#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 4.19 0.14 -0.78 3.52 -1.26 -4.95 118.95 119.82 2dr3 s ARG 3 Ca 0.00 2.43 0.07 0.00 -0.13 0.00 0.00 55.73 58.10 2dr3 s ARG 3 Cb 0.00 -3.10 -0.04 0.00 -1.56 0.00 0.00 34.95 30.25 2dr3 s ARG 3 CO 0.00 -0.58 -0.04 1.03 -0.81 0.00 0.00 175.30 174.90 2dr3 s ARG 4 N 0.35 2.31 -0.30 5.12 1.81 -1.26 -1.57 118.95 125.41 2dr3 s ARG 4 Ca 0.66 -1.05 -0.04 0.00 -1.72 0.00 0.00 55.73 53.58 2dr3 s ARG 4 Cb -0.45 -2.35 0.03 0.00 -0.45 0.00 0.00 34.95 31.73 2dr3 s ARG 4 CO 0.39 0.48 0.02 0.08 -0.68 0.00 0.00 175.30 175.59 2dr3 s VAL 5 N -1.50 3.32 -0.23 3.52 1.01 0.68 -4.83 120.40 122.36 2dr3 s VAL 5 Ca 0.25 -1.12 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 2dr3 s VAL 5 Cb -0.10 -2.82 -0.00 0.00 0.00 0.00 0.00 36.38 33.46 2dr3 s VAL 5 CO 0.17 -0.02 1.19 -0.54 0.00 0.00 0.00 175.10 175.90 2dr3 s LYS 6 N 1.35 4.14 0.31 2.72 1.02 -1.26 -2.22 119.74 125.79 2dr3 s LYS 6 Ca -0.02 1.41 0.10 0.00 0.02 0.00 0.00 55.97 57.48 2dr3 s LYS 6 Cb -0.19 -3.76 0.50 0.00 -0.52 0.00 0.00 37.83 33.87 2dr3 s LYS 6 CO -0.00 -0.82 1.70 1.79 -0.92 0.00 0.00 175.35 177.10 2dr3 h THR 7 N 5.63 1.35 0.00 2.17 1.35 -1.91 -3.44 112.91 118.06 2dr3 h THR 7 Ca -0.24 -1.69 0.00 0.00 -0.55 0.00 0.00 66.41 63.93 2dr3 h THR 7 Cb 1.09 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 2dr3 h THR 7 CO 1.00 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 177.37 2dr3 n GLY 8 N -0.09 1.91 3.65 5.82 0.00 -1.26 -4.38 105.19 110.84 2dr3 n GLY 8 Ca -0.02 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 -3.51 4.68 -0.31 -0.61 1.01 -1.26 -4.94 121.20 116.25 2dr3 s ILE 9 Ca 0.00 1.90 -0.44 0.00 0.00 0.00 0.00 60.65 62.12 2dr3 s ILE 9 Cb 0.00 -4.29 -0.19 0.00 0.01 0.00 0.00 42.46 37.99 2dr3 s ILE 9 CO 0.00 -0.21 1.49 -2.65 0.00 0.00 0.00 174.94 173.57 2dr3 n PRO 10 N 6.35 0.27 0.00 2.79 -0.02 -1.26 -1.10 135.00 142.03 2dr3 n PRO 10 Ca 0.11 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2dr3 n PRO 10 Cb 0.46 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 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 3.38 2.76 0.19 -1.23 0.00 -1.26 -1.43 105.19 107.60 2dr3 n GLY 11 Ca 0.27 0.00 -0.14 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 0.72 0.00 1.61 2.07 -1.40 -1.93 116.25 117.33 2dr3 h VAL 12 Ca 0.00 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2dr3 h VAL 12 Cb 0.00 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2dr3 h VAL 12 CO 0.00 0.04 -0.05 0.44 0.02 0.00 0.00 177.57 178.02 2dr3 h ASP 13 N -0.51 0.00 -0.08 0.57 3.32 -1.90 0.17 116.42 117.99 2dr3 h ASP 13 Ca -0.04 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.77 2dr3 h ASP 13 Cb 0.38 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.95 2dr3 h ASP 13 CO 0.07 0.05 -0.88 -0.33 -1.72 0.00 0.00 179.24 176.42 2dr3 h GLU 14 N 0.00 0.75 0.00 3.56 3.07 -1.86 0.47 114.58 120.56 2dr3 h GLU 14 Ca -0.00 -0.69 -0.05 0.00 -0.50 0.00 0.00 59.36 58.11 2dr3 h GLU 14 Cb 0.10 0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.17 2dr3 h GLU 14 CO 0.01 1.28 -0.26 0.82 -1.40 0.00 0.00 179.01 179.46 2dr3 h ILE 15 N 0.46 0.99 -0.39 3.13 2.04 -0.45 -1.19 117.51 122.10 2dr3 h ILE 15 Ca -0.09 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 64.82 2dr3 h ILE 15 Cb 1.53 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.15 2dr3 h ILE 15 CO 0.18 0.26 0.00 0.18 0.00 0.00 0.00 178.15 178.76 2dr3 n LEU 16 N -3.95 2.30 -3.62 1.44 4.77 -0.06 -0.55 117.00 117.33 2dr3 n LEU 16 Ca -0.02 -1.11 -0.20 0.00 -0.03 0.00 0.00 56.01 54.65 2dr3 n LEU 16 Cb 0.34 -0.26 0.05 0.00 -2.33 0.00 0.00 43.42 41.21 2dr3 n LEU 16 CO 0.36 0.56 -0.02 1.41 -1.33 0.00 0.00 177.39 178.36 2dr3 n HIS 17 N 0.75 -1.99 0.00 -1.77 8.25 -0.45 -3.10 115.22 116.91 2dr3 n HIS 17 Ca 0.15 0.87 0.00 0.00 -0.26 0.00 0.00 57.72 58.48 2dr3 n HIS 17 Cb 0.38 -4.59 0.00 0.00 1.12 0.00 0.00 29.99 26.90 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 -1.45 2.76 0.00 -1.41 0.00 0.16 -4.99 105.19 100.26 2dr3 n GLY 18 Ca -0.30 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 3.70 -0.02 0.00 -1.16 -4.69 105.19 103.94 2dr3 n GLY 19 Ca 0.00 -2.02 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 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 -1.25 3.58 0.06 -0.61 1.01 -0.94 -4.71 121.20 118.34 2dr3 s ILE 20 Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 60.65 61.40 2dr3 s ILE 20 Cb 0.00 -3.68 -0.09 0.00 0.01 0.00 0.00 42.46 38.71 2dr3 s ILE 20 CO 0.00 0.03 1.78 -2.84 0.00 0.00 0.00 174.94 173.91 2dr3 s PRO 21 N 1.84 4.16 0.51 2.79 0.02 -1.26 -0.23 135.00 142.83 2dr3 s PRO 21 Ca 0.64 2.45 -0.21 0.00 0.02 0.00 0.00 61.00 63.90 2dr3 s PRO 21 Cb -0.33 -3.79 -0.09 0.00 0.02 0.00 0.00 34.50 30.31 2dr3 s PRO 21 CO 0.28 -0.84 0.86 -1.91 -0.33 0.00 0.00 177.00 175.07 2dr3 n GLU 22 N 6.33 0.98 -0.98 5.54 2.13 -0.61 -1.81 120.64 132.22 2dr3 n GLU 22 Ca 0.18 0.36 0.00 0.00 0.66 0.00 0.00 57.16 58.36 2dr3 n GLU 22 Cb 0.40 -1.97 0.00 0.00 0.27 0.00 0.00 31.44 30.14 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 -0.22 -0.04 -2.97 5.31 5.12 -1.25 -5.01 116.66 117.60 2dr3 n ARG 23 Ca 0.11 0.01 -0.37 0.00 -1.93 0.00 0.00 57.85 55.68 2dr3 n ARG 23 Cb 0.43 -2.78 -0.06 0.00 -1.16 0.00 0.00 32.46 28.89 2dr3 n ARG 23 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 2dr3 s ASN 24 N -2.63 7.19 -0.29 0.55 -0.87 -0.75 -4.64 114.94 113.50 2dr3 s ASN 24 Ca 0.00 1.59 -0.13 0.00 -1.57 0.00 0.00 52.86 52.75 2dr3 s ASN 24 Cb 0.00 -2.48 -0.04 0.00 -0.02 0.00 0.00 41.25 38.71 2dr3 s ASN 24 CO 0.00 0.01 0.27 -0.69 -2.57 0.00 0.00 177.10 174.12 2dr3 s VAL 25 N -1.52 5.25 -0.24 1.60 1.01 -1.26 -1.41 120.40 123.82 2dr3 s VAL 25 Ca 0.45 0.24 -0.07 0.00 0.00 0.00 0.00 61.98 62.59 2dr3 s VAL 25 Cb -0.18 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 2dr3 s VAL 25 CO 0.22 0.15 0.07 -0.69 0.00 0.00 0.00 175.10 174.86 2dr3 s VAL 26 N 1.88 4.45 -0.14 2.92 1.01 1.00 -1.86 120.40 129.66 2dr3 s VAL 26 Ca 0.10 -0.13 -0.27 0.00 0.00 0.00 0.00 61.98 61.68 2dr3 s VAL 26 Cb -0.16 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 2dr3 s VAL 26 CO 0.11 0.36 0.91 -0.22 0.00 0.00 0.00 175.10 176.26 2dr3 s LEU 27 N 1.35 4.20 -0.43 3.92 2.96 -0.21 0.11 118.68 130.58 2dr3 s LEU 27 Ca 0.05 1.34 -0.08 0.00 -0.22 0.00 0.00 54.13 55.22 2dr3 s LEU 27 Cb -0.15 -3.38 0.10 0.00 0.50 0.00 0.00 46.19 43.26 2dr3 s LEU 27 CO 0.04 -0.43 0.27 -0.22 -1.32 0.00 0.00 176.35 174.69 2dr3 s LEU 28 N 2.13 5.35 -0.06 -0.68 2.96 0.49 -1.10 118.68 127.77 2dr3 s LEU 28 Ca 0.43 -1.77 -0.01 0.00 -0.22 0.00 0.00 54.13 52.57 2dr3 s LEU 28 Cb -0.17 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 2dr3 s LEU 28 CO 0.14 -0.59 -0.01 -0.55 -1.32 0.00 0.00 176.35 174.02 2dr3 s SER 29 N 2.25 5.12 0.00 3.68 0.15 -0.29 -0.50 113.70 124.11 2dr3 s SER 29 Ca 0.05 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.78 2dr3 s SER 29 Cb -0.24 -1.39 0.00 0.00 -1.71 0.00 0.00 66.02 62.68 2dr3 s SER 29 CO -0.00 0.35 0.00 0.61 1.20 0.00 0.00 173.24 175.39 2dr3 n GLY 30 N 1.94 1.07 3.00 9.45 0.00 -1.03 -0.81 105.19 118.81 2dr3 n GLY 30 Ca -0.17 -0.75 -0.25 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.22 -2.25 3.77 -0.02 0.00 -1.25 -1.80 105.19 103.41 2dr3 n GLY 31 Ca 0.00 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.06 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 -5.18 3.75 -1.52 1.61 0.04 -1.26 -3.21 135.00 129.23 2dr3 s PRO 32 Ca 0.60 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.93 2dr3 s PRO 32 Cb -0.04 -2.66 0.00 0.00 0.04 0.00 0.00 34.50 31.84 2dr3 s PRO 32 CO 0.45 -0.72 0.00 0.41 0.04 0.00 0.00 177.00 177.18 2dr3 n GLY 33 N 0.62 -0.23 0.75 0.56 0.00 -1.26 -4.91 105.19 100.72 2dr3 n GLY 33 Ca 0.05 -0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.93 0.00 -0.57 2.61 -2.24 -1.20 -4.96 114.28 104.00 2dr3 n THR 34 Ca -0.21 