#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p6o s GLU 2 N 0.00 4.21 -0.04 2.12 2.12 -1.26 -1.10 118.70 124.75 2p6o s GLU 2 Ca 0.00 2.09 0.03 0.00 0.36 0.00 0.00 54.97 57.45 2p6o s GLU 2 Cb 0.00 -3.83 0.00 0.00 0.26 0.00 0.00 34.13 30.56 2p6o s GLU 2 CO 0.00 -0.76 -0.12 -0.51 -0.54 0.00 0.00 175.26 173.32 2p6o s LEU 3 N 3.49 1.81 -0.27 2.70 1.43 -0.04 -2.14 118.68 125.66 2p6o s LEU 3 Ca 0.69 -0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 53.46 2p6o s LEU 3 Cb -0.32 -0.74 -0.01 0.00 0.03 0.00 0.00 46.19 45.15 2p6o s LEU 3 CO 0.27 0.09 0.07 0.26 0.23 0.00 0.00 176.35 177.28 2p6o s TRP 4 N 0.20 3.10 -0.40 0.29 0.52 -0.15 -0.46 118.94 122.03 2p6o s TRP 4 Ca -0.05 -0.66 -0.16 0.00 0.02 0.00 0.00 56.10 55.25 2p6o s TRP 4 Cb -0.11 -2.25 0.01 0.00 -1.15 0.00 0.00 33.47 29.98 2p6o s TRP 4 CO 0.01 -0.45 0.39 -0.51 0.02 0.00 0.00 176.95 176.41 2p6o s LEU 5 N 1.57 4.85 -0.19 2.99 2.01 0.48 0.09 118.68 130.46 2p6o s LEU 5 Ca 0.05 -0.65 -0.05 0.00 0.01 0.00 0.00 54.13 53.48 2p6o s LEU 5 Cb -0.16 -2.32 -0.03 0.00 0.01 0.00 0.00 46.19 43.70 2p6o s LEU 5 CO 0.03 -0.50 0.01 -0.69 1.01 0.00 0.00 176.35 176.21 2p6o s VAL 6 N 1.99 4.15 -0.11 -1.59 1.01 0.27 -1.35 120.40 124.78 2p6o s VAL 6 Ca 0.10 -0.25 -0.21 0.00 0.00 0.00 0.00 61.98 61.62 2p6o s VAL 6 Cb -0.17 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 2p6o s VAL 6 CO 0.12 0.44 0.61 -0.60 0.00 0.00 0.00 175.10 175.67 2p6o s ARG 7 N 0.82 4.36 0.88 2.72 3.52 -0.41 -0.36 118.95 130.48 2p6o s ARG 7 Ca 0.01 0.68 -0.13 0.00 -0.13 0.00 0.00 55.73 56.16 2p6o s ARG 7 Cb -0.14 -3.47 0.06 0.00 -1.56 0.00 0.00 34.95 29.84 2p6o s ARG 7 CO 0.02 0.04 0.74 -2.39 -0.81 0.00 0.00 175.30 172.90 2p6o n HIS 8 N 3.98 -0.33 -0.65 5.12 1.44 -0.70 -1.07 115.22 123.02 2p6o n HIS 8 Ca -0.03 0.32 -0.29 0.00 -2.01 0.00 0.00 57.72 55.71 2p6o n HIS 8 Cb 0.51 -1.91 0.23 0.00 0.12 0.00 0.00 29.99 28.94 2p6o n HIS 8 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 2p6o s GLY 9 N -2.07 1.56 0.50 -1.39 0.00 -1.26 -1.79 107.32 102.87 2p6o s GLY 9 Ca 0.64 -0.07 -0.22 0.00 0.00 0.00 0.00 44.72 45.06 2p6o s GLY 9 CO 0.61 0.60 1.19 -1.83 0.00 0.00 0.00 173.10 173.67 2p6o s GLU 10 N -4.55 3.52 0.47 2.90 -1.05 -1.26 -4.74 118.70 113.99 2p6o s GLU 10 Ca 0.68 1.83 0.03 0.00 -0.15 0.00 0.00 54.97 57.35 2p6o s GLU 10 Cb -0.24 -2.27 -0.03 0.00 -0.44 0.00 0.00 34.13 31.15 2p6o s GLU 10 CO 0.63 -0.76 0.02 0.95 0.95 0.00 0.00 175.26 177.04 2p6o s THR 11 N -1.55 1.28 0.43 1.83 -4.23 -1.26 -1.65 115.64 110.49 2p6o s THR 11 Ca 0.68 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.33 2p6o s THR 11 Cb -0.30 -2.38 0.16 0.00 1.34 0.00 0.00 72.50 71.32 2p6o s THR 11 CO 0.35 0.00 1.95 0.24 -0.54 0.00 0.00 174.62 176.62 2p6o h MET 12 N 1.52 0.00 0.00 3.99 0.00 -1.94 -2.39 114.93 116.11 2p6o h MET 12 Ca -0.43 -0.00 -0.06 0.00 0.00 0.00 0.00 59.70 59.21 2p6o h MET 12 Cb 1.29 -0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.88 2p6o h MET 12 CO 0.74 0.23 -0.27 -1.49 0.00 0.00 0.00 176.91 176.11 2p6o h TRP 13 N 0.00 0.00 -0.28 -0.22 4.06 -1.95 0.02 115.95 117.58 2p6o h TRP 13 Ca -0.00 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.88 2p6o h TRP 13 Cb 0.40 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.55 2p6o h TRP 13 CO 0.00 0.27 -0.10 -0.91 -3.56 0.00 0.00 178.44 174.14 2p6o h ASN 14 N 0.00 0.57 1.46 -3.49 4.21 -1.70 0.22 115.58 116.86 2p6o h ASN 14 Ca -0.00 -0.39 -0.03 0.00 1.21 0.00 0.00 56.30 57.09 2p6o h ASN 14 Cb 0.99 -0.16 -0.00 0.00 -1.12 0.00 0.00 38.32 38.03 2p6o h ASN 14 CO 0.04 0.83 -0.13 0.08 -1.29 0.00 0.00 177.43 176.96 2p6o h ARG 15 N 0.31 0.00 0.00 0.81 0.11 -1.35 -3.07 114.38 111.19 2p6o h ARG 15 Ca 0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.15 2p6o h ARG 15 Cb 0.59 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.67 2p6o h ARG 15 CO 0.03 0.13 -0.64 0.39 0.10 0.00 0.00 179.97 179.98 2p6o n GLU 16 N -3.18 0.09 -2.75 0.08 1.02 -0.03 -4.98 120.64 110.90 2p6o n GLU 16 Ca 0.02 0.01 -0.08 0.00 -0.02 0.00 0.00 57.16 57.09 2p6o n GLU 16 Cb 0.49 -1.54 0.03 0.00 -0.02 0.00 0.00 31.44 30.40 2p6o n GLU 16 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2p6o n GLY 17 N 1.45 0.25 3.49 0.62 0.00 -0.07 -4.90 105.19 106.04 2p6o n GLY 17 Ca 0.04 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 2p6o n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2p6o s ARG 18 N -5.03 2.28 0.13 1.61 0.52 -0.38 -1.23 118.95 116.85 2p6o s ARG 18 Ca 0.12 -0.86 -0.31 0.00 -0.52 0.00 0.00 55.73 54.16 2p6o s ARG 18 Cb -0.05 -2.30 -0.10 0.00 0.52 0.00 0.00 34.95 33.01 2p6o s ARG 18 CO 0.28 0.57 1.78 -0.51 0.02 0.00 0.00 175.30 177.44 2p6o s LEU 19 N -1.28 4.39 -0.26 2.53 1.43 0.09 -4.66 118.68 120.92 2p6o s LEU 19 Ca 0.15 2.73 0.01 0.00 -1.03 0.00 0.00 54.13 55.99 2p6o s LEU 19 Cb -0.11 -3.57 0.07 0.00 0.03 0.00 0.00 46.19 42.61 2p6o s LEU 19 CO 0.05 -0.98 -0.02 -0.22 0.23 0.00 0.00 176.35 175.41 2p6o s LEU 20 N 2.40 2.90 0.00 1.79 2.96 -1.26 -0.32 118.68 127.15 2p6o s LEU 20 Ca 0.78 -1.38 0.00 0.00 -0.22 0.00 0.00 54.13 53.31 2p6o s LEU 20 Cb -0.46 -1.23 0.00 0.00 0.50 0.00 0.00 46.19 45.00 2p6o s LEU 20 CO 0.35 -0.27 0.00 0.61 -1.32 0.00 0.00 176.35 175.71 2p6o n GLY 21 N 4.62 0.75 0.53 7.98 0.00 -1.26 -4.89 105.19 112.92 2p6o n GLY 21 Ca -0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.07 2p6o n GLY 21 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2p6o n TRP 22 N 0.00 0.00 -2.14 1.61 7.02 -1.26 -4.58 117.44 118.09 2p6o n TRP 22 Ca 0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.06 2p6o n TRP 22 Cb 0.00 -0.01 -0.03 0.00 -2.42 0.00 0.00 31.31 28.85 2p6o n TRP 22 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2p6o s THR 23 N -2.07 3.81 -1.53 -0.99 2.01 -1.26 -4.89 115.64 110.72 2p6o s THR 23 Ca 0.34 0.98 -0.11 0.00 0.31 0.00 0.00 