 252 Cb 0.51 -1.56 -0.04 0.00 0.02 0.00 0.00 35.03 33.96 3dk8 n LYS 252 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 3dk8 s GLU 253 N -2.51 0.92 -0.04 1.64 2.12 -1.20 -4.09 118.70 115.55 3dk8 s GLU 253 Ca -0.12 -0.08 0.02 0.00 0.36 0.00 0.00 54.97 55.16 3dk8 s GLU 253 Cb 0.07 0.43 0.01 0.00 0.26 0.00 0.00 34.13 34.89 3dk8 s GLU 253 CO 0.81 -0.35 -0.09 0.08 -0.54 0.00 0.00 175.26 175.16 3dk8 s VAL 254 N -2.25 0.84 0.03 3.70 1.01 -0.18 -0.80 120.40 122.76 3dk8 s VAL 254 Ca -0.02 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.64 3dk8 s VAL 254 Cb -0.01 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.59 3dk8 s VAL 254 CO -0.02 0.27 -0.13 -0.54 0.00 0.00 0.00 175.10 174.68 3dk8 s LYS 255 N 0.36 0.87 0.15 2.72 1.02 -0.51 -4.01 119.74 120.34 3dk8 s LYS 255 Ca -0.06 -0.70 -0.30 0.00 0.02 0.00 0.00 55.97 54.93 3dk8 s LYS 255 Cb -0.11 -0.85 -0.07 0.00 -0.52 0.00 0.00 37.83 36.29 3dk8 s LYS 255 CO 0.01 0.21 1.00 0.21 -0.92 0.00 0.00 175.35 175.87 3dk8 s LYS 256 N -1.05 4.69 0.43 1.68 2.47 -1.26 -0.72 119.74 125.98 3dk8 s LYS 256 Ca 0.01 1.55 0.04 0.00 -1.56 0.00 0.00 55.97 56.01 3dk8 s LYS 256 Cb -0.07 -3.33 -0.05 0.00 -1.46 0.00 0.00 37.83 32.92 3dk8 s LYS 256 CO 0.01 0.22 0.03 0.95 0.16 0.00 0.00 175.35 176.72 3dk8 s THR 257 N -0.28 1.39 0.38 3.43 -4.23 -0.28 -4.88 115.64 111.17 3dk8 s THR 257 Ca 0.47 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.04 3dk8 s THR 257 Cb -0.26 -2.59 0.20 0.00 1.34 0.00 0.00 72.50 71.18 3dk8 s THR 257 CO 0.32 0.00 1.95 -0.07 -0.54 0.00 0.00 174.62 176.28 3dk8 h LEU 258 N 1.69 0.41 -0.34 4.79 3.38 -1.99 -2.83 115.31 120.42 3dk8 h LEU 258 Ca -0.42 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3dk8 h LEU 258 Cb 1.27 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3dk8 h LEU 258 CO 0.73 0.44 -0.57 -0.24 0.09 0.00 0.00 178.44 178.89 3dk8 n SER 259 N -4.35 1.07 0.00 -0.43 2.88 -1.26 -5.05 113.62 106.48 3dk8 n SER 259 Ca 0.01 -1.04 0.00 0.00 -1.33 0.00 0.00 58.87 56.52 3dk8 n SER 259 Cb 0.18 0.79 0.00 0.00 -0.75 0.00 0.00 64.21 64.44 3dk8 n SER 259 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dk8 n GLY 260 N 1.28 -0.80 3.05 0.46 0.00 -1.07 -4.87 105.19 103.24 3dk8 n GLY 260 Ca 0.04 0.55 -0.19 0.00 0.00 0.00 0.00 46.02 46.43 3dk8 n GLY 260 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dk8 s LEU 261 N 0.00 2.05 -0.19 0.99 1.43 0.06 -1.13 118.68 121.90 3dk8 s LEU 261 Ca 0.00 -0.23 -0.04 0.00 -1.03 0.00 0.00 54.13 52.83 3dk8 s LEU 261 Cb 0.00 -0.48 -0.02 0.00 0.03 0.00 0.00 46.19 45.71 3dk8 s LEU 261 CO 0.00 0.09 -0.02 -0.70 0.23 0.00 0.00 176.35 175.94 3dk8 s GLU 262 N -0.42 3.56 -0.24 1.70 2.12 0.10 -1.21 118.70 124.32 3dk8 s GLU 262 Ca 0.03 -0.55 -0.09 0.00 0.36 0.00 0.00 54.97 54.72 3dk8 s GLU 262 Cb -0.05 -3.01 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 3dk8 s GLU 262 CO -0.00 0.02 0.11 0.08 -0.54 0.00 0.00 175.26 174.92 3dk8 s VAL 263 N 0.95 4.78 -0.27 3.70 1.01 -0.39 -1.43 120.40 128.76 3dk8 s VAL 263 Ca 0.01 -0.02 -0.18 0.00 0.00 0.00 0.00 61.98 61.79 3dk8 s VAL 263 Cb -0.14 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 3dk8 s VAL 263 CO 0.01 0.35 0.50 -0.55 0.00 0.00 0.00 175.10 175.42 3dk8 s SER 264 N 1.26 6.41 0.03 3.32 0.15 0.02 -0.17 113.70 124.72 3dk8 s SER 264 Ca 0.06 0.48 0.07 0.00 0.70 0.00 0.00 55.95 57.25 3dk8 s SER 264 Cb -0.14 -2.27 -0.03 0.00 -1.71 0.00 0.00 66.02 61.86 3dk8 s SER 264 CO 0.05 -0.29 -0.19 -0.32 1.20 0.00 0.00 173.24 173.69 3dk8 s MET 265 N 2.30 2.09 -0.15 5.44 0.00 -0.02 -0.12 119.30 128.84 3dk8 s MET 265 Ca 0.21 -0.96 -0.01 0.00 0.00 0.00 0.00 55.69 54.93 3dk8 s MET 265 Cb -0.16 -2.18 -0.01 0.00 0.00 0.00 0.00 34.83 32.49 3dk8 s MET 265 CO 0.09 0.55 -0.12 0.08 0.00 0.00 0.00 175.02 175.62 3dk8 s VAL 266 N -0.87 3.06 -0.12 10.11 1.01 0.09 -1.11 120.40 132.57 3dk8 s VAL 266 Ca 0.14 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3dk8 s VAL 266 Cb -0.10 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 3dk8 s VAL 266 CO 0.04 0.51 -0.16 -0.89 0.00 0.00 0.00 175.10 174.60 3dk8 s THR 267 N 0.56 2.82 -0.41 3.92 2.01 0.00 -1.34 115.64 123.20 3dk8 s THR 267 Ca -0.08 -0.75 0.04 0.00 0.31 0.00 0.00 61.69 61.22 3dk8 s THR 267 Cb -0.16 -2.16 0.17 0.00 0.01 0.00 0.00 72.50 70.36 3dk8 s THR 267 CO 0.03 0.54 0.34 0.00 -0.69 0.00 0.00 174.62 174.84 3dk8 n ALA 268 N 3.45 2.84 -2.28 7.40 0.00 -0.01 -1.01 120.51 130.90 3dk8 n ALA 268 Ca -0.18 -3.09 -0.41 0.00 0.00 0.00 0.00 53.44 49.75 3dk8 n ALA 268 Cb 0.53 -0.75 -0.04 0.00 0.00 0.00 0.00 19.45 19.18 3dk8 n ALA 268 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dk8 s VAL 269 N 0.06 4.30 0.21 0.00 1.01 -1.26 -4.87 120.40 119.84 3dk8 s VAL 269 Ca 0.33 1.86 -0.32 0.00 0.00 0.00 0.00 61.98 63.85 3dk8 s VAL 269 Cb 0.04 -4.19 -0.14 0.00 0.00 0.00 0.00 36.38 32.09 3dk8 s VAL 269 CO -0.20 0.26 1.43 -2.65 0.00 0.00 0.00 175.10 173.94 3dk8 n PRO 270 N 2.93 1.94 -0.19 2.72 -0.02 -1.26 -1.31 135.00 139.81 3dk8 n PRO 270 Ca 0.04 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 3dk8 n PRO 270 Cb 0.48 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3dk8 n PRO 270 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dk8 n GLY 271 N 2.47 1.38 3.72 -1.23 0.00 -1.26 -5.02 105.19 105.24 3dk8 n GLY 271 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 3dk8 n GLY 271 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dk8 s ARG 272 N -0.44 2.12 0.15 1.61 0.52 -0.43 -5.15 118.95 117.34 3dk8 s ARG 272 Ca 0.00 -2.25 -0.08 0.00 -0.52 0.00 0.00 55.73 52.88 3dk8 s ARG 272 Cb 0.00 -1.63 -0.06 0.00 0.52 0.00 0.00 34.95 33.78 3dk8 s ARG 272 CO 0.00 -0.25 0.45 -0.51 0.02 0.00 0.00 175.30 175.00 3dk8 s LEU 273 N -3.85 4.26 0.52 2.53 1.43 -1.26 -4.69 118.68 117.62 3dk8 s LEU 273 Ca 0.19 0.78 -0.22 0.00 -1.03 0.00 0.00 54.13 53.85 3dk8 s LEU 273 Cb 0.04 -3.34 -0.06 0.00 0.03 0.00 0.00 46.19 42.87 3dk8 s LEU 273 CO 0.10 0.05 1.36 -2.84 0.23 0.00 0.00 176.35 175.25 3dk8 s PRO 274 N -2.46 3.28 -0.01 1.29 0.02 -1.26 -4.70 135.00 131.16 3dk8 s PRO 274 Ca 0.41 2.25 -0.01 0.00 0.02 0.00 0.00 61.00 63.67 3dk8 s PRO 274 Cb -0.12 -2.34 0.00 0.00 0.02 0.00 0.00 34.50 32.05 3dk8 s PRO 274 CO 0.21 -1.09 0.02 0.54 -0.33 0.00 0.00 177.00 176.36 3dk8 s VAL 275 N -1.29 0.01 -0.16 3.83 0.11 -0.18 -4.99 120.40 117.73 3dk8 s VAL 275 Ca 0.69 -0.09 -0.11 0.00 -2.93 0.00 0.00 61.98 59.54 3dk8 s VAL 275 Cb -0.41 -0.07 -0.05 0.00 -1.53 0.00 0.00 36.38 34.33 3dk8 s VAL 275 CO 0.49 -0.05 0.21 -0.04 -3.33 0.00 0.00 175.10 172.38 3dk8 s MET 276 N -0.13 4.06 -0.04 1.54 -1.94 -1.26 -0.82 119.30 120.71 3dk8 s MET 276 Ca -0.02 -0.04 0.03 0.00 -1.71 0.00 0.00 55.69 53.95 3dk8 s MET 276 Cb -0.01 -3.37 0.00 0.00 2.01 0.00 0.00 34.83 33.46 3dk8 s MET 276 CO -0.00 0.39 -0.12 0.99 -0.01 0.00 0.00 175.02 176.27 3dk8 s THR 277 N 0.06 1.05 -0.10 2.05 2.01 -0.26 -5.00 115.64 115.44 3dk8 s THR 277 Ca 0.14 -0.49 -0.15 0.00 0.31 0.00 0.00 61.69 61.49 3dk8 s THR 277 Cb -0.12 -0.92 -0.05 0.00 0.01 0.00 0.00 72.50 71.42 3dk8 s THR 277 CO 0.02 0.32 0.37 -0.04 -0.69 0.00 0.00 174.62 174.60 3dk8 s MET 278 N 0.22 4.13 -0.39 4.92 -1.94 -1.26 -0.84 119.30 124.14 3dk8 s MET 278 Ca -0.05 0.27 -0.09 0.00 -1.71 0.00 0.00 55.69 54.11 3dk8 s MET 278 Cb -0.11 -3.35 0.05 0.00 2.01 0.00 0.00 34.83 33.43 3dk8 s MET 278 CO 0.01 0.38 0.22 0.42 -0.01 0.00 0.00 175.02 176.04 3dk8 s ILE 279 N -0.03 4.30 0.55 2.53 1.01 0.76 -4.96 121.20 125.36 3dk8 s ILE 279 Ca 0.21 -1.15 -0.04 0.00 0.00 0.00 0.00 60.65 59.68 3dk8 s ILE 279 Cb -0.15 -3.51 0.01 0.00 0.01 0.00 0.00 42.46 38.82 3dk8 s ILE 279 CO 0.08 -0.35 0.83 -2.16 0.00 0.00 0.00 174.94 173.34 3dk8 s PRO 280 N 1.47 2.88 -1.39 2.79 0.04 -1.26 -1.26 135.00 138.26 3dk8 s PRO 280 Ca 