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2dr3 n THR 34 Cb 0.65 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 70.00 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 1.30 0.91 0.19 3.38 0.00 -1.26 -4.69 105.19 105.01 2dr3 n GLY 35 Ca 0.15 -0.45 -0.14 0.00 0.00 0.00 0.00 46.02 45.58 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 0.00 0.63 -0.02 1.61 1.57 -1.93 -1.54 116.57 116.89 2dr3 h LYS 36 Ca 0.00 -0.39 -0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2dr3 h LYS 36 Cb 0.13 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 2dr3 h LYS 36 CO 0.00 1.01 0.01 1.15 -0.57 0.00 0.00 179.45 181.05 2dr3 h THR 37 N 0.32 1.10 -0.37 -0.16 2.02 -1.98 -0.88 112.91 112.95 2dr3 h THR 37 Ca 0.01 -0.30 0.01 0.00 0.77 0.00 0.00 66.41 66.90 2dr3 h THR 37 Cb 0.97 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.63 2dr3 h THR 37 CO 0.09 0.08 0.24 0.40 0.37 0.00 0.00 175.52 176.69 2dr3 h ILE 38 N -0.09 1.08 -0.20 3.11 2.04 -1.99 0.02 117.51 121.48 2dr3 h ILE 38 Ca 0.01 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.73 2dr3 h ILE 38 Cb 0.12 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 2dr3 h ILE 38 CO -0.00 0.09 0.01 0.15 0.00 0.00 0.00 178.15 178.40 2dr3 h PHE 39 N 0.48 0.01 -0.44 1.37 3.04 -1.18 0.14 116.94 120.37 2dr3 h PHE 39 Ca 0.14 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.09 2dr3 h PHE 39 Cb -0.04 0.03 -0.02 0.00 2.56 0.00 0.00 35.95 38.48 2dr3 h PHE 39 CO -0.06 -0.02 0.22 0.77 -2.02 0.00 0.00 178.31 177.20 2dr3 h SER 40 N 0.07 0.56 0.09 0.41 0.02 -0.85 -1.49 113.55 112.37 2dr3 h SER 40 Ca 0.09 -0.11 -0.07 0.00 -0.84 0.00 0.00 61.79 60.85 2dr3 h SER 40 Cb 0.11 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 2dr3 h SER 40 CO -0.15 0.52 -0.24 1.56 -1.14 0.00 0.00 176.83 177.38 2dr3 h GLN 41 N 0.56 0.27 -0.23 3.45 4.20 -0.72 -2.32 115.11 120.32 2dr3 h GLN 41 Ca 0.15 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 2dr3 h GLN 41 Cb 0.10 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2dr3 h GLN 41 CO -0.02 0.50 0.03 0.37 -0.67 0.00 0.00 178.83 179.03 2dr3 h GLN 42 N 0.24 0.38 -0.68 1.46 4.15 -0.36 -0.41 115.11 119.89 2dr3 h GLN 42 Ca 0.04 -0.11 0.13 0.00 0.77 0.00 0.00 58.65 59.48 2dr3 h GLN 42 Cb 0.56 -0.04 -0.09 0.00 0.21 0.00 0.00 27.48 28.12 2dr3 h GLN 42 CO 0.04 0.54 0.19 0.35 -1.93 0.00 0.00 178.83 178.02 2dr3 h PHE 43 N 0.17 0.32 0.01 3.99 3.57 -0.87 0.15 116.94 124.29 2dr3 h PHE 43 Ca 0.07 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 2dr3 h PHE 43 Cb 0.35 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.05 2dr3 h PHE 43 CO 0.02 -0.01 -0.01 -0.07 -2.23 0.00 0.00 178.31 176.01 2dr3 h LEU 44 N 0.32 -0.01 -0.16 0.59 3.38 -1.21 -2.17 115.31 116.04 2dr3 h LEU 44 Ca 0.37 -0.55 0.05 0.00 0.09 0.00 0.00 57.88 57.84 2dr3 h LEU 44 Cb 0.57 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 2dr3 h LEU 44 CO -0.43 0.55 -0.28 -0.25 0.09 0.00 0.00 178.44 178.12 2dr3 h TRP 45 N -0.58 -0.76 -0.49 1.13 2.91 -0.54 0.25 115.95 117.87 2dr3 h TRP 45 Ca -0.00 0.04 0.08 0.00 1.13 0.00 0.00 58.89 60.14 2dr3 h TRP 45 Cb 0.56 0.36 -0.03 0.00 -0.51 0.00 0.00 29.16 29.54 2dr3 h TRP 45 CO 0.12 -0.36 0.33 -0.91 -1.03 0.00 0.00 178.44 176.60 2dr3 h ASN 46 N -0.33 0.29 -0.67 2.65 2.35 -0.78 -0.59 115.58 118.49 2dr3 h ASN 46 Ca 0.11 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 2dr3 h ASN 46 Cb 0.50 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.78 2dr3 h ASN 46 CO -0.35 0.18 0.35 1.23 -1.65 0.00 0.00 177.43 177.19 2dr3 h GLY 47 N 0.32 1.01 0.86 2.83 0.00 0.10 -2.80 103.07 105.40 2dr3 h GLY 47 Ca 0.22 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 2dr3 h GLY 47 CO -0.05 0.46 -0.00 1.41 0.00 0.00 0.00 176.54 178.35 2dr3 h LEU 48 N 0.92 -0.00 -0.62 3.11 3.38 0.43 0.12 115.31 122.65 2dr3 h LEU 48 Ca 0.23 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2dr3 h LEU 48 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2dr3 h LEU 48 CO -0.03 0.14 0.12 0.29 0.09 0.00 0.00 178.44 179.05 2dr3 n LYS 49 N -5.02 0.06 -0.20 1.13 5.02 -0.90 -0.04 118.16 118.21 2dr3 n LYS 49 Ca -0.07 0.51 0.06 0.00 -2.02 0.00 0.00 58.31 56.79 2dr3 n LYS 49 Cb 0.09 -1.82 0.18 0.00 -0.02 0.00 0.00 35.03 33.45 2dr3 n LYS 49 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2dr3 n MET 50 N -1.80 2.85 -1.42 1.97 2.81 -0.86 -4.95 117.12 115.72 2dr3 n MET 50 Ca -0.01 -2.13 -0.01 0.00 -1.81 0.00 0.00 57.70 53.74 2dr3 n MET 50 Cb 0.14 -1.31 -0.00 0.00 -0.71 0.00 0.00 33.22 31.34 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 0.67 0.41 3.12 3.03 0.00 0.94 -5.02 105.19 108.34 2dr3 n GLY 51 Ca 0.13 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.86 2.05 0.54 1.61 2.02 0.37 -5.01 118.70 117.42 2dr3 s GLU 52 Ca 0.00 -1.68 -0.21 0.00 0.02 0.00 0.00 54.97 53.09 2dr3 s GLU 52 Cb 0.00 -3.44 -0.06 0.00 0.10 0.00 0.00 34.13 30.73 2dr3 s GLU 52 CO 0.00 -0.94 1.13 -0.35 0.02 0.00 0.00 175.26 175.12 2dr3 n PRO 53 N 4.56 1.33 -4.13 0.39 -0.04 -1.26 -3.07 135.00 132.78 2dr3 n PRO 53 Ca -0.04 0.49 -0.10 0.00 -0.04 0.00 0.00 63.50 63.82 2dr3 n PRO 53 Cb 0.42 -2.30 -0.10 0.00 -0.04 0.00 0.00 33.50 31.47 2dr3 n PRO 53 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2dr3 s GLY 54 N -0.98 0.64 -0.01 0.55 0.00 -0.43 -1.55 107.32 105.53 2dr3 s GLY 54 Ca 0.71 -1.23 0.05 0.00 0.00 0.00 0.00 44.72 44.25 2dr3 s GLY 54 CO 0.50 -1.34 -0.17 -0.42 0.00 0.00 0.00 173.10 171.67 2dr3 s ILE 55 N -3.45 1.37 -0.25 0.90 1.01 -0.10 -1.21 121.20 119.47 2dr3 s ILE 55 Ca 0.08 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 59.99 2dr3 s ILE 55 Cb 0.04 -1.14 0.07 0.00 0.01 0.00 0.00 42.46 41.44 2dr3 s ILE 55 CO -0.06 0.39 -0.02 -0.47 0.00 0.00 0.00 174.94 174.78 2dr3 s TYR 56 N -0.40 2.33 -0.43 3.97 6.14 -0.46 -0.59 117.35 127.91 2dr3 s TYR 56 Ca 0.07 -1.78 -0.23 0.00 0.64 0.00 0.00 57.07 55.77 2dr3 s TYR 56 Cb -0.07 -1.65 0.02 0.00 0.42 0.00 0.00 41.96 40.68 2dr3 s TYR 56 CO -0.01 -0.79 0.77 0.08 0.64 0.00 0.00 175.55 176.25 2dr3 s VAL 57 N 1.41 4.68 -0.22 3.14 1.01 0.10 -1.59 120.40 128.94 2dr3 s VAL 57 Ca -0.03 0.53 -0.15 0.00 0.00 0.00 0.00 61.98 62.33 2dr3 s VAL 57 Cb -0.19 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.87 2dr3 s VAL 57 CO -0.08 -0.64 0.36 0.00 0.00 0.00 0.00 175.10 174.74 2dr3 s ALA 58 N 3.21 3.57 0.00 5.51 0.00 -0.25 -0.87 121.76 132.93 2dr3 s ALA 58 Ca 0.30 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.62 2dr3 s ALA 58 Cb -0.12 -2.60 0.00 0.00 0.00 0.00 0.00 23.12 20.39 2dr3 s ALA 58 CO 0.21 -0.35 0.00 1.28 0.00 0.00 0.00 175.76 176.90 2dr3 n LEU 59 N 4.61 0.00 -0.06 0.00 4.32 0.11 -0.81 117.00 125.17 2dr3 n LEU 59 Ca -0.09 -0.36 -0.04 0.00 -0.02 0.00 0.00 56.01 55.50 2dr3 n LEU 59 Cb 0.51 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.17 2dr3 n LEU 59 CO 0.39 0.00 -0.97 -0.62 -1.22 0.00 0.00 177.39 174.96 2dr3 n GLU 60 N -0.78 0.97 -3.99 3.23 -0.58 -1.15 -4.59 120.64 113.74 2dr3 n GLU 60 Ca 0.00 -0.06 -0.09 0.00 -0.42 0.00 0.00 57.16 56.60 2dr3 n GLU 60 Cb 0.00 -1.45 -0.10 0.00 -0.57 0.00 0.00 31.44 29.31 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 -2.68 0.45 0.28 3.49 2.02 -1.26 -5.10 118.70 115.90 2dr3 s GLU 61 Ca -0.08 -0.77 -0.29 0.00 0.02 0.00 0.00 54.97 53.85 2dr3 s GLU 61 Cb 0.07 0.16 -0.10 0.00 0.10 0.00 0.00 34.13 34.37 2dr3 s GLU 61 CO 0.74 -0.09 1.27 -1.58 0.02 0.00 0.00 175.26 175.63 2dr3 s HIS 62 N -2.26 3.20 0.55 1.61 5.65 -1.26 -4.79 115.29 117.99 2dr3 s HIS 62 Ca -0.08 1.40 0.42 0.00 0.25 0.00 0.00 55.06 57.04 2dr3 s HIS 62 Cb -0.04 -3.59 1.62 0.00 -1.18 0.00 0.00 32.58 29.39 2dr3 s HIS 62 CO -0.04 -1.66 1.72 -1.35 -0.65 0.00 0.00 174.74 172.77 2dr3 h PRO 63 N 4.07 0.00 -0.04 2.88 0.11 -1.92 0.14 132.00 137.25 2dr3 h PRO 63 Ca -0.47 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 2dr3 h PRO 63 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2dr3 h PRO 63 CO 0.69 