#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 3.96 -4.67 6.15 5.03 -1.26 -4.84 115.26 119.63 2a6p n ASN 5 Ca 0.00 -2.12 -0.30 0.00 0.87 0.00 0.00 54.58 53.04 2a6p n ASN 5 Cb 0.00 -0.47 -0.10 0.00 -1.02 0.00 0.00 39.78 38.19 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 -1.22 2.30 0.15 3.10 3.76 -1.26 -5.05 115.29 117.08 2a6p s HIS 6 Ca 0.45 -0.76 0.06 0.00 -0.15 0.00 0.00 55.06 54.66 2a6p s HIS 6 Cb 0.25 -1.73 -0.04 0.00 1.11 0.00 0.00 32.58 32.17 2a6p s HIS 6 CO 0.28 0.37 -0.13 1.03 -0.85 0.00 0.00 174.74 175.44 2a6p s ARG 7 N -3.77 1.13 -0.30 1.40 0.52 -1.26 -4.78 118.95 111.89 2a6p s ARG 7 Ca 0.26 -1.41 -0.04 0.00 -0.52 0.00 0.00 55.73 54.02 2a6p s ARG 7 Cb 0.07 -0.89 0.03 0.00 0.52 0.00 0.00 34.95 34.69 2a6p s ARG 7 CO 0.13 0.15 0.02 -1.17 0.02 0.00 0.00 175.30 174.45 2a6p s LEU 8 N -2.93 3.81 0.05 2.53 2.96 -0.21 -1.60 118.68 123.29 2a6p s LEU 8 Ca 0.15 -1.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.04 2a6p s LEU 8 Cb -0.01 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.87 2a6p s LEU 8 CO 0.03 -0.23 0.11 -0.76 -1.32 0.00 0.00 176.35 174.18 2a6p s LEU 9 N 1.35 3.97 -0.03 -0.68 1.43 0.72 -0.46 118.68 124.97 2a6p s LEU 9 Ca -0.02 0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.22 2a6p s LEU 9 Cb -0.18 -2.53 0.00 0.00 0.03 0.00 0.00 46.19 43.51 2a6p s LEU 9 CO -0.00 0.20 -0.12 -0.76 0.23 0.00 0.00 176.35 175.90 2a6p s LEU 10 N -2.21 1.83 -0.13 1.79 1.02 -0.03 -0.88 118.68 120.06 2a6p s LEU 10 Ca 0.29 -0.26 0.01 0.00 0.02 0.00 0.00 54.13 54.19 2a6p s LEU 10 Cb -0.12 -0.73 0.02 0.00 0.02 0.00 0.00 46.19 45.37 2a6p s LEU 10 CO 0.21 0.10 -0.16 -0.22 0.02 0.00 0.00 176.35 176.30 2a6p s LEU 11 N 0.15 1.76 0.26 1.79 2.96 0.14 -1.65 118.68 124.10 2a6p s LEU 11 Ca -0.04 -0.48 -0.20 0.00 -0.22 0.00 0.00 54.13 53.19 2a6p s LEU 11 Cb -0.10 -1.19 -0.09 0.00 0.50 0.00 0.00 46.19 45.32 2a6p s LEU 11 CO 0.01 -0.01 0.77 -0.60 -1.32 0.00 0.00 176.35 175.20 2a6p s ARG 12 N 1.21 4.26 0.86 1.98 3.52 -0.74 -0.89 118.95 129.15 2a6p s ARG 12 Ca -0.01 0.92 -0.11 0.00 -0.13 0.00 0.00 55.73 56.40 2a6p s ARG 12 Cb -0.14 -2.76 0.11 0.00 -1.56 0.00 0.00 34.95 30.60 2a6p s ARG 12 CO -0.06 0.32 1.09 -3.38 -0.81 0.00 0.00 175.30 172.46 2a6p s HIS 13 N -1.65 2.30 1.28 5.12 -3.43 -1.07 -2.16 115.29 115.70 2a6p s HIS 13 Ca 0.47 1.41 -0.21 0.00 -0.80 0.00 0.00 55.06 55.93 2a6p s HIS 13 Cb -0.16 -3.13 0.32 0.00 -1.43 0.00 0.00 32.58 28.18 2a6p s HIS 13 CO 0.20 -2.28 1.05 0.20 -2.00 0.00 0.00 174.74 171.91 2a6p s GLY 14 N -3.30 1.52 0.51 -1.38 0.00 -1.26 -1.77 107.32 101.64 2a6p s GLY 14 Ca 0.63 -0.90 -0.22 0.00 0.00 0.00 0.00 44.72 44.23 2a6p s GLY 14 CO 0.57 0.03 1.23 1.85 0.00 0.00 0.00 173.10 176.78 2a6p s GLU 15 N -5.29 3.43 0.28 2.90 2.12 -1.26 -4.78 118.70 116.10 2a6p s GLU 15 Ca 0.70 1.92 0.02 0.00 0.36 0.00 0.00 54.97 57.97 2a6p s GLU 15 Cb -0.11 -2.27 -0.05 0.00 0.26 0.00 0.00 34.13 31.96 2a6p s GLU 15 CO 0.57 -0.86 0.10 0.95 -0.54 0.00 0.00 175.26 175.47 2a6p s THR 16 N -1.49 0.63 0.51 -1.70 -4.23 -1.26 -1.21 115.64 106.89 2a6p s THR 16 Ca 0.69 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 59.40 2a6p s THR 16 Cb -0.32 -2.64 0.27 0.00 1.34 0.00 0.00 72.50 71.15 2a6p s THR 16 CO 0.38 0.00 2.13 0.00 -0.54 0.00 0.00 174.62 176.59 2a6p h ALA 17 N 2.30 1.73 0.20 3.99 0.00 -1.94 -2.89 119.26 122.66 2a6p h ALA 17 Ca -0.38 -0.05 -0.29 0.00 0.00 0.00 0.00 54.91 54.18 2a6p h ALA 17 Cb 1.25 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 19.05 2a6p h ALA 17 CO 0.61 0.07 -1.33 -1.49 0.00 0.00 0.00 179.25 177.11 2a6p h TRP 18 N 0.00 0.77 -0.72 0.00 4.06 -1.92 -3.33 115.95 114.82 2a6p h TRP 18 Ca -0.00 -0.57 -0.02 0.00 2.06 0.00 0.00 58.89 60.37 2a6p h TRP 18 Cb 0.12 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 28.21 2a6p h TRP 18 CO 0.00 1.51 0.39 0.66 -3.56 0.00 0.00 178.44 177.44 2a6p h SER 19 N -0.05 0.91 -0.01 -3.49 4.64 -1.73 -1.28 113.55 112.53 2a6p h SER 19 Ca -0.24 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2a6p h SER 19 Cb 1.97 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 63.83 2a6p h SER 19 CO 0.21 0.75 0.01 0.71 -0.87 0.00 0.00 176.83 177.64 2a6p h THR 20 N 1.00 0.64 -0.02 2.95 1.35 -1.66 0.33 112.91 117.50 2a6p h THR 20 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.11 2a6p h THR 20 Cb 0.04 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 67.45 2a6p h THR 20 CO -0.04 0.00 -0.14 0.18 -0.25 0.00 0.00 175.52 175.27 2a6p n LEU 21 N -4.02 1.74 -0.23 3.87 4.77 -0.80 -4.93 117.00 117.40 2a6p n LEU 21 Ca -0.03 -0.57 -0.03 0.00 -0.03 0.00 0.00 56.01 55.35 2a6p n LEU 21 Cb 0.10 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 2a6p n LEU 21 CO 0.29 0.30 -0.03 0.61 -1.33 0.00 0.00 177.39 177.23 2a6p n GLY 22 N 1.29 0.62 3.75 -0.72 0.00 0.10 -4.93 105.19 105.30 2a6p n GLY 22 Ca 0.15 -0.77 -0.40 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.99 4.74 -0.25 1.61 0.52 -0.55 -4.21 118.95 118.82 2a6p s ARG 23 Ca 0.00 1.38 -0.29 0.00 -0.52 0.00 0.00 55.73 56.30 2a6p s ARG 23 Cb 0.00 -3.31 0.01 0.00 0.52 0.00 0.00 34.95 32.17 2a6p s ARG 23 CO 0.00 0.43 1.08 -1.01 0.02 0.00 0.00 175.30 175.82 2a6p s HIS 24 N -0.79 3.22 -0.24 -0.53 3.76 -0.80 -4.43 115.29 115.49 2a6p s HIS 24 Ca 0.41 1.33 -0.02 0.00 -0.15 0.00 0.00 55.06 56.63 2a6p s HIS 24 Cb -0.24 -3.43 0.02 0.00 1.11 0.00 0.00 32.58 30.04 2a6p s HIS 24 CO 0.30 -0.71 -0.06 0.99 -0.85 0.00 0.00 174.74 174.41 2a6p s THR 25 N 3.39 2.95 0.00 1.30 2.01 -1.26 -0.48 115.64 123.55 2a6p s THR 25 Ca 0.46 -0.92 0.00 0.00 0.31 0.00 0.00 61.69 61.53 2a6p s THR 25 Cb -0.15 -2.47 0.00 0.00 0.01 0.00 0.00 72.50 69.90 2a6p s THR 25 CO 0.10 0.25 0.00 0.61 -0.69 0.00 0.00 174.62 174.88 2a6p n GLY 26 N 4.69 0.36 0.15 4.40 0.00 -1.26 -4.87 105.19 108.66 2a6p n GLY 26 Ca -0.17 0.00 0.13 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 -4.57 -0.02 0.00 -1.91 -3.45 103.07 93.13 2a6p h GLY 27 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 2a6p h GLY 27 CO 0.00 0.00 0.98 -1.59 0.00 0.00 0.00 176.54 175.93 2a6p s THR 28 N -3.27 2.05 -1.03 4.70 2.01 -1.26 -4.91 115.64 113.93 2a6p s THR 28 Ca 0.07 0.03 -0.18 0.00 0.31 0.00 0.00 61.69 61.92 2a6p s THR 28 Cb 0.10 -3.02 0.13 0.00 0.01 0.00 0.00 72.50 69.72 2a6p s THR 