0.02 -0.23 -0.07 0.00 0.04 0.00 0.00 61.00 60.75 3dk8 s PRO 280 Cb -0.21 -2.37 0.01 0.00 0.04 0.00 0.00 34.50 31.97 3dk8 s PRO 280 CO 0.04 -0.62 0.98 -0.25 0.04 0.00 0.00 177.00 177.20 3dk8 n ASP 281 N -2.44 -6.23 -4.67 6.66 10.43 -1.10 -4.95 116.55 114.24 3dk8 n ASP 281 Ca 0.04 -0.45 -0.41 0.00 2.57 0.00 0.00 54.79 56.54 3dk8 n ASP 281 Cb 0.58 -4.92 -0.04 0.00 1.84 0.00 0.00 41.12 38.58 3dk8 n ASP 281 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3dk8 s VAL 282 N -3.27 4.91 -0.04 2.53 1.01 -0.35 -4.70 120.40 120.50 3dk8 s VAL 282 Ca 0.49 1.53 -0.10 0.00 0.00 0.00 0.00 61.98 63.89 3dk8 s VAL 282 Cb -0.21 -4.09 -0.31 0.00 0.00 0.00 0.00 36.38 31.76 3dk8 s VAL 282 CO 0.60 0.05 0.70 0.44 0.00 0.00 0.00 175.10 176.89 3dk8 h ASP 283 N 7.36 0.61 -3.19 3.32 3.45 -1.25 0.22 116.42 126.94 3dk8 h ASP 283 Ca -0.30 -0.90 -0.53 0.00 0.43 0.00 0.00 57.03 55.73 3dk8 h ASP 283 Cb 1.13 -0.20 -0.37 0.00 -0.56 0.00 0.00 39.33 39.34 3dk8 h ASP 283 CO 0.82 1.75 -0.80 0.00 -1.57 0.00 0.00 179.24 179.44 3dk8 s LEU 285 N 1.69 3.26 -0.23 0.00 2.96 -1.26 -0.77 118.68 124.33 3dk8 s LEU 285 Ca 0.05 -0.47 -0.00 0.00 -0.22 0.00 0.00 54.13 53.48 3dk8 s LEU 285 Cb -0.13 -1.80 0.03 0.00 0.50 0.00 0.00 46.19 44.79 3dk8 s LEU 285 CO -0.08 -0.07 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.55 3dk8 s LEU 286 N 1.50 2.91 -0.30 -0.68 0.20 -0.16 -0.60 118.68 121.56 3dk8 s LEU 286 Ca 0.05 -0.86 -0.27 0.00 0.69 0.00 0.00 54.13 53.74 3dk8 s LEU 286 Cb -0.15 -1.60 0.01 0.00 -0.43 0.00 0.00 46.19 44.02 3dk8 s LEU 286 CO -0.01 -0.09 0.99 0.26 -0.29 0.00 0.00 176.35 177.21 3dk8 s TRP 287 N 1.29 3.19 -0.48 5.38 0.52 0.38 -0.63 118.94 128.59 3dk8 s TRP 287 Ca 0.01 1.12 0.08 0.00 0.02 0.00 0.00 56.10 57.33 3dk8 s TRP 287 Cb -0.16 -3.50 0.33 0.00 -1.15 0.00 0.00 33.47 28.99 3dk8 s TRP 287 CO -0.07 -0.67 0.80 0.00 0.02 0.00 0.00 176.95 177.03 3dk8 n ALA 288 N 6.60 3.29 0.47 0.98 0.00 0.47 -4.30 120.51 128.01 3dk8 n ALA 288 Ca 0.10 -4.04 0.06 0.00 0.00 0.00 0.00 53.44 49.55 3dk8 n ALA 288 Cb 0.47 -0.84 0.04 0.00 0.00 0.00 0.00 19.45 19.12 3dk8 n ALA 288 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3dk8 n ILE 289 N 0.22 0.00 -0.76 0.00 -5.35 -1.25 -4.22 119.36 108.01 3dk8 n ILE 289 Ca 0.27 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 3dk8 n ILE 289 Cb 0.52 1.21 0.00 0.00 -1.74 0.00 0.00 39.64 39.63 3dk8 n ILE 289 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dk8 n GLY 290 N 0.69 -0.73 3.13 3.28 0.00 -1.26 -4.97 105.19 105.33 3dk8 n GLY 290 Ca 0.06 -1.60 -0.21 0.00 0.00 0.00 0.00 46.02 44.26 3dk8 n GLY 290 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dk8 s ARG 291 N -1.69 1.05 -0.05 1.61 1.81 -1.26 -0.96 118.95 119.45 3dk8 s ARG 291 Ca 0.00 -0.64 0.05 0.00 -1.72 0.00 0.00 55.73 53.43 3dk8 s ARG 291 Cb 0.00 -1.04 -0.02 0.00 -0.45 0.00 0.00 34.95 33.44 3dk8 s ARG 291 CO 0.00 0.27 -0.21 0.08 -0.68 0.00 0.00 175.30 174.76 3dk8 s VAL 292 N -0.59 2.46 0.50 3.52 1.01 0.30 -4.81 120.40 122.79 3dk8 s VAL 292 Ca 0.04 -0.94 -0.20 0.00 0.00 0.00 0.00 61.98 60.88 3dk8 s VAL 292 Cb -0.07 -1.92 -0.08 0.00 0.00 0.00 0.00 36.38 34.32 3dk8 s VAL 292 CO 0.00 0.58 1.05 -2.16 0.00 0.00 0.00 175.10 174.57 3dk8 s PRO 293 N -0.47 3.72 -1.15 2.72 0.04 -1.26 -0.59 135.00 138.01 3dk8 s PRO 293 Ca 0.06 1.40 -0.13 0.00 0.04 0.00 0.00 61.00 62.37 3dk8 s PRO 293 Cb -0.12 -2.08 0.20 0.00 0.04 0.00 0.00 34.50 32.54 3dk8 s PRO 293 CO 0.01 -0.50 1.31 -0.80 0.04 0.00 0.00 177.00 177.06 3dk8 s ASN 294 N -1.96 7.10 0.00 6.66 0.01 0.01 -4.59 114.94 122.17 3dk8 s ASN 294 Ca 0.68 -3.09 0.00 0.00 -0.71 0.00 0.00 52.86 49.74 3dk8 s ASN 294 Cb -0.18 -2.34 0.00 0.00 0.41 0.00 0.00 41.25 39.14 3dk8 s ASN 294 CO 0.21 -0.64 0.03 0.35 -1.51 0.00 0.00 177.10 175.54 3dk8 n THR 295 N 4.14 0.00 0.01 1.60 -2.24 -1.26 -4.76 114.28 111.76 3dk8 n THR 295 Ca 0.32 -0.24 0.03 0.00 -2.27 0.00 0.00 64.05 61.89 3dk8 n THR 295 Cb 0.42 1.07 0.39 0.00 -2.10 0.00 0.00 70.33 70.11 3dk8 n THR 295 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3dk8 h LYS 296 N 0.00 0.52 -0.40 -0.78 6.56 -1.92 -2.68 116.57 117.87 3dk8 h LYS 296 Ca 0.00 -0.05 -0.07 0.00 -1.06 0.00 0.00 60.65 59.47 3dk8 h LYS 296 Cb 0.03 -0.11 -0.04 0.00 -0.57 0.00 0.00 32.23 31.55 3dk8 h LYS 296 CO 0.00 0.40 0.04 -0.25 -2.06 0.00 0.00 179.45 177.58 3dk8 n ASP 297 N -4.42 4.08 -0.02 0.86 8.00 -1.26 -4.50 116.55 119.29 3dk8 n ASP 297 Ca 0.02 -3.16 0.13 0.00 0.71 0.00 0.00 54.79 52.49 3dk8 n ASP 297 Cb 0.11 -0.61 0.43 0.00 -0.02 0.00 0.00 41.12 41.03 3dk8 n ASP 297 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3dk8 n LEU 298 N -0.41 0.34 -3.66 0.64 4.77 -1.01 -4.67 117.00 112.99 3dk8 n LEU 298 Ca 0.28 0.17 -0.25 0.00 -0.03 0.00 0.00 56.01 56.17 3dk8 n LEU 298 Cb 1.05 -0.33 0.07 0.00 -2.33 0.00 0.00 43.42 41.88 3dk8 n LEU 298 CO 0.23 0.08 0.22 -1.20 -1.33 0.00 0.00 177.39 175.39 3dk8 n SER 299 N -1.40 -6.04 0.08 -1.43 7.64 -1.26 -1.10 113.62 110.11 3dk8 n SER 299 Ca 0.07 -0.59 0.09 0.00 1.01 0.00 0.00 58.87 59.46 3dk8 n SER 299 Cb 0.33 -4.80 0.55 0.00 -1.01 0.00 0.00 64.21 59.28 3dk8 n SER 299 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3dk8 h LEU 300 N -2.58 0.22 -2.36 -3.43 3.38 -1.91 -1.38 115.31 107.24 3dk8 h LEU 300 Ca -0.57 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.39 3dk8 h LEU 300 Cb 1.37 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.07 3dk8 h LEU 300 CO 0.58 0.15 -0.00 -0.55 0.09 0.00 0.00 178.44 178.71 3dk8 h ASN 301 N 0.25 0.00 0.75 -0.43 -1.07 -1.90 -2.08 115.58 111.10 3dk8 h ASN 301 Ca 0.13 0.00 -0.02 0.00 0.07 0.00 0.00 56.30 56.48 3dk8 h ASN 301 Cb 0.22 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.47 3dk8 h ASN 301 CO -0.03 0.00 -0.09 0.11 0.07 0.00 0.00 177.43 177.49 3dk8 h LYS 302 N 0.00 0.00 -0.05 4.14 1.57 -1.58 -2.78 116.57 117.87 3dk8 h LYS 302 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dk8 h LYS 302 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3dk8 h LYS 302 CO 0.00 0.09 0.00 1.28 -0.57 0.00 0.00 179.45 180.25 3dk8 n LEU 303 N -3.30 1.68 -1.07 2.94 4.77 -0.84 -4.67 117.00 116.51 3dk8 n LEU 303 Ca -0.00 -1.26 -0.10 0.00 -0.03 0.00 0.00 56.01 54.62 3dk8 n LEU 303 Cb 0.30 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.36 3dk8 n LEU 303 CO 0.29 0.38 -0.12 0.61 -1.33 0.00 0.00 177.39 177.22 3dk8 n GLY 304 N 0.20 0.11 3.72 -0.72 0.00 -0.85 -4.96 105.19 102.69 3dk8 n GLY 304 Ca 0.04 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 3dk8 n GLY 304 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dk8 s ILE 305 N -2.47 3.60 0.12 -0.61 1.01 -0.92 -4.90 121.20 117.03 3dk8 s ILE 305 Ca 0.00 1.16 -0.30 0.00 0.00 0.00 0.00 60.65 61.51 3dk8 s ILE 305 Cb 0.00 -3.74 -0.06 0.00 0.01 0.00 0.00 42.46 38.66 3dk8 s ILE 305 CO 0.00 0.10 1.03 -1.58 0.00 0.00 0.00 174.94 174.48 3dk8 s GLN 306 N 1.00 4.63 0.18 2.79 0.74 -1.26 -4.73 119.66 123.01 3dk8 s GLN 306 Ca 0.62 1.56 0.06 0.00 0.05 0.00 0.00 55.36 57.65 3dk8 s GLN 306 Cb -0.34 -3.35 -0.05 0.00 1.10 0.00 0.00 33.01 30.38 3dk8 s GLN 306 CO 0.30 0.12 -0.11 0.95 -0.55 0.00 0.00 175.29 176.00 3dk8 s THR 307 N 0.06 1.40 0.77 -0.34 -4.23 -1.26 -1.67 115.64 110.37 3dk8 s THR 307 Ca 0.49 -2.12 -0.10 0.00 -1.18 0.00 0.00 61.69 58.78 3dk8 s THR 307 Cb -0.26 -1.99 0.17 0.00 1.34 0.00 0.00 72.50 71.77 3dk8 s THR 307 CO 0.31 -0.64 1.05 -0.90 -0.54 0.00 0.00 174.62 173.91 3dk8 n ASP 308 N -0.30 0.41 0.16 3.99 5.68 -0.51 -4.89 116.55 121.09 3dk8 n ASP 308 Ca -0.09 -1.58 0.13 0.00 -0.50 0.00 0.00 54.79 52.75 3dk8 n ASP 308 Cb 0.61 -0.78 0.53 0.00 -1.14 0.00 0.00 41.12 40.34 3dk8 n ASP 308 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3dk8 h ASP 309 N -1.20 0.00 0.10 -1.12 3.32 -2.02 -2.05 116.42 113.45 3dk8 h ASP 309 Ca -0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.71 3dk8 h ASP 309 Cb 1.