#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w5p s SER 1 N 0.00 0.64 -0.16 1.61 0.15 0.54 -4.94 113.70 111.54 2w5p s SER 1 Ca 0.00 -0.08 -0.13 0.00 0.70 0.00 0.00 55.95 56.44 2w5p s SER 1 Cb 0.00 -0.26 -0.05 0.00 -1.71 0.00 0.00 66.02 64.00 2w5p s SER 1 CO 0.00 -0.04 0.27 0.12 1.20 0.00 0.00 173.24 174.79 2w5p s PHE 2 N 0.66 3.48 -0.31 3.44 2.19 -1.26 -1.49 117.98 124.68 2w5p s PHE 2 Ca -0.08 0.57 -0.07 0.00 0.33 0.00 0.00 56.93 57.68 2w5p s PHE 2 Cb -0.11 -2.29 0.01 0.00 -1.31 0.00 0.00 43.02 39.33 2w5p s PHE 2 CO -0.01 0.30 0.10 0.99 1.83 0.00 0.00 175.22 178.43 2w5p s THR 3 N 0.28 4.07 0.07 0.12 2.01 0.12 -4.96 115.64 117.36 2w5p s THR 3 Ca 0.16 -0.74 -0.31 0.00 0.31 0.00 0.00 61.69 61.11 2w5p s THR 3 Cb -0.13 -3.14 -0.08 0.00 0.01 0.00 0.00 72.50 69.16 2w5p s THR 3 CO 0.03 0.01 1.62 -2.84 -0.69 0.00 0.00 174.62 172.76 2w5p s PRO 4 N 1.50 4.21 -0.44 4.92 0.02 -1.26 -1.07 135.00 142.88 2w5p s PRO 4 Ca 0.02 2.30 0.04 0.00 0.02 0.00 0.00 61.00 63.38 2w5p s PRO 4 Cb -0.18 -3.56 0.19 0.00 0.02 0.00 0.00 34.50 30.98 2w5p s PRO 4 CO 0.03 -0.71 0.78 0.45 -0.33 0.00 0.00 177.00 177.23 2w5p s SER 5 N 2.25 -1.19 0.00 2.53 0.15 -0.12 -4.91 113.70 112.41 2w5p s SER 5 Ca 0.73 -1.05 0.00 0.00 0.70 0.00 0.00 55.95 56.33 2w5p s SER 5 Cb -0.39 1.54 0.00 0.00 -1.71 0.00 0.00 66.02 65.46 2w5p s SER 5 CO 0.32 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.28 2w5p n GLY 6 N 3.46 0.15 3.96 9.45 0.00 -1.19 -3.65 105.19 117.37 2w5p n GLY 6 Ca 0.13 -1.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.29 2w5p n GLY 6 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2w5p s THR 7 N -2.51 4.02 -0.19 2.61 -4.23 -1.26 -4.55 115.64 109.53 2w5p s THR 7 Ca 0.00 -0.55 -0.06 0.00 -1.18 0.00 0.00 61.69 59.90 2w5p s THR 7 Cb 0.00 -3.48 -0.03 0.00 1.34 0.00 0.00 72.50 70.33 2w5p s THR 7 CO 0.00 -0.32 0.03 -0.89 -0.54 0.00 0.00 174.62 172.90 2w5p s THR 8 N -2.51 4.32 -0.10 3.99 2.01 -1.26 -1.32 115.64 120.77 2w5p s THR 8 Ca 0.48 -0.19 -0.00 0.00 0.31 0.00 0.00 61.69 62.28 2w5p s THR 8 Cb -0.10 -2.95 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 2w5p s THR 8 CO 0.37 0.43 -0.07 -0.83 -0.69 0.00 0.00 174.62 173.84 2w5p s GLY 9 N 0.76 1.68 -0.22 4.40 0.00 -0.13 -4.98 107.32 108.82 2w5p s GLY 9 Ca 0.02 -0.87 -0.01 0.00 0.00 0.00 0.00 44.72 43.85 2w5p s GLY 9 CO 0.02 -0.44 -0.10 -1.59 0.00 0.00 0.00 173.10 170.99 2w5p s THR 10 N -0.34 2.70 -0.25 0.90 2.01 -1.26 -1.31 115.64 118.09 2w5p s THR 10 Ca 0.05 -0.93 -0.20 0.00 0.31 0.00 0.00 61.69 60.92 2w5p s THR 10 Cb -0.12 -2.30 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 2w5p s THR 10 CO 0.02 0.32 0.61 -0.89 -0.69 0.00 0.00 174.62 174.00 2w5p s THR 11 N 1.33 5.00 -0.12 -0.82 2.01 0.63 -4.93 115.64 118.73 2w5p s THR 11 Ca 0.02 1.09 -0.02 0.00 0.31 0.00 0.00 61.69 63.09 2w5p s THR 11 Cb -0.15 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.41 2w5p s THR 11 CO -0.07 0.04 -0.04 -0.54 -0.69 0.00 0.00 174.62 173.33 2w5p s LYS 12 N 2.42 3.35 -0.06 4.92 3.01 -1.26 -0.56 119.74 131.56 2w5p s LYS 12 Ca 0.26 -0.52 0.02 0.00 -1.01 0.00 0.00 55.97 54.72 2w5p s LYS 12 Cb -0.16 -2.81 0.01 0.00 -1.01 0.00 0.00 37.83 33.86 2w5p s LYS 12 CO 0.09 0.41 -0.12 -1.17 0.51 0.00 0.00 175.35 175.07 2w5p s LEU 13 N -0.09 1.66 -0.29 3.17 2.96 0.37 -4.41 118.68 122.05 2w5p s LEU 13 Ca 0.02 -0.28 -0.10 0.00 -0.22 0.00 0.00 54.13 53.55 2w5p s LEU 13 Cb -0.13 -0.78 -0.04 0.00 0.50 0.00 0.00 46.19 45.75 2w5p s LEU 13 CO 0.03 0.04 0.17 -0.89 -1.32 0.00 0.00 176.35 174.38 2w5p s THR 14 N 0.58 5.03 -0.12 3.68 2.01 -0.32 -0.10 115.64 126.40 2w5p s THR 14 Ca -0.12 -0.03 -0.18 0.00 0.31 0.00 0.00 61.69 61.67 2w5p s THR 14 Cb -0.15 -3.44 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 2w5p s THR 14 CO 0.03 0.20 0.47 -0.69 -0.69 0.00 0.00 174.62 173.94 2w5p s VAL 15 N 1.71 5.19 0.47 3.82 