0.00 0.02 0.28 -0.21 0.00 0.00 178.00 178.79 2dr3 h VAL 64 N 0.00 1.05 -0.31 3.15 2.07 -2.01 -2.00 116.25 118.20 2dr3 h VAL 64 Ca 0.70 -0.13 -0.10 0.00 0.82 0.00 0.00 66.70 67.99 2dr3 h VAL 64 Cb 2.81 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 33.63 2dr3 h VAL 64 CO -0.01 0.04 -0.21 1.56 0.02 0.00 0.00 177.57 178.97 2dr3 h GLN 65 N 0.01 0.58 -0.69 1.57 7.50 -1.11 -2.94 115.11 120.03 2dr3 h GLN 65 Ca 0.01 -0.21 -0.05 0.00 0.50 0.00 0.00 58.65 58.90 2dr3 h GLN 65 Cb 0.04 -0.04 -0.03 0.00 0.05 0.00 0.00 27.48 27.50 2dr3 h GLN 65 CO -0.00 0.76 0.22 0.28 -1.50 0.00 0.00 178.83 178.58 2dr3 h VAL 66 N 0.52 1.25 -0.25 -0.54 2.07 -1.24 -1.35 116.25 116.71 2dr3 h VAL 66 Ca 0.08 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 2dr3 h VAL 66 Cb 0.65 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2dr3 h VAL 66 CO 0.05 0.34 0.13 0.03 0.02 0.00 0.00 177.57 178.14 2dr3 h ARG 67 N 1.03 0.35 0.00 1.57 3.08 -1.24 -2.05 114.38 117.12 2dr3 h ARG 67 Ca 0.23 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 2dr3 h ARG 67 Cb 0.29 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 2dr3 h ARG 67 CO -0.01 0.32 -0.17 1.96 -1.07 0.00 0.00 179.97 181.00 2dr3 h GLN 68 N 0.29 0.00 0.06 0.04 4.20 -1.32 -1.75 115.11 116.62 2dr3 h GLN 68 Ca 0.09 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.54 2dr3 h GLN 68 Cb 0.07 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 2dr3 h GLN 68 CO -0.01 0.17 -1.27 -0.91 -0.67 0.00 0.00 178.83 176.13 2dr3 h ASN 69 N 0.00 0.20 0.22 1.46 2.35 -1.04 -2.59 115.58 116.18 2dr3 h ASN 69 Ca -0.00 -0.25 -0.17 0.00 -0.55 0.00 0.00 56.30 55.33 2dr3 h ASN 69 Cb 0.61 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 2dr3 h ASN 69 CO 0.02 1.20 -0.66 0.24 -1.65 0.00 0.00 177.43 176.58 2dr3 h MET 70 N 0.04 0.41 -0.05 0.81 2.86 -1.18 -2.64 114.93 115.18 2dr3 h MET 70 Ca -0.13 -0.31 -0.08 0.00 -2.06 0.00 0.00 59.70 57.12 2dr3 h MET 70 Cb 1.91 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 33.61 2dr3 h MET 70 CO 0.15 0.93 -0.36 0.00 1.06 0.00 0.00 176.91 178.70 2dr3 h ALA 71 N 0.99 1.31 -0.10 6.32 0.00 -1.26 0.60 119.26 127.11 2dr3 h ALA 71 Ca -0.02 -0.35 0.03 0.00 0.00 0.00 0.00 54.91 54.57 2dr3 h ALA 71 Cb 1.22 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2dr3 h ALA 71 CO 0.11 0.50 0.12 0.37 0.00 0.00 0.00 179.25 180.35 2dr3 h GLN 72 N 0.09 0.00 -0.55 0.00 4.15 -1.07 0.15 115.11 117.87 2dr3 h GLN 72 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2dr3 h GLN 72 Cb 0.68 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.37 2dr3 h GLN 72 CO 0.05 0.00 0.00 1.19 -1.93 0.00 0.00 178.83 178.14 2dr3 n PHE 73 N -3.75 0.78 -1.36 3.99 3.01 -0.75 -4.94 117.46 114.44 2dr3 n PHE 73 Ca -0.00 -0.51 0.00 0.00 1.01 0.00 0.00 57.45 57.94 2dr3 n PHE 73 Cb 0.23 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.67 2dr3 n PHE 73 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dr3 n GLY 74 N 1.09 0.59 2.95 1.37 0.00 0.52 -4.71 105.19 107.00 2dr3 n GLY 74 Ca 0.19 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 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 3.67 -0.61 1.61 0.51 0.13 -4.97 118.94 117.27 2dr3 s TRP 75 Ca 0.00 -3.27 -0.24 0.00 -2.12 0.00 0.00 56.10 50.47 2dr3 s TRP 75 Cb 0.00 -2.85 0.05 0.00 -0.81 0.00 0.00 33.47 29.86 2dr3 s TRP 75 CO 0.00 -0.59 0.98 0.34 -0.51 0.00 0.00 176.95 177.17 2dr3 s ASP 76 N -1.14 6.26 0.11 2.95 2.15 -1.26 -3.12 116.67 122.62 2dr3 s ASP 76 Ca 0.26 -0.62 0.26 0.00 0.43 0.00 0.00 52.55 52.87 2dr3 s ASP 76 Cb -0.05 -2.44 0.98 0.00 -0.30 0.00 0.00 42.92 41.11 2dr3 s ASP 76 CO -0.16 -1.37 1.80 1.33 -0.17 0.00 0.00 175.17 176.61 2dr3 n VAL 77 N 6.10 0.42 -0.24 1.11 0.24 -1.26 -4.07 118.33 120.63 2dr3 n VAL 77 Ca -0.00 -0.06 0.04 0.00 -2.04 0.00 0.00 64.34 62.27 2dr3 n VAL 77 Cb 0.47 -0.66 0.14 0.00 -1.47 0.00 0.00 33.84 32.32 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 0.13 -0.81 7.34 1.57 -1.97 -1.26 116.57 121.58 2dr3 h LYS 78 Ca 0.00 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2dr3 h LYS 78 Cb 0.55 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.79 2dr3 h LYS 78 CO 0.00 0.09 0.54 -1.35 -0.57 0.00 0.00 179.45 178.15 2dr3 h PRO 79 N 0.13 1.06 0.03 3.15 0.11 -2.02 -3.02 132.00 131.45 2dr3 h PRO 79 Ca 0.38 -0.06 -0.27 0.00 0.11 0.00 0.00 66.00 66.16 2dr3 h PRO 79 Cb 0.65 -0.24 0.02 0.00 0.11 0.00 0.00 31.00 31.54 2dr3 h PRO 79 CO -0.59 0.70 -1.08 1.88 -0.21 0.00 0.00 178.00 178.70 2dr3 h TYR 80 N 1.09 0.94 0.34 0.65 -1.99 -1.53 -3.29 116.97 113.17 2dr3 h TYR 80 Ca 0.30 -0.54 -0.01 0.00 2.00 0.00 0.00 58.73 60.48 2dr3 h TYR 80 Cb -0.12 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.50 2dr3 h TYR 80 CO -0.00 1.37 -0.22 0.93 -0.00 0.00 0.00 178.16 180.24 2dr3 h GLU 81 N 0.33 -0.53 -0.32 4.88 5.08 -1.25 -0.74 114.58 122.03 2dr3 h GLU 81 Ca -0.13 0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.36 2dr3 h GLU 81 Cb 1.74 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 31.09 2dr3 h GLU 81 CO 0.21 -0.35 0.49 1.49 -1.00 0.00 0.00 179.01 179.84 2dr3 h GLU 82 N -0.55 0.00 -0.66 2.33 4.22 -1.66 0.82 114.58 119.09 2dr3 h GLU 82 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.41 2dr3 h GLU 82 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2dr3 h GLU 82 CO 0.02 0.00 0.00 1.63 -2.18 0.00 0.00 179.01 178.48 2dr3 n LYS 83 N -3.40 3.88 -3.40 1.92 5.02 -0.63 -4.95 118.16 116.60 2dr3 n LYS 83 Ca 0.06 -2.94 -0.23 0.00 -2.02 0.00 0.00 58.31 53.18 2dr3 n LYS 83 Cb 0.63 -1.94 0.07 0.00 -0.02 0.00 0.00 35.03 33.77 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 1.13 -0.50 0.01 0.72 0.00 0.28 -4.91 105.19 101.93 2dr3 n GLY 84 Ca 0.26 0.19 0.02 0.00 0.00 0.00 0.00 46.02 46.50 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 -4.61 0.49 -4.25 1.61 2.81 -0.38 -4.59 117.12 108.20 2dr3 n MET 85 Ca -0.02 -0.05 -0.17 0.00 -1.81 0.00 0.00 57.70 55.64 2dr3 n MET 85 Cb 0.57 -1.14 -0.13 0.00 -0.71 0.00 0.00 33.22 31.82 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 -2.38 0.94 0.01 2.03 5.36 -1.23 -1.32 117.98 121.39 2dr3 s PHE 86 Ca -0.02 -0.34 0.01 0.00 -0.96 0.00 0.00 56.93 55.62 2dr3 s PHE 86 Cb 0.04 -0.56 -0.01 0.00 -0.34 0.00 0.00 43.02 42.14 2dr3 s PHE 86 CO 0.24 -0.00 -0.03 0.00 -1.46 0.00 0.00 175.22 173.96 2dr3 s ALA 87 N -0.83 0.22 -0.23 11.12 0.00 -0.35 -4.30 121.76 127.40 2dr3 s ALA 87 Ca -0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 51.96 51.65 2dr3 s ALA 87 Cb -0.07 0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.08 2dr3 s ALA 87 CO 0.01 -0.01 -0.10 -1.64 0.00 0.00 0.00 175.76 174.02 2dr3 s MET 88 N -0.57 2.89 -0.21 0.00 -1.94 -1.26 -1.35 119.30 116.86 2dr3 s MET 88 Ca -0.04 -0.93 -0.13 0.00 -1.71 0.00 0.00 55.69 52.88 2dr3 s MET 88 Cb -0.04 -2.86 -0.05 0.00 2.01 0.00 0.00 34.83 33.89 2dr3 s MET 88 CO -0.00 -0.34 0.25 0.08 -0.01 0.00 0.00 175.02 175.00 2dr3 s VAL 89 N 1.31 5.31 -0.79 -6.03 1.01 -0.62 -4.27 120.40 116.33 2dr3 s VAL 89 Ca 0.01 0.40 -0.19 0.00 0.00 0.00 0.00 61.98 62.21 2dr3 s VAL 89 Cb -0.16 -3.59 0.13 0.00 0.00 0.00 0.00 36.38 32.76 2dr3 s VAL 89 CO -0.07 0.34 0.95 -0.62 0.00 0.00 0.00 175.10 175.70 2dr3 s ASP 90 N 0.83 6.46 -0.31 3.32 3.68 0.63 -1.09 116.67 130.18 2dr3 s ASP 90 Ca 0.13 -1.80 0.07 0.00 2.13 0.00 0.00 52.55 53.08 2dr3 s ASP 90 Cb -0.13 -2.35 0.47 0.00 -1.45 0.00 0.00 42.92 39.45 2dr3 s ASP 90 CO 0.04 -1.08 1.37 0.00 0.13 0.00 0.00 175.17 175.64 2dr3 n ALA 91 N 6.35 4.68 -0.05 3.66 0.00 0.01 -1.09 120.51 134.07 2dr3 n ALA 91 Ca 0.10 -3.47 -0.11 0.00 0.00 0.00 0.00 53.44 49.96 2dr3 n ALA 91 Cb 0.47 -0.61 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 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 -0.94 0.00 -0.22 0.00 7.35 -0.85 -4.25 117.46 118.54 2dr3 n PHE 92 Ca 0.38 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 57.09 2dr3 n PHE 92 Cb 0.90 -0.39 0.14 0.00 0.35 0.00 