61.69 63.21 2p6o s THR 23 Cb 0.21 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 69.06 2p6o s THR 23 CO 0.36 -0.09 2.62 -0.67 -0.69 0.00 0.00 174.62 176.14 2p6o n ASP 24 N 7.01 6.95 -4.79 3.53 2.03 -1.26 -4.98 116.55 125.04 2p6o n ASP 24 Ca 0.16 -2.74 -0.35 0.00 0.52 0.00 0.00 54.79 52.38 2p6o n ASP 24 Cb 0.43 -1.57 -0.02 0.00 -0.72 0.00 0.00 41.12 39.24 2p6o n ASP 24 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2p6o s LEU 25 N 0.56 3.86 0.61 -2.67 1.43 -1.26 -4.84 118.68 116.37 2p6o s LEU 25 Ca 0.59 2.04 -0.05 0.00 -1.03 0.00 0.00 54.13 55.68 2p6o s LEU 25 Cb 0.16 -4.50 0.03 0.00 0.03 0.00 0.00 46.19 41.91 2p6o s LEU 25 CO -0.07 -0.88 0.90 -2.16 0.23 0.00 0.00 176.35 174.37 2p6o s PRO 26 N -3.13 2.67 0.60 1.29 0.04 -1.26 -3.60 135.00 131.61 2p6o s PRO 26 Ca 0.67 -0.21 -0.14 0.00 0.04 0.00 0.00 61.00 61.36 2p6o s PRO 26 Cb -0.20 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 2p6o s PRO 26 CO 0.24 -0.82 1.03 -0.51 0.04 0.00 0.00 177.00 176.98 2p6o s LEU 27 N -5.00 3.42 0.81 -3.56 1.43 -1.26 -4.51 118.68 110.01 2p6o s LEU 27 Ca 0.56 1.66 -0.08 0.00 -1.03 0.00 0.00 54.13 55.23 2p6o s LEU 27 Cb -0.11 -4.51 0.14 0.00 0.03 0.00 0.00 46.19 41.74 2p6o s LEU 27 CO 0.44 -1.03 1.12 0.42 0.23 0.00 0.00 176.35 177.53 2p6o s THR 28 N -2.72 2.12 0.28 5.49 -4.23 -0.66 -4.86 115.64 111.07 2p6o s THR 28 Ca 0.60 -0.29 -0.03 0.00 -1.18 0.00 0.00 61.69 60.80 2p6o s THR 28 Cb -0.13 -2.83 0.20 0.00 1.34 0.00 0.00 72.50 71.07 2p6o s THR 28 CO 0.41 0.00 1.87 0.00 -0.54 0.00 0.00 174.62 176.37 2p6o h ALA 29 N -0.96 1.26 -0.41 3.99 0.00 -1.97 -1.24 119.26 119.92 2p6o h ALA 29 Ca -0.41 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.23 2p6o h ALA 29 Cb 1.27 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2p6o h ALA 29 CO 0.45 0.56 -0.21 1.49 0.00 0.00 0.00 179.25 181.54 2p6o h GLU 30 N 0.98 0.82 -0.82 0.00 4.57 -1.93 -1.43 114.58 116.78 2p6o h GLU 30 Ca 0.24 -0.33 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2p6o h GLU 30 Cb 0.12 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.63 2p6o h GLU 30 CO -0.03 0.96 0.49 0.78 -1.18 0.00 0.00 179.01 180.03 2p6o h GLY 31 N 0.95 1.18 1.24 1.92 0.00 -1.50 0.14 103.07 107.00 2p6o h GLY 31 Ca 0.10 -0.49 -0.12 0.00 0.00 0.00 0.00 47.33 46.82 2p6o h GLY 31 CO 0.06 0.47 -0.23 0.83 0.00 0.00 0.00 176.54 177.67 2p6o h GLU 32 N 1.13 0.87 -0.71 4.80 5.08 -0.88 -1.48 114.58 123.39 2p6o h GLU 32 Ca 0.29 -0.37 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2p6o h GLU 32 Cb -0.05 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 2p6o h GLU 32 CO -0.06 1.01 0.23 0.00 -1.00 0.00 0.00 179.01 179.19 2p6o h ALA 33 N 0.98 0.93 -0.67 3.43 0.00 -0.30 -1.13 119.26 122.49 2p6o h ALA 33 Ca 0.10 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2p6o h ALA 33 Cb 0.78 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2p6o h ALA 33 CO 0.06 0.60 0.34 1.96 0.00 0.00 0.00 179.25 182.22 2p6o h GLN 34 N 1.04 0.95 -0.53 0.00 4.20 -0.51 -2.22 115.11 118.03 2p6o h GLN 34 Ca 0.23 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 2p6o h GLN 34 Cb 0.30 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 2p6o h GLN 34 CO -0.01 0.73 0.25 0.00 -0.67 0.00 0.00 178.83 179.13 2p6o h ALA 35 N 1.16 0.68 -0.62 3.87 0.00 -0.79 -2.68 119.26 120.88 2p6o h ALA 35 Ca 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2p6o h ALA 35 Cb 0.08 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2p6o h ALA 35 CO -0.03 0.26 0.32 0.00 0.00 0.00 0.00 179.25 179.79 2p6o h ARG 36 N 0.71 0.87 0.00 0.00 3.08 -0.96 -2.11 114.38 115.97 2p6o h ARG 36 Ca 0.18 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 2p6o h ARG 36 Cb 0.14 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2p6o h ARG 36 CO -0.02 0.66 -0.18 0.00 -1.07 0.00 0.00 179.97 179.36 2p6o h ARG 37 N 0.87 0.00 0.00 0.04 3.08 -1.07 -2.13 114.38 115.17 2p6o h ARG 37 Ca 0.22 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 2p6o h ARG 37 Cb 0.06 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 2p6o h ARG 37 CO -0.03 0.18 -0.09 -0.07 -1.07 0.00 0.00 179.97 178.89 2p6o h LEU 38 N 0.00 0.00 -1.79 3.04 3.38 -1.20 -2.82 115.31 115.92 2p6o h LEU 38 Ca -0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2p6o h LEU 38 Cb 0.32 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2p6o h LEU 38 CO 0.02 0.09 0.22 0.50 0.09 0.00 0.00 178.44 179.36 2p6o h LYS 39 N 0.00 0.26 -0.47 1.13 3.64 -1.44 -0.96 116.57 118.73 2p6o h LYS 39 Ca -0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2p6o h LYS 39 Cb 0.35 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2p6o h LYS 39 CO 0.01 0.17 0.00 0.41 -2.27 0.00 0.00 179.45 177.77 2p6o n GLY 40 N -1.53 1.14 0.40 5.01 0.00 -1.06 -4.41 105.19 104.74 2p6o n GLY 40 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2p6o n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p6o n ALA 41 N 0.60 2.27 -1.86 4.61 0.00 -0.48 -5.08 120.51 120.56 2p6o n ALA 41 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.17 2p6o n ALA 41 Cb 0.42 0.25 -0.03 0.00 0.00 0.00 0.00 19.45 20.09 2p6o n ALA 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2p6o s LEU 42 N -4.41 4.44 0.57 0.00 1.43 -0.53 -5.00 118.68 115.17 2p6o s LEU 42 Ca 0.00 2.52 -0.18 0.00 -1.03 0.00 0.00 54.13 55.45 2p6o s LEU 42 Cb 0.00 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.54 2p6o s LEU 42 CO 0.00 -0.49 1.08 -2.16 0.23 0.00 0.00 176.35 175.01 2p6o s PRO 43 N -1.01 3.36 -1.49 1.29 0.04 -1.26 -4.93 135.00 131.00 2p6o s PRO 43 Ca 0.52 1.38 -0.10 0.00 0.04 0.00 0.00 61.00 62.83 2p6o s PRO 43 Cb -0.38 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.15 2p6o s PRO 43 CO 0.45 -0.80 2.54 -1.13 0.04 0.00 0.00 177.00 178.10 2p6o n SER 44 N -1.65 6.90 -4.99 6.66 3.41 -1.26 -4.93 113.62 117.77 2p6o n SER 44 Ca 