#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dr3 s ARG 3 N 0.00 4.12 0.06 -0.78 0.52 -1.26 -4.90 118.95 116.71 2dr3 s ARG 3 Ca 0.00 2.20 0.06 0.00 -0.52 0.00 0.00 55.73 57.47 2dr3 s ARG 3 Cb 0.00 -2.88 -0.04 0.00 0.52 0.00 0.00 34.95 32.55 2dr3 s ARG 3 CO 0.00 -0.38 -0.09 1.03 0.02 0.00 0.00 175.30 175.88 2dr3 s ARG 4 N -2.07 2.30 -0.26 3.54 1.81 -1.26 -0.85 118.95 122.16 2dr3 s ARG 4 Ca 0.54 -0.90 -0.09 0.00 -1.72 0.00 0.00 55.73 53.56 2dr3 s ARG 4 Cb -0.39 -2.38 -0.04 0.00 -0.45 0.00 0.00 34.95 31.69 2dr3 s ARG 4 CO 0.51 0.55 0.12 0.08 -0.68 0.00 0.00 175.30 175.88 2dr3 s VAL 5 N -1.11 4.73 -0.17 3.52 1.01 0.11 -4.85 120.40 123.64 2dr3 s VAL 5 Ca 0.19 -0.03 -0.29 0.00 0.00 0.00 0.00 61.98 61.86 2dr3 s VAL 5 Cb -0.11 -3.23 -0.00 0.00 0.00 0.00 0.00 36.38 33.04 2dr3 s VAL 5 CO 0.11 0.31 1.00 -0.54 0.00 0.00 0.00 175.10 175.97 2dr3 s LYS 6 N 1.61 4.34 0.22 2.72 -0.14 -1.26 -1.50 119.74 125.72 2dr3 s LYS 6 Ca 0.06 1.32 0.08 0.00 -1.36 0.00 0.00 55.97 56.08 2dr3 s LYS 6 Cb -0.15 -3.59 0.16 0.00 -1.68 0.00 0.00 37.83 32.57 2dr3 s LYS 6 CO 0.06 -0.45 1.49 1.79 -0.76 0.00 0.00 175.35 177.49 2dr3 h THR 7 N 5.26 1.51 0.00 2.17 1.35 -1.92 -3.45 112.91 117.83 2dr3 h THR 7 Ca -0.26 -2.50 0.00 0.00 -0.55 0.00 0.00 66.41 63.10 2dr3 h THR 7 Cb 1.11 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 69.88 2dr3 h THR 7 CO 0.90 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 177.50 2dr3 n GLY 8 N 0.61 2.06 3.65 5.82 0.00 -1.26 -4.48 105.19 111.59 2dr3 n GLY 8 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2dr3 n GLY 8 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dr3 s ILE 9 N -3.36 4.40 -0.23 -0.61 1.01 -1.26 -4.92 121.20 116.24 2dr3 s ILE 9 Ca 0.00 1.65 -0.43 0.00 0.00 0.00 0.00 60.65 61.88 2dr3 s ILE 9 Cb 0.00 -4.22 -0.19 0.00 0.01 0.00 0.00 42.46 38.06 2dr3 s ILE 9 CO 0.00 -0.31 1.37 -2.65 0.00 0.00 0.00 174.94 173.34 2dr3 n PRO 10 N 6.77 0.17 0.00 2.79 -0.02 -1.26 -1.12 135.00 142.33 2dr3 n PRO 10 Ca 0.13 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 2dr3 n PRO 10 Cb 0.46 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 2dr3 n PRO 10 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dr3 n GLY 11 N 2.84 2.62 0.08 -1.23 0.00 -1.25 -0.58 105.19 107.68 2dr3 n GLY 11 Ca 0.25 -0.02 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 2dr3 n GLY 11 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2dr3 h VAL 12 N 0.00 1.18 0.00 1.61 2.07 -1.41 -0.99 116.25 118.72 2dr3 h VAL 12 Ca 0.00 -0.55 -0.05 0.00 0.82 0.00 0.00 66.70 66.92 2dr3 h VAL 12 Cb 0.00 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 2dr3 h VAL 12 CO 0.00 0.16 -0.23 0.44 0.02 0.00 0.00 177.57 177.96 2dr3 h ASP 13 N -0.04 0.00 0.00 0.57 3.32 -1.91 0.36 116.42 118.72 2dr3 h ASP 13 Ca 0.03 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 2dr3 h ASP 13 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2dr3 h ASP 13 CO -0.00 0.23 -0.00 -0.33 -1.72 0.00 0.00 179.24 177.42 2dr3 h GLU 14 N 0.00 -0.00 -0.11 3.56 3.07 -1.86 0.21 114.58 119.44 2dr3 h GLU 14 Ca -0.00 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.87 2dr3 h GLU 14 Cb 0.45 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2dr3 h GLU 14 CO 0.03 0.34 0.08 0.82 -1.40 0.00 0.00 179.01 178.88 2dr3 h ILE 15 N -0.35 0.99 -0.41 3.13 2.04 -0.47 -0.60 117.51 121.85 2dr3 h ILE 15 Ca -0.00 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2dr3 h ILE 15 Cb 0.35 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2dr3 h ILE 15 CO 0.00 0.01 0.00 0.18 0.00 0.00 0.00 178.15 178.35 2dr3 n LEU 16 N -4.52 2.74 -3.85 1.44 4.77 0.05 -1.10 117.00 116.53 2dr3 n LEU 16 Ca -0.01 -1.38 -0.26 0.00 -0.03 0.00 0.00 56.01 54.34 2dr3 n LEU 16 Cb 0.14 -0.38 0.01 0.00 -2.33 0.00 0.00 43.42 40.86 2dr3 n LEU 16 CO 0.34 0.55 -0.05 1.41 -1.33 0.00 0.00 177.39 178.31 2dr3 n HIS 17 N 0.65 -1.96 0.00 -1.77 8.25 -0.23 -3.17 115.22 116.99 2dr3 n HIS 17 Ca 0.15 0.84 0.00 0.00 -0.26 0.00 0.00 57.72 58.45 2dr3 n HIS 17 Cb 0.49 -4.03 0.00 0.00 1.12 0.00 0.00 29.99 27.57 2dr3 n HIS 17 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dr3 n GLY 18 N -1.69 1.27 0.00 -1.41 0.00 0.70 -4.97 105.19 99.09 2dr3 n GLY 18 Ca -0.18 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2dr3 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dr3 n GLY 19 N 0.00 0.91 3.68 -0.02 0.00 -1.19 -4.68 105.19 103.90 2dr3 n GLY 19 Ca 0.00 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 2dr3 n GLY 19 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dr3 s ILE 20 N -1.01 3.84 0.16 -0.61 1.01 -0.56 -4.66 121.20 119.37 2dr3 s ILE 20 Ca 0.00 1.19 -0.32 0.00 0.00 0.00 0.00 60.65 61.51 2dr3 s ILE 20 Cb 0.00 -3.76 -0.12 0.00 0.01 0.00 0.00 42.46 38.59 2dr3 s ILE 20 CO 0.00 -0.02 1.75 -2.65 0.00 0.00 0.00 174.94 174.02 2dr3 n PRO 21 N 5.59 2.67 -1.51 2.79 -0.02 -1.26 0.06 135.00 143.32 2dr3 n PRO 21 Ca 0.13 0.97 -0.51 0.00 -2.02 0.00 0.00 63.50 62.07 2dr3 n PRO 21 Cb 0.44 -2.82 -0.04 0.00 -0.02 0.00 0.00 33.50 31.06 2dr3 n PRO 21 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2dr3 n GLU 22 N 4.54 0.59 -0.83 -0.52 2.13 -0.03 -1.44 120.64 125.08 2dr3 n GLU 22 Ca 0.17 0.21 0.00 0.00 0.66 0.00 0.00 57.16 58.20 2dr3 n GLU 22 Cb 0.35 -1.56 0.00 0.00 0.27 0.00 0.00 31.44 30.50 2dr3 n GLU 22 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2dr3 n ARG 23 N 1.41 0.00 -2.18 5.31 1.74 -1.24 -5.01 116.66 116.69 2dr3 n ARG 23 Ca 0.17 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.87 2dr3 n ARG 23 Cb 0.22 -2.83 0.00 0.00 -1.02 0.00 0.00 32.46 28.83 2dr3 n ARG 23 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2dr3 s ASN 24 N -2.86 5.99 -0.28 0.55 -0.87 -0.52 -4.59 114.94 112.35 2dr3 s ASN 24 Ca 0.00 2.37 -0.08 0.00 -1.57 0.00 0.00 52.86 53.58 2dr3 s ASN 24 Cb 0.00 -2.61 -0.01 0.00 -0.02 0.00 0.00 41.25 38.61 2dr3 s ASN 24 CO 0.00 -1.05 0.10 -0.69 -2.57 0.00 0.00 177.10 172.89 2dr3 s VAL 25 N -1.52 4.33 -0.23 1.60 1.01 -1.26 -1.86 120.40 122.47 2dr3 s VAL 25 Ca 0.66 -0.38 -0.07 0.00 0.00 0.00 0.00 61.98 62.19 2dr3 s VAL 25 Cb -0.30 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 2dr3 s VAL 25 CO 0.36 0.19 0.05 -0.69 0.00 0.00 0.00 175.10 175.01 2dr3 s VAL 26 N 1.59 4.32 -0.26 2.92 1.01 0.18 -1.51 120.40 128.65 2dr3 s VAL 26 Ca 0.05 -0.18 -0.26 0.00 0.00 0.00 0.00 61.98 61.59 2dr3 s VAL 26 Cb -0.16 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.23 2dr3 s VAL 26 CO 0.04 0.38 0.92 -0.22 0.00 0.00 0.00 175.10 176.22 2dr3 s LEU 27 N 1.27 4.06 -0.46 3.92 2.96 0.59 -0.07 118.68 130.95 2dr3 s LEU 27 Ca 0.05 1.07 -0.14 0.00 -0.22 0.00 0.00 54.13 54.89 2dr3 s LEU 27 Cb -0.15 -3.33 0.07 0.00 0.50 0.00 0.00 46.19 43.29 2dr3 s LEU 27 CO 0.03 -0.64 0.37 -0.22 -1.32 0.00 0.00 176.35 174.57 2dr3 s LEU 28 N 3.10 5.53 0.01 -0.68 2.96 0.18 -0.51 118.68 129.26 2dr3 s LEU 28 Ca 0.39 -1.37 0.03 0.00 -0.22 0.00 0.00 54.13 52.96 2dr3 s LEU 28 Cb -0.14 -2.14 -0.03 0.00 0.50 0.00 0.00 46.19 44.37 2dr3 s LEU 28 CO 0.09 -0.63 -0.07 -0.55 -1.32 0.00 0.00 176.35 173.88 2dr3 s SER 29 N 2.51 4.63 0.00 3.68 0.15 -0.07 -0.54 113.70 124.06 2dr3 s SER 29 Ca 0.04 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.54 2dr3 s SER 29 Cb -0.24 -1.