1.01 0.34 -0.93 120.40 132.02 2w5p s VAL 15 Ca 0.06 0.93 0.02 0.00 0.00 0.00 0.00 61.98 63.00 2w5p s VAL 15 Cb -0.16 -3.81 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 2w5p s VAL 15 CO 0.09 0.32 0.07 0.42 0.00 0.00 0.00 175.10 176.00 2w5p s THR 16 N 0.65 0.80 0.49 3.92 -4.23 -0.13 -1.52 115.64 115.62 2w5p s THR 16 Ca 0.25 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.73 2w5p s THR 16 Cb -0.15 -2.18 0.10 0.00 1.34 0.00 0.00 72.50 71.62 2w5p s THR 16 CO 0.10 0.00 0.67 -0.62 -0.54 0.00 0.00 174.62 174.23 2w5p n GLU 17 N -1.13 -0.09 0.01 3.99 -0.58 -1.26 -1.03 120.64 120.54 2w5p n GLU 17 Ca -0.14 -1.56 -0.10 0.00 -0.42 0.00 0.00 57.16 54.94 2w5p n GLU 17 Cb 0.66 -0.53 -0.04 0.00 -0.57 0.00 0.00 31.44 30.97 2w5p n GLU 17 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2w5p h LYS 18 N 0.00 -0.13 -6.42 3.49 3.64 -1.98 -3.37 116.57 111.80 2w5p h LYS 18 Ca -0.22 0.01 -0.57 0.00 -1.27 0.00 0.00 60.65 58.60 2w5p h LYS 18 Cb 0.75 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.55 2w5p h LYS 18 CO 0.21 -0.09 1.01 0.00 -2.27 0.00 0.00 179.45 178.31 2w5p s GLN 20 N 4.47 2.46 -0.36 0.00 0.74 -1.26 -5.05 119.66 120.66 2w5p s GLN 20 Ca 0.59 -0.63 -0.02 0.00 0.05 0.00 0.00 55.36 55.35 2w5p s GLN 20 Cb -0.16 -2.18 0.08 0.00 1.10 0.00 0.00 33.01 31.85 2w5p s GLN 20 CO 0.27 -0.19 0.11 0.08 -0.55 0.00 0.00 175.29 175.00 2w5p s VAL 21 N 1.34 3.13 0.02 1.34 1.01 -1.26 -5.09 120.40 120.89 2w5p s VAL 21 Ca 0.03 -1.75 -0.28 0.00 0.00 0.00 0.00 61.98 59.98 2w5p s VAL 21 Cb -0.13 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 2w5p s VAL 21 CO -0.09 -0.42 0.87 -0.13 0.00 0.00 0.00 175.10 175.33 2w5p s ARG 22 N 1.19 4.55 -0.10 2.72 0.52 -1.26 -5.05 118.95 121.52 2w5p s ARG 22 Ca 0.02 1.24 0.01 0.00 -0.52 0.00 0.00 55.73 56.49 2w5p s ARG 22 Cb -0.21 -3.42 0.02 0.00 0.52 0.00 0.00 34.95 31.86 2w5p s ARG 22 CO -0.03 0.10 -0.13 0.08 0.02 0.00 0.00 175.30 175.35 2w5p s VAL 23 N 0.53 1.28 0.00 3.52 1.01 -1.26 -5.07 120.40 120.41 2w5p s VAL 23 Ca 0.45 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.92 2w5p s VAL 23 Cb -0.21 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 34.98 2w5p s VAL 23 CO 0.25 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.36 2w5p n GLY 24 N 4.26 -1.72 3.75 4.51 0.00 -1.26 -4.94 105.19 109.79 2w5p n GLY 24 Ca -0.19 -1.53 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 2w5p n GLY 24 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2w5p s ASP 25 N -4.00 4.66 0.25 1.61 3.84 -1.26 -4.92 116.67 116.85 2w5p s ASP 25 Ca 0.00 2.05 -0.30 0.00 -0.00 0.00 0.00 52.55 54.30 2w5p s ASP 25 Cb 0.00 -2.55 -0.14 0.00 -1.38 0.00 0.00 42.92 38.85 2w5p s ASP 25 CO 0.00 -1.94 1.23 -0.11 -0.00 0.00 0.00 175.17 174.35 2w5p n LEU 26 N -2.81 2.49 -4.03 2.11 7.94 -1.26 -5.01 117.00 116.43 2w5p n LEU 26 Ca 0.11 1.16 -0.10 0.00 -1.11 0.00 0.00 56.01 56.08 2w5p n LEU 26 Cb 0.52 -1.35 -0.06 0.00 0.53 0.00 0.00 43.42 43.05 2w5p n LEU 26 CO 0.49 -0.90 0.11 0.42 -1.11 0.00 0.00 177.39 176.40 2w5p s THR 27 N -0.52 0.00 -0.15 1.96 -4.23 -1.26 -5.14 115.64 106.30 2w5p s THR 27 Ca 0.65 -1.50 -0.27 0.00 -1.18 0.00 0.00 61.69 59.38 2w5p s THR 27 Cb -0.69 -2.25 -0.01 0.00 1.34 0.00 0.00 72.50 70.88 2w5p s THR 27 CO 0.55 -0.00 0.92 -0.69 -0.54 0.00 0.00 174.62 174.86 2w5p s VAL 28 N -4.04 4.82 0.02 2.29 1.01 -1.26 -5.01 120.40 118.23 2w5p s VAL 28 Ca 0.25 1.84 0.02 0.00 0.00 0.00 0.00 61.98 64.09 2w5p s VAL 28 Cb 0.01 -4.23 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 2w5p s VAL 28 CO 0.09 -0.00 -0.07 0.00 0.00 0.00 0.00 175.10 175.12 2w5p s ALA 29 N 2.19 0.57 0.01 5.51 0.00 -1.26 -1.17 121.76 127.61 2w5p s ALA 29 Ca 0.43 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.85 2w5p s ALA 29 Cb -0.17 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 2w5p s ALA 29 CO 0.14 0.06 -0.03 0.15 