28 CO 0.52 0.00 1.27 -1.61 -0.69 0.00 0.00 174.62 174.11 2a6p s GLU 29 N 0.76 3.74 0.04 4.92 0.41 -1.26 -5.00 118.70 122.31 2a6p s GLU 29 Ca 0.72 -1.91 -0.07 0.00 -0.41 0.00 0.00 54.97 53.30 2a6p s GLU 29 Cb -0.49 -5.04 -0.05 0.00 -1.78 0.00 0.00 34.13 26.77 2a6p s GLU 29 CO 0.36 -1.85 0.30 0.08 -0.49 0.00 0.00 175.26 173.66 2a6p s VAL 30 N 2.75 5.26 0.41 2.63 1.01 -1.26 -5.05 120.40 126.14 2a6p s VAL 30 Ca 0.38 0.18 -0.05 0.00 0.00 0.00 0.00 61.98 62.49 2a6p s VAL 30 Cb -0.03 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 2a6p s VAL 30 CO -0.06 0.31 0.70 -1.61 0.00 0.00 0.00 175.10 174.43 2a6p s GLU 31 N -1.91 3.58 0.40 2.72 0.41 -1.26 -4.18 118.70 118.46 2a6p s GLU 31 Ca 0.30 0.10 -0.24 0.00 -0.41 0.00 0.00 54.97 54.73 2a6p s GLU 31 Cb -0.13 -2.48 -0.09 0.00 -1.78 0.00 0.00 34.13 29.65 2a6p s GLU 31 CO 0.18 -0.04 1.04 -0.51 -0.49 0.00 0.00 175.26 175.43 2a6p s LEU 32 N -4.32 4.12 0.81 1.80 1.43 -1.26 -4.19 118.68 117.07 2a6p s LEU 32 Ca 0.46 2.00 -0.10 0.00 -1.03 0.00 0.00 54.13 55.46 2a6p s LEU 32 Cb -0.10 -4.22 0.12 0.00 0.03 0.00 0.00 46.19 42.02 2a6p s LEU 32 CO 0.39 -0.47 1.14 0.42 0.23 0.00 0.00 176.35 178.05 2a6p s THR 33 N -1.71 2.11 0.42 5.49 -4.23 -0.35 -4.80 115.64 112.57 2a6p s THR 33 Ca 0.58 -0.18 0.11 0.00 -1.18 0.00 0.00 61.69 61.02 2a6p s THR 33 Cb -0.21 -2.93 0.21 0.00 1.34 0.00 0.00 72.50 70.91 2a6p s THR 33 CO 0.26 0.00 2.00 0.44 -0.54 0.00 0.00 174.62 176.78 2a6p h ASP 34 N -1.01 0.22 0.11 3.99 3.32 -1.96 0.26 116.42 121.35 2a6p h ASP 34 Ca -0.44 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 56.47 2a6p h ASP 34 Cb 1.29 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 2a6p h ASP 34 CO 0.51 0.28 -0.42 0.74 -1.72 0.00 0.00 179.24 178.64 2a6p h THR 35 N 0.23 1.31 -0.55 0.35 2.02 -1.92 -2.60 112.91 111.76 2a6p h THR 35 Ca 0.06 -1.58 -0.08 0.00 0.77 0.00 0.00 66.41 65.58 2a6p h THR 35 Cb 0.20 1.64 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 2a6p h THR 35 CO 0.01 0.48 0.04 1.23 0.37 0.00 0.00 175.52 177.65 2a6p h GLY 36 N 1.16 1.03 1.02 2.16 0.00 -0.72 -1.30 103.07 106.42 2a6p h GLY 36 Ca 0.03 -0.73 -0.03 0.00 0.00 0.00 0.00 47.33 46.59 2a6p h GLY 36 CO 0.07 0.67 0.31 3.21 0.00 0.00 0.00 176.54 180.81 2a6p h ARG 37 N 0.84 1.05 -0.56 4.80 3.08 -0.83 -1.66 114.38 121.10 2a6p h ARG 37 Ca 0.16 -0.18 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 2a6p h ARG 37 Cb 0.49 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 2a6p h ARG 37 CO 0.02 0.85 0.09 1.15 -1.07 0.00 0.00 179.97 181.01 2a6p h THR 38 N 1.01 1.26 -0.17 2.04 2.02 -1.31 -1.07 112.91 116.69 2a6p h THR 38 Ca 0.24 -0.98 0.03 0.00 0.77 0.00 0.00 66.41 66.48 2a6p h THR 38 Cb 0.17 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 2a6p h THR 38 CO -0.02 0.35 -0.02 1.56 0.37 0.00 0.00 175.52 177.76 2a6p h GLN 39 N 0.82 0.03 -0.55 6.66 4.20 -0.92 -0.26 115.11 125.10 2a6p h GLN 39 Ca 0.17 -0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.91 2a6p h GLN 39 Cb 0.42 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 2a6p h GLN 39 CO 0.01 0.02 0.31 0.00 -0.67 0.00 0.00 178.83 178.50 2a6p h ALA 40 N 1.15 0.72 -0.64 3.87 0.00 -1.13 -0.70 119.26 122.53 2a6p h ALA 40 Ca 0.08 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2a6p h ALA 40 Cb 0.11 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2a6p h ALA 40 CO -0.15 -0.00 0.41 0.93 0.00 0.00 0.00 179.25 180.43 2a6p h GLU 41 N 0.60 0.78 -0.16 0.00 5.08 -0.64 -2.38 114.58 117.87 2a6p h GLU 41 Ca 0.23 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.44 2a6p h GLU 41 Cb 0.09 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2a6p h GLU 41 CO -0.13 0.52 -0.37 -0.07 -1.00 0.00 0.00 179.01 177.95 2a6p h LEU 42 N 0.81 0.36 -0.45 1.33 3.38 -0.50 -2.90 115.31 117.34 2a6p h LEU 42 Ca 0.25 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2a6p h LEU 42 Cb -0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2a6p h LEU 42 CO -0.09 0.71 0.13 0.00 0.09 0.00 0.00 178.44 179.28 2a6p h ALA 43 N 1.31 0.59 -0.03 1.53 0.00 -0.68 -0.84 119.26 121.14 2a6p h ALA 43 Ca 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2a6p h ALA 43 Cb 0.79 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2a6p h ALA 43 CO 0.06 0.26 -0.15 0.78 0.00 0.00 0.00 179.25 180.19 2a6p h GLY 44 N 0.59 0.06 0.93 0.00 0.00 -1.39 0.41 103.07 103.67 2a6p h GLY 44 Ca 0.14 -0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.40 2a6p h GLY 44 CO -0.00 0.03 0.09 -1.61 0.00 0.00 0.00 176.54 175.05 2a6p h GLN 45 N 0.05 0.61 -0.41 4.80 4.15 -1.20 -1.56 115.11 121.56 2a6p h GLN 45 Ca 0.01 -0.15 -0.13 0.00 0.77 0.00 0.00 58.65 59.15 2a6p h GLN 45 Cb 0.31 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2a6p h GLN 45 CO 0.02 0.65 -0.28 1.25 -1.93 0.00 0.00 178.83 178.54 2a6p h LEU 46 N 0.47 0.90 -1.64 -2.39 5.85 0.28 -2.58 115.31 116.21 2a6p h LEU 46 Ca 0.12 -0.36 -0.03 0.00 0.84 0.00 0.00 57.88 58.44 2a6p h LEU 46 Cb 0.31 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2a6p h LEU 46 CO 0.00 1.12 -0.15 -0.07 -0.34 0.00 0.00 178.44 179.00 2a6p h LEU 47 N 0.74 0.04 -1.37 2.25 -0.00 -0.04 -2.70 115.31 114.23 2a6p h LEU 47 Ca 0.09 -0.01 0.05 0.00 -0.00 0.00 0.00 57.88 58.01 2a6p h LEU 47 Cb 0.84 -0.01 -0.04 0.00 -0.00 0.00 0.00 40.66 41.44 2a6p h LEU 47 CO 0.07 0.19 0.47 1.23 -0.00 0.00 0.00 178.44 180.40 2a6p h GLY 48 N 0.52 0.95 -2.82 0.83 0.00 -0.86 -1.88 103.07 99.80 2a6p h GLY 48 Ca 0.01 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2a6p h GLY 48 CO 0.02 0.25 0.00 -1.84 0.00 0.00 0.00 176.54 174.97 2a6p n GLU 49 N -4.47 3.65 0.00 4.80 0.28 -1.02 -3.93 120.64 119.95 2a6p n GLU 49 Ca 0.10 -2.45 0.13 0.00 -0.16 0.00 0.00 57.16 54.78 2a6p n GLU 49 Cb 0.18 -1.93 0.34 0.00 1.43 0.00 0.00 31.44 31.47 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 0.74 2.04 -3.72 -1.84 4.77 -0.71 -4.99 117.00 113.29 2a6p n LEU 50 Ca 0.22 -0.68 -0.24 0.00 -0.03 0.00 0.00 56.01 55.28 2a6p n LEU 50 Cb 0.87 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.96 2a6p n LEU 50 CO 0.23 0.34 -0.15 -0.62 -1.33 0.00 0.00 177.39 175.86 2a6p n GLU 51 N 0.55 -1.35 -3.03 3.23 1.02 -1.25 -4.92 120.64 114.89 2a6p n GLU 51 Ca 0.16 0.76 -0.39 0.00 -0.02 0.00 0.00 57.16 57.67 2a6p n GLU 51 Cb 0.45 -2.87 -0.06 0.00 -0.02 0.00 0.00 31.44 28.94 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 -5.21 4.55 -0.58 -4.62 1.43 -1.26 -5.03 118.68 107.96 2a6p s LEU 52 Ca 0.08 1.58 -0.23 0.00 -1.03 0.00 0.00 54.13 54.53 2a6p s LEU 52 Cb -0.04 -3.30 0.05 0.00 0.03 0.00 0.00 46.19 42.93 2a6p s LEU 52 CO 0.88 0.19 0.91 -0.62 0.23 0.00 0.00 176.35 177.95 2a6p s ASP 53 N -1.22 6.27 -0.70 2.29 2.15 -1.26 -4.56 116.67 119.63 2a6p s ASP 53 Ca 0.36 -0.62 -0.20 0.00 0.43 0.00 0.00 52.55 52.52 2a6p s ASP 53 Cb -0.22 -2.41 0.03 0.00 -0.30 0.00 0.00 42.92 40.02 2a6p s ASP 53 CO 0.25 -1.26 0.38 -0.67 -0.17 0.00 0.00 175.17 173.70 2a6p n ASP 54 N 7.39 -2.28 -4.68 -0.34 2.03 -1.26 -1.94 116.55 115.48 2a6p n ASP 54 Ca -0.01 -0.76 -0.44 0.00 0.52 0.00 0.00 54.79 54.10 2a6p n ASP 54 Cb 0.47 -0.91 -0.02 0.00 -0.72 0.00 0.00 41.12 39.94 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 -3.33 2.08 -3.66 -0.67 -0.02 -1.26 -4.43 135.00 123.71 2a6p n PRO 55 Ca -0.07 0.74 -0.37 0.00 -2.02 0.00 0.00 63.50 61.78 2a6p n PRO 55 Cb 0.32 -2.38 -0.12 0.00 -0.02 0.00 0.00 33.50 31.30 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 -0.26 4.88 -0.27 4.25 2.07 -0.75 -4.98 121.20 126.15 2a6p s ILE 56 Ca 0.65 0.02 -0.11 0.00 -1.41 0.00 0.00 60.65 59.81 2a6p s ILE 56 Cb -0.63 -3.31 -0.05 0.00 0.13 0.00 0.00 42.46 38.60 2a6p s ILE 56 CO 0.52 0.29 0.18 -0.69 -1.91 0.00 0.00 174.94 173.33 2a6p s VAL 57 N 1.70 5.29 -0.13 4.00 1.01 -1.26 -1.89 120.40 129.12 2a6p s VAL 57 Ca 0.07 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.19 2a6p s VAL 57 Cb -0.16 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 2a6p s VAL 57 CO 0.08 0.27 -0.07 -0.63 0.00 0.00 0.00 175.10 174.76 2a6p s ILE 58 N 1.61 3.67 0.07 2.22 1.09 -0.31 -0.59 121.20 128.97 2a6p s ILE 58 Ca 0.07 -0.45 0.07 0.00 -1.10 0.00 0.00 60.65 59.23 2a6p s ILE 58 Cb -0.15 -2.56 -0.03 0.00 -1.06 0.00 0.00 42.46 38.65 2a6p s ILE 58 CO 0.09 0.53 -0.18 0.00 -0.10 0.00 0.00 174.94 175.29 2a6p s SER 60 N -1.61 6.62 0.61 0.00 0.15 -0.70 -1.62 113.70 117.14 2a6p s SER 60 Ca 0.03 2.22 0.39 0.00 0.70 0.00 0.00 55.95 59.29 2a6p s SER 60 Cb -0.09 -2.60 1.94 0.00 -1.71 0.00 0.00 66.02 63.56 2a6p s SER 60 CO 0.03 -0.60 2.20 -0.65 1.20 0.00 0.00 173.24 175.42 2a6p h PRO 61 N 2.60 0.00 -6.98 5.44 0.11 -1.92 -3.37 132.00 127.89 2a6p h PRO 61 Ca -0.48 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 0.15 0.00 0.11 0.00 0.00 31.00 32.49 2a6p h PRO 61 CO 0.62 0.01 0.40 0.54 -0.21 0.00 0.00 178.00 179.37 2a6p n ARG 62 N -3.16 1.23 0.03 1.05 5.12 -1.26 -4.82 116.66 114.84 2a6p n ARG 62 Ca -0.02 0.47 -0.03 0.00 -1.93 0.00 0.00 57.85 56.34 2a6p n ARG 62 Cb 0.17 -2.41 0.22 0.00 -1.16 0.00 0.00 32.46 29.28 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 0.83 0.43 -0.03 5.56 9.65 -1.88 -1.64 114.38 127.31 2a6p h ARG 63 Ca -0.50 -0.16 -0.03 0.00 -1.10 0.00 0.00 59.98 58.18 2a6p h ARG 63 Cb 1.34 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.89 2a6p h ARG 63 CO 0.54 0.67 -0.14 0.07 2.80 0.00 0.00 179.97 183.90 2a6p h ARG 64 N 0.38 0.04 0.17 0.20 0.11 -1.91 0.22 114.38 113.58 2a6p h ARG 64 Ca 0.05 -0.01 -0.33 0.00 0.10 0.00 0.00 59.98 59.79 2a6p h ARG 64 Cb 0.67 -0.01 0.01 0.00 1.11 0.00 0.00 29.97 31.75 2a6p h ARG 64 CO 0.05 0.18 -1.66 1.79 0.10 0.00 0.00 179.97 180.44 2a6p h THR 65 N 0.04 1.04 -0.41 0.08 1.35 -1.77 -2.73 112.91 110.51 2a6p h THR 65 Ca 0.01 -2.63 -0.02 0.00 -0.55 0.00 0.00 66.41 63.22 2a6p h THR 65 Cb 0.27 2.78 -0.02 0.00 -1.73 0.00 0.00 68.15 69.45 2a6p h THR 65 CO 0.02 0.84 0.17 -0.07 -0.25 0.00 0.00 175.52 176.23 2a6p h LEU 66 N 0.10 0.55 -0.46 3.87 3.38 -1.08 -1.76 115.31 119.91 2a6p h LEU 66 Ca -0.30 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 57.55 2a6p h LEU 66 Cb 2.08 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 42.64 2a6p h LEU 66 CO 0.18 0.56 0.22 -0.78 0.09 0.00 0.00 178.44 178.71 2a6p h ASP 67 N 0.51 0.31 -0.34 -0.43 1.82 -0.67 -2.06 116.42 115.57 2a6p h ASP 67 Ca 0.14 0.03 0.03 0.00 -0.39 0.00 0.00 57.03 56.83 2a6p h ASP 67 Cb 0.17 -0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.12 2a6p h ASP 67 CO -0.01 0.22 0.16 0.74 -1.61 0.00 0.00 179.24 178.74 2a6p h THR 68 N 0.44 0.97 -0.52 2.25 2.02 -1.22 0.28 112.91 117.14 2a6p h THR 68 Ca 0.20 -0.11 0.04 0.00 0.77 0.00 0.00 66.41 67.31 2a6p h THR 68 Cb 0.12 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.09 2a6p h THR 68 CO -0.15 0.06 0.28 0.00 0.37 0.00 0.00 175.52 176.08 2a6p h ALA 69 N 1.18 0.67 0.04 6.16 0.00 -0.97 0.33 119.26 126.69 2a6p h ALA 69 Ca 0.14 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2a6p h ALA 69 Cb 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2a6p h ALA 69 CO -0.11 -0.05 -0.02 -0.22 0.00 0.00 0.00 179.25 178.85 2a6p h LYS 70 N 0.54 -0.05 0.00 0.00 3.64 -1.01 -0.11 116.57 119.58 2a6p h LYS 70 Ca 0.23 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.59 2a6p h LYS 70 Cb 0.11 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2a6p h LYS 70 CO -0.14 0.11 -0.11 -0.07 -2.27 0.00 0.00 179.45 176.96 2a6p h LEU 71 N -0.21 0.00 0.00 5.20 3.38 -0.61 0.78 115.31 123.85 2a6p h LEU 71 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2a6p h LEU 71 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2a6p h LEU 71 CO 0.01 0.11 0.00 0.00 0.09 0.00 0.00 178.44 178.65 2a6p n ALA 72 N -2.49 2.42 -1.54 1.53 0.00 0.11 -4.08 120.51 116.46 2a6p n ALA 72 Ca -0.03 -0.14 -0.04 0.00 0.00 0.00 0.00 53.44 53.23 2a6p n ALA 72 Cb 0.19 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.18 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 0.96 0.46 3.93 0.00 0.00 0.27 -4.22 105.19 106.59 2a6p n GLY 73 Ca 0.15 -0.83 -0.26 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.92 4.19 -0.23 0.99 1.43 -0.08 -5.03 118.68 119.03 2a6p s LEU 74 Ca 0.00 0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 53.44 2a6p s LEU 74 Cb 0.00 -3.17 0.00 0.00 0.03 0.00 0.00 46.19 43.06 2a6p s LEU 74 CO 0.00 -0.10 -0.05 0.42 0.23 0.00 0.00 176.35 176.86 2a6p s THR 75 N -1.97 3.22 0.05 5.49 -4.23 -1.26 -4.43 115.64 112.51 2a6p s THR 75 Ca 0.38 -0.67 -0.30 0.00 -1.18 0.00 0.00 61.69 59.92 2a6p s THR 75 Cb -0.10 -2.52 -0.05 0.00 1.34 0.00 0.00 72.50 71.17 2a6p s THR 75 CO 0.30 0.34 1.01 -0.69 -0.54 0.00 0.00 174.62 175.05 2a6p s VAL 76 N 1.43 4.58 -0.15 2.29 1.01 -1.26 -4.58 120.40 123.72 2a6p s VAL 76 Ca 0.04 1.95 -0.00 0.00 0.00 0.00 0.00 61.98 63.97 2a6p s VAL 76 Cb -0.15 -4.25 -0.23 0.00 0.00 0.00 0.00 36.38 31.75 2a6p s VAL 76 CO -0.04 0.21 0.24 0.59 0.00 0.00 0.00 175.10 176.10 2a6p n ASN 77 N 3.45 1.77 -3.80 3.32 3.02 0.25 -4.95 115.26 118.32 2a6p n ASN 77 Ca 0.05 0.14 -0.14 0.00 -0.03 0.00 0.00 54.58 54.60 2a6p n ASN 77 Cb 0.49 -0.52 -0.15 0.00 -0.61 0.00 0.00 39.78 39.00 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 -0.02 -0.19 3.52 0.41 -0.79 -5.02 118.70 114.06 2a6p s GLU 78 Ca -0.22 0.15 -0.02 0.00 -0.41 0.00 0.00 54.97 54.46 2a6p s GLU 78 Cb 0.07 -0.17 -0.01 0.00 -1.78 0.00 0.00 34.13 32.24 2a6p s GLU 78 CO 0.74 -0.12 -0.09 0.08 -0.49 0.00 0.00 175.26 175.38 2a6p s VAL 79 N 0.77 3.10 -0.14 2.63 1.01 -1.26 -0.34 120.40 126.18 2a6p s VAL 79 Ca -0.06 -0.60 -0.14 0.00 0.00 0.00 0.00 61.98 61.17 2a6p s VAL 79 Cb -0.09 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 33.96 2a6p s VAL 79 CO -0.02 0.47 0.40 0.28 0.00 0.00 0.00 175.10 176.23 2a6p s THR 80 N 1.08 0.00 -1.43 3.92 -1.32 -0.64 -4.96 115.64 112.29 2a6p s THR 80 Ca 0.00 -0.04 0.07 0.00 -1.21 0.00 0.00 61.69 60.51 2a6p s THR 80 Cb -0.15 -0.57 0.11 0.00 -1.51 0.00 0.00 72.50 70.39 2a6p s THR 80 CO -0.02 -0.02 1.06 0.61 -2.21 0.00 0.00 174.62 174.04 2a6p n GLY 81 N 2.71 -0.50 0.28 6.08 0.00 -1.26 -2.32 105.19 110.19 2a6p n GLY 81 Ca -0.14 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 45.94 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 0.05 -2.54 0.99 5.85 -1.94 -1.00 115.31 116.72 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 0.06 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.08 2a6p h LEU 82 CO 0.00 0.04 0.00 0.18 -0.34 0.00 0.00 178.44 178.32 2a6p n LEU 83 N -4.52 3.70 -4.73 2.25 4.77 -0.98 -4.90 117.00 112.60 2a6p n LEU 83 Ca -0.01 -1.83 -0.34 0.00 -0.03 0.00 0.00 56.01 53.80 2a6p n LEU 83 Cb 0.15 -0.45 0.09 0.00 -2.33 0.00 0.00 43.42 40.88 2a6p n LEU 83 CO 0.34 0.92 0.79 0.00 -1.33 0.00 0.00 177.39 178.11 2a6p s ALA 84 N -1.11 2.16 1.00 -1.18 0.00 -0.38 -4.27 121.76 117.99 2a6p s ALA 84 Ca 0.46 0.85 -0.12 0.00 0.00 0.00 0.00 51.96 53.15 2a6p s ALA 84 Cb 0.24 -3.46 0.19 0.00 0.00 0.00 0.00 23.12 20.10 2a6p s ALA 84 CO 0.32 -1.80 1.08 -2.00 0.00 0.00 0.00 175.76 173.35 2a6p s GLU 85 N -3.91 0.38 0.18 0.00 2.56 -1.26 -4.82 118.70 111.83 2a6p s GLU 85 Ca 0.74 0.90 -0.33 0.00 0.00 0.00 0.00 54.97 56.27 2a6p s GLU 85 Cb -0.28 -1.70 -0.13 0.00 2.00 0.00 0.00 34.13 34.01 2a6p s GLU 85 CO 0.45 -2.86 1.63 1.87 -0.56 0.00 0.00 175.26 175.79 2a6p n TRP 86 N -4.32 2.46 -2.23 5.30 -0.00 -1.26 -4.88 117.44 112.51 2a6p n TRP 86 Ca 0.06 0.18 -0.43 0.00 -0.00 0.00 0.00 57.50 57.31 2a6p n TRP 86 Cb 0.55 -2.59 -0.02 0.00 -0.00 0.00 0.00 31.31 29.24 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 1.01 6.23 0.00 5.87 2.15 -1.26 -4.57 116.67 126.09 2a6p s ASP 87 Ca 0.77 1.06 0.31 0.00 0.43 0.00 0.00 52.55 55.12 2a6p s ASP 87 Cb -0.61 -2.54 1.64 0.00 -0.30 0.00 0.00 42.92 41.11 2a6p s ASP 87 CO 0.36 -1.48 2.09 -1.22 -0.17 0.00 0.00 175.17 174.75 2a6p n TYR 88 N 9.16 0.00 0.00 -5.34 4.02 -1.26 -1.11 117.16 122.62 2a6p n TYR 88 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.07 2a6p n TYR 88 Cb 0.47 -0.11 0.00 0.00 -0.02 0.00 0.00 39.34 39.68 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 1.14 2.49 0.30 2.72 0.00 -1.26 -0.66 105.19 109.91 2a6p n GLY 89 Ca 0.19 0.21 0.13 0.00 0.00 0.00 0.00 46.02 46.55 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 0.41 1.61 0.02 -0.47 -2.39 113.55 112.72 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 -0.06 -1.22 -1.14 0.00 0.00 176.83 174.41 2a6p n TYR 91 N -4.30 0.00 -1.62 3.45 0.53 0.16 -4.91 117.16 110.47 2a6p n TYR 91 Ca 0.00 0.00 -0.54 0.00 -1.02 0.00 0.00 57.90 56.34 2a6p n TYR 91 Cb 0.23 -0.21 -0.07 0.00 -1.03 0.00 0.00 39.34 38.27 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 -1.07 1.04 0.00 -0.72 4.07 -0.90 -0.32 120.64 122.74 2a6p n GLU 92 Ca 0.15 0.38 0.00 0.00 -0.06 0.00 0.00 57.16 57.63 2a6p n GLU 92 Cb 0.25 -2.02 0.00 0.00 -0.06 0.00 0.00 31.44 29.62 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 2.93 2.50 3.85 8.31 0.00 0.37 -4.98 105.19 118.17 2a6p n GLY 93 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 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 4.06 0.55 0.99 1.43 0.57 -4.51 118.68 121.77 2a6p s LEU 94 Ca 0.00 1.23 0.00 0.00 -1.03 0.00 0.00 54.13 54.33 2a6p s LEU 94 Cb 0.00 -4.03 0.03 0.00 0.03 0.00 0.00 46.19 42.22 2a6p s LEU 94 CO 0.00 -0.20 0.78 0.42 0.23 0.00 0.00 176.35 177.58 2a6p s THR 95 N -1.98 2.84 0.18 5.49 -4.23 -1.26 -1.90 115.64 114.77 2a6p s THR 95 Ca 0.53 -0.60 -0.12 0.00 -1.18 0.00 0.00 61.69 60.33 2a6p s THR 95 Cb -0.10 -3.07 0.09 0.00 1.34 0.00 0.00 72.50 70.76 2a6p s THR 95 CO 0.18 -0.05 1.76 0.74 -0.54 0.00 0.00 174.62 176.72 2a6p h THR 96 N 0.06 1.22 -0.09 3.99 2.02 -1.95 -1.27 112.91 116.88 2a6p h THR 96 Ca -0.43 -0.62 -0.00 0.00 0.77 0.00 0.00 66.41 66.13 2a6p h THR 96 Cb 1.29 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 68.16 2a6p h THR 96 CO 0.54 0.25 0.05 -0.65 0.37 0.00 0.00 175.52 176.08 2a6p h PRO 97 N 0.87 0.13 -0.70 6.66 0.11 -1.94 0.24 132.00 137.37 2a6p h PRO 97 Ca 0.22 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 66.42 2a6p h PRO 97 Cb 0.13 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 31.13 2a6p h PRO 97 CO -0.03 0.15 0.31 1.96 -0.21 0.00 0.00 178.00 180.18 2a6p h GLN 98 N 0.06 0.49 -0.06 1.05 4.20 -1.92 0.47 115.11 119.42 2a6p h GLN 98 Ca 0.03 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 2a6p h GLN 98 Cb 0.06 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2a6p h GLN 98 CO -0.01 0.33 -0.26 0.82 -0.67 0.00 0.00 178.83 179.04 2a6p h ILE 99 N 0.51 1.22 0.00 2.54 2.04 -0.79 -2.43 117.51 120.59 2a6p h ILE 99 Ca 0.36 -1.