#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dak s LEU 8 N 0.00 4.44 0.53 0.00 2.96 -1.26 -5.04 118.68 120.31 3dak s LEU 8 Ca 0.00 1.72 -0.19 0.00 -0.22 0.00 0.00 54.13 55.44 3dak s LEU 8 Cb 0.00 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 43.06 3dak s LEU 8 CO 0.00 -0.15 1.07 -2.16 -1.32 0.00 0.00 176.35 173.79 3dak s PRO 9 N 0.45 3.54 0.12 0.98 0.04 -1.26 -4.95 135.00 133.93 3dak s PRO 9 Ca 0.49 1.38 -0.31 0.00 0.04 0.00 0.00 61.00 62.60 3dak s PRO 9 Cb -0.22 -2.05 -0.10 0.00 0.04 0.00 0.00 34.50 32.16 3dak s PRO 9 CO 0.29 -0.65 1.85 -1.58 0.04 0.00 0.00 177.00 176.94 3dak s TRP 10 N -2.07 2.08 0.49 0.56 0.52 -1.26 -4.94 118.94 114.32 3dak s TRP 10 Ca 0.68 -0.07 -0.24 0.00 0.02 0.00 0.00 56.10 56.49 3dak s TRP 10 Cb -0.18 -4.19 -0.07 0.00 -1.15 0.00 0.00 33.47 27.88 3dak s TRP 10 CO 0.26 -4.96 1.37 0.45 0.02 0.00 0.00 176.95 174.10 3dak s SER 11 N 2.84 5.63 -0.02 2.95 0.15 -1.26 -4.93 113.70 119.06 3dak s SER 11 Ca 0.82 2.80 0.13 0.00 0.70 0.00 0.00 55.95 60.40 3dak s SER 11 Cb -0.46 -2.64 0.38 0.00 -1.71 0.00 0.00 66.02 61.59 3dak s SER 11 CO 0.37 -1.33 1.32 2.30 1.20 0.00 0.00 173.24 177.10 3dak n ILE 12 N -0.58 1.17 -3.41 6.45 -5.35 -1.26 -4.91 119.36 111.47 3dak n ILE 12 Ca 0.08 -1.10 -0.40 0.00 -0.27 0.00 0.00 62.75 61.06 3dak n ILE 12 Cb 0.44 0.41 -0.09 0.00 -1.74 0.00 0.00 39.64 38.65 3dak n ILE 12 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3dak s ASN 13 N -1.09 6.20 0.57 7.28 3.84 -1.26 -4.94 114.94 125.54 3dak s ASN 13 Ca 0.29 0.03 0.27 0.00 0.21 0.00 0.00 52.86 53.66 3dak s ASN 13 Cb 0.17 -2.20 1.59 0.00 -0.55 0.00 0.00 41.25 40.26 3dak s ASN 13 CO 0.17 -0.24 2.11 -0.09 -2.79 0.00 0.00 177.10 176.26 3dak h ARG 14 N 8.33 0.00 0.00 0.43 1.12 -1.95 0.16 114.38 122.47 3dak h ARG 14 Ca -0.31 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.56 3dak h ARG 14 Cb 1.16 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.12 3dak h ARG 14 CO 0.66 0.00 0.00 -0.25 -3.11 0.00 0.00 179.97 177.27 3dak n ASP 15 N -3.97 0.00 -0.38 -3.80 8.00 -1.26 -2.45 116.55 112.69 3dak n ASP 15 Ca 0.02 0.39 0.13 0.00 0.71 0.00 0.00 54.79 56.04 3dak n ASP 15 Cb 0.31 -0.44 0.42 0.00 -0.02 0.00 0.00 41.12 41.39 3dak n ASP 15 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3dak n ASP 16 N -1.44 1.33 -4.22 -2.24 8.00 0.05 -4.90 116.55 113.13 3dak n ASP 16 Ca 0.04 -1.22 -0.30 0.00 0.71 0.00 0.00 54.79 54.02 3dak n ASP 16 Cb 0.15 0.08 -0.17 0.00 -0.02 0.00 0.00 41.12 41.16 3dak n ASP 16 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3dak s TYR 17 N -2.26 2.30 -0.29 1.24 2.02 -1.03 -0.45 117.35 118.90 3dak s TYR 17 Ca 0.30 -0.78 -0.05 0.00 -0.37 0.00 0.00 57.07 56.17 3dak s TYR 17 Cb 0.20 -1.53 0.02 0.00 -0.40 0.00 0.00 41.96 40.25 3dak s TYR 17 CO 0.43 -0.28 0.03 -2.00 -1.57 0.00 0.00 175.55 172.16 3dak s GLU 18 N 0.09 2.88 0.22 -0.62 2.12 0.02 -4.94 118.70 118.47 3dak s GLU 18 Ca -0.09 -0.98 -0.30 0.00 0.36 0.00 0.00 54.97 53.96 3dak s GLU 18 Cb -0.15 -3.24 -0.09 0.00 0.26 0.00 0.00 34.13 30.91 3dak s GLU 18 CO 0.05 -0.48 1.26 -0.51 -0.54 0.00 0.00 175.26 175.05 3dak s LEU 19 N 1.41 4.44 0.00 2.70 1.43 -1.26 -0.26 118.68 127.13 3dak s LEU 19 Ca 0.00 2.39 0.00 0.00 -1.03 0.00 0.00 54.13 55.49 3dak s LEU 19 Cb -0.18 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.43 3dak s LEU 19 CO -0.00 -0.45 0.00 0.00 0.23 0.00 0.00 176.35 176.13 3dak n GLN 20 N 2.18 1.18 -2.10 1.70 6.02 0.75 -4.92 117.38 122.19 3dak n GLN 20 Ca 0.04 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.62 3dak n GLN 20 Cb 0.43 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.67 3dak n GLN 20 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 3dak s GLU 21 N 4.51 4.33 -0.19 -1.09 1.03 -1.26 -4.60 118.70 121.43 3dak s GLU 21 Ca 0.00 2.22 -0.29 0.00 0.03 0.00 0.00 54.97 56.93 3dak s GLU 21 Cb 0.00 -3.10 -0.02 0.00 -0.80 0.00 0.00 34.13 30.21 3dak s GLU 21 CO 0.00 -0.27 1.36 0.08 -1.33 0.00 0.00 175.26 175.10 3dak s VAL 22 N -0.62 4.09 -0.04 1.83 1.01 -1.26 -1.14 120.40 124.26 3dak s VAL 22 Ca 0.53 1.29 -0.11 0.00 0.00 0.00 0.00 61.98 63.70 3dak s VAL 22 Cb -0.40 -3.94 -0.31 0.00 0.00 0.00 0.00 36.38 31.73 3dak s VAL 22 CO 0.48 -0.24 0.69 0.40 0.00 0.00 0.00 175.10 176.44 3dak h ILE 23 N 5.71 0.96 -2.77 2.22 2.04 -1.17 -3.48 117.51 121.01 3dak h ILE 23 Ca -0.29 -2.54 -0.13 0.00 1.00 0.00 0.00 64.86 62.91 3dak h ILE 23 Cb 1.12 2.78 -0.25 0.00 -0.74 0.00 0.00 36.82 39.72 3dak h ILE 23 CO 0.99 0.85 -0.29 -0.83 0.00 0.00 0.00 178.15 178.88 3dak s GLY 24 N -5.09 -0.29 0.43 5.37 0.00 -0.99 -4.98 107.32 101.78 3dak s GLY 24 Ca -0.15 1.20 0.05 0.00 0.00 0.00 0.00 44.72 45.82 3dak s GLY 24 CO 0.86 1.16 0.01 -1.35 0.00 0.00 0.00 173.10 173.78 3dak s SER 25 N 0.59 3.87 0.00 1.64 1.04 -1.26 -0.10 113.70 119.47 3dak s SER 25 Ca -0.03 -1.46 0.00 0.00 0.48 0.00 0.00 55.95 54.94 3dak s SER 25 Cb -0.05 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 65.97 3dak s SER 25 CO -0.04 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.21 3dak n GLY 26 N -1.04 -1.26 0.12 7.32 0.00 -0.98 -4.93 105.19 104.43 3dak n GLY 26 Ca -0.09 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 3dak n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dak h ALA 27 N 0.00 -0.19 0.09 4.61 0.00 -2.02 -3.39 119.26 118.36 3dak h ALA 27 Ca 0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3dak h ALA 27 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3dak h ALA 27 CO 0.00 -0.32 -0.04 1.15 0.00 0.00 0.00 179.25 180.03 3dak h THR 28 N -0.76 1.09 -3.48 0.00 2.02 -1.94 -3.46 112.91 106.38 3dak h THR 28 Ca -0.02 -0.68 -0.07 0.00 0.77 0.00 0.00 66.41 66.41 3dak h THR 28 Cb 0.53 1.53 -0.14 0.00 -1.74 0.00 0.00 68.15 68.33 3dak h THR 28 CO 0.03 0.17 -0.19 0.00 0.37 0.00 0.00 175.52 175.89 3dak s ALA 29 N -4.94 -0.68 -0.03 6.16 0.00 -1.26 -1.38 121.76 119.63 3dak s ALA 29 Ca -0.15 -0.19 0.06 0.00 0.00 0.00 0.00 51.96 51.68 3dak s ALA 29 Cb 0.03 0.54 -0.01 0.00 0.00 0.00 0.00 23.12 23.68 3dak s ALA 29 CO 0.64 -0.55 -0.21 0.08 0.00 0.00 0.00 175.76 175.71 3dak s VAL 30 N -3.52 1.71 -0.16 0.00 1.01 -0.83 -2.32 120.40 116.30 3dak s VAL 30 Ca 0.02 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 3dak s VAL 30 Cb 0.02 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 3dak s VAL 30 CO -0.10 0.48 -0.02 -0.69 0.00 0.00 0.00 175.10 174.78 3dak s VAL 31 N -0.28 4.07 -0.03 2.92 1.01 0.85 -0.35 120.40 128.60 3dak s VAL 31 Ca 0.02 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.72 3dak s VAL 31 Cb -0.10 -2.80 0.02 0.00 0.00 0.00 0.00 36.38 33.50 3dak s VAL 31 CO 0.01 0.48 -0.01 -1.58 0.00 0.00 0.00 175.10 174.00 3dak s GLN 32 N 0.39 0.40 0.73 2.72 0.74 -0.25 -0.53 119.66 123.85 3dak s GLN 32 Ca -0.02 0.01 -0.16 0.00 0.05 0.00 0.00 55.36 55.24 3dak s GLN 32 Cb -0.14 -0.52 0.03 0.00 1.10 0.00 0.00 33.01 33.49 3dak s GLN 32 CO 0.02 -0.10 1.24 0.00 -0.55 0.00 0.00 175.29 175.91 3dak n ALA 33 N 3.96 0.54 -3.51 1.58 0.00 -0.30 -0.29 120.51 122.50 3dak n ALA 33 Ca -0.25 -0.16 -0.16 0.00 0.00 0.00 0.00 53.44 52.86 3dak n ALA 33 Cb 0.51 -2.28 -0.07 0.00 0.00 0.00 0.00 19.45 17.61 3dak n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dak s ALA 34 N -1.75 -1.62 -0.24 0.00 0.00 0.11 -0.18 121.76 118.08 3dak s ALA 34 Ca 0.78 1.39 -0.12 0.00 0.00 0.00 0.00 51.96 54.00 3dak s ALA 34 Cb -0.34 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.40 3dak s ALA 34 CO 0.46 -0.34 0.25 -0.47 0.00 0.00 0.00 175.76 175.65 3dak s TYR 35 N -0.71 3.31 -0.36 0.00 5.04 0.64 0.10 117.35 125.37 3dak s TYR 35 Ca -0.08 0.33 -0.17 0.00 -2.44 0.00 0.00 57.07 54.71 3dak s TYR 35 Cb -0.02 -2.38 -0.00 0.00 0.35 0.00 0.00 41.96 39.90 3dak s TYR 35 CO 0.06 -0.02 0.45 0.00 -1.34 0.00 0.00 175.55 174.71 3dak h ALA 37 N 8.50 -0.62 0.00 0.00 0.00 -1.05 -0.30 119.26 125.79 3dak h ALA 37 Ca -0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 3dak h ALA 37 Cb 1.13 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 3dak h ALA 37 CO 0.75 -0.70 -0.07 -1.00 0.00 0.00 0.00 179.25 178.23 3dak h PRO 38 N -0.91 0.00 0.00 0.00 0.13 -1.95 -2.47 132.00 126.80 3dak h PRO 38 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 3dak h PRO 38 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 3dak h PRO 38 CO 0.10 0.07 -0.75 1.63 -0.23 0.00 0.00 178.00 178.82 3dak n LYS 39 N -3.53 0.01 -3.89 0.86 4.76 -1.20 -4.99 118.16 110.18 3dak n LYS 39 Ca -0.02 -0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.16 3dak n LYS 39 Cb 0.19 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 3dak n LYS 39 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3dak n LYS 40 N -1.52 -4.10 -3.86 1.97 5.02 -0.16 -4.98 118.16 110.53 3dak n LYS 40 Ca 0.05 0.50 -0.12 0.00 -2.02 0.00 0.00 58.31 56.72 3dak n LYS 40 Cb 0.34 -4.92 -0.12 0.00 -0.02 0.00 0.00 35.03 30.30 3dak n LYS 40 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3dak s GLU 41 N -6.42 0.23 -0.28 1.97 2.12 -0.99 -5.00 118.70 110.33 3dak s GLU 41 Ca 0.16 -0.04 -0.27 0.00 0.36 0.00 0.00 54.97 55.18 3dak s GLU 41 Cb -0.09 0.10 0.01 0.00 0.26 0.00 0.00 34.13 34.41 3dak s GLU 41 CO 0.86 -0.04 0.98 0.21 -0.54 0.00 0.00 175.26 176.73 3dak s LYS 42 N -0.40 4.12 0.40 4.30 2.20 -1.26 0.11 119.74 129.21 3dak s LYS 42 Ca -0.05 1.05 0.08 0.00 -0.36 0.00 0.00 55.97 56.69 3dak s LYS 42 Cb -0.03 -3.69 -0.05 0.00 -1.51 0.00 0.00 37.83 32.55 3dak s LYS 42 CO 0.00 -0.72 0.19 0.14 -0.36 0.00 0.00 175.35 174.60 3dak s VAL 43 N 3.27 2.45 -0.13 4.02 -7.23 0.29 -4.37 120.40 118.70 3dak s VAL 43 Ca 0.41 -1.67 -0.06 0.00 -1.81 0.00 0.00 61.98 58.85 3dak s VAL 43 Cb -0.14 -2.99 -0.04 0.00 0.56 0.00 0.00 36.38 33.78 3dak s VAL 43 CO 0.11 -0.03 0.08 0.00 -0.31 0.00 0.00 175.10 174.95 3dak s ALA 44 N -2.56 3.60 -0.15 