0.00 39.48 40.48 2dr3 n PHE 92 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 2dr3 h THR 93 N -0.47 0.69 -0.46 -2.13 1.35 -1.89 0.27 112.91 110.27 2dr3 h THR 93 Ca -0.22 -0.13 0.11 0.00 -0.55 0.00 0.00 66.41 65.62 2dr3 h THR 93 Cb 1.00 0.27 -0.02 0.00 -1.73 0.00 0.00 68.15 67.67 2dr3 h THR 93 CO -0.13 0.07 0.32 0.00 -0.25 0.00 0.00 175.52 175.53 2dr3 h ALA 94 N 1.49 2.26 -0.21 6.62 0.00 -1.79 -1.82 119.26 125.82 2dr3 h ALA 94 Ca 0.35 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 2dr3 h ALA 94 Cb 0.50 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2dr3 h ALA 94 CO -0.37 -0.38 -0.08 0.78 0.00 0.00 0.00 179.25 179.19 2dr3 h GLY 95 N 0.13 0.35 -2.63 0.00 0.00 -0.69 -3.00 103.07 97.23 2dr3 h GLY 95 Ca 0.22 -0.21 -0.32 0.00 0.00 0.00 0.00 47.33 47.02 2dr3 h GLY 95 CO -0.03 0.20 -0.17 0.29 0.00 0.00 0.00 176.54 176.83 2dr3 n ILE 96 N -4.28 2.66 -0.43 2.60 -5.35 -0.70 -5.08 119.36 108.79 2dr3 n ILE 96 Ca -0.00 -3.16 0.05 0.00 -0.27 0.00 0.00 62.75 59.38 2dr3 n ILE 96 Cb 0.26 -0.61 -0.02 0.00 -1.74 0.00 0.00 39.64 37.53 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 -1.01 -2.34 7.00 3.28 0.00 -1.12 -5.07 105.19 105.93 2dr3 n GLY 97 Ca 0.39 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.95 0.00 -1.17 1.61 4.01 -1.26 -4.49 118.16 113.91 2dr3 n LYS 98 Ca -0.02 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.78 2dr3 n LYS 98 Cb 0.20 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.72 2dr3 n LYS 98 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2dr3 n GLU 101 N 0.00 -3.08 -3.04 1.97 1.02 -1.26 -4.89 120.64 111.37 2dr3 n GLU 101 Ca 0.00 2.27 -0.40 0.00 -0.02 0.00 0.00 57.16 59.01 2dr3 n GLU 101 Cb 0.00 -2.41 -0.05 0.00 -0.02 0.00 0.00 31.44 28.96 2dr3 n GLU 101 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2dr3 s TYR 102 N -1.21 3.63 -0.01 -0.32 5.04 -1.26 -5.07 117.35 118.15 2dr3 s TYR 102 Ca 0.00 1.31 0.01 0.00 -2.44 0.00 0.00 57.07 55.96 2dr3 s TYR 102 Cb 0.00 -2.80 0.00 0.00 0.35 0.00 0.00 41.96 39.52 2dr3 s TYR 102 CO 0.00 0.16 -0.05 -1.21 -1.34 0.00 0.00 175.55 173.11 2dr3 s GLU 103 N 0.49 0.51 0.24 4.97 0.41 -1.26 -5.04 118.70 119.02 2dr3 s GLU 103 Ca 0.38 -0.15 -0.05 0.00 -0.41 0.00 0.00 54.97 54.73 2dr3 s GLU 103 Cb -0.19 -0.52 0.39 0.00 -1.78 0.00 0.00 34.13 32.03 2dr3 s GLU 103 CO 0.20 0.06 1.79 -0.22 -0.49 0.00 0.00 175.26 176.59 2dr3 h LYS 104 N 6.36 0.68 -4.89 1.61 3.64 -1.98 -3.35 116.57 118.65 2dr3 h LYS 104 Ca -0.32 -0.04 -0.67 0.00 -1.27 0.00 0.00 60.65 58.35 2dr3 h LYS 104 Cb 1.18 -0.15 -0.33 0.00 -0.41 0.00 0.00 32.23 32.51 2dr3 h LYS 104 CO 0.49 0.45 -0.76 0.71 -2.27 0.00 0.00 179.45 178.08 2dr3 s TYR 105 N -6.04 3.11 0.01 1.91 2.02 -1.26 -5.10 117.35 112.01 2dr3 s TYR 105 Ca -0.12 -1.77 0.01 0.00 -0.37 0.00 0.00 57.07 54.81 2dr3 s TYR 105 Cb 0.19 -2.03 -0.01 0.00 -0.40 0.00 0.00 41.96 39.71 2dr3 s TYR 105 CO 0.77 -0.78 -0.03 -1.50 -1.57 0.00 0.00 175.55 172.44 2dr3 s ILE 106 N 1.26 0.22 -0.34 2.71 2.07 -1.26 -0.27 121.20 125.60 2dr3 s ILE 106 Ca -0.02 -0.50 -0.07 0.00 -1.41 0.00 0.00 60.65 58.65 2dr3 s ILE 106 Cb -0.18 -0.26 0.04 0.00 0.13 0.00 0.00 42.46 42.19 2dr3 s ILE 106 CO -0.05 -0.18 0.11 -0.69 -1.91 0.00 0.00 174.94 172.22 2dr3 s VAL 107 N -0.68 3.84 0.16 4.00 1.01 -0.25 -4.93 120.40 123.55 2dr3 s VAL 107 Ca -0.06 -1.09 0.07 0.00 0.00 0.00 0.00 61.98 60.90 2dr3 s VAL 107 Cb -0.05 -3.16 -0.16 0.00 0.00 0.00 0.00 36.38 33.01 2dr3 s VAL 107 CO -0.00 -0.16 1.37 0.45 0.00 0.00 0.00 175.10 176.75 2dr3 h HIS 108 N 8.23 0.06 -3.23 5.22 -0.00 -1.96 -3.39 115.15 120.09 2dr3 h HIS 108 Ca -0.24 -0.04 -0.54 0.00 -0.00 0.00 0.00 60.37 59.56 2dr3 h HIS 108 Cb 1.09 -0.01 -0.37 0.00 -0.00 0.00 0.00 27.41 28.12 2dr3 h HIS 108 CO 0.59 0.91 -0.80 0.34 -0.00 0.00 0.00 177.93 178.98 2dr3 s ASP 109 N -6.79 2.39 0.00 2.45 -1.08 -1.26 -4.79 116.67 107.59 2dr3 s ASP 109 Ca -0.00 -0.42 0.24 0.00 -0.52 0.00 0.00 52.55 51.84 2dr3 s ASP 109 Cb 0.11 -0.87 0.15 0.00 -1.46 0.00 0.00 42.92 40.85 2dr3 s ASP 109 CO 0.81 -0.14 1.23 0.18 0.52 0.00 0.00 175.17 177.76 2dr3 n LEU 110 N 4.92 2.82 -0.37 -1.34 4.77 -1.26 -4.38 117.00 122.16 2dr3 n LEU 110 Ca -0.12 -0.96 0.28 0.00 -0.03 0.00 0.00 56.01 55.18 2dr3 n LEU 110 Cb 0.49 0.00 0.55 0.00 -2.33 0.00 0.00 43.42 42.13 2dr3 n LEU 110 CO 0.17 0.48 1.20 0.74 -1.33 0.00 0.00 177.39 178.64 2dr3 h THR 111 N 4.29 0.32 -4.44 -5.08 2.02 -1.97 -3.42 112.91 104.64 2dr3 h THR 111 Ca 0.00 -0.09 -0.25 0.00 0.77 0.00 0.00 66.41 66.84 2dr3 h THR 111 Cb 0.95 0.03 -0.13 0.00 -1.74 0.00 0.00 68.15 67.26 2dr3 h THR 111 CO 0.00 0.05 -0.48 1.51 0.37 0.00 0.00 175.52 176.97 2dr3 s ASP 112 N -4.89 0.40 -0.07 4.18 -4.77 -1.26 -5.08 116.67 105.18 2dr3 s ASP 112 Ca -0.09 -1.37 0.20 0.00 -3.30 0.00 0.00 52.55 47.99 2dr3 s ASP 112 Cb 0.28 0.46 0.71 0.00 -1.09 0.00 0.00 42.92 43.29 2dr3 s ASP 112 CO 0.80 -0.96 1.61 2.30 0.70 0.00 0.00 175.17 179.62 2dr3 n ILE 113 N -0.37 1.53 0.08 2.11 -5.35 -1.26 -4.45 119.36 111.66 2dr3 n ILE 113 Ca 0.02 -1.12 -0.13 0.00 -0.27 0.00 0.00 62.75 61.25 2dr3 n ILE 113 Cb 0.64 0.27 -0.08 0.00 -1.74 0.00 0.00 39.64 38.73 2dr3 n ILE 113 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 2dr3 h ARG 114 N 4.26 -0.18 -0.69 6.28 3.08 -1.97 0.59 114.38 125.75 2dr3 h ARG 114 Ca 0.00 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 2dr3 h ARG 114 Cb 1.30 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.36 2dr3 h ARG 114 CO 0.15 0.07 0.40 1.49 -1.07 0.00 0.00 179.97 181.02 2dr3 h GLU 115 N -0.42 0.94 -0.70 0.04 4.81 -1.86 0.13 114.58 117.53 2dr3 h GLU 115 Ca -0.02 -0.09 0.09 0.00 -0.13 0.00 0.00 59.36 59.20 2dr3 h GLU 115 Cb 0.34 -0.19 -0.07 0.00 0.63 0.00 0.00 28.75 29.46 2dr3 h GLU 115 CO 0.03 0.68 0.35 0.35 -0.73 0.00 0.00 179.01 179.69 2dr3 h PHE 116 N 0.94 0.62 -0.37 0.92 3.04 -1.73 0.18 116.94 120.54 2dr3 h PHE 116 Ca 0.25 0.03 -0.13 0.00 3.98 0.00 0.00 57.97 62.10 2dr3 h PHE 116 Cb -0.01 -0.18 -0.01 0.00 2.56 0.00 0.00 35.95 38.32 2dr3 h PHE 116 CO -0.01 0.23 -0.28 0.82 -2.02 0.00 0.00 178.31 177.05 2dr3 h ILE 117 N 0.60 1.28 0.89 1.41 2.04 -0.12 -1.67 117.51 121.93 2dr3 h ILE 117 Ca 0.34 -1.42 -0.04 0.00 1.00 0.00 0.00 64.86 64.74 2dr3 h ILE 117 Cb 0.34 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 2dr3 h ILE 117 CO -0.26 0.47 -0.49 -0.33 0.00 0.00 0.00 178.15 177.54 2dr3 h GLU 118 N 0.67 -1.23 -0.80 2.37 5.08 0.70 0.23 114.58 121.61 2dr3 h GLU 118 Ca 0.08 0.08 0.13 0.00 -1.00 0.00 0.00 59.36 58.65 2dr3 h GLU 118 Cb 0.81 0.28 -0.09 0.00 0.50 0.00 0.00 28.75 30.25 2dr3 h GLU 118 CO 0.07 -0.82 0.40 0.28 -1.00 0.00 0.00 179.01 177.94 2dr3 h VAL 119 N -1.27 0.76 -0.60 3.13 2.07 -1.08 1.00 116.25 120.26 2dr3 h VAL 119 Ca -0.12 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 2dr3 h VAL 119 Cb 1.00 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 2dr3 h VAL 119 CO 0.16 0.11 0.20 0.25 0.02 0.00 0.00 177.57 178.30 2dr3 h LEU 120 N 0.61 0.87 -0.58 2.57 5.85 -1.05 -1.34 115.31 122.23 2dr3 h LEU 120 Ca 0.42 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 2dr3 h LEU 120 Cb 0.56 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2dr3 h LEU 120 CO -0.34 0.84 0.35 0.03 -0.34 0.00 0.00 178.44 178.98 2dr3 h ARG 121 N 0.86 0.79 0.14 1.25 3.08 0.12 -1.75 114.38 118.86 2dr3 h ARG 121 Ca 0.20 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2dr3 h ARG 121 Cb 0.28 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2dr3 h ARG 121 CO -0.01 0.58 -0.13 0.37 -1.07 0.00 0.00 179.97 179.70 2dr3 h GLN 122 N 0.79 -0.28 -0.74 0.04 5.75 -0.50 -2.24 115.11 117.93 2dr3 h GLN 122 Ca 0.21 0.02 0.04 0.00 -0.15 0.00 0.00 58.65 58.77 2dr3 h GLN 122 Cb -0.01 0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.55 2dr3 h GLN 122 CO -0.04 -0.19 0.45 0.00 -2.65 0.00 0.00 178.83 176.41 2dr3 h ALA 123 N 0.55 0.98 -0.77 3.38 0.00 -1.05 -1.00 119.26 121.34 2dr3 h ALA 123 