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.99 2dr3 s SER 29 CO 0.06 0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.38 2dr3 n GLY 30 N 1.50 1.90 1.85 9.45 0.00 -1.11 -0.99 105.19 117.78 2dr3 n GLY 30 Ca -0.15 -0.80 -0.15 0.00 0.00 0.00 0.00 46.02 44.92 2dr3 n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dr3 n GLY 31 N -0.54 -2.26 3.76 -0.02 0.00 -1.25 -2.72 105.19 102.16 2dr3 n GLY 31 Ca 0.00 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.08 2dr3 n GLY 31 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dr3 s PRO 32 N -4.33 4.39 -0.73 1.61 0.04 -1.26 -3.36 135.00 131.35 2dr3 s PRO 32 Ca 0.37 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.56 2dr3 s PRO 32 Cb -0.03 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.41 2dr3 s PRO 32 CO 0.28 -0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.56 2dr3 n GLY 33 N 1.15 0.56 0.35 0.56 0.00 -1.26 -4.92 105.19 101.63 2dr3 n GLY 33 Ca 0.01 -0.64 0.13 0.00 0.00 0.00 0.00 46.02 45.51 2dr3 n GLY 33 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dr3 n THR 34 N -3.33 0.00 -0.33 2.61 -2.24 -1.22 -4.96 114.28 104.82 2dr3 n THR 34 Ca -0.08 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2dr3 n THR 34 Cb 0.39 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.26 2dr3 n THR 34 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dr3 n GLY 35 N 1.34 0.80 0.23 3.38 0.00 -1.26 -4.77 105.19 104.91 2dr3 n GLY 35 Ca 0.12 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.70 2dr3 n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dr3 h LYS 36 N 0.21 0.76 -0.22 1.61 1.57 -1.92 -2.03 116.57 116.55 2dr3 h LYS 36 Ca 0.00 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.52 2dr3 h LYS 36 Cb 0.00 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 2dr3 h LYS 36 CO 0.00 0.81 0.01 1.15 -0.57 0.00 0.00 179.45 180.84 2dr3 h THR 37 N 0.61 1.25 -0.80 -0.16 2.02 -1.98 -1.76 112.91 112.08 2dr3 h THR 37 Ca 0.13 -0.86 0.02 0.00 0.77 0.00 0.00 66.41 66.47 2dr3 h THR 37 Cb 0.44 1.39 -0.04 0.00 -1.74 0.00 0.00 68.15 68.21 2dr3 h THR 37 CO 0.02 0.27 0.53 0.40 0.37 0.00 0.00 175.52 177.10 2dr3 h ILE 38 N 0.15 1.18 -0.11 3.11 2.04 -1.99 -2.02 117.51 119.86 2dr3 h ILE 38 Ca 0.06 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 2dr3 h ILE 38 Cb 0.39 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 2dr3 h ILE 38 CO 0.01 0.19 0.07 0.15 0.00 0.00 0.00 178.15 178.57 2dr3 h PHE 39 N 1.06 0.15 -0.10 1.37 3.04 -1.28 -1.54 116.94 119.64 2dr3 h PHE 39 Ca 0.30 -0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.18 2dr3 h PHE 39 Cb -0.08 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 38.37 2dr3 h PHE 39 CO -0.02 0.16 -0.26 0.66 -2.02 0.00 0.00 178.31 176.83 2dr3 h SER 40 N 0.11 0.17 0.37 0.41 4.64 -1.05 -1.92 113.55 116.28 2dr3 h SER 40 Ca 0.04 -0.05 -0.23 0.00 -0.47 0.00 0.00 61.79 61.08 2dr3 h SER 40 Cb 0.05 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2dr3 h SER 40 CO -0.01 0.43 -0.97 1.56 -0.87 0.00 0.00 176.83 176.98 2dr3 h GLN 41 N 0.16 0.39 -0.46 4.77 4.20 -1.25 -2.65 115.11 120.27 2dr3 h GLN 41 Ca 0.03 -0.43 -0.05 0.00 0.06 0.00 0.00 58.65 58.25 2dr3 h GLN 41 Cb 0.55 0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 2dr3 h GLN 41 CO 0.04 1.11 0.09 0.37 -0.67 0.00 0.00 178.83 179.77 2dr3 h GLN 42 N 0.21 0.70 -0.79 1.46 4.15 -0.97 0.87 115.11 120.74 2dr3 h GLN 42 Ca -0.08 -0.14 -0.05 0.00 0.77 0.00 0.00 58.65 59.15 2dr3 h GLN 42 Cb 1.61 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 29.16 2dr3 h GLN 42 CO 0.17 0.65 0.31 0.35 -1.93 0.00 0.00 178.83 178.38 2dr3 h PHE 43 N 0.68 1.21 -0.02 3.99 3.57 -1.23 -1.40 116.94 123.74 2dr3 h PHE 43 Ca 0.15 -0.09 -0.22 0.00 3.53 0.00 0.00 57.97 61.34 2dr3 h PHE 43 Cb 0.28 -0.36 0.02 0.00 2.79 0.00 0.00 35.95 38.67 2dr3 h PHE 43 CO 0.01 0.92 -0.85 -0.07 -2.23 0.00 0.00 178.31 176.09 2dr3 h LEU 44 N 1.16 0.78 0.01 0.59 3.38 -0.99 -2.98 115.31 117.27 2dr3 h LEU 44 Ca 0.26 -0.73 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 2dr3 h LEU 44 Cb 0.22 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2dr3 h LEU 44 CO -0.02 1.41 -0.01 -0.25 0.09 0.00 0.00 178.44 179.66 2dr3 h TRP 45 N 0.24 -0.02 -0.75 1.13 2.91 -0.75 -2.09 115.95 116.61 2dr3 h TRP 45 Ca -0.10 -0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.01 2dr3 h TRP 45 Cb 1.52 0.01 -0.05 0.00 -0.51 0.00 0.00 29.16 30.12 2dr3 h TRP 45 CO 0.12 0.05 0.49 -0.91 -1.03 0.00 0.00 178.44 177.16 2dr3 h ASN 46 N -0.08 0.60 -0.21 2.65 2.35 -1.36 -1.03 115.58 118.50 2dr3 h ASN 46 Ca -0.00 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2dr3 h ASN 46 Cb 0.07 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 2dr3 h ASN 46 CO 0.00 0.37 0.13 1.23 -1.65 0.00 0.00 177.43 177.51 2dr3 h GLY 47 N 0.67 0.31 0.45 2.83 0.00 -1.24 -2.42 103.07 103.67 2dr3 h GLY 47 Ca 0.34 -0.13 0.06 0.00 0.00 0.00 0.00 47.33 47.61 2dr3 h GLY 47 CO -0.12 0.12 -0.01 1.41 0.00 0.00 0.00 176.54 177.94 2dr3 h LEU 48 N 0.27 -0.16 -2.35 3.11 3.38 -0.60 0.33 115.31 119.29 2dr3 h LEU 48 Ca 0.08 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2dr3 h LEU 48 Cb 0.01 0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2dr3 h LEU 48 CO -0.01 -0.04 0.14 0.11 0.09 0.00 0.00 178.44 178.72 2dr3 h LYS 49 N 0.08 0.00 -0.23 1.13 1.57 -1.07 0.22 116.57 118.28 2dr3 h LYS 49 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2dr3 h LYS 49 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2dr3 h LYS 49 CO -0.28 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.27 2dr3 n MET 50 N -2.86 2.05 -0.85 3.15 2.81 0.93 -4.96 117.12 117.38 2dr3 n MET 50 Ca -0.02 -1.92 0.00 0.00 -1.81 0.00 0.00 57.70 53.94 2dr3 n MET 50 Cb 0.19 -1.40 0.00 0.00 -0.71 0.00 0.00 33.22 31.30 2dr3 n MET 50 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dr3 n GLY 51 N 1.13 0.53 3.47 3.03 0.00 0.79 -5.02 105.19 109.12 2dr3 n GLY 51 Ca 0.14 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 2dr3 n GLY 51 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dr3 s GLU 52 N -0.74 3.05 0.36 1.61 2.02 0.10 -4.97 118.70 120.15 2dr3 s GLU 52 Ca 0.00 -0.94 -0.28 0.00 0.02 0.00 0.00 54.97 53.77 2dr3 s GLU 52 Cb 0.00 -3.96 -0.11 0.00 0.10 0.00 0.00 34.13 30.17 2dr3 s GLU 52 CO 0.00 -0.72 1.47 -2.14 0.02 0.00 0.00 175.26 173.89 2dr3 s PRO 53 N 1.74 4.14 0.15 0.39 0.02 -1.26 -3.11 135.00 137.07 2dr3 s PRO 53 Ca 0.06 2.52 0.05 0.00 0.02 0.00 0.00 61.00 63.65 2dr3 s PRO 53 Cb -0.19 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 2dr3 s PRO 53 CO 0.10 -0.49 -0.10 0.20 -0.33 0.00 0.00 177.00 176.37 2dr3 s GLY 54 N -0.13 1.08 -0.04 0.52 0.00 -0.92 -0.05 107.32 107.78 2dr3 s GLY 54 Ca 0.53 -1.49 0.02 0.00 0.00 0.00 0.00 44.72 43.78 2dr3 s GLY 54 CO 0.60 -1.59 -0.07 -0.42 0.00 0.00 0.00 173.10 171.63 2dr3 s ILE 55 N -3.25 0.72 -0.27 0.90 1.01 0.52 -1.88 121.20 118.95 2dr3 s ILE 55 Ca 0.16 -0.25 -0.03 0.00 0.00 0.00 0.00 60.65 60.53 2dr3 s ILE 55 Cb 0.02 -0.69 0.03 0.00 0.01 0.00 0.00 42.46 41.83 2dr3 s ILE 55 CO 0.01 0.26 -0.01 -0.47 0.00 0.00 0.00 174.94 174.72 2dr3 s TYR 56 N 0.69 3.13 -0.47 3.97 6.14 -0.60 -0.32 117.35 129.89 2dr3 s TYR 56 Ca -0.11 -1.50 -0.20 0.00 0.64 0.00 0.00 57.07 55.90 2dr3 s TYR 56 Cb -0.14 -2.12 0.04 0.00 0.42 0.00 0.00 41.96 40.17 2dr3 s TYR 56 CO 0.01 -0.72 0.64 0.08 0.64 0.00 0.00 175.55 176.20 2dr3 s VAL 57 N 1.35 4.84 -0.29 3.14 1.01 0.15 -1.28 120.40 129.32 2dr3 s VAL 57 Ca -0.01 -0.19 -0.20 0.00 0.00 0.00 0.00 61.98 61.58 2dr3 s VAL 57 Cb -0.18 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 2dr3 s VAL 57 CO -0.02 -0.71 0.63 0.00 0.00 0.00 0.00 175.10 175.00 2dr3 s ALA 58 N 2.75 3.55 0.00 5.51 0.00 -0.45 -0.98 121.76 132.14 2dr3 s ALA 58 Ca 0.19 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.55 2dr3 s ALA 58 Cb -0.17 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.87 2dr3 s ALA 58 CO 0.15 -1.02 0.33 1.28 0.00 0.00 0.00 175.76 176.51 2dr3 n LEU 59 N 5.85 0.66 -0.02 0.00 4.32 0.13 -1.52 117.00 126.42 2dr3 n LEU 59 Ca -0.01 -0.78 0.01 0.00 -0.02 0.00 0.00 56.01 55.21 2dr3 n LEU 59 Cb 0.49 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.21 2dr3 n LEU 59 CO 0.45 0.17 -0.71 -0.62 -1.22 0.00 0.00 177.39 175.46 2dr3 n GLU 60 N -0.24 1.22 -3.99 3.23 -0.58 -1.09 -4.66 120.64 114.52 2dr3 n GLU 60 Ca 0.00 -0.06 -0.09 0.00 -0.42 0.00 0.00 57.16 56.59 2dr3 n GLU 60 Cb 0.02 -1.25 -0.08 0.00 -0.57 0.00 0.00 31.44 29.55 2dr3 n GLU 60 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2dr3 s GLU 61 N -2.52 0.93 0.37 3.49 2.02 -1.26 -5.11 118.70 116.62 2dr3 s GLU 61 Ca -0.04 -1.17 -0.25 0.00 0.02 0.00 0.00 54.97 53.52 2dr3 s GLU 61 Cb 0.05 0.31 -0.09 0.00 0.10 0.00 0.00 34.13 34.50 2dr3 s GLU 61 CO 0.43 -0.29 1.02 -1.58 0.02 0.00 0.00 175.26 174.86 2dr3 s HIS 62 N -3.95 3.41 0.47 1.61 5.65 -1.26 -4.73 115.29 116.49 2dr3 s HIS 62 Ca 0.13 1.68 0.25 0.00 0.25 0.00 0.00 55.06 57.38 2dr3 s HIS 62 Cb 0.05 -3.07 1.28 0.00 -1.18 0.00 0.00 32.58 29.66 2dr3 s HIS 62 CO -0.05 -0.37 1.82 -1.35 -0.65 0.00 0.00 174.74 174.15 2dr3 h PRO 63 N 2.77 0.21 -0.50 2.88 0.11 -1.92 -0.12 132.00 135.43 2dr3 h PRO 63 Ca -0.48 