0.10 -2.81 -0.19 0.00 -0.26 0.00 0.00 58.87 55.71 2p6o n SER 44 Cb 0.52 -1.54 0.02 0.00 -0.26 0.00 0.00 64.21 62.95 2p6o n SER 44 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2p6o s LEU 45 N 0.25 3.54 0.27 1.04 1.43 -1.26 -5.02 118.68 118.93 2p6o s LEU 45 Ca 0.57 -0.19 -0.30 0.00 -1.03 0.00 0.00 54.13 53.18 2p6o s LEU 45 Cb 0.16 -2.78 -0.13 0.00 0.03 0.00 0.00 46.19 43.46 2p6o s LEU 45 CO -0.07 -0.87 1.33 -2.65 0.23 0.00 0.00 176.35 174.33 2p6o n PRO 46 N -2.03 1.96 -4.46 1.29 -0.02 -1.26 -4.55 135.00 125.94 2p6o n PRO 46 Ca 0.07 0.69 -0.31 0.00 -2.02 0.00 0.00 63.50 61.93 2p6o n PRO 46 Cb 0.59 -2.30 -0.11 0.00 -0.02 0.00 0.00 33.50 31.66 2p6o n PRO 46 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2p6o s ALA 47 N -0.43 2.94 0.08 3.55 0.00 -1.26 -1.02 121.76 125.62 2p6o s ALA 47 Ca 0.64 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 51.54 2p6o s ALA 47 Cb -0.64 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.42 2p6o s ALA 47 CO 0.54 0.61 -0.09 -0.06 0.00 0.00 0.00 175.76 176.77 2p6o s PHE 48 N -1.02 0.91 0.01 0.00 0.40 -0.27 -1.57 117.98 116.43 2p6o s PHE 48 Ca 0.17 -0.68 -0.19 0.00 -0.60 0.00 0.00 56.93 55.63 2p6o s PHE 48 Cb -0.11 -0.51 0.04 0.00 0.51 0.00 0.00 43.02 42.94 2p6o s PHE 48 CO 0.08 -0.07 0.41 0.45 0.70 0.00 0.00 175.22 176.80 2p6o s SER 49 N -2.36 -0.30 0.61 1.36 0.15 -0.26 -0.86 113.70 112.04 2p6o s SER 49 Ca 0.03 0.14 -0.19 0.00 0.70 0.00 0.00 55.95 56.63 2p6o s SER 49 Cb -0.03 0.40 -0.03 0.00 -1.71 0.00 0.00 66.02 64.65 2p6o s SER 49 CO -0.01 -0.57 1.25 -0.55 1.20 0.00 0.00 173.24 174.55 2p6o s SER 50 N -1.62 4.97 0.00 5.45 0.15 -0.49 -1.15 113.70 121.01 2p6o s SER 50 Ca -0.09 2.49 0.30 0.00 0.70 0.00 0.00 55.95 59.35 2p6o s SER 50 Cb -0.02 -2.61 1.54 0.00 -1.71 0.00 0.00 66.02 63.21 2p6o s SER 50 CO 0.02 -1.75 2.04 -0.90 1.20 0.00 0.00 173.24 173.85 2p6o n ASP 51 N -1.68 0.25 -4.77 5.45 5.75 -1.25 -4.03 116.55 116.27 2p6o n ASP 51 Ca 0.14 -0.67 -0.39 0.00 -0.01 0.00 0.00 54.79 53.86 2p6o n ASP 51 Cb 0.49 -0.10 -0.03 0.00 -1.03 0.00 0.00 41.12 40.45 2p6o n ASP 51 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2p6o s LEU 52 N -2.30 4.28 0.23 -2.12 1.43 -1.26 -4.82 118.68 114.12 2p6o s LEU 52 Ca 0.36 2.31 -0.13 0.00 -1.03 0.00 0.00 54.13 55.64 2p6o s LEU 52 Cb 0.21 -3.93 0.29 0.00 0.03 0.00 0.00 46.19 42.80 2p6o s LEU 52 CO 0.42 -0.52 1.59 0.25 0.23 0.00 0.00 176.35 178.33 2p6o h LEU 53 N 2.94 -0.85 -1.44 1.79 5.85 -1.88 -1.51 115.31 120.21 2p6o h LEU 53 Ca -0.48 0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.53 2p6o h LEU 53 Cb 1.23 0.52 -0.04 0.00 0.37 0.00 0.00 40.66 42.74 2p6o h LEU 53 CO 0.64 -0.27 0.44 0.08 -0.34 0.00 0.00 178.44 178.98 2p6o h ARG 54 N -0.03 0.68 0.01 1.25 0.11 -1.91 0.77 114.38 115.27 2p6o h ARG 54 Ca 0.36 -0.04 -0.10 0.00 0.10 0.00 0.00 59.98 60.29 2p6o h ARG 54 Cb 0.58 -0.15 0.01 0.00 1.11 0.00 0.00 29.97 31.51 2p6o h ARG 54 CO -0.81 0.45 -0.39 0.00 0.10 0.00 0.00 179.97 179.32 2p6o h ALA 55 N 1.63 0.04 -0.40 0.08 0.00 -1.60 -2.55 119.26 116.46 2p6o h ALA 55 Ca 0.28 -0.52 0.03 0.00 0.00 0.00 0.00 54.91 54.70 2p6o h ALA 55 Cb 0.21 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2p6o h ALA 55 CO -0.08 0.19 0.20 0.00 0.00 0.00 0.00 179.25 179.56 2p6o h ARG 56 N -0.38 0.40 -0.36 0.00 3.08 -0.99 -0.87 114.38 115.27 2p6o h ARG 56 Ca -0.05 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 2p6o h ARG 56 Cb 1.15 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 2p6o h ARG 56 CO 0.08 0.27 -0.09 -0.09 -1.07 0.00 0.00 179.97 179.06 2p6o h ARG 57 N 0.41 0.61 -0.45 0.04 9.65 -0.95 -0.72 114.38 122.98 2p6o h ARG 57 Ca 0.17 -0.17 -0.06 0.00 -1.10 0.00 0.00 59.98 58.81 2p6o h ARG 57 Cb 0.07 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.56 2p6o h ARG 57 CO -0.11 0.69 0.05 1.15 2.80 0.00 0.00 179.97 184.55 2p6o h THR 58 N 0.56 1.25 -0.32 0.20 2.02 -0.99 -1.13 112.91 114.50 2p6o h THR 58 Ca 0.10 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.33 2p6o h THR 58 Cb 0.49 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 2p6o h THR 58 CO 0.03 0.33 0.19 0.00 0.37 0.00 0.00 175.52 176.44 2p6o h ALA 59 N 0.93 0.41 -0.16 6.16 0.00 -0.71 -1.24 119.26 124.66 2p6o h ALA 59 Ca 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2p6o h ALA 59 Cb 0.43 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2p6o h ALA 59 CO 0.01 -0.07 0.11 1.49 0.00 0.00 0.00 179.25 180.79 2p6o h GLU 60 N 0.41 0.22 0.00 0.00 4.81 -1.00 0.19 114.58 119.21 2p6o h GLU 60 Ca 0.12 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2p6o h GLU 60 Cb 0.03 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 2p6o h GLU 60 CO -0.02 0.15 -0.11 -0.07 -0.73 0.00 0.00 179.01 178.23 2p6o h LEU 61 N 0.22 0.00 -0.37 1.64 3.38 -1.10 -1.54 115.31 117.53 2p6o h LEU 61 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2p6o h LEU 61 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2p6o h LEU 61 CO -0.01 0.11 -0.02 0.00 0.09 0.00 0.00 178.44 178.61 2p6o n ALA 62 N -2.19 2.66 -0.93 1.53 0.00 -0.48 -4.05 120.51 117.06 2p6o n ALA 62 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2p6o n ALA 62 Cb 0.31 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.40 2p6o n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p6o n GLY 63 N 1.12 0.94 3.52 0.00 0.00 -0.58 -3.94 105.19 106.26 2p6o n GLY 63 Ca 0.20 -0.54 -0.24 0.00 0.00 0.00 0.00 46.02 45.44 2p6o n GLY 63 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2p6o s PHE 64 N -2.00 2.39 -0.55 1.61 0.40 0.01 -5.02 117.98 114.83 2p6o s PHE 64 Ca 0.00 -0.34 0.04 0.00 -0.60 0.00 0.00 56.93 56.03 2p6o s PHE 64 Cb 0.00 -1.11 0.17 0.00 0.51 0.00 0.00 43.02 42.59 2p6o s PHE 64 CO 0.00 0.67 0.40 -1.12 0.70 0.00 0.00 175.22 175.87 2p6o s SER 65 N -3.56 3.14 0.57 1.36 0.01 -1.26 -3.82 113.70 110.13 2p6o