0.00 0.00 0.00 175.76 176.08 2w5p s LYS 30 N -0.92 0.23 0.75 0.00 1.02 -0.10 -4.93 119.74 115.78 2w5p s LYS 30 Ca -0.04 -0.24 -0.11 0.00 0.02 0.00 0.00 55.97 55.61 2w5p s LYS 30 Cb -0.06 -0.12 0.04 0.00 -0.52 0.00 0.00 37.83 37.17 2w5p s LYS 30 CO 0.00 0.03 1.08 0.95 -0.92 0.00 0.00 175.35 176.49 2w5p s THR 31 N -0.44 3.51 0.40 2.17 -4.23 -1.26 -0.96 115.64 114.84 2w5p s THR 31 Ca -0.03 0.49 0.12 0.00 -1.18 0.00 0.00 61.69 61.09 2w5p s THR 31 Cb -0.03 -3.05 0.14 0.00 1.34 0.00 0.00 72.50 70.90 2w5p s THR 31 CO -0.00 -0.64 1.91 0.08 -0.54 0.00 0.00 174.62 175.42 2w5p h ARG 32 N -1.02 0.08 0.00 3.99 0.11 -1.37 -1.72 114.38 114.45 2w5p h ARG 32 Ca -0.44 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.62 2w5p h ARG 32 Cb 1.23 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.30 2w5p h ARG 32 CO 0.53 0.31 0.00 0.78 0.10 0.00 0.00 179.97 181.69 2w5p h GLY 33 N 0.79 0.00 1.62 0.08 0.00 -1.86 -1.01 103.07 102.69 2w5p h GLY 33 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2w5p h GLY 33 CO 0.03 0.00 -0.05 -1.06 0.00 0.00 0.00 176.54 175.46 2w5p n GLN 34 N -2.87 0.26 -1.67 4.80 6.02 -0.65 -4.44 117.38 118.85 2w5p n GLN 34 Ca -0.01 -0.03 -0.33 0.00 -0.01 0.00 0.00 57.00 56.62 2w5p n GLN 34 Cb 0.16 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 29.88 2w5p n GLN 34 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2w5p n LEU 35 N -1.34 7.28 -4.90 1.08 4.77 -0.38 -4.79 117.00 118.71 2w5p n LEU 35 Ca 0.11 -4.40 -0.29 0.00 -0.03 0.00 0.00 56.01 51.41 2w5p n LEU 35 Cb 0.29 -1.33 0.03 0.00 -2.33 0.00 0.00 43.42 40.08 2w5p n LEU 35 CO 0.26 1.91 0.64 0.42 -1.33 0.00 0.00 177.39 179.28 2w5p s THR 36 N -1.13 3.83 0.28 -5.08 -4.23 -1.26 -0.70 115.64 107.35 2w5p s THR 36 Ca 0.58 0.32 -0.30 0.00 -1.18 0.00 0.00 61.69 61.11 2w5p s THR 36 Cb 0.27 -3.55 -0.12 0.00 1.34 0.00 0.00 72.50 70.44 2w5p s THR 36 CO -0.13 -0.65 1.56 -0.67 -0.54 0.00 0.00 174.62 174.18 2w5p n ASP 37 N -2.75 3.60 0.00 3.99 2.03 -1.26 -2.01 116.55 120.15 2w5p n ASP 37 Ca 0.05 1.14 0.00 0.00 0.52 0.00 0.00 54.79 56.50 2w5p n ASP 37 Cb 0.57 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.41 2w5p n ASP 37 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2w5p n ALA 38 N 2.18 0.00 -1.78 -1.67 0.00 0.71 -4.94 120.51 115.01 2w5p n ALA 38 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.12 2w5p n ALA 38 Cb 0.35 -0.23 -0.02 0.00 0.00 0.00 0.00 19.45 19.55 2w5p n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w5p s ALA 39 N -3.19 3.74 0.26 0.00 0.00 -0.85 -4.52 121.76 117.18 2w5p s ALA 39 Ca 0.00 1.54 -0.30 0.00 0.00 0.00 0.00 51.96 53.21 2w5p s ALA 39 Cb 0.00 -3.64 -0.09 0.00 0.00 0.00 0.00 23.12 19.39 2w5p s ALA 39 CO 0.00 -0.95 1.17 -1.25 0.00 0.00 0.00 175.76 174.72 2w5p s PRO 40 N -0.45 4.55 -0.23 0.00 0.04 -1.26 -0.46 135.00 137.19 2w5p s PRO 40 Ca 0.63 1.89 -0.09 0.00 0.04 0.00 0.00 61.00 63.47 2w5p s PRO 40 Cb -0.47 -3.19 -0.11 0.00 0.04 0.00 0.00 34.50 30.78 2w5p s PRO 40 CO 0.47 0.05 -0.28 -0.89 0.04 0.00 0.00 177.00 176.39 2w5p n ILE 41 N 1.58 1.26 0.00 0.56 2.08 0.12 -4.89 119.36 120.06 2w5p n ILE 41 Ca 0.01 -0.35 0.00 0.00 0.56 0.00 0.00 62.75 62.97 2w5p n ILE 41 Cb 0.44 -1.72 0.00 0.00 -0.75 0.00 0.00 39.64 37.61 2w5p n ILE 41 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2w5p n GLY 42 N 1.71 1.13 3.92 7.39 0.00 -1.20 -5.00 105.19 113.15 2w5p n GLY 42 Ca -0.44 -0.87 -0.22 0.00 0.00 0.00 0.00 46.02 44.49 2w5p n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2w5p s PRO 43 N -2.00 3.29 -0.16 1.61 0.04 -1.26 -1.10 135.00 135.41 2w5p s PRO 43 Ca 0.00 -0.82 -0.00 0.00 0.04 0.00 0.00 61.00 60.22 2w5p s PRO 43 Cb 0.00 -2.80 0.04 0.00 0.04 0.00 0.00 34.50 31.77 2w5p s PRO 43 CO 0.00 0.43 -0.07 0.08 0.04 0.00 0.00 177.00 177.48 2w5p s VAL 44 N -1.99 1.22 0.29 -0.36 1.01 0.88 -4.95 120.40 116.51 2w5p s VAL 44 