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.63 2dr3 h PRO 63 Cb 1.21 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 2dr3 h PRO 63 CO 0.63 0.14 0.32 0.28 -0.21 0.00 0.00 178.00 179.17 2dr3 h VAL 64 N 0.22 1.11 -0.17 3.15 2.07 -2.00 -0.42 116.25 120.21 2dr3 h VAL 64 Ca 0.52 -0.23 -0.16 0.00 0.82 0.00 0.00 66.70 67.66 2dr3 h VAL 64 Cb 1.64 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2dr3 h VAL 64 CO -0.14 0.12 -0.55 1.56 0.02 0.00 0.00 177.57 178.57 2dr3 h GLN 65 N 0.66 0.51 -0.89 1.57 7.50 -1.42 -2.69 115.11 120.34 2dr3 h GLN 65 Ca 0.19 -0.32 -0.02 0.00 0.50 0.00 0.00 58.65 58.99 2dr3 h GLN 65 Cb -0.05 0.04 -0.04 0.00 0.05 0.00 0.00 27.48 27.47 2dr3 h GLN 65 CO -0.05 0.93 0.48 0.28 -1.50 0.00 0.00 178.83 178.97 2dr3 h VAL 66 N 0.39 1.26 -0.52 -0.54 2.07 -0.83 0.10 116.25 118.18 2dr3 h VAL 66 Ca 0.01 -0.65 -0.06 0.00 0.82 0.00 0.00 66.70 66.82 2dr3 h VAL 66 Cb 1.09 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2dr3 h VAL 66 CO 0.10 0.29 0.10 0.03 0.02 0.00 0.00 177.57 178.12 2dr3 h ARG 67 N 1.25 0.85 -0.20 1.57 3.08 -1.02 -1.21 114.38 118.71 2dr3 h ARG 67 Ca 0.31 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 2dr3 h ARG 67 Cb 0.03 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2dr3 h ARG 67 CO -0.05 0.83 0.11 1.96 -1.07 0.00 0.00 179.97 181.75 2dr3 h GLN 68 N 0.74 0.27 -0.66 0.04 4.20 -1.07 -1.76 115.11 116.86 2dr3 h GLN 68 Ca 0.16 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 2dr3 h GLN 68 Cb 0.38 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 2dr3 h GLN 68 CO 0.01 0.24 0.13 -0.91 -0.67 0.00 0.00 178.83 177.63 2dr3 h ASN 69 N 0.22 1.02 -0.52 1.46 2.35 -0.67 -2.89 115.58 116.55 2dr3 h ASN 69 Ca 0.07 -0.22 -0.10 0.00 -0.55 0.00 0.00 56.30 55.49 2dr3 h ASN 69 Cb 0.05 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.13 2dr3 h ASN 69 CO -0.01 0.99 -0.06 0.24 -1.65 0.00 0.00 177.43 176.94 2dr3 h MET 70 N 1.01 0.99 -0.42 0.81 2.86 -1.09 -2.85 114.93 116.24 2dr3 h MET 70 Ca 0.21 -0.33 0.04 0.00 -2.06 0.00 0.00 59.70 57.56 2dr3 h MET 70 Cb 0.39 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 2dr3 h MET 70 CO 0.01 1.01 0.28 0.00 1.06 0.00 0.00 176.91 179.27 2dr3 h ALA 71 N 1.03 1.90 0.00 6.32 0.00 -1.12 -0.86 119.26 126.52 2dr3 h ALA 71 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2dr3 h ALA 71 Cb 0.60 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2dr3 h ALA 71 CO 0.04 0.04 0.00 1.04 0.00 0.00 0.00 179.25 180.37 2dr3 n GLN 72 N -4.48 0.06 0.00 0.00 6.02 -1.07 -1.45 117.38 116.45 2dr3 n GLN 72 Ca 0.05 0.19 0.09 0.00 -0.01 0.00 0.00 57.00 57.33 2dr3 n GLN 72 Cb 0.20 -1.50 0.03 0.00 1.02 0.00 0.00 30.24 29.99 2dr3 n GLN 72 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 2dr3 n PHE 73 N -1.45 0.00 -0.14 1.08 3.72 -0.43 -4.94 117.46 115.30 2dr3 n PHE 73 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2dr3 n PHE 73 Cb 0.18 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 2dr3 n PHE 73 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dr3 n GLY 74 N 1.19 0.92 3.07 1.37 0.00 -0.53 -4.64 105.19 106.58 2dr3 n GLY 74 Ca 0.09 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2dr3 n GLY 74 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dr3 s TRP 75 N -2.00 3.68 -0.54 1.61 0.51 -0.60 -4.98 118.94 116.63 2dr3 s TRP 75 Ca 0.00 -3.00 -0.24 0.00 -2.12 0.00 0.00 56.10 50.75 2dr3 s TRP 75 Cb 0.00 -3.13 0.04 0.00 -0.81 0.00 0.00 33.47 29.57 2dr3 s TRP 75 CO 0.00 -0.74 0.90 0.34 -0.51 0.00 0.00 176.95 176.94 2dr3 s ASP 76 N -0.13 6.34 0.18 2.95 3.68 -1.26 -3.04 116.67 125.39 2dr3 s ASP 76 Ca 0.24 -0.37 0.26 0.00 2.13 0.00 0.00 52.55 54.80 2dr3 s ASP 76 Cb -0.11 -2.42 0.74 0.00 -1.45 0.00 0.00 42.92 39.68 2dr3 s ASP 76 CO -0.10 -1.17 1.69 1.33 0.13 0.00 0.00 175.17 177.05 2dr3 n VAL 77 N 6.14 0.50 -0.08 1.11 0.24 -1.26 -4.26 118.33 120.73 2dr3 n VAL 77 Ca 0.01 -0.26 -0.12 0.00 -2.04 0.00 0.00 64.34 61.93 2dr3 n VAL 77 Cb 0.47 -0.48 -0.07 0.00 -1.47 0.00 0.00 33.84 32.30 2dr3 n VAL 77 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2dr3 h LYS 78 N 0.00 -0.41 -0.92 7.34 6.56 -1.97 0.22 116.57 127.39 2dr3 h LYS 78 Ca 0.00 0.03 0.24 0.00 -1.06 0.00 0.00 60.65 59.86 2dr3 h LYS 78 Cb 0.72 0.09 -0.06 0.00 -0.57 0.00 0.00 32.23 32.42 2dr3 h LYS 78 CO 0.00 -0.27 0.63 -1.35 -2.06 0.00 0.00 179.45 176.40 2dr3 h PRO 79 N -0.42 0.21 0.06 3.15 0.11 -2.01 -0.43 132.00 132.67 2dr3 h PRO 79 Ca 0.09 -0.01 -0.26 0.00 0.11 0.00 0.00 66.00 65.93 2dr3 h PRO 79 Cb 0.62 -0.05 0.01 0.00 0.11 0.00 0.00 31.00 31.69 2dr3 h PRO 79 CO -0.51 0.14 -1.10 1.88 -0.21 0.00 0.00 178.00 178.20 2dr3 h TYR 80 N 0.22 0.77 -0.22 0.65 0.05 -1.09 -3.06 116.97 114.28 2dr3 h TYR 80 Ca 0.47 -0.46 -0.07 0.00 0.05 0.00 0.00 58.73 58.72 2dr3 h TYR 80 Cb 1.47 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 39.13 2dr3 h TYR 80 CO -0.00 1.30 -0.16 0.93 -1.05 0.00 0.00 178.16 179.18 2dr3 h GLU 81 N 0.24 0.37 0.00 4.88 5.08 0.94 -0.85 114.58 125.24 2dr3 h GLU 81 Ca -0.13 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2dr3 h GLU 81 Cb 1.76 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.97 2dr3 h GLU 81 CO 0.20 0.53 -0.05 0.93 -1.00 0.00 0.00 179.01 179.62 2dr3 h GLU 82 N 0.34 0.00 -0.05 2.33 5.08 -1.38 -2.68 114.58 118.23 2dr3 h GLU 82 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2dr3 h GLU 82 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2dr3 h GLU 82 CO 0.03 0.05 0.00 1.63 -1.00 0.00 0.00 179.01 179.72 2dr3 n LYS 83 N -3.14 1.93 -2.32 2.33 5.02 -0.77 -4.94 118.16 116.27 2dr3 n LYS 83 Ca 0.02 -1.36 -0.11 0.00 -2.02 0.00 0.00 58.31 54.84 2dr3 n LYS 83 Cb 0.41 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 2dr3 n LYS 83 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dr3 n GLY 84 N 1.25 -0.03 0.06 0.72 0.00 -0.97 -4.92 105.19 101.30 2dr3 n GLY 84 Ca 0.17 -0.41 0.05 0.00 0.00 0.00 0.00 46.02 45.83 2dr3 n GLY 84 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dr3 n MET 85 N -2.12 3.21 -3.99 1.61 2.81 -0.40 -4.45 117.12 113.79 2dr3 n MET 85 Ca -0.11 -0.16 -0.09 0.00 -1.81 0.00 0.00 57.70 55.53 2dr3 n MET 85 Cb 0.59 -1.02 -0.10 0.00 -0.71 0.00 0.00 33.22 31.98 2dr3 n MET 85 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 2dr3 s PHE 86 N -1.83 0.31 -0.11 2.03 5.36 -1.21 -2.16 117.98 120.37 2dr3 s PHE 86 Ca 0.05 -0.68 -0.20 0.00 -0.96 0.00 0.00 56.93 55.14 2dr3 s PHE 86 Cb 0.08 -0.23 0.05 0.00 -0.34 0.00 0.00 43.02 42.58 2dr3 s PHE 86 CO 0.38 -0.32 0.50 0.00 -1.46 0.00 0.00 175.22 174.31 2dr3 s ALA 87 N -2.70 -1.25 -0.13 11.12 0.00 -0.79 -4.49 121.76 123.53 2dr3 s ALA 87 Ca -0.04 1.12 -0.00 0.00 0.00 0.00 0.00 51.96 53.04 2dr3 s ALA 87 Cb -0.01 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.68 2dr3 s ALA 87 CO -0.05 -0.27 -0.13 -1.64 0.00 0.00 0.00 175.76 173.66 2dr3 s MET 88 N -0.47 3.37 -0.24 0.00 -1.94 -1.26 -1.55 119.30 117.22 2dr3 s MET 88 Ca -0.06 -0.69 -0.08 0.00 -1.71 0.00 0.00 55.69 53.15 2dr3 s MET 88 Cb -0.03 -2.64 -0.04 0.00 2.01 0.00 0.00 34.83 34.13 2dr3 s MET 88 CO 0.04 0.19 0.09 0.08 -0.01 0.00 0.00 175.02 175.41 2dr3 s VAL 89 N 0.41 4.65 -0.85 -6.03 1.01 -0.40 -4.28 120.40 114.91 2dr3 s VAL 89 Ca -0.10 -0.06 -0.22 0.00 0.00 0.00 0.00 61.98 61.59 2dr3 s VAL 89 Cb -0.16 -3.16 0.08 0.00 0.00 0.00 0.00 36.38 33.14 2dr3 s VAL 89 CO 0.05 0.36 1.19 -0.62 0.00 0.00 0.00 175.10 176.08 2dr3 s ASP 90 N 1.27 6.39 -0.22 3.32 2.15 0.82 -1.34 116.67 129.06 2dr3 s ASP 90 Ca 0.05 -1.34 0.12 0.00 0.43 0.00 0.00 52.55 51.82 2dr3 s ASP 90 Cb -0.14 -2.47 0.43 0.00 -0.30 0.00 0.00 42.92 40.44 2dr3 s ASP 90 CO 0.04 -1.41 1.31 0.00 -0.17 0.00 0.00 175.17 174.94 2dr3 n ALA 91 N 7.92 3.54 -0.09 3.66 0.00 -0.58 -0.74 120.51 134.22 2dr3 n ALA 91 Ca 0.15 -3.03 -0.14 0.00 0.00 0.00 0.00 53.44 50.43 2dr3 n ALA 91 Cb 0.49 -0.52 -0.05 0.00 0.00 0.00 0.00 19.45 19.37 2dr3 n ALA 91 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2dr3 n PHE 92 N -1.12 0.00 -0.30 0.00 7.35 -0.76 -4.45 117.46 118.18 2dr3 n PHE 92 Ca 0.23 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.94 2dr3 n PHE 92 Cb 0.81 -0.57 0.09 0.00 0.35 0.00 0.00 39.48 40.16 2dr3 n PHE 92 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 