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2dr3 h ALA 123 Cb 0.28 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2dr3 h ALA 123 CO -0.03 0.21 0.38 0.82 0.00 0.00 0.00 179.25 180.63 2dr3 h ILE 124 N 0.87 1.24 0.03 0.00 2.04 -1.18 -2.51 117.51 118.00 2dr3 h ILE 124 Ca 0.31 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.49 2dr3 h ILE 124 Cb 0.08 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2dr3 h ILE 124 CO -0.13 0.29 -0.02 -0.09 0.00 0.00 0.00 178.15 178.20 2dr3 h ARG 125 N 1.09 -0.04 -0.54 2.37 2.43 -0.96 0.80 114.38 119.52 2dr3 h ARG 125 Ca 0.27 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.53 2dr3 h ARG 125 Cb 0.11 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 2dr3 h ARG 125 CO -0.04 0.33 0.37 -0.44 -1.51 0.00 0.00 179.97 178.68 2dr3 h ASP 126 N -0.42 0.32 -0.01 -3.80 3.32 -1.12 -2.98 116.42 111.73 2dr3 h ASP 126 Ca -0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2dr3 h ASP 126 Cb 0.39 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2dr3 h ASP 126 CO 0.01 0.20 -0.09 -0.38 -1.72 0.00 0.00 179.24 177.26 2dr3 n ILE 127 N -4.47 0.00 -3.72 0.35 5.41 -0.95 -4.97 119.36 111.01 2dr3 n ILE 127 Ca 0.08 -0.46 -0.27 0.00 1.00 0.00 0.00 62.75 63.11 2dr3 n ILE 127 Cb 0.35 1.18 0.06 0.00 -0.71 0.00 0.00 39.64 40.52 2dr3 n ILE 127 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2dr3 n ASN 128 N 0.24 -5.77 -4.67 4.38 3.02 0.22 -4.79 115.26 107.90 2dr3 n ASN 128 Ca 0.05 -0.63 -0.43 0.00 -0.03 0.00 0.00 54.58 53.55 2dr3 n ASN 128 Cb 0.24 -4.56 -0.00 0.00 -0.61 0.00 0.00 39.78 34.85 2dr3 n ASN 128 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dr3 n ALA 129 N -4.86 0.86 0.00 5.41 0.00 -0.90 -4.66 120.51 116.36 2dr3 n ALA 129 Ca 0.02 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2dr3 n ALA 129 Cb 0.55 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.81 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 0.46 3.74 -4.37 0.00 5.02 -0.59 -4.55 118.16 117.88 2dr3 n LYS 130 Ca 0.06 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.15 2dr3 n LYS 130 Cb 0.36 -0.73 -0.16 0.00 -0.02 0.00 0.00 35.03 34.48 2dr3 n LYS 130 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2dr3 s ARG 131 N -1.46 1.06 -0.00 1.97 0.52 -1.05 -1.16 118.95 118.83 2dr3 s ARG 131 Ca 0.00 -0.27 0.02 0.00 -0.52 0.00 0.00 55.73 54.96 2dr3 s ARG 131 Cb 0.00 -0.97 -0.01 0.00 0.52 0.00 0.00 34.95 34.49 2dr3 s ARG 131 CO 0.00 0.05 -0.07 0.08 0.02 0.00 0.00 175.30 175.38 2dr3 s VAL 132 N 0.47 0.54 -0.07 3.52 1.01 -0.18 -0.93 120.40 124.76 2dr3 s VAL 132 Ca -0.08 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.57 2dr3 s VAL 132 Cb -0.12 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 35.81 2dr3 s VAL 132 CO 0.01 0.10 -0.16 -0.69 0.00 0.00 0.00 175.10 174.37 2dr3 s VAL 133 N -0.26 1.40 -0.27 2.92 1.01 0.24 -0.78 120.40 124.66 2dr3 s VAL 133 Ca 0.02 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 2dr3 s VAL 133 Cb -0.03 -1.24 0.04 0.00 0.00 0.00 0.00 36.38 35.14 2dr3 s VAL 133 CO -0.00 0.41 -0.04 -0.69 0.00 0.00 0.00 175.10 174.78 2dr3 s VAL 134 N 0.52 2.87 -0.25 2.92 1.01 -0.57 0.02 120.40 126.92 2dr3 s VAL 134 Ca -0.15 -1.20 -0.01 0.00 0.00 0.00 0.00 61.98 60.63 2dr3 s VAL 134 Cb -0.16 -2.54 0.07 0.00 0.00 0.00 0.00 36.38 33.75 2dr3 s VAL 134 CO 0.05 0.07 0.03 -0.62 0.00 0.00 0.00 175.10 174.63 2dr3 s ASP 135 N 1.28 3.59 0.08 3.32 2.15 -0.05 -1.44 116.67 125.61 2dr3 s ASP 135 Ca -0.02 -1.22 0.09 0.00 0.43 0.00 0.00 52.55 51.82 2dr3 s ASP 135 Cb -0.18 -0.87 -0.03 0.00 -0.30 0.00 0.00 42.92 41.53 2dr3 s ASP 135 CO -0.03 -0.32 -0.24 -0.94 -0.17 0.00 0.00 175.17 173.46 2dr3 s SER 136 N 1.62 2.92 0.45 -0.34 1.04 -1.26 0.09 113.70 118.22 2dr3 s SER 136 Ca 0.02 -0.65 0.31 0.00 0.48 0.00 0.00 55.95 56.11 2dr3 s SER 136 Cb -0.18 -0.21 1.48 0.00 0.10 0.00 0.00 66.02 67.21 2dr3 s SER 136 CO -0.13 0.17 1.93 1.62 0.98 0.00 0.00 173.24 177.81 2dr3 h VAL 137 N 4.11 0.00 -0.45 5.02 3.04 -1.44 -2.34 116.25 124.19 2dr3 h VAL 137 Ca -0.47 -0.20 -0.04 0.00 -1.01 0.00 0.00 66.70 64.97 2dr3 h VAL 137 Cb 1.16 1.02 -0.02 0.00 -2.01 0.00 0.00 31.29 31.44 2dr3 h VAL 137 CO 0.41 0.00 0.11 0.74 -1.01 0.00 0.00 177.57 177.82 2dr3 h THR 138 N 0.00 1.20 0.00 3.17 2.02 -1.92 -2.47 112.91 114.91 2dr3 h THR 138 Ca 0.00 -0.72 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 2dr3 h THR 138 Cb 0.24 0.74 -0.00 0.00 -1.74 0.00 0.00 68.15 67.39 2dr3 h THR 138 CO 0.00 0.26 -0.08 0.74 0.37 0.00 0.00 175.52 176.82 2dr3 h THR 139 N 0.66 0.49 0.00 3.16 2.02 -1.78 0.11 112.91 117.57 2dr3 h THR 139 Ca 0.15 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.94 2dr3 h THR 139 Cb 0.25 1.24 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 2dr3 h THR 139 CO -0.00 0.07 -0.15 -0.07 0.37 0.00 0.00 175.52 175.74 2dr3 h LEU 140 N 0.00 0.00 -1.39 2.58 3.38 -1.59 -3.34 115.31 114.95 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 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2dr3 h LEU 140 CO 0.01 0.15 -0.21 0.00 0.09 0.00 0.00 178.44 178.47 2dr3 n TYR 141 N -3.42 0.00 -0.22 1.13 0.18 -0.89 -4.89 117.16 109.05 2dr3 n TYR 141 Ca -0.01 0.00 0.17 0.00 1.88 0.00 0.00 57.90 59.94 2dr3 n TYR 141 Cb 0.33 -0.01 0.49 0.00 -0.38 0.00 0.00 39.34 39.77 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 4.78 0.74 -0.03 -3.48 6.09 -0.93 0.19 117.51 124.87 2dr3 h ILE 142 Ca 0.00 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 2dr3 h ILE 142 Cb 1.17 0.25 0.00 0.00 0.47 0.00 0.00 36.82 38.71 2dr3 h ILE 142 CO 0.00 0.08 0.00 0.59 -3.07 0.00 0.00 178.15 175.75 2dr3 n ASN 143 N -4.51 2.41 -3.14 2.19 3.02 -1.26 -4.45 115.26 109.52 2dr3 n ASN 143 Ca 0.17 -1.80 -0.19 0.00 -0.03 0.00 0.00 54.58 52.73 2dr3 n ASN 143 Cb 0.61 -0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.74 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 0.89 0.87 -0.33 3.52 2.85 0.03 -5.00 118.16 120.99 2dr3 n LYS 144 Ca 0.16 -3.16 0.26 0.00 -1.05 0.00 0.00 58.31 54.51 2dr3 n LYS 144 Cb 0.50 -1.48 0.50 0.00 -0.65 0.00 0.00 35.03 33.90 2dr3 n LYS 144 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 177.40 176.00 2dr3 h PRO 145 N 3.40 0.14 -0.04 -1.58 0.11 -1.71 0.02 132.00 132.34 2dr3 h PRO 145 Ca 0.07 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.18 2dr3 h PRO 145 Cb 0.95 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 2dr3 h PRO 145 CO 0.46 0.09 0.05 0.00 -0.21 0.00 0.00 178.00 178.39 2dr3 h ALA 146 N 1.92 1.60 -0.00 -0.75 0.00 -1.94 -1.80 119.26 118.29 2dr3 h ALA 146 Ca 0.76 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.67 2dr3 h ALA 146 Cb 1.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.64 2dr3 h ALA 146 CO -0.71 -0.07 -0.31 -1.33 0.00 0.00 0.00 179.25 176.83 2dr3 n MET 147 N -3.85 0.32 -0.02 0.00 2.81 -0.01 -4.30 117.12 112.07 2dr3 n MET 147 Ca -0.02 -0.16 -0.09 0.00 -1.81 0.00 0.00 57.70 55.62 2dr3 n MET 147 Cb 0.14 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.12 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 3.27 0.06 -0.23 3.04 0.00 -1.40 -2.53 119.26 121.46 2dr3 h ALA 148 Ca 0.00 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2dr3 h ALA 148 Cb 0.48 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 2dr3 h ALA 148 CO 0.00 -0.52 -0.18 -0.09 0.00 0.00 0.00 179.25 178.45 2dr3 h ARG 149 N -0.07 -0.18 -0.22 0.00 2.43 -1.78 -1.14 114.38 113.42 2dr3 h ARG 149 Ca 0.10 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.18 2dr3 h ARG 149 Cb 0.22 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2dr3 h ARG 149 CO -0.22 -0.12 -0.28 0.66 -1.51 0.00 0.00 179.97 178.50 2dr3 h SER 150 N -0.19 0.43 -0.31 -3.80 4.64 -1.83 -2.05 113.55 110.45 2dr3 h SER 150 Ca 0.13 -0.15 -0.06 0.00 -0.47 0.00 0.00 61.79 61.24 2dr3 h SER 150 Cb 0.38 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2dr3 h SER 150 CO -0.34 0.71 -0.04 0.40 -0.87 0.00 0.00 