1.32 0.00 -0.90 0.04 121.76 123.11 3dak s ALA 44 Ca 0.41 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.67 3dak s ALA 44 Cb 0.02 -1.83 0.02 0.00 0.00 0.00 0.00 23.12 21.33 3dak s ALA 44 CO 0.23 0.50 -0.19 0.42 0.00 0.00 0.00 175.76 176.72 3dak s ILE 45 N -0.63 1.85 -0.34 0.00 1.01 0.60 -1.26 121.20 122.43 3dak s ILE 45 Ca 0.12 -0.83 -0.19 0.00 0.00 0.00 0.00 60.65 59.75 3dak s ILE 45 Cb -0.12 -1.67 -0.00 0.00 0.01 0.00 0.00 42.46 40.67 3dak s ILE 45 CO 0.02 0.51 0.55 -0.75 0.00 0.00 0.00 174.94 175.27 3dak s LYS 46 N 1.12 3.69 -0.39 2.79 2.20 -0.48 -1.08 119.74 127.58 3dak s LYS 46 Ca -0.01 -0.05 -0.16 0.00 -0.36 0.00 0.00 55.97 55.39 3dak s LYS 46 Cb -0.14 -3.79 0.01 0.00 -1.51 0.00 0.00 37.83 32.40 3dak s LYS 46 CO -0.07 -0.63 0.39 1.03 -0.36 0.00 0.00 175.35 175.71 3dak s ARG 47 N 2.47 3.26 -0.24 4.03 0.52 0.52 -1.01 118.95 128.50 3dak s ARG 47 Ca 0.20 -0.65 -0.07 0.00 -0.52 0.00 0.00 55.73 54.69 3dak s ARG 47 Cb -0.15 -3.91 -0.03 0.00 0.52 0.00 0.00 34.95 31.39 3dak s ARG 47 CO 0.13 -0.72 0.05 0.42 0.02 0.00 0.00 175.30 175.21 3dak s ILE 48 N 2.05 4.20 -0.61 1.52 1.01 0.44 -1.96 121.20 127.84 3dak s ILE 48 Ca 0.11 -0.21 -0.28 0.00 0.00 0.00 0.00 60.65 60.27 3dak s ILE 48 Cb -0.17 -2.95 0.02 0.00 0.01 0.00 0.00 42.46 39.36 3dak s ILE 48 CO 0.12 0.35 1.39 0.21 0.00 0.00 0.00 174.94 177.02 3dak s ASN 49 N 1.57 6.11 0.26 3.58 3.84 -0.48 -0.82 114.94 129.01 3dak s ASN 49 Ca 0.06 0.10 -0.04 0.00 0.21 0.00 0.00 52.86 53.19 3dak s ASN 49 Cb -0.15 -2.55 0.32 0.00 -0.55 0.00 0.00 41.25 38.32 3dak s ASN 49 CO 0.03 -1.76 1.88 -0.07 -2.79 0.00 0.00 177.10 174.39 3dak h LEU 50 N 13.18 1.00 0.92 3.21 3.38 -1.77 0.17 115.31 135.40 3dak h LEU 50 Ca -0.27 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.57 3dak h LEU 50 Cb 1.08 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.59 3dak h LEU 50 CO 1.21 0.81 -0.44 -0.33 0.09 0.00 0.00 178.44 179.78 3dak h GLU 51 N 1.12 -1.19 -1.00 1.13 5.08 -1.79 -2.09 114.58 115.84 3dak h GLU 51 Ca 0.28 0.08 0.19 0.00 -1.00 0.00 0.00 59.36 58.91 3dak h GLU 51 Cb 0.05 0.27 -0.10 0.00 0.50 0.00 0.00 28.75 29.46 3dak h GLU 51 CO -0.04 -0.79 0.61 0.87 -1.00 0.00 0.00 179.01 178.66 3dak h LYS 52 N -1.27 0.72 -0.00 2.33 1.57 -1.86 -0.06 116.57 118.00 3dak h LYS 52 Ca -0.13 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3dak h LYS 52 Cb 0.95 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.09 3dak h LYS 52 CO 0.21 0.48 0.00 0.00 -0.57 0.00 0.00 179.45 179.57 3dak n GLN 54 N -0.95 -4.59 -4.43 0.00 6.02 -0.04 -4.97 117.38 108.43 3dak n GLN 54 Ca 0.24 0.77 -0.28 0.00 -0.01 0.00 0.00 57.00 57.72 3dak n GLN 54 Cb 0.12 -5.60 -0.07 0.00 1.02 0.00 0.00 30.24 25.72 3dak n GLN 54 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 3dak n THR 55 N -4.36 0.00 -3.88 5.09 5.66 -0.84 -5.06 114.28 110.89 3dak n THR 55 Ca -0.08 -2.27 -0.09 0.00 -3.05 0.00 0.00 64.05 58.57 3dak n THR 55 Cb 0.59 0.61 -0.07 0.00 -1.55 0.00 0.00 70.33 69.91 3dak n THR 55 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 3dak s SER 56 N -3.53 0.11 0.52 1.09 1.04 -1.26 -4.49 113.70 107.17 3dak s SER 56 Ca 0.08 -0.69 0.23 0.00 0.48 0.00 0.00 55.95 56.05 3dak s SER 56 Cb 0.00 0.35 1.35 0.00 0.10 0.00 0.00 66.02 67.82 3dak s SER 56 CO 0.06 -0.75 2.02 0.24 0.98 0.00 0.00 173.24 175.79 3dak h MET 57 N 2.72 0.03 -0.29 4.02 2.86 -1.97 -1.65 114.93 120.65 3dak h MET 57 Ca -0.34 -0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.27 3dak h MET 57 Cb 1.20 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.84 3dak h MET 57 CO 0.55 0.02 0.06 -0.44 1.06 0.00 0.00 176.91 178.16 3dak h ASP 58 N 0.03 0.45 0.34 1.22 3.32 -2.02 -2.62 116.42 117.15 3dak h ASP 58 Ca 0.21 -0.24 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 3dak h ASP 58 Cb 0.80 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 3dak h ASP 58 CO -0.01 0.58 -0.22 -0.08 -1.72 0.00 0.00 179.24 177.79 3dak h GLU 59 N 0.31 0.00 -0.01 3.56 4.81 -1.73 -3.24 114.58 118.28 3dak h GLU 59 Ca 0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3dak h GLU 59 Cb 0.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.69 3dak h GLU 59 CO 0.00 0.22 -0.43 1.28 -0.73 0.00 0.00 179.01 179.35 3dak n LEU 60 N -3.96 1.03 -0.19 1.64 4.77 -0.92 -4.52 117.00 114.85 3dak n LEU 60 Ca -0.02 -0.29 -0.05 0.00 -0.03 0.00 0.00 56.01 55.62 3dak n LEU 60 Cb 0.30 -0.13 0.12 0.00 -2.33 0.00 0.00 43.42 41.38 3dak n LEU 60 CO 0.35 0.21 0.94 -0.07 -1.33 0.00 0.00 177.39 177.49 3dak h LEU 61 N 0.94 0.92 -1.02 2.23 3.38 -1.50 -1.70 115.31 118.56 3dak h LEU 61 Ca 0.00 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.68 3dak h LEU 61 Cb 0.54 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3dak h LEU 61 CO 0.00 0.91 -0.49 0.11 0.09 0.00 0.00 178.44 179.06 3dak h LYS 62 N 0.93 0.00 -0.16 1.13 1.57 -1.84 -0.90 116.57 117.30 3dak h LYS 62 Ca 0.19 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 3dak h LYS 62 Cb 0.36 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3dak h LYS 62 CO 0.00 0.49 0.04 0.93 -0.57 0.00 0.00 179.45 180.34 3dak h GLU 63 N 0.00 0.25 -0.59 3.15 4.39 -1.68 -2.37 114.58 117.72 3dak h GLU 63 Ca -0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 3dak h GLU 63 Cb 0.86 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.45 3dak h GLU 63 CO 0.06 0.40 0.37 0.82 -1.16 0.00 0.00 179.01 179.50 3dak h ILE 64 N 0.06 1.17 -0.65 3.13 2.04 -1.16 -1.50 117.51 120.61 3dak h ILE 64 Ca 0.05 -0.35 0.05 0.00 1.00 0.00 0.00 64.86 65.61 3dak h ILE 64 Cb 0.26 0.33 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 3dak h ILE 64 CO 0.00 0.17 0.37 1.56 0.00 0.00 0.00 178.15 180.25 3dak h GLN 65 N 0.80 0.67 -0.57 2.37 4.20 -1.17 -0.74 115.11 120.67 3dak h GLN 65 Ca 0.21 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 3dak h GLN 65 Cb -0.05 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.55 3dak h GLN 65 CO -0.04 0.44 0.27 0.00 -0.67 0.00 0.00 178.83 178.83 3dak h ALA 66 N 1.32 0.74 -0.93 3.87 0.00 -1.20 -2.55 119.26 120.52 3dak h ALA 66 Ca 0.28 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.08 3dak h ALA 66 Cb 0.14 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 3dak h ALA 66 CO -0.16 0.32 0.61 0.52 0.00 0.00 0.00 179.25 180.54 3dak h MET 67 N 0.78 1.17 0.00 0.00 2.86 -0.72 -0.59 114.93 118.44 3dak h MET 67 Ca 0.20 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3dak h MET 67 Cb 0.14 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 31.53 3dak h MET 67 CO -0.02 0.78 0.00 -1.13 1.06 0.00 0.00 176.91 177.59 3dak n SER 68 N -4.47 0.00 -0.08 1.22 3.41 -0.33 -3.21 113.62 110.15 3dak n SER 68 Ca 0.11 0.42 -0.07 0.00 -0.26 0.00 0.00 58.87 59.08 3dak n SER 68 Cb 0.06 -0.47 -0.16 0.00 -0.26 0.00 0.00 64.21 63.38 3dak n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dak n GLN 69 N -1.47 0.68 -3.28 4.33 6.02 -0.81 -4.90 117.38 117.95 3dak n GLN 69 Ca 0.07 -0.03 -0.46 0.00 -0.01 0.00 0.00 57.00 56.56 3dak n GLN 69 Cb 0.27 -1.53 -0.03 0.00 1.02 0.00 0.00 30.24 29.98 3dak n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dak s HIS 71 N 0.86 2.30 -0.12 0.00 3.76 -1.26 -4.90 115.29 115.93 3dak s HIS 71 Ca 0.15 -0.91 -0.30 0.00 -0.15 0.00 0.00 55.06 53.85 3dak s HIS 71 Cb -0.15 -1.56 0.09 0.00 1.11 0.00 0.00 32.58 32.06 3dak s HIS 71 CO -0.05 -0.38 0.78 -1.58 -0.85 0.00 0.00 174.74 172.66 3dak s HIS 72 N 0.38 -0.60 0.51 1.40 5.04 -1.26 -5.04 115.29 115.71 3dak s HIS 72 Ca -0.17 1.14 0.40 0.00 -1.54 0.00 0.00 55.06 54.89 3dak s HIS 72 Cb -0.17 0.40 2.09 0.00 0.04 0.00 0.00 32.58 34.93 3dak s HIS 72 CO 0.08 -0.49 2.26 -1.00 -2.34 0.00 0.00 174.74 173.24 3dak h PRO 73 N 3.27 0.00 -0.57 2.88 0.13 -1.99 -2.48 132.00 133.24 3dak h PRO 73 Ca -0.25 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.86 3dak h PRO 73 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 3dak h PRO 73 CO 0.30 0.01 0.02 0.09 -0.23 0.00 0.00 178.00 178.19 3dak n ASN 74 N -3.15 5.62 -4.03 1.44 4.13 -1.26 -4.75 115.26 113.27 3dak n ASN 74 Ca -0.02 -2.96 -0.26 0.00 1.68 0.00 0.00 54.58 53.02 3dak n ASN 74 Cb 0.14 -0.69 -0.17 0.00 -1.54 0.00 0.00 39.78 37.53 3dak n ASN 74 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3dak s ILE 75 N -2.80 1.22 0.20 2.41 1.01 -0.93 -0.81 121.20 121.49 3dak s ILE 75 Ca 0.54 -0.51 -0.33 0.00 0.00 0.00 0.00 60.65 60.36 3dak s ILE 75 Cb 0.42 -1.12 -0.14 0.00 0.01 0.00 0.00 42.46 41.63 3dak s ILE 75 CO 0.15 0.38 1.45 0.52 0.00 0.00 0.00 174.94 177.44 3dak n VAL 76 N 3.96 0.53 -1.88 2.92 0.31 -0.32 -4.57 118.33 119.28 3dak n VAL 76 Ca -0.21 -0.13 -0.42 0.00 -0.01 0.00 0.00 64.34 63.56 3dak n VAL 76 Cb 0.52 -1.41 -0.03 0.00 -0.91 0.00 0.00 33.84 32.01 3dak n VAL 76 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3dak s SER 77 N 0.51 6.58 -0.14 4.52 0.01 -1.26 -4.91 113.70 119.01 3dak s SER 77 Ca 0.73 2.41 -0.21 0.00 1.31 0.00 0.00 55.95 60.20 3dak s SER 77 Cb -0.69 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 62.97 3dak s SER 77 CO 0.45 -0.97 0.62 -0.47 0.41 0.00 0.00 173.24 173.28 3dak s TYR 78 N 4.06 3.47 -0.21 2.43 5.04 -1.26 -1.33 117.35 129.55 3dak s TYR 78 Ca 0.79 1.02 -0.16 0.00 -2.44 0.00 0.00 57.07 56.28 3dak s TYR 78 Cb -0.37 -2.74 -0.09 0.00 0.35 0.00 0.00 41.96 39.11 3dak s TYR 78 CO 0.34 -0.01 -0.28 0.66 -1.34 0.00 0.00 175.55 174.92 3dak n TYR 79 N 4.33 0.22 -3.80 4.97 4.01 0.14 -4.97 117.16 122.06 3dak n TYR 79 Ca -0.03 0.10 -0.04 0.00 -0.16 0.00 0.00 57.90 57.77 3dak n TYR 79 Cb 0.51 -0.76 0.02 0.00 -0.31 0.00 0.00 39.34 38.80 3dak n TYR 79 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 3dak n THR 80 N -4.41 0.00 -3.63 -0.72 5.66 -1.05 -4.85 114.28 105.28 3dak n THR 80 Ca -0.28 -0.59 -0.14 0.00 -3.05 0.00 0.00 64.05 60.00 3dak n THR 80 Cb 0.62 0.72 -0.06 0.00 -1.55 0.00 0.00 70.33 70.06 3dak n THR 80 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 3dak s SER 81 N -3.04 -0.36 -0.01 1.09 1.04 -1.26 -0.61 113.70 110.56 3dak s SER 81 Ca 0.18 0.12 -0.28 0.00 0.48 0.00 0.00 55.95 56.45 3dak s SER 81 Cb -0.03 0.45 0.09 0.00 0.10 0.00 0.00 66.02 66.63 3dak s SER 81 CO 0.06 -0.66 0.79 0.72 0.98 0.00 0.00 173.24 175.13 3dak s PHE 82 N -2.27 -0.48 -0.05 5.02 -0.71 -0.82 -4.98 117.98 113.69 3dak s PHE 82 Ca -0.06 0.58 -0.22 0.00 -1.04 0.00 0.00 56.93 56.18 3dak s PHE 82 Cb -0.01 0.49 -0.04 0.00 -1.21 0.00 0.00 43.02 42.25 3dak s PHE 82 CO -0.01 -0.59 0.64 0.08 -1.34 0.00 0.00 175.22 174.01 3dak s VAL 83 N -2.32 5.01 -0.30 -2.49 1.01 -1.26 -0.68 120.40 119.38 3dak s VAL 83 Ca -0.02 1.33 0.01 0.00 0.00 0.00 0.00 61.98 63.30 3dak s VAL 83 Cb -0.01 -3.98 0.06 0.00 0.00 0.00 0.00 36.38 32.46 3dak s VAL 83 CO -0.03 0.31 -0.02 -0.69 0.00 0.00 0.00 175.10 174.67 3dak s VAL 84 N 0.47 2.60 0.00 2.92 1.01 -0.20 -4.96 120.40 122.24 3dak s VAL 84 Ca 0.34 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.67 3dak s VAL 84 Cb -0.18 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.62 3dak s VAL 84 CO 0.17 -0.18 0.00 0.29 0.00 0.00 0.00 175.10 175.38 3dak n LYS 85 N 4.50 0.00 -0.04 2.72 5.02 -1.26 -1.26 118.16 127.84 3dak n LYS 85 Ca -0.11 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.24 3dak n LYS 85 Cb 0.42 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.50 3dak n LYS 85 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3dak n ASP 86 N 7.47 2.11 -4.71 4.39 5.68 -1.26 -4.99 116.55 125.25 3dak n ASP 86 Ca 0.00 -1.57 -0.30 0.00 -0.50 0.00 0.00 54.79 52.42 3dak n ASP 86 Cb 0.00 -0.05 -0.08 0.00 -1.14 0.00 0.00 41.12 39.86 3dak n ASP 86 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 3dak s GLU 87 N -0.92 2.62 -0.18 0.11 2.02 -0.39 -2.19 118.70 119.76 3dak s GLU 87 Ca 0.15 -0.81 -0.11 0.00 0.02 0.00 0.00 54.97 54.22 3dak s GLU 87 Cb 0.10 -2.58 -0.05 0.00 0.10 0.00 0.00 34.13 31.70 3dak s GLU 87 CO 0.14 0.54 0.18 -1.17 0.02 0.00 0.00 175.26 174.97 3dak s LEU 88 N -2.34 4.24 -0.26 1.80 2.96 0.00 -1.04 118.68 124.04 3dak s LEU 88 Ca 0.27 0.33 -0.09 0.00 -0.22 0.00 0.00 54.13 54.42 3dak s LEU 88 Cb -0.12 -2.17 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 3dak s LEU 88 CO 0.19 0.18 0.12 0.26 -1.32 0.00 0.00 176.35 175.78 3dak s TRP 89 N 0.25 3.16 -0.30 5.38 0.52 0.14 -0.42 118.94 127.67 3dak s TRP 89 Ca 0.11 -0.15 -0.11 0.00 0.02 0.00 0.00 56.10 55.98 3dak s TRP 89 Cb -0.12 -2.29 -0.02 0.00 -1.15 0.00 0.00 33.47 29.89 3dak s TRP 89 CO 0.00 -0.23 0.18 -0.51 0.02 0.00 0.00 176.95 176.41 3dak s LEU 90 N 1.57 4.12 -0.22 2.99 1.43 -0.18 -1.94 118.68 126.46 3dak s LEU 90 Ca 0.06 -0.34 -0.09 0.00 -1.03 0.00 0.00 54.13 52.74 3dak s LEU 90 Cb -0.15 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 43.96 3dak s LEU 90 CO 0.06 -0.15 0.12 -0.69 0.23 0.00 0.00 176.35 175.92 3dak s VAL 91 N 1.68 5.12 0.20 -1.59 1.01 0.22 -1.38 120.40 125.66 3dak s VAL 91 Ca 0.06 0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.04 3dak s VAL 91 Cb -0.17 -3.36 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 3dak s VAL 91 CO 0.08 0.39 0.33 0.00 0.00 0.00 0.00 175.10 175.90 3dak s MET 92 N 0.78 1.29 0.34 2.72 0.00 -0.39 0.29 119.30 124.32 3dak s MET 92 Ca 0.06 -1.26 -0.29 0.00 0.00 0.00 0.00 55.69 54.21 3dak s MET 92 Cb -0.13 0.39 -0.10 0.00 0.00 0.00 0.00 34.83 34.99 3dak s MET 92 CO 0.02 -0.49 1.37 0.21 0.00 0.00 0.00 175.02 176.13 3dak s LYS 93 N -4.01 4.28 -0.26 3.16 2.20 -0.44 -2.13 119.74 122.54 3dak s LYS 93 Ca 0.22 2.32 -0.26 0.00 -0.36 0.00 0.00 55.97 57.89 3dak s LYS 93 Cb 0.03 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.30 3dak s LYS 93 CO 0.05 -0.30 0.90 -1.17 -0.36 0.00 0.00 175.35 174.47 3dak s LEU 94 N -1.79 4.07 -0.58 5.43 2.96 -1.26 -4.48 118.68 123.03 3dak s LEU 94 Ca 0.51 1.05 -0.05 0.00 -0.22 0.00 0.00 54.13 55.42 3dak s LEU 94 Cb -0.42 -3.29 0.15 0.00 0.50 0.00 0.00 46.19 43.13 3dak s LEU 94 CO 0.55 -0.62 0.40 -0.76 -1.32 0.00 0.00 176.35 174.61 3dak s LEU 95 N 3.05 5.43 0.33 -0.68 2.01 -1.26 -4.94 118.68 122.62 3dak s LEU 95 Ca 0.38 -2.54 0.13 0.00 0.01 0.00 0.00 54.13 52.10 3dak s LEU 95 Cb -0.15 -1.90 0.58 0.00 0.01 0.00 0.00 46.19 44.74 3dak s LEU 95 CO 0.09 -0.47 1.73 0.77 1.01 0.00 0.00 176.35 179.49 3dak h SER 96 N 7.49 0.00 0.00 2.29 4.64 -1.95 -2.50 113.55 123.53 3dak h SER 96 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3dak h SER 96 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 3dak h SER 96 CO 0.73 0.47 0.29 1.23 -0.87 0.00 0.00 176.83 178.68 3dak h GLY 97 N 1.53 0.00 0.00 -0.77 0.00 -1.91 -3.48 103.07 98.45 3dak h GLY 97 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3dak h GLY 97 CO 0.06 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.21 3dak n GLY 98 N -1.27 -0.19 3.71 4.60 0.00 -0.94 -4.71 105.19 106.38 3dak n GLY 98 Ca -0.01 -1.02 -0.23 0.00 0.00 0.00 0.00 46.02 44.76 3dak n GLY 98 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dak s SER 99 N -4.00 4.56 0.43 1.61 1.04 -1.26 -0.04 113.70 116.04 3dak s SER 99 Ca 0.00 -0.83 0.12 0.00 0.48 0.00 0.00 55.95 55.72 3dak s SER 99 Cb 0.00 -0.67 1.00 0.00 0.10 0.00 0.00 66.02 66.44 3dak s SER 99 CO 0.00 -0.29 2.00 0.58 0.98 0.00 0.00 173.24 176.51 3dak h VAL 100 N 1.60 0.95 -0.28 5.02 2.07 -1.09 -2.79 116.25 121.73 3dak h VAL 100 Ca -0.43 -0.15 -0.13 0.00 0.82 0.00 0.00 66.70 66.81 3dak h VAL 100 Cb 1.25 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 3dak h VAL 100 CO 0.64 0.08 -0.37 0.25 0.02 0.00 0.00 177.57 178.20 3dak h LEU 101 N 0.43 0.67 -0.88 2.57 5.85 -1.81 -1.90 115.31 120.24 3dak h LEU 101 Ca 0.24 -0.29 0.17 0.00 0.84 0.00 0.00 57.88 58.84 3dak h LEU 101 Cb 0.38 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 41.12 3dak h LEU 101 CO -0.06 0.98 0.46 0.44 -0.34 0.00 0.00 178.44 179.91 3dak h ASP 102 N 0.54 0.53 -0.19 1.25 3.32 -1.84 0.32 116.42 120.35 3dak h ASP 102 Ca 0.05 0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 3dak h ASP 102 Cb 0.88 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.45 3dak h ASP 102 CO 0.08 0.18 0.00 0.40 -1.72 0.00 0.00 179.24 178.18 3dak h ILE 103 N 0.60 1.25 -0.36 0.35 2.04 -1.37 -1.94 117.51 118.09 3dak h ILE 103 Ca 0.50 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.55 3dak h ILE 103 Cb 0.78 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 3dak h ILE 103 CO -0.40 0.26 0.14 0.40 0.00 0.00 0.00 178.15 178.55 3dak h ILE 104 N 0.09 0.92 -0.51 -0.67 2.04 -1.04 -1.26 117.51 117.09 3dak h ILE 104 Ca 0.05 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 3dak h ILE 104 Cb 0.38 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 3dak h ILE 104 CO 0.01 0.05 0.28 0.11 0.00 0.00 0.00 178.15 178.60 3dak h LYS 105 N 0.30 0.69 -0.24 2.37 1.57 -0.88 -0.75 116.57 119.62 3dak h LYS 105 Ca 0.16 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.76 3dak h LYS 105 Cb 0.12 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 3dak h LYS 105 CO -0.15 0.51 -0.28 1.25 -0.57 0.00 0.00 179.45 180.21 3dak h HIS 106 N 0.70 0.76 -0.66 -1.35 2.76 -0.97 -0.83 115.15 115.57 3dak h HIS 106 Ca 0.18 -0.24 -0.05 0.00 -2.20 0.00 0.00 60.37 58.07 3dak h HIS 106 Cb 0.02 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 28.80 3dak h HIS 106 CO 0.00 0.96 0.23 0.82 -1.30 0.00 0.00 177.93 178.65 3dak h ILE 107 N 0.33 1.25 -0.47 6.26 2.04 -0.90 -1.64 117.51 124.38 3dak h ILE 107 Ca 0.03 -0.82 -0.14 0.00 1.00 0.00 0.00 64.86 64.94 3dak h ILE 107 Cb 0.86 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 3dak h ILE 107 CO 0.07 0.32 -0.24 0.58 0.00 0.00 0.00 178.15 178.88 3dak h VAL 108 N 0.95 1.27 -0.04 1.67 2.07 -1.09 -1.20 116.25 119.87 3dak h VAL 108 Ca 0.22 -1.41 -0.07 0.00 0.82 0.00 0.00 66.70 66.26 3dak h VAL 108 Cb 0.26 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3dak h VAL 108 CO -0.01 0.48 -0.29 0.00 0.02 0.00 0.00 177.57 177.78 3dak h ALA 109 N 0.87 1.44 0.00 1.67 0.00 -1.05 -2.22 119.26 119.97 3dak h ALA 109 Ca 0.10 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3dak h ALA 109 Cb 0.82 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3dak h ALA 109 CO 0.07 0.41 0.00 1.63 0.00 0.00 0.00 179.25 181.36 3dak n LYS 110 N -4.17 0.25 -0.83 0.00 5.02 -0.63 -4.92 118.16 112.88 3dak n LYS 110 Ca -0.02 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 3dak n LYS 110 Cb 0.35 -1.84 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 3dak n LYS 110 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dak n GLY 111 N 0.88 0.53 1.97 0.72 0.00 -0.84 -4.96 105.19 103.49 3dak n GLY 111 Ca 0.04 -0.50 -0.02 0.00 0.00 0.00 0.00 46.02 45.54 3dak n GLY 111 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dak n GLU 112 N -2.83 4.06 0.00 1.61 1.02 -0.48 -4.26 120.64 119.77 3dak n GLU 112 Ca 0.00 -3.05 0.05 0.00 -0.02 0.00 0.00 57.16 54.14 3dak n GLU 112 Cb 0.00 -2.23 -0.05 0.00 -0.02 0.00 0.00 31.44 29.14 3dak n GLU 112 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 3dak n HIS 113 N 0.10 0.00 -1.83 -0.32 1.44 -1.25 -4.80 115.22 108.56 3dak n HIS 113 Ca 0.37 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.68 3dak n HIS 113 Cb 1.33 0.00 0.01 0.00 0.12 0.00 0.00 29.99 31.45 3dak n HIS 113 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 3dak s LYS 114 N -1.92 3.74 0.00 -1.40 1.02 -1.26 -0.70 119.74 119.21 3dak s LYS 114 Ca 0.05 2.40 0.00 0.00 0.02 0.00 0.00 55.97 58.44 3dak s LYS 114 Cb 0.08 -2.68 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 3dak s LYS 114 CO 0.41 -0.77 0.00 -1.13 -0.92 0.00 0.00 175.35 172.95 3dak n SER 115 N -0.12 -4.81 0.00 2.83 3.41 -1.26 -4.87 113.62 108.80 3dak n SER 115 