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.57 3dk8 h ASP 309 CO 0.27 0.00 -0.16 0.29 -1.72 0.00 0.00 179.24 177.92 3dk8 n LYS 310 N -2.39 1.29 -0.12 3.56 5.02 -1.26 -4.96 118.16 119.30 3dk8 n LYS 310 Ca 0.02 -0.82 0.00 0.00 -2.02 0.00 0.00 58.31 55.49 3dk8 n LYS 310 Cb 0.24 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 3dk8 n LYS 310 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dk8 n GLY 311 N 1.29 0.55 3.77 0.72 0.00 -0.77 -4.49 105.19 106.25 3dk8 n GLY 311 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3dk8 n GLY 311 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dk8 s HIS 312 N -2.25 3.18 0.07 1.61 3.76 -1.26 -4.66 115.29 115.75 3dk8 s HIS 312 Ca 0.00 1.56 -0.31 0.00 -0.15 0.00 0.00 55.06 56.16 3dk8 s HIS 312 Cb 0.00 -3.43 -0.06 0.00 1.11 0.00 0.00 32.58 30.20 3dk8 s HIS 312 CO 0.00 -1.26 1.23 0.42 -0.85 0.00 0.00 174.74 174.27 3dk8 s ILE 313 N -1.29 3.91 0.06 0.60 1.01 -0.80 -1.42 121.20 123.26 3dk8 s ILE 313 Ca 0.52 1.38 -0.27 0.00 0.00 0.00 0.00 60.65 62.29 3dk8 s ILE 313 Cb -0.33 -3.88 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 3dk8 s ILE 313 CO 0.42 0.11 0.83 -0.63 0.00 0.00 0.00 174.94 175.68 3dk8 s ILE 314 N 1.02 4.66 0.14 2.92 -1.09 -0.67 -4.47 121.20 123.71 3dk8 s ILE 314 Ca 0.59 1.78 0.03 0.00 -2.23 0.00 0.00 60.65 60.82 3dk8 s ILE 314 Cb -0.31 -4.19 -0.04 0.00 -1.58 0.00 0.00 42.46 36.34 3dk8 s ILE 314 CO 0.30 0.34 -0.06 0.68 -1.23 0.00 0.00 174.94 174.97 3dk8 s VAL 315 N -0.00 0.85 0.28 2.92 -7.23 -1.26 -4.28 120.40 111.68 3dk8 s VAL 315 Ca 0.42 -1.99 -0.02 0.00 -1.81 0.00 0.00 61.98 58.58 3dk8 s VAL 315 Cb -0.21 -1.88 0.06 0.00 0.56 0.00 0.00 36.38 34.91 3dk8 s VAL 315 CO 0.25 -0.71 0.39 -0.90 -0.31 0.00 0.00 175.10 173.82 3dk8 n ASP 316 N -0.16 0.37 0.19 4.85 3.85 -0.60 -4.94 116.55 120.12 3dk8 n ASP 316 Ca -0.10 -1.35 0.14 0.00 -0.71 0.00 0.00 54.79 52.77 3dk8 n ASP 316 Cb 0.61 -0.27 0.60 0.00 -1.35 0.00 0.00 41.12 40.72 3dk8 n ASP 316 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 3dk8 h GLU 317 N 0.00 0.00 -0.72 0.11 4.11 -1.99 -1.76 114.58 114.33 3dk8 h GLU 317 Ca -0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.30 3dk8 h GLU 317 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3dk8 h GLU 317 CO 0.12 0.00 0.00 1.19 0.07 0.00 0.00 179.01 180.39 3dk8 n PHE 318 N -2.52 1.20 -1.28 2.06 3.01 -1.26 -4.52 117.46 114.15 3dk8 n PHE 318 Ca 0.01 -0.54 -0.09 0.00 1.01 0.00 0.00 57.45 57.83 3dk8 n PHE 318 Cb 0.22 -0.10 -0.04 0.00 -0.01 0.00 0.00 39.48 39.55 3dk8 n PHE 318 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3dk8 n GLN 319 N 1.49 -0.90 -2.47 -1.08 1.13 -0.66 -4.93 117.38 109.96 3dk8 n GLN 319 Ca 0.26 0.79 -0.41 0.00 -1.94 0.00 0.00 57.00 55.69 3dk8 n GLN 319 Cb 0.74 -4.77 -0.04 0.00 0.11 0.00 0.00 30.24 26.28 3dk8 n GLN 319 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3dk8 s ASN 320 N -2.69 7.20 1.08 1.08 0.01 -1.26 -1.62 114.94 118.75 3dk8 s ASN 320 Ca 0.00 2.14 -0.13 0.00 -0.71 0.00 0.00 52.86 54.16 3dk8 s ASN 320 Cb 0.00 -2.61 0.19 0.00 0.41 0.00 0.00 41.25 39.24 3dk8 s ASN 320 CO 0.00 -0.27 0.88 0.35 -1.51 0.00 0.00 177.10 176.55 3dk8 n THR 321 N 2.37 0.00 1.28 1.60 -2.24 -0.75 -1.55 114.28 114.99 3dk8 n THR 321 Ca 0.03 -0.54 0.11 0.00 -2.27 0.00 0.00 64.05 61.38 3dk8 n THR 321 Cb 0.46 -1.43 0.63 0.00 -2.10 0.00 0.00 70.33 67.89 3dk8 n THR 321 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3dk8 n ASN 322 N -3.95 0.00 -4.32 3.42 6.94 -1.26 -4.74 115.26 111.35 3dk8 n ASN 322 Ca 0.11 -0.46 -0.34 0.00 -0.02 0.00 0.00 54.58 53.88 3dk8 n ASN 322 Cb 0.42 -0.10 -0.14 0.00 -2.36 0.00 0.00 39.78 37.59 3dk8 n ASN 322 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3dk8 s VAL 323 N -2.21 3.11 0.23 3.53 1.01 -1.26 -5.01 120.40 119.81 3dk8 s VAL 323 Ca 0.29 -0.61 -0.31 0.00 0.00 0.00 0.00 61.98 61.35 3dk8 s VAL 323 Cb 0.15 -2.36 -0.14 0.00 0.00 0.00 0.00 36.38 34.03 3dk8 s VAL 323 CO 0.29 0.48 1.33 0.29 0.00 0.00 0.00 175.10 177.49 3dk8 n LYS 324 N 4.19 1.82 -0.94 2.72 4.01 -1.26 -1.98 118.16 126.71 3dk8 n LYS 324 Ca -0.18 0.65 0.00 0.00 -0.51 0.00 0.00 58.31 58.26 3dk8 n LYS 324 Cb 0.52 -2.25 0.00 0.00 -0.51 0.00 0.00 35.03 32.78 3dk8 n LYS 324 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3dk8 n GLY 325 N 2.00 0.67 3.11 0.72 0.00 -1.26 -4.97 105.19 105.46 3dk8 n GLY 325 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 3dk8 n GLY 325 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dk8 s ILE 326 N -2.58 1.42 0.27 -0.61 1.01 -0.84 -0.93 121.20 118.93 3dk8 s ILE 326 Ca 0.00 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 60.00 3dk8 s ILE 326 Cb 0.00 -1.24 -0.06 0.00 0.01 0.00 0.00 42.46 41.18 3dk8 s ILE 326 CO 0.00 0.41 0.03 -0.31 0.00 0.00 0.00 174.94 175.07 3dk8 s TYR 327 N 0.26 1.70 -0.10 3.97 1.51 -0.31 -1.80 117.35 122.57 3dk8 s TYR 327 Ca -0.09 -0.97 -0.13 0.00 -1.01 0.00 0.00 57.07 54.88 3dk8 s TYR 327 Cb -0.14 -1.03 0.03 0.00 -0.11 0.00 0.00 41.96 40.72 3dk8 s TYR 327 CO 0.03 -0.06 0.34 0.00 -1.11 0.00 0.00 175.55 174.75 3dk8 s ALA 328 N -3.42 -0.84 0.11 3.71 0.00 -0.64 -0.65 121.76 120.04 3dk8 s ALA 328 Ca 0.33 0.81 -0.01 0.00 0.00 0.00 0.00 51.96 53.09 3dk8 s ALA 328 Cb 0.07 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 3dk8 s ALA 328 CO 0.12 -0.19 0.04 0.14 0.00 0.00 0.00 175.76 175.87 3dk8 s VAL 329 N -0.19 0.13 0.00 0.00 -7.23 -0.95 -4.72 120.40 107.44 3dk8 s VAL 329 Ca -0.03 -1.88 0.00 0.00 -1.81 0.00 0.00 61.98 58.26 3dk8 s VAL 329 Cb -0.03 -1.92 0.00 0.00 0.56 0.00 0.00 36.38 34.99 3dk8 s VAL 329 CO 0.01 -0.59 0.00 0.61 -0.31 0.00 0.00 175.10 174.83 3dk8 n GLY 330 N -0.05 -1.21 0.28 2.32 0.00 -1.26 -4.27 105.19 101.00 3dk8 n GLY 330 Ca -0.07 -1.34 0.13 0.00 0.00 0.00 0.00 46.02 44.73 3dk8 n GLY 330 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dk8 h ASP 331 N 2.02 0.00 0.18 1.61 3.45 -1.89 -1.82 116.42 119.97 3dk8 h ASP 331 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3dk8 h ASP 331 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3dk8 h ASP 331 CO 0.00 0.03 0.00 1.62 -1.57 0.00 0.00 179.24 179.32 3dk8 h VAL 332 N 0.00 0.00 0.00 -1.35 3.04 -1.74 -1.51 116.25 114.69 3dk8 h VAL 332 Ca -0.00 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.60 3dk8 h VAL 332 Cb 0.08 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 3dk8 h VAL 332 CO 0.00 0.00 -0.71 0.00 -1.01 0.00 0.00 177.57 175.86 3dk8 n GLY 334 N 1.49 0.54 3.22 0.00 0.00 -0.57 -4.73 105.19 105.14 3dk8 n GLY 334 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 3dk8 n GLY 334 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dk8 s LYS 335 N -0.09 3.15 -0.68 1.61 2.20 -1.26 -4.84 119.74 119.83 3dk8 s LYS 335 Ca 0.00 -0.77 -0.05 0.00 -0.36 0.00 0.00 55.97 54.79 3dk8 s LYS 335 Cb 0.00 -2.62 0.01 0.00 -1.51 0.00 0.00 37.83 33.70 3dk8 s LYS 335 CO 0.00 -0.06 0.67 0.00 -0.36 0.00 0.00 175.35 175.59 3dk8 n ALA 336 N 4.27 -2.63 -2.45 3.13 0.00 -1.26 -4.81 120.51 116.76 3dk8 n ALA 336 Ca -0.20 0.21 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 3dk8 n ALA 336 Cb 0.51 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.09 3dk8 n ALA 336 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dk8 n LEU 337 N -1.54 5.61 -4.08 0.00 4.77 -1.26 -4.74 117.00 115.77 3dk8 n LEU 337 Ca -0.02 -4.17 -0.13 0.00 -0.03 0.00 0.00 56.01 51.66 3dk8 n LEU 337 Cb 0.52 -1.67 -0.11 0.00 -2.33 0.00 0.00 43.42 39.83 3dk8 n LEU 337 CO 0.54 0.62 -0.40 -0.76 -1.33 0.00 0.00 177.39 176.06 3dk8 s LEU 338 N 2.71 2.28 0.09 2.23 1.43 -1.26 -5.07 118.68 121.09 3dk8 s LEU 338 Ca 0.48 -0.60 -0.21 0.00 -1.03 0.00 0.00 54.13 52.78 3dk8 s LEU 338 Cb 0.05 -0.16 -0.11 0.00 0.03 0.00 0.00 46.19 46.00 3dk8 s LEU 338 CO 0.02 -0.23 1.68 0.74 0.23 0.00 0.00 176.35 178.79 3dk8 h THR 339 N 4.34 1.10 0.00 5.49 2.02 -2.01 -2.58 112.91 121.27 3dk8 h THR 339 Ca -0.36 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.51 3dk8 h THR 339 Cb 1.20 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 68.65 3dk8 h THR 339 CO 0.43 0.09 -0.15 -0.65 0.37 0.00 0.00 175.52 175.61 3dk8 h PRO 340 N 0.11 0.00 -0.06 6.66 0.11 -1.98 -1.43 132.00 135.41 3dk8 h PRO 340 Ca 0.05 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.13 3dk8 h PRO 340 Cb 0.