176.83 176.69 2dr3 h ILE 151 N 0.38 1.27 -0.57 0.95 2.04 -1.00 0.11 117.51 120.69 2dr3 h ILE 151 Ca 0.05 -1.03 -0.05 0.00 1.00 0.00 0.00 64.86 64.84 2dr3 h ILE 151 Cb 0.69 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 2dr3 h ILE 151 CO 0.05 0.33 0.17 0.40 0.00 0.00 0.00 178.15 179.10 2dr3 h ILE 152 N 0.34 1.24 -0.22 -0.67 1.08 -1.12 -1.32 117.51 116.84 2dr3 h ILE 152 Ca 0.08 -0.82 -0.12 0.00 -0.39 0.00 0.00 64.86 63.62 2dr3 h ILE 152 Cb 0.50 0.70 -0.01 0.00 -3.07 0.00 0.00 36.82 34.94 2dr3 h ILE 152 CO 0.02 0.31 -0.35 -0.07 -0.69 0.00 0.00 178.15 177.36 2dr3 h LEU 153 N 0.79 0.50 -0.05 1.44 3.38 -1.22 -1.72 115.31 118.44 2dr3 h LEU 153 Ca 0.18 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2dr3 h LEU 153 Cb 0.29 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2dr3 h LEU 153 CO -0.00 0.81 -0.06 1.56 0.09 0.00 0.00 178.44 180.84 2dr3 h GLN 154 N 0.40 0.13 -0.77 1.13 4.20 -0.58 -1.85 115.11 117.77 2dr3 h GLN 154 Ca 0.04 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 2dr3 h GLN 154 Cb 0.81 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.56 2dr3 h GLN 154 CO 0.07 0.61 0.47 -0.07 -0.67 0.00 0.00 178.83 179.23 2dr3 h LEU 155 N -0.34 0.92 -0.39 1.46 3.38 -1.24 -1.93 115.31 117.17 2dr3 h LEU 155 Ca 0.01 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2dr3 h LEU 155 Cb 0.59 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2dr3 h LEU 155 CO 0.01 0.70 0.16 0.50 0.09 0.00 0.00 178.44 179.91 2dr3 h LYS 156 N 1.06 0.57 -0.59 1.13 3.64 -1.25 -0.55 116.57 120.58 2dr3 h LYS 156 Ca 0.28 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2dr3 h LYS 156 Cb -0.05 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 2dr3 h LYS 156 CO -0.05 0.54 0.21 -0.09 -2.27 0.00 0.00 179.45 177.78 2dr3 h ARG 157 N 0.48 0.90 -0.12 1.90 2.43 -0.85 -1.05 114.38 118.07 2dr3 h ARG 157 Ca 0.13 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2dr3 h ARG 157 Cb 0.17 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2dr3 h ARG 157 CO -0.01 0.79 0.02 0.28 -1.51 0.00 0.00 179.97 179.54 2dr3 h VAL 158 N 0.82 1.21 -0.18 0.20 2.07 -1.17 0.78 116.25 119.98 2dr3 h VAL 158 Ca 0.19 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 2dr3 h VAL 158 Cb 0.25 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2dr3 h VAL 158 CO -0.01 0.19 0.05 -0.07 0.02 0.00 0.00 177.57 177.75 2dr3 h LEU 159 N -0.03 0.26 -1.12 2.57 3.38 -1.04 -1.93 115.31 117.40 2dr3 h LEU 159 Ca 0.04 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 2dr3 h LEU 159 Cb 0.28 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2dr3 h LEU 159 CO 0.00 0.41 -0.23 0.00 0.09 0.00 0.00 178.44 178.71 2dr3 h ALA 160 N 0.86 1.26 0.00 1.53 0.00 -1.22 -0.61 119.26 121.08 2dr3 h ALA 160 Ca 0.06 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2dr3 h ALA 160 Cb 0.25 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2dr3 h ALA 160 CO -0.00 0.49 -0.15 0.78 0.00 0.00 0.00 179.25 180.37 2dr3 h GLY 161 N 0.97 0.00 -2.92 0.00 0.00 -0.48 -2.18 103.07 98.47 2dr3 h GLY 161 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2dr3 h GLY 161 CO 0.04 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.28 2dr3 n THR 162 N -3.55 1.67 -0.97 4.70 -2.24 -0.76 -4.93 114.28 108.20 2dr3 n THR 162 Ca -0.01 -1.17 0.00 0.00 -2.27 0.00 0.00 64.05 60.59 2dr3 n THR 162 Cb 0.29 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 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 1.18 0.36 3.85 3.38 0.00 -0.82 -4.97 105.19 108.17 2dr3 n GLY 163 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.69 2.38 0.18 0.00 2.01 -0.31 -3.74 115.64 113.47 2dr3 s THR 165 Ca 0.58 -0.90 0.04 0.00 0.31 0.00 0.00 61.69 61.72 2dr3 s THR 165 Cb -0.10 -1.95 -0.05 0.00 0.01 0.00 0.00 72.50 70.42 2dr3 s THR 165 CO 0.34 0.55 -0.05 -0.44 -0.69 0.00 0.00 174.62 174.33 2dr3 s SER 166 N 0.40 1.76 -0.18 3.53 0.01 -0.50 -1.01 113.70 117.71 2dr3 s SER 166 Ca -0.15 -1.11 0.00 0.00 1.31 0.00 0.00 55.95 56.00 2dr3 s SER 166 Cb -0.17 0.01 0.04 0.00 0.21 0.00 0.00 66.02 66.10 2dr3 s SER 166 CO 0.07 -0.43 -0.10 -0.63 0.41 0.00 0.00 173.24 172.56 2dr3 s ILE 167 N -3.39 1.50 -0.33 1.44 1.01 0.04 -0.00 121.20 121.47 2dr3 s ILE 167 Ca 0.22 -0.82 -0.15 0.00 0.00 0.00 0.00 60.65 59.90 2dr3 s ILE 167 Cb 0.04 -1.55 -0.02 0.00 0.01 0.00 0.00 42.46 40.94 2dr3 s ILE 167 CO 0.04 0.24 0.35 -0.36 0.00 0.00 0.00 174.94 175.21 2dr3 s PHE 168 N 1.47 3.21 -0.16 3.97 0.40 0.12 -1.51 117.98 125.48 2dr3 s PHE 168 Ca 0.01 0.02 -0.27 0.00 -0.60 0.00 0.00 56.93 56.09 2dr3 s PHE 168 Cb -0.15 -2.63 -0.01 0.00 0.51 0.00 0.00 43.02 40.74 2dr3 s PHE 168 CO -0.09 -0.39 0.91 0.08 0.70 0.00 0.00 175.22 176.43 2dr3 s VAL 169 N 1.99 4.82 -0.20 -0.44 1.01 -0.52 -0.38 120.40 126.69 2dr3 s VAL 169 Ca 0.11 1.80 -0.03 0.00 0.00 0.00 0.00 61.98 63.86 2dr3 s VAL 169 Cb -0.16 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.00 2dr3 s VAL 169 CO 0.11 -0.01 -0.06 -0.55 0.00 0.00 0.00 175.10 174.59 2dr3 s SER 170 N 1.15 4.22 -0.26 3.32 0.15 0.34 -2.10 113.70 120.53 2dr3 s SER 170 Ca 0.42 -0.38 -0.21 0.00 0.70 0.00 0.00 55.95 56.47 2dr3 s SER 170 Cb -0.17 -1.71 -0.01 0.00 -1.71 0.00 0.00 66.02 62.42 2dr3 s SER 170 CO 0.13 0.02 0.68 -1.10 1.20 0.00 0.00 173.24 174.17 2dr3 s GLN 171 N 1.26 4.11 0.01 5.44 -0.21 -1.26 -2.47 119.66 126.54 2dr3 s GLN 171 Ca 0.03 0.63 0.03 0.00 0.02 0.00 0.00 55.36 56.08 2dr3 s GLN 171 Cb -0.14 -3.65 -0.03 0.00 1.00 0.00 0.00 33.01 30.18 2dr3 s GLN 171 CO -0.02 -0.45 -0.06 0.08 -2.12 0.00 0.00 175.29 172.71 2dr3 s VAL 172 N 2.61 3.71 0.00 1.09 1.01 -0.74 -4.96 120.40 123.12 2dr3 s VAL 172 Ca 0.28 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2dr3 s VAL 172 Cb -0.15 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.60 2dr3 s VAL 172 CO 0.08 0.38 0.02 -1.20 0.00 0.00 0.00 175.10 174.39 2dr3 n SER 173 N 1.50 0.00 -3.35 3.32 7.64 -1.26 -3.86 113.62 117.61 2dr3 n SER 173 Ca -0.15 0.02 -0.15 0.00 1.01 0.00 0.00 58.87 59.60 2dr3 n SER 173 Cb 0.53 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.65 2dr3 n SER 173 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2dr3 s VAL 174 N -0.05 -0.41 0.00 0.44 1.01 -1.26 -4.57 120.40 115.57 2dr3 s VAL 174 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.15 2dr3 s VAL 174 Cb 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 36.38 35.71 2dr3 s VAL 174 CO 0.00 -0.51 0.00 0.61 0.00 0.00 0.00 175.10 175.20 2dr3 n GLY 175 N 4.42 -1.03 0.00 4.51 0.00 -1.26 -5.20 105.19 106.62 2dr3 n GLY 175 Ca 0.09 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.63 2dr3 n GLY 175 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dr3 n PRO 182 N 0.00 0.00 0.00 1.61 -0.04 -1.26 -5.00 135.00 130.31 2dr3 n PRO 182 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2dr3 n PRO 182 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2dr3 n PRO 182 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dr3 n GLY 183 N 0.00 1.47 0.13 0.55 0.00 -1.26 -4.59 105.19 101.49 2dr3 n GLY 183 Ca 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 2dr3 n GLY 183 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2dr3 h VAL 184 N 0.00 0.00 -0.02 1.61 2.07 -1.92 0.51 116.25 118.49 2dr3 h VAL 184 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2dr3 h VAL 184 Cb 0.00 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.77 2dr3 h VAL 184 CO 0.00 0.00 0.03 -0.33 0.02 0.00 0.00 177.57 177.29 2dr3 h GLU 185 N -0.29 0.00 0.00 1.57 5.08 -1.96 0.54 114.58 119.52 2dr3 h GLU 185 Ca -0.02 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.13 2dr3 h GLU 185 Cb 0.