#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a6p n ASN 5 N 0.00 3.39 -4.66 6.15 5.03 -1.26 -4.84 115.26 119.06 2a6p n ASN 5 Ca 0.00 -1.96 -0.29 0.00 0.87 0.00 0.00 54.58 53.20 2a6p n ASN 5 Cb 0.00 -0.31 -0.10 0.00 -1.02 0.00 0.00 39.78 38.35 2a6p n ASN 5 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.26 174.43 2a6p s HIS 6 N -1.13 2.33 0.14 3.10 3.76 -1.26 -5.05 115.29 117.18 2a6p s HIS 6 Ca 0.36 -0.75 0.06 0.00 -0.15 0.00 0.00 55.06 54.58 2a6p s HIS 6 Cb 0.20 -1.74 -0.04 0.00 1.11 0.00 0.00 32.58 32.11 2a6p s HIS 6 CO 0.26 0.38 -0.13 1.03 -0.85 0.00 0.00 174.74 175.43 2a6p s ARG 7 N -3.76 1.06 -0.28 1.40 0.52 -1.26 -4.78 118.95 111.84 2a6p s ARG 7 Ca 0.27 -1.32 -0.04 0.00 -0.52 0.00 0.00 55.73 54.12 2a6p s ARG 7 Cb 0.07 -0.85 0.02 0.00 0.52 0.00 0.00 34.95 34.72 2a6p s ARG 7 CO 0.14 0.15 0.02 -1.17 0.02 0.00 0.00 175.30 174.45 2a6p s LEU 8 N -2.71 3.61 0.05 2.53 2.96 -0.39 -1.38 118.68 123.35 2a6p s LEU 8 Ca 0.12 -0.84 0.02 0.00 -0.22 0.00 0.00 54.13 53.21 2a6p s LEU 8 Cb -0.03 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 2a6p s LEU 8 CO 0.03 -0.18 0.05 -0.76 -1.32 0.00 0.00 176.35 174.17 2a6p s LEU 9 N 1.40 3.70 -0.04 -0.68 1.43 0.12 -0.38 118.68 124.23 2a6p s LEU 9 Ca 0.01 -0.01 0.04 0.00 -1.03 0.00 0.00 54.13 53.14 2a6p s LEU 9 Cb -0.17 -2.29 -0.00 0.00 0.03 0.00 0.00 46.19 43.76 2a6p s LEU 9 CO -0.01 0.22 -0.15 -0.76 0.23 0.00 0.00 176.35 175.88 2a6p s LEU 10 N -2.06 1.89 -0.12 1.79 1.02 -0.08 -0.70 118.68 120.41 2a6p s LEU 10 Ca 0.25 -0.30 0.01 0.00 0.02 0.00 0.00 54.13 54.11 2a6p s LEU 10 Cb -0.12 -0.85 0.02 0.00 0.02 0.00 0.00 46.19 45.26 2a6p s LEU 10 CO 0.17 0.13 -0.14 -0.22 0.02 0.00 0.00 176.35 176.32 2a6p s LEU 11 N 0.05 1.63 0.26 1.79 2.96 0.86 -1.61 118.68 124.61 2a6p s LEU 11 Ca -0.03 -0.43 -0.21 0.00 -0.22 0.00 0.00 54.13 53.24 2a6p s LEU 11 Cb -0.10 -1.08 -0.09 0.00 0.50 0.00 0.00 46.19 45.42 2a6p s LEU 11 CO 0.01 -0.03 0.80 -0.60 -1.32 0.00 0.00 176.35 175.21 2a6p s ARG 12 N 1.28 4.34 0.98 1.98 3.52 -0.72 -1.12 118.95 129.21 2a6p s ARG 12 Ca -0.01 1.01 -0.12 0.00 -0.13 0.00 0.00 55.73 56.49 2a6p s ARG 12 Cb -0.14 -2.82 0.18 0.00 -1.56 0.00 0.00 34.95 30.61 2a6p s ARG 12 CO -0.06 0.34 1.08 -3.38 -0.81 0.00 0.00 175.30 172.47 2a6p s HIS 13 N -1.59 1.91 1.20 5.12 -3.43 -1.08 -2.11 115.29 115.32 2a6p s HIS 13 Ca 0.46 1.32 -0.20 0.00 -0.80 0.00 0.00 55.06 55.84 2a6p s HIS 13 Cb -0.17 -3.18 0.29 0.00 -1.43 0.00 0.00 32.58 28.09 2a6p s HIS 13 CO 0.21 -2.91 1.12 0.20 -2.00 0.00 0.00 174.74 171.37 2a6p s GLY 14 N -3.04 1.60 0.53 -1.38 0.00 -1.26 -1.42 107.32 102.35 2a6p s GLY 14 Ca 0.65 -1.00 -0.21 0.00 0.00 0.00 0.00 44.72 44.16 2a6p s GLY 14 CO 0.59 -0.10 1.26 1.85 0.00 0.00 0.00 173.10 176.70 2a6p s GLU 15 N -5.46 3.29 0.28 2.90 2.12 -1.26 -4.77 118.70 115.79 2a6p s GLU 15 Ca 0.71 2.00 0.02 0.00 0.36 0.00 0.00 54.97 58.06 2a6p s GLU 15 Cb -0.09 -2.23 -0.05 0.00 0.26 0.00 0.00 34.13 32.03 2a6p s GLU 15 CO 0.56 -1.00 0.11 0.95 -0.54 0.00 0.00 175.26 175.34 2a6p s THR 16 N -1.44 0.55 0.49 -1.70 -4.23 -1.26 -1.29 115.64 106.76 2a6p s THR 16 Ca 0.70 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 59.43 2a6p s THR 16 Cb -0.35 -2.61 0.27 0.00 1.34 0.00 0.00 72.50 71.16 2a6p s THR 16 CO 0.40 0.00 2.12 0.00 -0.54 0.00 0.00 174.62 176.60 2a6p h ALA 17 N 2.31 1.61 0.21 3.99 0.00 -1.93 -2.89 119.26 122.56 2a6p h ALA 17 Ca -0.37 -0.07 -0.33 0.00 0.00 0.00 0.00 54.91 54.14 2a6p h ALA 17 Cb 1.25 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.05 2a6p h ALA 17 CO 0.59 0.10 -1.54 -1.49 0.00 0.00 0.00 179.25 176.92 2a6p h TRP 18 N 0.00 0.81 -0.77 0.00 4.06 -1.92 -3.33 115.95 114.79 2a6p h TRP 18 Ca -0.00 -0.59 -0.04 0.00 2.06 0.00 0.00 58.89 60.32 2a6p h TRP 18 Cb 0.17 -0.03 -0.04 0.00 -1.00 0.00 0.00 29.16 28.26 2a6p h TRP 18 CO 0.00 1.59 0.34 0.66 -3.56 0.00 0.00 178.44 177.47 2a6p h SER 19 N 0.06 1.03 0.17 -3.49 4.64 -1.74 -1.26 113.55 112.96 2a6p h SER 19 Ca -0.29 -0.14 -0.02 0.00 -0.47 0.00 0.00 61.79 60.88 2a6p h SER 19 Cb 2.07 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 63.90 2a6p h SER 19 CO 0.21 0.90 -0.07 0.71 -0.87 0.00 0.00 176.83 177.70 2a6p h THR 20 N 1.11 0.67 -0.01 2.95 1.35 -1.66 -0.93 112.91 116.38 2a6p h THR 20 Ca 0.26 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 2a6p h THR 20 Cb 0.16 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 2a6p h THR 20 CO -0.03 0.07 -0.15 0.18 -0.25 0.00 0.00 175.52 175.34 2a6p n LEU 21 N -3.90 1.63 -0.28 3.87 4.77 -0.78 -4.94 117.00 117.37 2a6p n LEU 21 Ca -0.02 -0.53 -0.04 0.00 -0.03 0.00 0.00 56.01 55.39 2a6p n LEU 21 Cb 0.17 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 2a6p n LEU 21 CO 0.30 0.28 -0.03 0.61 -1.33 0.00 0.00 177.39 177.22 2a6p n GLY 22 N 1.29 0.66 3.76 -0.72 0.00 -0.36 -4.92 105.19 104.91 2a6p n GLY 22 Ca 0.15 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.94 2a6p n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a6p s ARG 23 N -2.19 4.72 -0.23 1.61 0.52 -0.54 -4.20 118.95 118.63 2a6p s ARG 23 Ca 0.00 1.35 -0.28 0.00 -0.52 0.00 0.00 55.73 56.28 2a6p s ARG 23 Cb 0.00 -3.20 0.01 0.00 0.52 0.00 0.00 34.95 32.27 2a6p s ARG 23 CO 0.00 0.50 0.98 -1.01 0.02 0.00 0.00 175.30 175.79 2a6p s HIS 24 N -1.23 3.33 -0.21 -0.53 3.76 -0.77 -4.45 115.29 115.18 2a6p s HIS 24 Ca 0.40 1.38 -0.01 0.00 -0.15 0.00 0.00 55.06 56.68 2a6p s HIS 24 Cb -0.24 -3.21 0.01 0.00 1.11 0.00 0.00 32.58 30.26 2a6p s HIS 24 CO 0.29 -0.45 -0.11 0.99 -0.85 0.00 0.00 174.74 174.61 2a6p s THR 25 N 3.08 2.74 0.00 1.30 2.01 -1.26 -0.60 115.64 122.91 2a6p s THR 25 Ca 0.41 -0.82 0.00 0.00 0.31 0.00 0.00 61.69 61.59 2a6p s THR 25 Cb -0.15 -2.27 0.00 0.00 0.01 0.00 0.00 72.50 70.09 2a6p s THR 25 CO 0.06 0.39 0.00 0.61 -0.69 0.00 0.00 174.62 175.00 2a6p n GLY 26 N 4.69 0.53 0.24 4.40 0.00 -1.26 -4.86 105.19 108.94 2a6p n GLY 26 Ca -0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.98 2a6p n GLY 26 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2a6p h GLY 27 N 0.00 0.00 -4.81 -0.02 0.00 -1.91 -3.44 103.07 92.89 2a6p h GLY 27 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 2a6p h GLY 27 CO 0.00 0.00 0.87 2.41 0.00 0.00 0.00 176.54 179.82 2a6p n THR 28 N -2.97 0.11 -2.89 4.70 -1.04 -1.26 -4.91 114.28 106.03 2a6p n THR 28 Ca 0.02 -0.03 -0.44 0.00 -2.04 0.00 0.00 64.05 61.57 2a6p n THR 28 Cb 0.37 -1.71 -0.02 0.00 -1.82 0.00 0.00 70.33 67.15 2a6p n THR 28 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2a6p s GLU 29 N 0.85 3.79 0.05 -2.82 0.41 -1.26 -5.00 118.70 