#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dk9 s VAL 18 N 0.00 1.01 0.10 0.00 0.11 -1.26 -4.16 120.40 116.19 3dk9 s VAL 18 Ca 0.00 -0.28 -0.25 0.00 -2.93 0.00 0.00 61.98 58.52 3dk9 s VAL 18 Cb 0.00 -1.03 -0.07 0.00 -1.53 0.00 0.00 36.38 33.76 3dk9 s VAL 18 CO 0.00 0.36 0.75 0.00 -3.33 0.00 0.00 175.10 172.89 3dk9 s ALA 19 N 1.66 3.42 -0.06 1.54 0.00 -1.01 -4.90 121.76 122.41 3dk9 s ALA 19 Ca 0.04 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.30 3dk9 s ALA 19 Cb -0.13 -2.95 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 3dk9 s ALA 19 CO -0.08 0.19 -0.08 0.45 0.00 0.00 0.00 175.76 176.25 3dk9 s SER 20 N -0.59 4.59 0.22 0.00 0.15 -1.26 -0.80 113.70 116.01 3dk9 s SER 20 Ca 0.37 -0.04 0.03 0.00 0.70 0.00 0.00 55.95 57.01 3dk9 s SER 20 Cb -0.21 -1.14 -0.05 0.00 -1.71 0.00 0.00 66.02 62.91 3dk9 s SER 20 CO 0.24 0.36 -0.01 -0.31 1.20 0.00 0.00 173.24 174.72 3dk9 s TYR 21 N -0.81 1.50 0.18 3.44 1.51 -0.44 -4.98 117.35 117.75 3dk9 s TYR 21 Ca 0.12 -0.93 0.05 0.00 -1.01 0.00 0.00 57.07 55.30 3dk9 s TYR 21 Cb -0.11 -0.86 0.03 0.00 -0.11 0.00 0.00 41.96 40.90 3dk9 s TYR 21 CO 0.01 -0.06 1.40 -0.44 -1.11 0.00 0.00 175.55 175.35 3dk9 h ASP 22 N 2.51 0.16 -2.99 2.29 3.45 -0.94 -3.36 116.42 117.55 3dk9 h ASP 22 Ca -0.38 -0.13 -0.22 0.00 0.43 0.00 0.00 57.03 56.73 3dk9 h ASP 22 Cb 1.22 -0.05 -0.32 0.00 -0.56 0.00 0.00 39.33 39.62 3dk9 h ASP 22 CO 0.64 0.93 -0.53 -0.47 -1.57 0.00 0.00 179.24 178.24 3dk9 s TYR 23 N -3.20 -0.38 -0.15 4.55 5.04 -0.80 -3.36 117.35 119.06 3dk9 s TYR 23 Ca -0.02 0.89 -0.01 0.00 -2.44 0.00 0.00 57.07 55.50 3dk9 s TYR 23 Cb 0.11 -0.04 -0.01 0.00 0.35 0.00 0.00 41.96 42.36 3dk9 s TYR 23 CO 0.81 -0.32 -0.11 -0.51 -1.34 0.00 0.00 175.55 174.08 3dk9 s LEU 24 N 2.15 2.74 -0.20 6.97 1.43 -0.72 -1.74 118.68 129.32 3dk9 s LEU 24 Ca -0.01 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 52.72 3dk9 s LEU 24 Cb -0.12 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.47 3dk9 s LEU 24 CO -0.08 0.11 -0.11 -0.69 0.23 0.00 0.00 176.35 175.81 3dk9 s VAL 25 N 0.67 2.84 -0.48 -1.59 1.01 -0.14 -0.73 120.40 121.98 3dk9 s VAL 25 Ca -0.06 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.07 3dk9 s VAL 25 Cb -0.15 -2.25 0.06 0.00 0.00 0.00 0.00 36.38 34.04 3dk9 s VAL 25 CO 0.02 0.48 0.50 -0.63 0.00 0.00 0.00 175.10 175.47 3dk9 s ILE 26 N 1.31 5.06 0.00 2.22 1.01 0.39 -0.61 121.20 130.58 3dk9 s ILE 26 Ca 0.04 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 59.96 3dk9 s ILE 26 Cb -0.14 -4.19 0.00 0.00 0.01 0.00 0.00 42.46 38.14 3dk9 s ILE 26 CO -0.06 -0.66 0.00 0.61 0.00 0.00 0.00 174.94 174.83 3dk9 n GLY 27 N 5.18 2.74 2.83 6.18 0.00 0.50 -0.47 105.19 122.15 3dk9 n GLY 27 Ca -0.09 -1.13 -0.38 0.00 0.00 0.00 0.00 46.02 44.41 3dk9 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dk9 n GLY 28 N 1.02 5.66 0.00 -0.02 0.00 -1.22 -4.12 105.19 106.51 3dk9 n GLY 28 Ca 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 46.02 43.49 3dk9 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dk9 n GLY 29 N -0.47 3.53 0.30 -0.02 0.00 -1.26 -0.91 105.19 106.37 3dk9 n GLY 29 Ca 0.51 -2.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.41 3dk9 n GLY 29 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3dk9 h SER 30 N 0.00 -0.86 -0.07 1.61 0.02 -1.93 -1.12 113.55 111.21 3dk9 h SER 30 Ca 0.00 0.13 -0.24 0.00 -0.84 0.00 0.00 61.79 60.84 3dk9 h SER 30 Cb 0.00 0.37 0.01 0.00 0.14 0.00 0.00 62.40 62.92 3dk9 h SER 30 CO 0.00 -0.33 -0.89 1.23 -1.14 0.00 0.00 176.83 175.70 3dk9 h GLY 31 N -0.37 0.82 0.85 -3.77 0.00 -1.86 -2.89 103.07 95.85 3dk9 h GLY 31 Ca 0.09 -1.27 -0.04 0.00 0.00 0.00 0.00 47.33 46.10 3dk9 h GLY 31 CO -0.31 1.13 -0.02 -1.33 0.00 0.00 0.00 176.54 176.01 3dk9 h GLY 32 N 0.54 0.48 0.93 4.60 0.00 -1.69 -0.93 103.07 107.00 3dk9 h GLY 32 Ca -0.08 -0.37 0.01 0.00 0.00 0.00 0.00 47.33 46.89 3dk9 h GLY 32 CO 0.18 0.34 0.09 1.41 0.00 0.00 0.00 176.54 178.56 3dk9 h LEU 33 N 0.21 0.14 -0.71 3.11 3.38 -1.31 -1.21 115.31 118.91 3dk9 h LEU 33 Ca 0.07 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 3dk9 h LEU 33 Cb 0.45 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 3dk9 h LEU 33 CO 0.02 0.11 0.37 0.00 0.09 0.00 0.00 178.44 179.02 3dk9 h ALA 34 N 1.09 0.92 -0.37 1.53 0.00 -1.41 -0.62 119.26 120.39 3dk9 h ALA 34 Ca 0.07 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 3dk9 h ALA 34 Cb 0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3dk9 h ALA 34 CO -0.05 0.45 -0.01 1.03 0.00 0.00 0.00 179.25 180.68 3dk9 h SER 35 N 0.99 0.65 -0.37 0.00 0.87 -1.02 -2.11 113.55 112.56 3dk9 h SER 35 Ca 0.25 -0.31 -0.02 0.00 -1.23 0.00 0.00 61.79 60.47 3dk9 h SER 35 Cb 0.07 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.84 3dk9 h SER 35 CO -0.04 0.81 0.14 0.00 -0.53 0.00 0.00 176.83 177.21 3dk9 h ALA 36 N 0.87 0.48 -0.58 6.23 0.00 -1.05 -0.74 119.26 124.46 3dk9 h ALA 36 Ca 0.11 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3dk9 h ALA 36 Cb 0.48 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 3dk9 h ALA 36 CO 0.02 0.09 0.37 0.00 0.00 0.00 0.00 179.25 179.73 3dk9 h ARG 37 N 0.45 0.71 -0.44 0.00 2.47 -1.05 -0.73 114.38 115.79 3dk9 h ARG 37 Ca 0.12 -0.04 -0.14 0.00 -1.26 0.00 0.00 59.98 58.66 3dk9 h ARG 37 Cb 0.21 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 3dk9 h ARG 37 CO -0.01 0.47 -0.25 -0.09 0.56 0.00 0.00 179.97 180.65 3dk9 h ARG 38 N 0.73 0.95 -0.64 0.04 9.65 -1.18 -2.51 114.38 121.41 3dk9 h ARG 38 Ca 0.23 -0.43 0.04 0.00 -1.10 0.00 0.00 59.98 58.72 3dk9 h ARG 38 Cb -0.01 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 28.51 3dk9 h ARG 38 CO -0.08 1.10 0.38 0.00 2.80 0.00 0.00 179.97 184.16 3dk9 h ALA 39 N 0.83 0.84 -0.60 2.80 0.00 -0.92 -2.15 119.26 120.06 3dk9 h ALA 39 Ca 0.09 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3dk9 h ALA 39 Cb 0.84 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 3dk9 h ALA 39 CO 0.07 0.10 0.34 0.00 0.00 0.00 0.00 179.25 179.76 3dk9 h ALA 40 N 1.30 1.48 -0.38 0.00 0.00 -0.98 -1.16 119.26 119.52 3dk9 h ALA 40 Ca 0.27 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.15 3dk9 h ALA 40 Cb 0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3dk9 h ALA 40 CO -0.13 0.44 0.25 1.49 0.00 0.00 0.00 179.25 181.31 3dk9 h GLU 41 N 0.83 0.28 -0.12 0.00 4.81 -0.94 -1.47 114.58 117.96 3dk9 h GLU 41 Ca 0.21 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 3dk9 h GLU 41 Cb -0.00 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.31 3dk9 h GLU 41 CO -0.04 0.19 0.00 1.28 -0.73 0.00 0.00 179.01 179.71 3dk9 n LEU 42 N -4.48 1.22 0.00 1.64 4.77 -0.51 -4.91 117.00 114.73 3dk9 n LEU 42 Ca 0.04 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 3dk9 n LEU 42 Cb 0.24 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3dk9 n LEU 42 CO 0.35 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 3dk9 n GLY 43 N 1.04 0.42 3.77 -0.72 0.00 -0.55 -4.95 105.19 104.20 3dk9 n GLY 43 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 3dk9 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk9 s ALA 44 N -2.07 3.36 -0.74 4.61 0.00 -0.78 -4.95 121.76 121.19 3dk9 s ALA 44 Ca 0.00 1.47 -0.24 0.00 0.00 0.00 0.00 51.96 53.20 3dk9 s ALA 44 Cb 0.00 -3.58 0.06 0.00 0.00 0.00 0.00 23.12 19.60 3dk9 s ALA 44 CO 0.00 -1.10 1.12 1.03 0.00 0.00 0.00 175.76 176.81 3dk9 s ARG 45 N -2.30 3.22 0.19 0.00 0.52 -1.26 -4.34 118.95 114.99 3dk9 s ARG 45 Ca 0.58 -0.76 0.11 0.00 -0.52 0.00 0.00 55.73 55.14 3dk9 s ARG 45 Cb -0.44 -4.37 -0.04 0.00 0.52 0.00 0.00 34.95 30.62 3dk9 s ARG 45 CO 0.58 -1.95 -0.20 0.00 0.02 0.00 0.00 175.30 173.74 3dk9 s ALA 46 N 4.54 2.65 -0.01 2.13 0.00 -1.26 -0.26 121.76 129.55 3dk9 s ALA 46 Ca 0.29 -1.60 -0.03 0.00 0.00 0.00 0.00 51.96 50.62 3dk9 s ALA 46 Cb -0.12 -0.44 -0.00 0.00 0.00 0.00 0.00 23.12 22.56 3dk9 s ALA 46 CO 0.08 0.44 0.06 0.00 0.00 0.00 0.00 175.76 176.34 3dk9 s ALA 47 N -1.69 -0.13 -0.13 0.00 0.00 -0.71 -2.11 121.76 116.99 3dk9 s ALA 47 Ca 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.08 3dk9 s ALA 47 Cb -0.08 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 3dk9 s ALA 47 CO 0.11 -0.11 -0.14 0.08 0.00 0.00 0.00 175.76 175.70 3dk9 s VAL 48 N -0.72 2.92 -0.19 0.00 1.01 -0.12 -0.97 120.40 122.32 3dk9 s VAL 48 Ca -0.08 -0.70 -0.12 0.00 0.00 0.00 0.00 61.98 61.08 3dk9 s VAL 48 Cb -0.05 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 34.06 3dk9 s VAL 48 CO 0.00 0.52 0.20 -0.69 0.00 0.00 0.00 175.10 175.14 3dk9 s VAL 49 N 0.42 5.36 -0.05 2.92 1.01 0.22 -0.64 120.40 129.64 3dk9 s VAL 49 Ca -0.11 0.33 -0.02 0.00 0.00 0.00 0.00 61.98 62.18 3dk9 s VAL 49 Cb -0.16 -3.54 0.04 0.00 0.00 0.00 0.00 36.38 32.71 3dk9 s VAL 49 CO 0.05 0.40 0.10 -0.70 0.00 0.00 0.00 175.10 174.95 3dk9 s GLU 50 N 0.57 -0.01 0.27 2.72 2.56 -0.45 -0.37 118.70 123.98 3dk9 s GLU 50 Ca 0.11 0.40 0.19 0.00 0.00 0.00 0.00 54.97 55.66 3dk9 s GLU 50 Cb -0.12 -0.34 0.09 0.00 2.00 0.00 0.00 34.13 35.76 3dk9 s GLU 50 CO 0.01 -0.27 1.31 0.66 -0.56 0.00 0.00 175.26 176.42 3dk9 h SER 51 N 8.01 0.00 0.00 -1.70 4.64 -1.77 -2.05 113.55 120.68 3dk9 h SER 51 Ca -0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 3dk9 h SER 51 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3dk9 h SER 51 CO 0.25 0.31 0.00 1.41 -0.87 0.00 0.00 176.83 177.93 3dk9 n HIS 52 N -3.05 0.00 -4.24 4.77 8.25 -1.26 -4.69 115.22 115.01 3dk9 n HIS 52 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.12 3dk9 n HIS 52 Cb 0.67 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.67 3dk9 n HIS 52 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3dk9 s LYS 53 N 3.13 3.78 0.46 -0.41 1.02 -1.26 -5.05 119.74 121.41 3dk9 s LYS 53 Ca 0.00 -0.44 -0.24 0.00 0.02 0.00 0.00 55.97 55.31 3dk9 s LYS 53 Cb 0.00 -3.03 -0.09 0.00 -0.52 0.00 0.00 37.83 34.19 3dk9 s LYS 53 CO 0.00 0.27 1.13 1.28 -0.92 0.00 0.00 175.35 177.12 3dk9 n LEU 54 N 3.47 3.55 0.00 3.17 4.77 -1.26 -2.27 117.00 128.43 3dk9 n LEU 54 Ca -0.17 1.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.83 3dk9 n LEU 54 Cb 0.52 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.18 3dk9 n LEU 54 CO 0.34 -1.14 0.00 0.61 -1.33 0.00 0.00 177.39 175.87 3dk9 n GLY 55 N 1.02 1.86 7.00 -0.72 0.00 -0.08 -4.65 105.19 109.62 3dk9 n GLY 55 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3dk9 n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dk9 n GLY 56 N -2.00 0.64 0.18 -0.02 0.00 -0.96 -2.62 105.19 100.40 3dk9 n GLY 56 Ca 0.00 -0.79 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 3dk9 n GLY 56 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3dk9 h THR 57 N 0.00 1.21 -0.12 2.61 2.02 -1.95 -2.36 112.91 114.32 3dk9 h THR 57 Ca 0.00 -0.66 0.03 0.00 0.77 0.00 0.00 66.41 66.55 3dk9 h THR 57 Cb 0.00 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 3dk9 h THR 57 CO 0.00 0.23 -0.08 0.00 0.37 0.00 0.00 175.52 176.04 3dk9 h VAL 59 N -0.08 1.28 0.05 0.00 2.07 -1.51 -1.73 116.25 116.33 3dk9 h VAL 59 Ca 0.07 -1.52 -0.36 0.00 0.82 0.00 0.00 66.70 65.71 3dk9 h VAL 59 Cb 0.19 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 3dk9 h VAL 59 CO -0.17 0.51 -2.17 0.59 0.02 0.00 0.00 177.57 176.35 3dk9 n ASN 60 N -4.11 1.67 -1.47 0.57 3.02 -0.89 -4.36 115.26 109.69 3dk9 n ASN 60 Ca -0.02 0.10 0.02 0.00 -0.03 0.00 0.00 54.58 54.64 3dk9 n ASN 60 Cb 0.52 -0.40 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 3dk9 n ASN 60 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3dk9 n VAL 61 N -3.27 0.05 0.00 2.41 0.24 0.07 -4.85 118.33 112.99 3dk9 n VAL 61 Ca -0.35 -0.88 0.00 0.00 -2.04 0.00 0.00 64.34 61.07 3dk9 n VAL 61 Cb 1.04 0.92 0.00 0.00 -1.47 0.00 0.00 33.84 34.33 3dk9 n VAL 61 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dk9 n GLY 62 N 0.34 4.53 0.37 7.63 0.00 0.51 -4.79 105.19 113.78 3dk9 n GLY 62 Ca -0.01 -0.52 0.01 0.00 0.00 0.00 0.00 46.02 45.51 3dk9 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk9 h VAL 64 N -0.01 0.39 0.00 0.00 2.07 -1.60 -0.48 116.25 116.62 3dk9 h VAL 64 Ca 0.39 -0.70 -0.06 0.00 0.82 0.00 0.00 66.70 67.14 3dk9 h VAL 64 Cb 0.64 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3dk9 h VAL 64 CO -0.98 0.09 -0.30 1.55 0.02 0.00 0.00 177.57 177.94 3dk9 h PRO 65 N -1.00 0.00 -0.29 1.57 0.13 -1.74 -1.82 132.00 128.85 3dk9 h PRO 65 Ca -0.05 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.10 3dk9 h PRO 65 Cb 0.51 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.62 3dk9 h PRO 65 CO 0.08 0.30 0.13 -0.22 -0.23 0.00 0.00 178.00 178.06 3dk9 h LYS 66 N 0.00 0.27 -0.45 0.86 3.11 -1.09 -1.87 116.57 117.38 3dk9 h LYS 66 Ca -0.00 -0.02 -0.07 0.00 -2.81 0.00 0.00 60.65 57.75 3dk9 h LYS 66 Cb 0.54 -0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 31.69 3dk9 h LYS 66 CO 0.04 0.18 0.01 -0.22 -2.81 0.00 0.00 179.45 176.64 3dk9 h LYS 67 N 0.27 0.74 -0.43 1.90 1.63 -0.29 0.13 116.57 120.52 3dk9 h LYS 67 Ca 0.12 -0.19 0.02 0.00 -0.85 0.00 0.00 60.65 59.75 3dk9 h LYS 67 Cb 0.06 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.57 3dk9 h LYS 67 CO -0.10 0.74 0.26 0.28 -3.45 0.00 0.00 179.45 177.18 3dk9 h VAL 68 N 0.69 1.05 -0.30 2.00 2.07 -1.19 0.21 116.25 120.80 3dk9 h VAL 68 Ca 0.14 -0.18 -0.08 0.00 0.82 0.00 0.00 66.70 67.40 3dk9 h VAL 68 Cb 0.42 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 3dk9 h VAL 68 CO 0.02 0.10 -0.14 0.24 0.02 0.00 0.00 177.57 177.80 3dk9 h MET 69 N 0.52 0.52 -0.39 1.57 2.86 -0.65 -1.59 114.93 117.77 3dk9 h MET 69 Ca 0.17 -0.16 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 3dk9 h MET 69 Cb 0.00 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 3dk9 h MET 69 CO -0.07 0.65 0.12 2.35 1.06 0.00 0.00 176.91 181.01 3dk9 h TRP 70 N 0.47 0.63 -0.80 -0.22 7.01 -0.29 -0.64 115.95 122.12 3dk9 h TRP 70 Ca 0.08 -0.07 0.03 0.00 2.11 0.00 0.00 58.89 61.04 3dk9 h TRP 70 Cb 0.53 -0.18 -0.04 0.00 -2.10 0.00 0.00 29.16 27.36 3dk9 h TRP 70 CO 0.02 0.60 0.53 -0.91 -2.79 0.00 0.00 178.44 175.88 3dk9 h ASN 71 N 0.48 0.87 -0.33 2.65 2.35 -0.69 0.23 115.58 121.15 3dk9 h ASN 71 Ca 0.13 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.82 3dk9 h ASN 71 Cb 0.27 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 3dk9 h ASN 71 CO -0.00 0.61 0.04 0.74 -1.65 0.00 0.00 177.43 177.17 3dk9 h THR 72 N 1.02 1.24 0.00 2.81 2.02 -0.93 -2.32 112.91 116.75 3dk9 h THR 72 Ca 0.31 -0.85 -0.01 0.00 0.77 0.00 0.00 66.41 66.62 3dk9 h THR 72 Cb -0.01 1.