s SER 65 Ca 0.31 -3.39 -0.17 0.00 1.31 0.00 0.00 55.95 54.01 2p6o s SER 65 Cb -0.04 -1.02 -0.05 0.00 0.21 0.00 0.00 66.02 65.12 2p6o s SER 65 CO 0.16 -0.14 1.05 -2.16 0.41 0.00 0.00 173.24 172.57 2p6o s PRO 66 N -0.60 3.45 0.01 12.44 0.04 -1.26 -4.79 135.00 144.28 2p6o s PRO 66 Ca 0.28 1.23 -0.25 0.00 0.04 0.00 0.00 61.00 62.30 2p6o s PRO 66 Cb -0.02 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 2p6o s PRO 66 CO -0.17 -0.71 0.77 1.03 0.04 0.00 0.00 177.00 177.97 2p6o s ARG 67 N -3.88 4.49 -0.10 4.56 0.52 -0.61 -4.80 118.95 119.13 2p6o s ARG 67 Ca 0.64 1.06 -0.20 0.00 -0.52 0.00 0.00 55.73 56.71 2p6o s ARG 67 Cb -0.16 -3.40 -0.04 0.00 0.52 0.00 0.00 34.95 31.88 2p6o s ARG 67 CO 0.33 0.19 0.56 -0.51 0.02 0.00 0.00 175.30 175.89 2p6o s LEU 68 N 0.28 4.29 -0.11 2.53 1.43 -1.26 -1.10 118.68 124.74 2p6o s LEU 68 Ca 0.40 0.95 -0.02 0.00 -1.03 0.00 0.00 54.13 54.42 2p6o s LEU 68 Cb -0.20 -2.83 0.04 0.00 0.03 0.00 0.00 46.19 43.23 2p6o s LEU 68 CO 0.22 -0.04 0.03 -0.31 0.23 0.00 0.00 176.35 176.48 2p6o s TYR 69 N 0.70 0.62 0.07 0.29 1.51 -0.30 -4.95 117.35 115.30 2p6o s TYR 69 Ca 0.30 -0.29 0.32 0.00 -1.01 0.00 0.00 57.07 56.39 2p6o s TYR 69 Cb -0.16 -0.80 1.56 0.00 -0.11 0.00 0.00 41.96 42.45 2p6o s TYR 69 CO 0.13 -0.40 1.95 -1.35 -1.11 0.00 0.00 175.55 174.78 2p6o h PRO 70 N 8.33 0.00 0.00 -1.71 0.11 -1.94 -2.04 132.00 134.75 2p6o h PRO 70 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2p6o h PRO 70 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2p6o h PRO 70 CO 0.27 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 178.99 2p6o h GLU 71 N 0.00 0.00 -0.14 1.05 3.07 -1.94 -1.60 114.58 115.03 2p6o h GLU 71 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2p6o h GLU 71 Cb 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 2p6o h GLU 71 CO 0.00 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.89 2p6o n LEU 72 N -3.00 1.48 -4.77 1.33 4.77 -0.77 -4.09 117.00 111.96 2p6o n LEU 72 Ca -0.02 -0.61 -0.33 0.00 -0.03 0.00 0.00 56.01 55.02 2p6o n LEU 72 Cb 0.14 -0.09 0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2p6o n LEU 72 CO 0.21 0.30 0.75 -0.13 -1.33 0.00 0.00 177.39 177.20 2p6o s ARG 73 N -1.83 2.83 0.97 3.23 0.52 -0.60 -4.27 118.95 119.80 2p6o s ARG 73 Ca 0.33 1.43 -0.12 0.00 -0.52 0.00 0.00 55.73 56.85 2p6o s ARG 73 Cb 0.17 -1.95 0.18 0.00 0.52 0.00 0.00 34.95 33.87 2p6o s ARG 73 CO 0.27 -1.23 1.09 -2.00 0.02 0.00 0.00 175.30 173.44 2p6o s GLU 74 N -4.00 0.60 0.57 3.54 2.56 -1.26 -4.89 118.70 115.82 2p6o s GLU 74 Ca 0.68 0.95 -0.20 0.00 0.00 0.00 0.00 54.97 56.40 2p6o s GLU 74 Cb -0.21 -1.72 -0.04 0.00 2.00 0.00 0.00 34.13 34.15 2p6o s GLU 74 CO 0.40 -2.73 1.24 -1.50 -0.56 0.00 0.00 175.26 172.11 2p6o s ILE 75 N -2.76 2.53 -0.37 -3.70 2.07 -1.26 -4.70 121.20 113.00 2p6o s ILE 75 Ca 0.65 0.35 -0.25 0.00 -1.41 0.00 0.00 60.65 59.99 2p6o s ILE 75 Cb -0.21 -3.15 0.01 0.00 0.13 0.00 0.00 42.46 39.25 2p6o s ILE 75 CO 0.59 -0.05 0.90 -2.28 -1.91 0.00 0.00 174.94 172.19 2p6o s HIS 76 N -1.51 3.07 -1.64 3.50 5.65 -1.26 -4.13 115.29 118.97 2p6o s HIS 76 Ca 0.75 0.70 0.28 0.00 0.25 0.00 0.00 55.06 57.04 2p6o s HIS 76 Cb -0.33 -3.62 1.52 0.00 -1.18 0.00 0.00 32.58 28.97 2p6o s HIS 76 CO 0.37 -0.83 1.99 1.19 -0.65 0.00 0.00 174.74 176.81 2p6o n PHE 77 N 6.73 0.00 0.00 3.88 3.72 -1.26 -1.04 117.46 129.49 2p6o n PHE 77 Ca 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.46 2p6o n PHE 77 Cb 0.48 -0.18 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2p6o n PHE 77 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2p6o n GLY 78 N 0.97 3.57 0.25 1.37 0.00 -1.26 -1.14 105.19 108.94 2p6o n GLY 78 Ca 0.16 -0.08 0.17 0.00 0.00 0.00 0.00 46.02 46.27 2p6o n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p6o h ALA 79 N -0.93 1.00 -0.00 4.61 0.00 -1.10 -1.93 119.26 120.91 2p6o h ALA 79 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2p6o h ALA 79 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2p6o h ALA 79 CO 0.00 0.00 -0.04 1.28 0.00 0.00 0.00 179.25 180.49 2p6o n LEU 80 N -2.74 0.37 -4.69 0.00 4.77 -0.30 -4.82 117.00 109.59 2p6o n LEU 80 Ca -0.01 -0.01 -0.44 0.00 -0.03 0.00 0.00 56.01 55.51 2p6o n LEU 80 Cb 0.13 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 2p6o n LEU 80 CO 0.19 0.06 1.23 -0.62 -1.33 0.00 0.00 177.39 176.92 2p6o n GLU 81 N -0.88 2.37 -0.63 3.23 -0.58 -0.73 -1.12 120.64 122.30 2p6o n GLU 81 Ca 0.18 0.85 0.00 0.00 -0.42 0.00 0.00 57.16 57.77 2p6o n GLU 81 Cb 0.23 -2.63 0.00 0.00 -0.57 0.00 0.00 31.44 28.46 2p6o n GLU 81 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2p6o n GLY 82 N 3.27 1.55 3.75 0.62 0.00 0.57 -4.97 105.19 109.99 2p6o n GLY 82 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2p6o n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p6o s ALA 83 N -3.55 3.48 0.08 4.61 0.00 -0.28 -4.57 121.76 121.52 2p6o s ALA 83 Ca 0.00 1.10 -0.31 0.00 0.00 0.00 0.00 51.96 52.76 2p6o s ALA 83 Cb 0.00 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.61 2p6o s ALA 83 CO 0.00 -0.47 1.45 -0.51 0.00 0.00 0.00 175.76 176.23 2p6o s LEU 84 N -1.09 4.35 0.28 0.00 1.43 -1.26 -0.73 118.68 121.66 2p6o s LEU 84 Ca 0.50 2.31 -0.03 0.00 -1.03 0.00 0.00 54.13 55.89 2p6o s LEU 84 Cb -0.36 -3.58 0.39 0.00 0.03 0.00 0.00 46.19 42.67 2p6o s LEU 84 CO 0.44 -0.72 1.89 -0.25 0.23 0.00 0.00 176.35 177.94 2p6o h TRP 85 N 7.37 1.00 -0.95 0.29 2.91 -1.51 -2.35 115.95 122.69 2p6o h TRP 85 Ca -0.41 -0.03 0.10 0.00 1.13 0.00 0.00 58.89 59.68 2p6o h TRP 85 Cb 1.20 -0.31 -0.08 0.00 -0.51 0.00 0.00 29.16 29.46 2p6o h TRP 85 CO 0.71 0.72 0.59 1.49 -1.03 0.00 0.00 178.44 180.92 2p6o h GLU 86 N 1.00 0.95 -0.35 2.65 4.81 -1.90 -2.71 114.58 119.04 2p6o h GLU 86 Ca 0.25 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2p6o h GLU 86 Cb 0.08 