114.72 2a6p s GLU 29 Ca 0.76 -2.02 -0.08 0.00 -0.41 0.00 0.00 54.97 53.23 2a6p s GLU 29 Cb -0.61 -5.04 -0.05 0.00 -1.78 0.00 0.00 34.13 26.65 2a6p s GLU 29 CO 0.37 -1.83 0.34 0.08 -0.49 0.00 0.00 175.26 173.73 2a6p s VAL 30 N 2.56 5.19 0.43 2.63 1.01 -1.26 -5.05 120.40 125.91 2a6p s VAL 30 Ca 0.38 0.29 -0.04 0.00 0.00 0.00 0.00 61.98 62.61 2a6p s VAL 30 Cb -0.03 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2a6p s VAL 30 CO -0.05 0.30 0.71 -1.61 0.00 0.00 0.00 175.10 174.44 2a6p s GLU 31 N -1.92 3.56 0.42 2.72 0.41 -1.26 -4.18 118.70 118.45 2a6p s GLU 31 Ca 0.31 0.08 -0.23 0.00 -0.41 0.00 0.00 54.97 54.73 2a6p s GLU 31 Cb -0.13 -2.47 -0.09 0.00 -1.78 0.00 0.00 34.13 29.66 2a6p s GLU 31 CO 0.18 -0.07 1.06 -0.51 -0.49 0.00 0.00 175.26 175.43 2a6p s LEU 32 N -4.46 4.07 0.81 1.80 1.43 -1.26 -4.20 118.68 116.88 2a6p s LEU 32 Ca 0.46 2.06 -0.09 0.00 -1.03 0.00 0.00 54.13 55.52 2a6p s LEU 32 Cb -0.10 -4.25 0.12 0.00 0.03 0.00 0.00 46.19 41.99 2a6p s LEU 32 CO 0.40 -0.60 1.14 0.42 0.23 0.00 0.00 176.35 177.94 2a6p s THR 33 N -1.70 2.12 0.45 5.49 -4.23 -0.41 -4.82 115.64 112.55 2a6p s THR 33 Ca 0.60 -0.20 0.13 0.00 -1.18 0.00 0.00 61.69 61.04 2a6p s THR 33 Cb -0.22 -2.92 0.21 0.00 1.34 0.00 0.00 72.50 70.91 2a6p s THR 33 CO 0.27 0.00 2.02 0.44 -0.54 0.00 0.00 174.62 176.81 2a6p h ASP 34 N -1.00 0.07 0.24 3.99 3.32 -1.96 0.26 116.42 121.33 2a6p h ASP 34 Ca -0.43 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.48 2a6p h ASP 34 Cb 1.28 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 2a6p h ASP 34 CO 0.50 0.18 -0.49 0.74 -1.72 0.00 0.00 179.24 178.45 2a6p h THR 35 N 0.07 1.34 -0.50 0.35 2.02 -1.91 -2.50 112.91 111.78 2a6p h THR 35 Ca 0.02 -1.72 -0.10 0.00 0.77 0.00 0.00 66.41 65.38 2a6p h THR 35 Cb 0.23 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 2a6p h THR 35 CO 0.01 0.51 -0.08 1.23 0.37 0.00 0.00 175.52 177.57 2a6p h GLY 36 N 1.29 0.98 1.06 2.16 0.00 -0.71 -1.35 103.07 106.50 2a6p h GLY 36 Ca 0.01 -0.74 -0.09 0.00 0.00 0.00 0.00 47.33 46.51 2a6p h GLY 36 CO 0.08 0.68 0.04 3.21 0.00 0.00 0.00 176.54 180.56 2a6p h ARG 37 N 0.82 1.05 -0.48 4.80 3.08 -0.88 -1.95 114.38 120.83 2a6p h ARG 37 Ca 0.14 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.80 2a6p h ARG 37 Cb 0.60 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 2a6p h ARG 37 CO 0.04 1.01 0.01 1.15 -1.07 0.00 0.00 179.97 181.11 2a6p h THR 38 N 0.95 1.26 -0.13 2.04 2.02 -1.27 -1.38 112.91 116.40 2a6p h THR 38 Ca 0.18 -1.04 0.03 0.00 0.77 0.00 0.00 66.41 66.35 2a6p h THR 38 Cb 0.50 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 2a6p h THR 38 CO 0.02 0.36 -0.08 1.56 0.37 0.00 0.00 175.52 177.76 2a6p h GLN 39 N 0.69 -0.07 -0.59 6.66 4.20 -1.06 -0.27 115.11 124.67 2a6p h GLN 39 Ca 0.14 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.90 2a6p h GLN 39 Cb 0.49 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.24 2a6p h GLN 39 CO 0.02 -0.05 0.31 0.00 -0.67 0.00 0.00 178.83 178.45 2a6p h ALA 40 N 1.04 0.77 -0.63 3.87 0.00 -1.22 -0.33 119.26 122.77 2a6p h ALA 40 Ca 0.08 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2a6p h ALA 40 Cb 0.19 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2a6p h ALA 40 CO -0.18 -0.02 0.41 0.93 0.00 0.00 0.00 179.25 180.39 2a6p h GLU 41 N 0.59 0.81 -0.29 0.00 5.08 -0.61 -2.41 114.58 117.76 2a6p h GLU 41 Ca 0.26 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.46 2a6p h GLU 41 Cb 0.16 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2a6p h GLU 41 CO -0.17 0.54 -0.29 -0.07 -1.00 0.00 0.00 179.01 178.01 2a6p h LEU 42 N 0.83 0.61 -0.37 1.33 3.38 -0.45 -2.86 115.31 117.77 2a6p h LEU 42 Ca 0.23 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2a6p h LEU 42 Cb -0.08 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2a6p h LEU 42 CO -0.06 0.87 0.21 0.00 0.09 0.00 0.00 178.44 179.55 2a6p h ALA 43 N 1.17 0.48 0.00 1.53 0.00 -0.71 -0.36 119.26 121.37 2a6p h ALA 43 Ca 0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2a6p h ALA 43 Cb 0.76 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2a6p h ALA 43 CO 0.06 -0.01 -0.11 0.78 0.00 0.00 0.00 179.25 179.97 2a6p h GLY 44 N 0.48 0.00 0.91 0.00 0.00 -1.38 0.39 103.07 103.46 2a6p h GLY 44 Ca 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.41 2a6p h GLY 44 CO -0.02 0.00 0.00 -1.61 0.00 0.00 0.00 176.54 174.91 2a6p h GLN 45 N 0.00 0.59 -0.42 4.80 4.15 -1.13 -1.98 115.11 121.13 2a6p h GLN 45 Ca -0.00 -0.19 -0.12 0.00 0.77 0.00 0.00 58.65 59.11 2a6p h GLN 45 Cb 0.19 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 2a6p h GLN 45 CO 0.01 0.71 -0.22 1.25 -1.93 0.00 0.00 178.83 178.66 2a6p h LEU 46 N 0.40 0.85 -1.64 -2.39 5.85 0.64 -2.62 115.31 116.40 2a6p h LEU 46 Ca 0.10 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.46 2a6p h LEU 46 Cb 0.45 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2a6p h LEU 46 CO 0.02 1.04 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.89 2a6p h LEU 47 N 0.73 0.00 -1.35 2.25 -0.00 -0.17 -2.70 115.31 114.07 2a6p h LEU 47 Ca 0.10 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 58.00 2a6p h LEU 47 Cb 0.75 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.38 2a6p h LEU 47 CO 0.06 0.20 0.45 1.23 -0.00 0.00 0.00 178.44 180.38 2a6p h GLY 48 N 0.68 0.94 -3.00 0.83 0.00 -0.96 -2.19 103.07 99.37 2a6p h GLY 48 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2a6p h GLY 48 CO 0.03 0.32 0.00 -1.84 0.00 0.00 0.00 176.54 175.04 2a6p n GLU 49 N -4.45 3.97 0.00 4.80 0.28 -1.02 -3.96 120.64 120.26 2a6p n GLU 49 Ca 0.08 -2.57 0.13 0.00 -0.16 0.00 0.00 57.16 54.63 2a6p n GLU 49 Cb 0.08 -2.03 0.30 0.00 1.43 0.00 0.00 31.44 31.22 2a6p n GLU 49 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2a6p n LEU 50 N 0.66 1.99 -3.71 -1.84 4.77 -0.82 -4.99 117.00 113.05 2a6p n LEU 50 Ca 0.23 -0.66 -0.24 0.00 -0.03 0.00 0.00 56.01 55.31 2a6p n LEU 50 Cb 0.96 -0.02 0.01 0.00 -2.33 0.00 0.00 43.42 42.04 2a6p n LEU 50 CO 0.25 0.34 -0.14 -0.62 -1.33 0.00 0.00 177.39 175.89 2a6p n GLU 51 N 0.43 -1.33 -3.00 3.23 1.02 -1.25 -4.93 120.64 114.81 2a6p n GLU 51 Ca 0.15 0.76 -0.38 0.00 -0.02 0.00 0.00 57.16 57.67 2a6p n GLU 51 Cb 0.45 -2.96 -0.06 0.00 -0.02 0.00 0.00 31.44 28.85 2a6p n GLU 51 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2a6p s LEU 52 N -5.24 4.52 -0.58 -4.62 1.43 -1.26 -5.03 118.68 107.91 2a6p s LEU 52 Ca 0.09 1.60 -0.23 0.00 -1.03 0.00 0.00 54.13 54.57 2a6p s LEU 52 Cb -0.05 -3.40 0.05 0.00 0.03 0.00 0.00 46.19 42.83 2a6p s LEU 52 CO 