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.56 3dk9 h THR 72 CO -0.08 0.28 -0.06 0.00 0.37 0.00 0.00 175.52 176.03 3dk9 h ALA 73 N 0.88 1.84 -0.07 6.16 0.00 -0.39 0.10 119.26 127.78 3dk9 h ALA 73 Ca 0.10 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 3dk9 h ALA 73 Cb 0.37 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3dk9 h ALA 73 CO 0.01 0.08 -0.45 0.28 0.00 0.00 0.00 179.25 179.17 3dk9 h VAL 74 N 0.00 1.33 -0.04 0.00 2.07 -0.55 -2.01 116.25 117.04 3dk9 h VAL 74 Ca -0.00 -1.60 -0.02 0.00 0.82 0.00 0.00 66.70 65.91 3dk9 h VAL 74 Cb 0.11 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 3dk9 h VAL 74 CO 0.01 0.47 -0.06 0.45 0.02 0.00 0.00 177.57 178.46 3dk9 h HIS 75 N 0.14 0.06 -0.41 1.57 3.86 -0.27 -1.03 115.15 119.06 3dk9 h HIS 75 Ca 0.01 -0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 3dk9 h HIS 75 Cb 0.85 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.28 3dk9 h HIS 75 CO 0.01 0.12 0.02 0.66 0.86 0.00 0.00 177.93 179.60 3dk9 h SER 76 N 0.06 0.61 -0.00 2.45 4.64 -1.02 -1.65 113.55 118.64 3dk9 h SER 76 Ca 0.01 -0.13 -0.17 0.00 -0.47 0.00 0.00 61.79 61.04 3dk9 h SER 76 Cb 0.14 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3dk9 h SER 76 CO 0.01 0.68 -0.57 -0.33 -0.87 0.00 0.00 176.83 175.74 3dk9 h GLU 77 N 0.62 0.59 -0.70 4.77 5.08 -1.15 -2.61 114.58 121.18 3dk9 h GLU 77 Ca 0.13 -0.39 0.09 0.00 -1.00 0.00 0.00 59.36 58.19 3dk9 h GLU 77 Cb 0.37 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.60 3dk9 h GLU 77 CO 0.01 1.00 0.35 0.74 -1.00 0.00 0.00 179.01 180.11 3dk9 h PHE 78 N 0.45 0.63 -0.85 4.33 0.05 -1.04 -2.08 116.94 118.42 3dk9 h PHE 78 Ca 0.00 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.80 3dk9 h PHE 78 Cb 1.13 -0.18 -0.04 0.00 2.00 0.00 0.00 35.95 38.86 3dk9 h PHE 78 CO 0.05 0.24 0.46 1.98 -0.18 0.00 0.00 178.31 180.86 3dk9 h MET 79 N 0.60 1.19 -0.74 1.51 4.05 -1.18 -2.69 114.93 117.67 3dk9 h MET 79 Ca 0.34 -0.14 -0.00 0.00 -0.28 0.00 0.00 59.70 59.62 3dk9 h MET 79 Cb 0.34 -0.23 -0.04 0.00 -0.80 0.00 0.00 31.60 30.87 3dk9 h MET 79 CO -0.26 0.88 0.46 0.45 0.23 0.00 0.00 176.91 178.67 3dk9 h HIS 80 N 1.20 0.96 -0.01 1.39 3.86 -1.00 -3.13 115.15 118.42 3dk9 h HIS 80 Ca 0.30 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.52 3dk9 h HIS 80 Cb 0.04 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.19 3dk9 h HIS 80 CO 0.01 0.63 -0.05 -0.25 0.86 0.00 0.00 177.93 179.13 3dk9 n ASP 81 N -4.40 1.41 -0.19 2.45 10.43 -1.01 -4.55 116.55 120.69 3dk9 n ASP 81 Ca 0.08 -1.38 -0.08 0.00 2.57 0.00 0.00 54.79 55.98 3dk9 n ASP 81 Cb 0.06 0.03 0.02 0.00 1.84 0.00 0.00 41.12 43.06 3dk9 n ASP 81 CO 0.00 0.00 0.00 -0.74 -1.07 0.00 0.00 177.20 175.39 3dk9 h HIS 82 N 2.14 0.79 -0.58 1.24 2.76 -1.42 -1.75 115.15 118.32 3dk9 h HIS 82 Ca 0.00 -0.04 -0.09 0.00 -2.20 0.00 0.00 60.37 58.04 3dk9 h HIS 82 Cb 0.50 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 29.20 3dk9 h HIS 82 CO 0.00 0.63 0.02 0.00 -1.30 0.00 0.00 177.93 177.27 3dk9 h ALA 83 N 1.09 0.94 -0.17 5.26 0.00 -1.80 -2.26 119.26 122.31 3dk9 h ALA 83 Ca 0.18 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3dk9 h ALA 83 Cb 0.14 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3dk9 h ALA 83 CO -0.02 0.64 0.03 -0.44 0.00 0.00 0.00 179.25 179.46 3dk9 h ASP 84 N 0.91 0.21 -0.30 0.00 3.45 -1.68 -1.57 116.42 117.44 3dk9 h ASP 84 Ca 0.17 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.61 3dk9 h ASP 84 Cb 0.51 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.22 3dk9 h ASP 84 CO 0.02 0.23 0.00 -1.22 -1.57 0.00 0.00 179.24 176.70 3dk9 n TYR 85 N -4.43 0.68 -0.07 4.55 4.02 -0.72 -4.85 117.16 116.34 3dk9 n TYR 85 Ca -0.00 -0.27 0.00 0.00 -0.01 0.00 0.00 57.90 57.61 3dk9 n TYR 85 Cb 0.14 -0.13 0.00 0.00 -0.02 0.00 0.00 39.34 39.33 3dk9 n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dk9 n GLY 86 N 0.69 0.95 3.67 2.72 0.00 -0.59 -5.06 105.19 107.56 3dk9 n GLY 86 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 3dk9 n GLY 86 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dk9 s PHE 87 N -2.01 2.78 0.17 1.61 0.08 -0.89 -5.02 117.98 114.70 3dk9 s PHE 87 Ca 0.00 -0.19 -0.34 0.00 0.12 0.00 0.00 56.93 56.52 3dk9 s PHE 87 Cb 0.00 -1.26 -0.14 0.00 -0.57 0.00 0.00 43.02 41.05 3dk9 s PHE 87 CO 0.00 0.59 1.46 -2.30 -0.10 0.00 0.00 175.22 174.87 3dk9 n PRO 88 N -0.77 1.88 -0.81 0.24 -0.02 -1.26 -3.55 135.00 130.71 3dk9 n PRO 88 Ca -0.07 0.68 -0.34 0.00 -2.02 0.00 0.00 63.50 61.74 3dk9 n PRO 88 Cb 0.58 -2.37 0.11 0.00 -0.02 0.00 0.00 33.50 31.80 3dk9 n PRO 88 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3dk9 n SER 89 N 2.82 -2.92 -3.64 2.55 7.64 -1.26 -4.54 113.62 114.27 3dk9 n SER 89 Ca 0.16 0.06 -0.08 0.00 1.01 0.00 0.00 58.87 60.01 3dk9 n SER 89 Cb 0.28 -0.91 -0.07 0.00 -1.01 0.00 0.00 64.21 62.50 3dk9 n SER 89 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dk9 n GLU 91 N 2.55 0.64 -2.74 0.00 2.13 -1.26 -4.66 120.64 117.30 3dk9 n GLU 91 Ca -0.14 -2.10 -0.21 0.00 0.66 0.00 0.00 57.16 55.37 3dk9 n GLU 91 Cb 0.56 -1.46 0.07 0.00 0.27 0.00 0.00 31.44 30.88 3dk9 n GLU 91 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 3dk9 s GLY 92 N -0.59 1.79 -0.14 8.31 0.00 -1.26 -5.07 107.32 110.37 3dk9 s GLY 92 Ca 0.32 -1.70 -0.23 0.00 0.00 0.00 0.00 44.72 43.10 3dk9 s GLY 92 CO -0.16 -1.28 0.72 0.54 0.00 0.00 0.00 173.10 172.93 3dk9 s LYS 93 N -4.85 4.33 0.45 2.90 1.02 -1.26 -5.05 119.74 117.29 3dk9 s LYS 93 Ca 0.62 0.85 -0.24 0.00 0.02 0.00 0.00 55.97 57.22 3dk9 s LYS 93 Cb -0.07 -3.53 -0.07 0.00 -0.52 0.00 0.00 37.83 33.64 3dk9 s LYS 93 CO 0.40 -0.15 1.24 0.12 -0.92 0.00 0.00 175.35 176.04 3dk9 s PHE 94 N 1.56 2.78 -0.50 3.18 5.36 -1.26 -5.00 117.98 124.09 3dk9 s PHE 94 Ca 0.35 1.48 -0.01 0.00 -0.96 0.00 0.00 56.93 57.79 3dk9 s PHE 94 Cb -0.17 -3.54 0.13 0.00 -0.34 0.00 0.00 43.02 39.11 3dk9 s PHE 94 CO 0.14 -1.89 0.29 1.21 -1.46 0.00 0.00 175.22 173.51 3dk9 s ASN 95 N -1.09 5.09 0.28 6.13 3.84 -1.26 -4.98 114.94 122.95 3dk9 s ASN 95 Ca 0.62 -2.50 0.02 0.00 0.21 0.00 0.00 52.86 51.22 3dk9 s ASN 95 Cb -0.34 -1.80 0.61 0.00 -0.55 0.00 0.00 41.25 39.18 3dk9 s ASN 95 CO 0.41 -0.42 1.78 -0.25 -2.79 0.00 0.00 177.10 175.83 3dk9 h TRP 96 N 7.41 0.95 -0.25 0.43 2.91 -1.94 -1.68 115.95 123.78 3dk9 h TRP 96 Ca -0.07 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 59.96 3dk9 h TRP 96 Cb 0.99 -0.28 -0.01 0.00 -0.51 0.00 0.00 29.16 29.34 3dk9 h TRP 96 CO 0.60 0.25 0.04 -0.09 -1.03 0.00 0.00 178.44 178.21 3dk9 h ARG 97 N 0.74 0.35 0.08 2.65 2.43 -1.94 -0.41 114.38 118.29 3dk9 h ARG 97 Ca 0.51 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.63 3dk9 h ARG 97 Cb 0.71 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 3dk9 h ARG 97 CO -0.35 0.35 -0.08 0.28 -1.51 0.00 0.00 179.97 178.66 3dk9 h VAL 98 N 0.35 0.81 -0.03 0.20 2.07 -1.69 -1.88 116.25 116.08 3dk9 h VAL 98 Ca 0.08 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.40 3dk9 h VAL 98 Cb 0.18 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3dk9 h VAL 98 CO -0.00 0.00 -0.84 -0.29 0.02 0.00 0.00 177.57 176.46 3dk9 h ILE 99 N -0.18 1.41 -0.56 4.57 6.09 -1.53 -2.91 117.51 124.40 3dk9 h ILE 99 Ca 0.01 -2.36 0.05 0.00 -1.37 0.00 0.00 64.86 61.19 3dk9 h ILE 99 Cb 0.18 2.30 -0.05 0.00 0.47 0.00 0.00 36.82 39.72 3dk9 h ILE 99 CO -0.03 0.70 0.29 0.50 -3.07 0.00 0.00 178.15 176.55 3dk9 h LYS 100 N 0.22 0.54 -0.54 2.19 3.64 -0.87 0.11 116.57 121.86 3dk9 h LYS 100 Ca -0.05 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 3dk9 h LYS 100 Cb 1.45 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 33.12 3dk9 h LYS 100 CO 0.14 0.36 0.30 1.49 -2.27 0.00 0.00 179.45 179.47 3dk9 h GLU 101 N 0.55 0.75 -0.42 1.90 4.22 -1.31 -0.08 114.58 120.20 3dk9 h GLU 101 Ca 0.25 -0.08 -0.12 0.00 0.08 0.00 0.00 59.36 59.48 3dk9 h GLU 101 Cb 0.16 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3dk9 h GLU 101 CO -0.17 0.57 -0.23 0.87 -2.18 0.00 0.00 179.01 177.87 3dk9 h LYS 102 N 0.72 0.86 -0.12 1.92 1.57 -1.25 -1.57 116.57 118.70 3dk9 h LYS 102 Ca 0.19 -0.36 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3dk9 h LYS 102 Cb 0.04 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 3dk9 h LYS 102 CO -0.03 1.00 0.07 -0.09 -0.57 0.00 0.00 179.45 179.83 3dk9 h ARG 103 N 0.74 0.16 -0.99 3.15 2.43 -0.57 -1.68 114.38 117.62 3dk9 h ARG 103 Ca 0.10 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.29 3dk9 h ARG 103 Cb 0.77 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.23 3dk9 h ARG 103 CO 0.06 0.16 0.65 -0.44 -1.51 0.00 0.00 179.97 178.89 3dk9 h ASP 104 N 0.11 1.08 -0.70 -3.80 3.32 -0.89 -1.37 116.42 114.18 3dk9 h ASP 104 Ca 0.04 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 3dk9 h ASP 104 Cb 0.04 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 3dk9 h ASP 104 CO -0.01 0.74 0.19 0.00 -1.72 0.00 0.00 179.24 178.44 3dk9 h ALA 105 N 1.40 0.91 -0.36 3.45 0.00 -1.04 -1.05 119.26 122.58 3dk9 h ALA 105 Ca 0.39 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3dk9 h ALA 105 Cb -0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3dk9 h ALA 105 CO -0.12 0.62 0.17 -0.92 0.00 0.00 0.00 179.25 178.99 3dk9 h TYR 106 N 1.04 0.53 -0.65 0.00 3.20 -0.81 -0.51 116.97 119.76 3dk9 h TYR 106 Ca 0.22 -0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.11 3dk9 h TYR 106 Cb 0.34 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.40 3dk9 h TYR 106 CO 0.03 0.45 0.38 0.28 -1.64 0.00 0.00 178.16 177.66 3dk9 h VAL 107 N 0.45 1.01 -0.92 1.81 2.07 -1.01 -1.06 116.25 118.60 3dk9 h VAL 107 Ca 0.12 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 3dk9 h VAL 107 Cb 0.13 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 3dk9 h VAL 107 CO -0.01 0.13 0.56 0.28 0.02 0.00 0.00 177.57 178.55 3dk9 h SER 108 N 0.72 1.10 -0.77 0.57 0.02 -0.72 0.30 113.55 114.77 3dk9 h SER 108 Ca 0.28 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3dk9 h SER 108 Cb 0.12 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.34 3dk9 h SER 108 CO -0.15 0.84 0.47 0.03 -1.14 0.00 0.00 176.83 176.89 3dk9 h ARG 109 N 1.27 1.04 -0.52 3.45 3.08 -0.37 -2.22 114.38 120.10 3dk9 h ARG 109 Ca 0.33 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 60.18 3dk9 h ARG 109 Cb -0.06 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.75 3dk9 h ARG 109 CO -0.06 0.72 -0.14 -0.07 -1.07 0.00 0.00 179.97 179.35 3dk9 h LEU 110 N 1.05 1.02 -0.64 3.04 3.38 -0.59 -1.94 115.31 120.62 3dk9 h LEU 110 Ca 0.28 -0.35 0.08 0.00 0.09 0.00 0.00 57.88 57.98 3dk9 h LEU 110 Cb -0.06 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.35 3dk9 h LEU 110 CO -0.05 1.14 0.30 0.78 0.09 0.00 0.00 178.44 180.70 3dk9 h ASN 111 N 0.89 0.38 -0.45 -0.43 -0.26 -0.66 -0.57 115.58 114.48 3dk9 h ASN 111 Ca 0.13 0.06 -0.09 0.00 -0.56 0.00 0.00 56.30 55.84 3dk9 h ASN 111 Cb 0.70 -0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.94 3dk9 h ASN 111 CO 0.05 0.23 -0.04 0.00 -1.06 0.00 0.00 177.43 176.61 3dk9 h ALA 112 N 1.40 0.97 -0.23 -0.83 0.00 -1.16 -1.95 119.26 117.46 3dk9 h ALA 112 Ca 0.31 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3dk9 h ALA 112 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3dk9 h ALA 112 CO -0.26 0.62 0.07 0.82 0.00 0.00 0.00 179.25 180.50 3dk9 h ILE 113 N 0.81 1.19 -0.32 0.00 2.04 -0.68 -1.72 117.51 118.82 3dk9 h ILE 113 Ca 0.14 -0.60 -0.09 0.00 1.00 0.00 0.00 64.86 65.31 3dk9 h ILE 113 Cb 0.54 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 3dk9 h ILE 113 CO 0.03 0.19 -0.19 1.88 0.00 0.00 0.00 178.15 180.07 3dk9 h TYR 114 N 0.20 0.66 -0.42 1.37 -1.99 -0.98 0.89 116.97 116.70 3dk9 h TYR 114 Ca 0.07 -0.13 0.02 0.00 2.00 0.00 0.00 58.73 60.69 3dk9 h TYR 114 Cb 0.23 -0.17 -0.03 0.00 2.00 0.00 0.00 36.73 38.77 3dk9 h TYR 114 CO 0.00 0.75 0.25 0.37 -0.00 0.00 0.00 178.16 179.53 3dk9 h GLN 115 N 0.54 0.49 -0.29 4.88 4.15 -1.25 -2.40 115.11 121.23 3dk9 h GLN 115 Ca 0.09 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.41 3dk9 h GLN 115 Cb 0.63 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.19 3dk9 h GLN 115 CO 0.04 0.33 -0.10 -0.97 -1.93 0.00 0.00 178.83 176.20 3dk9 h ASN 116 N 0.51 0.46 -0.71 -0.69 -0.00 -0.75 -1.88 115.58 112.52 3dk9 h ASN 116 Ca 0.17 -0.11 0.00 0.00 -0.00 0.00 0.00 56.30 56.36 3dk9 h ASN 116 Cb 0.01 -0.12 -0.03 0.00 -0.00 0.00 0.00 38.32 38.17 3dk9 h ASN 116 CO -0.08 0.61 0.46 0.78 -0.00 0.00 0.00 177.43 179.20 3dk9 h ASN 117 N 0.45 0.82 -0.54 1.15 -0.26 -0.48 0.99 115.58 117.71 3dk9 h ASN 117 Ca 0.09 -0.03 -0.05 0.00 -0.56 0.00 0.00 56.30 55.74 3dk9 h ASN 117 Cb 0.46 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 37.49 3dk9 h ASN 117 CO 0.03 0.61 0.12 -0.07 -1.06 0.00 0.00 177.43 177.06 3dk9 h LEU 118 N 0.96 0.83 -0.59 1.61 3.38 -1.08 -2.25 115.31 118.17 3dk9 h LEU 118 Ca 0.26 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3dk9 h LEU 118 Cb -0.09 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 3dk9 h LEU 118 CO -0.05 0.85 0.30 0.74 0.09 0.00 0.00 178.44 180.37 3dk9 h THR 119 N 0.77 1.20 -0.05 0.22 2.02 -0.70 -1.08 112.91 115.29 3dk9 h THR 119 Ca 0.17 -0.55 -0.06 0.00 0.77 0.00 0.00 66.41 66.74 3dk9 h THR 119 Cb 0.35 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 3dk9 h THR 119 CO 0.00 0.23 -0.26 0.11 0.37 0.00 0.00 175.52 175.97 3dk9 h LYS 120 N 0.80 0.09 -0.01 6.66 1.57 -0.73 -1.17 116.57 123.78 3dk9 h LYS 120 Ca 0.20 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3dk9 h LYS 120 Cb 0.09 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3dk9 h LYS 120 CO -0.03 0.34 -0.02 0.43 -0.57 0.00 0.00 179.45 179.61 3dk9 n SER 121 N -4.20 0.68 -3.31 0.86 7.64 -0.86 -4.93 113.62 109.51 3dk9 n SER 121 Ca -0.02 -1.14 -0.23 0.00 1.01 0.00 0.00 58.87 58.50 3dk9 n SER 121 Cb 0.33 -0.01 0.06 0.00 -1.01 0.00 0.00 64.21 63.58 3dk9 n SER 121 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3dk9 n HIS 122 N -0.52 -2.47 -3.36 1.43 8.25 -0.44 -4.94 115.22 113.17 3dk9 n HIS 122 Ca 0.20 0.80 -0.39 0.00 -0.26 0.00 0.00 57.72 58.08 3dk9 n HIS 122 Cb 0.24 -4.77 -0.08 0.00 1.12 0.00 0.00 29.99 26.49 3dk9 n HIS 122 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3dk9 s ILE 123 N -3.26 5.16 0.29 1.59 1.01 -0.48 -4.73 121.20 120.78 3dk9 s ILE 123 Ca 0.46 0.66 -0.29 0.00 0.00 0.00 0.00 60.65 61.48 3dk9 s ILE 123 Cb -0.20 -3.73 -0.10 0.00 0.01 0.00 0.00 42.46 38.44 3dk9 s ILE 123 CO 0.57 0.16 1.26 -0.70 0.00 0.00 0.00 174.94 176.24 3dk9 s GLU 124 N 1.95 4.43 -0.26 2.79 2.12 -0.90 -4.45 118.70 124.38 3dk9 s GLU 124 Ca 0.17 2.09 -0.09 0.00 0.36 0.00 0.00 54.97 57.50 3dk9 s GLU 124 Cb -0.15 -3.13 -0.04 0.00 0.26 0.00 0.00 34.13 31.07 3dk9 s GLU 124 CO 0.09 -0.12 0.12 0.42 -0.54 0.00 0.00 175.26 175.24 3dk9 s ILE 125 N -0.84 4.78 -0.34 -3.70 1.01 -1.26 -0.95 121.20 119.89 3dk9 s ILE 125 Ca 0.50 -0.01 -0.09 0.00 0.00 0.00 0.00 60.65 61.04 3dk9 s ILE 125 Cb -0.37 -3.25 0.02 0.00 0.01 0.00 0.00 42.46 38.86 3dk9 s ILE 125 CO 0.47 0.30 0.16 -0.63 0.00 0.00 0.00 174.94 175.24 3dk9 s ILE 126 N 1.65 4.35 -0.23 2.92 1.01 0.19 -4.98 121.20 126.11 3dk9 s ILE 126 Ca 0.07 -0.79 -0.21 0.00 0.00 0.00 0.00 60.65 59.72 3dk9 s ILE 126 Cb -0.15 -3.36 -0.02 0.00 0.01 0.00 0.00 42.46 38.93 3dk9 s ILE 126 CO 0.07 -0.11 0.65 -0.13 0.00 0.00 0.00 174.94 175.41 3dk9 s ARG 127 N 1.53 4.16 0.00 2.79 1.81 -1.26 -1.35 118.95 126.63 3dk9 s ARG 127 Ca 0.02 0.61 0.00 0.00 -1.72 0.00 0.00 55.73 54.64 3dk9 s ARG 127 Cb -0.18 -3.62 0.00 0.00 -0.45 0.00 0.00 34.95 30.70 3dk9 s ARG 127 CO 0.05 -0.35 0.00 0.41 -0.68 0.00 0.00 175.30 174.73 3dk9 n GLY 128 N 3.97 0.37 3.61 -3.53 0.00 -0.77 -4.88 105.19 103.95 3dk9 n GLY 128 Ca -0.00 -1.81 -0.39 0.00 0.00 0.00 0.00 46.02 43.82 3dk9 n GLY 128 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3dk9 s HIS 129 N -1.62 3.25 0.25 1.61 2.46 -1.26 -2.44 115.29 117.55 3dk9 s HIS 129 Ca 0.00 0.42 -0.18 0.00 0.47 0.00 0.00 55.06 55.77 3dk9 s HIS 129 Cb 0.00 -2.57 -0.08 0.00 -0.13 0.00 0.00 32.58 29.80 3dk9 s HIS 129 CO 0.00 -0.22 0.72 0.00 -2.47 0.00 0.00 174.74 172.76 3dk9 s ALA 130 N 2.05 3.39 0.01 1.58 0.00 -1.26 -4.38 121.76 123.15 3dk9 s ALA 130 Ca 0.15 0.10 -0.04 0.00 0.00 0.00 0.00 51.96 52.17 3dk9 s ALA 130 Cb -0.16 -2.78 -0.01 0.00 0.00 0.00 0.00 23.12 20.18 3dk9 s ALA 130 CO 0.10 0.34 0.06 0.00 0.00 0.00 0.00 175.76 176.26 3dk9 s ALA 131 N -1.69 -0.13 0.58 0.00 0.00 -0.96 -4.68 121.76 114.88 3dk9 s ALA 131 Ca 0.47 -0.30 -0.18 0.00 0.00 0.00 0.00 51.96 51.95 3dk9 s ALA 131 Cb -0.14 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 3dk9 s ALA 131 CO 0.20 -0.18 1.12 -0.06 0.00 0.00 0.00 175.76 176.84 3dk9 s PHE 132 N -1.32 2.66 0.51 0.00 0.40 -0.14 -0.89 117.98 119.20 3dk9 s PHE 132 Ca -0.14 1.55 0.08 0.00 -0.60 0.00 0.00 56.93 57.82 3dk9 s PHE 132 Cb -0.08 -3.24 0.04 0.00 0.51 0.00 0.00 43.02 40.25 3dk9 s PHE 132 CO 0.00 -1.59 0.60 0.95 0.70 0.00 0.00 175.22 175.88 3dk9 s THR 133 N -1.97 2.31 -2.14 0.64 -4.23 -0.46 -4.74 115.64 105.05 3dk9 s THR 133 Ca 0.71 -1.15 0.22 0.00 -1.18 0.00 0.00 61.69 60.28 3dk9 s THR 133 Cb -0.23 -2.47 0.55 0.00 1.34 0.00 0.00 72.50 71.70 3dk9 s THR 133 CO 0.32 0.00 1.72 -1.20 -0.54 0.00 0.00 174.62 174.92 3dk9 n SER 134 N -1.95 0.71 -4.67 3.99 7.64 -1.26 -4.61 113.62 113.47 3dk9 n SER 134 Ca 0.09 -1.48 -0.46 0.00 1.01 0.00 0.00 58.87 58.03 3dk9 n SER 134 Cb 0.62 -0.04 -0.04 0.00 -1.01 0.00 0.00 64.21 63.74 3dk9 n SER 134 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3dk9 n ASP 135 N -0.34 3.07 -0.29 6.43 9.92 -1.26 -4.85 116.55 129.23 3dk9 n ASP 135 Ca 0.16 1.08 0.10 0.00 -0.53 0.00 0.00 54.79 55.60 3dk9 n ASP 135 Cb 0.19 -1.42 0.33 0.00 -0.64 0.00 0.00 41.12 39.58 3dk9 n ASP 135 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 3dk9 h PRO 136 N 6.11 0.78 -6.42 -0.24 0.11 -1.95 -3.35 132.00 127.04 3dk9 h PRO 136 Ca -0.45 -0.05 -0.57 0.00 0.11 0.00 0.00 66.00 65.04 3dk9 h PRO 136 Cb 1.26 -0.18 -0.05 0.00 0.11 0.00 0.00 31.00 32.14 3dk9 h PRO 136 CO 0.89 0.52 1.04 0.21 -0.21 0.00 0.00 178.00 180.44 3dk9 s LYS 137 N -5.77 3.73 -0.02 1.05 2.20 -1.26 -4.96 119.74 114.72 3dk9 s LYS 137 Ca -0.11 1.15 -0.35 0.00 -0.36 0.00 0.00 55.97 56.31 3dk9 s LYS 137 Cb 0.22 -3.97 -0.13 0.00 -1.51 0.00 0.00 37.83 32.44 3dk9 s LYS 137 CO 0.79 -1.36 1.74 -2.30 -0.36 0.00 0.00 175.35 173.86 3dk9 n PRO 138 N 7.72 1.99 -3.90 4.03 -0.02 -1.26 -4.94 135.00 138.63 3dk9 n PRO 138 Ca 0.16 0.73 -0.11 0.00 -2.02 0.00 0.00 63.50 62.26 3dk9 n PRO 138 Cb 0.47 -2.52 -0.12 0.00 -0.02 0.00 0.00 33.50 31.31 3dk9 n PRO 138 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3dk9 s THR 139 N 2.82 0.06 0.26 3.45 2.01 -1.26 -4.09 115.64 118.89 3dk9 s THR 139 Ca 0.89 -0.49 0.11 0.00 0.31 0.00 0.00 61.69 62.51 3dk9 s THR 139 Cb -0.74 -0.