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 3dak n SER 115 Cb 0.42 -3.13 0.00 0.00 -0.26 0.00 0.00 64.21 61.24 3dak n SER 115 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dak n GLY 116 N 0.26 3.46 0.00 5.00 0.00 0.12 -4.48 105.19 109.56 3dak n GLY 116 Ca 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.14 3dak n GLY 116 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3dak n VAL 117 N -1.26 0.00 -3.35 1.61 0.31 0.29 -4.18 118.33 111.76 3dak n VAL 117 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.98 3dak n VAL 117 Cb 0.00 -0.37 -0.06 0.00 -0.91 0.00 0.00 33.84 32.50 3dak n VAL 117 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3dak s LEU 118 N -0.43 4.34 0.85 7.52 1.43 -0.79 -4.96 118.68 126.64 3dak s LEU 118 Ca 0.00 1.09 -0.11 0.00 -1.03 0.00 0.00 54.13 54.08 3dak s LEU 118 Cb 0.00 -3.27 0.10 0.00 0.03 0.00 0.00 46.19 43.05 3dak s LEU 118 CO 0.00 0.10 1.09 1.51 0.23 0.00 0.00 176.35 179.29 3dak s ASP 119 N -1.70 3.87 0.24 2.29 1.47 -1.26 -4.71 116.67 116.87 3dak s ASP 119 Ca 0.38 1.51 -0.06 0.00 1.18 0.00 0.00 52.55 55.56 3dak s ASP 119 Cb -0.15 -2.21 0.43 0.00 -0.34 0.00 0.00 42.92 40.65 3dak s ASP 119 CO 0.19 -2.39 1.70 -0.33 0.68 0.00 0.00 175.17 175.02 3dak h GLU 120 N -1.38 0.29 -0.06 2.11 5.08 -1.98 -1.01 114.58 117.63 3dak h GLU 120 Ca -0.48 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 57.73 3dak h GLU 120 Cb 1.27 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 3dak h GLU 120 CO 0.55 0.19 -0.56 0.66 -1.00 0.00 0.00 179.01 178.85 3dak h SER 121 N 0.30 0.21 0.58 1.42 4.64 -1.94 -1.25 113.55 117.52 3dak h SER 121 Ca 0.40 -0.11 -0.25 0.00 -0.47 0.00 0.00 61.79 61.36 3dak h SER 121 Cb 0.65 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3dak h SER 121 CO -0.47 0.73 -1.11 0.71 -0.87 0.00 0.00 176.83 175.82 3dak h THR 122 N 0.15 1.49 -0.77 2.95 1.35 -1.71 -1.63 112.91 114.73 3dak h THR 122 Ca -0.00 -2.88 0.02 0.00 -0.55 0.00 0.00 66.41 63.00 3dak h THR 122 Cb 1.03 2.75 -0.04 0.00 -1.73 0.00 0.00 68.15 70.16 3dak h THR 122 CO 0.08 0.84 0.50 0.40 -0.25 0.00 0.00 175.52 177.10 3dak h ILE 123 N 0.11 1.15 -0.45 6.82 2.04 -1.18 -2.34 117.51 123.66 3dak h ILE 123 Ca -0.10 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 3dak h ILE 123 Cb 1.80 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 3dak h ILE 123 CO 0.18 0.18 0.24 0.00 0.00 0.00 0.00 178.15 178.75 3dak h ALA 124 N 1.31 0.58 -0.01 1.87 0.00 -1.11 -0.61 119.26 121.29 3dak h ALA 124 Ca 0.30 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 3dak h ALA 124 Cb -0.04 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3dak h ALA 124 CO -0.09 0.11 0.00 1.15 0.00 0.00 0.00 179.25 180.42 3dak h THR 125 N 0.59 1.11 -0.23 0.00 2.02 -1.21 -2.35 112.91 112.84 3dak h THR 125 Ca 0.16 -0.32 -0.04 0.00 0.77 0.00 0.00 66.41 66.98 3dak h THR 125 Cb 0.07 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 3dak h THR 125 CO -0.02 0.08 -0.01 0.40 0.37 0.00 0.00 175.52 176.34 3dak h ILE 126 N -0.12 1.26 -0.01 3.11 2.04 -1.35 -3.14 117.51 119.30 3dak h ILE 126 Ca 0.00 -0.92 -0.18 0.00 1.00 0.00 0.00 64.86 64.77 3dak h ILE 126 Cb 0.13 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 3dak h ILE 126 CO -0.00 0.28 -0.80 -0.07 0.00 0.00 0.00 178.15 177.57 3dak h LEU 127 N 0.18 0.21 -0.70 1.44 3.38 -1.12 -1.70 115.31 117.01 3dak h LEU 127 Ca 0.07 -0.16 0.11 0.00 0.09 0.00 0.00 57.88 57.99 3dak h LEU 127 Cb 0.42 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.03 3dak h LEU 127 CO 0.01 0.92 0.30 -0.09 0.09 0.00 0.00 178.44 179.67 3dak h ARG 128 N 0.10 0.48 -0.60 1.13 2.43 -1.50 0.50 114.38 116.92 3dak h ARG 128 Ca -0.03 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 3dak h ARG 128 Cb 1.39 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.81 3dak h ARG 128 CO 0.12 0.32 -0.03 0.93 -1.51 0.00 0.00 179.97 179.80 3dak h GLU 129 N 0.50 1.07 -0.29 0.20 4.39 -1.32 -0.95 114.58 118.18 3dak h GLU 129 Ca 0.36 -0.35 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 3dak h GLU 129 Cb 0.46 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 3dak h GLU 129 CO -0.32 1.06 0.15 0.28 -1.16 0.00 0.00 179.01 179.02 3dak h VAL 130 N 0.97 1.14 -0.78 3.13 2.07 -0.72 -2.71 116.25 119.36 3dak h VAL 130 Ca 0.17 -0.38 0.04 0.00 0.82 0.00 0.00 66.70 67.34 3dak h VAL 130 Cb 0.59 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 3dak h VAL 130 CO 0.04 0.14 0.49 -0.07 0.02 0.00 0.00 177.57 178.18 3dak h LEU 131 N 0.34 0.80 -0.49 2.57 3.38 0.29 0.06 115.31 122.26 3dak h LEU 131 Ca 0.10 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.17 3dak h LEU 131 Cb 0.09 -0.17 -0.09 0.00 0.09 0.00 0.00 40.66 40.58 3dak h LEU 131 CO -0.01 0.55 -0.07 -0.33 0.09 0.00 0.00 178.44 178.66 3dak h GLU 132 N 0.95 0.04 -0.38 1.13 4.39 -1.13 -0.01 114.58 119.56 3dak h GLU 132 Ca 0.31 -0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.93 3dak h GLU 132 Cb 0.04 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 3dak h GLU 132 CO -0.12 0.03 -0.12 0.78 -1.16 0.00 0.00 179.01 178.42 3dak h GLY 133 N 0.04 0.73 0.67 -3.84 0.00 -0.94 -1.85 103.07 97.88 3dak h GLY 133 Ca 0.24 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 3dak h GLY 133 CO -0.47 0.49 -0.10 1.41 0.00 0.00 0.00 176.54 177.87 3dak h LEU 134 N 0.61 -0.24 -0.82 3.11 3.38 -0.67 -2.17 115.31 118.52 3dak h LEU 134 Ca 0.11 -0.22 0.16 0.00 0.09 0.00 0.00 57.88 58.02 3dak h LEU 134 Cb 0.56 0.06 -0.16 0.00 0.09 0.00 0.00 40.66 41.22 3dak h LEU 134 CO 0.04 0.11 -0.22 -0.33 0.09 0.00 0.00 178.44 178.13 3dak h GLU 135 N -0.62 -0.01 -0.46 1.13 5.08 -1.01 0.34 114.58 119.04 3dak h GLU 135 Ca -0.03 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 3dak h GLU 135 Cb 0.45 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 3dak h GLU 135 CO 0.05 -0.00 0.22 -0.92 -1.00 0.00 0.00 179.01 177.36 3dak h TYR 136 N -0.01 0.41 -0.38 4.33 3.20 -1.22 -1.86 116.97 121.44 3dak h TYR 136 Ca 0.39 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.23 3dak h TYR 136 Cb 0.60 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 3dak h TYR 136 CO -0.66 0.20 0.06 -0.07 -1.64 0.00 0.00 178.16 176.05 3dak h LEU 137 N 0.44 0.60 -0.02 2.82 3.38 -0.50 -3.07 115.31 118.95 3dak h LEU 137 Ca 0.20 -0.26 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 3dak h LEU 137 Cb 0.13 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 40.73 3dak h LEU 137 CO -0.15 0.71 -0.52 0.45 0.09 0.00 0.00 178.44 179.02 3dak h HIS 138 N 0.47 0.57 0.00 1.13 3.86 -0.18 0.39 115.15 121.40 3dak h HIS 138 Ca 0.11 -0.29 0.00 0.00 -1.16 0.00 0.00 60.37 59.03 3dak h HIS 138 Cb 0.37 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.77 3dak h HIS 138 CO 0.03 1.10 0.00 1.57 0.86 0.00 0.00 177.93 181.48 3dak h LYS 139 N -0.11 0.00 -0.34 2.45 2.10 -1.45 0.06 116.57 119.27 3dak h LYS 139 Ca -0.06 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 3dak h LYS 139 Cb 1.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 3dak h LYS 139 CO 0.10 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.64 3dak n ASN 140 N -2.65 2.49 0.00 7.07 3.02 -1.01 -4.95 115.26 119.23 3dak n ASN 140 Ca -0.00 -1.89 0.00 0.00 -0.03 0.00 0.00 54.58 52.66 3dak n ASN 140 Cb 0.18 -0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 3dak n ASN 140 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dak n GLY 141 N 1.29 0.41 3.72 7.41 0.00 0.01 -5.06 105.19 112.97 3dak n GLY 141 Ca 0.17 -1.01 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 3dak n GLY 141 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dak s GLN 142 N -2.43 2.62 0.01 1.61 -1.52 0.10 -5.02 119.66 115.03 3dak s GLN 142 Ca 0.00 -1.05 0.05 0.00 -1.95 0.00 0.00 55.36 52.41 3dak s GLN 142 Cb 0.00 -2.46 -0.02 0.00 -0.22 0.00 0.00 33.01 30.31 3dak s GLN 142 CO 0.00 0.45 -0.14 0.42 -0.25 0.00 0.00 175.29 175.77 3dak s ILE 143 N -1.83 1.10 -0.15 1.08 1.01 -1.26 -3.84 121.20 117.31 3dak s ILE 143 Ca 0.29 -0.77 -0.22 0.00 0.00 0.00 0.00 60.65 59.95 3dak s ILE 143 Cb -0.09 -0.95 -0.19 0.00 0.01 0.00 0.00 42.46 41.24 3dak s ILE 143 CO 0.21 0.17 0.47 -0.74 0.00 0.00 0.00 174.94 175.05 3dak h HIS 144 N 5.41 0.00 0.00 3.97 -0.00 -1.96 -3.46 115.15 119.11 3dak h HIS 144 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.01 3dak h HIS 144 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.58 3dak h HIS 144 CO 0.46 0.90 0.00 0.54 -0.00 0.00 0.00 177.93 179.83 3dak n ARG 145 N -4.60 0.00 -2.56 5.26 1.74 -1.26 -4.69 116.66 110.55 3dak n ARG 145 Ca -0.13 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.80 3dak n ARG 145 Cb 0.44 -0.98 0.02 0.00 -1.02 0.00 0.00 32.46 30.92 3dak n ARG 145 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3dak n ASP 146 N 0.00 2.84 -4.71 0.55 2.03 -1.26 -4.93 116.55 111.07 3dak n ASP 146 Ca 0.00 -3.01 -0.42 0.00 0.52 0.00 0.00 54.79 51.88 3dak n ASP 146 Cb 0.00 -0.48 -0.03 0.00 -0.72 0.00 0.00 41.12 39.89 3dak n ASP 146 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3dak s VAL 147 N -4.12 4.29 -0.23 5.18 1.01 -1.26 -4.80 120.40 120.47 3dak s VAL 147 Ca 0.36 1.64 -0.37 0.00 0.00 0.00 0.00 61.98 63.62 3dak s VAL 147 Cb 0.41 -4.05 0.15 0.00 0.00 0.00 0.00 36.38 32.89 3dak s VAL 147 CO -0.04 0.11 1.36 -1.59 0.00 0.00 0.00 175.10 174.94 3dak s LYS 148 N 1.22 0.09 0.32 2.72 -2.85 -1.26 -4.64 119.74 115.33 3dak s LYS 148 Ca 0.56 -0.04 0.03 0.00 -1.00 0.00 0.00 55.97 55.53 3dak s LYS 148 Cb -0.26 0.04 0.62 0.00 -2.06 0.00 0.00 37.83 36.16 3dak s LYS 148 CO 0.28 -0.04 1.90 0.00 0.10 0.00 0.00 175.35 177.59 3dak h ALA 149 N 2.00 1.60 0.00 0.59 0.00 -1.93 -1.88 119.26 119.64 3dak h ALA 149 Ca -0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3dak h ALA 149 Cb 1.15 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 