#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 4.11 -0.14 -2.82 3.52 -1.26 -4.85 118.95 117.51 2dr3 s ARG 3 Ca 0.00 2.58 -0.07 0.00 -0.13 0.00 0.00 55.73 58.12 2dr3 s ARG 3 Cb 0.00 -3.00 -0.04 0.00 -1.56 0.00 0.00 34.95 30.35 2dr3 s ARG 3 CO 0.00 -0.60 0.10 1.03 -0.81 0.00 0.00 175.30 175.01 2dr3 s ARG 4 N -1.12 3.61 -0.46 5.12 1.81 -1.26 -1.93 118.95 124.72 2dr3 s ARG 4 Ca 0.59 -0.24 -0.24 0.00 -1.72 0.00 0.00 55.73 54.13 2dr3 s ARG 4 Cb -0.47 -3.17 0.03 0.00 -0.45 0.00 0.00 34.95 30.89 2dr3 s ARG 4 CO 0.54 0.57 0.83 0.08 -0.68 0.00 0.00 175.30 176.64 2dr3 s VAL 5 N -0.45 4.59 0.02 3.52 1.01 0.61 -4.81 120.40 124.89 2dr3 s VAL 5 Ca 0.11 0.47 -0.30 0.00 0.00 0.00 0.00 61.98 62.25 2dr3 s VAL 5 Cb -0.12 -4.37 -0.06 0.00 0.00 0.00 0.00 36.38 31.84 2dr3 s VAL 5 CO 0.02 -0.78 1.45 -0.54 0.00 0.00 0.00 175.10 175.25 2dr3 s LYS 6 N 3.44 4.26 0.22 2.72 3.01 -1.26 -2.34 119.74 129.78 2dr3 s LYS 6 Ca 0.31 2.05 0.11 0.00 -1.01 0.00 0.00 55.97 57.43 2dr3 s LYS 6 Cb -0.12 -3.57 0.07 0.00 -1.01 0.00 0.00 37.83 33.21 2dr3 s LYS 6 CO 0.23 -0.60 1.44 1.79 0.51 0.00 0.00 175.35 178.71 2dr3 h THR 7 N 4.87 1.37 0.00 2.17 1.35 -1.93 -3.44 112.91 117.29 2dr3 h THR 7 Ca -0.39 -2.66 0.00 0.00 -0.55 0.00 0.00 66.41 62.81 2dr3 h THR 7 Cb 1.18 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 70.10 2dr3 h THR 7 CO 0.91 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 177.51 2dr3 n GLY 8 N 0.97 2.78 3.67 5.82 0.00 -1.26 -4.56 105.19 112.61 2dr3 n GLY 8 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.76 2.89 -0.27 -0.61 1.01 -1.26 -4.84 121.20 117.36 2dr3 s ILE 9 Ca 0.00 0.08 -0.41 0.00 0.00 0.00 0.00 60.65 60.32 2dr3 s ILE 9 Cb 0.00 -3.05 -0.17 0.00 0.01 0.00 0.00 42.46 39.25 2dr3 s ILE 9 CO 0.00 -0.00 1.64 -2.65 0.00 0.00 0.00 174.94 173.93 2dr3 n PRO 10 N 6.86 0.89 0.00 2.79 -0.02 -1.26 -1.53 135.00 142.73 2dr3 n PRO 10 Ca 0.19 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2dr3 n PRO 10 Cb 0.40 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 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 3.85 3.00 0.07 -1.23 0.00 -1.24 -1.00 105.19 108.63 2dr3 n GLY 11 Ca 0.26 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 1.37 0.00 1.61 2.07 -1.53 -2.80 116.25 116.96 2dr3 h VAL 12 Ca 0.00 -1.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.17 2dr3 h VAL 12 Cb 0.00 2.26 -0.00 0.00 -1.52 0.00 0.00 31.29 32.03 2dr3 h VAL 12 CO 0.00 0.34 -0.02 0.44 0.02 0.00 0.00 177.57 178.35 2dr3 h ASP 13 N -0.64 0.00 0.24 0.57 3.32 -1.91 -0.66 116.42 117.34 2dr3 h ASP 13 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 2dr3 h ASP 13 Cb 0.59 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.14 2dr3 h ASP 13 CO 0.01 0.02 -0.11 -0.33 -1.72 0.00 0.00 179.24 177.10 2dr3 h GLU 14 N 0.00 -0.31 -0.93 3.56 3.07 -1.91 0.16 114.58 118.23 2dr3 h GLU 14 Ca -0.00 0.02 0.25 0.00 -0.50 0.00 0.00 59.36 59.13 2dr3 h GLU 14 Cb 0.03 0.07 -0.05 0.00 -0.84 0.00 0.00 28.75 27.96 2dr3 h GLU 14 CO 0.00 0.04 0.64 0.82 -1.40 0.00 0.00 179.01 179.11 2dr3 h ILE 15 N -0.72 0.58 -0.08 3.13 2.04 -1.07 0.68 117.51 122.08 2dr3 h ILE 15 Ca -0.03 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.76 2dr3 h ILE 15 Cb 0.49 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2dr3 h ILE 15 CO 0.05 0.03 0.00 0.18 0.00 0.00 0.00 178.15 178.42 2dr3 n LEU 16 N -4.39 1.66 -3.43 1.44 4.77 -0.33 -0.51 117.00 116.21 2dr3 n LEU 16 Ca 0.20 -0.61 -0.18 0.00 -0.03 0.00 0.00 56.01 55.39 2dr3 n LEU 16 Cb 0.88 -0.04 0.07 0.00 -2.33 0.00 0.00 43.42 41.99 2dr3 n LEU 16 CO 0.34 0.31 0.04 1.41 -1.33 0.00 0.00 177.39 178.16 2dr3 n HIS 17 N 0.30 -2.22 0.00 -1.77 8.25 0.24 -3.57 115.22 116.45 2dr3 n HIS 17 Ca 0.18 0.86 0.00 0.00 -0.26 0.00 0.00 57.72 58.49 2dr3 n HIS 17 Cb 0.36 -4.50 0.00 0.00 1.12 0.00 0.00 29.99 26.97 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 -1.28 2.76 0.00 -1.41 0.00 -0.04 -4.96 105.19 100.26 2dr3 n GLY 18 Ca -0.20 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 44.89 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 0.88 3.62 -0.02 0.00 -1.17 -4.66 105.19 103.85 2dr3 n GLY 19 Ca 0.00 -1.97 -0.41 0.00 0.00 0.00 0.00 46.02 43.64 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 -2.23 4.89 0.04 -0.61 1.01 -0.99 -4.78 121.20 118.53 2dr3 s ILE 20 Ca 0.00 1.19 -0.35 0.00 0.00 0.00 0.00 60.65 61.48 2dr3 s ILE 20 Cb 0.00 -4.04 -0.14 0.00 0.01 0.00 0.00 42.46 38.28 2dr3 s ILE 20 CO 0.00 -0.10 1.60 -2.65 0.00 0.00 0.00 174.94 173.79 2dr3 n PRO 21 N 5.94 1.79 -1.49 2.79 -0.02 -1.26 -0.29 135.00 142.47 2dr3 n PRO 21 Ca 0.02 0.65 -0.46 0.00 -2.02 0.00 0.00 63.50 61.69 2dr3 n PRO 21 Cb 0.48 -2.39 -0.02 0.00 -0.02 0.00 0.00 33.50 31.55 2dr3 n PRO 21 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2dr3 n GLU 22 N 4.10 0.67 -0.86 -0.52 1.02 -0.81 -1.72 120.64 122.52 2dr3 n GLU 22 Ca 0.20 0.24 0.00 0.00 -0.02 0.00 0.00 57.16 57.57 2dr3 n GLU 22 Cb 0.25 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 2dr3 n GLU 22 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2dr3 n ARG 23 N 0.83 0.00 -2.46 3.49 1.74 -1.25 -5.00 116.66 114.01 2dr3 n ARG 23 Ca 0.13 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.80 2dr3 n ARG 23 Cb 0.30 -3.03 -0.04 0.00 -1.02 0.00 0.00 32.46 28.68 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 -2.74 7.19 -0.39 0.55 -0.87 -0.70 -4.63 114.94 113.35 2dr3 s ASN 24 Ca 0.00 2.15 -0.14 0.00 -1.57 0.00 0.00 52.86 53.29 2dr3 s ASN 24 Cb 0.00 -2.61 0.01 0.00 -0.02 0.00 0.00 41.25 38.63 2dr3 s ASN 24 CO 0.00 -0.28 0.29 -0.69 -2.57 0.00 0.00 177.10 173.85 2dr3 s VAL 25 N -0.16 5.26 -0.24 1.60 1.01 -1.26 -1.90 120.40 124.70 2dr3 s VAL 25 Ca 0.51 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.89 2dr3 s VAL 25 Cb -0.31 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 2dr3 s VAL 25 CO 0.36 -0.22 0.19 -0.69 0.00 0.00 0.00 175.10 174.73 2dr3 s VAL 26 N 1.73 5.34 -0.16 2.92 1.01 0.81 -1.45 120.40 130.60 2dr3 s VAL 26 Ca 0.06 0.23 -0.23 0.00 0.00 0.00 0.00 61.98 62.05 2dr3 s VAL 26 Cb -0.18 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 2dr3 s VAL 26 CO 0.10 0.33 0.70 -0.22 0.00 0.00 0.00 175.10 176.01 2dr3 s LEU 27 N 1.12 4.20 -0.30 3.92 2.96 0.11 -0.24 118.68 130.44 2dr3 s LEU 27 Ca 0.09 1.01 -0.05 0.00 -0.22 0.00 0.00 54.13 54.96 2dr3 s LEU 27 Cb -0.14 -3.02 0.03 0.00 0.50 0.00 0.00 46.19 43.56 2dr3 s LEU 27 CO 0.05 -0.26 0.05 -0.22 -1.32 0.00 0.00 176.35 174.65 2dr3 s LEU 28 N 1.66 3.92 0.20 -0.68 2.96 -0.17 -0.54 118.68 126.04 2dr3 s LEU 28 Ca 0.33 -1.00 0.08 0.00 -0.22 0.00 0.00 54.13 53.32 2dr3 s LEU 28 Cb -0.16 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.67 2dr3 s LEU 28 CO 0.13 -0.24 -0.15 -0.94 -1.32 0.00 0.00 176.35 173.82 2dr3 s SER 29 N 1.39 2.60 0.00 3.68 1.04 -0.77 -0.51 113.70 121.13 2dr3 s SER 29 Ca -0.01 -0.99 0.00 0.00 0.48 0.00 0.00 55.95 55.44 2dr3 s SER 29 Cb -0.18 -0.14 0.00 0.00 0.10 0.00 0.00 66.02 65.79 2dr3 s SER 29 CO 0.01 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.70 2dr3 n GLY 30 N -0.24 1.29 0.84 7.32 0.00 -1.07 -1.37 105.19 111.95 2dr3 n GLY 30 Ca -0.09 -1.06 -0.07 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.74 -2.16 3.78 -0.02 0.00 -1.25 -2.41 105.19 102.40 2dr3 n GLY 31 Ca 0.00 -1.52 -0.36 0.00 0.00 0.00 0.00 46.02 44.14 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 -3.61 3.88 -0.74 1.61 0.04 -1.26 -3.65 135.00 131.27 2dr3 s PRO 32 Ca 0.17 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.76 2dr3 s PRO 32 Cb -0.01 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 32.19 2dr3 s PRO 32 CO 0.13 -0.40 0.00 0.41 0.04 0.00 0.00 177.00 177.18 2dr3 n GLY 33 N 0.20 0.67 0.18 0.56 0.00 -1.26 -4.92 105.19 100.61 2dr3 n GLY 33 Ca 0.07 -0.67 0.11 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.17 0.00 -0.20 2.61 -2.24 -1.24 -4.97 114.28 105.07 2dr3 n THR 34 Ca -0.08 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2dr3 n THR 34 Cb 0.35 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 