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.20 3dk8 h PRO 340 CO -0.01 0.15 -0.06 0.28 -0.21 0.00 0.00 178.00 178.15 3dk8 h VAL 341 N 0.00 1.38 -0.58 3.15 2.07 -1.81 -0.58 116.25 119.89 3dk8 h VAL 341 Ca -0.00 -1.24 0.07 0.00 0.82 0.00 0.00 66.70 66.35 3dk8 h VAL 341 Cb 0.43 2.07 -0.06 0.00 -1.52 0.00 0.00 31.29 32.22 3dk8 h VAL 341 CO 0.02 0.34 0.27 0.00 0.02 0.00 0.00 177.57 178.22 3dk8 h ALA 342 N 0.54 0.75 0.05 1.67 0.00 -1.05 -0.08 119.26 121.13 3dk8 h ALA 342 Ca 0.01 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3dk8 h ALA 342 Cb 0.58 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3dk8 h ALA 342 CO 0.02 -0.11 -0.02 0.82 0.00 0.00 0.00 179.25 179.96 3dk8 h ILE 343 N 0.50 1.03 -0.37 0.00 2.04 -1.26 -0.74 117.51 118.70 3dk8 h ILE 343 Ca 0.27 -0.25 -0.07 0.00 1.00 0.00 0.00 64.86 65.81 3dk8 h ILE 343 Cb 0.24 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 3dk8 h ILE 343 CO -0.22 0.06 -0.05 0.00 0.00 0.00 0.00 178.15 177.95 3dk8 h ALA 344 N 0.77 0.51 -0.87 1.87 0.00 -0.89 0.31 119.26 120.96 3dk8 h ALA 344 Ca -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 3dk8 h ALA 344 Cb 0.15 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3dk8 h ALA 344 CO 0.01 0.32 0.52 0.00 0.00 0.00 0.00 179.25 180.10 3dk8 h ALA 345 N 0.85 1.11 -0.62 0.00 0.00 -0.99 -0.23 119.26 119.38 3dk8 h ALA 345 Ca 0.10 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3dk8 h ALA 345 Cb 0.54 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3dk8 h ALA 345 CO 0.03 0.58 0.09 0.78 0.00 0.00 0.00 179.25 180.73 3dk8 h GLY 346 N 1.20 1.11 0.91 0.00 0.00 -0.77 -1.71 103.07 103.82 3dk8 h GLY 346 Ca 0.31 -0.75 -0.08 0.00 0.00 0.00 0.00 47.33 46.81 3dk8 h GLY 346 CO -0.06 0.70 -0.15 3.21 0.00 0.00 0.00 176.54 180.24 3dk8 h ARG 347 N 0.94 0.61 -0.74 4.80 3.08 -0.73 -2.01 114.38 120.35 3dk8 h ARG 347 Ca 0.19 -0.27 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 3dk8 h ARG 347 Cb 0.45 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 3dk8 h ARG 347 CO 0.01 0.85 0.45 0.87 -1.07 0.00 0.00 179.97 181.09 3dk8 h LYS 348 N 0.36 0.99 -0.36 0.04 1.79 -0.99 -1.85 116.57 116.55 3dk8 h LYS 348 Ca 0.06 -0.08 -0.03 0.00 -2.18 0.00 0.00 60.65 58.42 3dk8 h LYS 348 Cb 0.67 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 31.09 3dk8 h LYS 348 CO 0.04 0.69 0.11 1.25 -1.08 0.00 0.00 179.45 180.46 3dk8 h LEU 349 N 1.01 0.53 -0.91 2.94 5.85 -1.24 -1.67 115.31 121.83 3dk8 h LEU 349 Ca 0.27 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.81 3dk8 h LEU 349 Cb -0.05 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.79 3dk8 h LEU 349 CO -0.05 0.60 0.59 0.00 -0.34 0.00 0.00 178.44 179.24 3dk8 h ALA 350 N 0.95 1.19 -0.47 1.25 0.00 -0.81 -0.65 119.26 120.72 3dk8 h ALA 350 Ca 0.12 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3dk8 h ALA 350 Cb 0.26 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3dk8 h ALA 350 CO -0.00 0.47 -0.08 0.45 0.00 0.00 0.00 179.25 180.08 3dk8 h HIS 351 N 1.16 0.91 -0.06 0.00 3.86 -1.17 0.59 115.15 120.43 3dk8 h HIS 351 Ca 0.36 -0.16 -0.00 0.00 -1.16 0.00 0.00 60.37 59.41 3dk8 h HIS 351 Cb -0.02 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 28.21 3dk8 h HIS 351 CO -0.01 0.87 0.04 -0.09 0.86 0.00 0.00 177.93 179.60 3dk8 h ARG 352 N 0.76 0.09 0.04 2.45 2.43 -0.54 -0.73 114.38 118.87 3dk8 h ARG 352 Ca 0.13 -0.01 -0.25 0.00 -0.81 0.00 0.00 59.98 59.04 3dk8 h ARG 352 Cb 0.57 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.11 3dk8 h ARG 352 CO 0.03 0.09 -1.05 -0.07 -1.51 0.00 0.00 179.97 177.47 3dk8 h LEU 353 N 0.05 0.61 -0.30 3.80 3.38 -1.00 -2.72 115.31 119.13 3dk8 h LEU 353 Ca 0.02 -0.53 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3dk8 h LEU 353 Cb 0.03 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.59 3dk8 h LEU 353 CO -0.00 1.34 -0.13 0.49 0.09 0.00 0.00 178.44 180.23 3dk8 n PHE 354 N -3.73 0.00 0.40 1.13 3.72 0.19 -4.37 117.46 114.79 3dk8 n PHE 354 Ca -0.09 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.36 3dk8 n PHE 354 Cb 0.89 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.45 3dk8 n PHE 354 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3dk8 n GLU 355 N -0.74 1.40 -2.06 -1.08 2.13 -0.34 -4.95 120.64 114.99 3dk8 n GLU 355 Ca 0.01 -0.77 -0.11 0.00 0.66 0.00 0.00 57.16 56.94 3dk8 n GLU 355 Cb 0.07 -1.10 -0.01 0.00 0.27 0.00 0.00 31.44 30.66 3dk8 n GLU 355 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3dk8 n TYR 356 N 0.06 -0.45 -2.91 4.31 4.01 -0.86 -4.94 117.16 116.38 3dk8 n TYR 356 Ca 0.04 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.35 3dk8 n TYR 356 Cb 0.21 -2.55 -0.03 0.00 -0.31 0.00 0.00 39.34 36.66 3dk8 n TYR 356 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3dk8 s LYS 357 N -4.28 3.48 0.59 -0.72 -0.14 -1.08 -4.90 119.74 112.69 3dk8 s LYS 357 Ca 0.00 -1.55 0.37 0.00 -1.36 0.00 0.00 55.97 53.43 3dk8 s LYS 357 Cb 0.00 -4.76 1.81 0.00 -1.68 0.00 0.00 37.83 33.20 3dk8 s LYS 357 CO 0.00 -1.78 2.16 1.05 -0.76 0.00 0.00 175.35 176.02 3dk8 h GLU 358 N 9.01 0.00 -0.48 1.68 9.09 -1.90 -1.52 114.58 130.46 3dk8 h GLU 358 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.46 3dk8 h GLU 358 Cb 1.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.14 3dk8 h GLU 358 CO 1.13 0.02 0.00 -0.40 0.05 0.00 0.00 179.01 179.81 3dk8 n ASP 359 N -3.18 3.33 -4.64 3.06 5.75 -1.26 -4.93 116.55 114.68 3dk8 n ASP 359 Ca -0.01 -1.97 -0.43 0.00 -0.01 0.00 0.00 54.79 52.37 3dk8 n ASP 359 Cb 0.20 -0.32 -0.02 0.00 -1.03 0.00 0.00 41.12 39.95 3dk8 n ASP 359 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3dk8 s SER 360 N -1.29 6.76 0.16 -1.12 0.15 -0.57 -4.96 113.70 112.83 3dk8 s SER 360 Ca 0.41 1.46 -0.24 0.00 0.70 0.00 0.00 55.95 58.29 3dk8 s SER 360 Cb 0.22 -2.54 0.07 0.00 -1.71 0.00 0.00 66.02 62.06 3dk8 s SER 360 CO 0.31 -0.96 0.67 -1.59 1.20 0.00 0.00 173.24 172.87 3dk8 s LYS 361 N 3.92 1.29 -0.05 5.44 -2.85 -1.26 -4.64 119.74 121.59 3dk8 s LYS 361 Ca 0.57 -0.54 -0.22 0.00 -1.00 0.00 0.00 55.97 54.78 3dk8 s LYS 361 Cb -0.20 0.56 -0.04 0.00 -2.06 0.00 0.00 37.83 36.09 3dk8 s LYS 361 CO 0.20 -0.57 0.65 -1.17 0.10 0.00 0.00 175.35 174.56 3dk8 s LEU 362 N -2.75 4.34 -0.26 2.77 2.96 -1.26 -4.99 118.68 119.49 3dk8 s LEU 362 Ca 0.03 1.15 -0.29 0.00 -0.22 0.00 0.00 54.13 54.80 3dk8 s LEU 362 Cb -0.02 -3.00 0.01 0.00 0.50 0.00 0.00 46.19 43.68 3dk8 s LEU 362 CO -0.09 -0.04 1.06 -0.62 -1.32 0.00 0.00 176.35 175.34 3dk8 s ASP 363 N 0.50 7.03 0.00 3.68 -1.08 -1.26 -4.94 116.67 120.60 3dk8 s ASP 363 Ca 0.34 1.27 0.29 0.00 -0.52 0.00 0.00 52.55 53.93 3dk8 s ASP 363 Cb -0.18 -2.54 1.22 0.00 -1.46 0.00 0.00 42.92 39.97 3dk8 s ASP 363 CO 0.17 -0.76 1.84 -1.22 0.52 0.00 0.00 175.17 175.73 3dk8 n TYR 364 N 6.55 0.00 -3.04 -5.34 4.02 -1.26 -4.84 117.16 113.25 3dk8 n TYR 364 Ca 0.12 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.69 3dk8 n TYR 364 Cb 0.46 -0.02 -0.06 0.00 -0.02 0.00 0.00 39.34 39.70 3dk8 n TYR 364 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 3dk8 s ASN 365 N -2.07 6.81 -1.59 7.72 0.01 -1.26 -4.30 114.94 