2dr3 h THR 93 N -0.86 0.13 -0.36 -2.13 2.02 -1.88 0.23 112.91 110.05 2dr3 h THR 93 Ca -0.20 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.09 2dr3 h THR 93 Cb 1.08 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2dr3 h THR 93 CO -0.12 0.00 0.28 0.00 0.37 0.00 0.00 175.52 176.05 2dr3 h ALA 94 N 1.67 2.27 0.00 6.16 0.00 -1.83 -1.09 119.26 126.44 2dr3 h ALA 94 Ca 0.38 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 2dr3 h ALA 94 Cb 0.61 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2dr3 h ALA 94 CO -0.87 -0.47 -0.21 0.78 0.00 0.00 0.00 179.25 178.48 2dr3 h GLY 95 N 0.00 0.00 -4.84 0.00 0.00 -0.77 -3.25 103.07 94.22 2dr3 h GLY 95 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 47.11 2dr3 h GLY 95 CO -0.00 0.00 -1.02 0.29 0.00 0.00 0.00 176.54 175.80 2dr3 n ILE 96 N -4.20 1.60 -3.00 2.60 -5.35 -0.45 -5.16 119.36 105.40 2dr3 n ILE 96 Ca -0.02 -3.54 -0.14 0.00 -0.27 0.00 0.00 62.75 58.78 2dr3 n ILE 96 Cb 0.28 0.22 0.02 0.00 -1.74 0.00 0.00 39.64 38.42 2dr3 n ILE 96 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dr3 n GLY 97 N -0.43 -1.03 0.00 3.28 0.00 -0.96 -5.04 105.19 101.01 2dr3 n GLY 97 Ca 0.20 1.21 0.00 0.00 0.00 0.00 0.00 46.02 47.42 2dr3 n GLY 97 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2dr3 n GLU 103 N -0.37 0.00 -0.30 1.61 4.07 -1.26 -4.65 120.64 119.73 2dr3 n GLU 103 Ca 0.07 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.30 2dr3 n GLU 103 Cb 0.51 0.00 0.37 0.00 -0.06 0.00 0.00 31.44 32.26 2dr3 n GLU 103 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 2dr3 h LYS 104 N 0.00 0.67 -4.90 5.31 3.64 -2.03 -3.37 116.57 115.90 2dr3 h LYS 104 Ca 0.00 -0.04 -0.67 0.00 -1.27 0.00 0.00 60.65 58.67 2dr3 h LYS 104 Cb 0.00 -0.15 -0.33 0.00 -0.41 0.00 0.00 32.23 31.34 2dr3 h LYS 104 CO 0.00 0.45 -0.76 0.71 -2.27 0.00 0.00 179.45 177.58 2dr3 s TYR 105 N -5.71 3.10 -0.00 1.91 2.02 -1.26 -5.08 117.35 112.32 2dr3 s TYR 105 Ca -0.10 -1.73 0.01 0.00 -0.37 0.00 0.00 57.07 54.88 2dr3 s TYR 105 Cb 0.23 -2.03 -0.00 0.00 -0.40 0.00 0.00 41.96 39.76 2dr3 s TYR 105 CO 0.79 -0.77 -0.04 0.42 -1.57 0.00 0.00 175.55 174.38 2dr3 s ILE 106 N 1.27 0.29 -0.31 2.71 1.01 -1.26 -0.13 121.20 124.78 2dr3 s ILE 106 Ca -0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.41 2dr3 s ILE 106 Cb -0.17 -0.26 0.05 0.00 0.01 0.00 0.00 42.46 42.09 2dr3 s ILE 106 CO -0.05 0.05 0.03 -0.69 0.00 0.00 0.00 174.94 174.28 2dr3 s VAL 107 N -0.16 3.15 0.10 2.92 1.01 0.08 -4.93 120.40 122.58 2dr3 s VAL 107 Ca 0.01 -1.38 0.12 0.00 0.00 0.00 0.00 61.98 60.72 2dr3 s VAL 107 Cb -0.02 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 2dr3 s VAL 107 CO -0.00 -0.16 1.47 0.45 0.00 0.00 0.00 175.10 176.86 2dr3 h HIS 108 N 8.04 0.00 -3.34 5.22 -0.00 -1.94 -3.39 115.15 119.73 2dr3 h HIS 108 Ca -0.21 0.00 -0.37 0.00 -0.00 0.00 0.00 60.37 59.79 2dr3 h HIS 108 Cb 1.06 0.00 -0.38 0.00 -0.00 0.00 0.00 27.41 28.10 2dr3 h HIS 108 CO 0.61 0.69 -0.74 0.34 -0.00 0.00 0.00 177.93 178.82 2dr3 s ASP 109 N -6.63 1.00 -0.16 2.45 2.15 -1.26 -4.77 116.67 109.45 2dr3 s ASP 109 Ca 0.01 0.05 0.16 0.00 0.43 0.00 0.00 52.55 53.20 2dr3 s ASP 109 Cb 0.10 -0.17 0.58 0.00 -0.30 0.00 0.00 42.92 43.13 2dr3 s ASP 109 CO 0.77 -0.22 1.49 0.18 -0.17 0.00 0.00 175.17 177.22 2dr3 n LEU 110 N 5.06 4.24 -0.17 -1.34 4.77 -1.26 -4.41 117.00 123.89 2dr3 n LEU 110 Ca -0.08 -2.84 -0.02 0.00 -0.03 0.00 0.00 56.01 53.04 2dr3 n LEU 110 Cb 0.50 -0.54 0.08 0.00 -2.33 0.00 0.00 43.42 41.13 2dr3 n LEU 110 CO 0.10 0.68 0.93 0.74 -1.33 0.00 0.00 177.39 178.52 2dr3 h THR 111 N 2.48 0.74 -2.68 -5.08 2.02 -1.98 -3.43 112.91 104.98 2dr3 h THR 111 Ca 0.00 -0.10 -0.55 0.00 0.77 0.00 0.00 66.41 66.53 2dr3 h THR 111 Cb 1.48 0.42 -0.15 0.00 -1.74 0.00 0.00 68.15 68.16 2dr3 h THR 111 CO 0.25 0.05 -0.76 -1.81 0.37 0.00 0.00 175.52 173.63 2dr3 s ASP 112 N -5.34 3.10 0.00 4.18 -0.00 -1.26 -5.03 116.67 112.32 2dr3 s ASP 112 Ca -0.13 -0.99 0.31 0.00 -0.00 0.00 0.00 52.55 51.74 2dr3 s ASP 112 Cb 0.16 -0.22 1.61 0.00 -0.00 0.00 0.00 42.92 44.47 2dr3 s ASP 112 CO 0.73 -0.04 2.08 0.00 -0.00 0.00 0.00 175.17 177.94 2dr3 n ILE 113 N -0.33 0.00 0.21 0.77 0.13 -1.26 -4.25 119.36 114.62 2dr3 n ILE 113 Ca -0.08 -0.02 -0.15 0.00 -1.10 0.00 0.00 62.75 61.40 2dr3 n ILE 113 Cb 0.59 -0.38 -0.07 0.00 -0.84 0.00 0.00 39.64 38.95 2dr3 n ILE 113 CO 0.00 0.00 0.00 -0.09 2.80 0.00 0.00 176.55 179.26 2dr3 h ARG 114 N 0.23 -0.57 -0.04 9.51 9.65 -1.96 -1.80 114.38 129.39 2dr3 h ARG 114 Ca 0.00 0.04 -0.07 0.00 -1.10 0.00 0.00 59.98 58.85 2dr3 h ARG 114 Cb 0.19 0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 2dr3 h ARG 114 CO 0.00 -0.38 -0.28 1.49 2.80 0.00 0.00 179.97 183.60 2dr3 h GLU 115 N -0.60 0.07 -0.13 0.20 4.81 -1.83 -1.79 114.58 115.32 2dr3 h GLU 115 Ca -0.02 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2dr3 h GLU 115 Cb 0.53 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2dr3 h GLU 115 CO -0.02 0.35 0.07 0.35 -0.73 0.00 0.00 179.01 179.03 2dr3 h PHE 116 N 0.07 0.18 0.10 0.92 3.04 -1.74 -1.76 116.94 117.74 2dr3 h PHE 116 Ca 0.01 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 2dr3 h PHE 116 Cb 0.53 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 38.99 2dr3 h PHE 116 CO 0.00 0.19 -0.05 0.82 -2.02 0.00 0.00 178.31 177.25 2dr3 h ILE 117 N 0.11 0.99 -0.62 1.41 2.04 -0.98 -0.69 117.51 119.77 2dr3 h ILE 117 Ca 0.04 -0.34 0.12 0.00 1.00 0.00 0.00 64.86 65.68 2dr3 h ILE 117 Cb 0.07 1.21 -0.09 0.00 -0.74 0.00 0.00 36.82 37.27 2dr3 h ILE 117 CO -0.01 0.08 0.12 -0.33 0.00 0.00 0.00 178.15 178.01 2dr3 h GLU 118 N -0.30 0.23 -0.46 2.37 5.08 -1.27 0.14 114.58 120.38 2dr3 h GLU 118 Ca -0.01 -0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 2dr3 h GLU 118 Cb 0.25 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2dr3 h GLU 118 CO 0.02 0.15 -0.22 0.28 -1.00 0.00 0.00 179.01 178.25 2dr3 h VAL 119 N 0.24 1.27 -0.50 3.13 2.07 -1.20 -1.73 116.25 119.52 2dr3 h VAL 119 Ca 0.33 -1.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.42 2dr3 h VAL 119 Cb 0.51 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 2dr3 h VAL 119 CO -0.44 0.47 0.10 0.25 0.02 0.00 0.00 177.57 177.97 2dr3 h LEU 120 N 0.81 0.79 -1.00 2.57 5.85 -0.13 -1.50 115.31 122.70 2dr3 h LEU 120 Ca 0.11 -0.25 0.03 0.00 0.84 0.00 0.00 57.88 58.60 2dr3 h LEU 120 Cb 0.78 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.55 2dr3 h LEU 120 CO 0.06 0.84 0.66 0.03 -0.34 0.00 0.00 178.44 179.69 2dr3 h ARG 121 N 0.71 1.26 -0.13 1.25 3.08 -0.61 -0.46 114.38 119.47 2dr3 h ARG 121 Ca 0.15 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 2dr3 h ARG 121 Cb 0.37 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2dr3 h ARG 121 CO 0.01 0.83 0.07 1.96 -1.07 0.00 0.00 179.97 181.77 2dr3 h GLN 122 N 1.29 0.18 -0.63 0.04 1.08 -0.93 -2.44 115.11 113.71 2dr3 h GLN 122 Ca 0.39 -0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 57.52 2dr3 h GLN 122 Cb -0.05 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.31 2dr3 h GLN 122 CO -0.11 0.20 0.19 0.00 -0.95 0.00 0.00 178.83 178.17 2dr3 h ALA 123 N 0.97 1.16 0.26 3.87 0.00 -0.77 -1.99 119.26 122.77 2dr3 h ALA 123 Ca 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2dr3 h ALA 123 Cb 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2dr3 h ALA 123 CO -0.01 0.58 -0.12 0.82 0.00 0.00 0.00 179.25 180.52 2dr3 h ILE 124 N 0.92 0.77 -0.14 0.00 2.04 -0.86 -2.81 117.51 117.42 2dr3 h ILE 124 Ca 0.21 -0.13 -0.12 0.00 1.00 0.00 0.00 64.86 65.82 2dr3 h ILE 124 Cb 0.27 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 2dr3 h ILE 124 CO -0.01 0.03 -0.45 0.08 0.00 0.00 0.00 178.15 177.80 2dr3 h ARG 125 N -0.41 0.34 -0.75 2.37 0.11 -1.42 -0.32 114.38 114.30 2dr3 h ARG 125 Ca -0.04 -0.18 0.06 0.00 0.10 0.00 0.00 59.98 59.93 2dr3 h ARG 125 Cb 0.31 0.01 -0.06 0.00 1.11 0.00 0.00 29.97 31.34 2dr3 h ARG 125 CO 0.06 0.73 0.44 -0.44 0.10 0.00 0.00 179.97 180.86 2dr3 h ASP 126 N 0.28 0.67 -0.22 0.08 5.19 -1.28 -3.09 116.42 118.05 2dr3 h ASP 126 Ca 0.02 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 2dr3 h ASP 126 Cb 0.91 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.31 2dr3 h ASP 126 CO 0.08 0.43 0.00 2.30 -3.12 0.00 0.00 179.24 178.92 2dr3 n ILE 127 N -4.72 0.69 -3.50 0.35 -5.35 -1.07 -4.99 119.36 100.77 2dr3 n ILE 127 Ca 0.10 -0.85 -0.19 0.00 -0.27 0.00 0.00 62.75 61.55 2dr3 n ILE 127 Cb 0.18 0.72 0.06 0.00 -1.74 0.00 0.00 39.64 38.86 2dr3 n ILE 127 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2dr3 n ASN 128 N 0.46 -2.85 -4.75 7.28 3.02 -0.24 -4.74 115.26 113.44 2dr3 n ASN 128 Ca 0.09 -0.73 -0.39 0.00 -0.03 0.00 0.00 54.58 53.52 2dr3 n ASN 128 Cb 0.36 -4.67 0.04 0.00 -0.61 0.00 0.00 39.78 34.90 2dr3 n ASN 128 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dr3 s ALA 129 N -3.48 2.88 0.00 5.41 0.00 -0.55 -4.39 121.76 121.63 2dr3 s ALA 129 Ca 0.12 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.44 2dr3 s ALA 129 Cb -0.02 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2dr3 s ALA 129 CO 0.77 -1.36 0.00 1.63 0.00 0.00 0.00 175.76 176.80 2dr3 n LYS 130 N -0.92 2.59 -5.12 0.00 4.76 0.92 -4.68 118.16 115.72 2dr3 n LYS 130 Ca 0.10 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.24 2dr3 n LYS 130 Cb 0.44 -0.89 -0.16 0.00 -1.84 0.00 0.00 35.03 32.58 2dr3 n LYS 130 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2dr3 s ARG 131 N -1.77 2.41 0.02 1.97 0.52 -0.80 -0.58 118.95 120.72 2dr3 s ARG 131 Ca 0.00 -0.80 0.03 0.00 -0.52 0.00 0.00 55.73 54.43 2dr3 s ARG 131 Cb 0.00 -2.00 -0.01 0.00 0.52 0.00 0.00 34.95 33.46 2dr3 s ARG 131 CO 0.00 0.29 -0.08 0.08 0.02 0.00 0.00 175.30 175.61 2dr3 s VAL 132 N 0.03 0.64 -0.05 3.52 1.01 -1.04 -0.35 120.40 124.15 2dr3 s VAL 132 Ca -0.07 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.25 2dr3 s VAL 132 Cb -0.14 -0.60 0.02 0.00 0.00 0.00 0.00 36.38 35.66 2dr3 s VAL 132 CO 0.04 -0.04 -0.05 -0.69 0.00 0.00 0.00 175.10 174.36 2dr3 s VAL 133 N -0.66 0.64 -0.31 2.92 1.01 0.57 -1.48 120.40 123.08 2dr3 s VAL 133 Ca -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 2dr3 s VAL 133 Cb -0.06 -0.65 0.06 0.00 0.00 0.00 0.00 36.38 35.72 2dr3 s VAL 133 CO 0.00 0.25 0.01 -0.69 0.00 0.00 0.00 175.10 174.68 2dr3 s VAL 134 N 0.98 2.98 -0.38 2.92 1.01 -0.78 0.34 120.40 127.47 2dr3 s VAL 134 Ca -0.10 -1.47 0.03 0.00 0.00 0.00 0.00 61.98 60.44 2dr3 s VAL 134 Cb -0.14 -2.75 0.11 0.00 0.00 0.00 0.00 36.38 33.60 2dr3 s VAL 134 CO -0.00 -0.16 0.12 -0.62 0.00 0.00 0.00 175.10 174.44 2dr3 s ASP 135 N 1.29 4.36 0.18 3.32 -1.08 -0.15 -1.78 116.67 122.81 2dr3 s ASP 135 Ca -0.04 -2.25 0.07 0.00 -0.52 0.00 0.00 52.55 49.81 2dr3 s ASP 135 Cb -0.20 -1.37 -0.05 0.00 -1.46 0.00 0.00 42.92 39.85 2dr3 s ASP 135 CO -0.02 -0.35 -0.13 -0.94 0.52 0.00 0.00 175.17 174.25 2dr3 s SER 136 N 0.79 2.33 0.38 -0.34 1.04 -1.26 0.23 113.70 116.87 2dr3 s SER 136 Ca 0.13 -1.01 0.11 0.00 0.48 0.00 0.00 55.95 55.66 2dr3 s SER 136 Cb -0.21 -0.10 0.76 0.00 0.10 0.00 0.00 66.02 66.57 2dr3 s SER 136 CO -0.10 -0.21 1.88 1.62 0.98 0.00 0.00 173.24 177.41 2dr3 h VAL 137 N 2.67 1.21 -0.94 5.02 3.04 -1.27 -3.09 116.25 122.89 2dr3 h VAL 137 Ca -0.38 -0.96 0.06 0.00 -1.01 0.00 0.00 66.70 64.41 2dr3 h VAL 137 Cb 1.21 1.40 -0.06 0.00 -2.01 0.00 0.00 31.29 31.83 2dr3 h VAL 137 CO 0.62 0.29 0.60 0.74 -1.01 0.00 0.00 177.57 178.80 2dr3 h THR 138 N 0.14 1.09 -0.01 3.17 2.02 -1.92 -1.82 112.91 115.57 2dr3 h THR 138 Ca 0.02 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.83 2dr3 h THR 138 Cb 0.49 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.78 2dr3 h THR 138 CO 0.03 0.20 0.02 0.74 0.37 0.00 0.00 175.52 176.88 2dr3 h THR 139 N 1.10 0.21 0.00 3.16 2.02 -1.90 0.15 112.91 117.65 2dr3 h THR 139 Ca 0.40 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.58 2dr3 h THR 139 Cb 0.13 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 2dr3 h THR 139 CO -0.16 0.00 0.00 -0.07 0.37 0.00 0.00 175.52 175.66 2dr3 h LEU 140 N 0.00 0.00 -0.73 2.58 3.38 -1.49 -3.36 115.31 115.69 2dr3 h LEU 140 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dr3 h LEU 140 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2dr3 h LEU 140 CO -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 178.44 178.47 2dr3 n TYR 141 N -2.68 0.00 0.28 1.13 0.18 -0.69 -4.89 117.16 110.49 2dr3 n TYR 141 Ca 0.02 0.00 0.18 0.00 1.88 0.00 0.00 57.90 59.98 2dr3 n TYR 141 Cb 0.31 0.08 0.96 0.00 -0.38 0.00 0.00 39.34 40.31 2dr3 n TYR 141 CO 0.00 0.00 0.00 0.97 -2.08 0.00 0.00 176.86 175.75 2dr3 h ILE 142 N 3.65 0.33 -0.25 -3.48 2.10 -0.89 0.68 117.51 119.65 2dr3 h ILE 142 Ca 0.00 0.00 -0.00 0.00 1.08 0.00 0.00 64.86 65.94 2dr3 h ILE 142 Cb 1.04 0.92 -0.00 0.00 -1.09 0.00 0.00 36.82 37.69 2dr3 h ILE 142 CO 0.00 0.00 0.00 0.59 -1.08 0.00 0.00 178.15 177.66 2dr3 n ASN 143 N -3.56 3.85 -2.92 2.19 3.02 -1.26 -4.60 115.26 111.98 2dr3 n ASN 143 Ca -0.01 -3.03 -0.13 0.00 -0.03 0.00 0.00 54.58 51.38 2dr3 n ASN 143 Cb 0.18 -0.54 0.03 0.00 -0.61 0.00 0.00 39.78 38.84 2dr3 n ASN 143 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2dr3 n LYS 144 N -0.54 1.04 -0.21 3.52 5.02 0.23 -5.00 118.16 122.23 2dr3 n LYS 144 Ca 0.21 -2.81 0.06 0.00 -2.02 0.00 0.00 58.31 53.75 2dr3 n LYS 144 Cb 0.89 -1.27 0.33 0.00 -0.02 0.00 0.00 35.03 34.96 2dr3 n LYS 144 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2dr3 h PRO 145 N 2.90 0.78 0.00 1.97 0.13 -1.73 0.33 132.00 136.38 2dr3 h PRO 145 Ca -0.03 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2dr3 h PRO 145 Cb 1.08 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2dr3 h PRO 145 CO 0.34 0.52 0.00 0.00 -0.23 0.00 0.00 178.00 178.63 2dr3 h ALA 146 N 1.59 1.00 -0.01 -0.56 0.00 -1.94 -1.83 119.26 117.50 2dr3 h ALA 146 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2dr3 h ALA 146 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2dr3 h ALA 146 CO -0.11 0.00 -0.29 -1.33 0.00 0.00 0.00 179.25 177.52 2dr3 n MET 147 N -2.55 0.86 0.26 0.00 2.81 0.12 -4.40 117.12 114.22 2dr3 n MET 147 Ca 0.01 -0.53 -0.16 0.00 -1.81 0.00 0.00 57.70 55.20 2dr3 n MET 147 Cb 0.21 -1.49 -0.08 0.00 -0.71 0.00 0.00 33.22 31.15 2dr3 n MET 147 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2dr3 h ALA 148 N 3.69 -0.78 -0.33 3.04 0.00 -1.31 -1.66 119.26 121.92 2dr3 h ALA 148 Ca 0.00 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.83 2dr3 h ALA 148 Cb 0.53 0.44 -0.08 0.00 0.00 0.00 0.00 17.79 18.68 2dr3 h ALA 148 CO 0.00 -0.96 -0.45 -0.09 0.00 0.00 0.00 179.25 177.75 2dr3 h ARG 149 N -0.77 -0.37 -0.27 0.00 2.43 -1.78 0.75 114.38 114.38 2dr3 h ARG 149 Ca -0.04 0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 2dr3 h ARG 149 Cb 0.65 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.27 2dr3 h ARG 149 CO 0.01 -0.25 -0.15 0.66 -1.51 0.00 0.00 179.97 178.73 2dr3 h SER 150 N -0.39 0.45 -0.28 -3.80 4.64 -1.83 -0.90 113.55 111.44 2dr3 h SER 150 Ca 0.11 -0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2dr3 h SER 150 Cb 0.60 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2dr3 h SER 150 CO -0.53 0.63 0.05 0.40 -0.87 0.00 0.00 176.83 176.51 2dr3 h ILE 151 N 0.43 1.23 -0.50 0.95 2.04 -0.37 0.36 117.51 121.65 2dr3 h ILE 151 Ca 0.08 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 2dr3 h ILE 151 Cb 0.52 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 2dr3 h ILE 151 CO 0.03 0.26 0.12 0.40 0.00 0.00 0.00 178.15 178.96 2dr3 h ILE 152 N 0.28 1.24 -0.09 -0.67 1.08 -0.70 -1.98 117.51 116.67 2dr3 h ILE 152 Ca 0.08 -0.84 -0.12 0.00 -0.39 0.00 0.00 64.86 63.59 2dr3 h ILE 152 Cb 0.34 0.84 -0.01 0.00 -3.07 0.00 0.00 36.82 34.91 2dr3 h ILE 152 CO 0.01 0.30 -0.47 -0.07 -0.69 0.00 0.00 178.15 177.23 2dr3 h LEU 153 N 0.68 0.25 -0.08 1.44 3.38 -1.03 -1.67 115.31 118.27 2dr3 h LEU 153 Ca 0.16 -0.12 -0.14 0.00 0.09 0.00 0.00 57.88 57.87 2dr3 h LEU 153 Cb 0.33 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.02 2dr3 h LEU 153 CO 0.00 0.69 -0.49 1.56 0.09 0.00 0.00 178.44 180.29 2dr3 h GLN 154 N 0.19 0.48 -0.56 1.13 4.20 -0.83 -2.61 115.11 117.11 2dr3 h GLN 154 Ca 0.01 -0.40 -0.05 0.00 0.06 0.00 0.00 58.65 58.26 2dr3 h GLN 154 Cb 0.91 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.75 2dr3 h GLN 154 CO 0.07 1.04 0.14 -0.07 -0.67 0.00 0.00 178.83 179.34 2dr3 h LEU 155 N 0.05 0.84 -0.61 1.46 3.38 -1.33 -1.98 115.31 117.11 2dr3 h LEU 155 Ca -0.04 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 