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.25 2p6o h GLU 86 CO -0.03 0.63 0.00 0.25 -0.73 0.00 0.00 179.01 179.13 2p6o n THR 87 N -4.63 2.01 -1.89 0.32 -2.24 -1.10 -5.02 114.28 101.74 2p6o n THR 87 Ca 0.17 -1.57 -0.42 0.00 -2.27 0.00 0.00 64.05 59.95 2p6o n THR 87 Cb 0.29 -0.05 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 2p6o n THR 87 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2p6o s LEU 88 N -2.32 4.37 0.17 3.22 2.96 -0.90 -4.90 118.68 121.27 2p6o s LEU 88 Ca 0.40 2.74 -0.33 0.00 -0.22 0.00 0.00 54.13 56.72 2p6o s LEU 88 Cb 0.30 -3.61 -0.15 0.00 0.50 0.00 0.00 46.19 43.22 2p6o s LEU 88 CO 0.13 -0.84 1.22 -0.67 -1.32 0.00 0.00 176.35 174.87 2p6o n ASP 89 N 3.16 1.58 -0.32 3.68 -0.08 -1.26 -4.63 116.55 118.67 2p6o n ASP 89 Ca 0.11 1.14 0.21 0.00 -1.51 0.00 0.00 54.79 54.74 2p6o n ASP 89 Cb 0.38 -1.24 0.48 0.00 2.34 0.00 0.00 41.12 43.08 2p6o n ASP 89 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2p6o h PRO 90 N 3.67 0.44 -0.10 -0.67 0.11 -1.98 -0.19 132.00 133.27 2p6o h PRO 90 Ca -0.44 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2p6o h PRO 90 Cb 1.33 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2p6o h PRO 90 CO 0.72 0.29 -0.14 0.07 -0.21 0.00 0.00 178.00 178.72 2p6o h ARG 91 N 0.45 0.16 0.13 1.05 0.11 -1.99 0.13 114.38 114.41 2p6o h ARG 91 Ca 0.59 -0.03 -0.34 0.00 0.10 0.00 0.00 59.98 60.29 2p6o h ARG 91 Cb 1.39 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 32.44 2p6o h ARG 91 CO -0.31 0.31 -1.82 1.88 0.10 0.00 0.00 179.97 180.13 2p6o h TYR 92 N 0.15 0.49 -0.46 4.08 0.05 -1.44 -3.14 116.97 116.69 2p6o h TYR 92 Ca 0.03 -0.36 -0.05 0.00 0.05 0.00 0.00 58.73 58.40 2p6o h TYR 92 Cb 0.35 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.05 2p6o h TYR 92 CO 0.00 1.60 0.09 -0.22 -1.05 0.00 0.00 178.16 178.58 2p6o h LYS 93 N 0.07 0.76 -0.58 4.88 3.64 -0.97 -1.04 116.57 123.34 2p6o h LYS 93 Ca -0.36 -0.20 -0.09 0.00 -1.27 0.00 0.00 60.65 58.73 2p6o h LYS 93 Cb 2.05 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 33.76 2p6o h LYS 93 CO 0.12 0.77 0.00 0.93 -2.27 0.00 0.00 179.45 179.01 2p6o h GLU 94 N 0.63 1.02 -0.36 1.90 5.08 -0.90 -0.71 114.58 121.24 2p6o h GLU 94 Ca 0.14 -0.32 0.02 0.00 -1.00 0.00 0.00 59.36 58.20 2p6o h GLU 94 Cb 0.37 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2p6o h GLU 94 CO 0.01 1.01 0.20 0.00 -1.00 0.00 0.00 179.01 179.23 2p6o h ALA 95 N 0.97 0.45 -0.41 3.43 0.00 -1.45 -0.04 119.26 122.21 2p6o h ALA 95 Ca 0.16 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 2p6o h ALA 95 Cb 0.55 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2p6o h ALA 95 CO 0.03 -0.15 -0.12 -0.07 0.00 0.00 0.00 179.25 178.95 2p6o h LEU 96 N 0.42 0.73 -0.67 0.00 3.38 -0.97 -2.97 115.31 115.23 2p6o h LEU 96 Ca 0.14 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2p6o h LEU 96 Cb 0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2p6o h LEU 96 CO -0.07 0.87 -0.28 -0.07 0.09 0.00 0.00 178.44 178.98 2p6o h LEU 97 N 0.67 0.00 0.00 1.67 3.38 -0.75 -3.27 115.31 117.01 2p6o h LEU 97 Ca 0.11 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2p6o h LEU 97 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2p6o h LEU 97 CO 0.04 0.28 -0.58 0.03 0.09 0.00 0.00 178.44 178.29 2p6o h ARG 98 N 0.00 0.00 -5.08 1.13 3.08 -0.85 -3.48 114.38 109.18 2p6o h ARG 98 Ca -0.00 0.00 -0.40 0.00 0.07 0.00 0.00 59.98 59.64 2p6o h ARG 98 Cb 0.96 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.03 2p6o h ARG 98 CO 0.04 0.15 -0.62 1.19 -1.07 0.00 0.00 179.97 179.66 2p6o n PHE 99 N -2.98 -2.05 -0.01 3.04 3.72 -1.15 -4.86 117.46 113.16 2p6o n PHE 99 Ca 0.01 0.60 0.03 0.00 -0.05 0.00 0.00 57.45 58.03 2p6o n PHE 99 Cb 0.63 -4.07 -0.08 0.00 -0.94 0.00 0.00 39.48 35.02 2p6o n PHE 99 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2p6o n GLN 100 N -4.12 0.82 0.00 -1.08 6.02 -1.26 -5.07 117.38 112.69 2p6o n GLN 100 Ca -0.06 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.86 2p6o n GLN 100 Cb 0.58 -1.24 0.00 0.00 1.02 0.00 0.00 30.24 30.60 2p6o n GLN 100 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2p6o n GLY 101 N 2.05 2.31 3.64 1.08 0.00 -1.26 -5.06 105.19 107.95 2p6o n GLY 101 Ca -0.05 -0.33 -0.06 0.00 0.00 0.00 0.00 46.02 45.58 2p6o n GLY 101 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2p6o s PHE 102 N -1.76 -0.86 -0.41 1.61 5.36 -1.26 -4.63 117.98 116.04 2p6o s PHE 102 Ca 0.00 1.76 0.05 0.00 -0.96 0.00 0.00 56.93 57.78 2p6o s PHE 102 Cb 0.00 0.50 0.17 0.00 -0.34 0.00 0.00 43.02 43.35 2p6o s PHE 102 CO 0.00 -0.42 0.51 -1.58 -1.46 0.00 0.00 175.22 172.26 2p6o s HIS 103 N 1.37 -0.81 0.47 10.12 2.46 -1.26 -0.30 115.29 127.33 2p6o s HIS 103 Ca -0.08 -0.61 -0.23 0.00 0.47 0.00 0.00 55.06 54.61 2p6o s HIS 103 Cb -0.05 -0.12 -0.07 0.00 -0.13 0.00 0.00 32.58 32.22 2p6o s HIS 103 CO -0.16 -1.07 1.17 -1.25 -2.47 0.00 0.00 174.74 170.96 2p6o s PRO 104 N 1.32 3.71 0.22 2.88 0.04 -1.26 -4.94 135.00 136.97 2p6o s PRO 104 Ca 0.20 1.77 -0.32 0.00 0.04 0.00 0.00 61.00 62.70 2p6o s PRO 104 Cb -0.08 -2.37 -0.13 0.00 0.04 0.00 0.00 34.50 31.96 2p6o s PRO 104 CO -0.06 -0.59 1.56 -2.30 0.04 0.00 0.00 177.00 175.65 2p6o n PRO 105 N -0.56 2.35 -0.89 0.56 -0.02 -1.26 -0.61 135.00 134.56 2p6o n PRO 105 Ca 0.08 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 2p6o n PRO 105 Cb 0.48 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 2p6o n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2p6o n GLY 106 N 2.84 0.44 0.00 -1.23 0.00 -1.26 -0.60 105.19 105.38 2p6o n GLY 106 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2p6o n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2p6o n GLY 107 N -1.67 5.27 3.61 -0.02 0.00 0.22 -4.23 105.19 108.37 2p6o n GLY 107 Ca 0.00 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.66 2p6o n GLY 107 