0.88 0.15 0.90 -0.62 0.23 0.00 0.00 176.35 177.89 2a6p s ASP 53 N -1.29 6.27 -0.68 2.29 2.15 -1.26 -4.57 116.67 119.58 2a6p s ASP 53 Ca 0.38 -0.65 -0.19 0.00 0.43 0.00 0.00 52.55 52.51 2a6p s ASP 53 Cb -0.21 -2.41 0.03 0.00 -0.30 0.00 0.00 42.92 40.03 2a6p s ASP 53 CO 0.25 -1.24 0.38 -0.67 -0.17 0.00 0.00 175.17 173.72 2a6p n ASP 54 N 7.32 -2.32 -4.70 -0.34 2.03 -1.26 -2.05 116.55 115.24 2a6p n ASP 54 Ca -0.01 -0.73 -0.44 0.00 0.52 0.00 0.00 54.79 54.13 2a6p n ASP 54 Cb 0.46 -0.89 -0.02 0.00 -0.72 0.00 0.00 41.12 39.95 2a6p n ASP 54 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 2a6p n PRO 55 N -3.21 2.34 -3.64 -0.67 -0.02 -1.26 -4.42 135.00 124.12 2a6p n PRO 55 Ca -0.07 0.83 -0.37 0.00 -2.02 0.00 0.00 63.50 61.87 2a6p n PRO 55 Cb 0.32 -2.56 -0.11 0.00 -0.02 0.00 0.00 33.50 31.13 2a6p n PRO 55 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 2a6p s ILE 56 N 0.12 5.20 -0.28 4.25 2.07 -0.77 -4.97 121.20 126.82 2a6p s ILE 56 Ca 0.68 0.13 -0.10 0.00 -1.41 0.00 0.00 60.65 59.95 2a6p s ILE 56 Cb -0.59 -3.46 -0.04 0.00 0.13 0.00 0.00 42.46 38.51 2a6p s ILE 56 CO 0.47 0.29 0.17 -0.69 -1.91 0.00 0.00 174.94 173.26 2a6p s VAL 57 N 1.54 5.06 -0.14 4.00 1.01 -1.26 -1.75 120.40 128.86 2a6p s VAL 57 Ca 0.07 0.04 -0.03 0.00 0.00 0.00 0.00 61.98 62.06 2a6p s VAL 57 Cb -0.15 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 2a6p s VAL 57 CO 0.08 0.24 -0.05 -0.63 0.00 0.00 0.00 175.10 174.75 2a6p s ILE 58 N 1.72 3.84 0.07 2.22 1.09 -0.35 -0.50 121.20 129.29 2a6p s ILE 58 Ca 0.07 -0.39 0.06 0.00 -1.10 0.00 0.00 60.65 59.29 2a6p s ILE 58 Cb -0.16 -2.66 -0.03 0.00 -1.06 0.00 0.00 42.46 38.55 2a6p s ILE 58 CO 0.09 0.52 -0.17 0.00 -0.10 0.00 0.00 174.94 175.28 2a6p s SER 60 N -1.54 6.37 0.62 0.00 0.15 -0.60 -1.72 113.70 116.97 2a6p s SER 60 Ca 0.02 2.19 0.40 0.00 0.70 0.00 0.00 55.95 59.26 2a6p s SER 60 Cb -0.09 -2.59 1.95 0.00 -1.71 0.00 0.00 66.02 63.58 2a6p s SER 60 CO 0.02 -0.77 2.20 -0.65 1.20 0.00 0.00 173.24 175.24 2a6p h PRO 61 N 2.15 0.00 -6.99 5.44 0.11 -1.92 -3.37 132.00 127.42 2a6p h PRO 61 Ca -0.49 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.06 2a6p h PRO 61 Cb 1.23 0.00 0.16 0.00 0.11 0.00 0.00 31.00 32.50 2a6p h PRO 61 CO 0.61 0.00 0.38 0.54 -0.21 0.00 0.00 178.00 179.32 2a6p n ARG 62 N -3.09 1.12 -0.02 1.05 5.12 -1.26 -4.83 116.66 114.75 2a6p n ARG 62 Ca -0.01 0.43 -0.05 0.00 -1.93 0.00 0.00 57.85 56.29 2a6p n ARG 62 Cb 0.18 -2.40 0.16 0.00 -1.16 0.00 0.00 32.46 29.23 2a6p n ARG 62 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 2a6p h ARG 63 N 0.65 0.59 0.00 5.56 9.65 -1.88 -1.91 114.38 127.04 2a6p h ARG 63 Ca -0.50 -0.23 -0.03 0.00 -1.10 0.00 0.00 59.98 58.13 2a6p h ARG 63 Cb 1.34 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.89 2a6p h ARG 63 CO 0.53 0.78 -0.13 0.07 2.80 0.00 0.00 179.97 184.02 2a6p h ARG 64 N 0.52 0.00 0.17 0.20 0.11 -1.91 0.27 114.38 113.73 2a6p h ARG 64 Ca 0.08 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 59.82 2a6p h ARG 64 Cb 0.69 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.77 2a6p h ARG 64 CO 0.05 0.13 -1.67 1.79 0.10 0.00 0.00 179.97 180.36 2a6p h THR 65 N 0.00 1.02 -0.51 0.08 1.35 -1.79 -2.72 112.91 110.33 2a6p h THR 65 Ca -0.00 -2.61 -0.03 0.00 -0.55 0.00 0.00 66.41 63.21 2a6p h THR 65 Cb 0.23 2.77 -0.02 0.00 -1.73 0.00 0.00 68.15 69.40 2a6p h THR 65 CO 0.02 0.84 0.18 -0.07 -0.25 0.00 0.00 175.52 176.24 2a6p h LEU 66 N 0.10 0.72 -0.37 3.87 3.38 -1.03 -1.79 115.31 120.19 2a6p h LEU 66 Ca -0.31 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.50 2a6p h LEU 66 Cb 2.08 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 42.61 2a6p h LEU 66 CO 0.18 0.71 0.20 -0.78 0.09 0.00 0.00 178.44 178.84 2a6p h ASP 67 N 0.69 0.31 -0.39 -0.43 1.82 -0.59 -2.12 116.42 115.71 2a6p h ASP 67 Ca 0.17 0.01 0.04 0.00 -0.39 0.00 0.00 57.03 56.85 2a6p h ASP 67 Cb 0.23 -0.05 -0.04 0.00 0.68 0.00 0.00 39.33 40.16 2a6p h ASP 67 CO -0.01 0.22 0.17 0.74 -1.61 0.00 0.00 179.24 178.75 2a6p h THR 68 N 0.41 0.94 -0.43 2.25 2.02 -1.16 -0.28 112.91 116.66 2a6p h THR 68 Ca 0.15 -0.12 0.04 0.00 0.77 0.00 0.00 66.41 67.25 2a6p h THR 68 Cb 0.04 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 66.97 2a6p h THR 68 CO -0.09 0.06 0.19 0.00 0.37 0.00 0.00 175.52 176.05 2a6p h ALA 69 N 1.22 0.52 -0.05 6.16 0.00 -0.98 0.34 119.26 126.47 2a6p h ALA 69 Ca 0.17 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2a6p h ALA 69 Cb 0.10 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2a6p h ALA 69 CO -0.14 -0.18 0.03 -0.22 0.00 0.00 0.00 179.25 178.74 2a6p h LYS 70 N 0.38 0.07 -0.03 0.00 3.64 -1.05 -0.05 116.57 119.53 2a6p h LYS 70 Ca 0.19 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2a6p h LYS 70 Cb 0.13 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 2a6p h LYS 70 CO -0.16 0.13 -0.17 -0.07 -2.27 0.00 0.00 179.45 176.92 2a6p h LEU 71 N -0.01 0.05 0.00 5.20 3.38 -0.70 -0.14 115.31 123.09 2a6p h LEU 71 Ca 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2a6p h LEU 71 Cb 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2a6p h LEU 71 CO -0.00 0.22 0.00 0.00 0.09 0.00 0.00 178.44 178.75 2a6p n ALA 72 N -2.50 2.39 -1.83 1.53 0.00 0.12 -4.11 120.51 116.11 2a6p n ALA 72 Ca -0.02 -0.14 -0.05 0.00 0.00 0.00 0.00 53.44 53.23 2a6p n ALA 72 Cb 0.25 -1.44 -0.01 0.00 0.00 0.00 0.00 19.45 18.26 2a6p n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a6p n GLY 73 N 0.88 0.33 3.94 0.00 0.00 -0.07 -4.20 105.19 106.07 2a6p n GLY 73 Ca 0.15 -0.74 -0.26 0.00 0.00 0.00 0.00 46.02 45.17 2a6p n GLY 73 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a6p s LEU 74 N -1.23 4.33 -0.23 0.99 1.43 -0.06 -5.03 118.68 118.88 2a6p s LEU 74 Ca 0.00 0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 53.24 2a6p s LEU 74 Cb 0.00 -2.92 -0.00 0.00 0.03 0.00 0.00 46.19 43.29 2a6p s LEU 74 CO 0.00 0.04 -0.03 0.42 0.23 0.00 0.00 176.35 177.01 2a6p s THR 75 N -1.76 3.39 0.03 5.49 -4.23 -1.26 -4.40 115.64 112.91 2a6p s THR 75 Ca 0.35 -0.55 -0.30 0.00 -1.18 0.00 0.00 61.69 60.01 2a6p s THR 75 Cb -0.11 -2.57 -0.04 0.00 1.34 0.00 0.00 72.50 71.12 2a6p s THR 75 CO 0.29 0.38 1.01 -0.69 -0.54 0.00 0.00 174.62 175.06 2a6p s VAL 76 N 1.47 4.66 -0.14 2.29 1.01 -1.26 -4.58 120.40 123.85 2a6p s VAL 76 Ca 0.05 1.97 0.05 0.00 0.00 0.00 0.00 61.98 64.05 2a6p s VAL 76 Cb -0.15 -4.26 -0.23 0.00 0.00 0.00 0.00 36.38 31.74 2a6p s VAL 76 CO -0.03 0.19 0.29 0.59 0.00 0.00 0.00 175.10 176.14 2a6p n ASN 77 N 3.66 1.35 -3.77 3.32 3.02 0.35 -4.95 115.26 118.23 