57.75 2dr3 h LEU 155 Cb 1.14 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.62 2dr3 h LEU 155 CO 0.10 0.85 0.34 0.50 0.09 0.00 0.00 178.44 180.32 2dr3 h LYS 156 N 0.79 0.62 -0.44 1.13 3.64 -1.35 0.07 116.57 121.03 2dr3 h LYS 156 Ca 0.17 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 2dr3 h LYS 156 Cb 0.33 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2dr3 h LYS 156 CO 0.00 0.41 0.16 -0.09 -2.27 0.00 0.00 179.45 177.66 2dr3 h ARG 157 N 0.64 0.67 -0.09 1.90 2.43 -1.20 -0.11 114.38 118.61 2dr3 h ARG 157 Ca 0.27 -0.13 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2dr3 h ARG 157 Cb 0.14 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 2dr3 h ARG 157 CO -0.16 0.63 0.05 0.28 -1.51 0.00 0.00 179.97 179.26 2dr3 h VAL 158 N 0.56 1.07 -0.13 0.20 2.07 -0.89 -0.05 116.25 119.09 2dr3 h VAL 158 Ca 0.14 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2dr3 h VAL 158 Cb 0.23 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2dr3 h VAL 158 CO -0.01 0.06 0.03 -0.07 0.02 0.00 0.00 177.57 177.61 2dr3 h LEU 159 N 0.06 0.20 -0.76 2.57 3.38 -0.84 -2.10 115.31 117.82 2dr3 h LEU 159 Ca 0.03 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.66 2dr3 h LEU 159 Cb 0.06 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2dr3 h LEU 159 CO -0.01 0.38 -0.27 0.00 0.09 0.00 0.00 178.44 178.64 2dr3 h ALA 160 N 0.82 0.94 0.00 1.53 0.00 -1.05 0.17 119.26 121.67 2dr3 h ALA 160 Ca 0.04 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2dr3 h ALA 160 Cb 0.26 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2dr3 h ALA 160 CO 0.00 0.61 -0.06 0.78 0.00 0.00 0.00 179.25 180.58 2dr3 h GLY 161 N 1.00 0.00 -2.47 0.00 0.00 -0.87 -1.56 103.07 99.17 2dr3 h GLY 161 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2dr3 h GLY 161 CO 0.06 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.30 2dr3 n THR 162 N -3.51 1.50 -1.08 4.70 -2.24 -0.80 -4.95 114.28 107.90 2dr3 n THR 162 Ca -0.02 -1.17 -0.03 0.00 -2.27 0.00 0.00 64.05 60.56 2dr3 n THR 162 Cb 0.18 0.26 -0.01 0.00 -2.10 0.00 0.00 70.33 68.66 2dr3 n THR 162 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dr3 n GLY 163 N 0.98 0.60 3.89 3.38 0.00 -0.59 -4.98 105.19 108.48 2dr3 n GLY 163 Ca 0.22 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 2dr3 n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dr3 s THR 165 N -2.06 2.32 0.25 0.00 2.01 0.25 -3.73 115.64 114.68 2dr3 s THR 165 Ca 0.46 -0.85 0.06 0.00 0.31 0.00 0.00 61.69 61.67 2dr3 s THR 165 Cb -0.11 -1.99 -0.05 0.00 0.01 0.00 0.00 72.50 70.36 2dr3 s THR 165 CO 0.27 0.52 -0.06 -0.44 -0.69 0.00 0.00 174.62 174.22 2dr3 s SER 166 N 1.28 2.47 -0.10 3.53 0.01 -0.78 -2.51 113.70 117.60 2dr3 s SER 166 Ca 0.04 -1.16 0.03 0.00 1.31 0.00 0.00 55.95 56.18 2dr3 s SER 166 Cb -0.13 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 65.99 2dr3 s SER 166 CO -0.10 -0.35 -0.20 -0.63 0.41 0.00 0.00 173.24 172.37 2dr3 s ILE 167 N -3.11 1.84 -0.33 1.44 1.01 -0.55 0.50 121.20 122.00 2dr3 s ILE 167 Ca 0.27 -0.87 -0.06 0.00 0.00 0.00 0.00 60.65 59.98 2dr3 s ILE 167 Cb 0.03 -1.62 0.03 0.00 0.01 0.00 0.00 42.46 40.92 2dr3 s ILE 167 CO 0.10 0.51 0.10 -0.36 0.00 0.00 0.00 174.94 175.28 2dr3 s PHE 168 N 0.59 3.23 -0.02 3.97 0.40 0.91 -1.87 117.98 125.19 2dr3 s PHE 168 Ca -0.14 -1.32 -0.30 0.00 -0.60 0.00 0.00 56.93 54.57 2dr3 s PHE 168 Cb -0.17 -2.27 -0.04 0.00 0.51 0.00 0.00 43.02 41.06 2dr3 s PHE 168 CO 0.04 -0.70 1.15 0.08 0.70 0.00 0.00 175.22 176.50 2dr3 s VAL 169 N 1.42 4.31 -0.22 -0.44 1.01 -0.73 -0.65 120.40 125.10 2dr3 s VAL 169 Ca -0.01 1.65 -0.01 0.00 0.00 0.00 0.00 61.98 63.61 2dr3 s VAL 169 Cb -0.19 -4.06 0.02 0.00 0.00 0.00 0.00 36.38 32.15 2dr3 s VAL 169 CO 0.03 0.06 -0.10 -0.55 0.00 0.00 0.00 175.10 174.54 2dr3 s SER 170 N 1.25 3.99 -0.12 3.32 0.15 0.30 -1.60 113.70 121.00 2dr3 s SER 170 Ca 0.56 -0.70 -0.23 0.00 0.70 0.00 0.00 55.95 56.28 2dr3 s SER 170 Cb -0.25 -1.63 -0.03 0.00 -1.71 0.00 0.00 66.02 62.40 2dr3 s SER 170 CO 0.25 -0.07 0.69 -1.10 1.20 0.00 0.00 173.24 174.21 2dr3 s GLN 171 N 1.35 4.34 0.07 5.44 -0.21 -1.26 -2.74 119.66 126.65 2dr3 s GLN 171 Ca 0.03 0.80 0.08 0.00 0.02 0.00 0.00 55.36 56.28 2dr3 s GLN 171 Cb -0.15 -3.50 -0.03 0.00 1.00 0.00 0.00 33.01 30.33 2dr3 s GLN 171 CO -0.06 -0.08 -0.21 0.08 -2.12 0.00 0.00 175.29 172.90 2dr3 s VAL 172 N 1.32 1.67 0.40 1.09 1.01 -1.10 -4.90 120.40 119.88 2dr3 s VAL 172 Ca 0.34 -1.34 -0.23 0.00 0.00 0.00 0.00 61.98 60.75 2dr3 s VAL 172 Cb -0.17 -1.48 -0.10 0.00 0.00 0.00 0.00 36.38 34.64 2dr3 s VAL 172 CO 0.14 0.09 1.00 -0.94 0.00 0.00 0.00 175.10 175.39 2dr3 s SER 173 N -1.49 6.88 0.42 3.32 1.04 -1.26 -3.92 113.70 118.69 2dr3 s SER 173 Ca 0.07 1.90 -0.24 0.00 0.48 0.00 0.00 55.95 58.17 2dr3 s SER 173 Cb -0.09 -2.57 -0.11 0.00 0.10 0.00 0.00 66.02 63.35 2dr3 s SER 173 CO 0.03 -0.40 0.87 0.52 0.98 0.00 0.00 173.24 175.24 2dr3 n VAL 174 N -0.16 2.30 0.00 5.02 0.31 -1.26 -2.61 118.33 121.93 2dr3 n VAL 174 Ca 0.05 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 2dr3 n VAL 174 Cb 0.51 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.48 2dr3 n VAL 174 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dr3 n GLY 175 N 1.37 2.67 3.70 2.92 0.00 -1.26 -5.00 105.19 109.59 2dr3 n GLY 175 Ca 0.10 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 2dr3 n GLY 175 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dr3 s GLU 176 N 0.00 4.25 -0.02 1.61 2.12 -1.07 -4.86 118.70 120.73 2dr3 s GLU 176 Ca 0.00 2.18 0.08 0.00 0.36 0.00 0.00 54.97 57.59 2dr3 s GLU 176 Cb 0.00 -3.42 0.26 0.00 0.26 0.00 0.00 34.13 31.23 2dr3 s GLU 176 CO 0.00 -0.59 1.17 0.54 -0.54 0.00 0.00 175.26 175.83 2dr3 n ARG 177 N 4.83 1.82 -0.45 4.30 1.74 -1.26 -4.84 116.66 122.80 2dr3 n ARG 177 Ca 0.14 -1.06 -0.29 0.00 -0.77 0.00 0.00 57.85 55.86 2dr3 n ARG 177 Cb 0.41 -1.33 0.27 0.00 -1.02 0.00 0.00 32.46 30.79 2dr3 n ARG 177 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2dr3 s GLY 178 N -0.86 1.48 -0.01 -0.13 0.00 -1.26 -4.98 107.32 101.56 2dr3 s GLY 178 Ca 0.19 -0.44 0.11 0.00 0.00 0.00 0.00 44.72 44.58 2dr3 s GLY 178 CO 0.12 0.42 0.29 0.69 0.00 0.00 0.00 173.10 174.62 2dr3 n PHE 179 N -5.28 0.00 0.00 1.90 3.72 -1.26 -4.85 117.46 111.68 2dr3 n PHE 179 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 2dr3 n PHE 179 Cb 0.57 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.92 2dr3 n PHE 179 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dr3 n GLY 180 N 1.72 0.00 0.00 1.37 0.00 -1.26 -4.77 105.19 102.25 2dr3 n GLY 180 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2dr3 n GLY 180 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dr3 n GLY 181 N 0.00 -0.12 3.68 -0.02 0.00 -1.26 -4.91 105.19 102.56 2dr3 n GLY 181 Ca 0.00 -2.28 -0.45 0.00 0.00 0.00 0.00 46.02 43.28 2dr3 n GLY 181 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dr3 n PRO 182 N -0.57 2.29 0.00 1.61 -0.02 -1.26 -3.23 135.00 133.82 2dr3 n PRO 182 Ca 0.00 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2dr3 n PRO 182 Cb 0.00 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 30.85 2dr3 n PRO 182 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dr3 n GLY 183 N 3.69 1.03 0.28 -1.23 0.00 -1.26 -4.63 105.19 103.07 2dr3 n GLY 183 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 2dr3 n GLY 183 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2dr3 h VAL 184 N 0.00 0.53 0.00 1.61 3.04 -1.89 1.03 116.25 120.57 2dr3 h VAL 184 Ca 0.00 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.66 2dr3 h VAL 184 Cb 0.00 0.54 0.00 0.00 -2.01 0.00 0.00 31.29 29.82 2dr3 h VAL 184 CO 0.00 0.01 0.00 1.05 -1.01 0.00 0.00 177.57 177.62 2dr3 h GLU 185 N -0.66 0.00 0.02 4.17 4.11 -1.84 -1.84 114.58 118.54 2dr3 h GLU 185 Ca -0.07 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.06 2dr3 h GLU 185 Cb 0.50 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 2dr3 h GLU 185 CO 0.11 0.00 -1.73 0.45 0.07 0.00 0.00 179.01 177.91 2dr3 h HIS 186 N 0.00 0.08 0.00 2.06 3.86 -1.61 -3.39 115.15 116.15 2dr3 h HIS 186 Ca 0.00 -0.06 -0.12 0.00 -1.16 0.00 0.00 60.37 59.04 2dr3 h HIS 186 Cb 0.19 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.64 