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 1.47 0.88 0.19 3.38 0.00 -1.26 -4.77 105.19 105.08 2dr3 n GLY 35 Ca 0.06 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 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 0.72 0.61 -0.14 1.61 1.57 -1.94 0.03 116.57 119.03 2dr3 h LYS 36 Ca 0.00 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 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 0.63 0.05 1.15 -0.57 0.00 0.00 179.45 180.71 2dr3 h THR 37 N 0.47 1.17 -0.80 -0.16 2.02 -1.98 -0.32 112.91 113.31 2dr3 h THR 37 Ca 0.12 -0.52 0.03 0.00 0.77 0.00 0.00 66.41 66.81 2dr3 h THR 37 Cb 0.29 1.26 -0.05 0.00 -1.74 0.00 0.00 68.15 67.92 2dr3 h THR 37 CO -0.00 0.16 0.51 0.40 0.37 0.00 0.00 175.52 176.96 2dr3 h ILE 38 N 0.05 1.14 -0.36 3.11 2.04 -1.97 -1.65 117.51 119.86 2dr3 h ILE 38 Ca 0.04 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 2dr3 h ILE 38 Cb 0.20 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 2dr3 h ILE 38 CO -0.00 0.18 0.16 0.15 0.00 0.00 0.00 178.15 178.64 2dr3 h PHE 39 N 1.01 0.54 -0.34 1.37 3.04 -0.76 -1.82 116.94 119.97 2dr3 h PHE 39 Ca 0.31 -0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.19 2dr3 h PHE 39 Cb -0.02 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.31 2dr3 h PHE 39 CO -0.03 0.48 0.03 0.77 -2.02 0.00 0.00 178.31 177.54 2dr3 h SER 40 N 0.45 0.48 0.16 0.41 0.02 -0.64 -2.34 113.55 112.08 2dr3 h SER 40 Ca 0.12 -0.08 -0.26 0.00 -0.84 0.00 0.00 61.79 60.73 2dr3 h SER 40 Cb 0.15 -0.12 0.02 0.00 0.14 0.00 0.00 62.40 62.59 2dr3 h SER 40 CO -0.01 0.52 -1.06 1.56 -1.14 0.00 0.00 176.83 176.70 2dr3 h GLN 41 N 0.50 0.58 -0.25 3.45 4.20 -1.15 -2.60 115.11 119.83 2dr3 h GLN 41 Ca 0.11 -0.66 -0.02 0.00 0.06 0.00 0.00 58.65 58.14 2dr3 h GLN 41 Cb 0.28 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 2dr3 h GLN 41 CO 0.00 1.26 0.07 0.37 -0.67 0.00 0.00 178.83 179.86 2dr3 h GLN 42 N 0.31 0.36 -0.04 1.46 4.15 -1.17 0.22 115.11 120.39 2dr3 h GLN 42 Ca -0.13 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.24 2dr3 h GLN 42 Cb 1.72 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 29.34 2dr3 h GLN 42 CO 0.20 0.33 0.01 0.35 -1.93 0.00 0.00 178.83 177.79 2dr3 h PHE 43 N 0.36 0.06 -0.46 3.99 3.57 -1.30 0.26 116.94 123.42 2dr3 h PHE 43 Ca 0.09 -0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.46 2dr3 h PHE 43 Cb 0.14 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 2dr3 h PHE 43 CO 0.00 0.26 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.08 2dr3 h LEU 44 N -0.15 0.94 0.58 0.59 3.38 -1.00 -1.46 115.31 118.20 2dr3 h LEU 44 Ca 0.01 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 2dr3 h LEU 44 Cb 0.22 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.72 2dr3 h LEU 44 CO -0.00 1.10 -0.28 -0.25 0.09 0.00 0.00 178.44 179.10 2dr3 h TRP 45 N 0.80 -0.73 -0.14 1.13 2.91 -0.47 -1.53 115.95 117.92 2dr3 h TRP 45 Ca 0.11 -0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.16 2dr3 h TRP 45 Cb 0.74 0.24 -0.01 0.00 -0.51 0.00 0.00 29.16 29.63 2dr3 h TRP 45 CO 0.05 -0.45 0.10 -0.91 -1.03 0.00 0.00 178.44 176.20 2dr3 h ASN 46 N -0.79 0.00 -0.06 2.65 2.35 -0.95 0.32 115.58 119.11 2dr3 h ASN 46 Ca -0.08 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.64 2dr3 h ASN 46 Cb 0.60 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.96 2dr3 h ASN 46 CO 0.13 0.00 -0.02 1.23 -1.65 0.00 0.00 177.43 177.12 2dr3 h GLY 47 N 0.00 0.24 0.44 2.83 0.00 -0.35 -1.26 103.07 104.97 2dr3 h GLY 47 Ca 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 2dr3 h GLY 47 CO -0.00 0.11 -0.13 1.41 0.00 0.00 0.00 176.54 177.94 2dr3 h LEU 48 N 0.23 -0.30 -1.06 3.11 3.38 0.57 2.92 115.31 124.16 2dr3 h LEU 48 Ca 0.05 -0.22 0.17 0.00 0.09 0.00 0.00 57.88 57.98 2dr3 h LEU 48 Cb 0.19 0.08 -0.10 0.00 0.09 0.00 0.00 40.66 40.92 2dr3 h LEU 48 CO 0.01 0.18 0.62 0.11 0.09 0.00 0.00 178.44 179.44 2dr3 h LYS 49 N -0.92 0.77 -0.29 1.13 1.57 -1.28 1.21 116.57 118.76 2dr3 h LYS 49 Ca -0.04 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2dr3 h LYS 49 Cb 0.50 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2dr3 h LYS 49 CO 0.06 0.51 0.00 -0.12 -0.57 0.00 0.00 179.45 179.33 2dr3 n MET 50 N -4.70 0.97 -2.18 3.15 1.56 -0.49 -4.79 117.12 110.64 2dr3 n MET 50 Ca 0.22 0.00 -0.05 0.00 -0.27 0.00 0.00 57.70 57.60 2dr3 n MET 50 Cb 0.52 -1.14 0.00 0.00 2.15 0.00 0.00 33.22 34.75 2dr3 n MET 50 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2dr3 n GLY 51 N 0.34 0.22 3.24 -5.12 0.00 0.41 -5.01 105.19 99.27 2dr3 n GLY 51 Ca 0.00 -0.65 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 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 -4.38 3.18 -0.09 1.61 2.02 0.98 -4.97 118.70 117.05 2dr3 s GLU 52 Ca 0.02 -0.75 -0.30 0.00 0.02 0.00 0.00 54.97 53.96 2dr3 s GLU 52 Cb -0.01 -2.66 -0.03 0.00 0.10 0.00 0.00 34.13 31.54 2dr3 s GLU 52 CO 0.02 -0.06 1.19 -2.14 0.02 0.00 0.00 175.26 174.29 2dr3 s PRO 53 N 1.00 4.33 0.25 0.39 0.02 -1.26 -2.52 135.00 137.22 2dr3 s PRO 53 Ca -0.02 1.63 0.11 0.00 0.02 0.00 0.00 61.00 62.74 2dr3 s PRO 53 Cb -0.15 -3.59 -0.05 0.00 0.02 0.00 0.00 34.50 30.73 2dr3 s PRO 53 CO -0.03 -0.49 -0.13 0.20 -0.33 0.00 0.00 177.00 176.22 2dr3 s GLY 54 N 1.52 1.78 -0.00 0.52 0.00 -1.19 0.50 107.32 110.44 2dr3 s GLY 54 Ca 0.54 -1.73 0.06 0.00 0.00 0.00 0.00 44.72 43.59 2dr3 s GLY 54 CO 0.20 -1.80 -0.18 -0.42 0.00 0.00 0.00 173.10 170.90 2dr3 s ILE 55 N -2.25 1.39 -0.28 0.90 1.01 0.68 -1.58 121.20 121.07 2dr3 s ILE 55 Ca 0.29 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 60.16 2dr3 s ILE 55 Cb -0.06 -1.16 0.07 0.00 0.01 0.00 0.00 42.46 41.31 2dr3 s ILE 55 CO 0.16 0.34 -0.06 -0.47 0.00 0.00 0.00 174.94 174.92 2dr3 s TYR 56 N -0.48 3.26 -0.34 3.97 6.14 -0.77 -0.65 117.35 128.48 2dr3 s TYR 56 Ca 0.06 -2.43 -0.25 0.00 0.64 0.00 0.00 57.07 55.10 2dr3 s TYR 56 Cb -0.07 -2.15 0.01 0.00 0.42 0.00 0.00 41.96 40.17 2dr3 s TYR 56 CO -0.00 -0.89 0.88 0.08 0.64 0.00 0.00 175.55 176.26 2dr3 s VAL 57 N 1.09 4.67 -0.31 3.14 1.01 0.22 -1.72 120.40 128.51 2dr3 s VAL 57 Ca -0.03 1.22 -0.11 0.00 0.00 0.00 0.00 61.98 63.06 2dr3 s VAL 57 Cb -0.20 -4.26 -0.02 0.00 0.00 0.00 0.00 36.38 31.91 2dr3 s VAL 57 CO -0.06 -0.41 0.18 0.00 0.00 0.00 0.00 175.10 174.81 2dr3 s ALA 58 N 3.25 3.38 -0.30 5.51 0.00 -0.50 -1.89 121.76 131.21 2dr3 s ALA 58 Ca 0.36 -1.32 0.04 0.00 0.00 0.00 0.00 51.96 51.05 2dr3 s ALA 58 Cb -0.13 -2.47 -0.03 0.00 0.00 0.00 0.00 23.12 20.50 2dr3 s ALA 58 CO 0.16 -0.84 0.30 1.28 0.00 0.00 0.00 175.76 176.66 2dr3 n LEU 59 N 5.03 0.49 -0.00 0.00 4.32 -0.28 -1.23 117.00 125.32 2dr3 n LEU 59 Ca -0.14 -0.62 0.05 0.00 -0.02 0.00 0.00 56.01 55.28 2dr3 n LEU 59 Cb 0.50 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.23 2dr3 n LEU 59 CO 0.34 0.11 -0.53 -0.62 -1.22 0.00 0.00 177.39 175.48 2dr3 n GLU 60 N -0.78 0.80 -3.95 3.23 -0.58 -1.21 -4.59 120.64 113.57 2dr3 n GLU 60 Ca 0.01 -0.07 -0.09 0.00 -0.42 0.00 0.00 57.16 56.59 2dr3 n GLU 60 Cb 0.08 -1.18 -0.09 0.00 -0.57 0.00 0.00 31.44 29.68 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 -2.53 0.65 0.38 3.49 2.02 -1.26 -5.10 118.70 116.35 2dr3 s GLU 61 Ca -0.02 -0.90 -0.24 0.00 0.02 0.00 0.00 54.97 53.83 2dr3 s GLU 61 Cb 0.06 0.25 -0.09 0.00 0.10 0.00 0.00 34.13 34.45 2dr3 s GLU 61 CO 0.38 -0.17 1.02 -1.58 0.02 0.00 0.00 175.26 174.94 2dr3 s HIS 62 N -3.16 3.36 0.46 1.61 5.65 -1.26 -4.72 115.29 117.23 2dr3 s HIS 62 Ca -0.00 1.67 0.23 0.00 0.25 0.00 0.00 55.06 57.21 2dr3 s HIS 62 Cb 0.02 -3.07 1.23 0.00 -1.18 0.00 0.00 32.58 29.59 2dr3 s HIS 62 CO -0.07 -0.42 1.85 -1.35 -0.65 0.00 0.00 174.74 174.10 2dr3 h PRO 63 N 2.61 0.25 -0.00 2.88 0.11 -1.91 0.33 132.00 136.26 2dr3 h PRO 63 Ca -0.48 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 2dr3 h PRO 63 Cb 1.21 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2dr3 h PRO 63 CO 0.63 0.17 0.00 0.28 -0.21 0.00 0.00 178.00 178.87 2dr3 h VAL 64 N 0.26 1.16 -0.67 3.15 2.07 -1.96 0.02 116.25 120.27 2dr3 h VAL 64 Ca 0.48 -0.46 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 