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.16 2a6p h ILE 99 Cb 0.44 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2a6p h ILE 99 CO -0.32 0.30 -0.23 -0.09 0.00 0.00 0.00 178.15 177.81 2a6p h ARG 100 N 0.09 0.00 0.00 2.37 9.65 0.34 0.13 114.38 126.96 2a6p h ARG 100 Ca 0.01 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.89 2a6p h ARG 100 Cb 0.52 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.10 2a6p h ARG 100 CO 0.04 0.23 -0.02 0.93 2.80 0.00 0.00 179.97 183.95 2a6p h GLU 101 N 0.00 0.00 0.00 0.20 5.08 -0.69 -2.11 114.58 117.06 2a6p h GLU 101 Ca -0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 2a6p h GLU 101 Cb 0.54 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 2a6p h GLU 101 CO 0.03 0.02 -1.67 0.43 -1.00 0.00 0.00 179.01 176.81 2a6p n SER 102 N -3.18 3.00 -3.61 1.42 7.64 -0.96 -4.83 113.62 113.09 2a6p n SER 102 Ca -0.02 -0.05 -0.27 0.00 1.01 0.00 0.00 58.87 59.54 2a6p n SER 102 Cb 0.17 -0.19 -0.10 0.00 -1.01 0.00 0.00 64.21 63.08 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 -2.87 1.61 -0.59 1.43 2.13 -0.01 -4.99 120.64 117.35 2a6p n GLU 103 Ca -0.21 -4.18 0.48 0.00 0.66 0.00 0.00 57.16 53.91 2a6p n GLU 103 Cb 0.72 -2.06 0.76 0.00 0.27 0.00 0.00 31.44 31.13 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 4.97 0.00 -0.39 5.31 0.11 -1.60 0.90 132.00 141.30 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 0.77 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2a6p h PRO 104 CO 0.66 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.05 2a6p n ASP 105 N -3.86 3.47 -4.76 -2.05 5.75 -1.26 -4.94 116.55 108.89 2a6p n ASP 105 Ca 0.39 -2.31 -0.41 0.00 -0.01 0.00 0.00 54.79 52.45 2a6p n ASP 105 Cb 1.85 -0.37 -0.01 0.00 -1.03 0.00 0.00 41.12 41.56 2a6p n ASP 105 CO 0.00 0.00 0.00 0.86 -0.11 0.00 0.00 177.20 177.95 2a6p s TRP 106 N -1.56 2.68 -0.13 2.11 -0.00 0.31 -5.00 118.94 117.36 2a6p s TRP 106 Ca 0.33 0.95 -0.08 0.00 -0.00 0.00 0.00 56.10 57.30 2a6p s TRP 106 Cb 0.21 -4.05 0.05 0.00 -0.00 0.00 0.00 33.47 29.68 2a6p s TRP 106 CO 0.16 -3.33 0.31 -0.51 -0.00 0.00 0.00 176.95 173.58 2a6p s LEU 107 N -1.18 0.35 0.48 5.86 1.43 -1.26 -5.01 118.68 119.36 2a6p s LEU 107 Ca 0.59 0.65 0.15 0.00 -1.03 0.00 0.00 54.13 54.49 2a6p s LEU 107 Cb -0.47 0.98 1.14 0.00 0.03 0.00 0.00 46.19 47.87 2a6p s LEU 107 CO 0.54 -0.16 2.07 1.62 0.23 0.00 0.00 176.35 180.65 2a6p h VAL 108 N 5.52 0.96 -0.05 -1.59 3.04 -1.96 -0.88 116.25 121.29 2a6p h VAL 108 Ca -0.36 -0.07 -0.02 0.00 -1.01 0.00 0.00 66.70 65.23 2a6p h VAL 108 Cb 1.17 0.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.17 2a6p h VAL 108 CO 0.34 0.04 -0.08 -0.50 -1.01 0.00 0.00 177.57 176.35 2a6p h TRP 109 N 0.22 0.07 0.00 3.17 4.06 -1.90 -1.97 115.95 119.60 2a6p h TRP 109 Ca 0.14 -0.00 -0.19 0.00 2.06 0.00 0.00 58.89 60.89 2a6p h TRP 109 Cb 0.27 -0.02 -0.04 0.00 -1.00 0.00 0.00 29.16 28.37 2a6p h TRP 109 CO -0.00 0.16 -1.72 0.25 -3.56 0.00 0.00 178.44 173.58 2a6p n THR 110 N -4.39 0.72 -0.11 1.49 -2.24 -0.93 -4.12 114.28 104.68 2a6p n THR 110 Ca -0.02 -0.44 -0.23 0.00 -2.27 0.00 0.00 64.05 61.09 2a6p n THR 110 Cb 0.19 -0.73 -0.12 0.00 -2.10 0.00 0.00 70.33 67.57 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 -2.39 0.34 -1.91 4.78 8.25 -0.38 -4.96 115.22 118.95 2a6p n HIS 111 Ca -0.17 0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 2a6p n HIS 111 Cb 0.84 -1.04 0.00 0.00 1.12 0.00 0.00 29.99 30.91 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 1.76 -1.85 3.07 -1.41 0.00 -0.74 -4.70 105.19 101.32 2a6p n GLY 112 Ca -0.45 -1.74 -0.25 0.00 0.00 0.00 0.00 46.02 43.57 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 0.40 4.24 -0.10 0.00 0.04 -1.26 -1.81 135.00 136.51 2a6p s PRO 114 Ca -0.11 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.09 2a6p s PRO 114 Cb -0.14 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.86 2a6p s PRO 114 CO 0.03 -0.64 0.00 0.00 0.04 0.00 0.00 177.00 176.44 2a6p n ALA 115 N 5.30 -0.01 -3.00 8.56 0.00 -1.26 0.20 120.51 130.30 2a6p n ALA 115 Ca 0.14 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2a6p n ALA 115 Cb 0.42 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.50 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 -2.65 5.36 3.79 0.00 0.00 -0.75 -4.25 105.19 106.69 2a6p n GLY 116 Ca -0.01 -1.31 -0.38 0.00 0.00 0.00 0.00 46.02 44.32 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 2.52 4.52 0.47 1.61 2.02 -0.27 -4.83 118.70 124.74 2a6p s GLU 117 Ca 0.00 1.15 0.02 0.00 0.02 0.00 0.00 54.97 56.16 2a6p s GLU 117 Cb 0.00 -3.06 0.01 0.00 0.10 0.00 0.00 34.13 31.18 2a6p s GLU 117 CO 0.00 0.45 0.68 -1.54 0.02 0.00 0.00 175.26 174.87 2a6p s SER 118 N -1.39 5.64 0.16 -0.19 1.04 -1.26 -2.31 113.70 115.39 2a6p s SER 118 Ca 0.41 0.09 -0.15 0.00 0.48 0.00 0.00 55.95 56.78 2a6p s SER 118 Cb -0.21 -1.22 0.08 0.00 0.10 0.00 0.00 66.02 64.78 2a6p s SER 118 CO 0.25 -0.83 1.75 0.58 0.98 0.00 0.00 173.24 175.97 2a6p h VAL 119 N 0.35 0.88 -0.53 5.02 2.07 -1.87 -2.19 116.25 119.98 2a6p h VAL 119 Ca -0.44 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.08 2a6p h VAL 119 Cb 1.27 0.57 -0.09 0.00 -1.52 0.00 0.00 31.29 31.52 2a6p h VAL 119 CO 0.54 0.05 0.02 0.00 0.02 0.00 0.00 177.57 178.21 2a6p h ALA 120 N 1.25 0.53 -0.81 1.67 0.00 -1.97 0.24 119.26 120.16 2a6p h ALA 120 Ca 0.18 0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 2a6p h ALA 120 Cb 0.16 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2a6p h ALA 120 CO -0.19 -0.37 0.37 1.96 0.00 0.00 0.00 179.25 181.02 2a6p h GLN 121 N 0.14 1.18 -0.01 0.00 4.20 -1.81 -1.78 115.11 117.05 2a6p h GLN 121 Ca 0.27 -0.19 -0.17 0.00 0.06 0.00 0.00 58.65 58.62 2a6p h GLN 121 Cb 0.41 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 2a6p h GLN 121 CO -0.43 0.93 -0.80 0.28 -0.67 0.00 0.00 178.83 178.14 2a6p h VAL 122 N 1.17 1.51 -0.58 -0.54 2.07 -0.77 -1.59 116.25 117.53 2a6p h VAL 122 Ca 0.28 -2.57 0.02 0.00 0.82 0.00 0.00 66.70 65.26 2a6p h VAL 122 Cb 0.15 2.40 -0.04 0.00 -1.52 0.00 0.00 31.29 32.28 2a6p h VAL 122 CO -0.03 0.74 0.35 -1.13 0.02 0.00 0.00 177.57 177.52 2a6p h ASN 123 N 0.06 0.58 -0.28 0.57 -0.73 -0.07 0.30 115.58 116.01 2a6p h ASN 123 Ca -0.02 0.00 -0.18 0.00 1.87 0.00 0.00 56.30 57.97 2a6p h ASN 123 Cb 1.40 -0.12 0.00 0.00 0.27 0.00 0.00 38.32 39.86 2a6p h ASN 123 CO 0.11 0.41 -0.52 0.44 -0.37 0.00 0.00 177.43 177.50 2a6p h ASP 124 N 0.70 0.94 -0.70 1.15 3.32 -1.26 -1.40 116.42 119.18 2a6p h ASP 124 Ca 0.23 -0.53 -0.07 0.00 0.02 0.00 0.00 57.03 56.68 2a6p h ASP 124 Cb 0.01 