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.49 3dk9 s THR 139 CO 0.49 -0.27 -0.14 0.27 -0.69 0.00 0.00 174.62 174.27 3dk9 s ILE 140 N -0.83 2.79 -0.04 1.82 -4.36 -0.15 -1.35 121.20 119.07 3dk9 s ILE 140 Ca -0.09 -2.17 0.05 0.00 -0.26 0.00 0.00 60.65 58.18 3dk9 s ILE 140 Cb -0.06 -2.45 -0.01 0.00 1.25 0.00 0.00 42.46 41.20 3dk9 s ILE 140 CO 0.00 -0.33 -0.20 -0.70 0.24 0.00 0.00 174.94 173.95 3dk9 s GLU 141 N -3.39 1.94 -0.07 0.37 2.12 -0.07 -1.07 118.70 118.53 3dk9 s GLU 141 Ca 0.29 -0.71 -0.01 0.00 0.36 0.00 0.00 54.97 54.90 3dk9 s GLU 141 Cb -0.06 -1.71 0.03 0.00 0.26 0.00 0.00 34.13 32.65 3dk9 s GLU 141 CO 0.16 0.32 0.00 0.08 -0.54 0.00 0.00 175.26 175.28 3dk9 s VAL 142 N -0.12 0.37 -1.57 3.70 1.01 -0.11 -2.27 120.40 121.41 3dk9 s VAL 142 Ca -0.01 0.12 -0.14 0.00 0.00 0.00 0.00 61.98 61.94 3dk9 s VAL 142 Cb -0.11 -0.53 0.10 0.00 0.00 0.00 0.00 36.38 35.84 3dk9 s VAL 142 CO 0.02 0.26 0.92 -1.20 0.00 0.00 0.00 175.10 175.10 3dk9 n SER 143 N 5.09 -4.28 0.00 3.32 7.64 -1.26 -1.71 113.62 122.42 3dk9 n SER 143 Ca -0.08 -0.84 0.00 0.00 1.01 0.00 0.00 58.87 58.96 3dk9 n SER 143 Cb 0.50 -3.60 0.00 0.00 -1.01 0.00 0.00 64.21 60.10 3dk9 n SER 143 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dk9 n GLY 144 N -1.63 0.77 3.48 0.23 0.00 -1.26 -5.03 105.19 101.77 3dk9 n GLY 144 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 3dk9 n GLY 144 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dk9 s LYS 145 N -0.02 2.45 -0.01 1.61 2.20 -0.69 -5.06 119.74 120.22 3dk9 s LYS 145 Ca 0.00 -0.74 0.00 0.00 -0.36 0.00 0.00 55.97 54.88 3dk9 s LYS 145 Cb 0.00 -2.36 -0.04 0.00 -1.51 0.00 0.00 37.83 33.92 3dk9 s LYS 145 CO 0.00 0.61 0.05 0.15 -0.36 0.00 0.00 175.35 175.80 3dk9 s LYS 146 N -0.89 2.95 -0.00 4.03 1.02 -1.26 -0.94 119.74 124.65 3dk9 s LYS 146 Ca 0.12 -0.53 0.01 0.00 0.02 0.00 0.00 55.97 55.59 3dk9 s LYS 146 Cb -0.11 -2.78 -0.00 0.00 -0.52 0.00 0.00 37.83 34.42 3dk9 s LYS 146 CO 0.02 0.64 -0.03 0.71 -0.92 0.00 0.00 175.35 175.77 3dk9 s TYR 147 N -1.14 0.23 0.07 3.18 2.02 -0.23 -2.41 117.35 119.07 3dk9 s TYR 147 Ca 0.21 -0.04 0.02 0.00 -0.37 0.00 0.00 57.07 56.88 3dk9 s TYR 147 Cb -0.12 -0.15 -0.04 0.00 -0.40 0.00 0.00 41.96 41.26 3dk9 s TYR 147 CO 0.12 -0.00 -0.06 -0.08 -1.57 0.00 0.00 175.55 173.95 3dk9 s THR 148 N -0.06 0.58 0.11 -0.71 -1.32 0.02 -0.97 115.64 113.29 3dk9 s THR 148 Ca 0.01 -1.64 -0.24 0.00 -1.21 0.00 0.00 61.69 58.62 3dk9 s THR 148 Cb -0.01 -1.30 0.06 0.00 -1.51 0.00 0.00 72.50 69.74 3dk9 s THR 148 CO -0.00 -0.73 0.58 0.00 -2.21 0.00 0.00 174.62 172.27 3dk9 s ALA 149 N -2.91 -1.53 -0.93 11.08 0.00 -1.26 -1.33 121.76 124.87 3dk9 s ALA 149 Ca 0.04 0.58 0.18 0.00 0.00 0.00 0.00 51.96 52.76 3dk9 s ALA 149 Cb 0.00 0.68 0.78 0.00 0.00 0.00 0.00 23.12 24.58 3dk9 s ALA 149 CO -0.04 -0.67 1.59 -0.35 0.00 0.00 0.00 175.76 176.29 3dk9 n PRO 150 N -0.08 0.03 -3.70 0.00 -0.04 -1.26 -4.55 135.00 125.40 3dk9 n PRO 150 Ca -0.17 0.22 -0.23 0.00 -0.04 0.00 0.00 63.50 63.28 3dk9 n PRO 150 Cb 0.63 -1.55 -0.17 0.00 -0.04 0.00 0.00 33.50 32.37 3dk9 n PRO 150 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3dk9 s HIS 151 N -3.04 0.42 -0.14 0.54 3.76 -1.21 -4.43 115.29 111.18 3dk9 s HIS 151 Ca 0.08 -0.15 0.00 0.00 -0.15 0.00 0.00 55.06 54.84 3dk9 s HIS 151 Cb 0.11 -0.70 0.02 0.00 1.11 0.00 0.00 32.58 33.12 3dk9 s HIS 151 CO 0.34 -0.36 -0.14 0.42 -0.85 0.00 0.00 174.74 174.15 3dk9 s ILE 152 N 2.06 1.51 -0.24 0.60 1.01 0.11 -1.75 121.20 124.50 3dk9 s ILE 152 Ca 0.04 -0.60 -0.11 0.00 0.00 0.00 0.00 60.65 59.98 3dk9 s ILE 152 Cb -0.14 -1.42 -0.05 0.00 0.01 0.00 0.00 42.46 40.86 3dk9 s ILE 152 CO -0.06 0.45 0.17 -0.22 0.00 0.00 0.00 174.94 175.29 3dk9 s LEU 153 N 1.45 4.12 -0.38 2.97 2.96 0.10 -1.07 118.68 128.83 3dk9 s LEU 153 Ca 0.04 0.14 -0.19 0.00 -0.22 0.00 0.00 54.13 53.90 3dk9 s LEU 153 Cb -0.13 -2.13 0.01 0.00 0.50 0.00 0.00 46.19 44.44 3dk9 s LEU 153 CO -0.09 0.06 0.56 -0.63 -1.32 0.00 0.00 176.35 174.93 3dk9 s ILE 154 N 1.04 4.95 -0.37 6.68 1.01 0.36 -0.46 121.20 134.42 3dk9 s ILE 154 Ca 0.08 0.27 0.13 0.00 0.00 0.00 0.00 60.65 61.13 3dk9 s ILE 154 Cb -0.13 -4.06 0.42 0.00 0.01 0.00 0.00 42.46 38.70 3dk9 s ILE 154 CO 0.04 -0.35 0.94 0.00 0.00 0.00 0.00 174.94 175.57 3dk9 n ALA 155 N 5.92 3.58 1.36 9.38 0.00 0.38 -2.19 120.51 138.95 3dk9 n ALA 155 Ca -0.03 -3.53 0.13 0.00 0.00 0.00 0.00 53.44 50.01 3dk9 n ALA 155 Cb 0.48 -0.84 0.41 0.00 0.00 0.00 0.00 19.45 19.50 3dk9 n ALA 155 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3dk9 n THR 156 N -0.09 0.00 -4.71 0.00 -2.24 -1.21 -4.30 114.28 101.72 3dk9 n THR 156 Ca 0.19 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 3dk9 n THR 156 Cb 0.73 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 3dk9 n THR 156 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dk9 n GLY 157 N 1.23 0.46 0.00 3.38 0.00 -1.26 -4.57 105.19 104.43 3dk9 n GLY 157 Ca 0.17 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3dk9 n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dk9 n GLY 158 N 0.00 4.50 3.39 -0.02 0.00 -1.26 -0.73 105.19 111.07 3dk9 n GLY 158 Ca 0.00 -1.49 -0.10 0.00 0.00 0.00 0.00 46.02 44.42 3dk9 n GLY 158 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3dk9 s MET 159 N -0.43 1.20 0.40 1.61 0.23 0.03 -4.75 119.30 117.59 3dk9 s MET 159 Ca 0.00 -0.75 -0.26 0.00 -1.03 0.00 0.00 55.69 53.65 3dk9 s MET 159 Cb 0.00 0.49 -0.09 0.00 -1.53 0.00 0.00 34.83 33.71 3dk9 s MET 159 CO 0.00 -0.49 1.25 -2.14 -2.03 0.00 0.00 175.02 171.61 3dk9 s PRO 160 N -3.83 4.00 0.23 3.16 0.02 -1.26 -0.54 135.00 136.78 3dk9 s PRO 160 Ca 0.05 2.03 -0.30 0.00 0.02 0.00 0.00 61.00 62.80 3dk9 s PRO 160 Cb 0.01 -2.73 -0.09 0.00 0.02 0.00 0.00 34.50 31.71 3dk9 s PRO 160 CO -0.09 -0.42 1.01 0.45 -0.33 0.00 0.00 177.00 177.62 3dk9 s SER 161 N -0.90 7.48 0.06 2.53 0.15 -0.32 -4.69 113.70 118.01 3dk9 s SER 161 Ca 0.57 2.04 0.06 0.00 0.70 0.00 0.00 55.95 59.32 3dk9 s SER 161 Cb -0.35 -2.61 -0.03 0.00 -1.71 0.00 0.00 66.02 61.32 3dk9 s SER 161 CO 0.45 0.00 -0.17 -0.89 1.20 0.00 0.00 173.24 173.83 3dk9 s THR 162 N -0.94 1.33 0.71 6.45 2.01 -1.26 -4.58 115.64 119.36 3dk9 s THR 162 Ca 0.44 -1.19 -0.16 0.00 0.31 0.00 0.00 61.69 61.08 3dk9 s THR 162 Cb -0.28 -1.21 0.03 0.00 0.01 0.00 0.00 72.50 71.05 3dk9 s THR 162 CO 0.35 -0.01 1.22 -2.84 -0.69 0.00 0.00 174.62 172.65 3dk9 s PRO 163 N -1.40 2.23 0.29 4.92 0.02 -1.26 -5.00 135.00 134.80 3dk9 s PRO 163 Ca 0.03 1.83 -0.29 0.00 0.02 0.00 0.00 61.00 62.59 3dk9 s PRO 163 Cb -0.09 -1.84 -0.09 0.00 0.02 0.00 0.00 34.50 32.50 3dk9 s PRO 163 CO 0.02 -1.79 1.04 -1.01 -0.33 0.00 0.00 177.00 174.93 3dk9 s HIS 164 N -1.85 3.67 0.37 6.54 3.76 -1.26 -4.77 115.29 121.74 3dk9 s HIS 164 Ca 0.76 1.76 0.11 0.00 -0.15 0.00 0.00 55.06 57.55 3dk9 s HIS 164 Cb -0.31 -3.16 0.89 0.00 1.11 0.00 0.00 32.58 31.12 3dk9 s HIS 164 CO 0.44 -0.22 1.86 1.49 -0.85 0.00 0.00 174.74 177.45 3dk9 h GLU 165 N 3.71 0.59 0.00 1.40 4.57 -1.95 -0.08 114.58 122.82 3dk9 h GLU 165 Ca -0.46 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 57.66 3dk9 h GLU 165 Cb 1.21 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.66 3dk9 h GLU 165 CO 0.67 0.39 -0.08 0.66 -1.18 0.00 0.00 179.01 179.46 3dk9 h SER 166 N 0.61 0.00 0.06 1.04 4.64 -2.00 -2.74 113.55 115.16 3dk9 h SER 166 Ca 0.47 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.48 3dk9 h SER 166 Cb 0.87 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.93 3dk9 h SER 166 CO -0.21 0.08 -1.66 1.67 -0.87 0.00 0.00 176.83 175.84 3dk9 n GLN 167 N -4.26 0.66 -3.75 4.77 7.27 -0.48 -4.77 117.38 116.82 3dk9 n GLN 167 Ca -0.03 0.42 -0.30 0.00 0.07 0.00 0.00 57.00 57.17 3dk9 n GLN 167 Cb 0.16 -1.72 -0.13 0.00 2.41 0.00 0.00 30.24 30.96 3dk9 n GLN 167 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 3dk9 s ILE 168 N -2.46 1.49 0.33 1.69 1.01 -0.17 -4.94 121.20 118.15 3dk9 s ILE 168 Ca -0.26 -2.46 -0.29 0.00 0.00 0.00 0.00 60.65 57.63 3dk9 s ILE 168 Cb 0.07 -2.05 -0.11 0.00 0.01 0.00 0.00 42.46 40.37 3dk9 s ILE 168 CO 0.67 -0.84 1.54 -2.16 0.00 0.00 0.00 174.94 174.14 3dk9 s PRO 169 N 0.49 4.13 0.00 2.79 0.04 -1.04 -1.75 135.00 139.66 3dk9 s PRO 169 Ca 0.16 2.56 0.00 0.00 0.04 0.00 0.00 61.00 63.76 3dk9 s PRO 169 Cb -0.24 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.30 3dk9 s PRO 169 CO -0.03 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 176.84 3dk9 n GLY 170 N 1.43 0.81 0.33 0.56 0.00 -1.26 -1.16 105.19 105.90 3dk9 n GLY 170 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.21 3dk9 n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk9 h ALA 171 N 0.00 2.22 0.00 4.61 0.00 -1.62 -0.06 119.26 124.41 3dk9 h ALA 171 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dk9 h ALA 171 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dk9 h ALA 171 CO 0.00 -0.31 0.00 -1.13 0.00 0.00 0.00 179.25 177.81 3dk9 n SER 172 N -4.46 0.53 0.16 0.00 3.41 -1.26 -1.56 113.62 110.44 3dk9 n SER 172 Ca 0.04 0.67 0.13 0.00 -0.26 0.00 0.00 58.87 59.46 3dk9 n SER 172 Cb 0.36 -0.77 0.45 0.00 -0.26 0.00 0.00 64.21 63.98 3dk9 n SER 172 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3dk9 h LEU 173 N 0.00 0.00-10.57 1.04 3.38 -1.39 -3.44 115.31 104.32 3dk9 h LEU 173 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 3dk9 h LEU 173 Cb 0.21 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.05 3dk9 h LEU 173 CO 0.00 0.00 0.36 -0.83 0.09 0.00 0.00 178.44 178.06 3dk9 s GLY 174 N -3.74 1.62 0.48 0.83 0.00 -0.60 -4.80 107.32 101.11 3dk9 s GLY 174 Ca 0.06 -0.65 0.04 0.00 0.00 0.00 0.00 44.72 44.18 3dk9 s GLY 174 CO 0.52 -0.21 0.15 -0.26 0.00 0.00 0.00 173.10 173.31 3dk9 s ILE 175 N -3.45 1.67 0.14 0.90 -4.36 0.24 -4.97 121.20 111.38 3dk9 s ILE 175 Ca 0.60 -1.79 0.00 0.00 -0.26 0.00 0.00 60.65 59.20 3dk9 s ILE 175 Cb -0.11 -2.46 -0.00 0.00 1.25 0.00 0.00 42.46 41.14 3dk9 s ILE 175 CO 0.48 0.00 0.00 0.35 0.24 0.00 0.00 174.94 176.02 3dk9 n THR 176 N -1.35 0.00 0.18 8.37 -2.24 -1.26 -0.34 114.28 117.64 3dk9 n THR 176 Ca -0.09 -0.69 0.11 0.00 -2.27 0.00 0.00 64.05 61.11 3dk9 n THR 176 Cb 0.66 0.15 0.64 0.00 -2.10 0.00 0.00 70.33 69.68 3dk9 n THR 176 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3dk9 h SER 177 N 0.36 0.03 -0.38 3.42 4.64 -1.97 -0.14 113.55 119.51 3dk9 h SER 177 Ca -0.12 -0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.21 3dk9 h SER 177 Cb 0.37 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 3dk9 h SER 177 CO 0.20 0.02 0.25 0.44 -0.87 0.00 0.00 176.83 176.86 3dk9 h ASP 178 N 0.03 0.43 0.15 4.97 3.32 -1.95 -2.45 116.42 120.91 3dk9 h ASP 178 Ca 0.07 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 3dk9 h ASP 178 Cb 0.25 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3dk9 h ASP 178 CO -0.00 0.31 -0.28 1.23 -1.72 0.00 0.00 179.24 178.77 3dk9 h GLY 179 N 0.51 0.23 0.33 2.75 0.00 -1.53 -2.73 103.07 102.63 3dk9 h GLY 179 Ca 0.14 -0.18 0.11 0.00 0.00 0.00 0.00 47.33 47.41 3dk9 h GLY 179 CO -0.04 0.16 0.33 -2.75 0.00 0.00 0.00 176.54 174.25 3dk9 h PHE 180 N 0.19 0.58 0.00 5.60 3.04 -0.62 -0.94 116.94 124.80 3dk9 h PHE 180 Ca 0.03 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.01 3dk9 h PHE 180 Cb 0.60 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.96 3dk9 h PHE 180 CO 0.01 0.16 0.00 1.19 -2.02 0.00 0.00 178.31 177.64 3dk9 n PHE 181 N -4.92 0.00 0.88 0.41 3.72 -1.04 -2.34 117.46 114.17 3dk9 n PHE 181 Ca 0.12 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.63 3dk9 n PHE 181 Cb 0.34 -0.29 -0.01 0.00 -0.94 0.00 0.00 39.48 38.57 3dk9 n PHE 181 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3dk9 n GLN 182 N -1.29 0.08 -1.72 -1.08 1.13 -0.40 -4.98 117.38 109.11 3dk9 n GLN 182 Ca 0.10 -0.01 -0.43 0.00 -1.94 0.00 0.00 57.00 54.73 3dk9 n GLN 182 Cb 0.18 -1.52 -0.02 0.00 0.11 0.00 0.00 30.24 29.00 3dk9 n GLN 182 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3dk9 n LEU 183 N -1.61 3.99 -0.08 1.08 4.77 -0.94 -4.90 117.00 119.32 3dk9 n LEU 183 Ca 0.04 1.15 0.08 0.00 -0.03 0.00 0.00 56.01 57.24 3dk9 n LEU 183 Cb 0.36 -1.54 -0.07 0.00 -2.33 0.00 0.00 43.42 39.84 3dk9 n LEU 183 CO 0.41 -0.05 0.02 -0.62 -1.33 0.00 0.00 177.39 175.82 3dk9 n GLU 184 N 2.00 1.79 -3.94 3.23 1.02 -1.26 -4.98 120.64 118.50 3dk9 n GLU 184 Ca 0.09 -0.17 -0.09 0.00 -0.02 0.00 0.00 57.16 56.98 3dk9 n GLU 184 Cb 0.35 -1.25 -0.09 0.00 -0.02 0.00 0.00 31.44 30.44 3dk9 n GLU 184 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3dk9 s GLU 185 N -2.37 0.69 -0.07 3.49 0.41 -1.26 -4.16 118.70 115.43 3dk9 s GLU 185 Ca 0.07 -0.94 -0.30 0.00 -0.41 0.00 0.00 54.97 53.40 3dk9 s GLU 185 Cb 0.12 0.27 -0.04 0.00 -1.78 0.00 0.00 34.13 32.70 3dk9 s GLU 185 CO 0.60 -0.18 1.36 -1.17 -0.49 0.00 0.00 175.26 175.37 3dk9 s LEU 186 N -2.59 4.26 0.31 1.80 2.96 -1.26 -4.99 118.68 119.18 3dk9 s LEU 186 Ca 0.02 1.93 -0.29 0.00 -0.22 0.00 0.00 54.13 55.57 3dk9 s LEU 186 Cb 0.03 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 43.07 3dk9 s LEU 186 CO -0.08 -0.74 1.38 -2.84 -1.32 0.00 0.00 176.35 172.75 3dk9 s PRO 187 N 2.99 4.28 0.17 0.98 0.02 -1.26 -4.92 135.00 137.26 3dk9 s PRO 187 Ca 0.61 2.31 -0.11 0.00 0.02 0.00 0.00 61.00 63.82 3dk9 s PRO 187 Cb -0.27 -3.06 0.05 0.00 0.02 0.00 0.00 34.50 31.24 3dk9 s PRO 187 CO 0.22 -0.32 1.66 0.78 -0.33 0.00 0.00 177.00 179.00 3dk9 h GLY 188 N 3.83 1.01 -6.85 0.52 0.00 -1.94 -3.40 103.07 96.25 3dk9 h GLY 188 Ca -0.48 -0.68 -0.41 0.00 0.00 0.00 0.00 47.33 45.76 3dk9 h GLY 188 CO 0.69 0.63 -0.76 -1.60 0.00 0.00 0.00 176.54 175.49 3dk9 s ARG 189 N -5.20 0.52 -0.01 4.80 6.06 -1.26 -1.15 118.95 122.71 3dk9 s ARG 189 Ca -0.12 0.10 0.06 0.00 -2.50 0.00 0.00 55.73 53.27 3dk9 s ARG 189 Cb 0.13 -0.83 -0.02 0.00 0.06 0.00 0.00 34.95 34.29 3dk9 s ARG 189 CO 0.82 -0.25 -0.20 -1.12 -2.50 0.00 0.00 175.30 172.05 3dk9 s SER 190 N 1.71 2.38 -0.17 -2.12 0.01 -0.15 -1.01 113.70 114.35 3dk9 s SER 190 Ca 0.01 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.89 3dk9 s SER 190 Cb -0.13 -0.26 0.03 0.00 0.21 0.00 0.00 66.02 65.88 3dk9 s SER 190 CO -0.04 0.24 -0.11 -0.69 0.41 0.00 0.00 173.24 173.05 3dk9 s VAL 191 N -0.51 1.48 -0.18 