3dak h ALA 149 CO 0.21 0.23 -0.02 0.78 0.00 0.00 0.00 179.25 180.46 3dak h GLY 150 N 0.92 0.00 -2.42 0.00 0.00 -1.95 -2.27 103.07 97.35 3dak h GLY 150 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 3dak h GLY 150 CO -0.17 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.07 3dak n ASN 151 N -3.19 3.76 -4.34 0.19 3.02 -0.71 -4.82 115.26 109.18 3dak n ASN 151 Ca -0.02 -2.00 -0.43 0.00 -0.03 0.00 0.00 54.58 52.10 3dak n ASN 151 Cb 0.17 -0.44 -0.08 0.00 -0.61 0.00 0.00 39.78 38.82 3dak n ASN 151 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3dak s ILE 152 N -1.00 4.93 0.03 2.41 1.01 -0.86 0.04 121.20 127.76 3dak s ILE 152 Ca 0.44 -1.23 -0.02 0.00 0.00 0.00 0.00 60.65 59.84 3dak s ILE 152 Cb 0.23 -4.00 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 3dak s ILE 152 CO 0.30 -0.60 0.21 -0.76 0.00 0.00 0.00 174.94 174.09 3dak s LEU 153 N 1.57 4.36 -0.11 2.97 1.43 0.76 -0.96 118.68 128.71 3dak s LEU 153 Ca 0.04 0.35 0.01 0.00 -1.03 0.00 0.00 54.13 53.49 3dak s LEU 153 Cb -0.25 -2.79 -0.02 0.00 0.03 0.00 0.00 46.19 43.16 3dak s LEU 153 CO 0.05 0.21 -0.14 -0.76 0.23 0.00 0.00 176.35 175.95 3dak s LEU 154 N -2.19 2.71 0.31 1.79 1.43 0.94 -1.20 118.68 122.47 3dak s LEU 154 Ca 0.31 -0.30 -0.24 0.00 -1.03 0.00 0.00 54.13 52.87 3dak s LEU 154 Cb -0.13 -1.59 -0.10 0.00 0.03 0.00 0.00 46.19 44.40 3dak s LEU 154 CO 0.22 0.21 0.90 -0.83 0.23 0.00 0.00 176.35 177.09 3dak s GLY 155 N 0.06 2.74 0.47 -3.19 0.00 -0.06 -3.59 107.32 103.75 3dak s GLY 155 Ca -0.05 0.44 0.27 0.00 0.00 0.00 0.00 44.72 45.38 3dak s GLY 155 CO 0.04 0.86 1.80 0.83 0.00 0.00 0.00 173.10 176.63 3dak h GLU 156 N 3.15 0.19 -0.01 2.90 3.07 -1.96 -1.02 114.58 120.90 3dak h GLU 156 Ca -0.47 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 3dak h GLU 156 Cb 1.19 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.06 3dak h GLU 156 CO 0.65 0.13 -0.01 -0.40 -1.40 0.00 0.00 179.01 177.97 3dak n ASP 157 N -4.41 0.71 0.00 1.42 5.75 -1.26 -4.90 116.55 113.85 3dak n ASP 157 Ca 0.24 -1.17 0.00 0.00 -0.01 0.00 0.00 54.79 53.85 3dak n ASP 157 Cb 1.02 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 41.11 3dak n ASP 157 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dak n GLY 158 N 1.11 0.21 3.75 6.12 0.00 -0.39 -5.08 105.19 110.91 3dak n GLY 158 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 3dak n GLY 158 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dak s SER 159 N -2.21 4.82 -0.10 1.61 1.04 -1.25 -4.77 113.70 112.84 3dak s SER 159 Ca 0.00 2.23 0.01 0.00 0.48 0.00 0.00 55.95 58.67 3dak s SER 159 Cb 0.00 -2.58 0.02 0.00 0.10 0.00 0.00 66.02 63.56 3dak s SER 159 CO 0.00 -1.84 -0.11 -0.69 0.98 0.00 0.00 173.24 171.58 3dak s VAL 160 N -2.00 1.18 -0.01 5.02 1.01 -1.26 -0.89 120.40 123.44 3dak s VAL 160 Ca 0.72 -0.43 -0.02 0.00 0.00 0.00 0.00 61.98 62.26 3dak s VAL 160 Cb -0.26 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.00 3dak s VAL 160 CO 0.40 0.38 0.04 0.00 0.00 0.00 0.00 175.10 175.93 3dak s GLN 161 N 1.24 0.08 -0.13 2.72 -2.07 -0.34 -4.48 119.66 116.69 3dak s GLN 161 Ca -0.03 0.01 -0.28 0.00 -1.82 0.00 0.00 55.36 53.24 3dak s GLN 161 Cb -0.14 0.04 -0.01 0.00 -1.09 0.00 0.00 33.01 31.80 3dak s GLN 161 CO -0.04 -0.01 0.94 0.42 -1.32 0.00 0.00 175.29 175.28 3dak s ILE 162 N -0.11 4.82 0.56 3.63 1.01 0.01 -0.17 121.20 130.96 3dak s ILE 162 Ca -0.01 1.89 -0.01 0.00 0.00 0.00 0.00 60.65 62.51 3dak s ILE 162 Cb -0.01 -4.25 0.03 0.00 0.01 0.00 0.00 42.46 38.24 3dak s ILE 162 CO 0.00 0.02 0.81 0.00 0.00 0.00 0.00 174.94 175.77 3dak s ALA 163 N 2.03 3.66 -1.36 9.38 0.00 0.11 -1.17 121.76 134.41 3dak s ALA 163 Ca 0.45 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 51.29 3dak s ALA 163 Cb -0.18 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.70 3dak s ALA 163 CO 0.16 -0.77 0.00 -0.25 0.00 0.00 0.00 175.76 174.90 3dak n ASP 164 N -2.42 -4.77 -4.73 0.00 8.00 -1.26 -4.91 116.55 106.46 3dak n ASP 164 Ca 0.06 0.32 -0.42 0.00 0.71 0.00 0.00 54.79 55.46 3dak n ASP 164 Cb 0.59 -3.40 -0.02 0.00 -0.02 0.00 0.00 41.12 38.27 3dak n ASP 164 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3dak n PHE 165 N -2.55 2.82 0.00 1.24 7.35 -1.26 -1.76 117.46 123.30 3dak n PHE 165 Ca -0.13 0.17 0.00 0.00 -0.76 0.00 0.00 57.45 56.73 3dak n PHE 165 Cb 0.46 -2.63 0.00 0.00 0.35 0.00 0.00 39.48 37.66 3dak n PHE 165 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3dak n GLY 166 N 2.88 1.26 0.21 7.13 0.00 -1.26 -4.51 105.19 110.89 3dak n GLY 166 Ca 0.11 -0.96 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 3dak n GLY 166 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3dak h VAL 167 N 0.00 0.62 -0.10 1.61 2.07 -1.81 -2.02 116.25 116.62 3dak h VAL 167 Ca 0.00 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 3dak h VAL 167 Cb 0.00 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 3dak h VAL 167 CO 0.00 0.03 -0.09 0.28 0.02 0.00 0.00 177.57 177.81 3dak h SER 168 N 0.16 0.24 -0.78 0.57 0.02 -1.79 -2.06 113.55 109.91 3dak h SER 168 Ca 0.27 -0.47 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 3dak h SER 168 Cb 0.41 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.84 3dak h SER 168 CO -0.41 0.66 0.45 0.00 -1.14 0.00 0.00 176.83 176.39 3dak h ALA 169 N 0.59 1.31 0.25 3.77 0.00 -1.30 0.16 119.26 124.04 3dak h ALA 169 Ca 0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3dak h ALA 169 Cb 0.59 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3dak h ALA 169 CO 0.02 0.58 -0.21 0.35 0.00 0.00 0.00 179.25 179.98 3dak h PHE 170 N 1.09 -0.57 -0.63 0.00 3.57 -1.25 -2.77 116.94 116.39 3dak h PHE 170 Ca 0.28 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.70 3dak h PHE 170 Cb -0.00 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 3dak h PHE 170 CO 0.01 -0.32 0.06 -0.07 -2.23 0.00 0.00 178.31 175.76 3dak h LEU 171 N -0.48 1.02 -2.05 0.59 3.38 -1.12 -0.18 115.31 116.47 3dak h LEU 171 Ca -0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 3dak h LEU 171 Cb 0.44 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3dak h LEU 171 CO -0.03 1.04 -0.05 0.00 0.09 0.00 0.00 178.44 179.49 3dak h ALA 172 N 1.08 1.10 -0.29 1.53 0.00 -0.90 -2.83 119.26 118.94 3dak h ALA 172 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3dak h ALA 172 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3dak h ALA 172 CO 0.02 0.06 0.00 0.25 0.00 0.00 0.00 179.25 179.58 3dak n THR 173 N -3.29 1.12 -0.08 0.00 -2.24 -1.05 -4.97 114.28 103.76 3dak n THR 173 Ca -0.01 -1.09 0.00 0.00 -2.27 0.00 0.00 64.05 60.68 3dak n THR 173 Cb 0.22 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 3dak n THR 173 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dak n GLY 174 N 0.29 0.95 7.00 3.38 0.00 -1.07 -4.59 105.19 111.16 3dak n GLY 174 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3dak n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dak n GLY 175 N -2.08 2.41 0.00 -0.02 0.00 -0.09 -3.18 105.19 102.23 3dak n GLY 175 Ca 0.00 -0.41 0.10 0.00 0.00 0.00 0.00 46.02 45.71 3dak n GLY 175 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dak n ASP 176 N 3.61 0.00 -0.28 1.61 5.75 -1.26 -2.09 116.55 123.88 3dak n ASP 176 Ca 0.00 0.50 0.08 0.00 -0.01 0.00 0.00 54.79 55.36 3dak n ASP 176 Cb 0.00 -0.50 0.23 0.00 -1.03 0.00 0.00 41.12 39.83 3dak n ASP 176 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 3dak h ILE 177 N 0.00 0.59 -0.97 2.12 2.04 -1.91 -2.81 117.51 116.57 3dak h ILE 177 Ca 0.00 -0.15 -0.64 0.00 1.00 0.00 0.00 64.86 65.07 3dak h ILE 177 Cb 0.36 0.11 -0.34 0.00 -0.74 0.00 0.00 36.82 36.21 3dak h ILE 177 CO 0.00 0.08 0.30 0.35 0.00 0.00 0.00 178.15 178.88 3dak n THR 178 N -5.01 3.25 -1.69 -0.27 -2.24 -0.89 -5.01 114.28 102.42 3dak n THR 178 Ca 0.18 -3.44 -0.44 0.00 -2.27 0.00 0.00 64.05 58.07 3dak n THR 178 Cb 0.51 -1.16 -0.03 0.00 -2.10 0.00 0.00 70.33 67.55 3dak n THR 178 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3dak n ARG 179 N -0.83 2.34 -2.29 -0.78 1.74 -1.06 -4.99 116.66 110.78 3dak n ARG 179 Ca 0.56 0.84 -0.41 0.00 -0.77 0.00 0.00 57.85 58.07 3dak n ARG 179 Cb 0.75 -2.60 0.00 0.00 -1.02 0.00 0.00 32.46 29.59 3dak n ARG 179 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3dak n ASN 180 N 2.98 7.08 -1.63 0.55 0.23 -1.26 -4.63 115.26 118.57 3dak n ASN 180 Ca 0.14 -3.26 0.00 0.00 -0.53 0.00 0.00 54.58 50.93 3dak n ASN 180 Cb 0.32 -1.34 0.00 0.00 -2.08 0.00 0.00 39.78 36.68 3dak n ASN 180 CO 0.00 0.00 0.00 2.22 -0.93 0.00 0.00 177.26 178.55 3dak n PHE 186 N 1.86 -4.38 -1.79 -2.53 1.16 -1.26 -4.72 117.46 105.80 3dak n PHE 186 Ca 0.51 2.37 -0.29 0.00 -1.87 0.00 0.00 57.45 58.16 3dak n PHE 186 Cb 0.28 -3.62 0.10 0.00 -1.61 0.00 0.00 39.48 34.64 3dak n PHE 186 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 3dak s VAL 187 N -5.02 2.10 0.00 1.97 1.01 -1.26 -5.00 120.40 114.20 3dak s VAL 187 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.01 3dak s VAL 187 Cb 0.00 -2.95 0.00 0.00 0.00 0.00 0.00 36.38 33.43 3dak s VAL 187 CO 0.00 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.67 3dak n GLY 188 N -2.95 0.80 3.78 4.51 0.00 -1.26 -4.97 105.19 105.09 3dak n GLY 188 Ca 0.07 -1.74 -0.39 0.00 0.00 0.00 0.00 46.02 43.96 3dak n GLY 188 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3dak s THR 189 N -2.94 4.62 -0.17 2.61 -1.32 -1.26 -4.98 115.64 112.20 3dak s THR 189 Ca 0.00 1.48 0.00 0.00 -1.21 0.00 0.00 61.69 61.96 3dak s THR 189 Cb 0.00 -4.03 0.16 0.00 -1.51 0.00 0.00 72.50 67.12 3dak s THR 189 CO 0.00 0.49 1.67 -0.81 -2.21 0.00 0.00 174.62 173.76 3dak n PRO 190 N 2.00 1.44 0.23 7.08 -0.04 -1.26 -4.66 135.00 139.79 3dak n PRO 190 Ca -0.07 -0.94 0.12 0.00 -0.04 0.00 0.00 63.50 62.57 3dak n PRO 190 Cb 0.50 -1.37 0.73 0.00 -0.04 0.00 0.00 33.50 33.32 3dak n PRO 190 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dak n TRP 192 N -4.29 0.00 -2.28 0.00 8.01 -1.26 -4.98 117.44 112.63 3dak n TRP 192 Ca -0.01 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.76 3dak n TRP 192 Cb 0.17 -0.05 -0.03 0.00 -2.01 0.00 0.00 31.31 29.39 3dak n TRP 192 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.69 178.09 3dak s MET 193 N -2.67 4.41 0.45 -0.99 1.75 -1.00 -5.00 119.30 116.26 3dak s MET 193 Ca 0.16 1.96 -0.24 0.00 -1.25 0.00 0.00 55.69 56.33 3dak s MET 193 Cb 0.18 -3.24 -0.07 0.00 2.84 0.00 0.00 34.83 34.53 3dak s MET 193 CO 0.65 -0.24 1.26 0.00 -0.65 0.00 0.00 175.02 176.03 3dak s ALA 194 N 0.41 3.06 0.27 4.11 0.00 -1.26 -4.81 121.76 123.55 3dak s ALA 194 Ca 0.57 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.68 3dak s ALA 194 Cb -0.34 -3.46 0.54 0.00 0.00 0.00 0.00 23.12 19.85 3dak s ALA 194 CO 0.35 -0.87 1.82 -1.00 0.00 0.00 0.00 175.76 176.05 3dak h PRO 195 N 2.19 0.88 0.00 0.00 0.13 -1.99 -0.37 132.00 132.84 3dak h PRO 195 Ca -0.50 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 64.56 3dak h PRO 195 Cb 1.26 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 3dak h PRO 195 CO 0.61 0.58 -0.11 1.05 -0.23 0.00 0.00 178.00 179.89 3dak h GLU 196 N 0.90 0.00 0.01 0.86 9.09 -2.00 0.21 114.58 123.66 3dak h GLU 196 Ca 0.48 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.87 3dak h GLU 196 Cb 0.52 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.62 3dak h GLU 196 CO -0.28 0.11 -0.09 0.28 0.05 0.00 0.00 179.01 179.08 3dak h VAL 197 N 0.00 1.69 -0.99 -1.06 2.07 -1.47 -3.19 116.25 113.30 3dak h VAL 197 Ca -0.00 -2.13 0.20 0.00 0.82 0.00 0.00 66.70 65.58 3dak h VAL 197 Cb 0.39 3.12 -0.11 0.00 -1.52 0.00 0.00 31.29 33.17 3dak h VAL 197 CO 0.01 0.56 0.58 0.24 0.02 0.00 0.00 177.57 178.99 3dak h MET 198 N -0.82 0.68 -0.80 1.57 2.86 -1.00 -0.78 114.93 116.64 3dak h MET 198 Ca -0.01 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 3dak h MET 198 Cb 0.97 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 32.44 3dak h MET 198 CO 0.02 0.45 0.45 1.49 1.06 0.00 0.00 176.91 180.38 3dak h GLU 199 N 0.70 1.11 -0.25 1.72 4.57 -1.04 -0.56 114.58 120.82 3dak h GLU 199 Ca 0.58 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.64 3dak h GLU 199 Cb 0.95 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 29.30 3dak h GLU 199 CO -0.41 0.80 0.13 1.96 -1.18 0.00 0.00 179.01 180.32 3dak h GLN 200 N 1.11 0.36 -0.30 1.92 4.20 -1.29 -2.59 115.11 118.51 3dak h GLN 200 Ca 0.28 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.88 3dak h GLN 200 Cb 0.01 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 3dak h GLN 200 CO -0.05 0.33 -0.11 -0.39 -0.67 0.00 0.00 178.83 177.95 3dak h VAL 201 N 0.29 1.23 0.00 -0.54 -1.51 -0.75 -2.51 116.25 112.45 3dak h VAL 201 Ca 0.09 -0.99 0.00 0.00 -1.23 0.00 0.00 66.70 64.57 3dak h VAL 201 Cb 0.09 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 30.36 3dak h VAL 201 CO -0.01 0.33 0.00 -0.09 -1.23 0.00 0.00 177.57 176.56 3dak h ARG 202 N 0.47 0.00 0.00 5.19 2.43 -1.08 -3.49 114.38 117.90 3dak h ARG 202 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 3dak h ARG 202 Cb 0.47 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 3dak h ARG 202 CO 0.03 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.90 3dak n GLY 203 N 0.18 1.43 3.84 2.80 0.00 -0.95 -4.95 105.19 107.55 3dak n GLY 203 Ca 0.01 -0.67 -0.08 0.00 0.00 0.00 0.00 46.02 45.29 3dak n GLY 203 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3dak s TYR 204 N 0.00 -0.10 0.06 1.61 -0.85 -1.26 -4.75 117.35 112.06 3dak s TYR 204 Ca 0.00 -0.42 0.01 0.00 -0.52 0.00 0.00 57.07 56.13 3dak s TYR 204 Cb 0.00 0.75 -0.00 0.00 0.38 0.00 0.00 41.96 43.08 3dak s TYR 204 CO 0.00 -1.34 0.03 -0.40 -1.52 0.00 0.00 175.55 172.32 3dak n ASP 205 N -0.73 0.72 0.19 -0.18 5.68 -1.26 -4.71 116.55 116.25 3dak n ASP 205 Ca -0.05 -1.34 0.17 0.00 -0.50 0.00 0.00 54.79 53.07 3dak n ASP 205 Cb 0.59 0.18 0.69 0.00 -1.14 0.00 0.00 41.12 41.45 3dak n ASP 205 CO 0.00 0.00 0.00 2.19 -1.33 0.00 0.00 177.20 178.06 3dak h PHE 206 N 1.12 0.00 0.00 2.11 -0.00 -1.97 -1.85 116.94 116.36 3dak h PHE 206 Ca -0.05 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 57.91 3dak h PHE 206 Cb 0.19 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.14 3dak h PHE 206 CO 0.00 0.00 -0.09 0.87 -0.00 0.00 0.00 178.31 179.09 3dak h LYS 207 N 0.00 0.00 -0.90 6.09 1.79 -1.95 -1.02 116.57 120.59 3dak h LYS 207 Ca 0.12 0.00 0.19 0.00 -2.18 0.00 0.00 60.65 58.78 3dak h LYS 207 Cb 1.13 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 31.71 3dak h LYS 207 CO -0.00 0.09 0.59 0.00 -1.08 0.00 0.00 179.45 179.04 3dak h ALA 208 N 1.91 2.15 0.00 3.86 0.00 -1.72 -1.17 119.26 124.30 3dak h ALA 208 Ca -0.00 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3dak h ALA 208 Cb 0.21 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3dak h ALA 208 CO 0.01 -0.43 -0.40 -0.44 0.00 0.00 0.00 179.25 177.99 3dak h ASP 209 N 0.44 0.00 0.03 0.00 3.32 -1.40 -2.74 116.42 116.07 3dak h ASP 209 Ca 0.47 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.32 3dak h ASP 209 Cb 1.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.66 3dak h ASP 209 CO -0.18 0.40 -0.70 0.40 -1.72 0.00 0.00 179.24 177.44 3dak h ILE 210 N 0.00 1.32 0.12 0.35 1.08 -1.30 -0.08 117.51 119.00 3dak h ILE 210 Ca -0.00 -1.98 0.00 0.00 -0.39 0.00 0.00 64.86 62.49 3dak h ILE 210 Cb 0.80 1.96 -0.01 0.00 -3.07 0.00 0.00 36.82 36.50 3dak h ILE 210 CO 0.05 0.62 -0.11 -0.25 -0.69 0.00 0.00 178.15 177.77 3dak h TRP 211 N 0.43 -0.29 -0.78 1.37 2.91 -1.42 -1.40 115.95 116.77 3dak h TRP 211 Ca -0.03 0.00 0.10 0.00 1.13 0.00 0.00 58.89 60.09 3dak h TRP 211 Cb 1.29 0.11 -0.07 0.00 -0.51 0.00 0.00 29.16 29.98 3dak h TRP 211 CO 0.06 -0.17 0.42 0.77 -1.03 0.00 0.00 178.44 178.49 3dak h SER 212 N -0.25 0.57 -0.37 2.65 0.02 -1.40 -0.93 113.55 113.85 3dak h SER 212 Ca 0.00 0.06 0.05 0.00 -0.84 0.00 0.00 61.79 61.06 3dak h SER 212 Cb 0.24 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.69 3dak h SER 212 CO -0.02 0.32 0.10 0.15 -1.14 0.00 0.00 176.83 176.24 3dak h PHE 213 N 0.70 0.18 -0.73 3.45 3.57 -0.94 0.74 116.94 123.90 3dak h PHE 213 Ca 0.39 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.98 3dak h PHE 213 Cb 0.40 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.05 3dak h PHE 213 CO -0.08 0.06 0.40 0.78 -2.23 0.00 0.00 178.31 177.24 3dak h GLY 214 N 0.24 1.10 0.98 2.40 0.00 -0.23 -1.19 103.07 106.36 3dak h GLY 214 Ca 0.17 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.16 3dak h GLY 214 CO -0.20 0.14 0.01 -2.22 0.00 0.00 0.00 176.54 174.26 3dak h ILE 215 N 0.71 1.26 -0.81 2.60 1.08 -0.83 -2.94 117.51 118.58 3dak h ILE 215 Ca 0.34 -1.04 0.11 0.00 -0.39 0.00 0.00 64.86 63.88 3dak h ILE 215 Cb 0.27 1.03 -0.08 0.00 -3.07 0.00 0.00 36.82 34.98 3dak h ILE 215 CO -0.22 0.36 0.44 0.74 -0.69 0.00 0.00 178.15 178.78 3dak h THR 216 N 0.65 0.86 -0.37 -0.27 2.02 -0.26 -1.58 112.91 113.95 3dak h THR 216 Ca 0.13 -0.25 0.07 0.00 0.77 0.00 0.00 66.41 67.13 3dak h THR 216 Cb 0.49 0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 66.91 3dak h THR 216 CO 0.02 0.13 -0.02 0.00 0.37 0.00 0.00 175.52 176.03 3dak h ALA 217 N 1.47 0.32 -0.46 6.16 0.00 -1.09 -0.71 119.26 124.96 3dak h ALA 217 Ca 0.40 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.47 3dak h ALA 217 Cb 0.43 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 3dak h ALA 217 CO -0.28 -0.41 0.20 0.82 0.00 0.00 0.00 179.25 179.59 3dak h ILE 218 N 0.08 0.91 -0.73 0.00 2.04 -1.27 -2.69 117.51 115.86 3dak h ILE 218 Ca 0.18 -0.14 0.07 0.00 1.00 0.00 0.00 64.86 65.98 3dak h ILE 218 Cb 0.26 0.48 -0.06 0.00 -0.74 0.00 0.00 36.82 36.75 3dak h ILE 218 CO -0.32 0.07 0.41 -0.08 0.00 0.00 0.00 178.15 178.24 3dak h GLU 219 N 0.40 0.70 0.00 2.37 4.81 -0.70 0.21 114.58 122.38 3dak h GLU 219 Ca 0.21 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.36 3dak h GLU 219 Cb 0.16 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3dak h GLU 219 CO -0.18 0.46 -0.19 -0.07 -0.73 0.00 0.00 179.01 178.31 3dak h LEU 220 N 0.72 0.00 0.09 1.64 3.38 -0.96 0.42 115.31 120.60 3dak h LEU 220 Ca 0.34 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.99 3dak h LEU 220 Cb 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3dak h LEU 220 CO -0.22 0.19 -1.77 0.00 0.09 0.00 0.00 178.44 176.73 3dak n ALA 221 N -2.34 0.85 0.35 1.53 0.00 -0.59 -1.89 120.51 118.42 3dak n ALA 221 Ca -0.02 -0.55 0.08 0.00 0.00 0.00 0.00 53.44 52.95 3dak n ALA 221 Cb 0.29 -0.65 -0.12 0.00 0.00 0.00 0.00 19.45 18.98 3dak n ALA 221 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3dak n THR 222 N -3.78 0.00 0.00 0.00 -2.24 0.65 -0.55 114.28 108.36 3dak n THR 222 Ca -0.32 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 3dak n THR 222 Cb 0.94 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 3dak n THR 222 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dak n GLY 223 N 1.46 1.52 3.38 3.38 0.00 0.15 -4.82 105.19 110.26 3dak n GLY 223 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 3dak n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dak s ALA 224 N -2.38 -1.29 0.51 4.61 0.00 -1.20 -4.93 121.76 117.08 3dak s ALA 224 Ca 0.00 0.73 -0.22 0.00 0.00 0.00 0.00 51.96 52.47 3dak s ALA 224 Cb 0.00 0.16 -0.06 0.00 0.00 0.00 0.00 23.12 23.22 3dak s ALA 224 CO 0.00 -0.39 1.23 0.00 0.00 0.00 0.00 175.76 176.61 3dak s ALA 225 N -1.72 2.87 0.35 0.00 0.00 -1.26 -3.75 121.76 118.25 3dak s ALA 225 Ca -0.10 1.07 0.16 0.00 0.00 0.00 0.00 51.96 53.10 3dak s ALA 225 Cb -0.02 -3.45 1.20 0.00 0.00 0.00 0.00 23.12 20.85 3dak s ALA 225 CO 0.04 -0.95 1.59 -1.35 