2a6p n ASN 77 Ca 0.06 0.17 -0.13 0.00 -0.03 0.00 0.00 54.58 54.64 2a6p n ASN 77 Cb 0.50 -0.21 -0.14 0.00 -0.61 0.00 0.00 39.78 39.32 2a6p n ASN 77 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2a6p s GLU 78 N -2.55 0.09 -0.19 3.52 0.41 -0.84 -5.02 118.70 114.11 2a6p s GLU 78 Ca -0.17 0.30 -0.03 0.00 -0.41 0.00 0.00 54.97 54.67 2a6p s GLU 78 Cb 0.07 -0.13 -0.01 0.00 -1.78 0.00 0.00 34.13 32.28 2a6p s GLU 78 CO 0.77 -0.13 -0.08 0.08 -0.49 0.00 0.00 175.26 175.41 2a6p s VAL 79 N 0.91 3.22 -0.13 2.63 1.01 -1.26 -0.35 120.40 126.42 2a6p s VAL 79 Ca -0.07 -0.56 -0.14 0.00 0.00 0.00 0.00 61.98 61.21 2a6p s VAL 79 Cb -0.09 -2.43 0.04 0.00 0.00 0.00 0.00 36.38 33.90 2a6p s VAL 79 CO -0.04 0.46 0.39 0.28 0.00 0.00 0.00 175.10 176.19 2a6p s THR 80 N 1.14 0.01 -1.22 3.92 -1.32 -0.70 -4.96 115.64 112.51 2a6p s THR 80 Ca 0.01 -0.05 0.08 0.00 -1.21 0.00 0.00 61.69 60.53 2a6p s THR 80 Cb -0.14 -0.57 0.10 0.00 -1.51 0.00 0.00 72.50 70.38 2a6p s THR 80 CO -0.02 -0.03 1.18 0.61 -2.21 0.00 0.00 174.62 174.15 2a6p n GLY 81 N 2.68 -0.65 0.33 6.08 0.00 -1.26 -2.24 105.19 110.13 2a6p n GLY 81 Ca -0.14 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 45.98 2a6p n GLY 81 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2a6p h LEU 82 N 0.00 0.08 -2.41 0.99 5.85 -1.94 -0.18 115.31 117.70 2a6p h LEU 82 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2a6p h LEU 82 Cb 0.10 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.11 2a6p h LEU 82 CO 0.00 0.05 0.00 0.18 -0.34 0.00 0.00 178.44 178.33 2a6p n LEU 83 N -4.46 3.51 -4.73 2.25 4.77 -0.95 -4.91 117.00 112.48 2a6p n LEU 83 Ca 0.04 -1.75 -0.34 0.00 -0.03 0.00 0.00 56.01 53.93 2a6p n LEU 83 Cb 0.34 -0.44 0.09 0.00 -2.33 0.00 0.00 43.42 41.08 2a6p n LEU 83 CO 0.35 0.88 0.79 0.00 -1.33 0.00 0.00 177.39 178.08 2a6p s ALA 84 N -1.12 2.16 0.99 -1.18 0.00 -0.08 -4.28 121.76 118.25 2a6p s ALA 84 Ca 0.44 0.84 -0.12 0.00 0.00 0.00 0.00 51.96 53.12 2a6p s ALA 84 Cb 0.23 -3.45 0.19 0.00 0.00 0.00 0.00 23.12 20.08 2a6p s ALA 84 CO 0.30 -1.80 1.08 -2.00 0.00 0.00 0.00 175.76 173.34 2a6p s GLU 85 N -3.92 0.45 0.19 0.00 2.56 -1.26 -4.81 118.70 111.90 2a6p s GLU 85 Ca 0.74 0.87 -0.33 0.00 0.00 0.00 0.00 54.97 56.24 2a6p s GLU 85 Cb -0.28 -1.71 -0.13 0.00 2.00 0.00 0.00 34.13 34.01 2a6p s GLU 85 CO 0.45 -2.81 1.62 1.87 -0.56 0.00 0.00 175.26 175.82 2a6p n TRP 86 N -4.28 2.45 -2.22 5.30 -0.00 -1.26 -4.88 117.44 112.55 2a6p n TRP 86 Ca 0.06 0.20 -0.43 0.00 -0.00 0.00 0.00 57.50 57.34 2a6p n TRP 86 Cb 0.55 -2.58 -0.02 0.00 -0.00 0.00 0.00 31.31 29.25 2a6p n TRP 86 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 2a6p s ASP 87 N 0.93 6.16 0.00 5.87 -1.08 -1.26 -4.55 116.67 122.74 2a6p s ASP 87 Ca 0.76 0.97 0.31 0.00 -0.52 0.00 0.00 52.55 54.07 2a6p s ASP 87 Cb -0.61 -2.54 1.66 0.00 -1.46 0.00 0.00 42.92 39.97 2a6p s ASP 87 CO 0.37 -1.55 2.10 -1.22 0.52 0.00 0.00 175.17 175.39 2a6p n TYR 88 N 9.40 0.00 0.00 -5.34 4.02 -1.26 -1.27 117.16 122.71 2a6p n TYR 88 Ca 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.08 2a6p n TYR 88 Cb 0.48 -0.10 0.00 0.00 -0.02 0.00 0.00 39.34 39.70 2a6p n TYR 88 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2a6p n GLY 89 N 1.13 2.47 0.28 2.72 0.00 -1.26 -0.71 105.19 109.82 2a6p n GLY 89 Ca 0.20 0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.56 2a6p n GLY 89 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2a6p h SER 90 N 0.00 0.00 0.47 1.61 0.02 -0.51 -2.37 113.55 112.77 2a6p h SER 90 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2a6p h SER 90 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2a6p h SER 90 CO 0.00 0.00 -0.08 -1.22 -1.14 0.00 0.00 176.83 174.39 2a6p n TYR 91 N -4.29 0.00 -1.59 3.45 0.53 0.11 -4.91 117.16 110.47 2a6p n TYR 91 Ca -0.02 0.00 -0.54 0.00 -1.02 0.00 0.00 57.90 56.32 2a6p n TYR 91 Cb 0.14 -0.23 -0.07 0.00 -1.03 0.00 0.00 39.34 38.15 2a6p n TYR 91 CO 0.00 0.00 0.00 -1.91 -1.02 0.00 0.00 176.86 173.93 2a6p n GLU 92 N -1.12 0.89 0.00 -0.72 4.07 -0.89 -0.37 120.64 122.50 2a6p n GLU 92 Ca 0.14 0.32 0.00 0.00 -0.06 0.00 0.00 57.16 57.56 2a6p n GLU 92 Cb 0.27 -1.94 0.00 0.00 -0.06 0.00 0.00 31.44 29.71 2a6p n GLU 92 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2a6p n GLY 93 N 2.51 2.89 3.85 8.31 0.00 0.23 -4.98 105.19 118.00 2a6p n GLY 93 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 2a6p n GLY 93 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a6p s LEU 94 N 0.00 4.05 0.54 0.99 1.43 0.51 -4.47 118.68 121.73 2a6p s LEU 94 Ca 0.00 1.33 -0.00 0.00 -1.03 0.00 0.00 54.13 54.42 2a6p s LEU 94 Cb 0.00 -4.12 0.03 0.00 0.03 0.00 0.00 46.19 42.12 2a6p s LEU 94 CO 0.00 -0.22 0.78 0.42 0.23 0.00 0.00 176.35 177.56 2a6p s THR 95 N -2.00 3.02 0.19 5.49 -4.23 -1.26 -1.86 115.64 114.99 2a6p s THR 95 Ca 0.55 -0.54 -0.10 0.00 -1.18 0.00 0.00 61.69 60.41 2a6p s THR 95 Cb -0.10 -3.15 0.12 0.00 1.34 0.00 0.00 72.50 70.71 2a6p s THR 95 CO 0.17 -0.11 1.79 0.74 -0.54 0.00 0.00 174.62 176.67 2a6p h THR 96 N 0.07 1.23 -0.22 3.99 2.02 -1.95 -1.00 112.91 117.04 2a6p h THR 96 Ca -0.43 -0.63 -0.01 0.00 0.77 0.00 0.00 66.41 66.11 2a6p h THR 96 Cb 1.29 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 2a6p h THR 96 CO 0.55 0.26 0.11 -0.65 0.37 0.00 0.00 175.52 176.16 2a6p h PRO 97 N 0.96 0.31 -0.80 6.66 0.11 -1.94 0.23 132.00 137.53 2a6p h PRO 97 Ca 0.24 -0.05 0.09 0.00 0.11 0.00 0.00 66.00 66.40 2a6p h PRO 97 Cb 0.10 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 31.08 2a6p h PRO 97 CO -0.03 0.33 0.45 1.96 -0.21 0.00 0.00 178.00 180.50 2a6p h GLN 98 N 0.23 0.74 -0.17 1.05 4.20 -1.89 0.35 115.11 119.62 2a6p h GLN 98 Ca 0.08 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.66 2a6p h GLN 98 Cb 0.11 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 2a6p h GLN 98 CO -0.01 0.49 -0.24 0.82 -0.67 0.00 0.00 178.83 179.22 2a6p h ILE 99 N 0.76 1.24 0.00 2.54 2.04 -0.74 -2.51 117.51 120.84 2a6p h ILE 99 Ca 0.39 -1.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 2a6p h ILE 99 Cb 0.35 1.