Ca 0.34 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 61.39 2w5p s VAL 44 Cb -0.09 -1.34 -0.09 0.00 0.00 0.00 0.00 36.38 34.86 2w5p s VAL 44 CO 0.28 0.20 1.06 0.42 0.00 0.00 0.00 175.10 177.05 2w5p s THR 45 N 1.59 3.65 -0.02 3.92 -4.23 -1.26 -0.37 115.64 118.92 2w5p s THR 45 Ca 0.01 1.60 0.01 0.00 -1.18 0.00 0.00 61.69 62.14 2w5p s THR 45 Cb -0.15 -3.99 0.01 0.00 1.34 0.00 0.00 72.50 69.71 2w5p s THR 45 CO -0.08 0.33 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.61 2w5p s VAL 46 N -1.25 0.33 -0.15 2.29 1.01 -0.54 -4.92 120.40 117.17 2w5p s VAL 46 Ca 0.46 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.31 2w5p s VAL 46 Cb -0.29 -0.34 0.07 0.00 0.00 0.00 0.00 36.38 35.82 2w5p s VAL 46 CO 0.37 0.14 0.17 -1.58 0.00 0.00 0.00 175.10 174.20 2w5p s GLN 47 N 0.44 0.11 0.16 2.72 2.00 -1.26 -1.03 119.66 122.80 2w5p s GLN 47 Ca -0.05 0.27 -0.11 0.00 -2.00 0.00 0.00 55.36 53.47 2w5p s GLN 47 Cb -0.08 -1.01 -0.07 0.00 0.80 0.00 0.00 33.01 32.65 2w5p s GLN 47 CO -0.01 -0.53 0.51 0.00 -0.50 0.00 0.00 175.29 174.76 2w5p s ALA 48 N 2.27 3.62 -0.01 1.58 0.00 -0.54 -5.01 121.76 123.67 2w5p s ALA 48 Ca 0.04 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.76 2w5p s ALA 48 Cb -0.14 -2.42 0.00 0.00 0.00 0.00 0.00 23.12 20.56 2w5p s ALA 48 CO -0.09 0.51 -0.03 -0.51 0.00 0.00 0.00 175.76 175.64 2w5p s LEU 49 N -2.30 1.86 -0.54 0.00 1.43 -1.26 -4.61 118.68 113.25 2w5p s LEU 49 Ca 0.41 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.45 2w5p s LEU 49 Cb -0.13 -0.17 0.00 0.00 0.03 0.00 0.00 46.19 45.91 2w5p s LEU 49 CO 0.20 0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.40 2w5p n GLY 50 N 3.20 0.77 1.20 -3.19 0.00 -1.26 -4.92 105.19 100.99 2w5p n GLY 50 Ca -0.15 -0.65 -0.03 0.00 0.00 0.00 0.00 46.02 45.19 2w5p n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w5p h ASP 52 N 1.15 0.00 -0.48 0.00 3.45 -1.91 -1.15 116.42 117.48 2w5p h ASP 52 Ca 0.21 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.67 2w5p h ASP 52 Cb 1.72 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.49 2w5p h ASP 52 CO 0.41 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 178.08 2w5p n ALA 53 N -2.51 2.63 -2.32 3.45 0.00 -1.26 -3.32 120.51 117.18 2w5p n ALA 53 Ca 0.03 -1.51 -0.16 0.00 0.00 0.00 0.00 53.44 51.79 2w5p n ALA 53 Cb 0.34 -0.73 -0.10 0.00 0.00 0.00 0.00 19.45 18.96 2w5p n ALA 53 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2w5p s ARG 54 N -1.58 1.15 -0.35 0.00 1.81 -0.45 -4.92 118.95 114.61 2w5p s ARG 54 Ca 0.39 -1.47 -0.18 0.00 -1.72 0.00 0.00 55.73 52.75 2w5p s ARG 54 Cb 0.24 -0.84 -0.00 0.00 -0.45 0.00 0.00 34.95 33.90 2w5p s ARG 54 CO 0.20 0.13 0.49 -0.65 -0.68 0.00 0.00 175.30 174.79 2w5p s GLN 55 N -3.56 3.61 0.43 3.54 -0.21 -1.26 -1.63 119.66 120.58 2w5p s GLN 55 Ca 0.18 -0.20 -0.25 0.00 0.02 0.00 0.00 55.36 55.10 2w5p s GLN 55 Cb 0.00 -3.81 -0.08 0.00 1.00 0.00 0.00 33.01 30.12 2w5p s GLN 55 CO 0.03 -0.63 1.33 0.08 -2.12 0.00 0.00 175.29 173.98 2w5p s VAL 56 N 2.34 2.46 0.13 1.09 1.01 -1.26 -1.24 120.40 124.93 2w5p s VAL 56 Ca 0.18 0.40 -0.11 0.00 0.00 0.00 0.00 61.98 62.45 2w5p s VAL 56 Cb -0.16 -3.23 0.01 0.00 0.00 0.00 0.00 36.38 33.00 2w5p s VAL 56 CO 0.13 0.05 0.28 0.00 0.00 0.00 0.00 175.10 175.56 2w5p s ALA 57 N -1.26 -0.34 -0.04 5.51 0.00 -0.40 -0.58 121.76 124.65 2w5p s ALA 57 Ca 0.59 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 52.02 2w5p s ALA 57 Cb -0.39 0.67 0.00 0.00 0.00 0.00 0.00 23.12 23.40 2w5p s ALA 57 CO 0.50 -0.60 -0.12 -0.51 0.00 0.00 0.00 175.76 175.03 2w5p s LEU 58 N -2.89 1.78 -0.14 0.00 2.01 0.23 -1.64 118.68 118.03 2w5p s LEU 58 Ca 0.09 -0.26 -0.00 0.00 0.01 0.00 0.00 54.13 53.96 2w5p s LEU 58 Cb 0.03 -0.74 -0.01 0.00 0.01 0.00 0.00 46.19 45.48 2w5p s LEU 58 CO -0.07 0.08 -0.13 -0.75 1.01 0.00 0.00 176.35 176.49 2w5p s LYS 59 N 0.28 3.35 0.49 