0.00 0.00 0.00 175.76 175.08 3dak h PRO 226 N 1.70 0.03 -0.38 0.00 0.11 -1.92 -1.95 132.00 129.58 3dak h PRO 226 Ca -0.50 -0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.38 3dak h PRO 226 Cb 1.27 -0.01 -0.15 0.00 0.11 0.00 0.00 31.00 32.22 3dak h PRO 226 CO 0.59 0.02 -0.24 0.66 -0.21 0.00 0.00 178.00 178.82 3dak n TYR 227 N -5.29 1.26 0.27 0.65 4.01 -1.26 -3.87 117.16 112.92 3dak n TYR 227 Ca 0.34 -1.78 0.10 0.00 -0.16 0.00 0.00 57.90 56.41 3dak n TYR 227 Cb 1.15 -0.48 0.73 0.00 -0.31 0.00 0.00 39.34 40.44 3dak n TYR 227 CO 0.00 0.00 0.00 1.12 -0.46 0.00 0.00 176.86 177.52 3dak h HIS 228 N 1.25 0.00 0.00 -0.72 2.07 -1.72 -2.13 115.15 113.89 3dak h HIS 228 Ca 0.22 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.74 3dak h HIS 228 Cb 1.46 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.44 3dak h HIS 228 CO 0.98 0.01 0.00 0.87 -3.07 0.00 0.00 177.93 176.72 3dak h LYS 229 N 0.00 0.00 -5.94 5.12 1.57 -1.86 -3.46 116.57 112.01 3dak h LYS 229 Ca -0.00 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.16 3dak h LYS 229 Cb 0.02 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.29 3dak h LYS 229 CO 0.00 0.00 -0.44 0.71 -0.57 0.00 0.00 179.45 179.16 3dak s TYR 230 N -3.41 3.53 0.71 -1.35 1.51 -0.80 -5.09 117.35 112.44 3dak s TYR 230 Ca 0.03 0.40 -0.16 0.00 -1.01 0.00 0.00 57.07 56.33 3dak s TYR 230 Cb 0.09 -1.87 0.00 0.00 -0.11 0.00 0.00 41.96 40.07 3dak s TYR 230 CO 0.40 0.58 1.00 -2.30 -1.11 0.00 0.00 175.55 174.12 3dak n PRO 231 N 0.57 0.58 -0.22 -1.71 -0.02 -1.26 -4.70 135.00 128.24 3dak n PRO 231 Ca -0.07 0.25 0.21 0.00 -2.02 0.00 0.00 63.50 61.87 3dak n PRO 231 Cb 0.52 -2.25 0.56 0.00 -0.02 0.00 0.00 33.50 32.30 3dak n PRO 231 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3dak h PRO 232 N -0.14 0.31 0.00 0.52 0.11 -1.98 -1.11 132.00 129.71 3dak h PRO 232 Ca -0.48 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 65.39 3dak h PRO 232 Cb 1.34 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.34 3dak h PRO 232 CO 0.48 0.21 -1.27 1.98 -0.21 0.00 0.00 178.00 179.18 3dak h MET 233 N 0.32 0.00 -0.29 1.05 4.05 -2.00 -2.90 114.93 115.16 3dak h MET 233 Ca 0.45 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.86 3dak h MET 233 Cb 1.25 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.04 3dak h MET 233 CO -0.14 0.65 0.12 0.87 0.23 0.00 0.00 176.91 178.64 3dak h LYS 234 N 0.00 0.43 -0.20 0.39 1.57 -1.57 -2.43 116.57 114.76 3dak h LYS 234 Ca -0.14 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 58.62 3dak h LYS 234 Cb 1.79 -0.07 -0.07 0.00 0.08 0.00 0.00 32.23 33.96 3dak h LYS 234 CO 0.09 0.44 -0.31 0.28 -0.57 0.00 0.00 179.45 179.38 3dak h VAL 235 N 0.33 0.29 -0.20 0.50 2.07 -1.46 0.14 116.25 117.91 3dak h VAL 235 Ca 0.10 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.64 3dak h VAL 235 Cb 0.17 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.19 3dak h VAL 235 CO -0.01 0.00 -0.21 -0.07 0.02 0.00 0.00 177.57 177.31 3dak h LEU 236 N -0.35 -0.71 -0.35 2.57 3.38 -1.52 -1.36 115.31 116.98 3dak h LEU 236 Ca 0.11 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.25 3dak h LEU 236 Cb 0.53 0.29 -0.09 0.00 0.09 0.00 0.00 40.66 41.49 3dak h LEU 236 CO -0.39 -0.13 -0.38 0.24 0.09 0.00 0.00 178.44 177.87 3dak h MET 237 N -0.11 -0.31 -0.21 1.13 2.86 -1.24 -1.45 114.93 115.60 3dak h MET 237 Ca 0.03 0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 3dak h MET 237 Cb 0.20 0.07 -0.07 0.00 0.06 0.00 0.00 31.60 31.86 3dak h MET 237 CO -0.25 -0.21 -0.48 -0.07 1.06 0.00 0.00 176.91 176.97 3dak h LEU 238 N -0.32 -1.53 -1.96 1.22 -0.00 -0.61 0.18 115.31 112.28 3dak h LEU 238 Ca 0.14 0.20 -0.02 0.00 -0.00 0.00 0.00 57.88 58.20 3dak h LEU 238 Cb 0.57 0.62 -0.00 0.00 -0.00 0.00 0.00 40.66 41.85 3dak h LEU 238 CO -0.52 -0.44 -0.09 0.74 -0.00 0.00 0.00 178.44 178.13 3dak h THR 239 N -0.49 0.85 0.00 0.22 2.02 -0.99 0.28 112.91 114.80 3dak h THR 239 Ca 0.07 -0.33 -0.18 0.00 0.77 0.00 0.00 66.41 66.74 3dak h THR 239 Cb 0.64 1.19 -0.03 0.00 -1.74 0.00 0.00 68.15 68.21 3dak h THR 239 CO -0.46 0.09 -1.27 -0.07 0.37 0.00 0.00 175.52 174.17 3dak h LEU 240 N 0.00 0.00 0.09 2.58 3.38 -0.77 -3.40 115.31 117.19 3dak h LEU 240 Ca -0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 3dak h LEU 240 Cb 0.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3dak h LEU 240 CO 0.01 0.66 -1.67 1.56 0.09 0.00 0.00 178.44 179.10 3dak h GLN 241 N 0.00 0.19 -7.34 1.13 4.20 -0.35 -3.49 115.11 109.46 3dak h GLN 241 Ca -0.14 -0.33 -0.46 0.00 0.06 0.00 0.00 58.65 57.78 3dak h GLN 241 Cb 1.63 0.12 0.10 0.00 0.30 0.00 0.00 27.48 29.64 3dak h GLN 241 CO 0.06 1.16 0.21 -0.80 -0.67 0.00 0.00 178.83 178.79 3dak s ASN 242 N -7.00 4.07 0.65 1.46 0.02 0.06 -5.08 114.94 109.12 3dak s ASN 242 Ca -0.23 -0.07 -0.15 0.00 -1.02 0.00 0.00 52.86 51.39 3dak s ASN 242 Cb 0.06 -0.26 -0.00 0.00 0.02 0.00 0.00 41.25 41.07 3dak s ASN 242 CO 0.72 -2.07 1.09 -1.81 0.02 0.00 0.00 177.10 175.06 3dak s ASP 243 N -4.75 5.23 0.51 -1.22 1.01 -1.26 -4.86 116.67 111.32 3dak s ASP 243 Ca 0.68 1.92 -0.23 0.00 0.71 0.00 0.00 52.55 55.63 3dak s ASP 243 Cb -0.06 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.27 3dak s ASP 243 CO 0.47 -1.55 1.34 -2.84 0.21 0.00 0.00 175.17 172.80 3dak s PRO 244 N -4.21 3.38 0.92 8.23 0.02 -1.26 -4.95 135.00 137.14 3dak s PRO 244 Ca 0.65 2.21 -0.11 0.00 0.02 0.00 0.00 61.00 63.76 3dak s PRO 244 Cb -0.19 -2.39 0.15 0.00 0.02 0.00 0.00 34.50 32.09 3dak s PRO 244 CO 0.42 -0.99 1.09 -2.14 -0.33 0.00 0.00 177.00 175.06 3dak s PRO 245 N -2.75 1.01 0.16 5.54 0.02 -1.26 -5.07 135.00 132.65 3dak s PRO 245 Ca 0.67 0.97 0.01 0.00 0.02 0.00 0.00 61.00 62.67 3dak s PRO 245 Cb -0.39 -1.77 -0.01 0.00 0.02 0.00 0.00 34.50 32.35 3dak s PRO 245 CO 0.48 -2.45 0.05 -1.13 -0.33 0.00 0.00 177.00 173.62 3dak n SER 246 N -4.05 1.22 0.10 2.53 3.41 -1.26 -4.93 113.62 110.65 3dak n SER 246 Ca 0.07 -1.85 0.04 0.00 -0.26 0.00 0.00 58.87 56.87 3dak n SER 246 Cb 0.54 0.37 0.45 0.00 -0.26 0.00 0.00 64.21 65.31 3dak n SER 246 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3dak h LEU 247 N 0.00 0.27 -1.95 1.04 6.46 -1.98 -3.04 115.31 116.11 3dak h LEU 247 Ca -0.13 -0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.60 3dak h LEU 247 Cb 0.48 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.34 3dak h LEU 247 CO 0.20 0.30 0.00 -0.62 -0.62 0.00 0.00 178.44 177.71 3dak n GLU 248 N -4.39 2.24 -0.16 1.25 4.71 -1.26 -4.72 120.64 118.31 3dak n GLU 248 Ca 0.00 -1.92 -0.01 0.00 -0.01 0.00 0.00 57.16 55.23 3dak n GLU 248 Cb 0.16 -1.44 0.23 0.00 -1.01 0.00 0.00 31.44 29.38 3dak n GLU 248 CO 0.00 0.00 0.00 1.79 0.09 0.00 0.00 177.13 179.01 3dak h THR 249 N 3.31 1.20 -0.26 2.62 1.35 -1.89 -2.85 112.91 116.39 3dak h THR 249 Ca 0.00 -0.57 -0.03 0.00 -0.55 0.00 0.00 66.41 65.26 3dak h THR 249 Cb 0.75 0.41 -0.02 0.00 -1.73 0.00 0.00 68.15 67.56 3dak h THR 249 CO 0.00 0.24 -0.00 0.61 -0.25 0.00 0.00 175.52 176.12 3dak n GLY 250 N -1.14 4.21 3.15 5.82 0.00 -1.25 -4.99 105.19 110.99 3dak n GLY 250 Ca 0.06 -1.08 -0.33 0.00 0.00 0.00 0.00 46.02 44.67 3dak n GLY 250 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dak s VAL 251 N -2.90 2.28 -0.04 1.61 0.11 -1.08 -5.05 120.40 115.33 3dak s VAL 251 Ca 0.42 -0.89 -0.04 0.00 -2.93 0.00 0.00 61.98 58.55 3dak s VAL 251 Cb 0.35 -1.98 -0.02 0.00 -1.53 0.00 0.00 36.38 33.20 3dak s VAL 251 CO 0.07 0.50 0.22 1.56 -3.33 0.00 0.00 175.10 174.13 3dak h GLN 252 N 7.96 -0.12 -5.99 1.54 4.20 -1.94 -3.38 115.11 117.38 3dak h GLN 252 Ca -0.45 0.01 -0.46 0.00 0.06 0.00 0.00 58.65 57.81 3dak h GLN 252 Cb 1.14 0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.89 3dak h GLN 252 CO 0.63 -0.08 1.14 0.34 -0.67 0.00 0.00 178.83 180.19 3dak s ASP 253 N -4.16 5.59 0.00 1.46 2.15 -1.26 -4.84 116.67 115.61 3dak s ASP 253 Ca -0.02 -0.39 0.13 0.00 0.43 0.00 0.00 52.55 52.70 3dak s ASP 253 Cb 0.00 -2.55 0.67 0.00 -0.30 0.00 0.00 42.92 40.74 3dak s ASP 253 CO 0.06 -2.25 1.32 0.29 -0.17 0.00 0.00 175.17 174.41 3dak n LYS 254 N 9.08 0.21 0.00 4.34 5.02 -1.26 -1.53 118.16 134.02 3dak n LYS 254 Ca 0.25 0.14 0.14 0.00 -2.02 0.00 0.00 58.31 56.82 3dak n LYS 254 Cb 0.50 -1.50 0.68 0.00 -0.02 0.00 0.00 35.03 34.69 3dak n LYS 254 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3dak n GLU 255 N -1.25 0.28 0.00 1.97 -0.58 -1.26 -3.07 120.64 116.73 3dak n GLU 255 Ca 0.07 0.02 0.02 0.00 -0.42 0.00 0.00 57.16 56.84 3dak n GLU 255 Cb 0.10 -1.50 0.10 0.00 -0.57 0.00 0.00 31.44 29.57 3dak n GLU 255 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 3dak n MET 256 N -1.35 0.31 -1.07 3.49 1.56 -0.59 -3.01 117.12 116.47 3dak n MET 256 Ca 0.11 0.00 0.03 0.00 -0.27 0.00 0.00 57.70 57.58 3dak n MET 256 Cb 0.26 -1.17 0.04 0.00 2.15 0.00 0.00 33.22 34.50 3dak n MET 256 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 3dak n LEU 257 N -0.67 0.98 -0.11 -0.89 7.99 -1.18 -2.52 117.00 120.60 3dak n LEU 257 Ca 0.03 -1.99 -0.10 0.00 -0.01 0.00 0.00 56.01 53.94 3dak n LEU 257 Cb 0.01 -0.08 -0.02 0.00 -0.11 0.00 0.00 43.42 43.22 3dak n LEU 257 CO 0.02 0.54 0.87 0.50 -1.51 0.00 0.00 177.39 177.81 3dak h LYS 258 N 0.68 0.53 -0.95 3.23 3.64 -1.77 -2.86 116.57 119.08 3dak h LYS 258 Ca -0.13 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.10 3dak h LYS 258 Cb 1.63 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.35 3dak h LYS 258 CO 0.06 0.56 0.04 1.63 -2.27 0.00 0.00 179.45 179.47 3dak n LYS 259 N -4.65 1.55 -3.84 1.90 5.02 -1.26 -4.70 118.16 112.18 3dak n LYS 259 Ca -0.01 -0.57 -0.36 0.00 -2.02 0.00 0.00 58.31 55.34 3dak n LYS 259 Cb 0.17 -1.49 -0.13 0.00 -0.02 0.00 0.00 35.03 33.56 3dak n LYS 259 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3dak s TYR 260 N -1.07 3.09 0.36 