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.81 2a6p h ILE 99 CO -0.25 0.35 -0.16 -0.09 0.00 0.00 0.00 178.15 178.01 2a6p h ARG 100 N 0.27 0.00 0.00 2.37 9.65 0.30 0.07 114.38 127.05 2a6p h ARG 100 Ca 0.04 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.92 2a6p h ARG 100 Cb 0.58 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.16 2a6p h ARG 100 CO 0.04 0.16 -0.00 0.93 2.80 0.00 0.00 179.97 183.89 2a6p h GLU 101 N 0.00 0.00 0.00 0.20 5.08 -0.70 -2.29 114.58 116.86 2a6p h GLU 101 Ca -0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 2a6p h GLU 101 Cb 0.39 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 2a6p h GLU 101 CO 0.02 0.00 -1.65 0.43 -1.00 0.00 0.00 179.01 176.82 2a6p n SER 102 N -3.11 3.08 -3.60 1.42 7.64 -0.87 -4.84 113.62 113.35 2a6p n SER 102 Ca -0.01 -0.06 -0.27 0.00 1.01 0.00 0.00 58.87 59.54 2a6p n SER 102 Cb 0.19 -0.09 -0.10 0.00 -1.01 0.00 0.00 64.21 63.19 2a6p n SER 102 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2a6p n GLU 103 N -2.79 1.46 -0.64 1.43 2.13 -0.04 -5.00 120.64 117.20 2a6p n GLU 103 Ca -0.20 -4.07 0.50 0.00 0.66 0.00 0.00 57.16 54.05 2a6p n GLU 103 Cb 0.72 -2.01 0.81 0.00 0.27 0.00 0.00 31.44 31.23 2a6p n GLU 103 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 2a6p h PRO 104 N 5.02 0.00 -0.43 5.31 0.11 -1.64 0.90 132.00 141.28 2a6p h PRO 104 Ca 0.18 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2a6p h PRO 104 Cb 0.78 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 2a6p h PRO 104 CO 0.63 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.02 2a6p n ASP 105 N -4.00 3.53 -4.75 -2.05 5.75 -1.26 -4.94 116.55 108.84 2a6p n ASP 105 Ca 0.41 -2.25 -0.42 0.00 -0.01 0.00 0.00 54.79 52.52 2a6p n ASP 105 Cb 1.88 -0.38 -0.01 0.00 -1.03 0.00 0.00 41.12 41.58 2a6p n ASP 105 CO 0.00 0.00 0.00 1.87 -0.11 0.00 0.00 177.20 178.96 2a6p n TRP 106 N 0.58 2.84 -3.74 2.11 -0.00 0.31 -5.00 117.44 114.54 2a6p n TRP 106 Ca 0.17 0.31 -0.12 0.00 -0.00 0.00 0.00 57.50 57.86 2a6p n TRP 106 Cb 0.61 -2.57 -0.12 0.00 -0.00 0.00 0.00 31.31 29.22 2a6p n TRP 106 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2a6p s LEU 107 N -0.81 0.49 0.44 5.87 1.43 -1.26 -5.00 118.68 119.84 2a6p s LEU 107 Ca 0.62 0.56 0.12 0.00 -1.03 0.00 0.00 54.13 54.40 2a6p s LEU 107 Cb -0.50 0.83 1.01 0.00 0.03 0.00 0.00 46.19 47.56 2a6p s LEU 107 CO 0.52 -0.15 2.02 1.62 0.23 0.00 0.00 176.35 180.59 2a6p h VAL 108 N 5.58 0.96 0.00 -1.59 3.04 -1.96 -0.87 116.25 121.42 2a6p h VAL 108 Ca -0.37 -0.14 -0.01 0.00 -1.01 0.00 0.00 66.70 65.17 2a6p h VAL 108 Cb 1.17 0.52 -0.00 0.00 -2.01 0.00 0.00 31.29 30.96 2a6p h VAL 108 CO 0.36 0.07 -0.05 -0.50 -1.01 0.00 0.00 177.57 176.44 2a6p h TRP 109 N 0.41 0.00 0.00 3.17 4.06 -1.90 -1.70 115.95 119.99 2a6p h TRP 109 Ca 0.22 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 61.01 2a6p h TRP 109 Cb 0.33 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.46 2a6p h TRP 109 CO -0.00 0.05 -1.61 0.25 -3.56 0.00 0.00 178.44 173.57 2a6p n THR 110 N -4.33 0.59 -0.12 1.49 -2.24 -0.90 -4.07 114.28 104.70 2a6p n THR 110 Ca -0.03 -0.38 -0.21 0.00 -2.27 0.00 0.00 64.05 61.17 2a6p n THR 110 Cb 0.14 -0.72 -0.12 0.00 -2.10 0.00 0.00 70.33 67.53 2a6p n THR 110 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2a6p n HIS 111 N -2.31 0.14 -2.43 4.78 8.25 -0.38 -4.96 115.22 118.31 2a6p n HIS 111 Ca -0.14 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 2a6p n HIS 111 Cb 0.77 -1.02 0.00 0.00 1.12 0.00 0.00 29.99 30.86 2a6p n HIS 111 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2a6p n GLY 112 N 2.03 -1.89 3.08 -1.41 0.00 -0.64 -4.72 105.19 101.65 2a6p n GLY 112 Ca -0.46 -1.66 -0.25 0.00 0.00 0.00 0.00 46.02 43.65 2a6p n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a6p s PRO 114 N 0.34 4.24 -0.17 0.00 0.04 -1.26 -1.87 135.00 136.32 2a6p s PRO 114 Ca -0.10 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.09 2a6p s PRO 114 Cb -0.14 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 30.81 2a6p s PRO 114 CO 0.03 -0.66 0.00 0.00 0.04 0.00 0.00 177.00 176.42 2a6p n ALA 115 N 5.51 -0.02 -3.00 8.56 0.00 -1.26 0.16 120.51 130.46 2a6p n ALA 115 Ca 0.14 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2a6p n ALA 115 Cb 0.42 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.37 2a6p n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a6p n GLY 116 N -2.61 5.41 3.78 0.00 0.00 -0.78 -4.26 105.19 106.73 2a6p n GLY 116 Ca -0.02 -1.24 -0.39 0.00 0.00 0.00 0.00 46.02 44.37 2a6p n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a6p s GLU 117 N 2.83 4.55 0.53 1.61 2.02 -0.39 -4.85 118.70 124.99 2a6p s GLU 117 Ca 0.00 1.13 -0.00 0.00 0.02 0.00 0.00 54.97 56.12 2a6p s GLU 117 Cb 0.00 -3.26 0.02 0.00 0.10 0.00 0.00 34.13 30.99 2a6p s GLU 117 CO 0.00 0.57 0.76 -1.54 0.02 0.00 0.00 175.26 175.08 2a6p s SER 118 N -1.13 5.49 0.17 -0.19 1.04 -1.26 -2.53 113.70 115.28 2a6p s SER 118 Ca 0.35 0.21 -0.14 0.00 0.48 0.00 0.00 55.95 56.85 2a6p s SER 118 Cb -0.23 -1.23 0.11 0.00 0.10 0.00 0.00 66.02 64.78 2a6p s SER 118 CO 0.26 -0.99 1.76 0.58 0.98 0.00 0.00 173.24 175.82 2a6p h VAL 119 N 0.13 0.89 -0.64 5.02 2.07 -1.87 -2.13 116.25 119.72 2a6p h VAL 119 Ca -0.44 -0.12 0.11 0.00 0.82 0.00 0.00 66.70 67.07 2a6p h VAL 119 Cb 1.28 0.50 -0.08 0.00 -1.52 0.00 0.00 31.29 31.47 2a6p h VAL 119 CO 0.56 0.07 0.21 0.00 0.02 0.00 0.00 177.57 178.42 2a6p h ALA 120 N 1.27 0.83 -0.69 1.67 0.00 -1.97 0.30 119.26 120.67 2a6p h ALA 120 Ca 0.20 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 2a6p h ALA 120 Cb 0.17 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 2a6p h ALA 120 CO -0.19 -0.23 0.13 1.96 0.00 0.00 0.00 179.25 180.92 2a6p h GLN 121 N 0.37 1.12 -0.00 0.00 4.20 -1.79 -1.91 115.11 117.10 2a6p h GLN 121 Ca 0.34 -0.29 -0.18 0.00 0.06 0.00 0.00 58.65 58.58 2a6p h GLN 121 Cb 0.47 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 2a6p h GLN 121 CO -0.36 1.01 -0.81 0.28 -0.67 0.00 0.00 178.83 178.27 2a6p h VAL 122 N 1.06 1.52 -0.50 -0.54 2.07 -0.78 -1.53 116.25 117.55 2a6p h VAL 122 Ca 0.21 -2.61 0.03 0.00 0.82 0.00 0.00 66.70 65.15 2a6p h VAL 122 Cb 0.42 2.