1.70 2.20 0.72 -1.03 119.74 127.45 2w5p s LYS 59 Ca -0.06 -0.69 -0.15 0.00 -0.36 0.00 0.00 55.97 54.70 2w5p s LYS 59 Cb -0.11 -2.65 -0.08 0.00 -1.51 0.00 0.00 37.83 33.48 2w5p s LYS 59 CO 0.02 0.15 0.94 0.00 -0.36 0.00 0.00 175.35 176.10 2w5p s ALA 60 N 0.50 3.13 0.79 3.13 0.00 -0.21 -0.30 121.76 128.79 2w5p s ALA 60 Ca -0.09 0.11 -0.13 0.00 0.00 0.00 0.00 51.96 51.85 2w5p s ALA 60 Cb -0.16 -3.03 0.07 0.00 0.00 0.00 0.00 23.12 20.00 2w5p s ALA 60 CO 0.04 -0.17 1.18 -0.51 0.00 0.00 0.00 175.76 176.30 2w5p s ASP 61 N -3.04 3.84 0.36 0.00 1.11 -0.52 -4.87 116.67 113.56 2w5p s ASP 61 Ca 0.57 2.25 0.11 0.00 0.18 0.00 0.00 52.55 55.67 2w5p s ASP 61 Cb -0.10 -2.58 0.89 0.00 1.07 0.00 0.00 42.92 42.20 2w5p s ASP 61 CO 0.30 -2.50 1.84 0.74 1.18 0.00 0.00 175.17 176.73 2w5p h THR 62 N -0.86 0.75 -0.34 -1.27 2.02 -1.93 -0.22 112.91 111.06 2w5p h THR 62 Ca -0.46 -0.21 -0.10 0.00 0.77 0.00 0.00 66.41 66.41 2w5p h THR 62 Cb 1.28 0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 67.71 2w5p h THR 62 CO 0.47 0.11 0.13 0.47 0.37 0.00 0.00 175.52 177.07 2w5p n ASP 63 N -4.59 3.22 -0.01 4.18 8.00 -1.26 -3.84 116.55 122.25 2w5p n ASP 63 Ca 0.20 -2.55 0.00 0.00 0.71 0.00 0.00 54.79 53.15 2w5p n ASP 63 Cb 0.58 -0.61 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 2w5p n ASP 63 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2w5p n ASN 64 N 0.06 1.10 -3.70 -2.24 5.03 -0.09 -4.53 115.26 110.89 2w5p n ASN 64 Ca 0.19 -1.60 -0.14 0.00 0.87 0.00 0.00 54.58 53.89 2w5p n ASN 64 Cb 0.83 -0.02 -0.09 0.00 -1.02 0.00 0.00 39.78 39.49 2w5p n ASN 64 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 2w5p s PHE 65 N -0.60 -0.43 -0.17 3.10 -0.12 -1.25 -0.94 117.98 117.57 2w5p s PHE 65 Ca 0.01 0.93 -0.09 0.00 -0.05 0.00 0.00 56.93 57.73 2w5p s PHE 65 Cb 0.01 0.19 -0.07 0.00 -0.63 0.00 0.00 43.02 42.51 2w5p s PHE 65 CO 0.00 -0.35 -0.22 -0.85 -0.05 0.00 0.00 175.22 173.75 2w5p n GLU 66 N 2.05 0.36 -1.97 1.99 0.28 -1.26 -4.98 120.64 117.12 2w5p n GLU 66 Ca -0.17 0.16 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 2w5p n GLU 66 Cb 0.57 -1.11 0.00 0.00 1.43 0.00 0.00 31.44 32.33 2w5p n GLU 66 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2w5p n LYS 69 N -3.77 -4.77 -3.34 3.44 5.02 -1.26 -5.08 118.16 108.40 2w5p n LYS 69 Ca -0.34 3.40 -0.30 0.00 -2.02 0.00 0.00 58.31 59.05 2w5p n LYS 69 Cb 0.74 -3.78 -0.04 0.00 -0.02 0.00 0.00 35.03 31.93 2w5p n LYS 69 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2w5p s PHE 70 N -1.08 3.45 -0.05 2.13 0.40 -1.25 -5.01 117.98 116.57 2w5p s PHE 70 Ca 0.00 0.79 -0.26 0.00 -0.60 0.00 0.00 56.93 56.86 2w5p s PHE 70 Cb 0.00 -2.21 0.06 0.00 0.51 0.00 0.00 43.02 41.38 2w5p s PHE 70 CO 0.00 0.20 0.58 -0.59 0.70 0.00 0.00 175.22 176.10 2w5p s PHE 71 N -1.98 -0.53 0.30 0.36 -0.12 -0.11 -1.24 117.98 114.66 2w5p s PHE 71 Ca 0.46 0.92 -0.21 0.00 -0.05 0.00 0.00 56.93 58.05 2w5p s PHE 71 Cb -0.11 0.32 -0.09 0.00 -0.63 0.00 0.00 43.02 42.51 2w5p s PHE 71 CO 0.26 -0.54 0.83 -0.51 -0.05 0.00 0.00 175.22 175.21 2w5p s LEU 72 N -1.16 4.24 -0.08 -1.99 1.02 -0.36 -4.41 118.68 115.94 2w5p s LEU 72 Ca -0.11 1.58 0.03 0.00 0.02 0.00 0.00 54.13 55.64 2w5p s LEU 72 Cb -0.02 -3.94 -0.02 0.00 0.02 0.00 0.00 46.19 42.23 2w5p s LEU 72 CO 0.08 -0.09 -0.15 -0.51 0.02 0.00 0.00 176.35 175.70 2w5p s ILE 73 N -1.72 2.96 0.83 -0.59 1.10 -0.44 -1.42 121.20 121.93 2w5p s ILE 73 Ca 0.50 -0.74 -0.11 0.00 -0.51 0.00 0.00 60.65 59.79 2w5p s ILE 73 Cb -0.15 -2.18 0.10 0.00 0.15 0.00 0.00 42.46 40.38 2w5p s ILE 73 CO 0.20 0.57 1.13 -0.55 -2.11 0.00 0.00 174.94 174.18 2w5p s SER 74 N -0.29 3.68 0.29 4.50 0.15 -0.28 -0.98 113.70 120.78 2w5p s SER 74 Ca 0.02 2.08 0.00 0.00 0.70 0.00 0.00 55.95 58.76 2w5p s SER 74 Cb -0.13 -2.55 0.45 0.00 -1.71 0.00 0.00 66.02 62.08 2w5p s SER 74 CO 0.03 -2.59 1.83 0.44 1.20 0.00 0.00 173.24 