2dr3 h VAL 64 Cb 1.44 1.46 -0.03 0.00 -1.52 0.00 0.00 31.29 32.64 2dr3 h VAL 64 CO -0.14 0.12 0.32 1.56 0.02 0.00 0.00 177.57 179.46 2dr3 h GLN 65 N -0.19 0.97 -0.34 1.57 1.08 -1.59 -0.90 115.11 115.72 2dr3 h GLN 65 Ca 0.00 -0.14 0.04 0.00 -1.45 0.00 0.00 58.65 57.10 2dr3 h GLN 65 Cb 0.20 -0.17 -0.04 0.00 -0.05 0.00 0.00 27.48 27.41 2dr3 h GLN 65 CO -0.00 0.77 0.12 0.28 -0.95 0.00 0.00 178.83 179.05 2dr3 h VAL 66 N 0.94 0.90 -0.88 -0.54 2.07 -0.74 0.94 116.25 118.94 2dr3 h VAL 66 Ca 0.23 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.64 2dr3 h VAL 66 Cb 0.12 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 2dr3 h VAL 66 CO -0.03 0.05 0.47 0.03 0.02 0.00 0.00 177.57 178.11 2dr3 h ARG 67 N 0.26 1.23 0.00 1.57 3.08 -0.63 0.44 114.38 120.33 2dr3 h ARG 67 Ca 0.15 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2dr3 h ARG 67 Cb 0.13 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 29.94 2dr3 h ARG 67 CO -0.16 0.91 0.00 1.96 -1.07 0.00 0.00 179.97 181.61 2dr3 h GLN 68 N 1.24 0.00 0.08 0.04 4.20 0.22 -2.07 115.11 118.83 2dr3 h GLN 68 Ca 0.31 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.67 2dr3 h GLN 68 Cb 0.04 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 2dr3 h GLN 68 CO -0.05 0.00 -1.96 0.09 -0.67 0.00 0.00 178.83 176.24 2dr3 n ASN 69 N -2.39 2.06 0.02 1.46 3.02 0.19 -3.85 115.26 115.76 2dr3 n ASN 69 Ca 0.01 0.20 -0.02 0.00 -0.03 0.00 0.00 54.58 54.74 2dr3 n ASN 69 Cb 0.19 -0.82 0.24 0.00 -0.61 0.00 0.00 39.78 38.77 2dr3 n ASN 69 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2dr3 h MET 70 N -0.15 0.48 -0.65 3.52 2.86 -1.00 -2.56 114.93 117.43 2dr3 h MET 70 Ca -0.44 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.02 2dr3 h MET 70 Cb 1.88 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 33.47 2dr3 h MET 70 CO -0.00 0.64 0.30 0.00 1.06 0.00 0.00 176.91 178.91 2dr3 h ALA 71 N 1.38 1.31 0.00 6.32 0.00 -0.75 -0.11 119.26 127.41 2dr3 h ALA 71 Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2dr3 h ALA 71 Cb 0.55 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2dr3 h ALA 71 CO 0.04 0.53 0.00 0.94 0.00 0.00 0.00 179.25 180.76 2dr3 n GLN 72 N -4.34 0.01 -0.15 0.00 7.27 -0.97 -0.40 117.38 118.80 2dr3 n GLN 72 Ca 0.06 0.42 0.05 0.00 0.07 0.00 0.00 57.00 57.60 2dr3 n GLN 72 Cb 0.14 -1.50 0.13 0.00 2.41 0.00 0.00 30.24 31.42 2dr3 n GLN 72 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 2dr3 n PHE 73 N -1.48 0.39 -0.83 3.69 3.72 -0.41 -4.94 117.46 117.60 2dr3 n PHE 73 Ca 0.01 -0.53 0.00 0.00 -0.05 0.00 0.00 57.45 56.88 2dr3 n PHE 73 Cb 0.04 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 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 0.22 0.52 3.10 1.37 0.00 0.46 -4.61 105.19 106.26 2dr3 n GLY 74 Ca 0.10 -0.54 -0.36 0.00 0.00 0.00 0.00 46.02 45.21 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 3.50 -0.40 1.61 0.51 -0.19 -4.98 118.94 116.99 2dr3 s TRP 75 Ca 0.00 -2.58 -0.15 0.00 -2.12 0.00 0.00 56.10 51.25 2dr3 s TRP 75 Cb 0.00 -3.20 0.01 0.00 -0.81 0.00 0.00 33.47 29.47 2dr3 s TRP 75 CO 0.00 -0.91 0.30 0.34 -0.51 0.00 0.00 176.95 176.17 2dr3 s ASP 76 N 1.25 6.11 0.00 2.95 -1.08 -1.26 -2.02 116.67 122.62 2dr3 s ASP 76 Ca 0.12 -0.79 0.27 0.00 -0.52 0.00 0.00 52.55 51.63 2dr3 s ASP 76 Cb -0.22 -2.16 0.87 0.00 -1.46 0.00 0.00 42.92 39.96 2dr3 s ASP 76 CO -0.04 -0.42 1.64 1.33 0.52 0.00 0.00 175.17 178.21 2dr3 n VAL 77 N 5.17 0.03 0.03 1.11 0.24 -1.26 -4.40 118.33 119.25 2dr3 n VAL 77 Ca -0.11 -0.31 -0.11 0.00 -2.04 0.00 0.00 64.34 61.77 2dr3 n VAL 77 Cb 0.48 0.66 -0.04 0.00 -1.47 0.00 0.00 33.84 33.46 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 2.76 -0.38 -0.60 7.34 1.57 -1.98 -1.12 116.57 124.16 2dr3 h LYS 78 Ca 0.00 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 58.92 2dr3 h LYS 78 Cb 0.59 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.95 2dr3 h LYS 78 CO 0.00 -0.25 0.41 -1.35 -0.57 0.00 0.00 179.45 177.69 2dr3 h PRO 79 N -0.39 0.34 0.05 3.15 0.11 -2.01 -2.47 132.00 130.77 2dr3 h PRO 79 Ca 0.08 -0.02 -0.25 0.00 0.11 0.00 0.00 66.00 65.91 2dr3 h PRO 79 Cb 0.50 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 31.55 2dr3 h PRO 79 CO -0.28 0.22 -1.07 1.88 -0.21 0.00 0.00 178.00 178.55 2dr3 h TYR 80 N 0.35 0.73 0.00 0.65 -1.99 -1.63 -2.76 116.97 112.31 2dr3 h TYR 80 Ca 0.28 -0.43 -0.02 0.00 2.00 0.00 0.00 58.73 60.56 2dr3 h TYR 80 Cb 0.65 -0.07 -0.00 0.00 2.00 0.00 0.00 36.73 39.31 2dr3 h TYR 80 CO -0.00 1.27 -0.11 0.93 -0.00 0.00 0.00 178.16 180.25 2dr3 h GLU 81 N 0.24 0.00 0.03 4.88 5.08 -0.78 -0.21 114.58 123.82 2dr3 h GLU 81 Ca -0.12 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.16 2dr3 h GLU 81 Cb 1.72 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.98 2dr3 h GLU 81 CO 0.19 0.11 -0.34 0.93 -1.00 0.00 0.00 179.01 178.90 2dr3 h GLU 82 N 0.00 0.17 0.00 2.33 4.39 -1.47 -3.12 114.58 116.88 2dr3 h GLU 82 Ca -0.00 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2dr3 h GLU 82 Cb 0.23 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2dr3 h GLU 82 CO 0.01 1.02 0.00 1.63 -1.16 0.00 0.00 179.01 180.52 2dr3 n LYS 83 N -4.43 0.25 -1.08 2.33 5.02 -0.96 -4.82 118.16 114.47 2dr3 n LYS 83 Ca -0.11 0.13 -0.03 0.00 -2.02 0.00 0.00 58.31 56.28 2dr3 n LYS 83 Cb 0.58 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.08 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 0.04 0.59 0.22 0.72 0.00 -0.39 -4.89 105.19 101.48 2dr3 n GLY 84 Ca 0.08 -0.48 0.14 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.53 0.90 -3.75 1.61 2.81 -0.23 -4.32 117.12 111.62 2dr3 n MET 85 Ca -0.03 -0.44 -0.13 0.00 -1.81 0.00 0.00 57.70 55.29 2dr3 n MET 85 Cb 0.14 -1.49 -0.10 0.00 -0.71 0.00 0.00 33.22 31.06 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 -2.40 -0.39 0.06 2.03 5.36 -1.13 -3.16 117.98 118.36 2dr3 s PHE 86 Ca 0.29 0.92 0.02 0.00 -0.96 0.00 0.00 56.93 57.20 2dr3 s PHE 86 Cb 0.20 0.14 -0.03 0.00 -0.34 0.00 0.00 43.02 42.99 2dr3 s PHE 86 CO 0.47 -0.22 -0.08 0.00 -1.46 0.00 0.00 175.22 173.93 2dr3 s ALA 87 N 0.02 0.76 -0.05 11.12 0.00 -0.62 -4.04 121.76 128.96 2dr3 s ALA 87 Ca -0.02 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 50.97 2dr3 s ALA 87 Cb -0.03 0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.18 2dr3 s ALA 87 CO 0.01 -0.08 -0.06 1.41 0.00 0.00 0.00 175.76 177.04 2dr3 s MET 88 N -2.38 0.99 -0.14 0.00 1.75 -1.26 -1.85 119.30 116.41 2dr3 s MET 88 Ca -0.02 -0.18 -0.06 0.00 -1.25 0.00 0.00 55.69 54.18 2dr3 s MET 88 Cb -0.05 -0.93 -0.04 0.00 2.84 0.00 0.00 34.83 36.65 2dr3 s MET 88 CO -0.01 -0.04 0.09 0.08 -0.65 0.00 0.00 175.02 174.49 2dr3 s VAL 89 N 0.78 5.04 -0.61 10.11 1.01 -0.70 -4.42 120.40 131.61 2dr3 s VAL 89 Ca -0.12 0.04 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 2dr3 s VAL 89 Cb -0.14 -3.21 0.14 0.00 0.00 0.00 0.00 36.38 33.17 2dr3 s VAL 89 CO 0.01 0.56 0.60 -0.62 0.00 0.00 0.00 175.10 175.65 2dr3 s ASP 90 N -0.51 6.30 -0.19 3.32 3.68 -0.22 -1.41 116.67 127.63 2dr3 s ASP 90 Ca 0.11 -1.88 0.13 0.00 2.13 0.00 0.00 52.55 53.04 2dr3 s ASP 90 Cb -0.12 -2.23 0.43 0.00 -1.45 0.00 0.00 42.92 39.55 2dr3 s ASP 90 CO 0.02 -0.87 1.21 0.00 0.13 0.00 0.00 175.17 175.66 2dr3 n ALA 91 N 5.30 3.65 -0.08 3.66 0.00 -0.37 -1.43 120.51 131.24 2dr3 n ALA 91 Ca -0.07 -3.24 -0.14 0.00 0.00 0.00 0.00 53.44 49.99 2dr3 n ALA 91 Cb 0.42 -0.41 -0.05 0.00 0.00 0.00 0.00 19.45 19.42 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 -0.85 0.00 -0.17 0.00 7.35 -0.80 -4.24 117.46 118.75 2dr3 n PHE 92 Ca 0.20 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.86 2dr3 n PHE 92 Cb 0.79 -0.53 0.03 0.00 0.35 0.00 0.00 39.48 40.11 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 -0.73 0.33 -0.09 -2.13 2.02 -1.88 0.26 112.91 110.69 2dr3 h THR 93 Ca -0.24 0.00 0.03 0.00 0.77 0.00 0.00 66.41 66.97 2dr3 h THR 93 Cb 1.06 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 2dr3 h THR 93 CO -0.15 0.00 0.18 0.00 0.37 0.00 0.00 175.52 175.93 2dr3 h ALA 94 N 1.30 1.48 0.00 6.16 0.00 -1.77 