120.27 3dk8 s ASN 365 Ca 0.39 1.39 -0.04 0.00 -0.71 0.00 0.00 52.86 53.89 3dk8 s ASN 365 Cb 0.21 -2.42 0.00 0.00 0.41 0.00 0.00 41.25 39.46 3dk8 s ASN 365 CO 0.36 -0.26 0.51 0.59 -1.51 0.00 0.00 177.10 176.80 3dk8 n ASN 366 N -0.48 -6.09 -4.68 -1.22 5.03 -1.26 -4.97 115.26 101.59 3dk8 n ASN 366 Ca 0.04 -0.24 -0.43 0.00 0.87 0.00 0.00 54.58 54.83 3dk8 n ASN 366 Cb 0.53 -4.93 -0.02 0.00 -1.02 0.00 0.00 39.78 34.34 3dk8 n ASN 366 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3dk8 s ILE 367 N -3.16 4.72 0.47 2.41 1.01 -1.26 -4.77 121.20 120.63 3dk8 s ILE 367 Ca 0.25 2.02 -0.13 0.00 0.00 0.00 0.00 60.65 62.79 3dk8 s ILE 367 Cb -0.11 -4.30 -0.07 0.00 0.01 0.00 0.00 42.46 37.99 3dk8 s ILE 367 CO 0.31 -0.07 0.89 -2.16 0.00 0.00 0.00 174.94 173.91 3dk8 s PRO 368 N 2.48 3.83 -0.09 2.79 0.04 -1.26 -4.51 135.00 138.28 3dk8 s PRO 368 Ca 0.47 0.70 -0.16 0.00 0.04 0.00 0.00 61.00 62.05 3dk8 s PRO 368 Cb -0.17 -2.25 0.04 0.00 0.04 0.00 0.00 34.50 32.15 3dk8 s PRO 368 CO 0.14 -0.19 0.39 -0.08 0.04 0.00 0.00 177.00 177.29 3dk8 s THR 369 N -2.56 0.02 -0.10 1.26 -1.32 -0.46 -5.02 115.64 107.47 3dk8 s THR 369 Ca 0.55 -0.19 0.00 0.00 -1.21 0.00 0.00 61.69 60.84 3dk8 s THR 369 Cb -0.10 -0.62 -0.02 0.00 -1.51 0.00 0.00 72.50 70.24 3dk8 s THR 369 CO 0.34 -0.11 -0.10 -0.69 -2.21 0.00 0.00 174.62 171.85 3dk8 s VAL 370 N -0.53 3.40 -0.18 5.08 1.01 -1.26 -1.55 120.40 126.37 3dk8 s VAL 370 Ca -0.06 -0.57 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 3dk8 s VAL 370 Cb -0.04 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 3dk8 s VAL 370 CO 0.03 0.56 -0.00 -0.69 0.00 0.00 0.00 175.10 174.99 3dk8 s VAL 371 N -0.26 4.04 -1.38 2.92 1.01 -0.27 -4.98 120.40 121.49 3dk8 s VAL 371 Ca 0.03 -0.29 -0.07 0.00 0.00 0.00 0.00 61.98 61.64 3dk8 s VAL 371 Cb -0.13 -2.81 0.09 0.00 0.00 0.00 0.00 36.38 33.53 3dk8 s VAL 371 CO 0.03 0.45 2.38 0.49 0.00 0.00 0.00 175.10 178.45 3dk8 n PHE 372 N 3.90 2.68 -1.26 5.22 3.72 -1.26 -1.20 117.46 129.26 3dk8 n PHE 372 Ca -0.17 -2.87 -0.03 0.00 -0.05 0.00 0.00 57.45 54.32 3dk8 n PHE 372 Cb 0.52 -2.01 0.02 0.00 -0.94 0.00 0.00 39.48 37.07 3dk8 n PHE 372 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3dk8 n SER 373 N 2.72 0.03 -3.87 4.37 2.88 -1.26 -4.67 113.62 113.83 3dk8 n SER 373 Ca 0.60 -1.07 -0.30 0.00 -1.33 0.00 0.00 58.87 56.77 3dk8 n SER 373 Cb 0.27 -0.12 -0.15 0.00 -0.75 0.00 0.00 64.21 63.47 3dk8 n SER 373 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3dk8 s HIS 374 N -1.19 2.73 0.84 0.66 0.09 -1.26 -2.66 115.29 114.50 3dk8 s HIS 374 Ca 0.09 -2.53 -0.12 0.00 -0.00 0.00 0.00 55.06 52.50 3dk8 s HIS 374 Cb -0.00 -2.35 0.10 0.00 -0.00 0.00 0.00 32.58 30.32 3dk8 s HIS 374 CO 0.06 -0.87 1.15 -1.25 -0.00 0.00 0.00 174.74 173.83 3dk8 s PRO 375 N 0.86 1.72 0.75 8.40 0.04 -1.26 -4.78 135.00 140.73 3dk8 s PRO 375 Ca 0.13 0.25 -0.11 0.00 0.04 0.00 0.00 61.00 61.30 3dk8 s PRO 375 Cb -0.20 -1.91 0.04 0.00 0.04 0.00 0.00 34.50 32.47 3dk8 s PRO 375 CO -0.11 -1.79 1.09 -1.25 0.04 0.00 0.00 177.00 174.98 3dk8 s PRO 376 N -5.41 2.39 -0.08 0.56 0.04 -1.09 -4.54 135.00 126.87 3dk8 s PRO 376 Ca 0.62 1.19 0.01 0.00 0.04 0.00 0.00 61.00 62.87 3dk8 s PRO 376 Cb -0.13 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 3dk8 s PRO 376 CO 0.51 -1.54 -0.10 0.42 0.04 0.00 0.00 177.00 176.33 3dk8 s ILE 377 N -2.81 3.45 -0.02 0.56 1.01 -0.34 -1.38 121.20 121.66 3dk8 s ILE 377 Ca 0.62 -0.56 0.05 0.00 0.00 0.00 0.00 60.65 60.75 3dk8 s ILE 377 Cb -0.18 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.88 3dk8 s ILE 377 CO 0.53 0.58 -0.16 -0.83 0.00 0.00 0.00 174.94 175.06 3dk8 s GLY 378 N -0.55 0.79 -0.06 6.18 0.00 -0.20 -1.11 107.32 112.36 3dk8 s GLY 378 Ca 0.08 -0.67 -0.09 0.00 0.00 0.00 0.00 44.72 44.03 3dk8 s GLY 378 CO 0.02 -0.52 0.24 -1.08 0.00 0.00 0.00 173.10 171.75 3dk8 s THR 379 N -0.29 0.02 -0.05 0.90 -1.32 -0.59 -0.97 115.64 113.35 3dk8 s THR 379 Ca 0.04 -0.20 -0.09 0.00 -1.21 0.00 0.00 61.69 60.24 3dk8 s THR 379 Cb -0.07 -0.40 0.02 0.00 -1.51 0.00 0.00 72.50 70.53 3dk8 s THR 379 CO -0.00 -0.11 0.21 0.54 -2.21 0.00 0.00 174.62 173.05 3dk8 s VAL 380 N -0.37 0.04 0.00 5.08 0.11 -0.36 -1.35 120.40 123.54 3dk8 s VAL 380 Ca -0.05 -0.30 0.00 0.00 -2.93 0.00 0.00 61.98 58.71 3dk8 s VAL 380 Cb -0.03 -0.40 0.00 0.00 -1.53 0.00 0.00 36.38 34.41 3dk8 s VAL 380 CO 0.01 -0.16 0.00 0.61 -3.33 0.00 0.00 175.10 172.23 3dk8 n GLY 381 N 2.21 -1.22 3.78 6.54 0.00 -1.26 -1.23 105.19 114.00 3dk8 n GLY 381 Ca -0.17 -1.26 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 3dk8 n GLY 381 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dk8 s LEU 382 N 0.00 4.51 0.87 0.99 1.43 0.27 -4.88 118.68 121.88 3dk8 s LEU 382 Ca 0.00 1.66 -0.11 0.00 -1.03 0.00 0.00 54.13 54.66 3dk8 s LEU 382 Cb 0.00 -3.50 0.12 0.00 0.03 0.00 0.00 46.19 42.84 3dk8 s LEU 382 CO 0.00 0.13 1.11 0.42 0.23 0.00 0.00 176.35 178.24 3dk8 s THR 383 N -1.30 2.62 0.22 5.49 -4.23 -1.26 -4.15 115.64 113.02 3dk8 s THR 383 Ca 0.40 0.20 -0.08 0.00 -1.18 0.00 0.00 61.69 61.03 3dk8 s THR 383 Cb -0.21 -2.46 0.16 0.00 1.34 0.00 0.00 72.50 71.32 3dk8 s THR 383 CO 0.25 -0.26 1.77 -0.08 -0.54 0.00 0.00 174.62 175.76 3dk8 h GLU 384 N -1.60 0.51 -0.39 3.99 4.81 -1.97 -0.39 114.58 119.55 3dk8 h GLU 384 Ca -0.45 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 58.64 3dk8 h GLU 384 Cb 1.26 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 3dk8 h GLU 384 CO 0.47 0.34 -0.21 -0.44 -0.73 0.00 0.00 179.01 178.44 3dk8 h ASP 385 N 0.53 0.78 -0.64 1.04 3.45 -1.99 -0.22 116.42 119.37 3dk8 h ASP 385 Ca 0.32 -0.28 -0.04 0.00 0.43 0.00 0.00 57.03 57.46 3dk8 h ASP 385 Cb 0.35 -0.21 -0.03 0.00 -0.56 0.00 0.00 39.33 38.88 3dk8 h ASP 385 CO -0.27 0.98 0.25 -0.33 -1.57 0.00 0.00 179.24 178.29 3dk8 h GLU 386 N 0.68 0.99 -0.45 3.56 5.08 -1.81 -1.34 114.58 121.29 3dk8 h GLU 386 Ca 0.10 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.17 3dk8 h GLU 386 Cb 0.72 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 3dk8 h GLU 386 CO 0.06 0.82 -0.17 0.00 -1.00 0.00 0.00 179.01 178.71 3dk8 h ALA 387 N 1.30 0.63 -0.73 3.43 0.00 -0.72 -1.46 119.26 121.71 3dk8 h ALA 387 Ca 0.22 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3dk8 h ALA 387 Cb 0.22 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3dk8 h ALA 387 CO -0.02 0.57 0.46 0.82 0.00 0.00 0.00 179.25 181.09 3dk8 h ILE 388 N 0.75 1.20 -0.51 0.00 2.04 -0.78 0.48 117.51 120.69 3dk8 h ILE 388 Ca 0.11 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 3dk8 h ILE 388 Cb 0.73 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 3dk8 h ILE 388 CO 0.06 0.20 0.28 -0.74 0.00 0.00 0.00 178.15 177.95 3dk8 h HIS 389 N 0.99 0.71 -0.10 1.37 2.76 -1.00 0.43 115.15 120.31 3dk8 h HIS 389 Ca 0.26 -0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.36 3dk8 h HIS 389 Cb -0.07 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 28.67 3dk8 h HIS 389 CO -0.02 0.52 -0.15 -0.22 -1.30 0.00 0.00 177.93 176.76 3dk8 h LYS 390 N 0.69 0.29 0.00 5.26 3.64 -0.92 -3.37 116.57 122.15 3dk8 h LYS 390 Ca 0.18 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3dk8 h LYS 390 Cb 0.05 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3dk8 h LYS 390 CO -0.03 0.74 -1.74 0.66 -2.27 0.00 0.00 179.45 176.81 3dk8 n TYR 391 N -4.58 0.00 0.00 1.91 4.02 0.13 -5.10 117.16 113.54 3dk8 n TYR 391 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.82 3dk8 n TYR 391 Cb 0.37 -0.38 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 3dk8 n TYR 391 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dk8 n GLY 392 N 1.35 1.17 0.34 2.72 0.00 0.14 -4.50 105.19 106.42 3dk8 n GLY 392 Ca -0.02 -1.51 0.06 0.00 0.00 0.00 0.00 46.02 44.55 3dk8 n GLY 392 