3.43 1.01 0.08 -0.98 120.40 124.72 3dk9 s VAL 191 Ca 0.08 -0.74 -0.08 0.00 0.00 0.00 0.00 61.98 61.24 3dk9 s VAL 191 Cb -0.08 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 3dk9 s VAL 191 CO -0.01 0.30 0.08 -0.63 0.00 0.00 0.00 175.10 174.84 3dk9 s ILE 192 N 1.50 4.96 -0.24 2.22 1.09 -0.03 -0.95 121.20 129.75 3dk9 s ILE 192 Ca 0.02 0.03 -0.06 0.00 -1.10 0.00 0.00 60.65 59.54 3dk9 s ILE 192 Cb -0.14 -3.23 -0.02 0.00 -1.06 0.00 0.00 42.46 38.00 3dk9 s ILE 192 CO -0.09 0.47 0.02 -0.69 -0.10 0.00 0.00 174.94 174.55 3dk9 s VAL 193 N 0.25 3.92 0.00 2.92 1.01 0.16 -0.37 120.40 128.29 3dk9 s VAL 193 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.73 3dk9 s VAL 193 Cb -0.12 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.45 3dk9 s VAL 193 CO -0.00 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.08 3dk9 n GLY 194 N 4.87 3.66 0.00 4.51 0.00 -0.57 -0.46 105.19 117.21 3dk9 n GLY 194 Ca -0.17 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.22 3dk9 n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk9 n ALA 195 N -1.99 1.06 -2.45 4.61 0.00 -1.26 -4.58 120.51 115.90 3dk9 n ALA 195 Ca 0.00 -0.40 -0.08 0.00 0.00 0.00 0.00 53.44 52.96 3dk9 n ALA 195 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 3dk9 n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dk9 n GLY 196 N -0.08 0.88 0.28 0.00 0.00 -1.26 -0.59 105.19 104.42 3dk9 n GLY 196 Ca 0.00 -2.00 -0.03 0.00 0.00 0.00 0.00 46.02 43.99 3dk9 n GLY 196 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3dk9 h TYR 197 N -0.40 0.71 -0.39 1.61 -0.00 -1.98 -1.08 116.97 115.44 3dk9 h TYR 197 Ca -0.11 -0.10 -0.04 0.00 0.00 0.00 0.00 58.73 58.48 3dk9 h TYR 197 Cb 0.43 -0.20 -0.02 0.00 0.00 0.00 0.00 36.73 36.95 3dk9 h TYR 197 CO 0.00 0.69 0.09 0.82 -0.00 0.00 0.00 178.16 179.76 3dk9 h ILE 198 N 0.62 1.23 -0.34 -0.90 2.04 -1.94 -0.04 117.51 118.18 3dk9 h ILE 198 Ca 0.12 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.19 3dk9 h ILE 198 Cb 0.44 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3dk9 h ILE 198 CO 0.02 0.27 0.21 0.00 0.00 0.00 0.00 178.15 178.66 3dk9 h ALA 199 N 0.94 0.43 -0.27 1.87 0.00 -1.69 -0.12 119.26 120.42 3dk9 h ALA 199 Ca 0.12 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3dk9 h ALA 199 Cb 0.32 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3dk9 h ALA 199 CO 0.00 -0.09 0.13 0.28 0.00 0.00 0.00 179.25 179.58 3dk9 h VAL 200 N 0.45 0.99 -0.34 0.00 2.07 -0.96 -1.01 116.25 117.44 3dk9 h VAL 200 Ca 0.12 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 3dk9 h VAL 200 Cb -0.02 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 3dk9 h VAL 200 CO -0.02 0.05 0.10 -0.33 0.02 0.00 0.00 177.57 177.38 3dk9 h GLU 201 N 0.28 0.54 -0.29 1.57 5.08 -0.76 -1.21 114.58 119.79 3dk9 h GLU 201 Ca 0.11 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3dk9 h GLU 201 Cb 0.03 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3dk9 h GLU 201 CO -0.08 0.58 0.12 0.52 -1.00 0.00 0.00 179.01 179.15 3dk9 h MET 202 N 0.40 0.43 -0.67 2.33 2.86 -0.87 -1.45 114.93 117.95 3dk9 h MET 202 Ca 0.11 -0.07 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 3dk9 h MET 202 Cb 0.27 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 3dk9 h MET 202 CO -0.00 0.43 0.42 0.00 1.06 0.00 0.00 176.91 178.82 3dk9 h ALA 203 N 0.97 0.87 -0.55 6.32 0.00 -1.12 -1.07 119.26 124.69 3dk9 h ALA 203 Ca 0.10 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3dk9 h ALA 203 Cb 0.16 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3dk9 h ALA 203 CO -0.01 0.18 0.06 0.78 0.00 0.00 0.00 179.25 180.26 3dk9 h GLY 204 N 0.82 0.96 0.59 0.00 0.00 -0.98 -1.01 103.07 103.44 3dk9 h GLY 204 Ca 0.27 -0.62 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 3dk9 h GLY 204 CO -0.11 0.58 -0.01 -2.22 0.00 0.00 0.00 176.54 174.78 3dk9 h ILE 205 N 0.84 1.30 -0.89 2.60 2.04 -1.07 -1.30 117.51 121.03 3dk9 h ILE 205 Ca 0.17 -0.94 0.01 0.00 1.00 0.00 0.00 64.86 65.09 3dk9 h ILE 205 Cb 0.42 1.93 -0.04 0.00 -0.74 0.00 0.00 36.82 38.38 3dk9 h ILE 205 CO 0.01 0.24 0.58 -0.07 0.00 0.00 0.00 178.15 178.91 3dk9 h LEU 206 N -0.42 1.03 -0.22 1.44 3.38 -1.11 -1.76 115.31 117.65 3dk9 h LEU 206 Ca -0.00 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 3dk9 h LEU 206 Cb 0.41 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3dk9 h LEU 206 CO 0.00 0.76 -0.28 -1.28 0.09 0.00 0.00 178.44 177.74 3dk9 h SER 207 N 1.21 0.63 -0.67 -0.43 0.87 -1.19 -0.32 113.55 113.65 3dk9 h SER 207 Ca 0.32 -0.50 0.02 0.00 -1.23 0.00 0.00 61.79 60.40 3dk9 h SER 207 Cb -0.12 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.63 3dk9 h SER 207 CO -0.07 1.00 0.44 0.00 -0.53 0.00 0.00 176.83 177.67 3dk9 h ALA 208 N 0.65 1.56 -0.00 6.23 0.00 -0.98 -2.09 119.26 124.62 3dk9 h ALA 208 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dk9 h ALA 208 Cb 0.85 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3dk9 h ALA 208 CO 0.07 0.39 -0.06 1.28 0.00 0.00 0.00 179.25 180.93 3dk9 n LEU 209 N -4.44 0.33 0.00 0.00 4.77 -0.68 -4.80 117.00 112.17 3dk9 n LEU 209 Ca 0.07 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3dk9 n LEU 209 Cb 0.07 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3dk9 n LEU 209 CO 0.36 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 3dk9 n GLY 210 N 1.24 1.17 3.76 -0.72 0.00 -0.79 -4.78 105.19 105.08 3dk9 n GLY 210 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 3dk9 n GLY 210 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dk9 s SER 211 N -1.07 7.10 -0.58 1.61 0.15 -0.16 -4.97 113.70 115.77 3dk9 s SER 211 Ca 0.00 2.22 -0.28 0.00 0.70 0.00 0.00 55.95 58.59 3dk9 s SER 211 Cb 0.00 -2.62 0.01 0.00 -1.71 0.00 0.00 66.02 61.71 3dk9 s SER 211 CO 0.00 -0.26 1.41 -0.75 1.20 0.00 0.00 173.24 174.85 3dk9 s LYS 212 N -1.74 3.26 -0.05 5.44 2.20 -0.30 -4.29 119.74 124.26 3dk9 s LYS 212 Ca 0.48 0.38 0.05 0.00 -0.36 0.00 0.00 55.97 56.53 3dk9 s LYS 212 Cb -0.30 -4.14 -0.02 0.00 -1.51 0.00 0.00 37.83 31.87 3dk9 s LYS 212 CO 0.38 -1.99 -0.21 0.99 -0.36 0.00 0.00 175.35 174.15 3dk9 s THR 213 N 6.13 2.40 0.13 3.43 2.01 -1.26 -0.97 115.64 127.51 3dk9 s THR 213 Ca 0.51 -0.95 0.11 0.00 0.31 0.00 0.00 61.69 61.66 3dk9 s THR 213 Cb -0.10 -1.90 -0.04 0.00 0.01 0.00 0.00 72.50 70.47 3dk9 s THR 213 CO 0.24 0.57 -0.25 -0.44 -0.69 0.00 0.00 174.62 174.05 3dk9 s SER 214 N -0.36 3.42 -0.19 3.53 0.01 -0.15 -1.51 113.70 118.44 3dk9 s SER 214 Ca 0.03 -0.71 0.01 0.00 1.31 0.00 0.00 55.95 56.58 3dk9 s SER 214 Cb -0.12 -0.28 0.04 0.00 0.21 0.00 0.00 66.02 65.87 3dk9 s SER 214 CO 0.02 0.18 -0.12 -0.22 0.41 0.00 0.00 173.24 173.51 3dk9 s LEU 215 N -2.05 2.27 -0.29 2.44 2.96 0.39 -0.85 118.68 123.55 3dk9 s LEU 215 Ca 0.15 -0.85 -0.11 0.00 -0.22 0.00 0.00 54.13 53.10 3dk9 s LEU 215 Cb -0.10 -1.27 -0.04 0.00 0.50 0.00 0.00 46.19 45.28 3dk9 s LEU 215 CO 0.07 -0.12 0.19 -0.32 -1.32 0.00 0.00 176.35 174.84 3dk9 s MET 216 N 1.38 3.84 0.09 1.98 -2.45 0.50 -0.63 119.30 124.00 3dk9 s MET 216 Ca -0.00 -0.40 0.07 0.00 -1.25 0.00 0.00 55.69 54.11 3dk9 s MET 216 Cb -0.16 -3.65 -0.03 0.00 1.25 0.00 0.00 34.83 32.24 3dk9 s MET 216 CO -0.09 -0.23 -0.19 0.96 1.05 0.00 0.00 175.02 176.53 3dk9 s ILE 217 N 1.74 1.50 0.05 10.11 -4.36 -0.43 -1.51 121.20 128.30 3dk9 s ILE 217 Ca 0.07 -1.43 0.20 0.00 -0.26 0.00 0.00 60.65 59.22 3dk9 s ILE 217 Cb -0.16 -1.38 0.16 0.00 1.25 0.00 0.00 42.46 42.32 3dk9 s ILE 217 CO 0.10 -0.09 1.68 0.03 0.24 0.00 0.00 174.94 176.90 3dk9 h ARG 218 N 4.22 0.00 0.00 0.37 3.08 -1.85 -0.91 114.38 119.29 3dk9 h ARG 218 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.61 3dk9 h ARG 218 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 3dk9 h ARG 218 CO 0.40 0.34 0.00 0.72 -1.07 0.00 0.00 179.97 180.36 3dk9 n HIS 219 N -3.38 0.00 0.01 3.04 8.25 -1.26 -3.78 115.22 118.11 3dk9 n HIS 219 Ca 0.01 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.56 3dk9 n HIS 219 Cb 0.54 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.53 3dk9 n HIS 219 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 3dk9 n ASP 220 N 0.00 0.26 -4.02 0.41 3.85 -1.26 -0.82 116.55 114.96 3dk9 n ASP 220 Ca 0.00 0.10 -0.08 0.00 -0.71 0.00 0.00 54.79 54.10 3dk9 n ASP 220 Cb 0.00 1.45 -0.10 0.00 -1.35 0.00 0.00 41.12 41.12 3dk9 n ASP 220 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3dk9 s LYS 221 N -3.38 0.61 0.63 0.11 1.02 -1.26 -4.97 119.74 112.50 3dk9 s LYS 221 Ca -0.06 -1.05 -0.05 0.00 0.02 0.00 0.00 55.97 54.83 3dk9 s LYS 221 Cb 0.12 0.22 0.03 0.00 -0.52 0.00 0.00 37.83 37.69 3dk9 s LYS 221 CO 0.87 -0.13 0.93 0.14 -0.92 0.00 0.00 175.35 176.24 3dk9 s VAL 222 N -3.45 2.99 -1.35 3.17 -7.23 -1.26 -4.54 120.40 108.73 3dk9 s VAL 222 Ca 0.02 -0.19 -0.02 0.00 -1.81 0.00 0.00 61.98 59.98 3dk9 s VAL 222 Cb 0.04 -3.22 0.01 0.00 0.56 0.00 0.00 36.38 33.78 3dk9 s VAL 222 CO -0.08 -0.22 0.74 0.18 -0.31 0.00 0.00 175.10 175.40 3dk9 n LEU 223 N -2.69 -2.99 0.19 1.32 4.77 0.25 -4.49 117.00 113.36 3dk9 n LEU 223 Ca 0.06 -0.82 0.14 0.00 -0.03 0.00 0.00 56.01 55.36 3dk9 n LEU 223 Cb 0.59 -2.63 0.55 0.00 -2.33 0.00 0.00 43.42 39.59 3dk9 n LEU 223 CO 0.52 0.42 0.91 0.03 -1.33 0.00 0.00 177.39 177.94 3dk9 h ARG 224 N -1.91 0.00 0.00 3.23 3.08 -1.80 -0.86 114.38 116.12 3dk9 h ARG 224 Ca -0.61 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.44 3dk9 h ARG 224 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.41 3dk9 h ARG 224 CO 0.58 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 178.35 3dk9 n SER 225 N -2.61 0.37 -4.73 7.04 3.41 -1.26 -4.85 113.62 110.99 3dk9 n SER 225 Ca 0.02 0.54 -0.27 0.00 -0.26 0.00 0.00 58.87 58.90 3dk9 n SER 225 Cb 0.29 -0.64 0.10 0.00 -0.26 0.00 0.00 64.21 63.70 3dk9 n SER 225 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3dk9 s PHE 226 N -3.05 2.47 0.44 7.33 0.40 -0.33 -5.01 117.98 120.23 3dk9 s PHE 226 Ca 0.12 0.36 -0.25 0.00 -0.60 0.00 0.00 56.93 56.56 3dk9 s PHE 226 Cb 0.15 -3.40 -0.09 0.00 0.51 0.00 0.00 43.02 40.19 3dk9 s PHE 226 CO 0.54 -1.76 1.24 -3.47 0.70 0.00 0.00 175.22 172.47 3dk9 n ASP 227 N -3.14 2.35 -0.31 1.36 2.03 -1.26 -4.69 116.55 112.89 3dk9 n ASP 227 Ca 0.10 1.08 0.19 0.00 0.52 0.00 0.00 54.79 56.68 3dk9 n ASP 227 Cb 0.60 -1.49 0.45 0.00 -0.72 0.00 0.00 41.12 39.97 3dk9 n ASP 227 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3dk9 h SER 228 N 1.92 0.54 -0.74 1.67 4.64 -1.92 -0.16 113.55 119.50 3dk9 h SER 228 Ca -0.48 0.07 -0.05 0.00 -0.47 0.00 0.00 61.79 60.86 3dk9 h SER 228 Cb 1.30 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 63.34 3dk9 h SER 228 CO 0.59 0.17 0.25 -0.03 -0.87 0.00 0.00 176.83 176.93 3dk9 h MET 229 N 0.51 1.13 -0.26 4.77 -1.53 -1.99 -1.32 114.93 116.24 3dk9 h MET 229 Ca 0.55 -0.23 -0.07 0.00 -3.44 0.00 0.00 59.70 56.51 3dk9 h MET 229 Cb 1.22 -0.17 -0.01 0.00 -0.55 0.00 0.00 31.60 32.09 3dk9 h MET 229 CO -0.28 0.95 -0.10 0.82 0.14 0.00 0.00 176.91 178.44 3dk9 h ILE 230 N 1.08 1.29 -0.39 1.77 1.08 -1.41 -0.60 117.51 120.33 3dk9 h ILE 230 Ca 0.24 -1.16 0.05 0.00 -0.39 0.00 0.00 64.86 63.60 3dk9 h ILE 230 Cb 0.28 1.51 -0.04 0.00 -3.07 0.00 0.00 36.82 35.50 3dk9 h ILE 230 CO -0.01 0.36 0.14 -1.28 -0.69 0.00 0.00 178.15 176.67 3dk9 h SER 231 N 0.25 0.14 0.43 1.72 0.87 -1.12 0.72 113.55 116.58 3dk9 h SER 231 Ca 0.06 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 3dk9 h SER 231 Cb 0.59 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 3dk9 h SER 231 CO 0.03 0.12 -0.21 0.74 -0.53 0.00 0.00 176.83 176.98 3dk9 h THR 232 N 0.29 0.57 -0.73 2.23 2.02 -1.21 -2.68 112.91 113.41 3dk9 h THR 232 Ca 0.18 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 3dk9 h THR 232 Cb 0.16 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 3dk9 h THR 232 CO -0.18 0.03 0.35 -1.13 0.37 0.00 0.00 175.52 174.96 3dk9 h ASN 233 N -0.69 0.96 -0.75 4.18 -1.24 -0.92 -1.75 115.58 115.37 3dk9 h ASN 233 Ca -0.06 -0.13 -0.05 0.00 0.71 0.00 0.00 56.30 56.77 3dk9 h ASN 233 Cb 0.50 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.27 3dk9 h ASN 233 CO 0.10 0.82 0.29 0.00 -1.29 0.00 0.00 177.43 177.35 3dk9 h THR 235 N 1.08 1.13 -0.60 0.00 2.02 -1.19 -1.12 112.91 114.22 3dk9 h THR 235 Ca 0.25 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 3dk9 h THR 235 Cb 0.23 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 3dk9 h THR 235 CO -0.02 0.13 0.30 -0.33 0.37 0.00 0.00 175.52 175.97 3dk9 h GLU 236 N 0.36 0.86 -0.51 6.66 5.08 -0.94 -2.18 114.58 123.91 3dk9 h GLU 236 Ca 0.10 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 3dk9 h GLU 236 Cb 0.06 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 3dk9 h GLU 236 CO -0.02 0.68 -0.03 0.93 -1.00 0.00 0.00 179.01 179.57 3dk9 h GLU 237 N 0.82 0.88 -0.04 2.33 4.39 -0.81 0.21 114.58 122.36 3dk9 h GLU 237 Ca 0.21 -0.27 0.02 0.00 0.34 0.00 0.00 59.36 59.66 3dk9 h GLU 237 Cb 0.09 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 3dk9 h GLU 237 CO -0.03 0.90 -0.07 -0.07 -1.16 0.00 0.00 179.01 178.58 3dk9 h LEU 238 N 0.81 -0.22 -0.67 1.33 3.38 -0.97 -1.52 115.31 117.45 3dk9 h LEU 238 Ca 0.15 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3dk9 h LEU 238 Cb 0.53 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 3dk9 h LEU 238 CO 0.03 -0.11 0.42 -0.33 0.09 0.00 0.00 178.44 178.54 3dk9 h GLU 239 N -0.11 0.89 0.00 1.13 5.08 -1.10 -1.72 114.58 118.75 3dk9 h GLU 239 Ca 0.04 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3dk9 h GLU 239 Cb 0.17 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 3dk9 h GLU 239 CO -0.10 0.62 -0.09 -0.91 -1.00 0.00 0.00 179.01 177.52 3dk9 h ASN 240 N 0.90 0.00 -0.01 1.42 2.35 -0.70 -1.30 115.58 118.24 3dk9 h ASN 240 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3dk9 h ASN 240 Cb -0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.31 3dk9 h ASN 240 CO -0.05 0.09 0.00 0.00 -1.65 0.00 0.00 177.43 175.83 3dk9 n ALA 241 N -2.36 2.62 -0.09 -0.83 0.00 -0.59 -4.91 120.51 114.34 3dk9 n ALA 241 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3dk9 n ALA 241 Cb 0.19 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.32 3dk9 n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dk9 n GLY 242 N 1.08 0.60 3.69 0.00 0.00 -0.49 -4.92 105.19 105.14 3dk9 n GLY 242 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3dk9 n GLY 242 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dk9 s VAL 243 N -2.16 4.63 -0.42 1.61 1.01 -0.70 -4.66 120.40 119.70 3dk9 s VAL 243 Ca 0.00 1.91 -0.29 0.00 0.00 0.00 0.00 61.98 63.60 3dk9 s VAL 243 Cb 0.00 -4.23 0.02 0.00 0.00 0.00 0.00 36.38 32.18 3dk9 s VAL 243 CO 0.00 0.01 1.14 -0.70 0.00 0.00 0.00 175.10 175.55 3dk9 s GLU 244 N 1.98 3.83 -0.39 2.72 2.12 -0.57 -3.94 118.70 124.46 3dk9 s GLU 244 Ca 0.51 0.77 -0.18 0.00 0.36 0.00 0.00 54.97 56.42 3dk9 s GLU 244 Cb -0.20 -3.86 0.01 0.00 0.26 0.00 0.00 34.13 30.33 3dk9 s GLU 244 CO 0.20 -1.24 0.50 0.08 -0.54 0.00 0.00 175.26 174.26 3dk9 s VAL 245 N 4.26 5.02 -0.65 3.70 1.01 -1.26 -0.46 120.40 132.01 3dk9 s VAL 245 Ca 0.48 0.05 -0.19 0.00 0.00 0.00 0.00 61.98 62.32 3dk9 s VAL 245 Cb -0.09 -4.02 0.11 0.00 0.00 0.00 0.00 36.38 32.37 3dk9 s VAL 245 CO 0.26 -0.34 0.80 -0.76 0.00 0.00 0.00 175.10 175.06 3dk9 s LEU 246 N 2.36 5.24 0.34 3.92 1.43 0.20 -4.96 118.68 127.21 3dk9 s LEU 246 Ca 0.17 -1.48 -0.14 0.00 -1.03 0.00 0.00 54.13 51.65 3dk9 s LEU 246 Cb -0.16 -2.33 -0.08 0.00 0.03 0.00 0.00 46.19 43.65 3dk9 s LEU 246 CO 0.14 -1.15 0.74 -0.54 0.23 0.00 0.00 176.35 175.78 3dk9 s LYS 247 N 2.82 3.94 -1.56 1.70 1.02 -1.26 -1.31 119.74 125.10 3dk9 s LYS 247 Ca 0.16 0.62 -0.12 0.00 0.02 0.00 0.00 55.97 56.64 3dk9 s LYS 247 Cb -0.20 -2.42 0.09 0.00 -0.52 0.00 0.00 37.83 34.78 3dk9 s LYS 247 CO 0.05 0.11 0.80 1.19 -0.92 0.00 0.00 175.35 176.57 3dk9 n PHE 248 N -0.60 -1.96 -4.77 3.18 3.01 -0.00 -4.70 117.46 111.61 3dk9 n PHE 248 Ca 0.03 0.84 -0.24 0.00 1.01 0.00 0.00 57.45 59.09 3dk9 n PHE 248 Cb 0.53 -3.59 -0.15 0.00 -0.01 0.00 0.00 39.48 36.26 3dk9 n PHE 248 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 3dk9 s SER 249 N -3.55 1.92 0.02 4.37 0.01 -0.41 -0.93 113.70 115.12 3dk9 s SER 249 Ca 0.54 -0.30 0.01 0.00 1.31 0.00 0.00 55.95 57.51 3dk9 s SER 249 Cb -0.28 -0.21 -0.02 0.00 0.21 0.00 0.00 66.02 65.72 3dk9 s SER 249 CO 0.87 0.20 -0.04 -1.10 0.41 0.00 0.00 173.24 173.58 3dk9 s GLN 250 N -0.38 0.36 -0.02 12.44 -0.21 -0.24 -4.01 119.66 127.61 3dk9 s GLN 250 Ca 0.06 -0.59 -0.27 0.00 0.02 0.00 0.00 55.36 54.58 3dk9 s GLN 250 Cb -0.06 -0.06 -0.04 0.00 1.00 0.00 0.00 33.01 33.85 3dk9 s GLN 250 CO -0.01 -0.00 0.85 0.08 -2.12 0.00 0.00 175.29 174.09 3dk9 s VAL 251 N -1.25 4.91 -0.19 1.09 1.01 -1.26 -0.85 120.40 123.86 3dk9 s VAL 251 Ca -0.12 1.79 0.10 0.00 0.00 0.00 0.00 61.98 63.75 3dk9 s VAL 251 Cb -0.09 -4.20 -0.23 0.00 0.00 0.00 0.00 36.38 31.87 3dk9 s VAL 251 CO -0.00 0.22 0.09 1.17 0.00 0.00 0.00 175.10 176.58 3dk9 n LYS 252 N 3.70 0.68 -3.50 2.72 4.81 0.35 -4.92 118.16 122.00 3dk9 n LYS 252 Ca 0.02 0.10 -0.12 0.00 -0.87 0.00 0.00 58.31 57.45 3dk9 n LYS 252 Cb 0.51 -1.58 -0.03 0.00 0.02 0.00 0.00 35.03 33.95 3dk9 n LYS 252 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 3dk9 s GLU 253 N -2.52 0.97 -0.02 1.64 2.12 -1.21 -4.04 118.70 115.64 3dk9 s GLU 253 Ca -0.18 -0.15 0.03 0.00 0.36 0.00 0.00 54.97 55.04 3dk9 s GLU 253 Cb 0.07 0.45 -0.00 0.00 0.26 0.00 0.00 34.13 34.91 3dk9 s GLU 253 CO 0.76 -0.38 -0.10 0.08 -0.54 0.00 0.00 175.26 175.07 3dk9 s VAL 254 N -2.53 0.84 0.01 3.70 1.01 -0.31 -0.81 120.40 122.32 3dk9 s VAL 254 Ca -0.01 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.56 3dk9 s VAL 254 Cb -0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 36.38 35.64 3dk9 s VAL 254 CO -0.04 0.25 -0.08 -0.54 0.00 0.00 0.00 175.10 174.68 3dk9 s LYS 255 N -0.09 0.60 0.13 2.72 1.02 -0.51 -4.02 119.74 119.59 3dk9 s LYS 255 Ca 0.01 -0.45 -0.30 0.00 0.02 0.00 0.00 55.97 55.25 3dk9 s LYS 255 Cb -0.06 -0.53 -0.07 0.00 -0.52 0.00 0.00 37.83 36.65 3dk9 s LYS 255 CO -0.00 0.13 1.16 0.21 -0.92 0.00 0.00 175.35 175.94 3dk9 s LYS 256 N -0.66 4.50 0.42 1.68 2.47 -1.26 -0.74 119.74 126.16 3dk9 s LYS 256 Ca -0.01 1.77 0.04 0.00 -1.56 0.00 0.00 55.97 56.22 3dk9 s LYS 256 Cb -0.05 -3.30 -0.05 0.00 -1.46 0.00 0.00 37.83 32.97 3dk9 s LYS 256 CO 0.00 -0.10 0.04 0.95 0.16 0.00 0.00 175.35 176.40 3dk9 s THR 257 N 0.33 1.35 0.39 3.43 -4.23 0.11 -4.88 115.64 112.15 3dk9 s THR 257 Ca 0.54 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.11 3dk9 s THR 257 Cb -0.30 -2.60 0.24 0.00 1.34 0.00 0.00 72.50 71.18 3dk9 s THR 257 CO 0.33 0.00 2.02 -0.07 -0.54 0.00 0.00 174.62 176.36 3dk9 h LEU 258 N 1.72 0.48 -0.73 4.79 3.38 -2.00 -3.02 115.31 119.93 3dk9 h LEU 258 Ca -0.42 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3dk9 h LEU 258 Cb 1.27 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3dk9 h LEU 258 CO 0.73 0.40 -0.31 -0.24 0.09 0.00 0.00 178.44 179.11 3dk9 n SER 259 N -4.43 1.33 0.00 -0.43 2.88 -1.26 -5.06 113.62 106.65 3dk9 n SER 259 Ca 0.03 -1.17 0.00 0.00 -1.33 0.00 0.00 58.87 56.40 3dk9 n SER 259 Cb 0.10 0.53 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 3dk9 n SER 259 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dk9 n GLY 260 N 1.05 -0.59 3.30 0.46 0.00 -1.14 -4.85 105.19 103.41 3dk9 n GLY 260 Ca 0.05 0.17 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 3dk9 n GLY 260 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dk9 s LEU 261 N 0.00 2.05 -0.23 0.99 1.43 0.42 0.09 118.68 123.44 3dk9 s LEU 261 Ca 0.00 -0.48 -0.09 0.00 -1.03 0.00 0.00 54.13 52.53 3dk9 s LEU 261 Cb 0.00 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 3dk9 s LEU 261 CO 0.00 0.30 0.12 -0.70 0.23 0.00 0.00 176.35 176.30 3dk9 s GLU 262 N -0.50 3.93 -0.26 1.70 2.12 0.08 -1.24 118.70 124.54 3dk9 s GLU 262 Ca 0.07 -0.35 -0.10 0.00 0.36 0.00 0.00 54.97 54.95 3dk9 s GLU 262 Cb -0.11 -3.42 -0.04 0.00 0.26 0.00 0.00 34.13 30.82 3dk9 s GLU 262 CO 0.00 0.03 0.15 0.08 -0.54 0.00 0.00 175.26 174.98 3dk9 s VAL 263 N 1.09 5.06 -0.28 3.70 1.01 -0.20 -1.42 120.40 129.36 3dk9 s VAL 263 Ca 0.06 0.08 -0.20 0.00 0.00 0.00 0.00 61.98 61.92 3dk9 s VAL 263 Cb -0.14 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 3dk9 s VAL 263 CO 0.04 0.30 0.62 -0.55 0.00 0.00 0.00 175.10 175.51 3dk9 s SER 264 N 1.49 6.52 -0.05 3.32 0.15 0.01 -0.32 113.70 124.83 3dk9 s SER 264 Ca 0.07 0.55 0.05 0.00 0.70 0.00 0.00 55.95 57.31 3dk9 s SER 264 Cb -0.15 -2.33 -0.02 0.00 -1.71 0.00 0.00 66.02 61.81 3dk9 s SER 264 CO 0.07 -0.42 -0.18 -0.32 1.20 0.00 0.00 173.24 173.60 3dk9 s MET 265 N 2.54 2.44 -0.17 5.44 0.00 -0.27 -0.50 119.30 128.79 3dk9 s MET 265 Ca 0.25 -0.77 -0.03 0.00 0.00 0.00 0.00 55.69 55.14 3dk9 s MET 265 Cb -0.15 -2.29 -0.02 0.00 0.00 0.00 0.00 34.83 32.36 3dk9 s MET 265 CO 0.10 0.58 -0.05 0.08 0.00 0.00 0.00 175.02 175.73 3dk9 s VAL 266 N -0.62 3.65 -0.11 10.11 1.01 -0.03 -0.82 120.40 133.60 3dk9 s VAL 266 Ca 0.09 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.65 3dk9 s VAL 266 Cb -0.11 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.65 3dk9 s VAL 266 CO 0.00 0.48 -0.16 -0.89 0.00 0.00 0.00 175.10 174.53 3dk9 s THR 267 N 0.62 2.80 -0.41 3.92 2.01 0.12 -1.07 115.64 123.63 3dk9 s THR 267 Ca -0.03 -0.76 0.04 0.00 0.31 0.00 0.00 61.69 61.24 3dk9 s THR 267 Cb -0.15 -2.14 0.17 0.00 0.01 0.00 0.00 72.50 70.39 3dk9 s THR 267 CO 0.03 0.54 0.35 0.00 -0.69 0.00 0.00 174.62 174.85 3dk9 s ALA 268 N 0.16 1.28 0.14 7.40 0.00 -0.11 -0.96 121.76 129.67 3dk9 s ALA 268 Ca -0.09 -2.38 -0.30 0.00 0.00 0.00 0.00 51.96 49.19 3dk9 s ALA 268 Cb -0.15 -1.62 -0.07 0.00 0.00 0.00 0.00 23.12 21.28 3dk9 s ALA 268 CO 0.05 -1.98 1.02 0.08 0.00 0.00 0.00 175.76 174.94 3dk9 s VAL 269 N 0.10 4.22 0.25 0.00 1.01 -1.26 -4.87 120.40 119.84 3dk9 s VAL 269 Ca 0.33 1.87 -0.31 0.00 0.00 0.00 0.00 61.98 63.87 3dk9 s VAL 269 Cb 0.04 -4.19 -0.13 0.00 0.00 0.00 0.00 36.38 32.09 3dk9 s VAL 269 CO -0.19 0.30 1.40 -2.65 0.00 0.00 0.00 175.10 173.96 3dk9 n PRO 270 N 2.62 2.05 -0.29 2.72 -0.02 -1.26 -1.63 135.00 139.20 3dk9 n PRO 270 Ca 0.03 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3dk9 n PRO 270 Cb 0.48 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3dk9 n PRO 270 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dk9 n GLY 271 N 2.04 1.66 3.71 -1.23 0.00 -1.26 -5.03 105.19 105.08 3dk9 n GLY 271 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 3dk9 n GLY 271 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dk9 s ARG 272 N -0.27 2.13 0.29 1.61 0.52 -0.64 -5.14 118.95 117.44 3dk9 s ARG 272 Ca 0.00 -2.00 -0.09 0.00 -0.52 0.00 0.00 55.73 53.12 3dk9 s ARG 272 Cb 0.00 -1.83 -0.07 0.00 0.52 0.00 0.00 34.95 33.58 3dk9 s ARG 272 CO 0.00 -0.15 0.61 -0.51 0.02 0.00 0.00 175.30 175.27 3dk9 s LEU 273 N -3.86 4.07 0.49 2.53 1.43 -1.26 -4.68 118.68 117.41 3dk9 s LEU 273 Ca 0.35 0.92 -0.23 0.00 -1.03 0.00 0.00 54.13 54.14 3dk9 s LEU 273 Cb 0.05 -3.73 -0.06 0.00 0.03 0.00 0.00 46.19 42.48 3dk9 s LEU 273 CO 0.19 -0.18 1.36 -2.84 0.23 0.00 0.00 176.35 175.11 3dk9 s PRO 274 N -3.24 3.45 -0.01 1.29 0.02 -1.26 -4.70 135.00 130.55 3dk9 s PRO 274 Ca 0.48 2.24 -0.01 0.00 0.02 0.00 0.00 61.00 63.72 3dk9 s PRO 274 Cb -0.11 -2.44 0.00 0.00 0.02 0.00 0.00 34.50 31.97 3dk9 s PRO 274 CO 0.25 -0.95 0.04 0.54 -0.33 0.00 0.00 177.00 176.55 3dk9 s VAL 275 N -1.29 0.00 -0.13 3.83 0.11 -0.13 -4.99 120.40 117.80 3dk9 s VAL 275 Ca 0.66 -0.01 -0.14 0.00 -2.93 0.00 0.00 61.98 59.56 3dk9 s VAL 275 Cb -0.40 -0.06 -0.05 0.00 -1.53 0.00 0.00 36.38 34.34 3dk9 s VAL 275 CO 0.49 -0.01 0.32 -0.04 -3.33 0.00 0.00 175.10 172.54 3dk9 s MET 276 N 0.00 4.17 -0.03 1.54 -1.94 -1.26 -0.70 119.30 121.08 3dk9 s MET 276 Ca -0.00 0.16 0.03 0.00 -1.71 0.00 0.00 55.69 54.17 3dk9 s MET 276 Cb -0.00 -3.39 0.00 0.00 2.01 0.00 0.00 34.83 33.45 3dk9 s MET 276 CO 0.00 0.32 -0.10 0.99 -0.01 0.00 0.00 175.02 176.22 3dk9 s THR 277 N 0.19 0.86 -0.08 2.05 2.01 0.00 -4.99 115.64 115.69 3dk9 s THR 277 Ca 0.18 -0.40 -0.20 0.00 0.31 0.00 0.00 61.69 61.59 3dk9 s THR 277 Cb -0.14 -0.77 -0.04 0.00 0.01 0.00 0.00 72.50 71.56 3dk9 s THR 277 CO 0.06 0.27 0.55 -0.04 -0.69 0.00 0.00 174.62 174.77 3dk9 s MET 278 N 0.22 4.34 -0.43 4.92 -1.94 -1.26 -1.11 119.30 124.03 3dk9 s MET 278 Ca -0.04 0.61 -0.11 0.00 -1.71 0.00 0.00 55.69 54.45 3dk9 s MET 278 Cb -0.09 -3.41 0.08 0.00 2.01 0.00 0.00 34.83 33.41 3dk9 s MET 278 CO 0.01 0.20 0.30 0.42 -0.01 0.00 0.00 175.02 175.93 3dk9 s ILE 279 N 0.44 4.47 0.55 2.53 1.01 0.56 -4.96 121.20 125.79 3dk9 s ILE 279 Ca 0.30 -1.34 -0.04 0.00 0.00 0.00 0.00 60.65 59.56 3dk9 s ILE 279 Cb -0.16 -3.73 0.01 0.00 0.01 0.00 0.00 42.46 38.58 3dk9 s ILE 279 CO 0.14 -0.54 0.83 -2.16 0.00 0.00 0.00 174.94 173.21 3dk9 s PRO 280 N 1.47 2.96 -1.32 2.79 0.04 -1.26 -1.04 135.00 138.65 3dk9 s PRO 280 Ca 0.03 -0.15 -0.08 0.00 0.04 0.00 0.00 61.00 60.85 3dk9 s PRO 280 Cb -0.24 -2.35 0.01 0.00 0.04 0.00 0.00 34.50 31.96 3dk9 s PRO 280 CO 0.03 -0.58 1.15 -0.25 0.04 0.00 0.00 177.00 177.39 3dk9 n ASP 281 N -2.44 -5.90 -4.69 6.66 10.43 -1.18 -4.94 116.55 114.49 3dk9 n ASP 281 Ca 0.04 -0.54 -0.39 0.00 2.57 0.00 0.00 54.79 56.47 3dk9 n ASP 281 Cb 0.58 -4.96 -0.06 0.00 1.84 0.00 0.00 41.12 38.51 3dk9 n ASP 281 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3dk9 s VAL 282 N -3.32 5.08 -0.04 2.53 1.01 -0.37 -4.70 120.40 120.60 3dk9 s VAL 282 Ca 0.52 1.15 -0.12 0.00 0.00 0.00 0.00 61.98 63.53 3dk9 s VAL 282 Cb -0.23 -3.92 -0.32 0.00 0.00 0.00 0.00 36.38 31.92 3dk9 s VAL 282 CO 0.72 0.21 0.73 0.44 0.00 0.00 0.00 175.10 177.19 3dk9 h ASP 283 N 7.11 0.66 -3.28 3.32 5.19 -1.38 0.12 116.42 128.16 3dk9 h ASP 283 Ca -0.36 -0.93 -0.54 0.00 -0.62 0.00 0.00 57.03 54.57 3dk9 h ASP 283 Cb 1.17 -0.22 -0.38 0.00 0.18 0.00 0.00 39.33 40.08 3dk9 h ASP 283 CO 0.76 1.77 -0.79 0.00 -3.12 0.00 0.00 179.24 177.86 3dk9 s LEU 285 N 1.69 3.27 -0.23 0.00 2.96 -1.26 -0.74 118.68 124.36 3dk9 s LEU 285 Ca 0.02 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 3dk9 s LEU 285 Cb -0.14 -1.83 0.03 0.00 0.50 0.00 0.00 46.19 44.75 3dk9 s LEU 285 CO -0.08 -0.06 -0.13 -0.22 -1.32 0.00 0.00 176.35 174.55 3dk9 s LEU 286 N 1.53 2.88 -0.26 -0.68 0.20 -0.12 -0.59 118.68 121.63 3dk9 s LEU 286 Ca 0.05 -0.96 -0.27 0.00 0.69 0.00 0.00 54.13 53.63 3dk9 s LEU 286 Cb -0.15 -1.56 0.01 0.00 -0.43 0.00 0.00 46.19 44.06 3dk9 s LEU 286 CO 0.00 -0.10 0.97 0.26 -0.29 0.00 0.00 176.35 177.19 3dk9 s TRP 287 N 1.24 3.27 -0.46 5.38 0.52 0.54 -0.67 118.94 128.77 3dk9 s TRP 287 Ca -0.01 1.25 0.09 0.00 0.02 0.00 0.00 56.10 57.45 3dk9 s TRP 287 Cb -0.16 -3.32 0.33 0.00 -1.15 0.00 0.00 33.47 29.16 3dk9 s TRP 287 CO -0.08 -0.54 0.78 0.00 0.02 0.00 0.00 176.95 177.13 3dk9 n ALA 288 N 6.38 3.03 0.53 0.98 0.00 0.40 -4.32 120.51 127.50 3dk9 n ALA 288 Ca 0.10 -3.90 0.06 0.00 0.00 0.00 0.00 53.44 49.69 3dk9 n ALA 288 Cb 0.47 -0.85 0.02 0.00 0.00 0.00 0.00 19.45 19.08 3dk9 n ALA 288 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3dk9 n ILE 289 N 0.26 0.00 0.00 0.00 -5.35 -1.25 -4.20 119.36 108.82 3dk9 n ILE 289 Ca 0.27 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.33 3dk9 n ILE 289 Cb 0.54 1.18 0.00 0.00 -1.74 0.00 0.00 39.64 39.62 3dk9 n ILE 289 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dk9 n GLY 290 N 0.89 -0.08 3.18 3.28 0.00 -1.26 -4.98 105.19 106.22 3dk9 n GLY 290 Ca 0.06 -1.52 -0.22 0.00 0.00 0.00 0.00 46.02 44.33 3dk9 n GLY 290 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dk9 s ARG 291 N -1.68 1.09 -0.03 1.61 1.81 -1.26 -1.17 118.95 119.30 3dk9 s ARG 291 Ca 0.00 -0.82 0.07 0.00 -1.72 0.00 0.00 55.73 53.26 3dk9 s ARG 291 Cb 0.00 -1.14 -0.02 0.00 -0.45 0.00 0.00 34.95 33.35 3dk9 s ARG 291 CO 0.00 0.28 -0.24 0.08 -0.68 0.00 0.00 175.30 174.74 3dk9 s VAL 292 N -0.83 2.16 0.54 3.52 1.01 0.29 -4.81 120.40 122.28 3dk9 s VAL 292 Ca 0.04 -1.06 -0.19 0.00 0.00 0.00 0.00 61.98 60.77 3dk9 s VAL 292 Cb -0.08 -1.77 -0.06 0.00 0.00 0.00 0.00 36.38 34.47 3dk9 s VAL 292 CO 0.01 0.58 1.08 -2.16 0.00 0.00 0.00 175.10 174.61 3dk9 s PRO 293 N -0.49 3.46 -1.17 2.72 0.04 -1.26 -0.79 135.00 137.50 3dk9 s PRO 293 Ca 0.06 1.43 -0.12 0.00 0.04 0.00 0.00 61.00 62.42 3dk9 s PRO 293 Cb -0.11 -2.04 0.22 0.00 0.04 0.00 0.00 34.50 32.61 3dk9 s PRO 293 CO 0.00 -0.73 1.30 -0.80 0.04 0.00 0.00 177.00 176.81 3dk9 s ASN 294 N -2.10 7.19 0.00 6.66 0.01 0.09 -4.56 114.94 122.24 3dk9 s ASN 294 Ca 0.69 -3.26 0.00 0.00 -0.71 0.00 0.00 52.86 49.57 3dk9 s ASN 294 Cb -0.19 -2.32 0.00 0.00 0.41 0.00 0.00 41.25 39.15 3dk9 s ASN 294 CO 0.27 -0.54 0.00 0.35 -1.51 0.00 0.00 177.10 175.67 3dk9 n THR 295 N 3.78 0.00 -0.04 1.60 -2.24 -1.26 -4.76 114.28 111.35 3dk9 n THR 295 Ca 0.31 -0.19 0.09 0.00 -2.27 0.00 0.00 64.05 61.99 3dk9 n THR 295 Cb 0.41 1.01 0.48 0.00 -2.10 0.00 0.00 70.33 70.13 3dk9 n THR 295 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3dk9 h LYS 296 N 0.00 0.43 -0.29 -0.78 6.56 -1.92 -2.74 116.57 117.83 3dk9 h LYS 296 Ca 0.00 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 3dk9 h LYS 296 Cb 0.01 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 31.57 3dk9 h LYS 296 CO 0.00 0.28 0.00 -0.25 -2.06 0.00 0.00 179.45 177.42 3dk9 n ASP 297 N -4.47 3.96 -0.07 0.86 8.00 -1.26 -4.55 116.55 119.02 3dk9 n ASP 297 Ca 0.07 -2.94 0.13 0.00 0.71 0.00 0.00 54.79 52.76 3dk9 n ASP 297 Cb 0.25 -0.53 0.46 0.00 -0.02 0.00 0.00 41.12 41.28 3dk9 n ASP 297 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3dk9 n LEU 298 N -0.35 0.45 -3.73 0.64 4.77 -1.03 -4.68 117.00 113.07 3dk9 n LEU 298 Ca 0.21 0.08 -0.27 0.00 -0.03 0.00 0.00 56.01 56.00 3dk9 n LEU 298 Cb 0.88 -0.27 0.05 0.00 -2.33 0.00 0.00 43.42 41.76 3dk9 n LEU 298 CO 0.16 0.09 0.18 -1.20 -1.33 0.00 0.00 177.39 175.30 3dk9 n SER 299 N -1.22 -5.69 -0.04 -1.43 7.64 -1.26 -0.97 113.62 110.65 3dk9 n SER 299 Ca 0.10 -0.64 0.12 0.00 1.01 0.00 0.00 58.87 59.46 3dk9 n SER 299 Cb 0.32 -4.50 0.53 0.00 -1.01 0.00 0.00 64.21 59.55 3dk9 n SER 299 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3dk9 h LEU 300 N -2.40 0.30 -2.45 -3.43 3.38 -1.91 -1.21 115.31 107.59 3dk9 h LEU 300 Ca -0.57 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.40 3dk9 h LEU 300 Cb 1.37 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 3dk9 h LEU 300 CO 0.61 0.18 -0.01 -0.55 0.09 0.00 0.00 178.44 178.76 3dk9 h ASN 301 N 0.33 0.00 0.62 -0.43 -1.07 -1.89 -2.04 115.58 111.11 3dk9 h ASN 301 Ca 0.24 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.58 3dk9 h ASN 301 Cb 0.51 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.76 3dk9 h ASN 301 CO -0.06 0.01 -0.12 0.11 0.07 0.00 0.00 177.43 177.44 3dk9 h LYS 302 N 0.00 0.00 -0.06 4.14 1.57 -1.54 -2.31 116.57 118.36 3dk9 h LYS 302 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dk9 h LYS 302 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3dk9 h LYS 302 CO 0.00 0.12 0.00 1.28 -0.57 0.00 0.00 179.45 180.28 3dk9 n LEU 303 N -3.41 1.80 -1.07 2.94 4.77 -0.88 -4.64 117.00 116.51 3dk9 n LEU 303 Ca -0.01 -1.41 -0.11 0.00 -0.03 0.00 0.00 56.01 54.45 3dk9 n LEU 303 Cb 0.29 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 3dk9 n LEU 303 CO 0.30 0.42 -0.13 0.61 -1.33 0.00 0.00 177.39 177.26 3dk9 n GLY 304 N 0.13 0.53 3.71 -0.72 0.00 -0.83 -4.96 105.19 103.05 3dk9 n GLY 304 Ca 0.04 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 3dk9 n GLY 304 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dk9 s ILE 305 N -2.49 3.70 0.16 -0.61 1.01 -0.85 -4.92 121.20 117.21 3dk9 s ILE 305 Ca 0.00 1.20 -0.30 0.00 0.00 0.00 0.00 60.65 61.55 3dk9 s ILE 305 Cb 0.00 -3.77 -0.07 0.00 0.01 0.00 0.00 42.46 38.63 3dk9 s ILE 305 CO 0.00 0.08 0.99 -1.58 0.00 0.00 0.00 174.94 174.43 3dk9 s GLN 306 N 1.29 4.71 0.15 2.79 0.74 -1.26 -4.73 119.66 123.34 3dk9 s GLN 306 Ca 0.62 1.53 0.04 0.00 0.05 0.00 0.00 55.36 57.60 3dk9 s GLN 306 Cb -0.33 -3.33 -0.04 0.00 1.10 0.00 0.00 33.01 30.41 3dk9 s GLN 306 CO 0.29 0.25 -0.10 0.95 -0.55 0.00 0.00 175.29 176.13 3dk9 s THR 307 N -0.33 1.15 0.95 -0.34 -4.23 -1.26 -1.65 115.64 109.92 3dk9 s THR 307 Ca 0.46 -2.06 -0.16 0.00 -1.18 0.00 0.00 61.69 58.75 3dk9 s THR 307 Cb -0.25 -1.86 0.22 0.00 1.34 0.00 0.00 72.50 71.95 3dk9 s THR 307 CO 0.32 -0.74 1.27 -0.90 -0.54 0.00 0.00 174.62 174.03 3dk9 n ASP 308 N -0.20 0.04 0.15 3.99 5.68 -0.56 -4.88 116.55 120.78 3dk9 n ASP 308 Ca -0.10 -1.45 0.13 0.00 -0.50 0.00 0.00 54.79 52.86 3dk9 n ASP 308 Cb 0.61 -0.98 0.53 0.00 -1.14 0.00 0.00 41.12 40.14 3dk9 n ASP 308 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3dk9 h ASP 309 N -1.71 0.00 0.14 -1.12 3.32 -2.02 -1.95 116.42 113.08 3dk9 h ASP 309 Ca -0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 3dk9 h ASP 309 Cb 1.