0.16 119.26 126.59 2dr3 h ALA 94 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2dr3 h ALA 94 Cb 0.48 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2dr3 h ALA 94 CO -0.60 -0.23 0.00 0.78 0.00 0.00 0.00 179.25 179.20 2dr3 h GLY 95 N 0.00 0.00 -5.12 0.00 0.00 -1.18 -3.33 103.07 93.44 2dr3 h GLY 95 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.07 2dr3 h GLY 95 CO -0.00 0.00 -1.07 0.29 0.00 0.00 0.00 176.54 175.76 2dr3 n ILE 96 N -2.96 1.47 0.00 2.60 -5.35 0.00 -5.11 119.36 110.00 2dr3 n ILE 96 Ca 0.03 -3.17 0.00 0.00 -0.27 0.00 0.00 62.75 59.34 2dr3 n ILE 96 Cb 0.42 0.83 0.00 0.00 -1.74 0.00 0.00 39.64 39.16 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 -0.58 2.49 0.60 3.28 0.00 -0.94 -4.92 105.19 105.12 2dr3 n GLY 97 Ca 0.14 -1.84 0.05 0.00 0.00 0.00 0.00 46.02 44.37 2dr3 n GLY 97 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dr3 n LYS 98 N -1.90 1.60 -2.28 1.61 5.02 -1.26 -3.69 118.16 117.26 2dr3 n LYS 98 Ca 0.00 -3.17 -0.36 0.00 -2.02 0.00 0.00 58.31 52.75 2dr3 n LYS 98 Cb 0.00 -1.63 -0.01 0.00 -0.02 0.00 0.00 35.03 33.37 2dr3 n LYS 98 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2dr3 s SER 99 N -3.07 6.05 0.47 4.39 0.01 -1.26 -5.04 113.70 115.24 2dr3 s SER 99 Ca 0.38 2.24 -0.03 0.00 1.31 0.00 0.00 55.95 59.85 2dr3 s SER 99 Cb 0.36 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.98 2dr3 s SER 99 CO -0.04 -1.00 0.74 -1.59 0.41 0.00 0.00 173.24 171.76 2dr3 s LYS 100 N -2.91 3.28 -0.02 12.44 -2.85 -1.26 -4.95 119.74 123.46 2dr3 s LYS 100 Ca 0.67 -0.12 -0.06 0.00 -1.00 0.00 0.00 55.97 55.46 2dr3 s LYS 100 Cb -0.26 -2.45 0.02 0.00 -2.06 0.00 0.00 37.83 33.08 2dr3 s LYS 100 CO 0.31 -0.26 0.28 -1.91 0.10 0.00 0.00 175.35 173.87 2dr3 n GLU 101 N -2.20 0.01 -4.40 1.78 4.07 -1.26 -5.16 120.64 113.48 2dr3 n GLU 101 Ca 0.01 -0.12 -0.34 0.00 -0.06 0.00 0.00 57.16 56.65 2dr3 n GLU 101 Cb 0.56 0.22 -0.12 0.00 -0.06 0.00 0.00 31.44 32.05 2dr3 n GLU 101 CO 0.00 0.00 0.00 -0.47 -0.06 0.00 0.00 177.13 176.60 2dr3 s TYR 102 N -2.27 3.04 0.00 4.31 5.04 -1.26 -5.05 117.35 121.16 2dr3 s TYR 102 Ca 0.07 -0.19 0.00 0.00 -2.44 0.00 0.00 57.07 54.51 2dr3 s TYR 102 Cb -0.00 -1.92 0.00 0.00 0.35 0.00 0.00 41.96 40.39 2dr3 s TYR 102 CO -0.00 0.07 0.00 -1.91 -1.34 0.00 0.00 175.55 172.37 2dr3 n GLU 103 N 3.23 0.00 -0.32 4.97 4.07 -1.26 -5.04 120.64 126.30 2dr3 n GLU 103 Ca -0.18 0.00 0.10 0.00 -0.06 0.00 0.00 57.16 57.03 2dr3 n GLU 103 Cb 0.53 0.00 0.28 0.00 -0.06 0.00 0.00 31.44 32.18 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 0.61 -4.93 5.31 3.64 -1.97 -3.37 116.57 115.86 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 -0.14 -0.31 0.00 -0.41 0.00 0.00 32.23 31.37 2dr3 h LYS 104 CO 0.00 0.40 -0.75 0.71 -2.27 0.00 0.00 179.45 177.55 2dr3 s TYR 105 N -5.91 3.03 -0.01 1.91 2.02 -1.26 -5.09 117.35 112.03 2dr3 s TYR 105 Ca -0.12 -1.45 0.00 0.00 -0.37 0.00 0.00 57.07 55.14 2dr3 s TYR 105 Cb 0.24 -2.06 0.01 0.00 -0.40 0.00 0.00 41.96 39.74 2dr3 s TYR 105 CO 0.79 -0.70 -0.00 0.42 -1.57 0.00 0.00 175.55 174.48 2dr3 s ILE 106 N 1.35 0.09 -0.33 2.71 1.01 -1.26 -1.06 121.20 123.71 2dr3 s ILE 106 Ca 0.01 0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.60 2dr3 s ILE 106 Cb -0.16 -0.13 0.01 0.00 0.01 0.00 0.00 42.46 42.19 2dr3 s ILE 106 CO -0.05 0.07 0.16 -0.69 0.00 0.00 0.00 174.94 174.43 2dr3 s VAL 107 N 0.43 4.46 0.12 2.92 1.01 -0.52 -4.96 120.40 123.85 2dr3 s VAL 107 Ca -0.04 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.33 2dr3 s VAL 107 Cb -0.06 -3.37 -0.22 0.00 0.00 0.00 0.00 36.38 32.73 2dr3 s VAL 107 CO -0.01 -0.05 1.27 0.45 0.00 0.00 0.00 175.10 176.75 2dr3 h HIS 108 N 8.36 0.11 -3.29 5.22 -0.00 -1.97 -3.40 115.15 120.18 2dr3 h HIS 108 Ca -0.29 -0.08 -0.52 0.00 -0.00 0.00 0.00 60.37 59.49 2dr3 h HIS 108 Cb 1.12 -0.00 -0.35 0.00 -0.00 0.00 0.00 27.41 28.18 2dr3 h HIS 108 CO 0.61 1.04 -0.81 0.34 -0.00 0.00 0.00 177.93 179.12 2dr3 s ASP 109 N -6.81 1.95 -0.19 2.45 3.68 -1.26 -4.73 116.67 111.77 2dr3 s ASP 109 Ca -0.00 -0.29 0.16 0.00 2.13 0.00 0.00 52.55 54.55 2dr3 s ASP 109 Cb 0.09 -0.82 0.58 0.00 -1.45 0.00 0.00 42.92 41.33 2dr3 s ASP 109 CO 0.83 -0.05 1.48 0.18 0.13 0.00 0.00 175.17 177.74 2dr3 n LEU 110 N 4.44 4.22 -0.14 -1.34 4.77 -1.26 -4.48 117.00 123.20 2dr3 n LEU 110 Ca -0.17 -2.99 -0.12 0.00 -0.03 0.00 0.00 56.01 52.69 2dr3 n LEU 110 Cb 0.51 -0.57 -0.01 0.00 -2.33 0.00 0.00 43.42 41.02 2dr3 n LEU 110 CO 0.20 0.67 0.62 0.74 -1.33 0.00 0.00 177.39 178.30 2dr3 h THR 111 N 2.21 1.27 -2.69 -5.08 2.02 -1.97 -3.43 112.91 105.24 2dr3 h THR 111 Ca 0.00 -1.43 -0.57 0.00 0.77 0.00 0.00 66.41 65.18 2dr3 h THR 111 Cb 1.54 1.25 -0.15 0.00 -1.74 0.00 0.00 68.15 69.05 2dr3 h THR 111 CO 0.27 0.49 -0.77 -1.81 0.37 0.00 0.00 175.52 174.07 2dr3 s ASP 112 N -6.72 3.19 0.00 4.18 1.11 -1.26 -5.04 116.67 112.13 2dr3 s ASP 112 Ca -0.11 -0.98 0.22 0.00 0.18 0.00 0.00 52.55 51.86 2dr3 s ASP 112 Cb 0.11 -0.23 0.60 0.00 1.07 0.00 0.00 42.92 44.47 2dr3 s ASP 112 CO 0.87 -0.01 1.48 -0.38 1.18 0.00 0.00 175.17 178.31 2dr3 n ILE 113 N -0.28 0.30 0.16 0.77 -0.00 -1.26 -4.40 119.36 114.64 2dr3 n ILE 113 Ca -0.08 -0.50 -0.14 0.00 -0.00 0.00 0.00 62.75 62.02 2dr3 n ILE 113 Cb 0.59 0.68 -0.08 0.00 -0.00 0.00 0.00 39.64 40.84 2dr3 n ILE 113 CO 0.00 0.00 0.00 0.03 -0.00 0.00 0.00 176.55 176.58 2dr3 h ARG 114 N 3.24 -0.32 -0.68 0.38 3.08 -1.96 -1.74 114.38 116.38 2dr3 h ARG 114 Ca 0.00 0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 2dr3 h ARG 114 Cb 0.71 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.80 2dr3 h ARG 114 CO 0.00 -0.21 0.13 1.49 -1.07 0.00 0.00 179.97 180.31 2dr3 h GLU 115 N -0.33 1.11 -0.41 0.04 4.81 -1.86 -1.76 114.58 116.18 2dr3 h GLU 115 Ca -0.03 -0.28 0.09 0.00 -0.13 0.00 0.00 59.36 59.00 2dr3 h GLU 115 Cb 0.26 -0.14 -0.09 0.00 0.63 0.00 0.00 28.75 29.41 2dr3 h GLU 115 CO 0.05 1.00 -0.25 0.35 -0.73 0.00 0.00 179.01 179.43 2dr3 h PHE 116 N 1.04 -0.66 -0.37 0.92 3.04 -1.74 0.30 116.94 119.48 2dr3 h PHE 116 Ca 0.21 0.05 -0.04 0.00 3.98 0.00 0.00 57.97 62.18 2dr3 h PHE 116 Cb 0.41 0.35 -0.01 0.00 2.56 0.00 0.00 35.95 39.26 2dr3 h PHE 116 CO 0.03 -0.33 0.09 0.82 -2.02 0.00 0.00 178.31 176.91 2dr3 h ILE 117 N -0.18 1.22 -0.07 1.41 2.04 -1.14 0.48 117.51 121.27 2dr3 h ILE 117 Ca 0.19 -0.76 0.03 0.00 1.00 0.00 0.00 64.86 65.32 2dr3 h ILE 117 Cb 0.48 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 2dr3 h ILE 117 CO -0.52 0.26 -0.52 -0.08 0.00 0.00 0.00 178.15 177.29 2dr3 h GLU 118 N 0.44 -0.59 -1.01 2.37 4.81 -0.27 0.62 114.58 120.95 2dr3 h GLU 118 Ca 0.11 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.41 2dr3 h GLU 118 Cb 0.30 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.76 2dr3 h GLU 118 CO 0.00 -0.39 0.66 0.28 -0.73 0.00 0.00 179.01 178.83 2dr3 h VAL 119 N -0.61 1.21 -0.34 0.32 2.07 -0.35 -1.94 116.25 116.61 2dr3 h VAL 119 Ca 0.03 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 2dr3 h VAL 119 Cb 0.70 -0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 2dr3 h VAL 119 CO -0.40 0.24 0.06 0.25 0.02 0.00 0.00 177.57 177.74 2dr3 h LEU 120 N 1.31 0.54 -1.00 2.57 5.85 0.45 0.98 115.31 126.01 2dr3 h LEU 120 Ca 0.39 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 2dr3 h LEU 120 Cb -0.07 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 2dr3 h LEU 120 CO -0.11 0.66 0.17 0.03 -0.34 0.00 0.00 178.44 178.86 2dr3 h ARG 121 N 0.40 0.89 -0.39 1.25 3.08 0.47 0.21 114.38 120.28 2dr3 h ARG 121 Ca 0.10 -0.17 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 2dr3 h ARG 121 Cb 0.35 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 2dr3 h ARG 121 CO 0.01 0.78 -0.03 0.37 -1.07 0.00 0.00 179.97 180.03 2dr3 h GLN 122 N 0.86 0.71 -0.24 0.04 5.75 -1.11 -1.99 115.11 119.13 2dr3 h GLN 122 Ca 0.19 -0.24 -0.09 0.00 -0.15 0.00 0.00 58.65 58.37 2dr3 h GLN 122 Cb 0.27 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.75 2dr3 h GLN 122 CO -0.01 0.82 -0.22 0.00 -2.65 0.00 0.00 178.83 176.77 2dr3 h ALA 123 N 0.87 1.16 -0.03 3.38 0.00 -0.15 -2.13 119.26 122.37 2dr3 h ALA 123 Ca 0.11 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2dr3 h ALA 123 Cb 0.51 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2dr3 h ALA 123 CO 0.03 0.53 -0.43 0.82 0.00 0.00 0.00 179.25 180.20 2dr3 h ILE 124 N 0.40 1.31 0.20 0.00 2.04 -0.34 -3.30 117.51 117.83 2dr3 h ILE 124 Ca 0.06 -1.51 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 2dr3 h ILE 124 Cb 0.62 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 2dr3 h ILE 124 CO 0.04 0.44 -0.09 0.03 0.00 0.00 0.00 178.15 178.57 2dr3 h ARG 125 N 0.06 -0.25 -0.78 2.37 3.08 -0.77 -3.16 114.38 114.93 2dr3 h ARG 125 Ca 0.00 0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.22 2dr3 h ARG 125 Cb 0.79 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.84 2dr3 h ARG 125 CO 0.06 0.13 0.52 -0.44 -1.07 0.00 0.00 179.97 179.17 2dr3 h ASP 126 N -0.90 0.40 -2.24 7.04 3.32 -1.50 -3.42 116.42 119.13 2dr3 h ASP 126 Ca -0.03 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2dr3 h ASP 126 Cb 0.50 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.00 2dr3 h ASP 126 CO 0.04 0.20 0.00 2.30 -1.72 0.00 0.00 179.24 180.07 2dr3 n ILE 127 N -4.48 0.00 -2.13 0.35 -5.35 -1.24 -5.03 119.36 101.47 2dr3 n ILE 127 Ca 0.15 0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 62.32 2dr3 n ILE 127 Cb 0.55 -0.50 0.02 0.00 -1.74 0.00 0.00 39.64 37.97 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 -0.74 5.88 -4.31 7.28 4.13 -1.26 -4.88 115.26 121.36 2dr3 n ASN 128 Ca 0.00 -3.77 -0.56 0.00 1.68 0.00 0.00 54.58 51.94 2dr3 n ASN 128 Cb 0.00 -0.68 -0.13 0.00 -1.54 0.00 0.00 39.78 37.44 2dr3 n ASN 128 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2dr3 n ALA 129 N -0.57 0.25 -0.01 5.41 0.00 -1.19 -4.24 120.51 120.16 2dr3 n ALA 129 Ca 0.47 0.08 0.02 0.00 0.00 0.00 0.00 53.44 54.01 2dr3 n ALA 129 Cb 0.58 -2.13 -0.04 0.00 0.00 0.00 0.00 19.45 17.85 2dr3 n ALA 129 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dr3 n LYS 130 N 7.73 0.57 -4.66 0.00 4.76 0.18 -4.52 118.16 122.22 2dr3 n LYS 130 Ca 0.57 -0.04 -0.23 0.00 -2.87 0.00 0.00 58.31 55.74 2dr3 n LYS 130 Cb -0.02 -1.13 -0.15 0.00 -1.84 0.00 0.00 35.03 31.89 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 -2.35 1.26 0.04 1.97 0.52 -0.61 -0.57 118.95 119.20 2dr3 s ARG 131 Ca -0.02 -0.50 0.02 0.00 -0.52 0.00 0.00 55.73 54.71 2dr3 s ARG 131 Cb 0.03 -1.18 -0.02 0.00 0.52 0.00 0.00 34.95 34.30 2dr3 s ARG 131 CO 0.23 0.26 -0.08 0.08 0.02 0.00 0.00 175.30 175.81 2dr3 s VAL 132 N -0.17 0.55 -0.04 3.52 1.01 -0.79 -0.23 120.40 124.24 2dr3 s VAL 132 Ca 0.02 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 61.00 2dr3 s VAL 132 Cb -0.07 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.74 2dr3 s VAL 132 CO 0.00 -0.32 0.03 -0.69 0.00 0.00 0.00 175.10 174.13 2dr3 s VAL 133 N -1.23 0.07 -0.35 2.92 1.01 0.17 -1.72 120.40 121.27 2dr3 s VAL 133 Ca -0.08 0.27 -0.06 0.00 0.00 0.00 0.00 61.98 62.11 2dr3 s VAL 133 Cb -0.09 -0.26 0.06 0.00 0.00 0.00 0.00 36.38 36.09 2dr3 s VAL 133 CO 0.00 0.18 0.12 -0.69 0.00 0.00 0.00 175.10 174.72 2dr3 s VAL 134 N 1.78 3.65 -0.22 2.92 1.01 -0.72 0.72 120.40 129.55 2dr3 s VAL 134 Ca 0.01 -1.33 -0.02 0.00 0.00 0.00 0.00 61.98 60.63 2dr3 s VAL 134 Cb -0.12 -3.15 0.07 0.00 0.00 0.00 0.00 36.38 33.17 2dr3 s VAL 134 CO -0.03 -0.28 0.04 -0.62 0.00 0.00 0.00 175.10 174.21 2dr3 s ASP 135 N 1.54 3.13 -0.01 3.32 2.15 -0.79 -0.43 116.67 125.58 2dr3 s ASP 135 Ca -0.00 -0.97 0.07 0.00 0.43 0.00 0.00 52.55 52.08 2dr3 s ASP 135 Cb -0.20 -0.65 -0.02 0.00 -0.30 0.00 0.00 42.92 41.74 2dr3 s ASP 135 CO 0.01 -0.32 -0.22 -0.94 -0.17 0.00 0.00 175.17 173.53 2dr3 s SER 136 N 1.81 3.43 0.61 -0.34 1.04 -1.26 -1.13 113.70 117.86 2dr3 s SER 136 Ca 0.01 -0.42 0.32 0.00 0.48 0.00 0.00 55.95 56.34 2dr3 s SER 136 Cb -0.17 -0.50 1.82 0.00 0.10 0.00 0.00 66.02 67.27 2dr3 s SER 136 CO -0.11 0.31 2.17 1.62 0.98 0.00 0.00 173.24 178.21 2dr3 h VAL 137 N 4.32 0.38 -0.92 5.02 3.04 -1.20 -2.05 116.25 124.84 2dr3 h VAL 137 Ca -0.45 0.00 0.09 0.00 -1.01 0.00 0.00 66.70 65.33 2dr3 h VAL 137 Cb 1.14 0.90 -0.07 0.00 -2.01 0.00 0.00 31.29 31.25 2dr3 h VAL 137 CO 0.47 0.00 0.59 0.74 -1.01 0.00 0.00 177.57 178.37 2dr3 h THR 138 N 0.00 1.00 -0.08 3.17 2.02 -1.92 -1.27 112.91 115.82 2dr3 h THR 138 Ca 0.04 -0.33 0.02 0.00 0.77 0.00 0.00 66.41 66.92 2dr3 h THR 138 Cb 0.29 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.65 2dr3 h THR 138 CO -0.00 0.18 0.07 0.74 0.37 0.00 0.00 175.52 176.87 2dr3 h THR 139 N 0.96 0.83 -0.40 3.16 2.02 -1.72 0.27 112.91 118.02 2dr3 h THR 139 Ca 0.42 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.57 2dr3 h THR 139 Cb 0.34 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2dr3 h THR 139 CO -0.18 0.00 0.14 -0.07 0.37 0.00 0.00 175.52 175.79 2dr3 h LEU 140 N 0.00 0.52 -0.67 2.58 3.38 -1.38 -3.36 115.31 116.38 2dr3 h LEU 140 Ca 0.04 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2dr3 h LEU 140 Cb 0.17 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2dr3 h LEU 140 CO -0.00 0.48 0.00 0.00 0.09 0.00 0.00 178.44 179.01 2dr3 n TYR 141 N -4.37 0.00 -0.35 1.13 0.18 -0.93 -4.87 117.16 107.96 2dr3 n TYR 141 Ca 0.03 -0.04 0.29 0.00 1.88 0.00 0.00 57.90 60.05 2dr3 n TYR 141 Cb 0.16 -0.00 0.61 0.00 -0.38 0.00 0.00 39.34 39.72 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 1.11 0.42 -0.01 -3.48 6.09 -1.11 0.29 117.51 120.82 2dr3 h ILE 142 Ca 0.00 -0.08 0.00 0.00 -1.37 0.00 0.00 64.86 63.41 2dr3 h ILE 142 Cb 0.50 0.18 0.00 0.00 0.47 0.00 0.00 36.82 37.96 2dr3 h ILE 142 CO 0.00 0.04 -0.42 0.59 -3.07 0.00 0.00 178.15 175.29 2dr3 n ASN 143 N -4.49 1.64 -3.19 2.19 3.02 -1.26 -4.43 115.26 108.73 2dr3 n ASN 143 Ca 0.27 -1.27 -0.22 0.00 -0.03 0.00 0.00 54.58 53.33 2dr3 n ASN 143 Cb 1.09 0.37 -0.05 0.00 -0.61 0.00 0.00 39.78 40.58 2dr3 n ASN 143 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2dr3 n LYS 144 N -0.30 1.02 -0.03 3.52 2.85 0.96 -4.99 118.16 121.20 2dr3 n LYS 144 Ca 0.10 -3.44 0.24 0.00 -1.05 0.00 0.00 58.31 54.16 2dr3 n LYS 144 Cb 0.42 -1.50 0.71 0.00 -0.65 0.00 0.00 35.03 34.01 2dr3 n LYS 144 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 2dr3 h PRO 145 N 3.59 0.00 0.00 -1.58 0.13 -1.62 -1.06 132.00 131.45 2dr3 h PRO 145 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2dr3 h PRO 145 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2dr3 h PRO 145 CO 0.51 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.28 2dr3 h ALA 146 N 1.42 1.00 0.00 -0.56 0.00 -1.94 -2.91 119.26 116.27 2dr3 h ALA 146 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2dr3 h ALA 146 Cb 1.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2dr3 h ALA 146 CO -0.00 0.00 -0.60 -1.33 0.00 0.00 0.00 179.25 177.32 2dr3 n MET 147 N -2.93 0.20 -0.11 0.00 2.81 -0.40 -4.36 117.12 112.32 2dr3 n MET 147 Ca 0.01 0.05 -0.05 0.00 -1.81 0.00 0.00 57.70 55.91 2dr3 n MET 147 Cb 0.33 -1.62 0.01 0.00 -0.71 0.00 0.00 33.22 31.23 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 2.66 0.14 0.04 3.04 0.00 -1.60 -1.80 119.26 121.74 2dr3 h ALA 148 Ca 0.00 0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.08 2dr3 h ALA 148 Cb 0.67 0.42 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 2dr3 h ALA 148 CO 0.00 -0.53 -0.42 -0.09 0.00 0.00 0.00 179.25 178.21 2dr3 h ARG 149 N -0.09 -0.58 -0.73 0.00 2.43 -1.80 0.10 114.38 113.72 2dr3 h ARG 149 Ca 0.19 0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.34 2dr3 h ARG 149 Cb 0.39 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 2dr3 h ARG 149 CO -0.45 -0.38 0.22 0.66 -1.51 0.00 0.00 179.97 178.50 2dr3 h SER 150 N -0.60 1.06 -0.20 -3.80 4.64 -1.82 -1.25 113.55 111.58 2dr3 h SER 150 Ca 0.04 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2dr3 h SER 150 Cb 0.66 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 2dr3 h SER 150 CO -0.29 0.98 0.13 0.40 -0.87 0.00 0.00 176.83 177.18 2dr3 h ILE 151 N 1.08 1.06 -0.23 0.95 2.04 -0.98 0.38 117.51 121.80 2dr3 h ILE 151 Ca 0.23 -0.11 0.01 0.00 1.00 0.00 0.00 