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.58 2a6p h VAL 122 CO 0.01 0.75 0.28 -1.13 0.02 0.00 0.00 177.57 177.51 2a6p h ASN 123 N 0.06 0.44 -0.26 0.57 -0.73 -0.15 0.26 115.58 115.78 2a6p h ASN 123 Ca -0.02 0.01 -0.17 0.00 1.87 0.00 0.00 56.30 57.99 2a6p h ASN 123 Cb 1.42 -0.08 -0.00 0.00 0.27 0.00 0.00 38.32 39.93 2a6p h ASN 123 CO 0.12 0.31 -0.48 0.44 -0.37 0.00 0.00 177.43 177.44 2a6p h ASP 124 N 0.56 0.91 -0.65 1.15 3.32 -1.26 -1.51 116.42 118.94 2a6p h ASP 124 Ca 0.21 -0.46 -0.07 0.00 0.02 0.00 0.00 57.03 56.73 2a6p h ASP 124 Cb 0.05 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 2a6p h ASP 124 CO -0.11 1.24 0.12 -0.09 -1.72 0.00 0.00 179.24 178.68 2a6p h ARG 125 N 0.66 1.06 -0.36 3.56 2.43 -0.89 -1.45 114.38 119.39 2a6p h ARG 125 Ca 0.03 -0.28 -0.01 0.00 -0.81 0.00 0.00 59.98 58.92 2a6p h ARG 125 Cb 1.07 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 2a6p h ARG 125 CO 0.11 0.97 0.19 0.00 -1.51 0.00 0.00 179.97 179.73 2a6p h ALA 126 N 1.04 0.46 -0.80 2.80 0.00 -0.39 -1.65 119.26 120.72 2a6p h ALA 126 Ca 0.20 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2a6p h ALA 126 Cb 0.41 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2a6p h ALA 126 CO 0.01 0.00 0.33 -0.44 0.00 0.00 0.00 179.25 179.15 2a6p h ASP 127 N 0.45 1.10 -0.88 0.00 3.32 -1.06 -1.28 116.42 118.07 2a6p h ASP 127 Ca 0.12 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 2a6p h ASP 127 Cb 0.08 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 39.31 2a6p h ASP 127 CO -0.02 0.97 0.50 0.28 -1.72 0.00 0.00 179.24 179.26 2a6p h SER 128 N 1.16 1.08 -0.58 6.45 0.02 -1.01 0.02 113.55 120.69 2a6p h SER 128 Ca 0.27 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 2a6p h SER 128 Cb 0.21 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 2a6p h SER 128 CO -0.02 0.85 0.25 0.00 -1.14 0.00 0.00 176.83 176.77 2a6p h ALA 129 N 1.33 0.75 -0.74 3.77 0.00 -0.69 0.61 119.26 124.29 2a6p h ALA 129 Ca 0.31 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2a6p h ALA 129 Cb -0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2a6p h ALA 129 CO -0.05 0.34 0.25 0.28 0.00 0.00 0.00 179.25 180.07 2a6p h VAL 130 N 0.79 1.26 -0.79 0.00 2.07 -0.70 -1.90 116.25 116.99 2a6p h VAL 130 Ca 0.20 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 2a6p h VAL 130 Cb 0.16 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 2a6p h VAL 130 CO -0.02 0.35 0.41 0.00 0.02 0.00 0.00 177.57 178.32 2a6p h ALA 131 N 1.13 1.02 -0.06 1.67 0.00 -0.47 -1.63 119.26 120.91 2a6p h ALA 131 Ca 0.24 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2a6p h ALA 131 Cb 0.28 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 2a6p h ALA 131 CO -0.01 0.56 0.04 1.25 0.00 0.00 0.00 179.25 181.08 2a6p h LEU 132 N 1.11 0.07 -0.03 0.00 5.85 -0.50 -3.00 115.31 118.81 2a6p h LEU 132 Ca 0.27 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 59.01 2a6p h LEU 132 Cb 0.08 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 2a6p h LEU 132 CO -0.04 0.06 -0.14 0.00 -0.34 0.00 0.00 178.44 177.98 2a6p h ALA 133 N 1.02 -0.14 -0.47 1.25 0.00 -0.95 -2.53 119.26 117.43 2a6p h ALA 133 Ca 0.02 0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.09 2a6p h ALA 133 Cb -0.00 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2a6p h ALA 133 CO -0.00 -0.63 0.36 -0.07 0.00 0.00 0.00 179.25 178.91 2a6p h LEU 134 N -0.22 0.00 -0.48 0.00 3.38 -1.26 -0.47 115.31 116.26 2a6p h LEU 134 Ca 0.06 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.86 2a6p h LEU 134 Cb 0.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2a6p h LEU 134 CO -0.16 0.00 -0.66 -0.08 0.09 0.00 0.00 178.44 177.63 2a6p h GLU 135 N 0.00 0.40 0.00 1.13 4.81 -1.31 -3.25 114.58 116.37 2a6p h GLU 135 Ca 0.23 -0.30 -0.20 0.00 -0.13 0.00 0.00 59.36 58.95 2a6p h GLU 135 Cb 0.94 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 2a6p h GLU 135 CO -0.00 0.92 -1.38 0.45 -0.73 0.00 0.00 179.01 178.28 2a6p h HIS 136 N 0.29 0.00 0.00 0.92 3.86 -1.27 -3.31 115.15 115.63 2a6p h HIS 136 Ca -0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2a6p h HIS 136 Cb 1.22 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.69 2a6p h HIS 136 CO 0.04 0.74 0.00 -1.33 0.86 0.00 0.00 177.93 178.24 2a6p n MET 137 N -3.02 0.11 0.28 2.45 2.81 -0.28 -1.26 117.12 118.22 2a6p n MET 137 Ca -0.10 0.22 0.18 0.00 -1.81 0.00 0.00 57.70 56.19 2a6p n MET 137 Cb 0.91 -1.50 0.73 0.00 -0.71 0.00 0.00 33.22 32.64 2a6p n MET 137 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2a6p h SER 138 N 0.00 0.00 0.00 7.83 0.87 -1.65 -3.35 113.55 117.25 2a6p h SER 138 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2a6p h SER 138 Cb 0.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 2a6p h SER 138 CO 0.00 0.00 -0.01 -1.54 -0.53 0.00 0.00 176.83 174.75 2a6p n SER 139 N -3.09 0.04 -3.87 6.23 3.41 -0.59 -5.05 113.62 110.71 2a6p n SER 139 Ca 0.00 -0.01 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 2a6p n SER 139 Cb 0.29 0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.22 2a6p n SER 139 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2a6p s ARG 140 N -0.03 1.65 0.43 4.33 1.70 -0.39 -4.99 118.95 121.65 2a6p s ARG 140 Ca 0.00 -1.25 -0.16 0.00 -0.47 0.00 0.00 55.73 53.85 2a6p s ARG 140 Cb 0.00 0.50 -0.08 0.00 -0.57 0.00 0.00 34.95 34.80 2a6p s ARG 140 CO 0.00 -0.71 0.88 -0.51 -1.08 0.00 0.00 175.30 173.88 2a6p s ASP 141 N -3.02 6.70 -0.05 -2.89 1.01 -0.87 -3.34 116.67 114.22 2a6p s ASP 141 Ca 0.21 1.44 0.06 0.00 0.71 0.00 0.00 52.55 54.97 2a6p s ASP 141 Cb -0.02 -2.45 -0.01 0.00 1.01 0.00 0.00 42.92 41.45 2a6p s ASP 141 CO 0.10 -0.42 -0.24 -0.69 0.21 0.00 0.00 175.17 174.13 2a6p s VAL 142 N -2.34 2.15 -0.14 -1.27 1.01 -0.48 -1.84 120.40 117.49 2a6p s VAL 142 Ca 0.57 -1.04 -0.00 0.00 0.00 0.00 0.00 61.98 61.51 2a6p s VAL 142 Cb -0.10 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.53 2a6p s VAL 142 CO 0.24 0.57 -0.11 -0.22 0.00 0.00 0.00 175.10 175.59 2a6p s LEU 143 N -0.30 1.50 -0.22 3.92 2.96 -0.72 0.12 118.68 125.95 2a6p s LEU 143 Ca 0.01 -0.44 -0.09 0.00 -0.22 0.00 0.00 54.13 53.38 2a6p s LEU 143 Cb -0.13 -1.02 -0.05 0.00 0.50 0.00 0.00 46.19 45.50 2a6p s LEU 143 CO 0.02 -0.10 0.12 -0.36 -1.32 0.00 0.00 176.35 174.72 2a6p s PHE 144 N 1.59 3.29 -0.38 5.38 0.08 0.12 -1.21 117.98 126.85 2a6p s PHE 144 Ca 0.04 0.15 -0.09 0.00 0.12 0.00 0.00 56.93 57.15 2a6p s PHE 144 Cb -0.13 -2.19 0.05 0.00 -0.57 0.00 0.00 43.02 40.18 2a6p s PHE 144 CO -0.09 0.10 0.19 0.08 -0.10 0.00 0.00 175.22 175.39 2a6p s VAL 145 N 0.78 4.19 0.00 -0.44 1.01 -0.21 -0.10 120.40 125.64 2a6p s VAL 145 Ca 0.06 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 60.89 2a6p s VAL 145 Cb -0.13 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.82 2a6p s VAL 145 CO 0.02 -0.32 0.00 -0.24 0.00 0.00 0.00 175.10 174.56 2a6p n SER 146 N 4.91 0.13 -4.68 3.32 2.88 -0.28 -1.55 113.62 118.35 2a6p n SER 146 Ca -0.11 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.15 2a6p n SER 146 Cb 0.44 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.81 2a6p n SER 146 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2a6p s HIS 147 N 1.22 2.41 0.04 0.66 3.76 -1.26 -2.63 115.29 119.50 2a6p s HIS 147 Ca 0.00 -0.70 -0.17 0.00 -0.15 0.00 0.00 55.06 54.05 2a6p s HIS 147 Cb 0.00 -1.81 -0.08 0.00 1.11 0.00 0.00 32.58 31.81 2a6p s HIS 147 CO 