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2p6o s GLU 108 N 1.73 2.62 0.53 1.61 2.12 -0.20 -4.82 118.70 122.27 2p6o s GLU 108 Ca 0.00 -0.68 -0.14 0.00 0.36 0.00 0.00 54.97 54.50 2p6o s GLU 108 Cb 0.00 -2.55 -0.07 0.00 0.26 0.00 0.00 34.13 31.78 2p6o s GLU 108 CO 0.00 0.61 0.97 -1.54 -0.54 0.00 0.00 175.26 174.76 2p6o s SER 109 N -1.39 6.51 0.26 -1.70 1.04 -1.26 -4.30 113.70 112.85 2p6o s SER 109 Ca 0.17 1.47 -0.04 0.00 0.48 0.00 0.00 55.95 58.03 2p6o s SER 109 Cb -0.11 -2.47 0.34 0.00 0.10 0.00 0.00 66.02 63.88 2p6o s SER 109 CO 0.07 -0.63 1.90 0.25 0.98 0.00 0.00 173.24 175.81 2p6o h LEU 110 N 0.65 1.08 -0.75 2.42 5.85 -1.04 -0.66 115.31 122.87 2p6o h LEU 110 Ca -0.46 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.23 2p6o h LEU 110 Cb 1.19 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 2p6o h LEU 110 CO 0.62 0.73 0.38 0.77 -0.34 0.00 0.00 178.44 180.59 2p6o h SER 111 N 1.25 0.96 -0.56 1.25 4.64 -1.93 0.53 113.55 119.70 2p6o h SER 111 Ca 0.41 -0.12 -0.11 0.00 -0.47 0.00 0.00 61.79 61.50 2p6o h SER 111 Cb 0.04 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 2p6o h SER 111 CO -0.14 0.81 -0.07 0.00 -0.87 0.00 0.00 176.83 176.56 2p6o h ALA 112 N 1.19 0.80 0.01 5.18 0.00 -1.74 -0.61 119.26 124.08 2p6o h ALA 112 Ca 0.26 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2p6o h ALA 112 Cb 0.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2p6o h ALA 112 CO -0.04 0.67 -0.00 0.35 0.00 0.00 0.00 179.25 180.23 2p6o h PHE 113 N 0.93 -0.01 -0.83 0.00 3.57 -0.74 -2.64 116.94 117.23 2p6o h PHE 113 Ca 0.15 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 2p6o h PHE 113 Cb 0.64 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 2p6o h PHE 113 CO 0.04 0.05 0.42 1.96 -2.23 0.00 0.00 178.31 178.56 2p6o h GLN 114 N -0.06 1.17 -0.19 1.11 4.20 -0.74 -1.85 115.11 118.74 2p6o h GLN 114 Ca -0.00 -0.15 0.03 0.00 0.06 0.00 0.00 58.65 58.58 2p6o h GLN 114 Cb 0.06 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 2p6o h GLN 114 CO 0.00 0.88 0.03 1.49 -0.67 0.00 0.00 178.83 180.56 2p6o h GLU 115 N 1.17 0.10 -0.23 1.46 4.22 -0.85 -0.61 114.58 119.84 2p6o h GLU 115 Ca 0.29 -0.01 -0.18 0.00 0.08 0.00 0.00 59.36 59.54 2p6o h GLU 115 Cb 0.08 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2p6o h GLU 115 CO -0.04 0.06 -0.58 0.07 -2.18 0.00 0.00 179.01 176.34 2p6o h ARG 116 N 0.10 0.74 0.12 1.92 0.11 -1.34 -1.44 114.38 114.59 2p6o h ARG 116 Ca 0.09 -0.49 -0.01 0.00 0.10 0.00 0.00 59.98 59.67 2p6o h ARG 116 Cb 0.09 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.24 2p6o h ARG 116 CO -0.12 1.11 -0.06 0.28 0.10 0.00 0.00 179.97 181.28 2p6o h VAL 117 N 0.56 1.01 0.00 0.08 2.07 -1.19 -1.60 116.25 117.18 2p6o h VAL 117 Ca 0.00 -0.49 -0.11 0.00 0.82 0.00 0.00 66.70 66.93 2p6o h VAL 117 Cb 1.17 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 2p6o h VAL 117 CO 0.12 0.12 -0.51 -0.26 0.02 0.00 0.00 177.57 177.06 2p6o h PHE 118 N -0.38 0.00 -0.55 1.57 0.04 -1.18 -1.40 116.94 115.03 2p6o h PHE 118 Ca -0.02 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.68 2p6o h PHE 118 Cb 0.31 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 2p6o h PHE 118 CO 0.00 0.51 0.05 -0.09 -0.60 0.00 0.00 178.31 178.18 2p6o h ARG 119 N 0.00 0.93 0.02 1.51 2.43 -1.21 -1.08 114.38 116.99 2p6o h ARG 119 Ca -0.01 -0.27 -0.00 0.00 -0.81 0.00 0.00 59.98 58.89 2p6o h ARG 119 Cb 0.96 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 2p6o h ARG 119 CO 0.07 0.92 -0.01 0.35 -1.51 0.00 0.00 179.97 179.79 2p6o h PHE 120 N 0.82 -0.03 -0.60 2.20 3.57 -0.96 -1.80 116.94 120.14 2p6o h PHE 120 Ca 0.16 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.69 2p6o h PHE 120 Cb 0.47 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 2p6o h PHE 120 CO 0.03 0.09 0.37 -0.07 -2.23 0.00 0.00 178.31 176.50 2p6o h LEU 121 N -0.14 0.59 -1.54 0.59 3.38 -1.15 -1.84 115.31 115.20 2p6o h LEU 121 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2p6o h LEU 121 Cb 0.13 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2p6o h LEU 121 CO 0.01 0.41 -0.02 -0.33 0.09 0.00 0.00 178.44 178.60 2p6o h GLU 122 N 0.72 0.00 0.00 1.13 4.39 -1.12 -2.70 114.58 117.00 2p6o h GLU 122 Ca 0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.94 2p6o h GLU 122 Cb 0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2p6o h GLU 122 CO -0.10 0.02 -0.16 0.41 -1.16 0.00 0.00 179.01 178.01 2p6o n GLY 123 N -0.04 -1.62 3.78 -3.84 0.00 -0.68 -4.88 105.19 97.91 2p6o n GLY 123 Ca 0.00 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 2p6o n GLY 123 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p6o s LEU 124 N -4.33 4.30 0.00 0.99 1.43 -1.02 -4.93 118.68 115.11 2p6o s LEU 124 Ca 0.10 2.97 0.07 0.00 -1.03 0.00 0.00 54.13 56.24 2p6o s LEU 124 Cb 0.13 -3.72 0.12 0.00 0.03 0.00 0.00 46.19 42.75 2p6o s LEU 124 CO 0.63 -0.88 0.91 0.29 0.23 0.00 0.00 176.35 177.53 2p6o n LYS 125 N 0.38 1.26 -3.63 1.70 5.02 -1.26 -5.04 118.16 116.60 2p6o n LYS 125 Ca 0.02 -1.32 -0.07 0.00 -2.02 0.00 0.00 58.31 54.91 2p6o n LYS 125 Cb 0.40 -1.15 -0.02 0.00 -0.02 0.00 0.00 35.03 34.24 2p6o n LYS 125 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2p6o s ALA 126 N -0.77 -1.66 0.63 7.82 0.00 -1.26 -5.15 121.76 121.38 2p6o s ALA 126 Ca 0.11 0.44 -0.18 0.00 0.00 0.00 0.00 51.96 52.33 2p6o s ALA 126 Cb 0.07 0.62 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 2p6o s ALA 126 CO 0.09 -0.88 1.01 -2.30 0.00 0.00 0.00 175.76 173.68 2p6o n PRO 127 N -0.38 0.87 -3.71 0.00 -0.02 -1.26 -4.97 135.00 125.53 2p6o n PRO 127 Ca -0.08 0.34 -0.09 0.00 -2.02 0.00 0.00 63.50 61.65 2p6o n PRO 127 Cb 0.61 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 2p6o n PRO 127 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2p6o s ALA 128 N -1.52 -1.09 -0.20 3.55 0.00 -0.91 -4.02 121.76 117.56 2p6o s ALA 128 Ca 0.77 -0.13 -0.03 0.00 0.00 0.00 0.00 51.96 52.57 2p6o s ALA 128 Cb -0.40 0.86 -0.01 0.00 0.00 0.00 0.00 23.12 23.57 2p6o s ALA 128 CO 0.46 -0.85 -0.05 0.08 0.00 0.00 0.00 175.76 175.40 2p6o s VAL 129 N -3.86 3.39 -0.29 0.00 1.01 -0.19 -0.98 120.40 119.48 2p6o s VAL 129 Ca 0.08 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.53 2p6o s VAL 129 Cb -0.02 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.86 2p6o s VAL 129 CO -0.02 0.44 0.03 -0.76 0.00 0.00 0.00 175.10 174.78 2p6o s LEU 130 N 1.25 3.75 -0.36 3.92 1.43 0.11 -1.12 118.68 127.67 2p6o s LEU 130 Ca 0.03 -0.95 -0.23 0.00 -1.03 0.00 0.00 54.13 51.95 2p6o s LEU 130 Cb -0.14 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.30 2p6o s LEU 130 CO -0.02 -0.21 0.76 -0.36 0.23 0.00 0.00 176.35 176.75 2p6o s PHE 131 N 1.38 3.12 0.00 0.29 0.08 -0.04 -0.57 117.98 122.25 2p6o s PHE 131 Ca -0.01 0.54 0.00 0.00 0.12 0.00 0.00 56.93 57.59 2p6o s PHE 131 Cb -0.18 -3.35 0.00 0.00 -0.57 0.00 0.00 43.02 38.92 2p6o s PHE 131 CO -0.00 -0.70 0.00 -2.37 -0.10 0.00 0.00 175.22 172.04 2p6o n THR 132 N 5.74 0.00 -4.51 0.64 5.66 0.52 -1.40 114.28 120.93 2p6o n THR 132 Ca 0.02 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.78 2p6o n THR 132 Cb 0.48 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.16 2p6o n THR 132 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 2p6o s HIS 133 N 0.65 2.24 0.24 1.09 3.76 -1.26 -1.72 115.29 120.29 2p6o s HIS 133 Ca 0.00 -0.61 -0.05 0.00 -0.15 0.00 0.00 55.06 54.25 2p6o s HIS 133 Cb 0.00 -1.33 0.43 0.00 1.11 0.00 0.00 32.58 32.78 2p6o s HIS 133 CO 0.00 0.43 1.73 0.78 -0.85 0.00 0.00 174.74 176.84 2p6o h GLY 134 N 2.08 1.10 1.79 -2.22 0.00 -1.94 -1.12 103.07 102.76 2p6o h GLY 134 Ca -0.41 -0.15 -0.06 0.00 0.00 0.00 0.00 47.33 46.71 2p6o h GLY 134 CO 0.71 -0.08 -0.16 -1.33 0.00 0.00 0.00 176.54 175.68 2p6o h GLY 135 N 0.45 0.27 0.77 4.60 0.00 -1.97 -0.34 103.07 106.86 2p6o h GLY 135 Ca 0.40 -0.18 -0.14 0.00 0.00 0.00 0.00 47.33 47.40 2p6o h GLY 135 CO -0.38 0.17 -0.55 -2.08 0.00 0.00 0.00 176.54 173.69 2p6o h VAL 136 N 0.24 1.43 -0.61 4.60 2.07 -1.63 -1.48 116.25 120.87 2p6o h VAL 136 Ca 0.05 -2.02 -0.01 0.00 0.82 0.00 0.00 66.70 65.54 2p6o h VAL 136 Cb 0.43 2.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.70 2p6o h VAL 136 CO 0.03 0.59 0.35 0.58 0.02 0.00 0.00 177.57 179.13 2p6o h VAL 137 N -0.10 1.19 -0.68 2.57 2.07 -1.10 -1.96 116.25 118.24 2p6o h VAL 137 Ca -0.06 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 2p6o h VAL 137 Cb 1.25 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 2p6o h VAL 137 CO 0.11 0.20 0.41 -0.09 0.02 0.00 0.00 177.57 178.22 2p6o h ARG 138 N 0.83 0.93 -0.85 1.57 2.43 -1.07 -0.96 114.38 117.26 2p6o h ARG 138 Ca 0.22 -0.09 0.04 0.00 -0.81 0.00 0.00 59.98 59.34 2p6o h ARG 138 Cb 0.01 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 29.31 2p6o h ARG 138 CO -0.04 0.67 0.54 0.00 -1.51 0.00 0.00 179.97 179.63 2p6o h ALA 139 N 1.21 1.13 -0.23 2.80 0.00 -0.85 0.48 119.26 123.81 2p6o h ALA 139 Ca 0.25 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 2p6o h ALA 139 Cb -0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2p6o h ALA 139 CO -0.05 0.34 -0.06 0.28 0.00 0.00 0.00 179.25 179.77 2p6o h VAL 140 N 1.02 1.29 -0.54 0.00 2.07 -0.86 -1.74 116.25 117.49 2p6o h VAL 140 Ca 0.35 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 2p6o h VAL 140 Cb 0.06 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2p6o h VAL 140 CO -0.13 0.33 0.32 -0.07 0.02 0.00 0.00 177.57 178.03 2p6o h LEU 141 N 0.18 0.65 -1.09 2.57 3.38 -0.79 -2.66 115.31 117.55 2p6o h LEU 141 Ca 0.06 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2p6o h LEU 141 Cb 0.52 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2p6o h LEU 141 CO 0.02 0.53 -0.30 0.03 0.09 0.00 0.00 178.44 178.81 2p6o h ARG 142 N 0.73 0.26 0.00 1.13 3.08 -0.89 0.13 114.38 118.82 2p6o h ARG 142 Ca 0.19 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 2p6o h ARG 142 Cb -0.00 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 2p6o h ARG 142 CO -0.04 0.55 -0.09 0.00 -1.07 0.00 0.00 179.97 179.32 2p6o h ALA 143 N 1.45 1.17 -0.69 0.04 0.00 -0.98 -1.24 119.26 119.01 2p6o h ALA 143 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2p6o h ALA 143 Cb 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2p6o h ALA 143 CO 0.05 0.12 0.00 1.28 0.00 0.00 0.00 179.25 180.70 2p6o n LEU 144 N -3.45 4.37 -1.06 0.00 4.77 -0.73 -4.93 117.00 115.97 2p6o n LEU 144 Ca -0.01 -2.20 -0.10 0.00 -0.03 0.00 0.00 56.01 53.67 2p6o n LEU 144 Cb 0.25 -0.54 -0.02 0.00 -2.33 0.00 0.00 43.42 40.78 2p6o n LEU 144 CO 0.29 0.89 -0.12 0.61 -1.33 0.00 0.00 177.39 177.72 2p6o n GLY 145 N 1.40 0.27 3.55 -0.72 0.00 -0.47 -4.89 105.19 104.33 2p6o n GLY 145 Ca 0.25 -0.49 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 2p6o n GLY 145 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2p6o s GLU 146 N -4.07 2.08 0.52 1.61 0.41 0.36 -4.99 118.70 114.62 2p6o s GLU 146 Ca 0.00 -1.04 0.08 0.00 -0.41 0.00 0.00 54.97 53.60 2p6o s GLU 146 Cb 0.00 -2.27 0.04 0.00 -1.78 0.00 0.00 34.13 30.12 2p6o s GLU 146 CO 0.00 0.51 0.57 0.34 -0.49 0.00 0.00 175.26 176.19 2p6o s ASP 147 N -2.10 5.02 0.73 -0.19 -1.08 -1.26 -3.39 116.67 114.40 2p6o s ASP 147 Ca 0.20 -0.89 0.00 0.00 -0.52 0.00 0.00 52.55 51.34 2p6o s ASP 147 Cb -0.11 0.05 0.00 0.00 -1.46 0.00 0.00 42.92 41.40 2p6o s ASP 147 CO 0.12 -1.07 0.00 0.61 0.52 0.00 0.00 175.17 175.35 2p6o n GLY 148 N -1.92 -1.31 1.52 2.66 0.00 -1.26 -4.99 105.19 99.90 2p6o n GLY 148 Ca 0.07 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.91 2p6o n GLY 148 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2p6o n LEU 149 N 0.00 0.00 -4.54 0.99 7.94 -1.26 -4.92 117.00 115.22 2p6o