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3dk8 h ILE 393 N 0.00 1.05 0.00 -0.61 2.10 -1.90 -0.38 117.51 117.76 3dk8 h ILE 393 Ca 0.00 -0.25 0.00 0.00 1.08 0.00 0.00 64.86 65.69 3dk8 h ILE 393 Cb 0.00 0.26 0.00 0.00 -1.09 0.00 0.00 36.82 35.99 3dk8 h ILE 393 CO 0.00 0.13 0.00 -0.62 -1.08 0.00 0.00 178.15 176.58 3dk8 n GLU 394 N -4.47 0.03 -0.20 2.19 -0.58 -1.26 -3.08 120.64 113.27 3dk8 n GLU 394 Ca 0.09 0.19 0.06 0.00 -0.42 0.00 0.00 57.16 57.08 3dk8 n GLU 394 Cb 0.19 -1.55 0.15 0.00 -0.57 0.00 0.00 31.44 29.65 3dk8 n GLU 394 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3dk8 n ASN 395 N -1.61 2.95 -4.17 1.62 3.02 -0.16 -4.95 115.26 111.96 3dk8 n ASN 395 Ca 0.05 -2.33 -0.28 0.00 -0.03 0.00 0.00 54.58 51.98 3dk8 n ASN 395 Cb 0.24 -0.28 -0.16 0.00 -0.61 0.00 0.00 39.78 38.97 3dk8 n ASN 395 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3dk8 s VAL 396 N -1.58 1.65 -0.05 2.41 1.01 -1.18 -0.49 120.40 122.18 3dk8 s VAL 396 Ca 0.24 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.43 3dk8 s VAL 396 Cb 0.16 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 35.12 3dk8 s VAL 396 CO 0.10 0.47 -0.15 -0.75 0.00 0.00 0.00 175.10 174.78 3dk8 s LYS 397 N 0.13 1.70 0.09 2.72 2.20 -0.30 -4.99 119.74 121.28 3dk8 s LYS 397 Ca -0.08 -0.51 0.06 0.00 -0.36 0.00 0.00 55.97 55.08 3dk8 s LYS 397 Cb -0.14 -1.44 -0.04 0.00 -1.51 0.00 0.00 37.83 34.70 3dk8 s LYS 397 CO 0.04 0.15 -0.09 0.95 -0.36 0.00 0.00 175.35 176.03 3dk8 s THR 398 N 0.29 3.41 -0.02 3.43 -4.23 -1.26 -0.59 115.64 116.67 3dk8 s THR 398 Ca -0.08 -1.19 0.06 0.00 -1.18 0.00 0.00 61.69 59.30 3dk8 s THR 398 Cb -0.13 -2.58 -0.01 0.00 1.34 0.00 0.00 72.50 71.12 3dk8 s THR 398 CO 0.03 0.16 -0.20 -0.31 -0.54 0.00 0.00 174.62 173.76 3dk8 s TYR 399 N -1.18 1.79 0.12 3.99 1.51 -0.35 -5.00 117.35 118.23 3dk8 s TYR 399 Ca 0.21 -0.38 -0.10 0.00 -1.01 0.00 0.00 57.07 55.79 3dk8 s TYR 399 Cb -0.11 -1.16 0.00 0.00 -0.11 0.00 0.00 41.96 40.58 3dk8 s TYR 399 CO 0.13 -0.06 0.26 -1.54 -1.11 0.00 0.00 175.55 173.23 3dk8 s SER 400 N -0.37 0.04 0.10 2.29 1.04 -1.26 -0.67 113.70 114.86 3dk8 s SER 400 Ca 0.05 -0.67 -0.09 0.00 0.48 0.00 0.00 55.95 55.72 3dk8 s SER 400 Cb -0.09 0.40 -0.00 0.00 0.10 0.00 0.00 66.02 66.43 3dk8 s SER 400 CO -0.00 -0.81 0.20 0.28 0.98 0.00 0.00 173.24 173.89 3dk8 s THR 401 N -3.89 0.14 -0.02 2.02 -1.32 -0.47 -4.94 115.64 107.16 3dk8 s THR 401 Ca 0.09 -1.19 -0.00 0.00 -1.21 0.00 0.00 61.69 59.38 3dk8 s THR 401 Cb 0.04 -1.38 0.03 0.00 -1.51 0.00 0.00 72.50 69.68 3dk8 s THR 401 CO -0.07 -0.62 0.03 -0.55 -2.21 0.00 0.00 174.62 171.20 3dk8 s SER 402 N -2.87 0.05 0.19 8.08 0.15 -1.26 -1.39 113.70 116.65 3dk8 s SER 402 Ca 0.06 0.04 -0.16 0.00 0.70 0.00 0.00 55.95 56.59 3dk8 s SER 402 Cb 0.05 -0.05 0.02 0.00 -1.71 0.00 0.00 66.02 64.33 3dk8 s SER 402 CO -0.10 -0.11 0.49 0.72 1.20 0.00 0.00 173.24 175.43 3dk8 s PHE 403 N 0.93 -0.03 -0.29 3.44 -0.71 -0.31 -5.00 117.98 116.01 3dk8 s PHE 403 Ca -0.08 -0.31 -0.14 0.00 -1.04 0.00 0.00 56.93 55.36 3dk8 s PHE 403 Cb -0.11 0.32 -0.04 0.00 -1.21 0.00 0.00 43.02 41.98 3dk8 s PHE 403 CO -0.03 -0.89 0.30 0.99 -1.34 0.00 0.00 175.22 174.26 3dk8 s THR 404 N -3.89 5.22 0.53 -4.49 2.01 -1.26 -0.35 115.64 113.40 3dk8 s THR 404 Ca 0.11 0.31 -0.22 0.00 0.31 0.00 0.00 61.69 62.20 3dk8 s THR 404 Cb -0.00 -3.66 -0.06 0.00 0.01 0.00 0.00 72.50 68.78 3dk8 s THR 404 CO -0.02 0.14 1.17 -2.65 -0.69 0.00 0.00 174.62 172.56 3dk8 n PRO 405 N 5.24 1.42 0.19 4.92 -0.02 -1.26 -4.87 135.00 140.62 3dk8 n PRO 405 Ca -0.11 0.52 0.14 0.00 -2.02 0.00 0.00 63.50 62.04 3dk8 n PRO 405 Cb 0.51 -2.33 0.64 0.00 -0.02 0.00 0.00 33.50 32.30 3dk8 n PRO 405 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 3dk8 h MET 406 N 1.25 0.00 -1.01 -0.52 4.05 -1.97 -0.68 114.93 116.04 3dk8 h MET 406 Ca -0.49 0.00 0.25 0.00 -0.28 0.00 0.00 59.70 59.18 3dk8 h MET 406 Cb 1.33 0.00 -0.12 0.00 -0.80 0.00 0.00 31.60 32.01 3dk8 h MET 406 CO 0.55 0.00 0.61 -0.92 0.23 0.00 0.00 176.91 177.38 3dk8 h TYR 407 N 0.00 0.96 -0.18 1.39 3.20 -2.01 -0.98 116.97 119.35 3dk8 h TYR 407 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3dk8 h TYR 407 Cb 0.25 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.24 3dk8 h TYR 407 CO 0.00 0.06 0.00 0.72 -1.64 0.00 0.00 178.16 177.30 3dk8 n HIS 408 N -4.85 0.23 0.22 -3.82 8.25 -0.26 -4.17 115.22 110.82 3dk8 n HIS 408 Ca 0.27 -0.12 0.16 0.00 -0.26 0.00 0.00 57.72 57.77 3dk8 n HIS 408 Cb 0.77 0.00 0.82 0.00 1.12 0.00 0.00 29.99 32.70 3dk8 n HIS 408 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dk8 h ALA 409 N 3.88 1.81 -0.08 -1.41 0.00 -1.29 -2.65 119.26 119.52 3dk8 h ALA 409 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dk8 h ALA 409 Cb 0.41 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3dk8 h ALA 409 CO 0.00 -0.22 0.00 1.33 0.00 0.00 0.00 179.25 180.36 3dk8 n VAL 410 N -3.93 0.39 -4.14 0.00 0.24 -1.26 -5.02 118.33 104.61 3dk8 n VAL 410 Ca 0.01 -0.69 -0.30 0.00 -2.04 0.00 0.00 64.34 61.31 3dk8 n VAL 410 Cb 0.26 0.89 -0.08 0.00 -1.47 0.00 0.00 33.84 33.44 3dk8 n VAL 410 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3dk8 s THR 411 N -0.72 3.97 0.12 3.34 -4.23 -1.00 -4.72 115.64 112.41 3dk8 s THR 411 Ca 0.10 -1.03 0.04 0.00 -1.18 0.00 0.00 61.69 59.61 3dk8 s THR 411 Cb 0.06 -2.90 -0.21 0.00 1.34 0.00 0.00 72.50 70.79 3dk8 s THR 411 CO 0.08 0.10 1.28 0.11 -0.54 0.00 0.00 174.62 175.65 3dk8 h LYS 412 N 3.38 0.09 -6.91 3.99 1.57 -1.95 -3.45 116.57 113.29 3dk8 h LYS 412 Ca -0.48 -0.14 -0.48 0.00 -1.87 0.00 0.00 60.65 57.68 3dk8 h LYS 412 Cb 1.17 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.53 3dk8 h LYS 412 CO 0.59 1.03 0.39 0.50 -0.57 0.00 0.00 179.45 181.39 3dk8 s ARG 413 N -2.81 4.40 0.04 3.15 3.52 -1.26 -5.07 118.95 120.92 3dk8 s ARG 413 Ca -0.01 1.47 0.03 0.00 -0.13 0.00 0.00 55.73 57.09 3dk8 s ARG 413 Cb 0.09 -2.73 -0.02 0.00 -1.56 0.00 0.00 34.95 30.73 3dk8 s ARG 413 CO 0.83 0.08 -0.10 0.15 -0.81 0.00 0.00 175.30 175.45 3dk8 s LYS 414 N -2.18 0.67 0.14 5.12 -0.14 -1.26 -4.91 119.74 117.17 3dk8 s LYS 414 Ca 0.53 -0.71 0.05 0.00 -1.36 0.00 0.00 55.97 54.48 3dk8 s LYS 414 Cb -0.22 -0.57 -0.04 0.00 -1.68 0.00 0.00 37.83 35.32 3dk8 s LYS 414 CO 0.27 0.13 -0.11 0.95 -0.76 0.00 0.00 175.35 175.83 3dk8 s THR 415 N -1.04 1.22 0.26 2.17 -4.23 -1.26 -5.05 115.64 107.70 3dk8 s THR 415 Ca -0.04 -1.91 0.07 0.00 -1.18 0.00 0.00 61.69 58.63 3dk8 s THR 415 Cb -0.08 -1.70 -0.03 0.00 1.34 0.00 0.00 72.50 72.02 3dk8 s THR 415 CO 0.01 -0.62 0.21 -0.75 -0.54 0.00 0.00 174.62 172.93 3dk8 s LYS 416 N -3.30 2.90 -0.09 3.99 2.20 -1.26 -4.35 119.74 119.82 3dk8 s LYS 416 Ca 0.13 -1.09 0.04 0.00 -0.36 0.00 0.00 55.97 54.69 3dk8 s LYS 416 Cb -0.01 -2.55 -0.01 0.00 -1.51 0.00 0.00 37.83 33.76 3dk8 s LYS 416 CO 0.02 0.36 -0.22 0.00 -0.36 0.00 0.00 175.35 175.15 3dk8 s VAL 418 N 0.18 1.73 0.00 0.00 -7.23 -0.45 -1.17 120.40 113.47 3dk8 s VAL 418 Ca -0.13 -0.95 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 3dk8 s VAL 418 Cb -0.16 -1.44 -0.00 0.00 0.56 0.00 0.00 36.38 35.33 3dk8 s VAL 418 CO 0.07 0.48 -0.01 -0.04 -0.31 0.00 0.00 175.10 175.29 3dk8 s MET 419 N -0.55 0.10 -0.04 4.82 -1.94 -0.49 -1.36 119.30 119.85 3dk8 s MET 419 Ca 0.08 -0.11 0.01 0.00 -1.71 0.00 0.00 55.69 53.97 3dk8 s MET 419 Cb -0.08 -0.04 0.02 0.00 2.01 0.00 0.00 34.83 36.74 3dk8 s MET 419 CO -0.01 0.01 -0.02 0.21 -0.01 0.00 0.00 175.02 175.20 3dk8 s LYS 420 N -0.21 0.52 -0.16 2.03 2.20 0.17 -1.36 119.74 122.93 3dk8 s LYS 420 Ca -0.02 -0.00 -0.03 0.00 -0.36 0.00 0.00 55.97 55.56 3dk8 s LYS 420 Cb -0.02 -0.63 -0.02 0.00 -1.51 0.00 0.00 37.83 35.65 3dk8 s LYS 420 CO -0.00 -0.11 -0.06 1.41 -0.36 0.00 0.00 175.35 176.23 3dk8 s MET 421 N 0.97 3.55 -0.24 4.03 -2.45 0.15 -1.20 119.30 124.12 3dk8 s MET 421 Ca -0.11 -0.58 -0.06 0.00 -1.25 0.00 0.00 55.69 53.70 3dk8 s MET 421 Cb -0.14 -2.86 -0.02 0.00 1.25 0.00 0.00 34.83 33.06 3dk8 s MET 421 CO -0.01 0.17 0.03 0.08 1.05 0.00 0.00 175.02 176.34 3dk8 s VAL 422 N 0.53 3.97 0.04 10.11 1.01 -0.08 -1.22 120.40 134.75 3dk8 s VAL 422 Ca -0.05 -0.29 0.08 0.00 0.00 0.00 0.00 61.98 61.73 3dk8 s VAL 422 Cb -0.15 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 3dk8 s VAL 422 CO 0.03 0.37 -0.23 0.00 0.00 0.00 0.00 175.10 175.27 3dk8 s ALA 424 N -0.83 2.21 0.23 0.00 0.00 0.05 -1.15 121.76 122.27 3dk8 s ALA 424 Ca 0.13 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.86 3dk8 s ALA 424 Cb -0.10 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.53 3dk8 s ALA 424 CO 0.03 0.53 0.00 0.09 0.00 0.00 0.00 175.76 176.41 3dk8 n ASN 425 N 1.95 -6.37 -0.02 0.00 5.03 0.36 -1.53 115.26 114.68 3dk8 n ASN 425 Ca -0.17 1.05 -0.01 0.00 0.87 0.00 0.00 54.58 56.32 3dk8 n ASN 425 Cb 0.52 -2.95 0.27 0.00 -1.02 0.00 0.00 39.78 36.60 3dk8 n ASN 425 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 3dk8 h LYS 426 N 0.00 0.57 0.00 3.52 3.64 -1.99 -0.98 116.57 121.33 3dk8 h LYS 426 Ca 0.02 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3dk8 h LYS 426 Cb 0.89 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 3dk8 h LYS 426 CO 0.01 0.60 0.00 -0.85 -2.27 0.00 0.00 179.45 176.94 3dk8 n GLU 427 N -4.26 0.31 -3.68 1.90 0.28 -1.26 -4.92 120.64 109.01 3dk8 n GLU 427 Ca 0.02 0.07 -0.22 0.00 -0.16 0.00 0.00 57.16 56.87 3dk8 n GLU 427 Cb 0.26 -1.50 0.03 0.00 1.43 0.00 0.00 31.44 31.67 3dk8 n GLU 427 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3dk8 n GLU 428 N -1.29 -4.46 -1.69 3.44 1.02 -0.37 -4.32 120.64 112.96 3dk8 n GLU 428 Ca 0.11 0.62 -0.45 0.00 -0.02 0.00 0.00 57.16 57.42 3dk8 n GLU 428 Cb 0.18 -5.12 -0.04 0.00 -0.02 0.00 0.00 31.44 26.45 3dk8 n GLU 428 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3dk8 n LYS 429 N -4.21 2.38 -2.59 3.49 4.81 -0.58 -0.82 118.16 120.64 3dk8 n LYS 429 Ca -0.27 0.86 -0.42 0.00 -0.87 0.00 0.00 58.31 57.60 3dk8 n LYS 429 Cb 0.67 -2.66 -0.02 0.00 0.02 0.00 0.00 35.03 33.03 3dk8 n LYS 429 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3dk8 s VAL 430 N 1.11 4.04 -1.16 3.15 1.01 0.24 -0.77 120.40 128.02 3dk8 s VAL 430 Ca 0.78 0.92 0.18 0.00 0.00 0.00 0.00 61.98 63.86 3dk8 s VAL 430 Cb -0.61 -4.72 -0.13 0.00 0.00 0.00 0.00 36.38 30.92 3dk8 s VAL 430 CO 0.36 -1.31 0.83 1.33 0.00 0.00 0.00 175.10 176.30 3dk8 n VAL 431 N 6.68 0.00 -3.64 2.92 0.24 0.17 -4.76 118.33 119.94 3dk8 n VAL 431 Ca 0.09 -0.16 -0.15 0.00 -2.04 0.00 0.00 64.34 62.08 3dk8 n VAL 431 Cb 0.49 1.08 -0.08 0.00 -1.47 0.00 0.00 33.84 33.86 3dk8 n VAL 431 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3dk8 s GLY 432 N -2.48 -0.46 -0.05 7.63 0.00 -1.07 -0.56 107.32 110.32 3dk8 s GLY 432 Ca 0.10 1.49 0.02 0.00 0.00 0.00 0.00 44.72 46.32 3dk8 s GLY 432 CO 0.64 1.22 -0.08 -0.42 0.00 0.00 0.00 173.10 174.46 3dk8 s ILE 433 N -0.21 0.83 -0.03 0.90 1.01 -0.37 -0.91 121.20 122.43 3dk8 s ILE 433 Ca -0.04 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.31 3dk8 s ILE 433 Cb -0.03 -0.79 0.03 0.00 0.01 0.00 0.00 42.46 41.68 3dk8 s ILE 433 CO 0.03 0.29 0.01 -1.00 0.00 0.00 0.00 174.94 174.27 3dk8 s HIS 434 N 0.75 0.22 0.08 3.97 3.76 -0.34 -1.23 115.29 122.51 3dk8 s HIS 434 Ca -0.13 0.04 -0.18 0.00 -0.15 0.00 0.00 55.06 54.64 3dk8 s HIS 434 Cb -0.15 -0.35 0.04 0.00 1.11 0.00 0.00 32.58 33.23 3dk8 s HIS 434 CO 0.02 -0.12 0.43 0.00 -0.85 0.00 0.00 174.74 174.22 3dk8 s MET 435 N 1.03 1.01 -0.03 1.40 0.23 -0.14 -0.65 119.30 122.14 3dk8 s MET 435 Ca -0.10 -0.48 -0.01 0.00 -1.03 0.00 0.00 55.69 54.07 3dk8 s MET 435 Cb -0.13 0.45 0.02 0.00 -1.53 0.00 0.00 34.83 33.64 3dk8 s MET 435 CO -0.02 -0.37 0.07 -1.14 -2.03 0.00 0.00 175.02 171.53 3dk8 s GLN 436 N -3.04 0.04 0.00 3.16 0.74 -0.46 -1.04 119.66 119.06 3dk8 s GLN 436 Ca -0.02 0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.59 3dk8 s GLN 436 Cb 0.00 -0.13 0.00 0.00 1.10 0.00 0.00 33.01 33.99 3dk8 s GLN 436 CO -0.06 -0.11 0.00 0.41 -0.55 0.00 0.00 175.29 174.98 3dk8 n GLY 437 N 3.77 2.34 3.65 2.59 0.00 -0.48 -1.34 105.19 115.72 3dk8 n GLY 437 Ca -0.22 -0.96 -0.47 0.00 0.00 0.00 0.00 46.02 44.37 3dk8 n GLY 437 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dk8 n LEU 438 N 0.00 2.80 0.00 0.99 4.77 -1.26 -1.62 117.00 122.69 3dk8 n LEU 438 Ca 0.00 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 57.07 3dk8 n LEU 438 Cb 0.00 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 39.71 3dk8 n LEU 438 CO 0.00 -0.44 0.00 0.61 -1.33 0.00 0.00 177.39 176.23 3dk8 n GLY 439 N 3.25 1.73 0.26 -0.72 0.00 -1.26 -4.90 105.19 103.54 3dk8 n GLY 439 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 3dk8 n GLY 439 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk8 h ASP 441 N 0.00 1.04 0.27 0.00 2.03 -1.84 -3.06 116.42 114.87 3dk8 h ASP 441 Ca -0.00 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 3dk8 h ASP 441 Cb 0.43 -0.22 0.00 0.00 -0.83 0.00 0.00 39.33 38.71 3dk8 h ASP 441 CO 0.02 0.67 -0.97 -0.62 -1.03 0.00 0.00 179.24 177.31 3dk8 n GLU 442 N -4.50 0.16 0.06 4.15 -0.58 -0.85 -4.39 120.64 114.70 3dk8 n GLU 442 Ca 0.15 -0.01 -0.06 0.00 -0.42 0.00 0.00 57.16 56.82 3dk8 n GLU 442 Cb 0.17 -1.54 -0.10 0.00 -0.57 0.00 0.00 31.44 29.40 3dk8 n GLU 442 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 3dk8 h MET 443 N 0.00 0.00 -0.14 3.49 4.05 -1.29 -3.39 114.93 117.65 3dk8 h MET 443 Ca 0.00 0.00 -0.19 0.00 -0.28 0.00 0.00 59.70 59.23 3dk8 h MET 443 Cb 0.62 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.42 3dk8 h MET 443 CO 0.00 0.90 -0.68 1.25 0.23 0.00 0.00 176.91 178.60 3dk8 h LEU 444 N 0.00 0.66 -0.58 3.39 5.85 -1.75 -3.35 115.31 119.53 3dk8 h LEU 444 Ca -0.03 -0.41 0.09 0.00 0.84 0.00 0.00 57.88 58.38 3dk8 h LEU 444 Cb 1.74 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 42.50 3dk8 h LEU 444 CO 0.12 1.16 0.19 -0.61 -0.34 0.00 0.00 178.44 178.96 3dk8 h GLN 445 N 0.41 0.35 -0.46 1.25 5.75 -1.86 -0.20 115.11 120.35 3dk8 h GLN 445 Ca -0.02 -0.02 -0.11 0.00 -0.15 0.00 0.00 58.65 58.35 3dk8 h GLN 445 Cb 1.26 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.72 3dk8 h GLN 445 CO 0.13 0.23 -0.13 0.78 -2.65 0.00 0.00 178.83 177.19 3dk8 h GLY 446 N 0.36 0.94 1.47 2.39 0.00 -1.87 -2.13 103.07 104.24 3dk8 h GLY 446 Ca 0.29 -0.75 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 3dk8 h GLY 446 CO -0.32 0.69 0.13 0.74 0.00 0.00 0.00 176.54 177.78 3dk8 h PHE 447 N 0.78 0.68 -0.71 5.60 -1.00 -1.41 -2.31 116.94 118.56 3dk8 h PHE 447 Ca 0.12 -0.04 -0.04 0.00 2.81 0.00 0.00 57.97 60.81 3dk8 h PHE 447 Cb 0.65 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.98 3dk8 h PHE 447 CO 0.04 0.57 0.28 0.00 -1.61 0.00 0.00 178.31 177.58 3dk8 h ALA 448 N 1.49 1.14 -0.57 2.45 0.00 -0.46 -0.77 119.26 122.54 3dk8 h ALA 448 Ca 0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3dk8 h ALA 448 Cb 0.22 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3dk8 h ALA 448 CO -0.01 0.61 0.33 0.28 0.00 0.00 0.00 179.25 180.46 3dk8 h VAL 449 N 1.04 1.18 -0.49 0.00 2.07 -0.88 -0.73 116.25 118.44 3dk8 h VAL 449 Ca 0.24 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 3dk8 h VAL 449 Cb 0.21 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 3dk8 h VAL 449 CO -0.02 0.19 0.27 0.00 0.02 0.00 0.00 177.57 178.03 3dk8 h ALA 450 N 1.15 0.62 -0.28 1.67 0.00 -1.05 -1.78 119.26 119.60 3dk8 h ALA 450 Ca 0.20 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3dk8 h ALA 450 Cb 0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3dk8 h ALA 450 CO -0.03 0.14 0.16 0.28 0.00 0.00 0.00 179.25 179.80 