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 2a6p h ASP 124 CO -0.09 1.30 0.18 -0.09 -1.72 0.00 0.00 179.24 178.82 2a6p h ARG 125 N 0.62 1.12 -0.39 3.56 2.43 -0.90 -1.08 114.38 119.75 2a6p h ARG 125 Ca 0.01 -0.26 -0.02 0.00 -0.81 0.00 0.00 59.98 58.91 2a6p h ARG 125 Cb 1.13 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.51 2a6p h ARG 125 CO 0.12 0.98 0.18 0.00 -1.51 0.00 0.00 179.97 179.73 2a6p h ALA 126 N 1.13 0.50 -0.74 2.80 0.00 -0.32 -1.78 119.26 120.85 2a6p h ALA 126 Ca 0.22 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2a6p h ALA 126 Cb 0.35 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2a6p h ALA 126 CO -0.00 0.07 0.29 -0.44 0.00 0.00 0.00 179.25 179.17 2a6p h ASP 127 N 0.49 1.03 -0.99 0.00 3.32 -0.96 -1.19 116.42 118.12 2a6p h ASP 127 Ca 0.13 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.01 2a6p h ASP 127 Cb 0.14 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.37 2a6p h ASP 127 CO -0.02 0.93 0.65 0.28 -1.72 0.00 0.00 179.24 179.36 2a6p h SER 128 N 1.07 1.14 -0.47 6.45 0.02 -0.98 0.08 113.55 120.86 2a6p h SER 128 Ca 0.24 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 2a6p h SER 128 Cb 0.23 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 2a6p h SER 128 CO -0.02 0.83 0.23 0.00 -1.14 0.00 0.00 176.83 176.73 2a6p h ALA 129 N 1.36 0.61 -0.79 3.77 0.00 -0.71 0.06 119.26 123.56 2a6p h ALA 129 Ca 0.36 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 2a6p h ALA 129 Cb -0.15 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 2a6p h ALA 129 CO -0.08 0.17 0.30 0.28 0.00 0.00 0.00 179.25 179.92 2a6p h VAL 130 N 0.62 1.26 -0.69 0.00 2.07 -0.69 -1.74 116.25 117.07 2a6p h VAL 130 Ca 0.16 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 2a6p h VAL 130 Cb 0.11 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 2a6p h VAL 130 CO -0.02 0.34 0.37 0.00 0.02 0.00 0.00 177.57 178.28 2a6p h ALA 131 N 1.17 0.89 0.00 1.67 0.00 -0.53 -1.50 119.26 120.96 2a6p h ALA 131 Ca 0.26 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2a6p h ALA 131 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2a6p h ALA 131 CO -0.02 0.41 -0.03 1.25 0.00 0.00 0.00 179.25 180.86 2a6p h LEU 132 N 0.95 -0.08 -0.20 0.00 5.85 -0.63 -2.91 115.31 118.29 2a6p h LEU 132 Ca 0.24 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.02 2a6p h LEU 132 Cb 0.05 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 2a6p h LEU 132 CO -0.04 -0.04 -0.07 0.00 -0.34 0.00 0.00 178.44 177.95 2a6p h ALA 133 N 0.94 0.10 -0.40 1.25 0.00 -0.92 -2.37 119.26 117.87 2a6p h ALA 133 Ca 0.01 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.11 2a6p h ALA 133 Cb 0.07 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2a6p h ALA 133 CO -0.03 -0.50 0.29 -0.07 0.00 0.00 0.00 179.25 178.94 2a6p h LEU 134 N -0.03 0.02 -0.62 0.00 3.38 -1.19 -0.73 115.31 116.13 2a6p h LEU 134 Ca 0.10 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 2a6p h LEU 134 Cb 0.19 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2a6p h LEU 134 CO -0.22 0.01 -0.54 -0.08 0.09 0.00 0.00 178.44 177.70 2a6p h GLU 135 N 0.02 0.42 0.00 1.13 4.81 -1.23 -3.23 114.58 116.50 2a6p h GLU 135 Ca 0.19 -0.26 -0.19 0.00 -0.13 0.00 0.00 59.36 58.97 2a6p h GLU 135 Cb 0.73 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 2a6p h GLU 135 CO -0.01 0.85 -1.35 0.45 -0.73 0.00 0.00 179.01 178.23 2a6p h HIS 136 N 0.32 0.00 0.00 0.92 3.86 -1.32 -3.32 115.15 115.62 2a6p h HIS 136 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2a6p h HIS 136 Cb 1.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.52 2a6p h HIS 136 CO 0.03 0.70 0.00 -1.33 0.86 0.00 0.00 177.93 178.19 2a6p n MET 137 N -3.00 0.07 0.28 2.45 2.81 -0.36 -1.04 117.12 118.33 2a6p n MET 137 Ca -0.09 0.27 0.18 0.00 -1.81 0.00 0.00 57.70 56.24 2a6p n MET 137 Cb 0.89 -1.50 0.73 0.00 -0.71 0.00 0.00 33.22 32.63 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 -1.66 -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 0.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.06 2a6p h SER 138 CO 0.00 0.00 0.00 -1.54 -0.53 0.00 0.00 176.83 174.76 2a6p n SER 139 N -3.04 0.00 -3.74 6.23 3.41 -0.55 -5.04 113.62 110.89 2a6p n SER 139 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 2a6p n SER 139 Cb 0.27 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.18 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 0.00 1.71 0.36 4.33 1.70 -0.20 -4.99 118.95 121.86 2a6p s ARG 140 Ca 0.00 -1.34 -0.14 0.00 -0.47 0.00 0.00 55.73 53.78 2a6p s ARG 140 Cb 0.00 0.50 -0.08 0.00 -0.57 0.00 0.00 34.95 34.79 2a6p s ARG 140 CO 0.00 -0.73 0.78 -0.51 -1.08 0.00 0.00 175.30 173.76 2a6p s ASP 141 N -3.05 6.71 -0.04 -2.89 1.01 -0.82 -3.39 116.67 114.20 2a6p s ASP 141 Ca 0.22 1.29 0.06 0.00 0.71 0.00 0.00 52.55 54.83 2a6p s ASP 141 Cb -0.02 -2.38 -0.02 0.00 1.01 0.00 0.00 42.92 41.52 2a6p s ASP 141 CO 0.11 -0.29 -0.24 -0.69 0.21 0.00 0.00 175.17 174.27 2a6p s VAL 142 N -2.14 2.23 -0.12 -1.27 1.01 -0.63 -1.81 120.40 117.67 2a6p s VAL 142 Ca 0.54 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2a6p s VAL 142 Cb -0.10 -1.80 0.02 0.00 0.00 0.00 0.00 36.38 34.50 2a6p s VAL 142 CO 0.22 0.58 -0.10 -0.22 0.00 0.00 0.00 175.10 175.58 2a6p s LEU 143 N -0.44 1.36 -0.21 3.92 2.96 -0.79 -0.20 118.68 125.26 2a6p s LEU 143 Ca 0.05 -0.35 -0.08 0.00 -0.22 0.00 0.00 54.13 53.53 2a6p s LEU 143 Cb -0.12 -0.92 -0.04 0.00 0.50 0.00 0.00 46.19 45.61 2a6p s LEU 143 CO 0.01 -0.09 0.08 -0.36 -1.32 0.00 0.00 176.35 174.68 2a6p s PHE 144 N 1.53 3.21 -0.40 5.38 0.08 -0.06 -1.16 117.98 126.56 2a6p s PHE 144 Ca 0.03 -0.03 -0.09 0.00 0.12 0.00 0.00 56.93 56.96 2a6p s PHE 144 Cb -0.13 -2.16 0.06 0.00 -0.57 0.00 0.00 43.02 40.22 2a6p s PHE 144 CO -0.07 -0.01 0.23 0.08 -0.10 0.00 0.00 175.22 175.35 2a6p s VAL 145 N 0.86 4.27 0.00 -0.44 1.01 -0.35 0.26 120.40 126.00 2a6p s VAL 145 Ca 0.04 -1.24 0.00 0.00 0.00 0.00 0.00 61.98 60.79 2a6p s VAL 145 Cb -0.13 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.71 2a6p s VAL 145 CO 0.03 -0.40 0.00 -0.24 0.00 0.00 0.00 175.10 174.48 2a6p n SER 146 N 4.93 0.14 -4.72 3.32 2.88 -0.07 -1.72 113.62 118.38 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 -0.08 0.00 -0.75 0.00 0.00 64.21 63.82 