0.00 0.32 1.26 0.78 -0.85 0.00 0.00 174.74 176.25 2a6p h GLY 148 N 1.59 -1.09 0.86 -2.22 0.00 -1.95 0.42 103.07 100.68 2a6p h GLY 148 Ca -0.43 0.51 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 2a6p h GLY 148 CO 0.76 -0.35 0.02 0.45 0.00 0.00 0.00 176.54 177.43 2a6p h HIS 149 N -0.42 0.49 -0.63 5.60 3.86 -1.98 -2.41 115.15 119.66 2a6p h HIS 149 Ca -0.02 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.09 2a6p h HIS 149 Cb 0.39 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.70 2a6p h HIS 149 CO -0.27 0.59 0.28 0.35 0.86 0.00 0.00 177.93 179.74 2a6p h PHE 150 N 0.24 0.93 -0.73 2.45 3.57 -1.87 0.52 116.94 122.06 2a6p h PHE 150 Ca 0.08 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.57 2a6p h PHE 150 Cb 0.38 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 38.79 2a6p h PHE 150 CO 0.03 0.72 0.43 0.77 -2.23 0.00 0.00 178.31 178.04 2a6p h SER 151 N 0.87 0.68 -0.22 0.41 0.02 -0.88 0.13 113.55 114.56 2a6p h SER 151 Ca 0.21 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.13 2a6p h SER 151 Cb 0.16 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2a6p h SER 151 CO -0.02 0.45 -0.00 0.03 -1.14 0.00 0.00 176.83 176.15 2a6p h ARG 152 N 0.82 0.51 -0.15 3.45 3.08 -0.89 -0.69 114.38 120.51 2a6p h ARG 152 Ca 0.31 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 2a6p h ARG 152 Cb 0.12 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2a6p h ARG 152 CO -0.15 0.54 0.05 0.00 -1.07 0.00 0.00 179.97 179.34 2a6p h ALA 153 N 1.51 0.20 -0.42 0.04 0.00 0.92 0.14 119.26 121.65 2a6p h ALA 153 Ca 0.11 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2a6p h ALA 153 Cb 0.32 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2a6p h ALA 153 CO 0.01 -0.19 0.27 0.28 0.00 0.00 0.00 179.25 179.62 2a6p h VAL 154 N 0.07 1.09 -0.22 0.00 2.07 -0.36 -1.40 116.25 117.50 2a6p h VAL 154 Ca 0.05 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2a6p h VAL 154 Cb 0.21 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2a6p h VAL 154 CO -0.00 0.10 0.13 0.40 0.02 0.00 0.00 177.57 178.22 2a6p h ILE 155 N 0.55 1.09 -0.92 4.57 2.04 -0.94 0.25 117.51 124.13 2a6p h ILE 155 Ca 0.16 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.89 2a6p h ILE 155 Cb -0.04 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 36.81 2a6p h ILE 155 CO -0.05 0.08 0.60 0.74 0.00 0.00 0.00 178.15 179.52 2a6p h THR 156 N 0.27 1.05 0.04 -0.27 2.02 -0.49 -1.84 112.91 113.69 2a6p h THR 156 Ca 0.08 -0.36 -0.22 0.00 0.77 0.00 0.00 66.41 66.68 2a6p h THR 156 Cb 0.02 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.35 2a6p h THR 156 CO -0.01 0.19 -1.01 0.03 0.37 0.00 0.00 175.52 175.09 2a6p h ARG 157 N 1.04 0.22 -0.76 6.66 2.47 -0.87 -1.81 114.38 121.32 2a6p h ARG 157 Ca 0.40 -0.29 0.06 0.00 -1.26 0.00 0.00 59.98 58.90 2a6p h ARG 157 Cb 0.23 0.09 -0.06 0.00 -1.65 0.00 0.00 29.97 28.59 2a6p h ARG 157 CO -0.16 1.05 0.45 2.35 0.56 0.00 0.00 179.97 184.23 2a6p h TRP 158 N 0.10 0.83 -0.21 3.04 2.91 0.26 -0.02 115.95 122.87 2a6p h TRP 158 Ca -0.07 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.98 2a6p h TRP 158 Cb 1.68 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 30.07 2a6p h TRP 158 CO 0.04 0.41 0.00 1.33 -1.03 0.00 0.00 178.44 179.19 2a6p n VAL 159 N -4.70 0.42 -3.79 2.65 0.24 -0.79 -4.72 118.33 107.64 2a6p n VAL 159 Ca 0.10 -0.32 -0.25 0.00 -2.04 0.00 0.00 64.34 61.84 2a6p n VAL 159 Cb 0.17 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 32.57 2a6p n VAL 159 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2a6p n GLN 160 N 0.15 -5.04 -4.26 7.34 6.02 -0.02 -5.02 117.38 116.55 2a6p n GLN 160 Ca 0.07 0.60 -0.23 0.00 -0.01 0.00 0.00 57.00 57.43 2a6p n GLN 160 Cb 0.27 -5.25 -0.07 0.00 1.02 0.00 0.00 30.24 26.21 2a6p n GLN 160 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2a6p s LEU 161 N -6.91 3.21 0.53 1.08 1.43 -0.69 -5.03 118.68 112.30 2a6p s LEU 161 Ca 0.23 -0.69 -0.21 0.00 -1.03 0.00 0.00 54.13 52.44 2a6p s LEU 161 Cb -0.12 -1.71 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 2a6p s LEU 161 CO 0.82 -0.08 1.25 -2.84 0.23 0.00 0.00 176.35 175.73 2a6p s PRO 162 N -3.71 3.30 0.61 1.29 0.02 -1.26 -4.48 135.00 130.77 2a6p s PRO 162 Ca 0.33 1.95 0.32 0.00 0.02 0.00 0.00 61.00 63.62 2a6p s PRO 162 Cb -0.05 -2.21 1.85 0.00 0.02 0.00 0.00 34.50 34.11 2a6p s PRO 162 CO 0.21 -0.98 2.18 1.25 -0.33 0.00 0.00 177.00 179.32 2a6p h LEU 163 N 1.48 0.00 -2.02 -5.54 6.46 -1.92 -0.94 115.31 112.83 2a6p h LEU 163 Ca -0.50 0.00 0.12 0.00 -0.12 0.00 0.00 57.88 57.38 2a6p h LEU 163 Cb 1.28 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.19 2a6p h LEU 163 CO 0.58 0.00 0.40 0.00 -0.62 0.00 0.00 178.44 178.80 2a6p h ALA 164 N 1.83 2.17 0.00 1.25 0.00 -1.89 -0.43 119.26 122.18 2a6p h ALA 164 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2a6p h ALA 164 Cb 0.29 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2a6p h ALA 164 CO -0.00 -0.61 0.00 0.39 0.00 0.00 0.00 179.25 179.03 2a6p n GLU 165 N -3.88 0.57 0.28 0.00 -0.58 -0.36 -3.63 120.64 113.05 2a6p n GLU 165 Ca 0.07 0.03 0.18 0.00 -0.42 0.00 0.00 57.16 57.02 2a6p n GLU 165 Cb 0.58 -1.50 0.98 0.00 -0.57 0.00 0.00 31.44 30.93 2a6p n GLU 165 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2a6p h GLY 166 N 4.06 0.00 2.00 0.62 0.00 -1.28 -0.42 103.07 108.06 2a6p h GLY 166 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2a6p h GLY 166 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 176.54 178.02 2a6p h SER 167 N 0.00 0.00 -0.04 0.19 4.64 -1.81 -3.12 113.55 113.40 2a6p h SER 167 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a6p h SER 167 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2a6p h SER 167 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 2a6p n ARG 168 N -2.92 1.45 -4.28 4.77 5.12 -0.17 -4.83 116.66 115.81 2a6p n ARG 168 Ca 0.01 -0.66 -0.25 0.00 -1.93 0.00 0.00 57.85 55.02 2a6p n ARG 168 Cb 0.32 -1.45 -0.17 0.00 -1.16 0.00 0.00 32.46 30.01 2a6p n ARG 168 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2a6p s PHE 169 N -1.96 1.46 0.67 -1.55 0.40 -1.18 -5.14 117.98 110.68 2a6p s PHE 169 Ca 0.38 -0.63 -0.11 0.00 -0.60 0.00 0.00 56.93 55.98 2a6p s PHE 169 Cb 0.20 -1.13 -0.01 0.00 0.51 0.00 0.00 43.02 42.59 2a6p s PHE 169 CO 0.32 -0.38 1.06 0.00 0.70 0.00 0.00 175.22 176.91 2a6p s ALA 170 N 1.12 3.00 -0.47 5.36 0.00 -1.26 -4.97 121.76 124.53 2a6p s ALA 170 Ca -0.06 -0.28 0.04 0.00 0.00 0.00 0.00 51.96 51.66 2a6p s ALA 170 Cb -0.14 -3.01 0.21 0.00 0.00 0.00 0.00 23.12 20.17 