n LEU 149 Ca 0.00 -1.45 -0.34 0.00 -1.11 0.00 0.00 56.01 53.12 2p6o n LEU 149 Cb 0.20 0.59 -0.12 0.00 0.53 0.00 0.00 43.42 44.63 2p6o n LEU 149 CO 0.00 -0.23 -0.35 -0.69 -1.11 0.00 0.00 177.39 175.01 2p6o s VAL 150 N -2.40 3.92 0.86 1.96 1.01 -1.26 -5.11 120.40 119.38 2p6o s VAL 150 Ca 0.13 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 2p6o s VAL 150 Cb 0.01 -2.69 0.11 0.00 0.00 0.00 0.00 36.38 33.80 2p6o s VAL 150 CO 0.09 0.53 1.09 -2.16 0.00 0.00 0.00 175.10 174.65 2p6o s PRO 151 N 0.01 1.58 0.35 2.72 0.04 -1.26 -4.90 135.00 133.54 2p6o s PRO 151 Ca 0.01 0.93 -0.28 0.00 0.04 0.00 0.00 61.00 61.70 2p6o s PRO 151 Cb -0.13 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.45 2p6o s PRO 151 CO 0.03 -2.05 1.39 -2.30 0.04 0.00 0.00 177.00 174.10 2p6o n PRO 152 N -3.77 2.39 -0.87 0.56 -0.02 -1.26 -1.81 135.00 130.21 2p6o n PRO 152 Ca 0.08 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2p6o n PRO 152 Cb 0.55 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2p6o n PRO 152 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2p6o n GLY 153 N 0.70 0.77 3.85 -1.23 0.00 -0.23 -4.70 105.19 104.35 2p6o n GLY 153 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 2p6o n GLY 153 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2p6o s SER 154 N -2.55 4.49 0.18 1.61 1.04 -0.75 -4.80 113.70 112.93 2p6o s SER 154 Ca 0.00 -1.31 -0.10 0.00 0.48 0.00 0.00 55.95 55.02 2p6o s SER 154 Cb 0.00 0.31 -0.01 0.00 0.10 0.00 0.00 66.02 66.42 2p6o s SER 154 CO 0.00 -0.96 0.32 0.00 0.98 0.00 0.00 173.24 173.58 2p6o s ALA 155 N -2.77 -0.07 -0.03 5.32 0.00 -0.74 -1.29 121.76 122.18 2p6o s ALA 155 Ca 0.28 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.40 2p6o s ALA 155 Cb -0.01 0.90 0.02 0.00 0.00 0.00 0.00 23.12 24.03 2p6o s ALA 155 CO 0.17 -0.68 -0.03 0.54 0.00 0.00 0.00 175.76 175.76 2p6o s VAL 156 N -3.97 0.32 -0.12 0.00 0.11 -0.45 0.12 120.40 116.41 2p6o s VAL 156 Ca 0.18 -0.05 -0.06 0.00 -2.93 0.00 0.00 61.98 59.12 2p6o s VAL 156 Cb 0.03 -0.36 -0.04 0.00 -1.53 0.00 0.00 36.38 34.48 2p6o s VAL 156 CO 0.01 0.15 0.09 0.00 -3.33 0.00 0.00 175.10 172.02 2p6o s ALA 157 N 0.65 3.62 0.08 1.54 0.00 0.02 -0.39 121.76 127.28 2p6o s ALA 157 Ca -0.07 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.22 2p6o s ALA 157 Cb -0.10 -1.82 -0.03 0.00 0.00 0.00 0.00 23.12 21.16 2p6o s ALA 157 CO -0.01 0.53 -0.10 0.14 0.00 0.00 0.00 175.76 176.32 2p6o s VAL 158 N -0.73 0.87 -0.78 0.00 -7.23 0.39 0.09 120.40 113.01 2p6o s VAL 158 Ca 0.13 -1.50 -0.12 0.00 -1.81 0.00 0.00 61.98 58.67 2p6o s VAL 158 Cb -0.12 -1.19 0.21 0.00 0.56 0.00 0.00 36.38 35.84 2p6o s VAL 158 CO 0.03 -0.50 0.70 -0.62 -0.31 0.00 0.00 175.10 174.40 2p6o s ASP 159 N -2.21 6.51 0.16 4.85 2.15 0.12 -0.86 116.67 127.38 2p6o s ASP 159 Ca 0.02 -2.66 -0.30 0.00 0.43 0.00 0.00 52.55 50.03 2p6o s ASP 159 Cb -0.05 -2.16 -0.07 0.00 -0.30 0.00 0.00 42.92 40.34 2p6o s ASP 159 CO 0.00 -0.56 1.18 0.86 -0.17 0.00 0.00 175.17 176.48 2p6o s TRP 160 N 0.21 3.46 -0.57 -5.34 -0.11 -0.26 0.84 118.94 117.16 2p6o s TRP 160 Ca 0.17 1.42 0.01 0.00 1.22 0.00 0.00 56.10 58.92 2p6o s TRP 160 Cb -0.13 -3.40 0.44 0.00 -1.50 0.00 0.00 33.47 28.88 2p6o s TRP 160 CO -0.07 -1.12 1.75 -0.35 -4.62 0.00 0.00 176.95 172.53 2p6o n PRO 161 N 2.79 3.00 -0.10 5.86 -0.04 -1.26 -0.97 135.00 144.28 2p6o n PRO 161 Ca 0.05 -3.63 -0.16 0.00 -0.04 0.00 0.00 63.50 59.72 2p6o n PRO 161 Cb 0.45 -2.28 -0.06 0.00 -0.04 0.00 0.00 33.50 31.57 2p6o n PRO 161 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2p6o n ARG 162 N -0.79 0.53 -3.81 0.54 1.74 0.25 -4.98 116.66 110.14 2p6o n ARG 162 Ca 0.55 0.42 -0.05 0.00 -0.77 0.00 0.00 57.85 58.00 2p6o n ARG 162 Cb 0.69 -1.61 -0.01 0.00 -1.02 0.00 0.00 32.46 30.51 2p6o n ARG 162 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2p6o s ARG 163 N -2.47 1.50 0.11 5.56 1.70 -0.63 -4.99 118.95 119.73 2p6o s ARG 163 Ca -0.27 -0.84 -0.28 0.00 -0.47 0.00 0.00 55.73 53.88 2p6o s ARG 163 Cb 0.06 0.51 -0.06 0.00 -0.57 0.00 0.00 34.95 34.89 2p6o s ARG 163 CO 0.42 -0.69 0.86 0.08 -1.08 0.00 0.00 175.30 174.90 2p6o s VAL 164 N -3.52 4.52 -0.18 4.99 1.01 -1.26 0.13 120.40 126.09 2p6o s VAL 164 Ca 0.12 1.87 -0.15 0.00 0.00 0.00 0.00 61.98 63.82 2p6o s VAL 164 Cb -0.04 -4.22 -0.21 0.00 0.00 0.00 0.00 36.38 31.91 2p6o s VAL 164 CO 0.05 0.38 0.20 0.18 0.00 0.00 0.00 175.10 175.91 2p6o n LEU 165 N 2.51 2.20 -3.57 3.92 4.77 0.11 -4.83 117.00 122.10 2p6o n LEU 165 Ca -0.01 0.31 -0.08 0.00 -0.03 0.00 0.00 56.01 56.20 2p6o n LEU 165 Cb 0.49 -1.01 -0.04 0.00 -2.33 0.00 0.00 43.42 40.53 2p6o n LEU 165 CO 0.49 0.54 0.84 0.54 -1.33 0.00 0.00 177.39 178.46 2p6o s VAL 166 N -2.45 0.00 -0.11 4.08 0.11 -1.06 -5.00 120.40 115.97 2p6o s VAL 166 Ca -0.28 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.77 2p6o s VAL 166 Cb 0.07 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.90 2p6o s VAL 166 CO 0.65 0.00 -0.11 -0.13 -3.33 0.00 0.00 175.10 172.18 2p6o s ARG 167 N -1.60 3.16 -0.87 1.54 0.52 -1.26 -0.80 118.95 119.63 2p6o s ARG 167 Ca 0.02 -0.64 -0.01 0.00 -0.52 0.00 0.00 55.73 54.59 2p6o s ARG 167 Cb -0.01 -2.62 0.21 0.00 0.52 0.00 0.00 34.95 33.05 2p6o s ARG 167 CO -0.02 0.37 0.74 -1.17 0.02 0.00 0.00 175.30 175.24 2p6o s LEU 168 N -0.05 5.44 -0.40 2.53 2.96 0.12 -5.00 118.68 124.28 2p6o s LEU 168 Ca -0.02 -3.76 -0.19 0.00 -0.22 0.00 0.00 54.13 49.95 2p6o s LEU 168 Cb -0.14 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 44.70 2p6o s LEU 168 CO 0.04 -0.16 0.54 0.00 -1.32 0.00 0.00 176.35 175.44 2p6o s ALA 169 N -1.39 3.42 -2.06 5.97 0.00 -1.26 -1.79 121.76 124.66 2p6o s ALA 169 Ca 0.27 -1.20 0.16 0.00 0.00 0.00 0.00 51.96 51.20 2p6o s ALA 169 Cb -0.07 -3.12 0.13 0.00 0.00 0.00 0.00 23.12 20.06 2p6o s ALA 169 CO -0.13 -1.50 1.02 1.28 0.00 0.00 0.00 175.76 176.43