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2dr3 h GLU 185 CO 0.01 0.00 -1.13 0.45 -1.00 0.00 0.00 179.01 177.34 2dr3 h HIS 186 N 0.00 0.00 0.00 4.33 3.86 -1.90 -3.34 115.15 118.10 2dr3 h HIS 186 Ca 0.01 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.10 2dr3 h HIS 186 Cb 0.08 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.53 2dr3 h HIS 186 CO 0.00 0.85 -0.56 0.78 0.86 0.00 0.00 177.93 179.87 2dr3 h GLY 187 N 3.30 0.00 -1.21 2.45 0.00 0.24 -3.46 103.07 104.39 2dr3 h GLY 187 Ca -0.09 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.76 2dr3 h GLY 187 CO 0.10 0.00 0.29 -1.34 0.00 0.00 0.00 176.54 175.59 2dr3 s VAL 188 N -3.51 3.18 -0.01 4.60 -7.23 -1.07 -4.88 120.40 111.48 2dr3 s VAL 188 Ca -0.00 0.12 -0.02 0.00 -1.81 0.00 0.00 61.98 60.26 2dr3 s VAL 188 Cb 0.12 -3.34 -0.27 0.00 0.56 0.00 0.00 36.38 33.45 2dr3 s VAL 188 CO 0.74 -0.39 0.81 0.44 -0.31 0.00 0.00 175.10 176.39 2dr3 h ASP 189 N -0.50 0.37 -5.13 4.85 3.32 -1.74 -3.48 116.42 114.10 2dr3 h ASP 189 Ca -0.45 -0.54 -0.16 0.00 0.02 0.00 0.00 57.03 55.90 2dr3 h ASP 189 Cb 1.27 -0.12 -0.15 0.00 0.22 0.00 0.00 39.33 40.55 2dr3 h ASP 189 CO 0.62 1.45 -0.67 -0.83 -1.72 0.00 0.00 179.24 178.09 2dr3 s GLY 190 N -5.00 0.68 -0.07 2.75 0.00 -0.78 -0.53 107.32 104.37 2dr3 s GLY 190 Ca -0.10 -1.31 -0.03 0.00 0.00 0.00 0.00 44.72 43.29 2dr3 s GLY 190 CO 0.85 -1.36 0.13 -0.42 0.00 0.00 0.00 173.10 172.29 2dr3 s ILE 191 N -3.88 -0.15 -0.16 0.90 1.01 0.35 -1.05 121.20 118.23 2dr3 s ILE 191 Ca 0.12 0.30 0.01 0.00 0.00 0.00 0.00 60.65 61.08 2dr3 s ILE 191 Cb 0.07 -0.23 0.02 0.00 0.01 0.00 0.00 42.46 42.33 2dr3 s ILE 191 CO -0.06 0.12 -0.16 -0.63 0.00 0.00 0.00 174.94 174.22 2dr3 s ILE 192 N 1.79 1.71 -0.18 2.92 1.01 -0.26 -1.44 121.20 126.76 2dr3 s ILE 192 Ca -0.02 -0.72 -0.08 0.00 0.00 0.00 0.00 60.65 59.83 2dr3 s ILE 192 Cb -0.12 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.72 2dr3 s ILE 192 CO -0.05 0.48 0.10 -0.13 0.00 0.00 0.00 174.94 175.34 2dr3 s ARG 193 N 1.42 3.95 -0.14 2.79 0.52 -0.73 -1.13 118.95 125.63 2dr3 s ARG 193 Ca 0.05 -0.27 -0.02 0.00 -0.52 0.00 0.00 55.73 54.96 2dr3 s ARG 193 Cb -0.13 -3.27 -0.03 0.00 0.52 0.00 0.00 34.95 32.04 2dr3 s ARG 193 CO -0.11 0.36 -0.06 -0.51 0.02 0.00 0.00 175.30 175.00 2dr3 s LEU 194 N 0.14 3.13 0.18 2.53 1.43 0.01 -2.19 118.68 123.91 2dr3 s LEU 194 Ca 0.07 -0.15 0.07 0.00 -1.03 0.00 0.00 54.13 53.09 2dr3 s LEU 194 Cb -0.12 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2dr3 s LEU 194 CO -0.00 0.20 -0.15 -1.81 0.23 0.00 0.00 176.35 174.82 2dr3 s ASP 195 N 0.20 2.45 -0.20 2.29 -0.00 0.41 -4.27 116.67 117.53 2dr3 s ASP 195 Ca -0.03 -0.97 -0.04 0.00 -0.00 0.00 0.00 52.55 51.51 2dr3 s ASP 195 Cb -0.14 -0.12 0.07 0.00 -0.00 0.00 0.00 42.92 42.73 2dr3 s ASP 195 CO 0.03 -0.16 0.09 -0.22 -0.00 0.00 0.00 175.17 174.91 2dr3 s LEU 196 N -3.09 0.61 0.04 1.23 2.96 -1.26 -1.81 118.68 117.36 2dr3 s LEU 196 Ca 0.19 -0.82 0.08 0.00 -0.22 0.00 0.00 54.13 53.36 2dr3 s LEU 196 Cb -0.02 -0.35 -0.03 0.00 0.50 0.00 0.00 46.19 46.29 2dr3 s LEU 196 CO 0.06 -0.36 -0.24 -1.81 -1.32 0.00 0.00 176.35 172.68 2dr3 s ASP 197 N 2.06 2.86 -0.31 3.68 1.01 -0.32 -4.90 116.67 120.75 2dr3 s ASP 197 Ca 0.03 -0.55 -0.18 0.00 0.71 0.00 0.00 52.55 52.56 2dr3 s ASP 197 Cb -0.16 -0.25 -0.02 0.00 1.01 0.00 0.00 42.92 43.50 2dr3 s ASP 197 CO -0.15 0.22 0.52 -0.70 0.21 0.00 0.00 175.17 175.27 2dr3 s GLU 198 N -1.17 3.85 -0.14 8.23 2.12 -1.26 0.42 118.70 130.74 2dr3 s GLU 198 Ca 0.10 0.09 -0.00 0.00 0.36 0.00 0.00 54.97 55.51 2dr3 s GLU 198 Cb -0.09 -3.73 0.03 0.00 0.26 0.00 0.00 34.13 30.60 2dr3 s GLU 198 CO 0.02 -0.50 -0.08 0.42 -0.54 0.00 0.00 175.26 174.58 2dr3 s ILE 199 N 2.37 1.14 -1.25 -3.70 1.09 0.20 -4.85 121.20 116.21 2dr3 s ILE 199 Ca 0.20 -0.47 -0.08 0.00 -1.10 0.00 0.00 60.65 59.20 2dr3 s ILE 199 Cb -0.15 -1.20 -0.01 0.00 -1.06 0.00 0.00 42.46 40.03 2dr3 s ILE 199 CO 0.11 0.29 0.68 0.47 -0.10 0.00 0.00 174.94 176.40 2dr3 n ASP 200 N 4.89 -2.76 -0.32 3.58 8.00 -1.26 -1.61 116.55 127.06 2dr3 n ASP 200 Ca -0.13 -0.92 -0.04 0.00 0.71 0.00 0.00 54.79 54.41 2dr3 n ASP 200 Cb 0.49 -3.67 -0.02 0.00 -0.02 0.00 0.00 41.12 37.90 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 -1.68 0.62 3.01 0.44 0.00 -1.26 -5.00 105.19 101.31 2dr3 n GLY 201 Ca -0.22 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.77 1.41 -0.17 1.61 2.56 -0.63 -5.12 118.70 116.58 2dr3 s GLU 202 Ca 0.00 -0.36 -0.22 0.00 0.00 0.00 0.00 54.97 54.39 2dr3 s GLU 202 Cb 0.00 -1.22 -0.02 0.00 2.00 0.00 0.00 34.13 34.89 2dr3 s GLU 202 CO 0.00 0.04 0.68 -0.51 -0.56 0.00 0.00 175.26 174.91 2dr3 s LEU 203 N 0.56 4.17 -0.07 2.70 1.43 -1.26 0.62 118.68 126.84 2dr3 s LEU 203 Ca -0.11 0.95 0.05 0.00 -1.03 0.00 0.00 54.13 53.99 2dr3 s LEU 203 Cb -0.14 -2.99 -0.01 0.00 0.03 0.00 0.00 46.19 43.09 2dr3 s LEU 203 CO 0.02 -0.28 -0.24 -0.54 0.23 0.00 0.00 176.35 175.55 2dr3 s LYS 204 N 1.81 2.56 -0.07 1.70 1.02 0.17 -4.91 119.74 122.02 2dr3 s LYS 204 Ca 0.32 -0.85 -0.13 0.00 0.02 0.00 0.00 55.97 55.32 2dr3 s LYS 204 Cb -0.16 -2.11 -0.05 0.00 -0.52 0.00 0.00 37.83 34.99 2dr3 s LYS 204 CO 0.12 0.31 0.33 1.03 -0.92 0.00 0.00 175.35 176.21 2dr3 s ARG 205 N 0.00 3.91 0.02 1.68 0.52 -1.26 -1.18 118.95 122.65 2dr3 s ARG 205 Ca -0.08 0.23 -0.10 0.00 -0.52 0.00 0.00 55.73 55.26 2dr3 s ARG 205 Cb -0.15 -3.27 0.01 0.00 0.52 0.00 0.00 34.95 32.06 2dr3 s ARG 205 CO 0.05 0.58 0.20 -1.54 0.02 0.00 0.00 175.30 174.60 2dr3 s SER 206 N -0.63 -0.00 0.04 0.23 1.04 -0.75 -2.38 113.70 111.25 2dr3 s SER 206 Ca 0.20 -0.25 0.06 0.00 0.48 0.00 0.00 55.95 56.45 2dr3 s SER 206 Cb -0.15 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.22 2dr3 s SER 206 CO 0.09 -0.49 -0.18 -0.22 0.98 0.00 0.00 173.24 173.42 2dr3 s LEU 207 N -1.76 2.15 -0.10 2.42 0.20 0.11 -0.45 118.68 121.25 2dr3 s LEU 207 Ca -0.09 -0.48 -0.08 0.00 0.69 0.00 0.00 54.13 54.17 2dr3 s LEU 207 Cb -0.04 -0.84 0.03 0.00 -0.43 0.00 0.00 46.19 44.92 2dr3 s LEU 207 CO -0.01 0.12 0.27 -0.51 -0.29 0.00 0.00 176.35 175.93 2dr3 s ILE 208 N -0.77 -0.01 -0.61 6.68 2.07 -0.93 -0.30 121.20 127.32 2dr3 s ILE 208 Ca 0.05 0.05 -0.20 0.00 -1.41 0.00 0.00 60.65 59.14 2dr3 s ILE 208 Cb -0.08 -0.39 0.09 0.00 0.13 0.00 0.00 42.46 42.21 2dr3 s ILE 208 CO 0.01 0.02 0.79 -0.69 -1.91 0.00 0.00 174.94 173.17 2dr3 s VAL 209 N 0.55 4.65 0.18 4.00 1.01 -1.26 -1.78 120.40 127.76 2dr3 s VAL 209 Ca -0.03 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.22 2dr3 s VAL 209 Cb -0.05 -4.56 -0.13 0.00 0.00 0.00 0.00 36.38 31.65 2dr3 s VAL 209 CO -0.03 -1.24 1.42 -0.25 0.00 0.00 0.00 175.10 175.00 2dr3 h TRP 210 N 9.32 0.14 -1.97 5.22 2.91 -1.60 -3.46 115.95 126.52 2dr3 h TRP 210 Ca -0.29 -0.08 -0.04 0.00 1.13 0.00 0.00 58.89 59.62 2dr3 h TRP 210 Cb 1.08 -0.02 -0.21 0.00 -0.51 0.00 0.00 29.16 29.51 2dr3 h TRP 210 CO 0.88 0.88 0.17 0.21 -1.03 0.00 0.00 178.44 179.55 2dr3 s LYS 211 N -3.20 0.85 -0.30 2.65 2.20 -1.05 -4.93 119.74 115.97 2dr3 s LYS 211 Ca -0.01 0.84 0.05 0.00 -0.36 0.00 0.00 55.97 56.48 2dr3 s LYS 211 Cb 0.11 0.41 0.19 0.00 -1.51 0.00 0.00 37.83 37.03 2dr3 s LYS 211 CO 0.81 -0.14 0.53 1.41 -0.36 0.00 0.00 175.35 177.61 2dr3 s MET 212 N 0.08 0.53 0.36 4.03 1.75 -1.25 0.13 119.30 124.93 2dr3 s MET 212 Ca -0.02 0.37 -0.28 0.00 -1.25 0.00 0.00 55.69 54.51 2dr3 s MET 212 Cb -0.04 0.06 -0.10 0.00 2.84 0.00 0.00 34.83 37.60 2dr3 s MET 212 CO 0.02 -1.06 1.28 0.50 -0.65 0.00 0.00 175.02 175.12 2dr3 s ARG 213 N 2.68 4.23 0.00 4.11 3.52 0.32 -3.35 118.95 130.45 2dr3 s ARG 213 Ca 0.10 2.15 0.00 0.00 -0.13 0.00 0.00 55.73 57.85 2dr3 s ARG 213 Cb -0.10 -2.95 0.00 0.00 -1.56 0.00 0.00 34.95 30.34 2dr3 s ARG 213 CO -0.26 -0.27 0.00 0.41 -0.81 0.00 0.00 175.30 174.37 2dr3 n GLY 214 N 0.76 0.72 3.59 8.12 0.00 -1.26 -4.73 105.19 112.39 2dr3 n GLY 214 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.46 0.00 0.67 2.61 -1.32 -1.21 -4.94 115.64 108.98 2dr3 s THR 215 Ca 0.00 -0.18 -0.05 0.00 -1.21 0.00 0.00 61.69 60.24 2dr3 s THR 215 Cb 0.00 -1.34 0.05 0.00 -1.51 0.00 0.00 72.50 69.69 2dr3 s THR 215 CO 0.00 0.00 0.97 -0.94 -2.21 0.00 0.00 174.62 172.44 2dr3 s SER 216 N -2.59 5.00 0.00 8.08 1.04 -1.26 -4.79 113.70 