2.13 1.51 -1.08 -4.68 117.35 117.61 3dak s TYR 260 Ca 0.10 -1.10 -0.04 0.00 -1.01 0.00 0.00 57.07 55.02 3dak s TYR 260 Cb 0.08 -2.17 0.08 0.00 -0.11 0.00 0.00 41.96 39.84 3dak s TYR 260 CO 0.03 -0.60 0.49 0.41 -1.11 0.00 0.00 175.55 174.76 3dak n GLY 261 N 4.80 -0.46 0.17 0.71 0.00 -1.26 -4.93 105.19 104.21 3dak n GLY 261 Ca -0.16 -1.81 -0.06 0.00 0.00 0.00 0.00 46.02 43.99 3dak n GLY 261 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dak h LYS 262 N 0.00 0.27 0.00 1.61 1.79 -1.99 -3.09 116.57 115.16 3dak h LYS 262 Ca -0.16 -0.19 -0.09 0.00 -2.18 0.00 0.00 60.65 58.03 3dak h LYS 262 Cb 0.49 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 3dak h LYS 262 CO 0.13 0.81 -0.43 0.66 -1.08 0.00 0.00 179.45 179.53 3dak h SER 263 N 0.20 0.00 -0.25 0.86 4.64 -1.99 -1.98 113.55 115.03 3dak h SER 263 Ca -0.01 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.23 3dak h SER 263 Cb 1.14 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 3dak h SER 263 CO 0.10 0.43 -0.17 0.15 -0.87 0.00 0.00 176.83 176.47 3dak h PHE 264 N 0.00 0.66 -0.10 4.77 3.57 -1.93 -2.07 116.94 121.83 3dak h PHE 264 Ca -0.00 -0.18 -0.11 0.00 3.53 0.00 0.00 57.97 61.21 3dak h PHE 264 Cb 1.04 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 3dak h PHE 264 CO 0.00 0.85 -0.42 0.00 -2.23 0.00 0.00 178.31 176.51 3dak h ARG 265 N 0.28 0.23 -0.15 1.11 3.08 -1.45 -1.58 114.38 115.91 3dak h ARG 265 Ca 0.05 -0.11 -0.22 0.00 0.07 0.00 0.00 59.98 59.77 3dak h ARG 265 Cb 0.71 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.77 3dak h ARG 265 CO 0.05 0.62 -0.75 0.87 -1.07 0.00 0.00 179.97 179.69 3dak h LYS 266 N 0.19 0.77 -0.31 0.04 1.57 -1.42 -1.23 116.57 116.18 3dak h LYS 266 Ca 0.02 -0.63 0.04 0.00 -1.87 0.00 0.00 60.65 58.21 3dak h LYS 266 Cb 0.83 0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.24 3dak h LYS 266 CO 0.07 1.24 0.07 1.98 -0.57 0.00 0.00 179.45 182.24 3dak h MET 267 N 0.49 0.19 -0.73 3.15 4.05 -1.16 -1.03 114.93 119.89 3dak h MET 267 Ca -0.05 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.34 3dak h MET 267 Cb 1.39 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 32.11 3dak h MET 267 CO 0.16 0.12 0.38 0.82 0.23 0.00 0.00 176.91 178.62 3dak h ILE 268 N 0.19 1.23 -0.02 1.77 2.04 -1.22 -2.88 117.51 118.62 3dak h ILE 268 Ca 0.14 -0.61 -0.14 0.00 1.00 0.00 0.00 64.86 65.25 3dak h ILE 268 Cb 0.15 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 3dak h ILE 268 CO -0.18 0.26 -0.63 0.77 0.00 0.00 0.00 178.15 178.37 3dak h SER 269 N 1.02 0.09 -0.69 1.72 4.64 -0.92 -0.78 113.55 118.63 3dak h SER 269 Ca 0.25 -0.06 0.02 0.00 -0.47 0.00 0.00 61.79 61.54 3dak h SER 269 Cb 0.08 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.10 3dak h SER 269 CO -0.04 0.70 0.44 -0.07 -0.87 0.00 0.00 176.83 177.00 3dak h LEU 270 N 0.06 0.74 -0.89 5.97 3.38 -1.13 -2.91 115.31 120.52 3dak h LEU 270 Ca -0.01 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 3dak h LEU 270 Cb 1.13 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 3dak h LEU 270 CO 0.09 0.52 -0.20 0.00 0.09 0.00 0.00 178.44 178.93 3dak n LEU 272 N -4.14 6.78 -4.33 0.00 4.77 -0.35 -3.88 117.00 115.85 3dak n LEU 272 Ca 0.00 -5.32 -0.32 0.00 -0.03 0.00 0.00 56.01 50.33 3dak n LEU 272 Cb 0.39 -1.18 -0.15 0.00 -2.33 0.00 0.00 43.42 40.14 3dak n LEU 272 CO 0.42 1.90 -0.50 -1.10 -1.33 0.00 0.00 177.39 176.79 3dak s GLN 273 N -3.59 2.98 0.52 3.23 -0.21 -1.26 -4.70 119.66 116.62 3dak s GLN 273 Ca 0.36 -0.78 0.19 0.00 0.02 0.00 0.00 55.36 55.15 3dak s GLN 273 Cb 0.13 -2.41 1.33 0.00 1.00 0.00 0.00 33.01 33.06 3dak s GLN 273 CO -0.02 0.31 2.12 0.87 -2.12 0.00 0.00 175.29 176.45 3dak h LYS 274 N 6.34 0.00 -5.27 2.91 1.79 -1.96 -3.39 116.57 116.99 3dak h LYS 274 Ca -0.29 0.00 -0.66 0.00 -2.18 0.00 0.00 60.65 57.52 3dak h LYS 274 Cb 1.20 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 31.69 3dak h LYS 274 CO 0.51 0.06 0.23 0.34 -1.08 0.00 0.00 179.45 179.51 3dak s ASP 275 N -6.78 6.26 0.30 0.86 -1.08 -1.26 -4.95 116.67 110.02 3dak s ASP 275 Ca -0.05 -0.73 0.06 0.00 -0.52 0.00 0.00 52.55 51.32 3dak s ASP 275 Cb 0.16 -2.34 0.79 0.00 -1.46 0.00 0.00 42.92 40.07 3dak s ASP 275 CO 0.64 -1.01 1.71 1.55 0.52 0.00 0.00 175.17 178.58 3dak h PRO 276 N 9.11 0.46 0.00 4.34 0.13 -1.96 -0.91 132.00 143.16 3dak h PRO 276 Ca -0.27 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.82 3dak h PRO 276 Cb 1.09 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.11 3dak h PRO 276 CO 1.01 0.30 -0.03 0.93 -0.23 0.00 0.00 178.00 179.98 3dak h GLU 277 N 0.47 0.00 0.00 0.86 3.07 -1.94 -1.27 114.58 115.78 3dak h GLU 277 Ca 0.59 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.45 3dak h GLU 277 Cb 1.12 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.03 3dak h GLU 277 CO -0.51 0.03 -0.02 0.87 -1.40 0.00 0.00 179.01 177.98 3dak h LYS 278 N 0.00 0.00 -6.85 2.33 1.57 -1.54 -3.45 116.57 108.62 3dak h LYS 278 Ca -0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 3dak h LYS 278 Cb 0.07 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.40 3dak h LYS 278 CO 0.00 0.02 0.46 1.03 -0.57 0.00 0.00 179.45 180.40 3dak s ARG 279 N -3.54 4.50 0.87 3.15 0.52 -0.48 -5.00 118.95 118.98 3dak s ARG 279 Ca 0.03 1.74 -0.12 0.00 -0.52 0.00 0.00 55.73 56.86 3dak s ARG 279 Cb 0.08 -3.02 0.12 0.00 0.52 0.00 0.00 34.95 32.65 3dak s ARG 279 CO 0.59 0.11 1.12 -1.25 0.02 0.00 0.00 175.30 175.88 3dak s PRO 280 N -1.72 1.44 0.64 3.54 0.04 -1.26 -5.06 135.00 132.62 3dak s PRO 280 Ca 0.48 0.45 -0.07 0.00 0.04 0.00 0.00 61.00 61.90 3dak s PRO 280 Cb -0.30 -1.86 0.02 0.00 0.04 0.00 0.00 34.50 32.40 3dak s PRO 280 CO 0.38 -2.02 0.96 0.95 0.04 0.00 0.00 177.00 177.31 3dak s THR 281 N -3.20 3.36 0.26 1.26 -4.23 -1.26 -4.92 115.64 106.92 3dak s THR 281 Ca 0.63 0.06 -0.03 0.00 -1.18 0.00 0.00 61.69 61.17 3dak s THR 281 Cb -0.15 -3.38 0.13 0.00 1.34 0.00 0.00 72.50 70.45 3dak s THR 281 CO 0.54 -0.41 1.78 0.00 -0.54 0.00 0.00 174.62 175.99 3dak h ALA 282 N -0.36 1.13 -0.41 3.99 0.00 -1.95 -1.80 119.26 119.87 3dak h ALA 282 Ca -0.45 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.31 3dak h ALA 282 Cb 1.27 -0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.75 3dak h ALA 282 CO 0.61 0.57 -0.26 0.00 0.00 0.00 0.00 179.25 180.17 3dak h ALA 283 N 1.27 -0.03 -0.63 0.00 0.00 -1.94 -0.76 119.26 117.17 3dak h ALA 283 Ca 0.17 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 3dak h ALA 283 Cb 0.36 0.60 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 3dak h ALA 283 CO 0.01 -0.64 0.33 0.93 0.00 0.00 0.00 179.25 179.87 3dak h GLU 284 N -0.19 0.89 -0.67 0.00 5.08 -1.87 -2.82 114.58 115.01 3dak h GLU 284 Ca 0.19 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3dak h GLU 284 Cb 0.49 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 3dak h GLU 284 CO -0.52 0.70 0.42 -0.07 -1.00 0.00 0.00 179.01 178.54 3dak h LEU 285 N 0.86 0.78 -2.18 1.33 3.38 -0.98 -1.88 115.31 116.61 3dak h LEU 285 Ca 0.22 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.20 3dak h LEU 285 Cb 0.08 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3dak h LEU 285 CO -0.03 0.58 0.13 -0.07 0.09 0.00 0.00 178.44 179.14 3dak h LEU 286 N 0.91 0.00 -0.45 1.67 3.38 -0.87 -0.85 115.31 119.10 3dak h LEU 286 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3dak h LEU 286 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3dak h LEU 286 CO -0.05 0.00 -0.22 0.54 0.09 0.00 0.00 178.44 178.80 3dak n ARG 287 N -4.11 0.82 -1.83 1.13 1.74 -0.72 -4.84 116.66 108.84 3dak n ARG 287 Ca 0.01 -0.45 -0.37 0.00 -0.77 0.00 0.00 57.85 56.26 3dak n ARG 287 Cb 0.25 -1.49 0.05 0.00 -1.02 0.00 0.00 32.46 30.25 3dak n ARG 287 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 3dak s HIS 288 N -2.49 2.26 0.50 -1.55 2.46 -0.33 -4.90 115.29 111.24 3dak s HIS 288 Ca 0.25 1.44 0.33 0.00 0.47 0.00 0.00 55.06 57.55 3dak s HIS 288 Cb 0.19 -3.69 1.78 0.00 -0.13 0.00 0.00 32.58 30.73 3dak s HIS 288 CO 0.51 -2.72 2.19 -0.22 -2.47 0.00 0.00 174.74 172.02 3dak h LYS 289 N 1.09 0.00 -0.44 2.88 3.64 -1.92 -2.59 116.57 119.22 3dak h LYS 289 Ca -0.51 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 58.73 3dak h LYS 289 Cb 1.31 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.12 3dak h LYS 289 CO 0.56 0.05 -0.29 0.35 -2.27 0.00 0.00 179.45 177.85 3dak h PHE 290 N 0.00 1.15 0.00 1.91 3.57 -1.91 -2.85 116.94 118.81 3dak h PHE 290 Ca -0.00 -0.31 0.00 0.00 3.53 0.00 0.00 57.97 61.19 3dak h PHE 290 Cb 0.18 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.66 3dak h PHE 290 CO 0.00 1.14 0.00 1.19 -2.23 0.00 0.00 178.31 178.41 3dak n PHE 291 N -4.09 0.00 0.55 0.41 3.01 -0.98 -1.74 117.46 114.63 3dak n PHE 291 Ca -0.01 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.58 3dak n PHE 291 Cb 0.50 0.00 0.44 0.00 -0.01 0.00 0.00 39.48 40.41 3dak n PHE 291 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3dak n GLN 292 N -0.93 0.23 0.00 -1.08 6.02 -1.08 -3.02 117.38 117.53 3dak n GLN 292 Ca 0.11 0.29 0.15 0.00 -0.01 0.00 0.00 57.00 57.53 3dak n GLN 292 Cb 0.05 -1.82 0.71 0.00 1.02 0.00 0.00 30.24 30.20 3dak n GLN 292 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3dak n LYS 293 N -2.24 0.45 -2.31 -1.09 5.02 -0.71 -4.85 118.16 112.42 3dak n LYS 293 Ca 0.04 -0.05 -0.38 0.00 -2.02 0.00 0.00 58.31 55.91 3dak n LYS 293 Cb 0.35 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.85 3dak n LYS 293 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dak s ALA 294 N -2.58 3.09 -2.48 7.82 0.00 -1.17 -4.27 121.76 122.16 3dak s ALA 294 Ca 0.27 0.92 0.20 0.00 0.00 0.00 0.00 51.96 53.36 3dak s ALA 294 Cb 0.20 -3.37 0.16 0.00 0.00 0.00 0.00 23.12 20.11 3dak s ALA 294 CO 0.47 -0.53 1.13 1.17 0.00 0.00 0.00 175.76 178.01