64.86 65.99 2dr3 h ILE 151 Cb 0.31 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2dr3 h ILE 151 CO -0.01 0.05 0.13 0.40 0.00 0.00 0.00 178.15 178.73 2dr3 h ILE 152 N 0.27 1.02 -0.19 -0.67 1.08 -0.56 -1.36 117.51 117.09 2dr3 h ILE 152 Ca 0.07 -0.09 -0.13 0.00 -0.39 0.00 0.00 64.86 64.32 2dr3 h ILE 152 Cb -0.02 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 34.44 2dr3 h ILE 152 CO -0.02 0.05 -0.43 -0.07 -0.69 0.00 0.00 178.15 177.00 2dr3 h LEU 153 N 0.28 0.50 -0.38 1.44 3.38 -0.96 -1.44 115.31 118.12 2dr3 h LEU 153 Ca 0.09 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2dr3 h LEU 153 Cb -0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2dr3 h LEU 153 CO -0.05 0.86 0.01 1.56 0.09 0.00 0.00 178.44 180.92 2dr3 h GLN 154 N 0.38 0.65 -0.34 1.13 4.20 -0.01 -1.90 115.11 119.23 2dr3 h GLN 154 Ca 0.03 -0.20 -0.11 0.00 0.06 0.00 0.00 58.65 58.43 2dr3 h GLN 154 Cb 0.91 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.61 2dr3 h GLN 154 CO 0.08 0.75 -0.24 -0.07 -0.67 0.00 0.00 178.83 178.67 2dr3 h LEU 155 N 0.48 0.68 0.24 1.46 3.38 -1.18 -2.59 115.31 117.78 2dr3 h LEU 155 Ca 0.11 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2dr3 h LEU 155 Cb 0.44 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2dr3 h LEU 155 CO 0.02 0.91 -0.26 0.50 0.09 0.00 0.00 178.44 179.70 2dr3 h LYS 156 N 0.59 -0.52 -0.31 1.13 3.64 -1.04 -1.80 116.57 118.26 2dr3 h LYS 156 Ca 0.08 0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.56 2dr3 h LYS 156 Cb 0.73 0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.60 2dr3 h LYS 156 CO 0.06 -0.34 -0.08 -0.09 -2.27 0.00 0.00 179.45 176.72 2dr3 h ARG 157 N -0.53 -0.01 -0.09 1.90 2.43 -1.29 0.41 114.38 117.20 2dr3 h ARG 157 Ca -0.00 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 2dr3 h ARG 157 Cb 0.50 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.00 2dr3 h ARG 157 CO -0.07 -0.00 -0.45 0.28 -1.51 0.00 0.00 179.97 178.22 2dr3 h VAL 158 N -0.01 0.00 -0.51 0.20 2.07 -1.16 0.60 116.25 117.44 2dr3 h VAL 158 Ca 0.15 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.67 2dr3 h VAL 158 Cb 0.23 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 2dr3 h VAL 158 CO -0.32 0.00 0.32 -0.07 0.02 0.00 0.00 177.57 177.52 2dr3 h LEU 159 N -0.49 0.61 -0.72 2.57 3.38 -1.13 -2.53 115.31 117.00 2dr3 h LEU 159 Ca 0.02 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2dr3 h LEU 159 Cb 0.57 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 2dr3 h LEU 159 CO -0.34 0.47 0.15 0.00 0.09 0.00 0.00 178.44 178.81 2dr3 h ALA 160 N 1.16 0.95 0.00 1.53 0.00 -0.71 -0.17 119.26 122.02 2dr3 h ALA 160 Ca 0.19 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2dr3 h ALA 160 Cb -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.49 2dr3 h ALA 160 CO -0.04 0.67 0.00 0.78 0.00 0.00 0.00 179.25 180.66 2dr3 h GLY 161 N 1.07 0.00 -1.51 0.00 0.00 0.62 -1.96 103.07 101.29 2dr3 h GLY 161 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2dr3 h GLY 161 CO 0.01 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.25 2dr3 n THR 162 N -2.90 1.45 -1.03 4.70 -2.24 -0.90 -4.96 114.28 108.40 2dr3 n THR 162 Ca -0.02 -1.28 -0.01 0.00 -2.27 0.00 0.00 64.05 60.47 2dr3 n THR 162 Cb 0.11 0.24 -0.00 0.00 -2.10 0.00 0.00 70.33 68.58 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 0.25 0.46 3.79 3.38 0.00 -0.74 -4.96 105.19 107.37 2dr3 n GLY 163 Ca 0.16 -0.16 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.46 3.66 0.17 0.00 2.01 0.26 -3.83 115.64 116.46 2dr3 s THR 165 Ca 0.45 -0.44 0.05 0.00 0.31 0.00 0.00 61.69 62.06 2dr3 s THR 165 Cb -0.20 -2.60 -0.05 0.00 0.01 0.00 0.00 72.50 69.67 2dr3 s THR 165 CO 0.24 0.49 -0.10 -0.44 -0.69 0.00 0.00 174.62 174.12 2dr3 s SER 166 N 0.47 1.95 -0.15 3.53 0.01 -0.80 -1.89 113.70 116.82 2dr3 s SER 166 Ca -0.05 -1.03 0.01 0.00 1.31 0.00 0.00 55.95 56.19 2dr3 s SER 166 Cb -0.15 -0.03 0.02 0.00 0.21 0.00 0.00 66.02 66.07 2dr3 s SER 166 CO 0.03 -0.31 -0.16 -0.63 0.41 0.00 0.00 173.24 172.58 2dr3 s ILE 167 N -3.26 1.71 -0.29 1.44 1.01 -0.70 -0.14 121.20 120.98 2dr3 s ILE 167 Ca 0.19 -0.73 -0.18 0.00 0.00 0.00 0.00 60.65 59.93 2dr3 s ILE 167 Cb 0.02 -1.58 -0.02 0.00 0.01 0.00 0.00 42.46 40.89 2dr3 s ILE 167 CO 0.02 0.48 0.51 -0.36 0.00 0.00 0.00 174.94 175.59 2dr3 s PHE 168 N 1.34 3.24 -0.13 3.97 0.40 0.66 -1.75 117.98 125.71 2dr3 s PHE 168 Ca 0.03 0.50 -0.29 0.00 -0.60 0.00 0.00 56.93 56.57 2dr3 s PHE 168 Cb -0.13 -2.77 -0.01 0.00 0.51 0.00 0.00 43.02 40.62 2dr3 s PHE 168 CO -0.10 -0.35 0.99 0.08 0.70 0.00 0.00 175.22 176.55 2dr3 s VAL 169 N 2.33 4.78 -0.21 -0.44 1.01 0.43 -0.99 120.40 127.30 2dr3 s VAL 169 Ca 0.20 2.00 -0.02 0.00 0.00 0.00 0.00 61.98 64.17 2dr3 s VAL 169 Cb -0.16 -4.30 0.01 0.00 0.00 0.00 0.00 36.38 31.93 2dr3 s VAL 169 CO 0.10 -0.02 -0.10 -0.55 0.00 0.00 0.00 175.10 174.54 2dr3 s SER 170 N 1.11 3.92 -0.20 3.32 0.15 0.34 -1.40 113.70 120.94 2dr3 s SER 170 Ca 0.47 -0.54 -0.20 0.00 0.70 0.00 0.00 55.95 56.38 2dr3 s SER 170 Cb -0.18 -1.64 -0.03 0.00 -1.71 0.00 0.00 66.02 62.46 2dr3 s SER 170 CO 0.16 -0.03 0.62 -1.10 1.20 0.00 0.00 173.24 174.09 2dr3 s GLN 171 N 1.40 4.21 0.15 5.44 -0.21 -1.26 -2.61 119.66 126.78 2dr3 s GLN 171 Ca 0.05 0.59 0.11 0.00 0.02 0.00 0.00 55.36 56.13 2dr3 s GLN 171 Cb -0.14 -3.58 -0.04 0.00 1.00 0.00 0.00 33.01 30.25 2dr3 s GLN 171 CO -0.07 -0.23 -0.25 0.14 -2.12 0.00 0.00 175.29 172.77 2dr3 s VAL 172 N 1.88 2.20 0.54 1.09 -7.23 -1.01 -4.93 120.40 112.94 2dr3 s VAL 172 Ca 0.28 -1.86 -0.19 0.00 -1.81 0.00 0.00 61.98 58.41 2dr3 s VAL 172 Cb -0.16 -1.99 -0.06 0.00 0.56 0.00 0.00 36.38 34.73 2dr3 s VAL 172 CO 0.10 -0.04 1.09 -0.44 -0.31 0.00 0.00 175.10 175.50 2dr3 s SER 173 N -2.33 5.88 0.23 4.85 0.01 -1.26 -3.88 113.70 117.21 2dr3 s SER 173 Ca 0.16 2.02 -0.32 0.00 1.31 0.00 0.00 55.95 59.12 2dr3 s SER 173 Cb -0.09 -2.56 -0.13 0.00 0.21 0.00 0.00 66.02 63.45 2dr3 s SER 173 CO 0.07 -1.10 1.52 0.55 0.41 0.00 0.00 173.24 174.69 2dr3 n VAL 174 N -1.41 0.69 0.00 3.43 3.14 -1.26 -0.89 118.33 122.02 2dr3 n VAL 174 Ca 0.10 -0.17 0.00 0.00 -2.96 0.00 0.00 64.34 61.31 2dr3 n VAL 174 Cb 0.52 -1.67 0.00 0.00 -1.06 0.00 0.00 33.84 31.63 2dr3 n VAL 174 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2dr3 n GLY 175 N 2.59 3.31 3.74 7.55 0.00 -1.26 -5.03 105.19 116.08 2dr3 n GLY 175 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.65 4.42 0.05 1.61 2.56 -0.07 -4.93 118.70 121.69 2dr3 s GLU 176 Ca 0.00 2.01 0.10 0.00 0.00 0.00 0.00 54.97 57.07 2dr3 s GLU 176 Cb 0.00 -3.20 -0.22 0.00 2.00 0.00 0.00 34.13 32.71 2dr3 s GLU 176 CO 0.00 -0.20 0.99 0.07 -0.56 0.00 0.00 175.26 175.56 2dr3 h ARG 177 N 5.25 0.00 0.00 4.30 0.11 -1.96 -3.47 114.38 118.61 2dr3 h ARG 177 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 2dr3 h ARG 177 Cb 1.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.29 2dr3 h ARG 177 CO 0.76 0.76 0.00 0.41 0.10 0.00 0.00 179.97 182.00 2dr3 n GLY 178 N 1.44 1.70 0.00 0.08 0.00 -1.26 -5.05 105.19 102.10 2dr3 n GLY 178 Ca -0.08 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 43.98 2dr3 n GLY 178 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2dr3 n PHE 179 N 0.00 0.00 0.00 1.61 3.72 -1.26 -4.91 117.46 116.62 2dr3 n PHE 179 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2dr3 n PHE 179 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 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 1.29 0.00 0.00 1.37 0.00 -1.26 -4.81 105.19 101.78 2dr3 n GLY 180 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.69 3.47 -0.02 0.00 -1.26 -4.67 105.19 102.03 2dr3 n GLY 181 Ca 0.00 -1.73 -0.49 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.71 1.24 0.00 1.61 -0.02 -1.26 -2.99 135.00 132.87 2dr3 n PRO 182 Ca 0.00 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2dr3 n PRO 182 Cb 0.00 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 30.89 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 6.37 1.50 0.14 -1.23 0.00 -1.26 -4.73 105.19 105.99 2dr3 n GLY 183 Ca 0.39 -0.59 