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.69 3dk9 h ASP 309 CO 0.29 0.00 -0.24 0.29 -1.72 0.00 0.00 179.24 177.86 3dk9 n LYS 310 N -2.34 1.11 -0.45 3.56 5.02 -1.26 -4.96 118.16 118.84 3dk9 n LYS 310 Ca 0.01 -0.73 0.00 0.00 -2.02 0.00 0.00 58.31 55.58 3dk9 n LYS 310 Cb 0.21 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 3dk9 n LYS 310 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dk9 n GLY 311 N 1.33 0.75 3.76 0.72 0.00 -0.73 -4.50 105.19 106.52 3dk9 n GLY 311 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 3dk9 n GLY 311 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dk9 s HIS 312 N -2.41 3.23 0.09 1.61 3.76 -1.26 -4.68 115.29 115.63 3dk9 s HIS 312 Ca 0.00 1.45 -0.31 0.00 -0.15 0.00 0.00 55.06 56.05 3dk9 s HIS 312 Cb 0.00 -3.56 -0.07 0.00 1.11 0.00 0.00 32.58 30.06 3dk9 s HIS 312 CO 0.00 -1.52 1.37 0.42 -0.85 0.00 0.00 174.74 174.15 3dk9 s ILE 313 N -0.90 3.47 0.13 0.60 1.01 -0.73 -1.50 121.20 123.29 3dk9 s ILE 313 Ca 0.49 1.03 -0.28 0.00 0.00 0.00 0.00 60.65 61.89 3dk9 s ILE 313 Cb -0.37 -3.66 -0.07 0.00 0.01 0.00 0.00 42.46 38.37 3dk9 s ILE 313 CO 0.47 0.07 0.88 -0.63 0.00 0.00 0.00 174.94 175.73 3dk9 s ILE 314 N 1.30 4.45 0.09 2.92 -1.09 -0.66 -4.47 121.20 123.74 3dk9 s ILE 314 Ca 0.64 1.92 0.01 0.00 -2.23 0.00 0.00 60.65 60.98 3dk9 s ILE 314 Cb -0.35 -4.25 -0.04 0.00 -1.58 0.00 0.00 42.46 36.24 3dk9 s ILE 314 CO 0.30 0.40 -0.05 0.68 -1.23 0.00 0.00 174.94 175.04 3dk9 s VAL 315 N -0.43 0.54 0.25 2.92 -7.23 -1.26 -4.26 120.40 110.93 3dk9 s VAL 315 Ca 0.42 -1.91 -0.02 0.00 -1.81 0.00 0.00 61.98 58.66 3dk9 s VAL 315 Cb -0.23 -1.69 0.05 0.00 0.56 0.00 0.00 36.38 35.07 3dk9 s VAL 315 CO 0.28 -0.85 0.34 -0.90 -0.31 0.00 0.00 175.10 173.65 3dk9 n ASP 316 N -0.02 0.26 0.17 4.85 3.85 -0.58 -4.93 116.55 120.14 3dk9 n ASP 316 Ca -0.12 -1.26 0.13 0.00 -0.71 0.00 0.00 54.79 52.83 3dk9 n ASP 316 Cb 0.61 -0.24 0.57 0.00 -1.35 0.00 0.00 41.12 40.71 3dk9 n ASP 316 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 3dk9 h GLU 317 N 0.00 0.00 -0.71 0.11 4.11 -1.99 -1.53 114.58 114.57 3dk9 h GLU 317 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.32 3dk9 h GLU 317 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3dk9 h GLU 317 CO 0.10 0.00 0.00 1.19 0.07 0.00 0.00 179.01 180.37 3dk9 n PHE 318 N -2.43 1.17 -1.09 2.06 3.01 -1.26 -4.52 117.46 114.40 3dk9 n PHE 318 Ca 0.01 -0.54 -0.03 0.00 1.01 0.00 0.00 57.45 57.90 3dk9 n PHE 318 Cb 0.22 -0.09 -0.01 0.00 -0.01 0.00 0.00 39.48 39.59 3dk9 n PHE 318 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3dk9 n GLN 319 N 1.49 -0.77 -2.32 -1.08 1.13 -0.58 -4.94 117.38 110.31 3dk9 n GLN 319 Ca 0.25 0.41 -0.41 0.00 -1.94 0.00 0.00 57.00 55.32 3dk9 n GLN 319 Cb 0.72 -4.13 -0.03 0.00 0.11 0.00 0.00 30.24 26.91 3dk9 n GLN 319 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3dk9 s ASN 320 N -2.31 7.04 1.09 1.08 0.01 -1.26 -1.57 114.94 119.03 3dk9 s ASN 320 Ca 0.00 2.36 -0.12 0.00 -0.71 0.00 0.00 52.86 54.39 3dk9 s ASN 320 Cb 0.00 -2.62 0.17 0.00 0.41 0.00 0.00 41.25 39.21 3dk9 s ASN 320 CO 0.00 -0.37 0.75 0.35 -1.51 0.00 0.00 177.10 176.32 3dk9 n THR 321 N 1.87 0.00 1.59 1.60 -2.24 -0.71 -1.53 114.28 114.86 3dk9 n THR 321 Ca 0.02 -0.44 0.13 0.00 -2.27 0.00 0.00 64.05 61.49 3dk9 n THR 321 Cb 0.44 -1.38 0.76 0.00 -2.10 0.00 0.00 70.33 68.04 3dk9 n THR 321 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3dk9 n ASN 322 N -3.89 0.00 -4.26 3.42 6.94 -1.26 -4.72 115.26 111.49 3dk9 n ASN 322 Ca 0.10 -0.78 -0.33 0.00 -0.02 0.00 0.00 54.58 53.55 3dk9 n ASN 322 Cb 0.36 -0.01 -0.15 0.00 -2.36 0.00 0.00 39.78 37.62 3dk9 n ASN 322 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3dk9 s VAL 323 N -2.02 2.64 0.24 3.53 1.01 -1.26 -5.01 120.40 119.53 3dk9 s VAL 323 Ca 0.38 -0.78 -0.31 0.00 0.00 0.00 0.00 61.98 61.27 3dk9 s VAL 323 Cb 0.18 -2.11 -0.13 0.00 0.00 0.00 0.00 36.38 34.31 3dk9 s VAL 323 CO 0.30 0.52 1.43 0.29 0.00 0.00 0.00 175.10 177.64 3dk9 n LYS 324 N 4.09 2.10 -0.81 2.72 4.01 -1.26 -1.89 118.16 127.11 3dk9 n LYS 324 Ca -0.19 0.75 0.00 0.00 -0.51 0.00 0.00 58.31 58.36 3dk9 n LYS 324 Cb 0.52 -2.42 0.00 0.00 -0.51 0.00 0.00 35.03 32.62 3dk9 n LYS 324 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3dk9 n GLY 325 N 2.18 0.84 3.12 0.72 0.00 -1.26 -4.98 105.19 105.81 3dk9 n GLY 325 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 3dk9 n GLY 325 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dk9 s ILE 326 N -3.27 1.41 0.25 -0.61 1.01 -0.79 -0.71 121.20 118.49 3dk9 s ILE 326 Ca 0.00 -0.69 0.04 0.00 0.00 0.00 0.00 60.65 60.00 3dk9 s ILE 326 Cb 0.00 -1.23 -0.05 0.00 0.01 0.00 0.00 42.46 41.19 3dk9 s ILE 326 CO 0.00 0.41 0.00 -0.31 0.00 0.00 0.00 174.94 175.04 3dk9 s TYR 327 N 0.19 1.66 -0.08 3.97 1.51 -0.23 -1.73 117.35 122.63 3dk9 s TYR 327 Ca -0.07 -0.91 -0.12 0.00 -1.01 0.00 0.00 57.07 54.96 3dk9 s TYR 327 Cb -0.13 -0.98 0.03 0.00 -0.11 0.00 0.00 41.96 40.77 3dk9 s TYR 327 CO 0.03 -0.01 0.30 0.00 -1.11 0.00 0.00 175.55 174.77 3dk9 s ALA 328 N -3.37 -0.75 0.11 3.71 0.00 -0.61 -0.48 121.76 120.38 3dk9 s ALA 328 Ca 0.30 0.65 -0.01 0.00 0.00 0.00 0.00 51.96 52.90 3dk9 s ALA 328 Cb 0.06 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 3dk9 s ALA 328 CO 0.10 -0.19 0.04 0.14 0.00 0.00 0.00 175.76 175.85 3dk9 s VAL 329 N -0.38 0.14 0.00 0.00 -7.23 -0.93 -4.72 120.40 107.28 3dk9 s VAL 329 Ca -0.05 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.23 3dk9 s VAL 329 Cb -0.03 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 34.98 3dk9 s VAL 329 CO 0.02 -0.59 0.00 0.61 -0.31 0.00 0.00 175.10 174.83 3dk9 n GLY 330 N -0.05 -1.40 0.29 2.32 0.00 -1.26 -4.29 105.19 100.81 3dk9 n GLY 330 Ca -0.07 -1.38 0.15 0.00 0.00 0.00 0.00 46.02 44.72 3dk9 n GLY 330 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dk9 h ASP 331 N 0.92 0.00 0.34 1.61 3.45 -1.89 -1.64 116.42 119.21 3dk9 h ASP 331 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3dk9 h ASP 331 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3dk9 h ASP 331 CO 0.00 0.02 0.00 1.62 -1.57 0.00 0.00 179.24 179.31 3dk9 h VAL 332 N 0.00 0.00 -0.00 -1.35 3.04 -1.74 -1.09 116.25 115.10 3dk9 h VAL 332 Ca -0.00 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.54 3dk9 h VAL 332 Cb 0.07 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 30.33 3dk9 h VAL 332 CO 0.00 0.00 -0.59 0.00 -1.01 0.00 0.00 177.57 175.98 3dk9 n GLY 334 N 1.45 0.62 3.15 0.00 0.00 -0.41 -4.74 105.19 105.26 3dk9 n GLY 334 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3dk9 n GLY 334 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dk9 s LYS 335 N -0.03 3.04 -0.67 1.61 2.20 -1.26 -4.85 119.74 119.77 3dk9 s LYS 335 Ca 0.00 -0.82 -0.05 0.00 -0.36 0.00 0.00 55.97 54.74 3dk9 s LYS 335 Cb 0.00 -2.56 0.01 0.00 -1.51 0.00 0.00 37.83 33.76 3dk9 s LYS 335 CO 0.00 -0.14 0.67 0.00 -0.36 0.00 0.00 175.35 175.51 3dk9 n ALA 336 N 4.45 -2.64 -2.29 3.13 0.00 -1.26 -4.81 120.51 117.10 3dk9 n ALA 336 Ca -0.20 0.25 -0.43 0.00 0.00 0.00 0.00 53.44 53.06 3dk9 n ALA 336 Cb 0.51 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.98 3dk9 n ALA 336 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dk9 n LEU 337 N -1.47 5.70 -4.00 0.00 4.77 -1.26 -4.74 117.00 116.01 3dk9 n LEU 337 Ca -0.00 -4.05 -0.11 0.00 -0.03 0.00 0.00 56.01 51.81 3dk9 n LEU 337 Cb 0.51 -1.70 -0.12 0.00 -2.33 0.00 0.00 43.42 39.79 3dk9 n LEU 337 CO 0.53 0.57 -0.38 -0.76 -1.33 0.00 0.00 177.39 176.02 3dk9 s LEU 338 N 3.21 2.22 0.10 2.23 1.43 -1.26 -5.06 118.68 121.54 3dk9 s LEU 338 Ca 0.50 -0.46 -0.21 0.00 -1.03 0.00 0.00 54.13 52.93 3dk9 s LEU 338 Cb 0.07 -0.02 -0.11 0.00 0.03 0.00 0.00 46.19 46.16 3dk9 s LEU 338 CO 0.01 -0.23 1.70 0.74 0.23 0.00 0.00 176.35 178.81 3dk9 h THR 339 N 4.65 1.08 0.00 5.49 2.02 -2.00 -2.64 112.91 121.51 3dk9 h THR 339 Ca -0.33 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.61 3dk9 h THR 339 Cb 1.21 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.61 3dk9 h THR 339 CO 0.42 0.07 -0.12 -0.65 0.37 0.00 0.00 175.52 175.62 3dk9 h PRO 340 N 0.12 0.00 0.06 6.66 0.11 -1.98 -1.39 132.00 135.59 3dk9 h PRO 340 Ca 0.04 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.15 3dk9 h PRO 340 Cb 0.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.17 3dk9 h PRO 340 CO -0.01 0.12 -0.03 0.28 -0.21 0.00 0.00 178.00 178.15 3dk9 h VAL 341 N 0.00 1.22 -0.58 3.15 2.07 -1.82 -0.74 116.25 119.54 3dk9 h VAL 341 Ca -0.00 -1.04 0.09 0.00 0.82 0.00 0.00 66.70 66.57 3dk9 h VAL 341 Cb 0.30 1.88 -0.07 0.00 -1.52 0.00 0.00 31.29 31.89 3dk9 h VAL 341 CO 0.02 0.25 0.21 0.00 0.02 0.00 0.00 177.57 178.07 3dk9 h ALA 342 N 0.32 0.74 -0.10 1.67 0.00 -1.10 -0.08 119.26 120.71 3dk9 h ALA 342 Ca -0.01 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3dk9 h ALA 342 Cb 0.48 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3dk9 h ALA 342 CO 0.01 -0.21 0.05 0.82 0.00 0.00 0.00 179.25 179.93 3dk9 h ILE 343 N 0.38 1.10 -0.42 0.00 2.04 -1.26 -0.39 117.51 118.97 3dk9 h ILE 343 Ca 0.29 -0.29 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 3dk9 h ILE 343 Cb 0.36 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 3dk9 h ILE 343 CO -0.30 0.09 0.01 0.00 0.00 0.00 0.00 178.15 177.95 3dk9 h ALA 344 N 0.94 0.56 -0.84 1.87 0.00 -0.90 0.17 119.26 121.06 3dk9 h ALA 344 Ca 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3dk9 h ALA 344 Cb 0.10 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 3dk9 h ALA 344 CO -0.00 0.33 0.40 0.00 0.00 0.00 0.00 179.25 179.98 3dk9 h ALA 345 N 0.90 1.08 -0.58 0.00 0.00 -0.98 -0.24 119.26 119.44 3dk9 h ALA 345 Ca 0.12 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3dk9 h ALA 345 Cb 0.47 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3dk9 h ALA 345 CO 0.02 0.65 -0.02 0.78 0.00 0.00 0.00 179.25 180.68 3dk9 h GLY 346 N 1.19 1.10 0.94 0.00 0.00 -0.70 -1.37 103.07 104.23 3dk9 h GLY 346 Ca 0.29 -0.81 -0.10 0.00 0.00 0.00 0.00 47.33 46.71 3dk9 h GLY 346 CO -0.04 0.75 -0.18 3.21 0.00 0.00 0.00 176.54 180.28 3dk9 h ARG 347 N 0.93 0.67 -0.69 4.80 3.08 -0.74 -2.06 114.38 120.36 3dk9 h ARG 347 Ca 0.16 -0.31 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 3dk9 h ARG 347 Cb 0.57 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 3dk9 h ARG 347 CO 0.03 0.90 0.41 0.87 -1.07 0.00 0.00 179.97 181.12 3dk9 h LYS 348 N 0.42 0.93 -0.38 0.04 1.79 -0.94 -1.65 116.57 116.78 3dk9 h LYS 348 Ca 0.06 -0.08 -0.04 0.00 -2.18 0.00 0.00 60.65 58.42 3dk9 h LYS 348 Cb 0.72 -0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 31.16 3dk9 h LYS 348 CO 0.05 0.66 0.09 1.25 -1.08 0.00 0.00 179.45 180.42 3dk9 h LEU 349 N 0.95 0.58 -0.96 2.94 5.85 -1.15 -1.45 115.31 122.06 3dk9 h LEU 349 Ca 0.25 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.75 3dk9 h LEU 349 Cb -0.04 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.79 3dk9 h LEU 349 CO -0.05 0.66 0.64 0.00 -0.34 0.00 0.00 178.44 179.35 3dk9 h ALA 350 N 0.94 1.23 -0.37 1.25 0.00 -0.73 -0.51 119.26 121.07 3dk9 h ALA 350 Ca 0.12 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3dk9 h ALA 350 Cb 0.31 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3dk9 h ALA 350 CO 0.00 0.59 -0.21 0.45 0.00 0.00 0.00 179.25 180.08 3dk9 h HIS 351 N 1.29 0.82 -0.22 0.00 3.86 -1.09 0.11 115.15 119.92 3dk9 h HIS 351 Ca 0.36 -0.18 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 3dk9 h HIS 351 Cb -0.12 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.14 3dk9 h HIS 351 CO -0.00 0.88 0.13 -0.09 0.86 0.00 0.00 177.93 179.70 3dk9 h ARG 352 N 0.64 0.30 0.09 2.45 2.43 -0.44 -0.73 114.38 119.11 3dk9 h ARG 352 Ca 0.09 -0.03 -0.28 0.00 -0.81 0.00 0.00 59.98 58.96 3dk9 h ARG 352 Cb 0.71 -0.06 0.02 0.00 -0.42 0.00 0.00 29.97 30.21 3dk9 h ARG 352 CO 0.05 0.26 -1.17 -0.07 -1.51 0.00 0.00 179.97 177.53 3dk9 h LEU 353 N 0.26 0.73 0.00 3.80 3.38 -0.97 -2.71 115.31 119.81 3dk9 h LEU 353 Ca 0.08 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.39 3dk9 h LEU 353 Cb 0.03 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3dk9 h LEU 353 CO -0.01 1.48 -0.60 0.49 0.09 0.00 0.00 178.44 179.88 3dk9 n PHE 354 N -3.74 0.00 0.44 1.13 3.72 0.01 -4.33 117.46 114.68 3dk9 n PHE 354 Ca -0.11 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.34 3dk9 n PHE 354 Cb 0.95 -0.04 0.03 0.00 -0.94 0.00 0.00 39.48 39.48 3dk9 n PHE 354 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3dk9 n GLU 355 N -1.32 0.86 -2.63 -1.08 2.13 -0.33 -4.95 120.64 113.32 3dk9 n GLU 355 Ca 0.01 -0.99 -0.17 0.00 0.66 0.00 0.00 57.16 56.67 3dk9 n GLU 355 Cb 0.15 -1.17 0.01 0.00 0.27 0.00 0.00 31.44 30.70 3dk9 n GLU 355 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3dk9 n TYR 356 N 0.37 -1.23 -2.96 4.31 4.01 -0.89 -4.94 117.16 115.84 3dk9 n TYR 356 Ca 0.06 0.24 -0.44 0.00 -0.16 0.00 0.00 57.90 57.60 3dk9 n TYR 356 Cb 0.25 -3.59 -0.03 0.00 -0.31 0.00 0.00 39.34 35.65 3dk9 n TYR 356 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3dk9 s LYS 357 N -5.18 3.39 0.54 -0.72 -0.14 -1.05 -4.89 119.74 111.68 3dk9 s LYS 357 Ca 0.14 -1.49 0.32 0.00 -1.36 0.00 0.00 55.97 53.57 3dk9 s LYS 357 Cb -0.06 -4.61 1.43 0.00 -1.68 0.00 0.00 37.83 32.91 3dk9 s LYS 357 CO 0.17 -1.72 2.02 1.05 -0.76 0.00 0.00 175.35 176.11 3dk9 h GLU 358 N 9.02 0.00 -0.50 1.68 9.09 -1.90 -1.46 114.58 130.52 3dk9 h GLU 358 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.38 3dk9 h GLU 358 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.15 3dk9 h GLU 358 CO 1.11 0.07 0.00 -0.40 0.05 0.00 0.00 179.01 179.84 3dk9 n ASP 359 N -3.26 2.99 -4.65 3.06 5.75 -1.26 -4.94 116.55 114.25 3dk9 n ASP 359 Ca -0.00 -1.97 -0.43 0.00 -0.01 0.00 0.00 54.79 52.38 3dk9 n ASP 359 Cb 0.29 -0.33 -0.02 0.00 -1.03 0.00 0.00 41.12 40.03 3dk9 n ASP 359 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3dk9 s SER 360 N -1.16 6.91 0.09 -1.12 0.15 -0.55 -4.96 113.70 113.06 3dk9 s SER 360 Ca 0.38 1.40 -0.26 0.00 0.70 0.00 0.00 55.95 58.17 3dk9 s SER 360 Cb 0.20 -2.54 0.08 0.00 -1.71 0.00 0.00 66.02 62.05 3dk9 s SER 360 CO 0.27 -0.84 0.76 -1.59 1.20 0.00 0.00 173.24 173.05 3dk9 s LYS 361 N 3.61 1.09 -0.06 5.44 -2.85 -1.26 -4.65 119.74 121.06 3dk9 s LYS 361 Ca 0.51 -0.43 -0.22 0.00 -1.00 0.00 0.00 55.97 54.83 3dk9 s LYS 361 Cb -0.17 0.48 -0.04 0.00 -2.06 0.00 0.00 37.83 36.04 3dk9 s LYS 361 CO 0.15 -0.48 0.63 -1.17 0.10 0.00 0.00 175.35 174.57 3dk9 s LEU 362 N -2.65 4.33 -0.25 2.77 2.96 -1.26 -4.99 118.68 119.59 3dk9 s LEU 362 Ca 0.04 1.10 -0.29 0.00 -0.22 0.00 0.00 54.13 54.76 3dk9 s LEU 362 Cb -0.01 -2.96 0.01 0.00 0.50 0.00 0.00 46.19 43.73 3dk9 s LEU 362 CO -0.09 -0.04 