2a6p s ALA 170 CO -0.02 -0.95 0.84 -0.12 0.00 0.00 0.00 175.76 175.52 2a6p n MET 171 N -2.88 0.47 -1.35 0.00 0.00 -1.26 -4.64 117.12 107.46 2a6p n MET 171 Ca 0.06 -1.71 -0.29 0.00 0.00 0.00 0.00 57.70 55.77 2a6p n MET 171 Cb 0.56 -1.12 0.14 0.00 0.00 0.00 0.00 33.22 32.81 2a6p n MET 171 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 2a6p s PRO 172 N 0.84 1.08 0.28 2.12 0.04 -1.26 -4.72 135.00 133.38 2a6p s PRO 172 Ca 0.29 0.52 -0.30 0.00 0.04 0.00 0.00 61.00 61.55 2a6p s PRO 172 Cb 0.07 -1.81 -0.11 0.00 0.04 0.00 0.00 34.50 32.68 2a6p s PRO 172 CO -0.09 -2.29 1.60 0.95 0.04 0.00 0.00 177.00 177.21 2a6p s THR 173 N -3.09 2.10 -1.52 1.26 -4.23 -1.26 -2.02 115.64 106.88 2a6p s THR 173 Ca 0.64 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.23 2a6p s THR 173 Cb -0.17 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.62 2a6p s THR 173 CO 0.56 0.01 0.00 0.00 -0.54 0.00 0.00 174.62 174.65 2a6p n ALA 174 N 2.35 -0.37 -2.94 3.99 0.00 -0.51 -4.84 120.51 118.19 2a6p n ALA 174 Ca 0.09 0.19 -0.25 0.00 0.00 0.00 0.00 53.44 53.47 2a6p n ALA 174 Cb 0.37 -1.76 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 2a6p n ALA 174 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2a6p s SER 175 N -2.52 6.26 -0.06 0.00 1.04 -0.86 -4.59 113.70 112.96 2a6p s SER 175 Ca 0.00 0.12 0.05 0.00 0.48 0.00 0.00 55.95 56.60 2a6p s SER 175 Cb 0.00 -1.86 -0.02 0.00 0.10 0.00 0.00 66.02 64.25 2a6p s SER 175 CO 0.00 0.02 -0.21 -0.63 0.98 0.00 0.00 173.24 173.40 2a6p s ILE 176 N -1.81 2.40 0.05 -1.02 1.01 0.07 -1.75 121.20 120.16 2a6p s ILE 176 Ca 0.34 -0.94 0.09 0.00 0.00 0.00 0.00 60.65 60.14 2a6p s ILE 176 Cb -0.10 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 2a6p s ILE 176 CO 0.28 0.57 -0.25 -0.83 0.00 0.00 0.00 174.94 174.71 2a6p s GLY 177 N -0.24 1.35 -0.09 6.18 0.00 -0.63 -1.99 107.32 111.90 2a6p s GLY 177 Ca -0.00 -1.24 0.01 0.00 0.00 0.00 0.00 44.72 43.49 2a6p s GLY 177 CO 0.03 -1.14 -0.09 -0.42 0.00 0.00 0.00 173.10 171.48 2a6p s ILE 178 N -0.83 1.02 -0.09 0.90 1.01 0.80 -0.90 121.20 123.10 2a6p s ILE 178 Ca 0.11 -0.35 -0.01 0.00 0.00 0.00 0.00 60.65 60.40 2a6p s ILE 178 Cb -0.10 -0.99 -0.03 0.00 0.01 0.00 0.00 42.46 41.35 2a6p s ILE 178 CO 0.02 0.35 -0.03 0.00 0.00 0.00 0.00 174.94 175.28 2a6p n GLY 180 N 2.45 4.52 3.07 0.00 0.00 0.28 -1.26 105.19 114.25 2a6p n GLY 180 Ca -0.18 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 45.13 2a6p n GLY 180 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2a6p s PHE 181 N 0.49 0.38 -0.11 1.61 0.40 -1.26 -0.34 117.98 119.15 2a6p s PHE 181 Ca 0.00 -0.81 -0.04 0.00 -0.60 0.00 0.00 56.93 55.48 2a6p s PHE 181 Cb 0.00 -0.28 0.06 0.00 0.51 0.00 0.00 43.02 43.31 2a6p s PHE 181 CO 0.00 -0.34 0.17 -2.00 0.70 0.00 0.00 175.22 173.75 2a6p s GLU 182 N -3.09 0.07 -1.38 0.44 2.12 -0.22 -4.88 118.70 111.76 2a6p s GLU 182 Ca -0.01 0.48 -0.08 0.00 0.36 0.00 0.00 54.97 55.71 2a6p s GLU 182 Cb 0.02 -0.51 0.01 0.00 0.26 0.00 0.00 34.13 33.91 2a6p s GLU 182 CO -0.07 -0.38 0.39 0.72 -0.54 0.00 0.00 175.26 175.37 2a6p n HIS 183 N 5.32 -1.53 -0.64 5.30 8.25 -1.26 -1.28 115.22 129.39 2a6p n HIS 183 Ca -0.05 0.56 0.00 0.00 -0.26 0.00 0.00 57.72 57.97 2a6p n HIS 183 Cb 0.50 -3.28 0.00 0.00 1.12 0.00 0.00 29.99 28.33 2a6p n HIS 183 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2a6p n GLY 184 N -2.14 1.54 3.58 -1.41 0.00 -1.26 -5.04 105.19 100.46 2a6p n GLY 184 Ca -0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 2a6p n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a6p s VAL 185 N -3.58 4.16 0.12 1.61 1.01 -0.40 -5.07 120.40 118.26 2a6p s VAL 185 Ca 0.00 -0.28 -0.31 0.00 0.00 0.00 0.00 61.98 61.39 2a6p s VAL 185 Cb 0.00 -2.81 -0.09 0.00 0.00 0.00 0.00 36.38 33.49 2a6p s VAL 185 CO 0.00 0.53 1.54 -0.13 0.00 0.00 0.00 175.10 177.03 2a6p s ARG 186 N -0.06 4.24 0.04 2.72 0.52 -1.26 -1.05 118.95 124.09 2a6p s ARG 186 Ca 0.03 2.26 -0.02 0.00 -0.52 0.00 0.00 55.73 57.48 2a6p s ARG 186 Cb -0.13 -3.31 -0.02 0.00 0.52 0.00 0.00 34.95 32.01 2a6p s ARG 186 CO 0.02 -0.60 0.02 -1.14 0.02 0.00 0.00 175.30 173.62 2a6p s GLN 187 N 1.57 0.50 -0.30 3.54 0.74 0.54 -4.70 119.66 121.55 2a6p s GLN 187 Ca 0.69 -0.84 -0.22 0.00 0.05 0.00 0.00 55.36 55.04 2a6p s GLN 187 Cb -0.40 0.18 -0.01 0.00 1.10 0.00 0.00 33.01 33.88 2a6p s GLN 187 CO 0.31 -0.10 0.71 -1.17 -0.55 0.00 0.00 175.29 174.49 2a6p s LEU 188 N -2.13 4.11 -0.21 3.68 0.20 -1.26 -0.56 118.68 122.51 2a6p s LEU 188 Ca -0.05 0.58 -0.10 0.00 0.69 0.00 0.00 54.13 55.25 2a6p s LEU 188 Cb -0.01 -2.95 -0.20 0.00 -0.43 0.00 0.00 46.19 42.60 2a6p s LEU 188 CO -0.05 -0.53 0.05 0.00 -0.29 0.00 0.00 176.35 175.53 2a6p n ALA 189 N 6.02 1.04 -2.74 5.97 0.00 0.11 -4.94 120.51 125.97 2a6p n ALA 189 Ca 0.01 -0.78 -0.17 0.00 0.00 0.00 0.00 53.44 52.50 2a6p n ALA 189 Cb 0.48 -0.36 -0.13 0.00 0.00 0.00 0.00 19.45 19.44 2a6p n ALA 189 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2a6p s VAL 190 N -2.49 0.70 -0.05 0.00 1.01 -0.92 -4.95 120.40 113.71 2a6p s VAL 190 Ca -0.30 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 60.87 2a6p s VAL 190 Cb 0.09 -0.65 0.02 0.00 0.00 0.00 0.00 36.38 35.83 2a6p s VAL 190 CO 0.63 -0.03 0.25 -0.22 0.00 0.00 0.00 175.10 175.73 2a6p s LEU 191 N -0.81 1.07 -1.56 3.92 2.96 -1.26 -0.14 118.68 122.87 2a6p s LEU 191 Ca -0.01 0.21 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 2a6p s LEU 191 Cb -0.06 0.97 0.00 0.00 0.50 0.00 0.00 46.19 47.60 2a6p s LEU 191 CO 0.00 -0.28 0.00 0.61 -1.32 0.00 0.00 176.35 175.37 2a6p n GLY 192 N 2.03 0.53 3.70 7.98 0.00 -1.18 -4.95 105.19 113.31 2a6p n GLY 192 Ca -0.18 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 2a6p n GLY 192 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2a6p s LEU 193 N -4.32 4.34 -0.03 0.99 0.20 -0.84 -4.83 118.68 114.19 2a6p s LEU 193 Ca 0.00 2.10 0.03 0.00 0.69 0.00 0.00 54.13 56.94 2a6p s LEU 193 Cb 0.00 -3.57 0.00 0.00 -0.43 0.00 0.00 46.19 42.19 2a6p s LEU 193 CO 0.00 -0.60 -0.09 -0.89 -0.29 0.00 0.00 176.35 174.47 2a6p s THR 194 N 1.60 0.83 -2.12 3.68 2.01 -1.26 -0.75 115.64 119.62 2a6p s THR 194 Ca 0.61 -0.38 0.20 0.00 0.31 0.00 0.00 61.69 62.44 2a6p s THR 194 Cb -0.31 -0.74 0.40 0.00 0.01 0.00 0.00 72.50 71.85 2a6p s THR 194 CO 0.28 0.26 1.34 0.61 -0.69 0.00 0.00 174.62 176.42 2a6p n GLY 195 N 3.33 1.75 0.00 4.40 0.00 -1.26 -5.10 105.19 108.31 2a6p n GLY 195 Ca -0.19 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.17 2a6p n GLY 195 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93