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 2dr3 n GLY 183 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2dr3 n VAL 184 N 0.00 -0.23 0.25 1.61 0.31 -1.16 -1.92 118.33 117.18 2dr3 n VAL 184 Ca 0.00 1.08 0.10 0.00 -0.01 0.00 0.00 64.34 65.51 2dr3 n VAL 184 Cb 0.00 -1.36 0.67 0.00 -0.91 0.00 0.00 33.84 32.24 2dr3 n VAL 184 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 2dr3 h GLU 185 N 0.00 0.00 0.00 5.55 4.11 -1.86 -2.72 114.58 119.65 2dr3 h GLU 185 Ca 0.05 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.33 2dr3 h GLU 185 Cb 0.14 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 2dr3 h GLU 185 CO -0.32 0.12 -1.25 0.45 0.07 0.00 0.00 179.01 178.08 2dr3 h HIS 186 N 0.00 0.00 0.00 2.06 3.86 -1.68 -3.37 115.15 116.02 2dr3 h HIS 186 Ca -0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 2dr3 h HIS 186 Cb 0.26 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.72 2dr3 h HIS 186 CO 0.00 0.57 -0.13 0.78 0.86 0.00 0.00 177.93 180.01 2dr3 h GLY 187 N 3.67 0.00 -1.90 2.45 0.00 -1.17 -3.46 103.07 102.65 2dr3 h GLY 187 Ca -0.13 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.70 2dr3 h GLY 187 CO 0.05 0.00 0.19 -1.34 0.00 0.00 0.00 176.54 175.44 2dr3 s VAL 188 N -3.17 4.84 0.06 4.60 -7.23 -1.12 -4.87 120.40 113.51 2dr3 s VAL 188 Ca 0.06 0.43 0.03 0.00 -1.81 0.00 0.00 61.98 60.70 2dr3 s VAL 188 Cb 0.06 -3.85 -0.24 0.00 0.56 0.00 0.00 36.38 32.90 2dr3 s VAL 188 CO 0.69 -0.89 1.08 0.44 -0.31 0.00 0.00 175.10 176.11 2dr3 h ASP 189 N 0.22 0.17 -4.62 4.85 3.32 -1.58 -3.47 116.42 115.31 2dr3 h ASP 189 Ca -0.46 -0.21 -0.23 0.00 0.02 0.00 0.00 57.03 56.14 2dr3 h ASP 189 Cb 1.20 -0.06 -0.16 0.00 0.22 0.00 0.00 39.33 40.53 2dr3 h ASP 189 CO 0.62 1.17 -0.70 -0.83 -1.72 0.00 0.00 179.24 177.78 2dr3 s GLY 190 N -4.80 0.73 -0.05 2.75 0.00 -0.87 -0.83 107.32 104.25 2dr3 s GLY 190 Ca -0.03 -1.25 -0.02 0.00 0.00 0.00 0.00 44.72 43.42 2dr3 s GLY 190 CO 0.84 -1.35 0.06 -0.42 0.00 0.00 0.00 173.10 172.23 2dr3 s ILE 191 N -3.22 -0.09 -0.15 0.90 1.01 0.11 0.07 121.20 119.83 2dr3 s ILE 191 Ca 0.08 0.36 0.02 0.00 0.00 0.00 0.00 60.65 61.11 2dr3 s ILE 191 Cb 0.03 -0.21 0.01 0.00 0.01 0.00 0.00 42.46 42.30 2dr3 s ILE 191 CO -0.04 0.14 -0.19 -0.63 0.00 0.00 0.00 174.94 174.21 2dr3 s ILE 192 N 2.16 1.91 -0.22 2.92 1.01 0.30 -1.30 121.20 127.97 2dr3 s ILE 192 Ca 0.05 -0.87 -0.12 0.00 0.00 0.00 0.00 60.65 59.71 2dr3 s ILE 192 Cb -0.12 -1.72 -0.05 0.00 0.01 0.00 0.00 42.46 40.58 2dr3 s ILE 192 CO -0.04 0.52 0.21 -0.13 0.00 0.00 0.00 174.94 175.51 2dr3 s ARG 193 N 1.05 4.12 -0.26 2.79 1.81 0.21 -1.85 118.95 126.83 2dr3 s ARG 193 Ca -0.02 -0.14 -0.08 0.00 -1.72 0.00 0.00 55.73 53.76 2dr3 s ARG 193 Cb -0.14 -3.51 -0.03 0.00 -0.45 0.00 0.00 34.95 30.81 2dr3 s ARG 193 CO -0.06 0.09 0.11 -0.51 -0.68 0.00 0.00 175.30 174.25 2dr3 s LEU 194 N 0.97 3.63 0.23 2.53 1.43 -0.47 -1.70 118.68 125.30 2dr3 s LEU 194 Ca 0.11 -0.18 0.10 0.00 -1.03 0.00 0.00 54.13 53.13 2dr3 s LEU 194 Cb -0.13 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 2dr3 s LEU 194 CO 0.04 -0.05 -0.09 -1.81 0.23 0.00 0.00 176.35 174.68 2dr3 s ASP 195 N 1.65 4.20 -0.25 2.29 1.01 0.15 -4.33 116.67 121.39 2dr3 s ASP 195 Ca 0.06 -0.71 -0.03 0.00 0.71 0.00 0.00 52.55 52.58 2dr3 s ASP 195 Cb -0.15 -0.66 0.10 0.00 1.01 0.00 0.00 42.92 43.21 2dr3 s ASP 195 CO 0.06 0.05 0.17 -0.22 0.21 0.00 0.00 175.17 175.44 2dr3 s LEU 196 N -3.29 0.21 0.01 1.23 2.96 -1.26 -1.76 118.68 116.79 2dr3 s LEU 196 Ca 0.28 -0.82 0.07 0.00 -0.22 0.00 0.00 54.13 53.44 2dr3 s LEU 196 Cb -0.07 -0.01 -0.02 0.00 0.50 0.00 0.00 46.19 46.59 2dr3 s LEU 196 CO 0.17 -0.39 -0.21 -1.81 -1.32 0.00 0.00 176.35 172.79 2dr3 s ASP 197 N 2.21 2.44 -0.44 3.68 1.11 -0.74 -4.91 116.67 120.03 2dr3 s ASP 197 Ca 0.07 -0.44 -0.28 0.00 0.18 0.00 0.00 52.55 52.08 2dr3 s ASP 197 Cb -0.16 -0.24 0.03 0.00 1.07 0.00 0.00 42.92 43.62 2dr3 s ASP 197 CO -0.25 0.21 1.06 -0.70 1.18 0.00 0.00 175.17 176.66 2dr3 s GLU 198 N -0.82 3.75 -0.17 8.23 2.12 -1.26 -0.76 118.70 129.79 2dr3 s GLU 198 Ca 0.08 0.55 -0.00 0.00 0.36 0.00 0.00 54.97 55.95 2dr3 s GLU 198 Cb -0.08 -3.87 0.04 0.00 0.26 0.00 0.00 34.13 30.47 2dr3 s GLU 198 CO 0.00 -1.22 -0.05 0.42 -0.54 0.00 0.00 175.26 173.87 2dr3 s ILE 199 N 4.06 1.12 -1.04 -3.70 1.01 0.12 -4.81 121.20 117.96 2dr3 s ILE 199 Ca 0.44 -0.64 -0.07 0.00 0.00 0.00 0.00 60.65 60.38 2dr3 s ILE 199 Cb -0.09 -1.29 -0.06 0.00 0.01 0.00 0.00 42.46 41.03 2dr3 s ILE 199 CO 0.27 0.13 0.89 0.47 0.00 0.00 0.00 174.94 176.70 2dr3 n ASP 200 N 4.87 -6.59 -0.40 3.58 9.92 -1.26 -2.53 116.55 124.14 2dr3 n ASP 200 Ca -0.12 -0.70 -0.05 0.00 -0.53 0.00 0.00 54.79 53.39 2dr3 n ASP 200 Cb 0.48 -5.03 -0.02 0.00 -0.64 0.00 0.00 41.12 35.91 2dr3 n ASP 200 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dr3 n GLY 201 N -1.31 0.45 3.00 0.44 0.00 -1.26 -4.94 105.19 101.57 2dr3 n GLY 201 Ca -0.07 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.15 0.67 -0.18 1.61 2.12 -1.05 -5.12 118.70 114.59 2dr3 s GLU 202 Ca 0.00 -0.28 -0.26 0.00 0.36 0.00 0.00 54.97 54.80 2dr3 s GLU 202 Cb 0.00 -0.65 -0.01 0.00 0.26 0.00 0.00 34.13 33.73 2dr3 s GLU 202 CO 0.00 0.16 0.86 -0.51 -0.54 0.00 0.00 175.26 175.23 2dr3 s LEU 203 N -0.12 4.16 -0.08 2.70 1.43 -1.26 0.15 118.68 125.66 2dr3 s LEU 203 Ca 0.02 1.19 0.03 0.00 -1.03 0.00 0.00 54.13 54.33 2dr3 s LEU 203 Cb -0.04 -3.27 -0.02 0.00 0.03 0.00 0.00 46.19 42.89 2dr3 s LEU 203 CO -0.00 -0.44 -0.15 -0.54 0.23 0.00 0.00 176.35 175.45 2dr3 s LYS 204 N 2.35 2.80 -0.02 1.70 1.02 0.06 -4.91 119.74 122.74 2dr3 s LYS 204 Ca 0.39 -0.71 -0.15 0.00 0.02 0.00 0.00 55.97 55.52 2dr3 s LYS 204 Cb -0.16 -2.44 -0.05 0.00 -0.52 0.00 0.00 37.83 34.65 2dr3 s LYS 204 CO 0.11 0.47 0.41 1.03 -0.92 0.00 0.00 175.35 176.45 2dr3 s ARG 205 N -0.32 3.97 -0.01 1.68 0.52 -1.26 -1.79 118.95 121.74 2dr3 s ARG 205 Ca 0.03 0.39 -0.19 0.00 -0.52 0.00 0.00 55.73 55.44 2dr3 s ARG 205 Cb -0.13 -3.25 0.04 0.00 0.52 0.00 0.00 34.95 32.13 2dr3 s ARG 205 CO 0.02 0.62 0.42 -1.54 0.02 0.00 0.00 175.30 174.84 2dr3 s SER 206 N -0.83 -0.33 0.15 0.23 1.04 -0.72 -2.46 113.70 110.78 2dr3 s SER 206 Ca 0.23 0.23 0.10 0.00 0.48 0.00 0.00 55.95 57.00 2dr3 s SER 206 Cb -0.16 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 2dr3 s SER 206 CO 0.12 -0.53 -0.24 -0.22 0.98 0.00 0.00 173.24 173.36 2dr3 s LEU 207 N -1.41 2.37 -0.22 2.42 0.20 0.64 0.30 118.68 122.97 2dr3 s LEU 207 Ca -0.11 -0.79 -0.17 0.00 0.69 0.00 0.00 54.13 53.74 2dr3 s LEU 207 Cb -0.03 -1.11 0.06 0.00 -0.43 0.00 0.00 46.19 44.68 2dr3 s LEU 207 CO 0.05 0.12 0.58 -0.51 -0.29 0.00 0.00 176.35 176.29 2dr3 s ILE 208 N -1.39 -0.00 -0.46 6.68 2.07 -0.69 -0.83 121.20 126.58 2dr3 s ILE 208 Ca 0.15 0.02 -0.19 0.00 -1.41 0.00 0.00 60.65 59.22 2dr3 s ILE 208 Cb -0.09 -0.82 0.04 0.00 0.13 0.00 0.00 42.46 41.72 2dr3 s ILE 208 CO 0.07 0.01 0.56 -0.69 -1.91 0.00 0.00 174.94 172.98 2dr3 s VAL 209 N 0.80 4.94 0.07 4.00 1.01 -1.26 -0.62 120.40 129.34 2dr3 s VAL 209 Ca -0.04 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 61.68 2dr3 s VAL 209 Cb -0.05 -4.19 -0.23 0.00 0.00 0.00 0.00 36.38 31.91 2dr3 s VAL 209 CO -0.06 -0.63 1.08 -0.50 0.00 0.00 0.00 175.10 174.99 2dr3 h TRP 210 N 8.88 0.08 -2.36 5.22 4.06 -1.56 -3.46 115.95 126.81 2dr3 h TRP 210 Ca -0.27 -0.06 -0.08 0.00 2.06 0.00 0.00 58.89 60.55 2dr3 h TRP 210 Cb 1.10 -0.00 -0.21 0.00 -1.00 0.00 0.00 29.16 29.04 2dr3 h TRP 210 CO 0.70 1.06 -0.02 0.21 -3.56 0.00 0.00 178.44 176.83 2dr3 s LYS 211 N -2.67 0.76 -0.48 0.49 2.20 -1.07 -4.93 119.74 114.05 2dr3 s LYS 211 Ca -0.02 0.53 0.06 0.00 -0.36 0.00 0.00 55.97 56.19 2dr3 s LYS 211 Cb 0.09 0.36 0.19 0.00 -1.51 0.00 0.00 37.83 36.96 2dr3 s LYS 211 CO 0.83 -0.15 0.73 1.41 -0.36 0.00 0.00 175.35 177.80 2dr3 s MET 212 N -0.28 0.95 0.36 4.03 1.75 -1.25 0.07 119.30 124.93 2dr3 s MET 212 Ca -0.05 -0.78 -0.26 0.00 -1.25 0.00 0.00 55.69 53.35 2dr3 s MET 212 Cb -0.03 -0.00 -0.12 0.00 2.84 0.00 0.00 34.83 37.51 2dr3 s MET 212 CO 0.03 -1.22 1.04 0.54 -0.65 0.00 0.00 175.02 174.77 2dr3 