174.14 2w5p h ASP 75 N -1.36 0.67 -4.11 5.45 5.19 -0.62 -3.35 116.42 118.29 2w5p h ASP 75 Ca -0.44 -0.13 -0.50 0.00 -0.62 0.00 0.00 57.03 55.34 2w5p h ASP 75 Cb 1.26 -0.18 0.08 0.00 0.18 0.00 0.00 39.33 40.67 2w5p h ASP 75 CO 0.46 0.71 0.42 0.54 -3.12 0.00 0.00 179.24 178.25 2w5p s ASN 76 N -6.65 5.62 -0.75 6.45 4.22 -1.26 -4.93 114.94 117.65 2w5p s ASN 76 Ca -0.09 2.12 0.01 0.00 -2.14 0.00 0.00 52.86 52.76 2w5p s ASN 76 Cb 0.15 -2.57 0.36 0.00 1.28 0.00 0.00 41.25 40.47 2w5p s ASN 76 CO 0.79 -1.28 1.57 -3.20 -2.04 0.00 0.00 177.10 172.94 2w5p n ASN 77 N -1.54 6.29 0.06 3.54 5.15 -1.26 -4.53 115.26 122.97 2w5p n ASN 77 Ca 0.11 -3.75 0.00 0.00 -0.60 0.00 0.00 54.58 50.34 2w5p n ASN 77 Cb 0.51 -0.86 0.00 0.00 -0.53 0.00 0.00 39.78 38.91 2w5p n ASN 77 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 2w5p n ARG 78 N -0.36 0.00 -1.90 1.20 0.63 -1.26 -4.97 116.66 109.99 2w5p n ARG 78 Ca 0.45 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.97 2w5p n ARG 78 Cb 0.37 -0.41 -0.01 0.00 0.45 0.00 0.00 32.46 32.86 2w5p n ARG 78 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2w5p s ASP 79 N -5.82 6.51 0.02 6.15 1.01 -1.26 -4.86 116.67 118.42 2w5p s ASP 79 Ca 0.00 2.86 0.05 0.00 0.71 0.00 0.00 52.55 56.18 2w5p s ASP 79 Cb 0.00 -2.64 -0.02 0.00 1.01 0.00 0.00 42.92 41.27 2w5p s ASP 79 CO 0.00 -0.78 -0.16 -0.54 0.21 0.00 0.00 175.17 173.90 2w5p s LYS 80 N -1.19 1.15 -0.33 8.23 1.02 -1.26 -1.12 119.74 126.24 2w5p s LYS 80 Ca 0.56 -0.72 0.02 0.00 0.02 0.00 0.00 55.97 55.85 2w5p s LYS 80 Cb -0.44 -1.17 0.09 0.00 -0.52 0.00 0.00 37.83 35.79 2w5p s LYS 80 CO 0.52 0.30 0.04 -1.17 -0.92 0.00 0.00 175.35 174.13 2w5p s LEU 81 N -0.86 4.52 0.29 3.17 2.96 -0.50 -4.97 118.68 123.29 2w5p s LEU 81 Ca 0.05 -1.92 -0.29 0.00 -0.22 0.00 0.00 54.13 51.75 2w5p s LEU 81 Cb -0.07 -1.65 -0.10 0.00 0.50 0.00 0.00 46.19 44.87 2w5p s LEU 81 CO 0.01 -0.36 1.25 -0.31 -1.32 0.00 0.00 176.35 175.61 2w5p s TYR 82 N 1.01 3.24 0.10 5.38 1.51 -1.26 -1.22 117.35 126.11 2w5p s TYR 82 Ca 0.05 1.46 -0.03 0.00 -1.01 0.00 0.00 57.07 57.55 2w5p s TYR 82 Cb -0.20 -3.55 -0.03 0.00 -0.11 0.00 0.00 41.96 38.07 2w5p s TYR 82 CO -0.06 -1.48 0.06 0.14 -1.11 0.00 0.00 175.55 173.11 2w5p s VAL 83 N -0.91 0.15 -0.03 0.71 -7.23 -0.38 -1.74 120.40 110.98 2w5p s VAL 83 Ca 0.49 -1.73 0.04 0.00 -1.81 0.00 0.00 61.98 58.97 2w5p s VAL 83 Cb -0.37 -1.74 -0.03 0.00 0.56 0.00 0.00 36.38 34.80 2w5p s VAL 83 CO 0.47 -0.67 -0.15 0.20 -0.31 0.00 0.00 175.10 174.64 2w5p s ASN 84 N -2.97 3.99 -0.07 4.85 0.01 0.11 -3.79 114.94 117.08 2w5p s ASN 84 Ca 0.15 -0.25 0.04 0.00 -0.71 0.00 0.00 52.86 52.09 2w5p s ASN 84 Cb 0.07 -0.80 -0.02 0.00 0.41 0.00 0.00 41.25 40.91 2w5p s ASN 84 CO -0.04 0.32 -0.17 0.27 -1.51 0.00 0.00 177.10 175.97 2w5p s ILE 85 N -0.79 2.79 -0.13 0.60 -4.36 -1.26 -1.08 121.20 116.97 2w5p s ILE 85 Ca 0.12 -0.81 -0.10 0.00 -0.26 0.00 0.00 60.65 59.61 2w5p s ILE 85 Cb -0.11 -2.09 0.04 0.00 1.25 0.00 0.00 42.46 41.56 2w5p s ILE 85 CO 0.02 0.57 0.34 -0.60 0.24 0.00 0.00 174.94 175.51 2w5p s ARG 86 N -0.39 0.36 0.36 0.37 3.52 -0.54 -4.97 118.95 117.66 2w5p s ARG 86 Ca 0.04 0.56 -0.27 0.00 -0.13 0.00 0.00 55.73 55.93 2w5p s ARG 86 Cb -0.12 0.08 -0.09 0.00 -1.56 0.00 0.00 34.95 33.26 2w5p s ARG 86 CO 0.02 -0.10 1.18 -1.25 -0.81 0.00 0.00 175.30 174.34 2w5p s PRO 87 N 0.68 4.27 0.41 5.12 0.04 -1.26 -0.56 135.00 143.69 2w5p s PRO 87 Ca -0.04 1.90 0.16 0.00 0.04 0.00 0.00 61.00 63.06 2w5p s PRO 87 Cb -0.05 -2.88 0.88 0.00 0.04 0.00 0.00 34.50 32.49 2w5p s PRO 87 CO -0.04 -0.15 1.89 1.79 0.04 0.00 0.00 177.00 180.52 2w5p h THR 88 N 2.66 1.11 0.00 1.26 1.35 -1.51 -2.55 112.91 115.24 2w5p h THR 88 Ca -0.48 -1.05 0.00 0.00 -0.55 0.00 0.00 66.41 64.33 2w5p h THR 88 Cb 1.23 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 2w5p h THR 88 CO 0.64 0.29 0.00 -0.90 -0.25 