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 1.27 2.32 0.05 0.66 3.76 -1.26 -2.59 115.29 119.50 2a6p s HIS 147 Ca 0.00 -0.72 -0.24 0.00 -0.15 0.00 0.00 55.06 53.95 2a6p s HIS 147 Cb 0.00 -1.81 -0.12 0.00 1.11 0.00 0.00 32.58 31.76 2a6p s HIS 147 CO 0.00 0.23 1.37 0.78 -0.85 0.00 0.00 174.74 176.27 2a6p h GLY 148 N 1.47 -1.07 0.82 -2.22 0.00 -1.96 0.25 103.07 100.38 2a6p h GLY 148 Ca -0.43 0.48 -0.04 0.00 0.00 0.00 0.00 47.33 47.35 2a6p h GLY 148 CO 0.74 -0.34 -0.01 0.45 0.00 0.00 0.00 176.54 177.38 2a6p h HIS 149 N -0.69 0.41 -0.65 5.60 3.86 -1.98 -2.37 115.15 119.33 2a6p h HIS 149 Ca -0.05 -0.07 -0.03 0.00 -1.16 0.00 0.00 60.37 59.06 2a6p h HIS 149 Cb 0.59 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.92 2a6p h HIS 149 CO -0.17 0.57 0.28 0.35 0.86 0.00 0.00 177.93 179.82 2a6p h PHE 150 N 0.13 0.96 -0.68 2.45 3.57 -1.88 0.11 116.94 121.61 2a6p h PHE 150 Ca 0.06 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.55 2a6p h PHE 150 Cb 0.41 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 38.81 2a6p h PHE 150 CO 0.04 0.74 0.39 0.77 -2.23 0.00 0.00 178.31 178.02 2a6p h SER 151 N 0.91 0.59 -0.13 0.41 0.02 -0.91 0.13 113.55 114.57 2a6p h SER 151 Ca 0.22 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.15 2a6p h SER 151 Cb 0.17 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 2a6p h SER 151 CO -0.02 0.39 -0.04 0.03 -1.14 0.00 0.00 176.83 176.05 2a6p h ARG 152 N 0.73 0.39 -0.31 3.45 3.08 -0.86 -0.82 114.38 120.04 2a6p h ARG 152 Ca 0.30 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.23 2a6p h ARG 152 Cb 0.16 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2a6p h ARG 152 CO -0.17 0.45 0.05 0.00 -1.07 0.00 0.00 179.97 179.23 2a6p h ALA 153 N 1.59 0.41 -0.41 0.04 0.00 0.12 0.43 119.26 121.43 2a6p h ALA 153 Ca 0.08 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2a6p h ALA 153 Cb 0.32 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2a6p h ALA 153 CO 0.01 0.10 0.25 0.28 0.00 0.00 0.00 179.25 179.89 2a6p h VAL 154 N 0.33 1.13 -0.31 0.00 2.07 -0.16 -1.40 116.25 117.92 2a6p h VAL 154 Ca 0.09 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2a6p h VAL 154 Cb 0.34 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2a6p h VAL 154 CO 0.01 0.13 0.16 0.40 0.02 0.00 0.00 177.57 178.29 2a6p h ILE 155 N 0.55 1.14 -0.74 4.57 2.04 -1.01 0.29 117.51 124.36 2a6p h ILE 155 Ca 0.15 -0.39 0.03 0.00 1.00 0.00 0.00 64.86 65.64 2a6p h ILE 155 Cb 0.00 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 2a6p h ILE 155 CO -0.03 0.15 0.49 0.74 0.00 0.00 0.00 178.15 179.50 2a6p h THR 156 N 0.37 1.13 0.04 -0.27 2.02 -0.70 -1.86 112.91 113.64 2a6p h THR 156 Ca 0.11 -0.32 -0.23 0.00 0.77 0.00 0.00 66.41 66.74 2a6p h THR 156 Cb 0.09 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.61 2a6p h THR 156 CO -0.02 0.17 -1.07 0.03 0.37 0.00 0.00 175.52 175.01 2a6p h ARG 157 N 0.93 0.10 -0.76 6.66 2.47 -0.81 -1.79 114.38 121.17 2a6p h ARG 157 Ca 0.29 -0.16 0.05 0.00 -1.26 0.00 0.00 59.98 58.90 2a6p h ARG 157 Cb 0.01 0.06 -0.05 0.00 -1.65 0.00 0.00 29.97 28.34 2a6p h ARG 157 CO -0.08 1.06 0.47 2.35 0.56 0.00 0.00 179.97 184.33 2a6p h TRP 158 N 0.03 0.86 -0.20 3.04 2.91 0.34 -0.29 115.95 122.65 2a6p h TRP 158 Ca -0.05 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.99 2a6p h TRP 158 Cb 1.81 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 30.18 2a6p h TRP 158 CO 0.02 0.46 0.00 1.33 -1.03 0.00 0.00 178.44 179.22 2a6p n VAL 159 N -4.67 0.43 -3.83 2.65 0.24 -0.80 -4.73 118.33 107.62 2a6p n VAL 159 Ca 0.10 -0.32 -0.25 0.00 -2.04 0.00 0.00 64.34 61.83 2a6p n VAL 159 Cb 0.13 -0.02 0.02 0.00 -1.47 0.00 0.00 33.84 32.50 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 0.14 -4.62 -4.22 7.34 6.02 -0.12 -5.02 117.38 116.90 2a6p n GLN 160 Ca 0.07 0.56 -0.23 0.00 -0.01 0.00 0.00 57.00 57.39 2a6p n GLN 160 Cb 0.27 -5.10 -0.07 0.00 1.02 0.00 0.00 30.24 26.36 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 3.20 0.44 1.08 1.43 -0.69 -5.03 118.68 112.19 2a6p s LEU 161 Ca 0.20 -0.74 -0.25 0.00 -1.03 0.00 0.00 54.13 52.31 2a6p s LEU 161 Cb -0.10 -1.68 -0.08 0.00 0.03 0.00 0.00 46.19 44.37 2a6p s LEU 161 CO 0.84 -0.16 1.28 -2.84 0.23 0.00 0.00 176.35 175.70 2a6p s PRO 162 N -3.75 3.78 0.62 1.29 0.02 -1.26 -4.50 135.00 131.21 2a6p s PRO 162 Ca 0.34 2.07 0.30 0.00 0.02 0.00 0.00 61.00 63.74 2a6p s PRO 162 Cb -0.04 -2.59 1.67 0.00 0.02 0.00 0.00 34.50 33.56 2a6p s PRO 162 CO 0.21 -0.62 2.01 1.25 -0.33 0.00 0.00 177.00 179.52 2a6p h LEU 163 N 2.33 0.00 -2.11 -5.54 6.46 -1.92 -0.35 115.31 114.19 2a6p h LEU 163 Ca -0.50 0.00 0.09 0.00 -0.12 0.00 0.00 57.88 57.35 2a6p h LEU 163 Cb 1.25 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.17 2a6p h LEU 163 CO 0.61 0.00 0.29 0.00 -0.62 0.00 0.00 178.44 178.72 2a6p h ALA 164 N 1.55 2.04 0.00 1.25 0.00 -1.89 -0.62 119.26 121.59 2a6p h ALA 164 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2a6p h ALA 164 Cb 0.69 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2a6p h ALA 164 CO -0.00 -0.45 0.00 0.39 0.00 0.00 0.00 179.25 179.19 2a6p n GLU 165 N -3.93 0.61 0.32 0.00 -0.58 -0.14 -3.47 120.64 113.44 2a6p n GLU 165 Ca 0.05 0.02 0.20 0.00 -0.42 0.00 0.00 57.16 57.01 2a6p n GLU 165 Cb 0.45 -1.50 1.11 0.00 -0.57 0.00 0.00 31.44 30.92 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 3.87 0.00 2.00 0.62 0.00 -1.31 -0.42 103.07 107.82 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 -0.03 0.19 4.64 -1.81 -3.07 113.55 113.47 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 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 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 -2.85 1.49 -4.32 4.77 5.12 -0.17 -4.82 116.66 115.88 2a6p n ARG 168 Ca 0.00 -0.72 -0.27 0.00 -1.93 0.00 0.00 57.85 54.94 2a6p n ARG 168 Cb 0.24 -1.47 -0.17 0.00 -1.16 0.00 0.00 32.46 29.90 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 -1.98 1.71 0.72 -1.55 0.40 -1.16 -5.14 117.98 110.98 2a6p s PHE 169 Ca 0.39 -0.79 -0.11 0.00 -0.60 0.00 0.00 56.93 55.82 2a6p s PHE 169 Cb 0.21 -1.28 0.02 0.00 0.51 0.00 0.00 43.02 42.47 2a6p s PHE 169 CO 0.33 -0.44 1.10 0.00 0.70 0.00 0.00 175.22 176.91 2a6p s ALA 170 N 1.12 2.84 -0.45 5.36 0.00 -1.26 -4.97 121.76 124.40 