1.10 -0.62 -1.32 0.00 0.00 176.35 175.39 3dk9 s ASP 363 N 0.51 6.99 0.00 3.68 -1.08 -1.26 -4.93 116.67 120.59 3dk9 s ASP 363 Ca 0.33 1.32 0.23 0.00 -0.52 0.00 0.00 52.55 53.91 3dk9 s ASP 363 Cb -0.17 -2.54 0.96 0.00 -1.46 0.00 0.00 42.92 39.70 3dk9 s ASP 363 CO 0.16 -0.78 1.67 -1.22 0.52 0.00 0.00 175.17 175.52 3dk9 n TYR 364 N 6.63 0.11 -3.11 -5.34 4.02 -1.26 -4.83 117.16 113.38 3dk9 n TYR 364 Ca 0.12 -0.06 -0.33 0.00 -0.01 0.00 0.00 57.90 57.62 3dk9 n TYR 364 Cb 0.46 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.72 3dk9 n TYR 364 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 3dk9 s ASN 365 N -1.69 6.85 -1.45 7.72 0.01 -1.26 -4.31 114.94 120.80 3dk9 s ASN 365 Ca 0.34 1.33 -0.03 0.00 -0.71 0.00 0.00 52.86 53.79 3dk9 s ASN 365 Cb 0.18 -2.39 0.00 0.00 0.41 0.00 0.00 41.25 39.45 3dk9 s ASN 365 CO 0.28 -0.16 0.41 0.59 -1.51 0.00 0.00 177.10 176.70 3dk9 n ASN 366 N -0.13 -5.61 -4.69 -1.22 5.03 -1.26 -4.97 115.26 102.41 3dk9 n ASN 366 Ca 0.02 -0.19 -0.42 0.00 0.87 0.00 0.00 54.58 54.85 3dk9 n ASN 366 Cb 0.53 -4.50 -0.03 0.00 -1.02 0.00 0.00 39.78 34.76 3dk9 n ASN 366 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3dk9 s ILE 367 N -3.07 4.74 0.45 2.41 1.01 -1.26 -4.76 121.20 120.73 3dk9 s ILE 367 Ca 0.20 2.01 -0.13 0.00 0.00 0.00 0.00 60.65 62.73 3dk9 s ILE 367 Cb -0.09 -4.29 -0.07 0.00 0.01 0.00 0.00 42.46 38.02 3dk9 s ILE 367 CO 0.25 0.01 0.86 -2.16 0.00 0.00 0.00 174.94 173.89 3dk9 s PRO 368 N 2.01 3.83 0.02 2.79 0.04 -1.26 -4.49 135.00 137.93 3dk9 s PRO 368 Ca 0.49 0.65 -0.10 0.00 0.04 0.00 0.00 61.00 62.08 3dk9 s PRO 368 Cb -0.19 -2.29 0.01 0.00 0.04 0.00 0.00 34.50 32.07 3dk9 s PRO 368 CO 0.18 -0.14 0.21 -0.08 0.04 0.00 0.00 177.00 177.21 3dk9 s THR 369 N -2.50 0.09 -0.05 1.26 -1.32 -0.35 -5.02 115.64 107.75 3dk9 s THR 369 Ca 0.54 -0.74 0.04 0.00 -1.21 0.00 0.00 61.69 60.32 3dk9 s THR 369 Cb -0.10 -0.72 -0.02 0.00 -1.51 0.00 0.00 72.50 70.15 3dk9 s THR 369 CO 0.32 -0.41 -0.16 -0.69 -2.21 0.00 0.00 174.62 171.47 3dk9 s VAL 370 N -1.97 2.87 -0.18 5.08 1.01 -1.26 -1.18 120.40 124.76 3dk9 s VAL 370 Ca -0.10 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 3dk9 s VAL 370 Cb -0.04 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 3dk9 s VAL 370 CO -0.01 0.58 -0.05 -0.69 0.00 0.00 0.00 175.10 174.93 3dk9 s VAL 371 N -0.56 3.54 -1.36 2.92 1.01 -0.23 -4.98 120.40 120.75 3dk9 s VAL 371 Ca 0.08 -0.46 -0.08 0.00 0.00 0.00 0.00 61.98 61.52 3dk9 s VAL 371 Cb -0.11 -2.57 0.10 0.00 0.00 0.00 0.00 36.38 33.80 3dk9 s VAL 371 CO 0.01 0.47 2.27 0.49 0.00 0.00 0.00 175.10 178.34 3dk9 n PHE 372 N 4.06 2.76 -1.36 5.22 3.72 -1.26 -1.08 117.46 129.51 3dk9 n PHE 372 Ca -0.18 -2.86 -0.05 0.00 -0.05 0.00 0.00 57.45 54.32 3dk9 n PHE 372 Cb 0.52 -2.01 0.03 0.00 -0.94 0.00 0.00 39.48 37.08 3dk9 n PHE 372 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3dk9 n SER 373 N 3.03 0.05 -3.86 4.37 2.88 -1.26 -4.65 113.62 114.18 3dk9 n SER 373 Ca 0.56 -1.10 -0.30 0.00 -1.33 0.00 0.00 58.87 56.69 3dk9 n SER 373 Cb 0.30 -0.16 -0.15 0.00 -0.75 0.00 0.00 64.21 63.45 3dk9 n SER 373 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3dk9 s HIS 374 N -1.29 2.69 0.85 0.66 0.09 -1.26 -2.69 115.29 114.34 3dk9 s HIS 374 Ca 0.13 -2.41 -0.12 0.00 -0.00 0.00 0.00 55.06 52.65 3dk9 s HIS 374 Cb -0.00 -2.31 0.10 0.00 -0.00 0.00 0.00 32.58 30.37 3dk9 s HIS 374 CO 0.09 -0.89 1.16 -1.25 -0.00 0.00 0.00 174.74 173.85 3dk9 s PRO 375 N 1.10 1.67 0.70 8.40 0.04 -1.26 -4.78 135.00 140.88 3dk9 s PRO 375 Ca 0.11 0.19 -0.13 0.00 0.04 0.00 0.00 61.00 61.21 3dk9 s PRO 375 Cb -0.19 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.46 3dk9 s PRO 375 CO -0.14 -1.81 1.10 -1.25 0.04 0.00 0.00 177.00 174.93 3dk9 s PRO 376 N -5.46 2.63 -0.07 0.56 0.04 -1.09 -4.51 135.00 127.09 3dk9 s PRO 376 Ca 0.63 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.93 3dk9 s PRO 376 Cb -0.12 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 3dk9 s PRO 376 CO 0.51 -1.37 -0.06 0.42 0.04 0.00 0.00 177.00 176.54 3dk9 s ILE 377 N -2.62 3.79 0.01 0.56 1.01 -0.24 -1.26 121.20 122.45 3dk9 s ILE 377 Ca 0.64 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.89 3dk9 s ILE 377 Cb -0.18 -2.56 -0.02 0.00 0.01 0.00 0.00 42.46 39.71 3dk9 s ILE 377 CO 0.48 0.60 -0.16 -0.83 0.00 0.00 0.00 174.94 175.03 3dk9 s GLY 378 N -0.80 0.81 -0.05 6.18 0.00 -0.03 -1.06 107.32 112.37 3dk9 s GLY 378 Ca 0.12 -0.75 -0.10 0.00 0.00 0.00 0.00 44.72 44.00 3dk9 s GLY 378 CO 0.02 -0.66 0.23 -1.08 0.00 0.00 0.00 173.10 171.61 3dk9 s THR 379 N -0.52 0.03 -0.10 0.90 -1.32 -0.33 -0.73 115.64 113.58 3dk9 s THR 379 Ca 0.05 -0.28 -0.12 0.00 -1.21 0.00 0.00 61.69 60.13 3dk9 s THR 379 Cb -0.07 -0.43 0.03 0.00 -1.51 0.00 0.00 72.50 70.52 3dk9 s THR 379 CO 0.00 -0.16 0.32 0.54 -2.21 0.00 0.00 174.62 173.12 3dk9 s VAL 380 N -0.58 0.01 0.00 5.08 0.11 -0.30 -1.21 120.40 123.51 3dk9 s VAL 380 Ca -0.07 -0.10 0.00 0.00 -2.93 0.00 0.00 61.98 58.89 3dk9 s VAL 380 Cb -0.04 -0.49 0.00 0.00 -1.53 0.00 0.00 36.38 34.32 3dk9 s VAL 380 CO 0.02 -0.05 0.00 0.61 -3.33 0.00 0.00 175.10 172.34 3dk9 n GLY 381 N 2.59 -1.47 3.78 6.54 0.00 -1.26 -0.99 105.19 114.37 3dk9 n GLY 381 Ca -0.15 -1.36 -0.38 0.00 0.00 0.00 0.00 46.02 44.14 3dk9 n GLY 381 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dk9 s LEU 382 N 0.00 4.46 0.90 0.99 1.43 0.40 -4.87 118.68 121.99 3dk9 s LEU 382 Ca 0.00 1.72 -0.11 0.00 -1.03 0.00 0.00 54.13 54.71 3dk9 s LEU 382 Cb 0.00 -3.67 0.13 0.00 0.03 0.00 0.00 46.19 42.68 3dk9 s LEU 382 CO 0.00 0.06 1.10 0.42 0.23 0.00 0.00 176.35 178.16 3dk9 s THR 383 N -1.40 2.58 0.19 5.49 -4.23 -1.26 -4.15 115.64 112.86 3dk9 s THR 383 Ca 0.43 0.19 -0.12 0.00 -1.18 0.00 0.00 61.69 61.02 3dk9 s THR 383 Cb -0.21 -2.48 0.10 0.00 1.34 0.00 0.00 72.50 71.26 3dk9 s THR 383 CO 0.25 -0.25 1.78 -0.08 -0.54 0.00 0.00 174.62 175.78 3dk9 h GLU 384 N -1.67 0.48 -0.74 3.99 4.81 -1.97 -0.49 114.58 118.99 3dk9 h GLU 384 Ca -0.47 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 58.68 3dk9 h GLU 384 Cb 1.27 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 3dk9 h GLU 384 CO 0.49 0.32 0.26 -0.44 -0.73 0.00 0.00 179.01 178.91 3dk9 h ASP 385 N 0.49 1.04 -0.62 1.04 3.45 -1.99 -0.44 116.42 119.39 3dk9 h ASP 385 Ca 0.26 -0.18 -0.03 0.00 0.43 0.00 0.00 57.03 57.51 3dk9 h ASP 385 Cb 0.21 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 38.68 3dk9 h ASP 385 CO -0.20 0.95 0.27 -0.33 -1.57 0.00 0.00 179.24 178.36 3dk9 h GLU 386 N 1.09 0.90 -0.56 3.56 5.08 -1.80 -1.29 114.58 121.56 3dk9 h GLU 386 Ca 0.24 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.39 3dk9 h GLU 386 Cb 0.26 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 3dk9 h GLU 386 CO -0.01 0.74 0.09 0.00 -1.00 0.00 0.00 179.01 178.83 3dk9 h ALA 387 N 1.11 0.74 -0.59 3.43 0.00 -0.79 -1.14 119.26 122.02 3dk9 h ALA 387 Ca 0.21 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3dk9 h ALA 387 Cb 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3dk9 h ALA 387 CO -0.02 0.48 0.39 0.82 0.00 0.00 0.00 179.25 180.92 3dk9 h ILE 388 N 0.82 1.15 -0.67 0.00 2.04 -0.88 0.12 117.51 120.09 3dk9 h ILE 388 Ca 0.17 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 3dk9 h ILE 388 Cb 0.41 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 3dk9 h ILE 388 CO 0.01 0.15 0.32 -0.74 0.00 0.00 0.00 178.15 177.88 3dk9 h HIS 389 N 0.80 0.96 -0.11 1.37 2.76 -0.93 0.19 115.15 120.19 3dk9 h HIS 389 Ca 0.22 -0.05 -0.08 0.00 -2.20 0.00 0.00 60.37 58.26 3dk9 h HIS 389 Cb -0.09 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 28.57 3dk9 h HIS 389 CO -0.03 0.72 -0.23 -0.22 -1.30 0.00 0.00 177.93 176.87 3dk9 h LYS 390 N 0.92 0.34 0.00 5.26 3.64 -0.84 -3.37 116.57 122.53 3dk9 h LYS 390 Ca 0.23 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3dk9 h LYS 390 Cb 0.12 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 3dk9 h LYS 390 CO -0.03 0.83 -1.91 0.66 -2.27 0.00 0.00 179.45 176.73 3dk9 n TYR 391 N -4.49 0.06 0.00 1.91 4.02 0.39 -5.10 117.16 113.94 3dk9 n TYR 391 Ca -0.07 0.02 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 3dk9 n TYR 391 Cb 0.43 -0.51 0.00 0.00 -0.02 0.00 0.00 39.34 39.24 3dk9 n TYR 391 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dk9 n GLY 392 N 1.26 0.94 0.31 2.72 0.00 0.66 -4.48 105.19 106.60 3dk9 n GLY 392 Ca -0.03 -1.50 0.03 0.00 0.00 0.00 0.00 46.02 44.51 3dk9 n GLY 392 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3dk9 h ILE 393 N 0.00 1.14 0.00 -0.61 2.10 -1.91 0.28 117.51 118.50 3dk9 h ILE 393 Ca 0.00 -0.32 0.00 0.00 1.08 0.00 0.00 64.86 65.62 3dk9 h ILE 393 Cb 0.00 0.50 0.00 0.00 -1.09 0.00 0.00 36.82 36.23 3dk9 h ILE 393 CO 0.00 0.15 0.00 -0.62 -1.08 0.00 0.00 178.15 176.60 3dk9 n GLU 394 N -4.43 0.17 -0.26 2.19 -0.58 -1.26 -2.88 120.64 113.59 3dk9 n GLU 394 Ca 0.04 0.39 0.07 0.00 -0.42 0.00 0.00 57.16 57.23 3dk9 n GLU 394 Cb 0.08 -1.82 0.18 0.00 -0.57 0.00 0.00 31.44 29.31 3dk9 n GLU 394 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3dk9 n ASN 395 N -2.15 3.16 -4.16 1.62 3.02 0.08 -4.95 115.26 111.88 3dk9 n ASN 395 Ca 0.03 -2.61 -0.27 0.00 -0.03 0.00 0.00 54.58 51.69 3dk9 n ASN 395 Cb 0.24 -0.37 -0.16 0.00 -0.61 0.00 0.00 39.78 38.87 3dk9 n ASN 395 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3dk9 s VAL 396 N -2.09 1.56 -0.05 2.41 1.01 -1.14 -0.66 120.40 121.45 3dk9 s VAL 396 Ca 0.30 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.51 3dk9 s VAL 396 Cb 0.23 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 35.28 3dk9 s VAL 396 CO 0.09 0.45 -0.10 -0.75 0.00 0.00 0.00 175.10 174.79 3dk9 s LYS 397 N 0.01 1.31 0.09 2.72 2.20 -0.36 -4.99 119.74 120.74 3dk9 s LYS 397 Ca -0.04 -0.32 0.06 0.00 -0.36 0.00 0.00 55.97 55.31 3dk9 s LYS 397 Cb -0.12 -1.15 -0.04 0.00 -1.51 0.00 0.00 37.83 35.01 3dk9 s LYS 397 CO 0.03 0.03 -0.07 0.95 -0.36 0.00 0.00 175.35 175.93 3dk9 s THR 398 N 0.57 3.55 -0.01 3.43 -4.23 -1.26 -0.67 115.64 117.03 3dk9 s THR 398 Ca -0.11 -1.16 0.07 0.00 -1.18 0.00 0.00 61.69 59.31 3dk9 s THR 398 Cb -0.14 -2.66 -0.02 0.00 1.34 0.00 0.00 72.50 71.03 3dk9 s THR 398 CO 0.02 0.14 -0.22 -0.31 -0.54 0.00 0.00 174.62 173.71 3dk9 s TYR 399 N -1.22 1.94 0.14 3.99 1.51 -0.34 -4.99 117.35 118.38 3dk9 s TYR 399 Ca 0.22 -0.37 -0.18 0.00 -1.01 0.00 0.00 57.07 55.73 3dk9 s TYR 399 Cb -0.11 -1.23 0.04 0.00 -0.11 0.00 0.00 41.96 40.55 3dk9 s TYR 399 CO 0.14 -0.01 0.46 -1.54 -1.11 0.00 0.00 175.55 173.50 3dk9 s SER 400 N -0.64 -0.31 0.11 2.29 1.04 -1.26 -0.52 113.70 114.42 3dk9 s SER 400 Ca 0.08 -0.27 -0.10 0.00 0.48 0.00 0.00 55.95 56.14 3dk9 s SER 400 Cb -0.08 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.55 3dk9 s SER 400 CO -0.00 -0.91 0.25 0.28 0.98 0.00 0.00 173.24 173.84 3dk9 s THR 401 N -3.80 0.11 -0.02 2.02 -1.32 -0.47 -4.95 115.64 107.22 3dk9 s THR 401 Ca 0.03 -1.13 -0.01 0.00 -1.21 0.00 0.00 61.69 59.38 3dk9 s THR 401 Cb 0.01 -1.42 0.02 0.00 -1.51 0.00 0.00 72.50 69.59 3dk9 s THR 401 CO -0.11 -0.52 0.03 -0.55 -2.21 0.00 0.00 174.62 171.27 3dk9 s SER 402 N -2.87 0.01 0.21 8.08 0.15 -1.26 -1.43 113.70 116.59 3dk9 s SER 402 Ca 0.07 0.06 -0.17 0.00 0.70 0.00 0.00 55.95 56.61 3dk9 s SER 402 Cb 0.04 0.00 0.02 0.00 -1.71 0.00 0.00 66.02 64.37 3dk9 s SER 402 CO -0.09 -0.07 0.53 0.72 1.20 0.00 0.00 173.24 175.53 3dk9 s PHE 403 N 0.54 -0.02 -0.33 3.44 -0.71 -0.38 -5.00 117.98 115.52 3dk9 s PHE 403 Ca -0.04 -0.34 -0.13 0.00 -1.04 0.00 0.00 56.93 55.38 3dk9 s PHE 403 Cb -0.06 0.37 -0.02 0.00 -1.21 0.00 0.00 43.02 42.10 3dk9 s PHE 403 CO -0.02 -0.96 0.24 0.99 -1.34 0.00 0.00 175.22 174.14 3dk9 s THR 404 N -3.91 5.29 0.39 -4.49 2.01 -1.26 -0.30 115.64 113.37 3dk9 s THR 404 Ca 0.12 -0.17 -0.25 0.00 0.31 0.00 0.00 61.69 61.70 3dk9 s THR 404 Cb -0.01 -3.70 -0.11 0.00 0.01 0.00 0.00 72.50 68.68 3dk9 s THR 404 CO 0.00 0.01 1.01 -2.65 -0.69 0.00 0.00 174.62 172.30 3dk9 n PRO 405 N 5.11 1.36 0.26 4.92 -0.02 -1.26 -4.86 135.00 140.51 3dk9 n PRO 405 Ca -0.13 0.49 0.18 0.00 -2.02 0.00 0.00 63.50 62.01 3dk9 n PRO 405 Cb 0.50 -2.00 0.89 0.00 -0.02 0.00 0.00 33.50 32.87 3dk9 n PRO 405 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 3dk9 h MET 406 N 1.65 0.00 -0.99 -0.52 1.85 -1.98 -0.73 114.93 114.21 3dk9 h MET 406 Ca -0.43 0.00 0.27 0.00 -0.61 0.00 0.00 59.70 58.93 3dk9 h MET 406 Cb 1.34 0.00 -0.14 0.00 0.43 0.00 0.00 31.60 33.23 3dk9 h MET 406 CO 0.58 0.00 0.55 -0.92 -0.40 0.00 0.00 176.91 176.71 3dk9 h TYR 407 N 0.00 0.91 -0.17 1.39 3.20 -2.01 -0.45 116.97 119.85 3dk9 h TYR 407 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 3dk9 h TYR 407 Cb 0.10 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.13 3dk9 h TYR 407 CO 0.00 -0.06 0.00 0.72 -1.64 0.00 0.00 178.16 177.18 3dk9 n HIS 408 N -4.99 0.22 0.17 -3.82 8.25 -0.28 -4.16 115.22 110.60 3dk9 n HIS 408 Ca 0.28 -0.11 0.13 0.00 -0.26 0.00 0.00 57.72 57.76 3dk9 n HIS 408 Cb 0.83 0.00 0.66 0.00 1.12 0.00 0.00 29.99 32.61 3dk9 n HIS 408 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dk9 h ALA 409 N 3.83 2.18 -0.18 -1.41 0.00 -1.20 -2.41 119.26 120.06 3dk9 h ALA 409 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dk9 h ALA 409 Cb 0.37 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3dk9 h ALA 409 CO 0.00 -0.24 0.00 1.33 0.00 0.00 0.00 179.25 180.34 3dk9 n VAL 410 N -4.47 0.38 -4.21 0.00 0.24 -1.26 -5.02 118.33 104.00 3dk9 n VAL 410 Ca 0.02 -0.69 -0.28 0.00 -2.04 0.00 0.00 64.34 61.35 3dk9 n VAL 410 Cb 0.28 1.00 -0.09 0.00 -1.47 0.00 0.00 33.84 33.56 3dk9 n VAL 410 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3dk9 s THR 411 N -1.13 3.58 0.11 3.34 -4.23 -0.91 -4.70 115.64 111.71 3dk9 s THR 411 Ca 0.22 -1.34 0.06 0.00 -1.18 0.00 0.00 61.69 59.44 3dk9 s THR 411 Cb 0.13 -2.75 -0.22 0.00 1.34 0.00 0.00 72.50 71.01 3dk9 s THR 411 CO 0.19 -0.01 1.24 0.11 -0.54 0.00 0.00 174.62 175.62 3dk9 h LYS 412 N 3.12 0.03 -6.90 3.99 1.57 -1.95 -3.45 116.57 112.98 3dk9 h LYS 412 Ca -0.48 -0.06 -0.47 0.00 -1.87 0.00 0.00 60.65 57.77 3dk9 h LYS 412 Cb 1.19 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 3dk9 h LYS 412 CO 0.56 1.01 0.37 0.50 -0.57 0.00 0.00 179.45 181.32 3dk9 s ARG 413 N -2.70 4.48 0.04 3.15 3.52 -1.26 -5.07 118.95 121.12 3dk9 s ARG 413 Ca 0.00 1.40 0.04 0.00 -0.13 0.00 0.00 55.73 57.05 3dk9 s ARG 413 Cb 0.10 -2.76 -0.02 0.00 -1.56 0.00 0.00 34.95 30.71 3dk9 s ARG 413 CO 0.83 0.17 -0.12 0.15 -0.81 0.00 0.00 175.30 175.51 3dk9 s LYS 414 N -2.13 0.80 0.12 5.12 -0.14 -1.26 -4.91 119.74 117.34 3dk9 s LYS 414 Ca 0.52 -0.77 0.04 0.00 -1.36 0.00 0.00 55.97 54.40 3dk9 s LYS 414 Cb -0.20 -0.76 -0.04 0.00 -1.68 0.00 0.00 37.83 35.15 3dk9 s LYS 414 CO 0.26 0.18 -0.11 0.95 -0.76 0.00 0.00 175.35 175.87 3dk9 s THR 415 N -1.00 1.11 0.33 2.17 -4.23 -1.26 -5.05 115.64 107.72 3dk9 s THR 415 Ca -0.01 -1.84 0.07 0.00 -1.18 0.00 0.00 61.69 58.72 3dk9 s THR 415 Cb -0.08 -1.61 -0.02 0.00 1.34 0.00 0.00 72.50 72.12 3dk9 s THR 415 CO 0.01 -0.62 0.34 -0.75 -0.54 0.00 0.00 174.62 173.07 3dk9 s LYS 416 N -3.20 2.84 -0.09 3.99 2.20 -1.26 -4.30 119.74 119.92 3dk9 s LYS 416 Ca 0.11 -1.21 0.03 0.00 -0.36 0.00 0.00 55.97 54.54 3dk9 s LYS 416 Cb -0.01 -2.58 0.01 0.00 -1.51 0.00 0.00 37.83 33.74 3dk9 s LYS 416 CO 0.01 0.09 -0.17 0.00 -0.36 0.00 0.00 175.35 174.91 3dk9 s VAL 418 N 0.66 2.03 -0.00 0.00 -7.23 -0.44 -1.25 120.40 114.17 3dk9 s VAL 418 Ca -0.13 -1.22 0.00 0.00 -1.81 0.00 0.00 61.98 58.82 3dk9 s VAL 418 Cb -0.16 -1.71 -0.00 0.00 0.56 0.00 0.00 36.38 35.07 3dk9 s VAL 418 CO 0.04 0.45 -0.00 -0.04 -0.31 0.00 0.00 175.10 175.23 3dk9 s MET 419 N -0.91 0.04 -0.02 4.82 -1.94 -0.52 -1.24 119.30 119.54 3dk9 s MET 419 Ca 0.10 -0.02 0.00 0.00 -1.71 0.00 0.00 55.69 54.07 3dk9 s MET 419 Cb -0.10 -0.04 0.02 0.00 2.01 0.00 0.00 34.83 36.72 3dk9 s MET 419 