0.00 0.00 175.52 175.30 2w5p n ASP 89 N -4.04 0.00 -1.78 5.36 3.85 -1.26 -4.91 116.55 113.77 2w5p n ASP 89 Ca -0.02 -0.90 -0.19 0.00 -0.71 0.00 0.00 54.79 52.97 2w5p n ASP 89 Cb 0.36 -0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 40.07 2w5p n ASP 89 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2w5p n ASN 90 N -1.00 -5.39 -4.71 -1.12 3.02 -0.96 -5.00 115.26 100.10 2w5p n ASN 90 Ca 0.22 0.25 -0.31 0.00 -0.03 0.00 0.00 54.58 54.71 2w5p n ASN 90 Cb 0.10 -4.51 0.13 0.00 -0.61 0.00 0.00 39.78 34.89 2w5p n ASN 90 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2w5p s SER 91 N -2.50 3.60 -0.23 6.41 1.04 -1.26 -4.98 113.70 115.77 2w5p s SER 91 Ca 0.00 1.89 -0.21 0.00 0.48 0.00 0.00 55.95 58.11 2w5p s SER 91 Cb 0.00 -2.48 -0.02 0.00 0.10 0.00 0.00 66.02 63.62 2w5p s SER 91 CO 0.00 -2.63 0.65 0.00 0.98 0.00 0.00 173.24 172.25 2w5p s ALA 92 N -2.79 3.59 0.22 5.32 0.00 -1.26 -4.80 121.76 122.03 2w5p s ALA 92 Ca 0.64 -0.34 0.04 0.00 0.00 0.00 0.00 51.96 52.30 2w5p s ALA 92 Cb -0.20 -3.04 -0.05 0.00 0.00 0.00 0.00 23.12 19.83 2w5p s ALA 92 CO 0.57 -0.73 -0.03 -1.58 0.00 0.00 0.00 175.76 173.99 2w5p s TRP 93 N 2.33 1.55 0.08 0.00 0.52 -1.26 -1.01 118.94 121.14 2w5p s TRP 93 Ca 0.28 -0.86 0.05 0.00 0.02 0.00 0.00 56.10 55.60 2w5p s TRP 93 Cb -0.16 -0.87 -0.03 0.00 -1.15 0.00 0.00 33.47 31.26 2w5p s TRP 93 CO 0.09 0.03 -0.14 0.99 0.02 0.00 0.00 176.95 177.95 2w5p s THR 94 N -3.34 1.10 -0.20 2.01 2.01 -0.08 -4.89 115.64 112.24 2w5p s THR 94 Ca 0.26 -1.37 -0.06 0.00 0.31 0.00 0.00 61.69 60.83 2w5p s THR 94 Cb 0.05 -1.13 -0.03 0.00 0.01 0.00 0.00 72.50 71.40 2w5p s THR 94 CO 0.07 -0.28 0.02 -0.89 -0.69 0.00 0.00 174.62 172.85 2w5p s THR 95 N -1.47 4.17 -0.32 -0.82 2.01 -1.26 -0.93 115.64 117.02 2w5p s THR 95 Ca -0.01 -0.24 -0.00 0.00 0.31 0.00 0.00 61.69 61.75 2w5p s THR 95 Cb -0.09 -2.89 0.10 0.00 0.01 0.00 0.00 72.50 69.63 2w5p s THR 95 CO 0.02 0.42 0.10 -0.62 -0.69 0.00 0.00 174.62 173.86 2w5p s ASP 96 N 0.93 4.05 -1.10 3.53 3.68 0.14 -4.97 116.67 122.94 2w5p s ASP 96 Ca 0.02 -1.73 -0.23 0.00 2.13 0.00 0.00 52.55 52.73 2w5p s ASP 96 Cb -0.14 -0.92 0.02 0.00 -1.45 0.00 0.00 42.92 40.43 2w5p s ASP 96 CO 0.02 -0.40 0.69 -3.20 0.13 0.00 0.00 175.17 172.41 2w5p n ASN 97 N 4.73 -4.66 0.00 -0.34 5.15 -1.26 -1.67 115.26 117.20 2w5p n ASN 97 Ca -0.01 -1.13 0.00 0.00 -0.60 0.00 0.00 54.58 52.84 2w5p n ASN 97 Cb 0.42 -2.12 0.00 0.00 -0.53 0.00 0.00 39.78 37.54 2w5p n ASN 97 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2w5p n GLY 98 N -1.91 1.86 3.65 8.20 0.00 -1.26 -5.02 105.19 110.71 2w5p n GLY 98 Ca -0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 2w5p n GLY 98 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w5p s VAL 99 N -2.33 4.70 -0.30 1.61 1.01 -0.67 -1.05 120.40 123.36 2w5p s VAL 99 Ca 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.92 2w5p s VAL 99 Cb 0.00 -3.09 0.07 0.00 0.00 0.00 0.00 36.38 33.36 2w5p s VAL 99 CO 0.00 0.50 -0.02 0.12 0.00 0.00 0.00 175.10 175.70 2w5p s PHE 100 N 0.06 3.38 0.14 5.22 5.36 -0.20 0.24 117.98 132.20 2w5p s PHE 100 Ca 0.05 -2.32 0.11 0.00 -0.96 0.00 0.00 56.93 53.81 2w5p s PHE 100 Cb -0.12 -2.27 -0.04 0.00 -0.34 0.00 0.00 43.02 40.25 2w5p s PHE 100 CO 0.01 -0.88 -0.26 1.52 -1.46 0.00 0.00 175.22 174.15 2w5p s TYR 101 N 1.11 2.30 0.06 10.12 1.13 -0.11 -0.60 117.35 131.36 2w5p s TYR 101 Ca -0.03 -0.38 -0.28 0.00 -1.41 0.00 0.00 57.07 54.97 2w5p s TYR 101 Cb -0.20 -1.22 -0.05 0.00 -1.10 0.00 0.00 41.96 39.39 2w5p s TYR 101 CO -0.04 0.37 0.89 0.21 -2.51 0.00 0.00 175.55 174.47 2w5p s LYS 102 N -2.18 4.59 0.59 -3.49 2.20 0.26 -0.90 119.74 120.82 2w5p s LYS 102 Ca 0.15 1.29 0.39 0.00 -0.36 0.00 0.00 55.97 57.45 2w5p s LYS 102 Cb -0.10 -3.40 2.07 0.00 -1.51 0.00 0.00 37.83 34.90 2w5p s LYS 102 CO 0.07 0.17 2.20 -0.91 -0.36 0.00 0.00 175.35 176.51 2w5p h