3dk8 h VAL 451 N 0.64 1.11 -0.43 0.00 2.07 -0.98 -1.73 116.25 116.93 3dk8 h VAL 451 Ca 0.17 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.47 3dk8 h VAL 451 Cb 0.05 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 3dk8 h VAL 451 CO -0.03 0.11 0.29 0.50 0.02 0.00 0.00 177.57 178.46 3dk8 h LYS 452 N 0.34 0.32 0.00 1.57 1.63 -0.85 -0.75 116.57 118.83 3dk8 h LYS 452 Ca 0.10 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 3dk8 h LYS 452 Cb 0.04 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.60 3dk8 h LYS 452 CO -0.02 0.21 0.00 -1.33 -3.45 0.00 0.00 179.45 174.86 3dk8 n MET 453 N -4.47 0.40 -1.56 1.90 2.81 -0.70 -4.92 117.12 110.58 3dk8 n MET 453 Ca 0.06 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 3dk8 n MET 453 Cb 0.26 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 3dk8 n MET 453 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dk8 n GLY 454 N 0.88 0.73 3.65 3.03 0.00 -0.29 -5.01 105.19 108.18 3dk8 n GLY 454 Ca 0.13 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 45.05 3dk8 n GLY 454 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk8 n ALA 455 N -1.01 0.60 -2.19 4.61 0.00 -0.69 -4.78 120.51 117.06 3dk8 n ALA 455 Ca 0.00 0.17 -0.20 0.00 0.00 0.00 0.00 53.44 53.41 3dk8 n ALA 455 Cb 0.39 -2.16 -0.02 0.00 0.00 0.00 0.00 19.45 17.65 3dk8 n ALA 455 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3dk8 s THR 456 N -1.32 2.67 0.32 0.00 -4.23 -1.26 -0.59 115.64 111.22 3dk8 s THR 456 Ca 0.66 -1.29 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 3dk8 s THR 456 Cb -0.49 -2.96 0.23 0.00 1.34 0.00 0.00 72.50 70.62 3dk8 s THR 456 CO 0.54 0.00 1.95 0.50 -0.54 0.00 0.00 174.62 177.07 3dk8 h LYS 457 N 0.95 0.88 -0.73 3.99 1.63 -1.17 -1.04 116.57 121.08 3dk8 h LYS 457 Ca -0.41 -0.09 0.06 0.00 -0.85 0.00 0.00 60.65 59.37 3dk8 h LYS 457 Cb 1.27 -0.18 -0.05 0.00 -0.60 0.00 0.00 32.23 32.67 3dk8 h LYS 457 CO 0.55 0.64 0.48 0.00 -3.45 0.00 0.00 179.45 177.67 3dk8 h ALA 458 N 1.51 1.70 -0.67 5.00 0.00 -1.84 -0.17 119.26 124.78 3dk8 h ALA 458 Ca 0.23 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 3dk8 h ALA 458 Cb 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3dk8 h ALA 458 CO -0.04 0.19 0.18 -0.44 0.00 0.00 0.00 179.25 179.14 3dk8 h ASP 459 N 0.76 0.98 -0.13 0.00 3.32 -1.58 0.02 116.42 119.80 3dk8 h ASP 459 Ca 0.31 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 3dk8 h ASP 459 Cb 0.25 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 3dk8 h ASP 459 CO -0.10 0.93 0.01 -0.26 -1.72 0.00 0.00 179.24 178.10 3dk8 h PHE 460 N 1.00 0.23 0.00 4.55 -1.00 -1.13 -3.15 116.94 117.44 3dk8 h PHE 460 Ca 0.22 -0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.94 3dk8 h PHE 460 Cb 0.32 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.82 3dk8 h PHE 460 CO 0.02 0.44 -0.09 -0.44 -1.61 0.00 0.00 178.31 176.62 3dk8 h ASP 461 N -0.04 0.00 0.67 2.17 3.32 -0.80 -1.44 116.42 120.31 3dk8 h ASP 461 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3dk8 h ASP 461 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3dk8 h ASP 461 CO 0.00 0.09 0.00 0.59 -1.72 0.00 0.00 179.24 178.21 3dk8 n ASN 462 N -3.24 0.00 -4.68 6.45 3.02 -0.03 -4.76 115.26 112.02 3dk8 n ASN 462 Ca 0.00 0.11 -0.38 0.00 -0.03 0.00 0.00 54.58 54.29 3dk8 n ASN 462 Cb 0.35 -0.36 -0.08 0.00 -0.61 0.00 0.00 39.78 39.08 3dk8 n ASN 462 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3dk8 s THR 463 N -2.73 5.23 0.25 3.41 2.01 -0.55 -5.04 115.64 118.23 3dk8 s THR 463 Ca 0.21 0.64 -0.30 0.00 0.31 0.00 0.00 61.69 62.56 3dk8 s THR 463 Cb 0.18 -3.69 -0.10 0.00 0.01 0.00 0.00 72.50 68.90 3dk8 s THR 463 CO 0.45 0.29 1.35 -0.69 -0.69 0.00 0.00 174.62 175.33 3dk8 s VAL 464 N 1.12 2.90 0.77 3.82 1.01 -1.26 -4.98 120.40 123.78 3dk8 s VAL 464 Ca 0.18 0.78 -0.12 0.00 0.00 0.00 0.00 61.98 62.82 3dk8 s VAL 464 Cb -0.14 -3.50 0.06 0.00 0.00 0.00 0.00 36.38 32.80 3dk8 s VAL 464 CO 0.07 0.14 1.12 0.00 0.00 0.00 0.00 175.10 176.43 3dk8 s ALA 465 N -0.26 2.13 -0.22 5.51 0.00 -1.26 -5.06 121.76 122.61 3dk8 s ALA 465 Ca 0.55 0.46 -0.04 0.00 0.00 0.00 0.00 51.96 52.94 3dk8 s ALA 465 Cb -0.39 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.37 3dk8 s ALA 465 CO 0.44 -1.87 -0.03 0.42 0.00 0.00 0.00 175.76 174.72 3dk8 s ILE 466 N -2.62 3.54 0.02 0.00 1.01 -1.26 -5.09 121.20 116.80 3dk8 s ILE 466 Ca 0.65 -0.44 0.08 0.00 0.00 0.00 0.00 60.65 60.94 3dk8 s ILE 466 Cb -0.20 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.63 3dk8 s ILE 466 CO 0.52 0.42 -0.24 -2.28 0.00 0.00 0.00 174.94 173.36 3dk8 s HIS 467 N 1.38 2.10 -0.21 3.97 2.46 -1.26 -3.44 115.29 120.29 3dk8 s HIS 467 Ca 0.05 -0.40 -0.20 0.00 0.47 0.00 0.00 55.06 54.98 3dk8 s HIS 467 Cb -0.14 -1.29 -0.02 0.00 -0.13 0.00 0.00 32.58 30.99 3dk8 s HIS 467 CO -0.01 0.05 0.61 -1.25 -2.47 0.00 0.00 174.74 171.67 3dk8 s PRO 468 N -0.94 4.18 0.14 2.88 0.05 -1.26 -5.18 135.00 134.86 3dk8 s PRO 468 Ca 0.10 0.56 -0.04 0.00 0.05 0.00 0.00 61.00 61.67 3dk8 s PRO 468 Cb -0.09 -3.60 -0.03 0.00 0.05 0.00 0.00 34.50 30.83 3dk8 s PRO 468 CO 0.01 -0.28 0.13 0.95 0.05 0.00 0.00 177.00 177.87 3dk8 s THR 469 N 2.04 0.09 0.18 1.26 -4.23 -1.22 -5.04 115.64 108.72 3dk8 s THR 469 Ca 0.27 -1.72 -0.03 0.00 -1.18 0.00 0.00 61.69 59.04 3dk8 s THR 469 Cb -0.16 -1.96 -0.09 0.00 1.34 0.00 0.00 72.50 71.63 3dk8 s THR 469 CO 0.10 -0.42 1.45 0.28 -0.54 0.00 0.00 174.62 175.48 3dk8 h SER 470 N 2.76 0.54 -0.05 3.99 0.02 -1.90 -3.33 113.55 115.58 3dk8 h SER 470 Ca -0.34 -0.34 0.02 0.00 -0.84 0.00 0.00 61.79 60.29 3dk8 h SER 470 Cb 1.21 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.59 3dk8 h SER 470 CO 0.55 1.07 0.04 0.77 -1.14 0.00 0.00 176.83 178.12 3dk8 h SER 471 N 0.33 0.00 0.32 3.07 4.64 -1.93 -1.32 113.55 118.66 3dk8 h SER 471 Ca -0.02 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 3dk8 h SER 471 Cb 1.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3dk8 h SER 471 CO 0.12 0.00 -0.05 1.05 -0.87 0.00 0.00 176.83 177.08 3dk8 h GLU 472 N 0.00 0.00 0.00 4.77 4.11 -1.75 -2.18 114.58 119.52 3dk8 h GLU 472 Ca 0.03 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.45 3dk8 h GLU 472 Cb 0.10 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 3dk8 h GLU 472 CO -0.00 0.05 -0.04 0.93 0.07 0.00 0.00 179.01 180.02 3dk8 h GLU 473 N 0.00 0.00 0.00 1.06 4.39 -1.47 -2.09 114.58 116.47 3dk8 h GLU 473 Ca -0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 3dk8 h GLU 473 Cb 0.22 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 3dk8 h GLU 473 CO 0.01 0.04 -0.18 1.25 -1.16 0.00 0.00 179.01 178.97 3dk8 h LEU 474 N 0.00 0.00 -2.58 1.33 5.85 -1.59 -3.04 115.31 115.29 3dk8 h LEU 474 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3dk8 h LEU 474 Cb 0.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3dk8 h LEU 474 CO 0.01 0.18 0.00 1.33 -0.34 0.00 0.00 178.44 179.61 3dk8 n VAL 475 N -3.20 0.79 -1.65 1.05 0.24 -0.80 -4.43 118.33 110.33 3dk8 n VAL 475 Ca 0.02 -0.90 0.05 0.00 -2.04 0.00 0.00 64.34 61.47 3dk8 n VAL 475 Cb 0.52 0.71 0.07 0.00 -1.47 0.00 0.00 33.84 33.66 3dk8 n VAL 475 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 3dk8 n THR 476 N 1.61 0.86 -2.27 3.34 5.66 -1.11 -4.36 114.28 118.02 3dk8 n THR 476 Ca 0.23 -1.15 -0.40 0.00 -3.05 0.00 0.00 64.05 59.68 3dk8 n THR 476 Cb 0.62 0.21 -0.03 0.00 -1.55 0.00 0.00 70.33 69.58 3dk8 n THR 476 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 3dk8 s LEU 477 N -1.31 4.38 0.00 1.09 1.43 -1.21 -5.04 118.68 118.01 3dk8 s LEU 477 Ca 0.17 2.46 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 3dk8 s LEU 477 Cb 0.16 -3.78 0.00 0.00 0.03 0.00 0.00 46.19 42.60 3dk8 s LEU 477 CO -0.01 -0.49 0.09 0.54 0.23 0.00 0.00 176.35 176.72