119.18 2dr3 s SER 216 Ca 0.08 0.44 -0.29 0.00 0.48 0.00 0.00 55.95 56.66 2dr3 s SER 216 Cb -0.00 -1.17 0.10 0.00 0.10 0.00 0.00 66.02 65.05 2dr3 s SER 216 CO -0.05 -1.45 1.07 -1.38 0.98 0.00 0.00 173.24 172.41 2dr3 s HIS 217 N -3.14 -0.16 0.25 5.02 -3.43 -1.26 -4.47 115.29 108.10 2dr3 s HIS 217 Ca 0.59 0.00 -0.31 0.00 -0.80 0.00 0.00 55.06 54.54 2dr3 s HIS 217 Cb -0.11 0.57 -0.13 0.00 -1.43 0.00 0.00 32.58 31.48 2dr3 s HIS 217 CO 0.44 -0.49 1.42 0.45 -2.00 0.00 0.00 174.74 174.56 2dr3 n SER 218 N -0.34 2.90 -1.56 7.38 2.88 0.29 -4.86 113.62 120.31 2dr3 n SER 218 Ca -0.06 1.15 0.06 0.00 -1.33 0.00 0.00 58.87 58.69 2dr3 n SER 218 Cb 0.61 -1.45 0.35 0.00 -0.75 0.00 0.00 64.21 62.96 2dr3 n SER 218 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2dr3 n MET 219 N 1.96 4.08 -4.26 -1.46 0.00 -1.26 -4.47 117.12 111.70 2dr3 n MET 219 Ca 0.11 -3.06 -0.24 0.00 0.00 0.00 0.00 57.70 54.51 2dr3 n MET 219 Cb 0.32 -2.12 -0.07 0.00 0.00 0.00 0.00 33.22 31.35 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 -2.83 2.34 -0.26 0.03 1.81 -1.26 -5.03 118.95 113.75 2dr3 s ARG 220 Ca 0.51 -1.31 -0.18 0.00 -1.72 0.00 0.00 55.73 53.02 2dr3 s ARG 220 Cb 0.40 -2.23 -0.03 0.00 -0.45 0.00 0.00 34.95 32.64 2dr3 s ARG 220 CO 0.13 0.39 0.50 0.50 -0.68 0.00 0.00 175.30 176.15 2dr3 s ARG 221 N -3.46 4.06 -0.10 3.54 3.52 -1.26 -4.49 118.95 120.76 2dr3 s ARG 221 Ca 0.30 0.30 -0.02 0.00 -0.13 0.00 0.00 55.73 56.18 2dr3 s ARG 221 Cb -0.07 -3.65 -0.03 0.00 -1.56 0.00 0.00 34.95 29.63 2dr3 s ARG 221 CO 0.20 -0.35 -0.02 -1.01 -0.81 0.00 0.00 175.30 173.31 2dr3 s HIS 222 N 2.29 3.08 0.67 5.12 3.76 0.59 -0.32 115.29 130.48 2dr3 s HIS 222 Ca 0.21 0.04 -0.11 0.00 -0.15 0.00 0.00 55.06 55.05 2dr3 s HIS 222 Cb -0.16 -1.82 -0.01 0.00 1.11 0.00 0.00 32.58 31.71 2dr3 s HIS 222 CO 0.09 0.31 1.05 -1.25 -0.85 0.00 0.00 174.74 174.10 2dr3 s PRO 223 N -0.55 3.15 0.17 8.40 0.04 -1.26 0.05 135.00 145.01 2dr3 s PRO 223 Ca 0.09 0.81 -0.15 0.00 0.04 0.00 0.00 61.00 61.79 2dr3 s PRO 223 Cb -0.12 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.42 2dr3 s PRO 223 CO 0.02 -0.91 0.43 -0.59 0.04 0.00 0.00 177.00 176.00 2dr3 s PHE 224 N -3.13 0.00 0.14 0.56 -0.71 -1.00 -2.05 117.98 111.79 2dr3 s PHE 224 Ca 0.57 -0.35 0.07 0.00 -1.04 0.00 0.00 56.93 56.18 2dr3 s PHE 224 Cb -0.13 0.24 -0.04 0.00 -1.21 0.00 0.00 43.02 41.89 2dr3 s PHE 224 CO 0.54 -0.82 -0.17 -0.51 -1.34 0.00 0.00 175.22 172.92 2dr3 s ASP 225 N -2.88 2.41 -0.17 1.98 1.01 0.16 -4.44 116.67 114.73 2dr3 s ASP 225 Ca 0.10 -0.82 -0.03 0.00 0.71 0.00 0.00 52.55 52.50 2dr3 s ASP 225 Cb 0.01 -0.12 -0.02 0.00 1.01 0.00 0.00 42.92 43.79 2dr3 s ASP 225 CO -0.04 -0.06 -0.05 -0.63 0.21 0.00 0.00 175.17 174.60 2dr3 s ILE 226 N -1.98 3.63 0.00 0.77 1.01 -1.26 -1.04 121.20 122.34 2dr3 s ILE 226 Ca 0.12 -0.44 0.00 0.00 0.00 0.00 0.00 60.65 60.33 2dr3 s ILE 226 Cb -0.06 -2.60 0.00 0.00 0.01 0.00 0.00 42.46 39.81 2dr3 s ILE 226 CO 0.05 0.47 0.00 0.35 0.00 0.00 0.00 174.94 175.81 2dr3 n THR 227 N 3.92 0.00 0.44 2.92 -2.24 0.21 -4.98 114.28 114.55 2dr3 n THR 227 Ca -0.18 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.74 2dr3 n THR 227 Cb 0.52 0.00 0.42 0.00 -2.10 0.00 0.00 70.33 69.17 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 -0.28 3.42 3.32 -1.97 -2.96 116.42 117.95 2dr3 h ASP 228 Ca 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 2dr3 h ASP 228 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2dr3 h ASP 228 CO 0.00 0.00 -0.00 0.29 -1.72 0.00 0.00 179.24 177.81 2dr3 n LYS 229 N -2.54 2.67 0.00 3.56 5.02 -1.26 -4.59 118.16 121.02 2dr3 n LYS 229 Ca 0.04 -2.89 0.00 0.00 -2.02 0.00 0.00 58.31 53.43 2dr3 n LYS 229 Cb 0.38 -1.84 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 2dr3 n LYS 229 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dr3 n GLY 230 N -0.66 -0.83 3.86 0.72 0.00 -1.12 -5.01 105.19 102.16 2dr3 n GLY 230 Ca 0.24 -2.01 -0.35 0.00 0.00 0.00 0.00 46.02 43.90 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 5.05 -0.12 -0.61 1.01 -1.26 0.68 121.20 125.95 2dr3 s ILE 231 Ca 0.00 0.52 -0.02 0.00 0.00 0.00 0.00 60.65 61.15 2dr3 s ILE 231 Cb 0.00 -3.66 0.04 0.00 0.01 0.00 0.00 42.46 38.85 2dr3 s ILE 231 CO 0.00 0.28 0.02 -0.63 0.00 0.00 0.00 174.94 174.61 2dr3 s ILE 232 N -1.41 0.36 -0.05 2.92 1.01 -0.20 -4.23 121.20 119.60 2dr3 s ILE 232 Ca 0.34 -0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.84 2dr3 s ILE 232 Cb -0.14 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.61 2dr3 s ILE 232 CO 0.18 0.06 0.15 -0.69 0.00 0.00 0.00 174.94 174.64 2dr3 s VAL 233 N 1.96 5.32 -0.46 2.92 1.01 -0.51 -0.66 120.40 129.97 2dr3 s VAL 233 Ca 0.03 -0.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.89 2dr3 s VAL 233 Cb -0.14 -3.41 0.12 0.00 0.00 0.00 0.00 36.38 32.95 2dr3 s VAL 233 CO -0.06 0.44 0.28 -0.31 0.00 0.00 0.00 175.10 175.44 2dr3 s TYR 234 N -1.19 3.53 0.55 5.22 1.51 -0.87 -3.99 117.35 122.11 2dr3 s TYR 234 Ca 0.22 -2.36 0.38 0.00 -1.01 0.00 0.00 57.07 54.30 2dr3 s TYR 234 Cb -0.12 -3.28 2.07 0.00 -0.11 0.00 0.00 41.96 40.51 2dr3 s TYR 234 CO 0.12 -0.95 2.27 -1.35 -1.11 0.00 0.00 175.55 174.53 2dr3 h PRO 235 N 7.94 0.00 -0.01 -1.71 0.11 -1.88 -2.20 132.00 134.25 2dr3 h PRO 235 Ca -0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.99 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 0.73 0.02 -0.17 -0.25 -0.21 0.00 0.00 178.00 178.12 2dr3 n ASP 236 N -3.31 1.21 -4.58 -2.05 10.43 -1.26 -4.88 116.55 112.11 2dr3 n ASP 236 Ca -0.02 -1.11 -0.29 0.00 2.57 0.00 0.00 54.79 55.93 2dr3 n ASP 236 Cb 0.12 0.09 -0.10 0.00 1.84 0.00 0.00 41.12 43.07 2dr3 n ASP 236 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2dr3 s LYS 237 N -2.32 2.13 0.01 -1.24 1.02 -0.83 -4.75 119.74 113.76 2dr3 s LYS 237 Ca 0.29 -1.06 -0.04 0.00 0.02 0.00 0.00 55.97 55.18 2dr3 s LYS 237 Cb 0.20 -2.29 -0.01 0.00 -0.52 0.00 0.00 37.83 35.21 2dr3 s LYS 237 CO 0.45 0.49 0.06 0.08 -0.92 0.00 0.00 175.35 175.51 2dr3 s VAL 238 N -1.31 0.09 -0.61 3.17 1.01 -0.76 -4.36 120.40 117.63 2dr3 s VAL 238 Ca 0.22 -0.77 -0.17 0.00 0.00 0.00 0.00 61.98 61.27 2dr3 s VAL 238 Cb -0.11 -0.34 0.14 0.00 0.00 0.00 0.00 36.38 36.07 2dr3 s VAL 238 CO 0.14 -0.42 0.62 -0.76 0.00 0.00 0.00 175.10 174.68 2dr3 s LEU 239 N -1.37 6.02 -0.05 3.92 1.43 0.56 -1.73 118.68 127.46 2dr3 s LEU 239 Ca -0.15 -1.84 -0.24 0.00 -1.03 0.00 0.00 54.13 50.86 2dr3 s LEU 239 Cb -0.08 -2.24 -0.23 0.00 0.03 0.00 0.00 46.19 43.66 2dr3 s LEU 239 CO 0.00 -0.89 1.05 0.11 0.23 0.00 0.00 176.35 176.85 2dr3 h LYS 240 N 8.80 0.16 0.00 1.70 1.57 -1.94 -3.44 116.57 123.42 2dr3 h LYS 240 Ca -0.22 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 2dr3 h LYS 240 Cb 1.08 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.44 2dr3 h LYS 240 CO 1.01 0.88 0.00 -2.13 -0.57 0.00 0.00 179.45 178.65 2dr3 n ARG 241 N -4.54 0.00 -4.19 3.15 3.00 -1.26 -5.12 116.66 107.71 2dr3 n ARG 241 Ca -0.09 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.48 2dr3 n ARG 241 Cb 0.48 -0.06 -0.04 0.00 0.00 0.00 0.00 32.46 32.84 2dr3 n ARG 241 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2dr3 s GLY 242 N -1.15 2.54 -0.40 5.14 0.00 -1.26 -5.00 107.32 107.18 2dr3 s GLY 242 Ca 0.00 -1.26 -0.28 0.00 0.00 0.00 0.00 44.72 43.17 2dr3 s GLY 242 CO 0.00 -2.00 1.59 0.54 0.00 0.00 0.00 173.10 173.23 2dr3 s LYS 243 N -4.07 3.40 0.43 2.90 1.02 -1.26 -4.42 119.74 117.75 2dr3 s LYS 243 Ca 0.28 1.07 0.04 0.00 0.02 0.00 0.00 55.97 57.39 2dr3 s LYS 243 Cb 0.01 -4.12 -0.05 0.00 -0.52 0.00 0.00 37.83 33.14 2dr3 s LYS 243 CO 0.17 -1.78 0.03 0.14 -0.92 0.00 0.00 175.35 172.98 2dr3 s VAL 244 N 6.28 1.46 -2.36 3.17 -7.23 -0.71 -4.99 120.40 116.02 2dr3 s VAL 244 Ca 0.68 -2.00 0.29 0.00 -1.81 0.00 0.00 61.98 59.14 2dr3 s VAL 244 Cb -0.17 -2.63 0.65 0.00 0.56 0.00 0.00 36.38 34.79 2dr3 s VAL 244 CO 0.32 0.00 1.88 0.00 -0.31 0.00 0.00 175.10 176.99