CO 0.01 0.01 0.00 0.21 -0.01 0.00 0.00 175.02 175.24 3dk9 s LYS 420 N -0.00 0.19 -0.16 2.03 2.20 0.24 -1.37 119.74 122.87 3dk9 s LYS 420 Ca 0.00 0.06 -0.01 0.00 -0.36 0.00 0.00 55.97 55.66 3dk9 s LYS 420 Cb -0.00 -0.34 -0.01 0.00 -1.51 0.00 0.00 37.83 35.97 3dk9 s LYS 420 CO -0.00 -0.10 -0.11 1.41 -0.36 0.00 0.00 175.35 176.19 3dk9 s MET 421 N 0.75 3.34 -0.24 4.03 -2.45 0.33 -1.08 119.30 123.98 3dk9 s MET 421 Ca -0.07 -0.68 -0.07 0.00 -1.25 0.00 0.00 55.69 53.62 3dk9 s MET 421 Cb -0.10 -2.74 -0.03 0.00 1.25 0.00 0.00 34.83 33.21 3dk9 s MET 421 CO -0.02 0.05 0.06 0.08 1.05 0.00 0.00 175.02 176.24 3dk9 s VAL 422 N 0.78 4.24 -0.03 10.11 1.01 0.03 -1.20 120.40 135.35 3dk9 s VAL 422 Ca -0.04 -0.20 0.05 0.00 0.00 0.00 0.00 61.98 61.79 3dk9 s VAL 422 Cb -0.15 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.23 3dk9 s VAL 422 CO 0.01 0.36 -0.19 0.00 0.00 0.00 0.00 175.10 175.28 3dk9 s ALA 424 N -0.72 2.26 0.27 0.00 0.00 0.18 -1.22 121.76 122.53 3dk9 s ALA 424 Ca 0.11 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3dk9 s ALA 424 Cb -0.10 -0.50 0.00 0.00 0.00 0.00 0.00 23.12 22.52 3dk9 s ALA 424 CO 0.01 0.54 0.00 0.09 0.00 0.00 0.00 175.76 176.39 3dk9 n ASN 425 N 1.84 -6.39 -0.37 0.00 5.03 0.17 -1.18 115.26 114.36 3dk9 n ASN 425 Ca -0.17 0.50 0.06 0.00 0.87 0.00 0.00 54.58 55.84 3dk9 n ASN 425 Cb 0.52 -3.30 0.22 0.00 -1.02 0.00 0.00 39.78 36.20 3dk9 n ASN 425 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 3dk9 h LYS 426 N -1.00 1.01 0.00 3.52 3.64 -1.98 -0.36 116.57 121.41 3dk9 h LYS 426 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3dk9 h LYS 426 Cb 0.99 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 3dk9 h LYS 426 CO 0.01 0.67 0.00 -0.85 -2.27 0.00 0.00 179.45 177.01 3dk9 n GLU 427 N -4.59 0.30 -3.59 1.90 0.28 -1.26 -4.92 120.64 108.77 3dk9 n GLU 427 Ca 0.18 0.07 -0.21 0.00 -0.16 0.00 0.00 57.16 57.03 3dk9 n GLU 427 Cb 0.31 -1.50 0.05 0.00 1.43 0.00 0.00 31.44 31.73 3dk9 n GLU 427 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3dk9 n GLU 428 N -1.31 -4.00 -1.74 3.44 1.02 -0.15 -4.27 120.64 113.64 3dk9 n GLU 428 Ca 0.11 0.66 -0.42 0.00 -0.02 0.00 0.00 57.16 57.49 3dk9 n GLU 428 Cb 0.20 -5.18 -0.02 0.00 -0.02 0.00 0.00 31.44 26.41 3dk9 n GLU 428 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3dk9 n LYS 429 N -4.06 2.70 -2.63 3.49 4.81 -0.32 -0.86 118.16 121.29 3dk9 n LYS 429 Ca -0.22 0.97 -0.42 0.00 -0.87 0.00 0.00 58.31 57.76 3dk9 n LYS 429 Cb 0.65 -2.76 -0.03 0.00 0.02 0.00 0.00 35.03 32.91 3dk9 n LYS 429 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3dk9 s VAL 430 N 0.33 4.03 -1.44 3.15 1.01 0.46 -0.65 120.40 127.29 3dk9 s VAL 430 Ca 0.67 0.63 0.19 0.00 0.00 0.00 0.00 61.98 63.48 3dk9 s VAL 430 Cb -0.50 -4.74 -0.08 0.00 0.00 0.00 0.00 36.38 31.05 3dk9 s VAL 430 CO 0.44 -1.43 0.91 1.33 0.00 0.00 0.00 175.10 176.35 3dk9 n VAL 431 N 6.49 0.00 -3.60 2.92 0.24 0.29 -4.75 118.33 119.92 3dk9 n VAL 431 Ca 0.06 -0.20 -0.16 0.00 -2.04 0.00 0.00 64.34 62.00 3dk9 n VAL 431 Cb 0.49 1.14 -0.07 0.00 -1.47 0.00 0.00 33.84 33.93 3dk9 n VAL 431 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3dk9 s GLY 432 N -2.43 -0.51 -0.04 7.63 0.00 -1.07 -0.45 107.32 110.45 3dk9 s GLY 432 Ca 0.13 1.51 0.01 0.00 0.00 0.00 0.00 44.72 46.37 3dk9 s GLY 432 CO 0.60 1.21 -0.06 -0.42 0.00 0.00 0.00 173.10 174.43 3dk9 s ILE 433 N -0.47 0.58 -0.02 0.90 1.01 -0.17 -0.79 121.20 122.24 3dk9 s ILE 433 Ca -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.41 3dk9 s ILE 433 Cb -0.03 -0.57 0.03 0.00 0.01 0.00 0.00 42.46 41.90 3dk9 s ILE 433 CO 0.05 0.22 0.02 -1.00 0.00 0.00 0.00 174.94 174.23 3dk9 s HIS 434 N 0.64 0.13 0.10 3.97 3.76 -0.24 -1.15 115.29 122.50 3dk9 s HIS 434 Ca -0.09 0.08 -0.20 0.00 -0.15 0.00 0.00 55.06 54.71 3dk9 s HIS 434 Cb -0.12 -0.29 0.05 0.00 1.11 0.00 0.00 32.58 33.32 3dk9 s HIS 434 CO 0.00 -0.10 0.48 0.00 -0.85 0.00 0.00 174.74 174.27 3dk9 s MET 435 N 1.03 1.08 -0.04 1.40 0.23 0.10 -0.59 119.30 122.50 3dk9 s MET 435 Ca -0.09 -0.47 -0.03 0.00 -1.03 0.00 0.00 55.69 54.07 3dk9 s MET 435 Cb -0.13 0.49 0.02 0.00 -1.53 0.00 0.00 34.83 33.68 3dk9 s MET 435 CO -0.02 -0.42 0.10 -1.14 -2.03 0.00 0.00 175.02 171.51 3dk9 s GLN 436 N -3.19 0.08 0.00 3.16 0.74 -0.37 -0.85 119.66 119.24 3dk9 s GLN 436 Ca -0.01 0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.60 3dk9 s GLN 436 Cb 0.00 -0.06 0.00 0.00 1.10 0.00 0.00 33.01 34.05 3dk9 s GLN 436 CO -0.08 -0.08 0.00 0.41 -0.55 0.00 0.00 175.29 175.00 3dk9 n GLY 437 N 3.53 2.97 3.65 2.59 0.00 -0.39 -1.32 105.19 116.22 3dk9 n GLY 437 Ca -0.19 -1.05 -0.47 0.00 0.00 0.00 0.00 46.02 44.32 3dk9 n GLY 437 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dk9 n LEU 438 N 0.00 2.73 0.00 0.99 4.77 -1.26 -1.61 117.00 122.63 3dk9 n LEU 438 Ca 0.00 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.09 3dk9 n LEU 438 Cb 0.00 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 39.72 3dk9 n LEU 438 CO 0.00 -0.54 0.00 0.61 -1.33 0.00 0.00 177.39 176.13 3dk9 n GLY 439 N 2.84 1.86 0.24 -0.72 0.00 -1.26 -4.89 105.19 103.26 3dk9 n GLY 439 Ca 0.16 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.28 3dk9 n GLY 439 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk9 h ASP 441 N 0.00 0.98 0.32 0.00 2.03 -1.83 -3.01 116.42 114.91 3dk9 h ASP 441 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3dk9 h ASP 441 Cb 0.49 -0.21 0.00 0.00 -0.83 0.00 0.00 39.33 38.78 3dk9 h ASP 441 CO 0.02 0.65 -0.90 -0.62 -1.03 0.00 0.00 179.24 177.36 3dk9 n GLU 442 N -4.52 0.14 0.07 4.15 -0.58 -0.87 -4.37 120.64 114.65 3dk9 n GLU 442 Ca 0.13 -0.01 -0.06 0.00 -0.42 0.00 0.00 57.16 56.81 3dk9 n GLU 442 Cb 0.13 -1.54 -0.10 0.00 -0.57 0.00 0.00 31.44 29.36 3dk9 n GLU 442 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 3dk9 h MET 443 N 0.00 0.00 -0.24 3.49 4.05 -1.23 -3.38 114.93 117.61 3dk9 h MET 443 Ca 0.00 0.00 -0.18 0.00 -0.28 0.00 0.00 59.70 59.24 3dk9 h MET 443 Cb 0.61 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.41 3dk9 h MET 443 CO 0.00 0.94 -0.57 1.25 0.23 0.00 0.00 176.91 178.76 3dk9 h LEU 444 N 0.00 0.84 -0.50 3.39 5.85 -1.74 -3.35 115.31 119.79 3dk9 h LEU 444 Ca -0.01 -0.46 0.09 0.00 0.84 0.00 0.00 57.88 58.35 3dk9 h LEU 444 Cb 1.72 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 42.43 3dk9 h LEU 444 CO 0.12 1.23 0.04 -0.61 -0.34 0.00 0.00 178.44 178.88 3dk9 h GLN 445 N 0.57 0.16 -0.40 1.25 5.75 -1.86 -0.20 115.11 120.38 3dk9 h GLN 445 Ca 0.01 -0.01 -0.10 0.00 -0.15 0.00 0.00 58.65 58.40 3dk9 h GLN 445 Cb 1.15 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.65 3dk9 h GLN 445 CO 0.12 0.10 -0.14 0.78 -2.65 0.00 0.00 178.83 177.04 3dk9 h GLY 446 N 0.16 0.80 1.59 2.39 0.00 -1.87 -2.01 103.07 104.14 3dk9 h GLY 446 Ca 0.26 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.91 3dk9 h GLY 446 CO -0.39 0.57 -0.03 0.74 0.00 0.00 0.00 176.54 177.43 3dk9 h PHE 447 N 0.67 0.52 -0.58 5.60 -1.00 -1.42 -2.21 116.94 118.52 3dk9 h PHE 447 Ca 0.11 -0.06 -0.06 0.00 2.81 0.00 0.00 57.97 60.77 3dk9 h PHE 447 Cb 0.62 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 40.00 3dk9 h PHE 447 CO 0.03 0.54 0.12 0.00 -1.61 0.00 0.00 178.31 177.39 3dk9 h ALA 448 N 1.49 1.12 -0.43 2.45 0.00 -0.46 -0.33 119.26 123.12 3dk9 h ALA 448 Ca 0.10 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3dk9 h ALA 448 Cb 0.37 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3dk9 h ALA 448 CO 0.01 0.58 0.26 0.28 0.00 0.00 0.00 179.25 180.39 3dk9 h VAL 449 N 0.86 1.13 -0.52 0.00 2.07 -0.80 -0.50 116.25 118.50 3dk9 h VAL 449 Ca 0.18 -0.29 0.02 0.00 0.82 0.00 0.00 66.70 67.42 3dk9 h VAL 449 Cb 0.34 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 3dk9 h VAL 449 CO 0.00 0.13 0.33 0.00 0.02 0.00 0.00 177.57 178.05 3dk9 h ALA 450 N 1.12 0.66 -0.45 1.67 0.00 -0.99 -1.68 119.26 119.60 3dk9 h ALA 450 Ca 0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3dk9 h ALA 450 Cb -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3dk9 h ALA 450 CO -0.03 0.06 0.20 0.28 0.00 0.00 0.00 179.25 179.75 3dk9 h VAL 451 N 0.66 1.20 -0.32 0.00 2.07 -0.85 -1.58 116.25 117.43 3dk9 h VAL 451 Ca 0.20 -0.59 0.05 0.00 0.82 0.00 0.00 66.70 67.18 3dk9 h VAL 451 Cb -0.03 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 3dk9 h VAL 451 CO -0.07 0.22 0.22 0.50 0.02 0.00 0.00 177.57 178.46 3dk9 h LYS 452 N 0.59 0.21 -0.00 1.57 1.63 -0.77 -0.82 116.57 118.98 3dk9 h LYS 452 Ca 0.15 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 3dk9 h LYS 452 Cb 0.16 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 3dk9 h LYS 452 CO -0.02 0.14 -0.01 -1.33 -3.45 0.00 0.00 179.45 174.79 3dk9 n MET 453 N -4.48 0.92 -1.65 1.90 2.81 -0.66 -4.92 117.12 111.04 3dk9 n MET 453 Ca 0.03 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.84 3dk9 n MET 453 Cb 0.23 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.25 3dk9 n MET 453 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dk9 n GLY 454 N 1.09 0.51 3.63 3.03 0.00 -0.31 -5.01 105.19 108.12 3dk9 n GLY 454 Ca 0.21 -0.84 -0.40 0.00 0.00 0.00 0.00 46.02 44.99 3dk9 n GLY 454 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dk9 n ALA 455 N -0.69 0.38 -2.16 4.61 0.00 -0.64 -4.75 120.51 117.26 3dk9 n ALA 455 Ca 0.00 0.17 -0.20 0.00 0.00 0.00 0.00 53.44 53.41 3dk9 n ALA 455 Cb 0.37 -2.12 -0.02 0.00 0.00 0.00 0.00 19.45 17.68 3dk9 n ALA 455 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3dk9 s THR 456 N -1.33 2.72 0.35 0.00 -4.23 -1.26 -0.41 115.64 111.47 3dk9 s THR 456 Ca 0.66 -1.25 0.04 0.00 -1.18 0.00 0.00 61.69 59.96 3dk9 s THR 456 Cb -0.51 -2.97 0.28 0.00 1.34 0.00 0.00 72.50 70.65 3dk9 s THR 456 CO 0.54 0.00 1.97 0.50 -0.54 0.00 0.00 174.62 177.09 3dk9 h LYS 457 N 0.91 0.82 -0.46 3.99 1.63 -1.18 -0.67 116.57 121.60 3dk9 h LYS 457 Ca -0.41 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.32 3dk9 h LYS 457 Cb 1.27 -0.18 -0.02 0.00 -0.60 0.00 0.00 32.23 32.69 3dk9 h LYS 457 CO 0.54 0.54 0.21 0.00 -3.45 0.00 0.00 179.45 177.29 3dk9 h ALA 458 N 1.58 1.49 -0.53 5.00 0.00 -1.84 0.86 119.26 125.83 3dk9 h ALA 458 Ca 0.30 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 3dk9 h ALA 458 Cb 0.14 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3dk9 h ALA 458 CO -0.09 0.40 0.07 -0.44 0.00 0.00 0.00 179.25 179.19 3dk9 h ASP 459 N 0.65 0.80 -0.17 0.00 3.32 -1.51 0.66 116.42 120.17 3dk9 h ASP 459 Ca 0.16 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 3dk9 h ASP 459 Cb 0.10 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 3dk9 h ASP 459 CO -0.02 0.82 -0.05 -0.26 -1.72 0.00 0.00 179.24 178.01 3dk9 h PHE 460 N 0.80 0.38 0.00 4.55 -1.00 -1.09 -3.10 116.94 117.48 3dk9 h PHE 460 Ca 0.17 -0.08 -0.02 0.00 2.81 0.00 0.00 57.97 60.85 3dk9 h PHE 460 Cb 0.37 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 39.84 3dk9 h PHE 460 CO 0.02 0.61 -0.09 -0.44 -1.61 0.00 0.00 178.31 176.80 3dk9 h ASP 461 N 0.04 0.00 0.37 2.17 3.32 -0.54 -1.47 116.42 120.31 3dk9 h ASP 461 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3dk9 h ASP 461 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3dk9 h ASP 461 CO 0.02 0.09 0.00 0.59 -1.72 0.00 0.00 179.24 178.22 3dk9 n ASN 462 N -3.19 0.00 -4.63 6.45 3.02 0.20 -4.67 115.26 112.44 3dk9 n ASN 462 Ca 0.01 0.25 -0.37 0.00 -0.03 0.00 0.00 54.58 54.44 3dk9 n ASN 462 Cb 0.41 -0.37 -0.10 0.00 -0.61 0.00 0.00 39.78 39.10 3dk9 n ASN 462 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3dk9 s THR 463 N -2.75 5.32 0.36 3.41 2.01 -0.55 -5.06 115.64 118.39 3dk9 s THR 463 Ca 0.11 0.22 -0.28 0.00 0.31 0.00 0.00 61.69 62.06 3dk9 s THR 463 Cb 0.10 -3.53 -0.10 0.00 0.01 0.00 0.00 72.50 68.98 3dk9 s THR 463 CO 0.24 0.30 1.34 -0.69 -0.69 0.00 0.00 174.62 175.12 3dk9 s VAL 464 N 1.38 2.54 0.72 3.82 1.01 -1.26 -4.97 120.40 123.64 3dk9 s VAL 464 Ca 0.08 0.53 -0.13 0.00 0.00 0.00 0.00 61.98 62.46 3dk9 s VAL 464 Cb -0.15 -3.33 0.03 0.00 0.00 0.00 0.00 36.38 32.94 3dk9 s VAL 464 CO 0.07 0.11 1.11 0.00 0.00 0.00 0.00 175.10 176.40 3dk9 s ALA 465 N -1.17 2.30 -0.23 5.51 0.00 -1.26 -5.05 121.76 121.86 3dk9 s ALA 465 Ca 0.52 0.47 -0.05 0.00 0.00 0.00 0.00 51.96 52.90 3dk9 s ALA 465 Cb -0.41 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.37 3dk9 s ALA 465 CO 0.54 -1.60 0.01 0.42 0.00 0.00 0.00 175.76 175.13 3dk9 s ILE 466 N -2.54 3.83 0.02 0.00 1.01 -1.26 -5.09 121.20 117.17 3dk9 s ILE 466 Ca 0.65 -0.34 0.07 0.00 0.00 0.00 0.00 60.65 61.03 3dk9 s ILE 466 Cb -0.20 -2.76 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 3dk9 s ILE 466 CO 0.48 0.39 -0.20 -2.28 0.00 0.00 0.00 174.94 173.33 3dk9 s HIS 467 N 1.46 1.80 -0.25 3.97 2.46 -1.26 -3.30 115.29 120.17 3dk9 s HIS 467 Ca 0.05 -0.36 -0.19 0.00 0.47 0.00 0.00 55.06 55.03 3dk9 s HIS 467 Cb -0.15 -1.11 -0.02 0.00 -0.13 0.00 0.00 32.58 31.17 3dk9 s HIS 467 CO 0.00 0.04 0.57 -2.14 -2.47 0.00 0.00 174.74 170.75 3dk9 s PRO 468 N -0.91 4.11 0.14 2.88 0.02 -1.26 -5.19 135.00 134.80 3dk9 s PRO 468 Ca 0.07 0.45 -0.01 0.00 0.02 0.00 0.00 61.00 61.53 3dk9 s PRO 468 Cb -0.08 -3.63 -0.04 0.00 0.02 0.00 0.00 34.50 30.76 3dk9 s PRO 468 CO 0.01 -0.34 0.07 0.95 -0.33 0.00 0.00 177.00 177.36 3dk9 s THR 469 N 2.27 0.09 0.25 0.99 -4.23 -1.21 -5.03 115.64 108.77 3dk9 s THR 469 Ca 0.24 -1.91 0.04 0.00 -1.18 0.00 0.00 61.69 58.88 3dk9 s THR 469 Cb -0.16 -2.08 -0.02 0.00 1.34 0.00 0.00 72.50 71.59 3dk9 s THR 469 CO 0.09 -0.42 1.60 0.28 -0.54 0.00 0.00 174.62 175.62 3dk9 h SER 470 N 2.84 0.33 -0.08 3.99 0.02 -1.90 -3.33 113.55 115.43 3dk9 h SER 470 Ca -0.35 -0.17 0.01 0.00 -0.84 0.00 0.00 61.79 60.44 3dk9 h SER 470 Cb 1.20 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.65 3dk9 h SER 470 CO 0.58 0.80 0.05 0.77 -1.14 0.00 0.00 176.83 177.89 3dk9 h SER 471 N 0.23 0.04 0.16 3.07 4.64 -1.93 -1.49 113.55 118.27 3dk9 h SER 471 Ca 0.01 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 3dk9 h SER 471 Cb 1.01 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.09 3dk9 h SER 471 CO 0.09 0.03 -0.03 1.05 -0.87 0.00 0.00 176.83 177.09 3dk9 h GLU 472 N 0.05 0.00 -0.01 4.77 4.11 -1.74 -1.97 114.58 119.79 3dk9 h GLU 472 Ca 0.03 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.44 3dk9 h GLU 472 Cb 0.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 3dk9 h GLU 472 CO -0.00 0.03 -0.11 0.93 0.07 0.00 0.00 179.01 179.93 3dk9 h GLU 473 N 0.00 0.01 0.00 1.06 4.39 -1.50 -2.06 114.58 116.48 3dk9 h GLU 473 Ca -0.00 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3dk9 h GLU 473 Cb 0.12 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 3dk9 h GLU 473 CO 0.00 0.12 0.00 1.25 -1.16 0.00 0.00 179.01 179.23 3dk9 h LEU 474 N 0.01 0.00 -2.95 1.33 5.85 -1.54 -2.77 115.31 115.24 3dk9 h LEU 474 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3dk9 h LEU 474 Cb 0.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 3dk9 h LEU 474 CO 0.01 0.00 0.00 1.33 -0.34 0.00 0.00 178.44 179.44 3dk9 n VAL 475 N -2.67 1.35 -1.79 1.05 0.24 -0.79 -4.47 118.33 111.24 3dk9 n VAL 475 Ca 0.03 -1.15 0.04 0.00 -2.04 0.00 0.00 64.34 61.22 3dk9 n VAL 475 Cb 0.35 0.33 0.07 0.00 -1.47 0.00 0.00 33.84 33.11 3dk9 n VAL 475 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 3dk9 n THR 476 N 0.86 0.80 -2.35 3.34 5.66 -1.05 -4.49 114.28 117.05 3dk9 n THR 476 Ca 0.20 -1.23 -0.38 0.00 -3.05 0.00 0.00 64.05 59.59 3dk9 n THR 476 Cb 0.64 0.30 -0.03 0.00 -1.55 0.00 0.00 70.33 69.70 3dk9 n THR 476 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 3dk9 s LEU 477 N -1.20 4.22 0.00 1.09 1.43 -1.20 -5.04 118.68 117.98 3dk9 s LEU 477 Ca 0.20 2.29 0.00 0.00 -1.03 0.00 0.00 54.13 55.59 3dk9 s LEU 477 Cb 0.20 -4.01 0.00 0.00 0.03 0.00 0.00 46.19 42.41 3dk9 s LEU 477 CO -0.03 -0.59 0.08 0.54 0.23 0.00 0.00 176.35 176.58