2dr3 h HIS 186 CO 0.00 1.12 -0.55 0.78 0.86 0.00 0.00 177.93 180.14 2dr3 h GLY 187 N 3.11 0.00 -1.22 2.45 0.00 0.19 -3.46 103.07 104.15 2dr3 h GLY 187 Ca -0.30 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.53 2dr3 h GLY 187 CO 0.08 0.00 0.40 -1.34 0.00 0.00 0.00 176.54 175.68 2dr3 s VAL 188 N -3.26 4.01 0.01 4.60 -7.23 -1.07 -4.92 120.40 112.55 2dr3 s VAL 188 Ca 0.01 0.65 0.11 0.00 -1.81 0.00 0.00 61.98 60.94 2dr3 s VAL 188 Cb 0.10 -3.57 -0.19 0.00 0.56 0.00 0.00 36.38 33.28 2dr3 s VAL 188 CO 0.74 -0.85 1.00 0.44 -0.31 0.00 0.00 175.10 176.11 2dr3 h ASP 189 N -0.59 0.00 -5.21 4.85 5.19 -1.60 -3.48 116.42 115.57 2dr3 h ASP 189 Ca -0.45 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 55.85 2dr3 h ASP 189 Cb 1.22 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.58 2dr3 h ASP 189 CO 0.61 0.93 -0.63 -0.83 -3.12 0.00 0.00 179.24 176.20 2dr3 s GLY 190 N -4.87 0.40 -0.07 2.75 0.00 -0.96 -0.85 107.32 103.72 2dr3 s GLY 190 Ca -0.01 -1.08 -0.02 0.00 0.00 0.00 0.00 44.72 43.60 2dr3 s GLY 190 CO 0.82 -1.20 0.05 -0.42 0.00 0.00 0.00 173.10 172.34 2dr3 s ILE 191 N -3.79 0.03 -0.17 0.90 1.01 0.17 -0.30 121.20 119.05 2dr3 s ILE 191 Ca 0.06 0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.96 2dr3 s ILE 191 Cb 0.07 -0.33 0.01 0.00 0.01 0.00 0.00 42.46 42.22 2dr3 s ILE 191 CO -0.10 0.13 -0.19 -0.63 0.00 0.00 0.00 174.94 174.15 2dr3 s ILE 192 N 2.11 2.17 -0.17 2.92 1.01 0.33 -1.00 121.20 128.57 2dr3 s ILE 192 Ca 0.04 -0.91 -0.08 0.00 0.00 0.00 0.00 60.65 59.70 2dr3 s ILE 192 Cb -0.13 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 2dr3 s ILE 192 CO -0.04 0.53 0.11 -0.60 0.00 0.00 0.00 174.94 174.93 2dr3 s ARG 193 N 1.17 3.88 -0.18 2.79 6.06 -0.31 -0.89 118.95 131.47 2dr3 s ARG 193 Ca 0.02 -0.24 -0.03 0.00 -2.50 0.00 0.00 55.73 52.98 2dr3 s ARG 193 Cb -0.14 -3.27 -0.02 0.00 0.06 0.00 0.00 34.95 31.58 2dr3 s ARG 193 CO -0.09 0.43 -0.06 -0.51 -2.50 0.00 0.00 175.30 172.57 2dr3 s LEU 194 N -0.04 2.99 0.19 -0.88 1.43 -0.16 -1.41 118.68 120.79 2dr3 s LEU 194 Ca 0.09 -0.28 0.11 0.00 -1.03 0.00 0.00 54.13 53.01 2dr3 s LEU 194 Cb -0.12 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 2dr3 s LEU 194 CO 0.00 0.09 -0.21 -1.81 0.23 0.00 0.00 176.35 174.65 2dr3 s ASP 195 N 0.83 3.60 -0.28 2.29 1.01 0.12 -4.34 116.67 119.90 2dr3 s ASP 195 Ca -0.02 -0.81 -0.04 0.00 0.71 0.00 0.00 52.55 52.39 2dr3 s ASP 195 Cb -0.15 -0.35 0.10 0.00 1.01 0.00 0.00 42.92 43.53 2dr3 s ASP 195 CO 0.01 0.12 0.12 -0.22 0.21 0.00 0.00 175.17 175.42 2dr3 s LEU 196 N -2.71 0.60 -0.06 1.23 2.96 -1.26 -1.82 118.68 117.62 2dr3 s LEU 196 Ca 0.22 -1.24 0.04 0.00 -0.22 0.00 0.00 54.13 52.93 2dr3 s LEU 196 Cb -0.08 -0.36 -0.02 0.00 0.50 0.00 0.00 46.19 46.23 2dr3 s LEU 196 CO 0.11 -0.43 -0.19 -1.81 -1.32 0.00 0.00 176.35 172.71 2dr3 s ASP 197 N 2.08 3.64 -0.34 3.68 1.01 -0.67 -4.88 116.67 121.19 2dr3 s ASP 197 Ca 0.08 -0.34 -0.24 0.00 0.71 0.00 0.00 52.55 52.76 2dr3 s ASP 197 Cb -0.16 -0.90 0.01 0.00 1.01 0.00 0.00 42.92 42.88 2dr3 s ASP 197 CO -0.34 0.29 0.83 -0.70 0.21 0.00 0.00 175.17 175.46 2dr3 s GLU 198 N -0.39 3.86 -0.18 8.23 2.12 -1.26 -0.70 118.70 130.38 2dr3 s GLU 198 Ca 0.04 0.50 0.00 0.00 0.36 0.00 0.00 54.97 55.87 2dr3 s GLU 198 Cb -0.12 -3.78 0.04 0.00 0.26 0.00 0.00 34.13 30.53 2dr3 s GLU 198 CO 0.02 -0.81 -0.08 0.42 -0.54 0.00 0.00 175.26 174.26 2dr3 s ILE 199 N 3.15 1.42 -1.16 -3.70 1.01 0.14 -4.81 121.20 117.25 2dr3 s ILE 199 Ca 0.34 -0.82 -0.13 0.00 0.00 0.00 0.00 60.65 60.03 2dr3 s ILE 199 Cb -0.13 -1.52 -0.02 0.00 0.01 0.00 0.00 42.46 40.79 2dr3 s ILE 199 CO 0.16 0.17 0.79 0.47 0.00 0.00 0.00 174.94 176.53 2dr3 n ASP 200 N 4.77 -4.69 -0.68 3.58 8.00 -1.26 -2.11 116.55 124.15 2dr3 n ASP 200 Ca -0.14 -0.91 -0.09 0.00 0.71 0.00 0.00 54.79 54.37 2dr3 n ASP 200 Cb 0.47 -3.93 -0.04 0.00 -0.02 0.00 0.00 41.12 37.61 2dr3 n ASP 200 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dr3 n GLY 201 N -1.57 0.93 2.88 0.44 0.00 -1.26 -4.98 105.19 101.63 2dr3 n GLY 201 Ca -0.13 -0.12 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 2dr3 n GLY 201 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dr3 s GLU 202 N -2.56 0.53 -0.06 1.61 2.12 -0.90 -5.13 118.70 114.31 2dr3 s GLU 202 Ca 0.00 -0.05 -0.27 0.00 0.36 0.00 0.00 54.97 55.01 2dr3 s GLU 202 Cb 0.00 -0.60 -0.03 0.00 0.26 0.00 0.00 34.13 33.76 2dr3 s GLU 202 CO 0.00 -0.06 0.86 -0.51 -0.54 0.00 0.00 175.26 175.01 2dr3 s LEU 203 N 0.73 4.31 -0.06 2.70 1.43 -1.26 0.25 118.68 126.79 2dr3 s LEU 203 Ca -0.08 1.41 0.05 0.00 -1.03 0.00 0.00 54.13 54.47 2dr3 s LEU 203 Cb -0.12 -3.35 -0.00 0.00 0.03 0.00 0.00 46.19 42.75 2dr3 s LEU 203 CO -0.01 -0.25 -0.20 -0.54 0.23 0.00 0.00 176.35 175.58 2dr3 s LYS 204 N 1.22 2.19 0.11 1.70 1.02 0.12 -4.92 119.74 121.18 2dr3 s LYS 204 Ca 0.44 -0.73 -0.13 0.00 0.02 0.00 0.00 55.97 55.57 2dr3 s LYS 204 Cb -0.19 -1.84 -0.06 0.00 -0.52 0.00 0.00 37.83 35.22 2dr3 s LYS 204 CO 0.21 0.27 0.49 1.03 -0.92 0.00 0.00 175.35 176.43 2dr3 s ARG 205 N 0.04 3.91 0.00 1.68 0.52 -1.26 -1.67 118.95 122.17 2dr3 s ARG 205 Ca -0.06 0.39 -0.24 0.00 -0.52 0.00 0.00 55.73 55.29 2dr3 s ARG 205 Cb -0.13 -2.99 0.05 0.00 0.52 0.00 0.00 34.95 32.40 2dr3 s ARG 205 CO 0.04 0.53 0.55 -1.54 0.02 0.00 0.00 175.30 174.89 2dr3 s SER 206 N -1.65 -0.48 0.05 0.23 1.04 -0.76 -2.89 113.70 109.24 2dr3 s SER 206 Ca 0.34 0.36 0.08 0.00 0.48 0.00 0.00 55.95 57.22 2dr3 s SER 206 Cb -0.15 0.48 -0.03 0.00 0.10 0.00 0.00 66.02 66.42 2dr3 s SER 206 CO 0.18 -0.64 -0.24 -0.22 0.98 0.00 0.00 173.24 173.31 2dr3 s LEU 207 N -1.59 2.17 -0.12 2.42 0.20 0.92 0.14 118.68 122.82 2dr3 s LEU 207 Ca -0.09 -0.57 -0.08 0.00 0.69 0.00 0.00 54.13 54.09 2dr3 s LEU 207 Cb -0.01 -1.14 0.04 0.00 -0.43 0.00 0.00 46.19 44.65 2dr3 s LEU 207 CO 0.03 0.21 0.29 -0.51 -0.29 0.00 0.00 176.35 176.08 2dr3 s ILE 208 N -0.82 -0.02 -0.60 6.68 2.07 -0.50 -1.24 121.20 126.77 2dr3 s ILE 208 Ca 0.10 0.08 -0.21 0.00 -1.41 0.00 0.00 60.65 59.21 2dr3 s ILE 208 Cb -0.09 -0.43 0.08 0.00 0.13 0.00 0.00 42.46 42.15 2dr3 s ILE 208 CO 0.02 0.03 0.80 -0.69 -1.91 0.00 0.00 174.94 173.20 2dr3 s VAL 209 N 0.84 4.62 0.13 4.00 1.01 -1.26 -1.17 120.40 128.57 2dr3 s VAL 209 Ca -0.06 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.37 2dr3 s VAL 209 Cb -0.07 -4.54 -0.20 0.00 0.00 0.00 0.00 36.38 31.58 2dr3 s VAL 209 CO -0.06 -1.20 1.30 -0.25 0.00 0.00 0.00 175.10 174.89 2dr3 h TRP 210 N 9.30 0.08 -2.22 5.22 2.91 -1.43 -3.46 115.95 126.35 2dr3 h TRP 210 Ca -0.29 -0.05 -0.07 0.00 1.13 0.00 0.00 58.89 59.61 2dr3 h TRP 210 Cb 1.08 -0.00 -0.21 0.00 -0.51 0.00 0.00 29.16 29.52 2dr3 h TRP 210 CO 0.88 1.00 0.04 0.21 -1.03 0.00 0.00 178.44 179.54 2dr3 s LYS 211 N -2.81 0.80 -0.35 2.65 2.20 -1.04 -4.91 119.74 116.28 2dr3 s LYS 211 Ca -0.00 0.67 0.04 0.00 -0.36 0.00 0.00 55.97 56.32 2dr3 s LYS 211 Cb 0.10 0.39 0.19 0.00 -1.51 0.00 0.00 37.83 36.99 2dr3 s LYS 211 CO 0.82 -0.15 0.70 1.41 -0.36 0.00 0.00 175.35 177.78 2dr3 s MET 212 N -0.11 0.60 0.43 4.03 1.75 -1.25 0.46 119.30 125.21 2dr3 s MET 212 Ca -0.03 0.07 -0.26 0.00 -1.25 0.00 0.00 55.69 54.22 2dr3 s MET 212 Cb -0.03 0.14 -0.09 0.00 2.84 0.00 0.00 34.83 37.68 2dr3 s MET 212 CO 0.03 -0.96 1.45 0.54 -0.65 0.00 0.00 175.02 175.44 2dr3 n ARG 213 N 4.74 2.38 -0.70 4.11 1.74 -0.03 -3.30 116.66 125.60 2dr3 n ARG 213 Ca 0.08 0.84 0.00 0.00 -0.77 0.00 0.00 57.85 58.01 2dr3 n ARG 213 Cb 0.57 -2.64 0.00 0.00 -1.02 0.00 0.00 32.46 29.36 2dr3 n ARG 213 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dr3 n GLY 214 N 0.54 0.64 3.59 -0.13 0.00 -1.26 -4.76 105.19 103.81 2dr3 n GLY 214 Ca 0.04 -0.10 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 2dr3 n GLY 214 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dr3 s THR 215 N -2.00 0.00 0.67 2.61 -1.32 -1.21 -4.73 115.64 109.67 2dr3 s THR 215 Ca 0.00 0.00 -0.06 0.00 -1.21 0.00 0.00 61.69 60.42 2dr3 s THR 215 Cb 0.00 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.04 2dr3 s THR 215 CO 0.00 0.00 0.98 -0.94 -2.21 0.00 0.00 174.62 172.45 2dr3 s SER 216 N -1.79 5.03 0.11 8.08 1.04 -1.26 -4.80 113.70 120.12 2dr3 s SER 216 Ca 0.07 0.52 -0.26 0.00 0.48 0.00 0.00 55.95 56.76 2dr3 s SER 216 Cb -0.01 -1.26 0.07 0.00 0.10 0.00 0.00 66.02 64.92 2dr3 s SER 216 CO -0.05 -1.45 0.94 -1.38 0.98 0.00 0.00 173.24 172.29 2dr3 s HIS 217 N -3.17 -0.19 0.40 5.02 -0.00 -1.26 -4.31 115.29 111.77 2dr3 s HIS 217 Ca 0.58 -0.07 -0.27 0.00 -0.00 0.00 0.00 55.06 55.30 2dr3 s HIS 217 Cb -0.11 0.61 -0.10 0.00 -0.00 0.00 0.00 32.58 32.98 2dr3 s HIS 217 CO 0.45 -0.75 1.48 0.45 -0.00 0.00 0.00 174.74 176.36 2dr3 s SER 218 N -2.83 6.19 -0.08 7.38 0.15 -0.26 -4.89 113.70 119.35 2dr3 s SER 218 Ca 0.10 3.03 0.15 0.00 0.70 0.00 0.00 55.95 59.94 2dr3 s SER 218 Cb -0.01 -2.67 0.52 0.00 -1.71 0.00 0.00 66.02 62.15 2dr3 s SER 218 CO -0.01 -0.98 1.44 0.23 1.20 0.00 0.00 173.24 175.12 2dr3 n MET 219 N 0.25 3.18 -4.06 5.44 0.00 -1.26 -4.54 117.12 116.13 2dr3 n MET 219 Ca 0.02 -2.57 -0.23 0.00 0.00 0.00 0.00 57.70 54.92 2dr3 n MET 219 Cb 0.40 -1.64 -0.04 0.00 0.00 0.00 0.00 33.22 31.94 2dr3 n MET 219 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 2dr3 s ARG 220 N -1.74 3.08 -0.37 0.03 1.81 -1.26 -5.02 118.95 115.48 2dr3 s ARG 220 Ca 0.39 -0.90 -0.20 0.00 -1.72 0.00 0.00 55.73 53.30 2dr3 s ARG 220 Cb 0.25 -2.69 0.01 0.00 -0.45 0.00 0.00 34.95 32.07 2dr3 s ARG 220 CO 0.18 0.44 0.62 0.50 -0.68 0.00 0.00 175.30 176.36 2dr3 s ARG 221 N -3.61 3.59 -0.13 3.54 3.52 -1.26 -4.62 118.95 119.98 2dr3 s ARG 221 Ca 0.33 -0.06 -0.06 0.00 -0.13 0.00 0.00 55.73 55.81 2dr3 s ARG 221 Cb -0.09 -3.84 -0.04 0.00 -1.56 0.00 0.00 34.95 29.42 2dr3 s ARG 221 CO 0.26 -0.78 0.09 -1.01 -0.81 0.00 0.00 175.30 173.05 2dr3 s HIS 222 N 2.69 3.40 0.67 5.12 3.76 -0.37 -1.25 115.29 129.30 2dr3 s HIS 222 Ca 0.23 0.33 -0.11 0.00 -0.15 0.00 0.00 55.06 55.36 2dr3 s HIS 222 Cb -0.14 -1.96 -0.01 0.00 1.11 0.00 0.00 32.58 31.58 2dr3 s HIS 222 CO 0.15 0.50 1.05 -1.25 -0.85 0.00 0.00 174.74 174.34 2dr3 s PRO 223 N -0.53 3.13 0.14 8.40 0.04 -1.26 -0.05 135.00 144.86 2dr3 s PRO 223 Ca 0.11 0.92 -0.15 0.00 0.04 0.00 0.00 61.00 61.92 2dr3 s PRO 223 Cb -0.12 -2.02 0.03 0.00 0.04 0.00 0.00 34.50 32.43 2dr3 s PRO 223 CO 0.02 -0.95 0.39 -0.59 0.04 0.00 0.00 177.00 175.92 2dr3 s PHE 224 N -3.04 -0.10 0.13 0.56 -0.71 -1.14 -2.07 117.98 111.61 2dr3 s PHE 224 Ca 0.58 -0.24 0.08 0.00 -1.04 0.00 0.00 56.93 56.31 2dr3 s PHE 224 Cb -0.13 0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.87 2dr3 s PHE 224 CO 0.53 -0.73 -0.18 -0.51 -1.34 0.00 0.00 175.22 172.99 2dr3 s ASP 225 N -2.84 2.45 -0.20 1.98 1.01 -0.95 -4.46 116.67 113.66 2dr3 s ASP 225 Ca 0.06 -0.77 -0.06 0.00 0.71 0.00 0.00 52.55 52.49 2dr3 s ASP 225 Cb 0.02 -0.13 -0.03 0.00 1.01 0.00 0.00 42.92 43.79 2dr3 s ASP 225 CO -0.09 -0.02 0.03 -0.63 0.21 0.00 0.00 175.17 174.68 2dr3 s ILE 226 N -1.65 4.32 0.00 0.77 1.01 -1.26 -2.05 121.20 122.35 2dr3 s ILE 226 Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.56 2dr3 s ILE 226 Cb -0.08 -2.96 0.00 0.00 0.01 0.00 0.00 42.46 39.43 2dr3 s ILE 226 CO 0.05 0.42 0.00 0.35 0.00 0.00 0.00 174.94 175.76 2dr3 n THR 227 N 4.09 0.00 0.19 2.92 -2.24 0.19 -4.98 114.28 114.45 2dr3 n THR 227 Ca -0.17 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.69 2dr3 n THR 227 Cb 0.52 -0.01 0.20 0.00 -2.10 0.00 0.00 70.33 68.94 2dr3 n THR 227 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2dr3 h ASP 228 N 0.00 0.00 -0.47 3.42 5.19 -1.96 -3.06 116.42 119.54 2dr3 h ASP 228 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2dr3 h ASP 228 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2dr3 h ASP 228 CO 0.00 0.29 0.00 0.29 -3.12 0.00 0.00 179.24 176.70 2dr3 n LYS 229 N -3.24 2.52 0.00 3.56 4.76 -1.26 -4.55 118.16 119.95 2dr3 n LYS 229 Ca 0.02 -2.30 0.00 0.00 -2.87 0.00 0.00 58.31 53.16 2dr3 n LYS 229 Cb 0.59 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.31 2dr3 n LYS 229 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dr3 n GLY 230 N 1.31 -0.20 3.87 0.72 0.00 -1.16 -5.02 105.19 104.72 2dr3 n GLY 230 Ca 0.19 -2.14 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 2dr3 n GLY 230 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dr3 s ILE 231 N 0.00 5.01 -0.09 -0.61 1.01 -1.26 0.56 121.20 125.82 2dr3 s ILE 231 Ca 0.00 0.41 -0.02 0.00 0.00 0.00 0.00 60.65 61.04 2dr3 s ILE 231 Cb 0.00 -3.64 0.04 0.00 0.01 0.00 0.00 42.46 38.87 2dr3 s ILE 231 CO 0.00 0.06 0.03 -0.63 0.00 0.00 0.00 174.94 174.40 2dr3 s ILE 232 N -1.66 0.19 -0.02 2.92 1.01 -0.87 -4.21 121.20 118.56 2dr3 s ILE 232 Ca 0.42 0.12 -0.03 0.00 0.00 0.00 0.00 60.65 61.16 2dr3 s ILE 232 Cb -0.12 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 41.84 2dr3 s ILE 232 CO 0.21 0.12 0.16 -0.69 0.00 0.00 0.00 174.94 174.74 2dr3 s VAL 233 N 2.04 5.31 -0.62 2.92 1.01 0.26 -2.23 120.40 129.09 2dr3 s VAL 233 Ca 0.04 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 61.79 2dr3 s VAL 233 Cb -0.13 -3.45 0.16 0.00 0.00 0.00 0.00 36.38 32.96 2dr3 s VAL 233 CO -0.05 0.36 0.48 -0.31 0.00 0.00 0.00 175.10 175.58 2dr3 s TYR 234 N -1.27 3.50 0.59 5.22 1.51 -0.88 -3.80 117.35 122.23 2dr3 s TYR 234 Ca 0.25 -2.35 0.29 0.00 -1.01 0.00 0.00 57.07 54.26 2dr3 s TYR 234 Cb -0.12 -3.41 1.81 0.00 -0.11 0.00 0.00 41.96 40.13 2dr3 s TYR 234 CO 0.16 -0.92 2.25 -1.35 -1.11 0.00 0.00 175.55 174.58 2dr3 h PRO 235 N 7.58 0.00 -0.09 -1.71 0.11 -1.88 -2.18 132.00 133.84 2dr3 h PRO 235 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2dr3 h PRO 235 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2dr3 h PRO 235 CO 0.75 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.29 2dr3 n ASP 236 N -3.86 1.32 -4.33 -2.05 8.00 -1.26 -4.86 116.55 109.51 2dr3 n ASP 236 Ca -0.03 -1.57 -0.23 0.00 0.71 0.00 0.00 54.79 53.67 2dr3 n ASP 236 Cb 0.09 -0.06 -0.12 0.00 -0.02 0.00 0.00 41.12 41.02 2dr3 n ASP 236 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2dr3 s LYS 237 N -1.89 1.24 0.07 -1.24 1.02 -0.82 0.72 119.74 118.85 2dr3 s LYS 237 Ca 0.34 -1.32 0.03 0.00 0.02 0.00 0.00 55.97 55.05 2dr3 s LYS 237 Cb 0.18 -1.43 -0.03 0.00 -0.52 0.00 0.00 37.83 36.03 2dr3 s LYS 237 CO 0.28 0.31 -0.09 0.54 -0.92 0.00 0.00 175.35 175.47 2dr3 s VAL 238 N -1.60 0.76 -0.30 3.17 0.11 -0.49 -4.34 120.40 117.70 2dr3 s VAL 238 Ca 0.12 -1.37 -0.08 0.00 -2.93 0.00 0.00 61.98 57.72 2dr3 s VAL 238 Cb -0.08 -1.02 0.00 0.00 -1.53 0.00 0.00 36.38 33.75 2dr3 s VAL 238 CO 0.06 -0.46 0.12 -0.22 -3.33 0.00 0.00 175.10 171.26 2dr3 s LEU 239 N -2.01 3.98 -0.52 2.54 2.96 -0.38 -1.60 118.68 123.64 2dr3 s LEU 239 Ca -0.02 -0.61 0.04 0.00 -0.22 0.00 0.00 54.13 53.32 2dr3 s LEU 239 Cb -0.06 -1.94 0.16 0.00 0.50 0.00 0.00 46.19 44.85 2dr3 s LEU 239 CO -0.00 -0.19 0.37 -0.54 -1.32 0.00 0.00 176.35 174.67 2dr3 s LYS 240 N 1.56 1.54 -0.82 1.98 1.02 -1.26 -4.78 119.74 118.97 2dr3 s LYS 240 Ca 0.04 -2.53 -0.03 0.00 0.02 0.00 0.00 55.97 53.47 2dr3 s LYS 240 Cb -0.17 -2.32 0.03 0.00 -0.52 0.00 0.00 37.83 34.85 2dr3 s LYS 240 CO 0.04 -1.30 0.14 2.89 -0.92 0.00 0.00 175.35 176.20 2dr3 n ARG 241 N 2.68 -2.67 0.00 1.68 0.00 -1.26 -4.74 116.66 112.35 2dr3 n ARG 241 Ca 0.22 0.36 0.00 0.00 -0.00 0.00 0.00 57.85 58.43 2dr3 n ARG 241 Cb 0.40 -4.96 0.00 0.00 -0.00 0.00 0.00 32.46 27.91 2dr3 n ARG 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dr3 n GLY 242 N -0.81 3.84 3.76 2.89 0.00 -1.26 -5.08 105.19 108.53 2dr3 n GLY 242 Ca -0.06 -0.61 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 2dr3 n GLY 242 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dr3 s LYS 243 N -2.24 4.62 -0.05 1.61 -2.85 -1.26 -4.35 119.74 115.23 2dr3 s LYS 243 Ca 0.00 1.81 -0.13 0.00 -1.00 0.00 0.00 55.97 56.65 2dr3 s LYS 243 Cb 0.00 -3.20 0.02 0.00 -2.06 0.00 0.00 37.83 32.60 2dr3 s LYS 243 CO 0.00 0.18 0.30 0.14 0.10 0.00 0.00 175.35 176.07 2dr3 s VAL 244 N -1.02 0.04 0.47 1.79 -7.23 -0.63 -4.96 120.40 108.86 2dr3 s VAL 244 Ca 0.45 -0.32 -0.22 0.00 -1.81 0.00 0.00 61.98 60.08 2dr3 s VAL 244 Cb -0.32 -0.54 -0.07 0.00 0.56 0.00 0.00 36.38 36.01 2dr3 s VAL 244 CO 0.41 -0.18 1.16 -0.76 -0.31 0.00 0.00 175.10 175.42 2dr3 s LEU 245 N -0.79 3.98 0.00 1.32 1.43 -1.26 -1.40 118.68 121.95 2dr3 s LEU 245 Ca -0.09 2.28 0.00 0.00 -1.03 0.00 0.00 54.13 55.29 2dr3 s LEU 245 Cb -0.04 -4.29 0.00 0.00 0.03 0.00 0.00 46.19 41.89 2dr3 s LEU 245 CO 0.03 -0.95 0.00 1.21 0.23 0.00 0.00 176.35 176.87