2a6p s ALA 170 Ca -0.05 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 51.59 2a6p s ALA 170 Cb -0.14 -3.03 0.21 0.00 0.00 0.00 0.00 23.12 20.15 2a6p s ALA 170 CO -0.02 -1.20 0.89 -0.12 0.00 0.00 0.00 175.76 175.31 2a6p n MET 171 N -3.05 0.41 -1.35 0.00 0.00 -1.26 -4.67 117.12 107.21 2a6p n MET 171 Ca 0.07 -1.56 -0.29 0.00 0.00 0.00 0.00 57.70 55.92 2a6p n MET 171 Cb 0.57 -0.92 0.14 0.00 0.00 0.00 0.00 33.22 33.01 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 1.03 0.28 2.12 0.04 -1.26 -4.72 135.00 133.33 2a6p s PRO 172 Ca 0.28 0.51 -0.30 0.00 0.04 0.00 0.00 61.00 61.52 2a6p s PRO 172 Cb 0.08 -1.81 -0.11 0.00 0.04 0.00 0.00 34.50 32.69 2a6p s PRO 172 CO -0.09 -2.32 1.60 0.95 0.04 0.00 0.00 177.00 177.18 2a6p s THR 173 N -3.09 2.09 -1.52 1.26 -4.23 -1.26 -2.04 115.64 106.85 2a6p s THR 173 Ca 0.64 0.07 0.00 0.00 -1.18 0.00 0.00 61.69 61.22 2a6p s THR 173 Cb -0.17 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.63 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 -0.36 -2.95 3.99 0.00 -0.73 -4.85 120.51 117.96 2a6p n ALA 174 Ca 0.09 0.19 -0.23 0.00 0.00 0.00 0.00 53.44 53.48 2a6p n ALA 174 Cb 0.37 -1.75 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 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 -2.54 6.28 -0.04 0.00 1.04 -0.86 -4.61 113.70 112.97 2a6p s SER 175 Ca 0.00 0.10 0.07 0.00 0.48 0.00 0.00 55.95 56.59 2a6p s SER 175 Cb 0.00 -1.85 -0.01 0.00 0.10 0.00 0.00 66.02 64.25 2a6p s SER 175 CO 0.00 -0.01 -0.25 -0.63 0.98 0.00 0.00 173.24 173.33 2a6p s ILE 176 N -1.88 2.01 0.04 -1.02 1.01 -0.11 -1.79 121.20 119.46 2a6p s ILE 176 Ca 0.34 -1.06 0.08 0.00 0.00 0.00 0.00 60.65 60.01 2a6p s ILE 176 Cb -0.10 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.66 2a6p s ILE 176 CO 0.28 0.56 -0.24 -0.83 0.00 0.00 0.00 174.94 174.72 2a6p s GLY 177 N -0.34 1.27 -0.08 6.18 0.00 -0.66 -1.93 107.32 111.76 2a6p s GLY 177 Ca 0.02 -1.17 0.01 0.00 0.00 0.00 0.00 44.72 43.59 2a6p s GLY 177 CO 0.02 -1.07 -0.10 -0.42 0.00 0.00 0.00 173.10 171.52 2a6p s ILE 178 N -0.79 1.09 -0.10 0.90 1.01 0.62 -0.85 121.20 123.08 2a6p s ILE 178 Ca 0.10 -0.41 -0.01 0.00 0.00 0.00 0.00 60.65 60.33 2a6p s ILE 178 Cb -0.09 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.31 2a6p s ILE 178 CO 0.02 0.36 -0.05 0.00 0.00 0.00 0.00 174.94 175.27 2a6p n GLY 180 N 2.61 4.62 3.07 0.00 0.00 0.26 -1.04 105.19 114.71 2a6p n GLY 180 Ca -0.18 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.11 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 0.61 0.44 -0.10 1.61 0.40 -1.26 -0.22 117.98 119.46 2a6p s PHE 181 Ca 0.00 -0.92 -0.04 0.00 -0.60 0.00 0.00 56.93 55.38 2a6p s PHE 181 Cb 0.00 -0.33 0.05 0.00 0.51 0.00 0.00 43.02 43.25 2a6p s PHE 181 CO 0.00 -0.34 0.19 -2.00 0.70 0.00 0.00 175.22 173.76 2a6p s GLU 182 N -3.34 0.06 -1.39 0.44 2.12 -0.12 -4.87 118.70 111.61 2a6p s GLU 182 Ca 0.02 0.59 -0.11 0.00 0.36 0.00 0.00 54.97 55.83 2a6p s GLU 182 Cb 0.04 -0.25 0.01 0.00 0.26 0.00 0.00 34.13 34.19 2a6p s GLU 182 CO -0.08 -0.31 0.35 0.72 -0.54 0.00 0.00 175.26 175.40 2a6p n HIS 183 N 5.33 -1.45 -0.61 5.30 8.25 -1.26 -1.05 115.22 129.74 2a6p n HIS 183 Ca -0.05 0.49 0.00 0.00 -0.26 0.00 0.00 57.72 57.90 2a6p n HIS 183 Cb 0.50 -3.08 0.00 0.00 1.12 0.00 0.00 29.99 28.52 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 -2.23 1.63 3.58 -1.41 0.00 -1.26 -5.03 105.19 100.47 2a6p n GLY 184 Ca -0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.55 4.15 0.08 1.61 1.01 -0.21 -5.07 120.40 118.43 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 -2.80 -0.08 0.00 0.00 0.00 0.00 36.38 33.50 2a6p s VAL 185 CO 0.00 0.53 1.55 -0.13 0.00 0.00 0.00 175.10 177.04 2a6p s ARG 186 N -0.09 4.24 0.05 2.72 0.52 -1.26 -0.95 118.95 124.18 2a6p s ARG 186 Ca 0.03 2.22 0.00 0.00 -0.52 0.00 0.00 55.73 57.47 2a6p s ARG 186 Cb -0.13 -3.46 -0.03 0.00 0.52 0.00 0.00 34.95 31.85 2a6p s ARG 186 CO 0.02 -0.63 -0.05 -1.14 0.02 0.00 0.00 175.30 173.52 2a6p s GLN 187 N 2.07 0.57 -0.32 3.54 0.74 0.70 -4.69 119.66 122.27 2a6p s GLN 187 Ca 0.70 -1.01 -0.21 0.00 0.05 0.00 0.00 55.36 54.88 2a6p s GLN 187 Cb -0.38 0.01 -0.00 0.00 1.10 0.00 0.00 33.01 33.73 2a6p s GLN 187 CO 0.31 -0.05 0.67 -1.17 -0.55 0.00 0.00 175.29 174.49 2a6p s LEU 188 N -2.35 4.15 -0.19 3.68 0.20 -1.26 -0.58 118.68 122.33 2a6p s LEU 188 Ca -0.01 0.42 -0.05 0.00 0.69 0.00 0.00 54.13 55.19 2a6p s LEU 188 Cb -0.00 -2.87 -0.21 0.00 -0.43 0.00 0.00 46.19 42.68 2a6p s LEU 188 CO -0.05 -0.53 0.08 0.00 -0.29 0.00 0.00 176.35 175.56 2a6p n ALA 189 N 5.99 1.11 -2.84 5.97 0.00 0.14 -4.94 120.51 125.93 2a6p n ALA 189 Ca -0.00 -0.81 -0.13 0.00 0.00 0.00 0.00 53.44 52.49 2a6p n ALA 189 Cb 0.49 -0.40 -0.13 0.00 0.00 0.00 0.00 19.45 19.41 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 -2.53 0.41 -0.05 0.00 1.01 -0.77 -4.93 120.40 113.53 2a6p s VAL 190 Ca -0.29 -0.69 -0.13 0.00 0.00 0.00 0.00 61.98 60.88 2a6p s VAL 190 Cb 0.08 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 36.05 2a6p s VAL 190 CO 0.68 -0.20 0.30 -0.22 0.00 0.00 0.00 175.10 175.66 2a6p s LEU 191 N -0.95 0.87 -1.64 3.92 2.96 -1.26 -0.28 118.68 122.31 2a6p s LEU 191 Ca -0.06 0.27 0.00 0.00 -0.22 0.00 0.00 54.13 54.12 2a6p s LEU 191 Cb -0.07 1.16 0.00 0.00 0.50 0.00 0.00 46.19 47.79 2a6p s LEU 191 CO 0.00 -0.32 0.00 0.61 -1.32 0.00 0.00 176.35 175.32 2a6p n GLY 192 N 1.89 0.50 3.71 7.98 0.00 -1.19 -4.95 105.19 113.14 2a6p n GLY 192 Ca -0.18 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 -4.60 4.36 -0.02 0.99 0.20 -0.81 -4.83 118.68 113.96 2a6p s LEU 193 Ca 0.00 2.14 0.03 0.00 0.69 0.00 0.00 54.13 56.98 2a6p s LEU 193 Cb 0.00 -3.58 0.00 0.00 -0.43 0.00 0.00 46.19 42.18 2a6p s LEU 193 CO 0.00 -0.58 -0.09 -0.89 -0.29 0.00 0.00 176.35 174.50 2a6p s THR 194 N 1.33 0.80 -1.93 3.68 2.01 -1.26 -0.94 115.64 119.33 2a6p s THR 194 Ca 0.61 -0.38 0.18 0.00 0.31 0.00 0.00 61.69 62.42 2a6p s THR 194 Cb -0.32 -0.70 0.35 0.00 0.01 0.00 0.00 72.50 71.83 2a6p s THR 194 CO 0.29 0.25 1.28 0.61 -0.69 0.00 0.00 174.62 176.35 2a6p n GLY 195 N 3.20 1.62 0.01 4.40 0.00 -1.26 -5.10 105.19 108.07 2a6p n GLY 195 Ca -0.17 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2a6p n GLY 195 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93