n ARG 213 N 3.35 1.45 -0.24 4.11 1.74 -0.01 -2.82 116.66 124.25 2dr3 n ARG 213 Ca 0.16 0.52 0.00 0.00 -0.77 0.00 0.00 57.85 57.75 2dr3 n ARG 213 Cb 0.57 -2.00 0.00 0.00 -1.02 0.00 0.00 32.46 30.01 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 1.15 0.83 3.53 -0.13 0.00 -1.26 -4.81 105.19 104.50 2dr3 n GLY 214 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.60 0.00 0.64 2.61 -1.32 -1.13 -4.96 115.64 108.88 2dr3 s THR 215 Ca 0.00 -0.16 -0.06 0.00 -1.21 0.00 0.00 61.69 60.26 2dr3 s THR 215 Cb 0.00 -1.19 0.03 0.00 -1.51 0.00 0.00 72.50 69.82 2dr3 s THR 215 CO 0.00 0.00 0.95 -0.94 -2.21 0.00 0.00 174.62 172.42 2dr3 s SER 216 N -2.67 5.28 0.10 8.08 1.04 -1.26 -4.80 113.70 119.47 2dr3 s SER 216 Ca 0.05 0.61 -0.27 0.00 0.48 0.00 0.00 55.95 56.83 2dr3 s SER 216 Cb -0.01 -1.47 0.08 0.00 0.10 0.00 0.00 66.02 64.72 2dr3 s SER 216 CO -0.08 -1.28 1.02 -1.38 0.98 0.00 0.00 173.24 172.50 2dr3 s HIS 217 N -3.10 -0.13 0.36 5.02 -3.43 -1.26 -4.48 115.29 108.27 2dr3 s HIS 217 Ca 0.56 -0.11 -0.28 0.00 -0.80 0.00 0.00 55.06 54.43 2dr3 s HIS 217 Cb -0.11 0.61 -0.11 0.00 -1.43 0.00 0.00 32.58 31.54 2dr3 s HIS 217 CO 0.45 -0.68 1.50 0.45 -2.00 0.00 0.00 174.74 174.45 2dr3 s SER 218 N -2.89 6.37 -0.04 7.38 0.15 0.33 -4.90 113.70 120.10 2dr3 s SER 218 Ca 0.12 3.02 0.16 0.00 0.70 0.00 0.00 55.95 59.94 2dr3 s SER 218 Cb -0.00 -2.66 0.49 0.00 -1.71 0.00 0.00 66.02 62.14 2dr3 s SER 218 CO -0.00 -0.87 1.41 0.23 1.20 0.00 0.00 173.24 175.21 2dr3 n MET 219 N 0.76 3.02 -4.16 5.44 0.00 -1.26 -4.55 117.12 116.37 2dr3 n MET 219 Ca 0.02 -2.45 -0.22 0.00 0.00 0.00 0.00 57.70 55.05 2dr3 n MET 219 Cb 0.39 -1.53 -0.06 0.00 0.00 0.00 0.00 33.22 32.02 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 -1.39 2.55 -0.29 0.03 0.52 -1.26 -5.01 118.95 114.10 2dr3 s ARG 220 Ca 0.37 -1.32 -0.21 0.00 -0.52 0.00 0.00 55.73 54.05 2dr3 s ARG 220 Cb 0.22 -2.32 -0.01 0.00 0.52 0.00 0.00 34.95 33.36 2dr3 s ARG 220 CO 0.20 0.31 0.69 0.50 0.02 0.00 0.00 175.30 177.02 2dr3 s ARG 221 N -3.79 4.00 -0.15 3.54 3.52 -1.26 -4.62 118.95 120.18 2dr3 s ARG 221 Ca 0.34 0.49 -0.05 0.00 -0.13 0.00 0.00 55.73 56.38 2dr3 s ARG 221 Cb -0.06 -3.70 -0.03 0.00 -1.56 0.00 0.00 34.95 29.60 2dr3 s ARG 221 CO 0.23 -0.55 0.00 -1.01 -0.81 0.00 0.00 175.30 173.16 2dr3 s HIS 222 N 2.69 3.13 0.73 5.12 3.76 -0.01 -0.79 115.29 129.92 2dr3 s HIS 222 Ca 0.28 -0.08 -0.11 0.00 -0.15 0.00 0.00 55.06 55.00 2dr3 s HIS 222 Cb -0.15 -1.97 0.03 0.00 1.11 0.00 0.00 32.58 31.60 2dr3 s HIS 222 CO 0.11 0.12 1.08 -1.25 -0.85 0.00 0.00 174.74 173.95 2dr3 s PRO 223 N 0.14 2.60 0.19 8.40 0.04 -1.26 -0.26 135.00 144.84 2dr3 s PRO 223 Ca 0.01 1.09 -0.20 0.00 0.04 0.00 0.00 61.00 61.94 2dr3 s PRO 223 Cb -0.13 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.51 2dr3 s PRO 223 CO 0.02 -1.37 0.57 -0.59 0.04 0.00 0.00 177.00 175.67 2dr3 s PHE 224 N -2.93 -0.29 0.15 0.56 -0.71 -1.03 -2.12 117.98 111.60 2dr3 s PHE 224 Ca 0.60 -0.02 0.08 0.00 -1.04 0.00 0.00 56.93 56.55 2dr3 s PHE 224 Cb -0.16 0.49 -0.04 0.00 -1.21 0.00 0.00 43.02 42.10 2dr3 s PHE 224 CO 0.55 -0.92 -0.17 -0.51 -1.34 0.00 0.00 175.22 172.82 2dr3 s ASP 225 N -2.83 2.47 -0.18 1.98 1.01 -0.47 -4.46 116.67 114.18 2dr3 s ASP 225 Ca 0.06 -0.83 -0.05 0.00 0.71 0.00 0.00 52.55 52.45 2dr3 s ASP 225 Cb -0.02 -0.13 -0.03 0.00 1.01 0.00 0.00 42.92 43.76 2dr3 s ASP 225 CO -0.06 -0.06 -0.01 -0.63 0.21 0.00 0.00 175.17 174.62 2dr3 s ILE 226 N -1.97 3.99 0.34 0.77 1.01 -1.26 -1.19 121.20 122.89 2dr3 s ILE 226 Ca 0.13 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.47 2dr3 s ILE 226 Cb -0.06 -2.78 -0.00 0.00 0.01 0.00 0.00 42.46 39.63 2dr3 s ILE 226 CO 0.05 0.46 0.03 0.35 0.00 0.00 0.00 174.94 175.83 2dr3 n THR 227 N 3.86 0.00 0.91 2.92 -2.24 0.23 -4.98 114.28 114.99 2dr3 n THR 227 Ca -0.17 -1.69 0.11 0.00 -2.27 0.00 0.00 64.05 60.03 2dr3 n THR 227 Cb 0.52 0.40 0.52 0.00 -2.10 0.00 0.00 70.33 69.67 2dr3 n THR 227 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dr3 n ASP 228 N -1.33 0.00 -0.26 3.42 5.75 -1.26 -2.44 116.55 120.44 2dr3 n ASP 228 Ca -0.12 0.22 0.04 0.00 -0.01 0.00 0.00 54.79 54.92 2dr3 n ASP 228 Cb 0.45 -0.39 0.01 0.00 -1.03 0.00 0.00 41.12 40.16 2dr3 n ASP 228 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 2dr3 n LYS 229 N -1.39 1.56 0.00 0.11 4.81 -1.26 -4.54 118.16 117.46 2dr3 n LYS 229 Ca 0.08 -0.72 0.00 0.00 -0.87 0.00 0.00 58.31 56.80 2dr3 n LYS 229 Cb 0.21 -1.09 0.00 0.00 0.02 0.00 0.00 35.03 34.18 2dr3 n LYS 229 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2dr3 n GLY 230 N 0.74 0.69 3.87 3.14 0.00 -1.02 -5.00 105.19 107.61 2dr3 n GLY 230 Ca 0.04 -2.02 -0.36 0.00 0.00 0.00 0.00 46.02 43.68 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 -1.60 5.18 -0.23 -0.61 1.01 -1.26 0.77 121.20 124.46 2dr3 s ILE 231 Ca 0.00 0.43 -0.01 0.00 0.00 0.00 0.00 60.65 61.07 2dr3 s ILE 231 Cb 0.00 -3.61 0.07 0.00 0.01 0.00 0.00 42.46 38.92 2dr3 s ILE 231 CO 0.00 0.41 0.02 -0.63 0.00 0.00 0.00 174.94 174.74 2dr3 s ILE 232 N -1.26 0.90 -0.14 2.92 1.01 -0.33 -4.12 121.20 120.18 2dr3 s ILE 232 Ca 0.28 -0.92 -0.09 0.00 0.00 0.00 0.00 60.65 59.92 2dr3 s ILE 232 Cb -0.14 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 2dr3 s ILE 232 CO 0.15 -0.26 0.16 -0.69 0.00 0.00 0.00 174.94 174.30 2dr3 s VAL 233 N 1.67 5.45 -0.67 2.92 1.01 -0.17 -1.37 120.40 129.23 2dr3 s VAL 233 Ca -0.00 0.25 -0.11 0.00 0.00 0.00 0.00 61.98 62.11 2dr3 s VAL 233 Cb -0.18 -3.45 0.17 0.00 0.00 0.00 0.00 36.38 32.93 2dr3 s VAL 233 CO -0.10 0.56 0.58 -0.31 0.00 0.00 0.00 175.10 175.82 2dr3 s TYR 234 N -0.57 3.54 0.60 5.22 1.51 -0.90 -3.73 117.35 123.03 2dr3 s TYR 234 Ca 0.13 -1.98 0.31 0.00 -1.01 0.00 0.00 57.07 54.52 2dr3 s TYR 234 Cb -0.12 -3.64 1.79 0.00 -0.11 0.00 0.00 41.96 39.88 2dr3 s TYR 234 CO 0.03 -0.97 2.16 -1.35 -1.11 0.00 0.00 175.55 174.31 2dr3 h PRO 235 N 7.96 0.00 -0.01 -1.71 0.11 -1.88 -1.85 132.00 134.63 2dr3 h PRO 235 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.06 2dr3 h PRO 235 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2dr3 h PRO 235 CO 0.82 0.00 -0.34 -0.25 -0.21 0.00 0.00 178.00 178.02 2dr3 n ASP 236 N -3.66 0.96 -4.74 -2.05 8.00 -1.26 -4.89 116.55 108.92 2dr3 n ASP 236 Ca -0.00 -0.78 -0.26 0.00 0.71 0.00 0.00 54.79 54.45 2dr3 n ASP 236 Cb 0.24 0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 41.47 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 -2.62 2.67 -0.02 -1.24 -0.14 -0.70 -5.13 119.74 112.57 2dr3 s LYS 237 Ca 0.21 -1.01 0.01 0.00 -1.36 0.00 0.00 55.97 53.83 2dr3 s LYS 237 Cb 0.19 -2.50 0.01 0.00 -1.68 0.00 0.00 37.83 33.85 2dr3 s LYS 237 CO 0.57 0.46 -0.04 0.08 -0.76 0.00 0.00 175.35 175.66 2dr3 s VAL 238 N -1.79 0.42 -0.17 3.17 1.01 -1.26 -4.42 120.40 117.36 2dr3 s VAL 238 Ca 0.30 -0.16 -0.08 0.00 0.00 0.00 0.00 61.98 62.04 2dr3 s VAL 238 Cb -0.09 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 2dr3 s VAL 238 CO 0.21 0.15 0.08 -0.22 0.00 0.00 0.00 175.10 175.33 2dr3 s LEU 239 N 0.33 3.96 -0.44 3.92 2.96 0.03 -4.88 118.68 124.57 2dr3 s LEU 239 Ca -0.04 0.17 -0.06 0.00 -0.22 0.00 0.00 54.13 53.98 2dr3 s LEU 239 Cb -0.07 -2.00 0.12 0.00 0.50 0.00 0.00 46.19 44.73 2dr3 s LEU 239 CO -0.00 0.22 0.28 -0.54 -1.32 0.00 0.00 176.35 174.98 2dr3 s LYS 240 N 0.12 2.24 0.35 1.98 3.01 -1.26 -4.68 119.74 121.50 2dr3 s LYS 240 Ca 0.06 -1.81 0.19 0.00 -1.01 0.00 0.00 55.97 53.40 2dr3 s LYS 240 Cb -0.12 -3.75 0.47 0.00 -1.01 0.00 0.00 37.83 33.42 2dr3 s LYS 240 CO 0.00 -1.13 1.63 0.00 0.51 0.00 0.00 175.35 176.35 2dr3 h ARG 241 N 8.23 0.00 0.00 1.68 3.08 -1.99 -3.47 114.38 121.90 2dr3 h ARG 241 Ca -0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.88 2dr3 h ARG 241 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.11 2dr3 h ARG 241 CO 0.78 0.38 0.00 0.41 -1.07 0.00 0.00 179.97 180.46 2dr3 n GLY 242 N 0.68 0.67 0.26 0.04 0.00 -1.26 -5.04 105.19 100.54 2dr3 n GLY 242 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 2dr3 n GLY 242 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60