ASN 103 N 5.94 0.00 -4.03 1.43 2.35 -1.42 -3.42 115.58 116.43 2w5p h ASN 103 Ca -0.43 0.00 -0.40 0.00 -0.55 0.00 0.00 56.30 54.93 2w5p h ASN 103 Cb 1.21 0.00 -0.18 0.00 0.05 0.00 0.00 38.32 39.40 2w5p h ASN 103 CO 0.72 0.00 -0.75 -1.81 -1.65 0.00 0.00 177.43 173.94 2w5p s ASP 104 N -5.03 1.95 0.71 5.81 1.01 -1.26 -5.10 116.67 114.75 2w5p s ASP 104 Ca -0.03 -0.84 -0.12 0.00 0.71 0.00 0.00 52.55 52.27 2w5p s ASP 104 Cb 0.11 -0.06 0.02 0.00 1.01 0.00 0.00 42.92 44.00 2w5p s ASP 104 CO 0.40 -0.18 1.08 0.68 0.21 0.00 0.00 175.17 177.35 2w5p s VAL 105 N -2.34 3.68 0.00 -1.27 -7.23 -1.26 -4.59 120.40 107.39 2w5p s VAL 105 Ca 0.10 0.59 0.00 0.00 -1.81 0.00 0.00 61.98 60.87 2w5p s VAL 105 Cb -0.04 -3.20 0.00 0.00 0.56 0.00 0.00 36.38 33.71 2w5p s VAL 105 CO 0.03 -0.66 0.00 0.61 -0.31 0.00 0.00 175.10 174.76 2w5p n GLY 106 N -1.45 4.67 2.70 2.32 0.00 -0.65 -4.92 105.19 107.85 2w5p n GLY 106 Ca 0.08 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.45 2w5p n GLY 106 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2w5p n SER 107 N 0.00 4.67 -4.77 1.61 7.64 -1.23 -4.45 113.62 117.10 2w5p n SER 107 Ca 0.00 -2.86 -0.40 0.00 1.01 0.00 0.00 58.87 56.63 2w5p n SER 107 Cb 0.00 -1.62 0.01 0.00 -1.01 0.00 0.00 64.21 61.59 2w5p n SER 107 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 2w5p s TRP 108 N 2.58 2.59 0.02 1.43 -0.00 -1.26 -4.56 118.94 119.74 2w5p s TRP 108 Ca 0.49 1.32 0.05 0.00 -0.00 0.00 0.00 56.10 57.96 2w5p s TRP 108 Cb 0.14 -3.82 -0.02 0.00 -0.00 0.00 0.00 33.47 29.77 2w5p s TRP 108 CO -0.07 -2.61 -0.16 0.20 -0.00 0.00 0.00 176.95 174.30 2w5p s GLY 109 N -0.62 0.87 0.00 5.86 0.00 -1.26 -1.47 107.32 110.70 2w5p s GLY 109 Ca 0.60 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 44.49 2w5p s GLY 109 CO 0.53 -0.76 0.00 0.61 0.00 0.00 0.00 173.10 173.48 2w5p n GLY 110 N 2.18 -0.73 3.05 0.20 0.00 -0.20 -5.00 105.19 104.69 2w5p n GLY 110 Ca -0.16 -0.80 -0.28 0.00 0.00 0.00 0.00 46.02 44.77 2w5p n GLY 110 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2w5p s ILE 111 N -3.00 1.48 -0.45 -0.61 -1.09 -1.26 -1.46 121.20 114.80 2w5p s ILE 111 Ca 0.00 -0.62 -0.19 0.00 -2.23 0.00 0.00 60.65 57.60 2w5p s ILE 111 Cb 0.00 -1.36 0.03 0.00 -1.58 0.00 0.00 42.46 39.55 2w5p s ILE 111 CO 0.00 0.44 0.57 -0.63 -1.23 0.00 0.00 174.94 174.08 2w5p s ILE 112 N 1.04 4.93 0.28 2.92 -1.09 0.50 -1.12 121.20 128.66 2w5p s ILE 112 Ca -0.06 -0.19 -0.25 0.00 -2.23 0.00 0.00 60.65 57.93 2w5p s ILE 112 Cb -0.15 -4.17 -0.09 0.00 -1.58 0.00 0.00 42.46 36.47 2w5p s ILE 112 CO -0.02 -0.59 0.88 -0.83 -1.23 0.00 0.00 174.94 173.15 2w5p s GLY 113 N 2.09 2.77 -0.22 6.18 0.00 0.27 -0.08 107.32 118.33 2w5p s GLY 113 Ca 0.17 0.42 -0.04 0.00 0.00 0.00 0.00 44.72 45.27 2w5p s GLY 113 CO 0.15 0.85 -0.03 -0.42 0.00 0.00 0.00 173.10 173.66 2w5p s ILE 114 N -1.54 3.51 0.04 0.90 -1.09 -0.26 -1.47 121.20 121.29 2w5p s ILE 114 Ca 0.47 -0.45 0.08 0.00 -2.23 0.00 0.00 60.65 58.52 2w5p s ILE 114 Cb -0.19 -2.60 -0.02 0.00 -1.58 0.00 0.00 42.46 38.07 2w5p s ILE 114 CO 0.24 0.42 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.83 2w5p s TYR 115 N 1.43 1.91 0.27 3.97 2.02 -0.24 0.11 117.35 126.82 2w5p s TYR 115 Ca 0.05 -0.38 -0.31 0.00 -0.37 0.00 0.00 57.07 56.07 2w5p s TYR 115 Cb -0.14 -1.15 -0.12 0.00 -0.40 0.00 0.00 41.96 40.15 2w5p s TYR 115 CO -0.02 0.09 1.61 0.28 -1.57 0.00 0.00 175.55 175.94 2w5p n VAL 116 N 1.91 0.78 -3.80 0.71 0.31 0.39 -0.71 118.33 117.92 2w5p n VAL 116 Ca -0.17 -0.19 -0.35 0.00 -0.01 0.00 0.00 64.34 63.62 2w5p n VAL 116 Cb 0.53 -1.93 -0.11 0.00 -0.91 0.00 0.00 33.84 31.42 2w5p n VAL 116 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2w5p s ASP 117 N 0.64 5.01 0.00 4.52 2.15 -0.71 -0.21 116.67 128.07 2w5p s ASP 117 Ca 0.67 -2.73 0.00 0.00 0.43 0.00 0.00 52.55 50.92 2w5p s ASP 117 Cb -0.51 -1.79 0.00 0.00 -0.30 0.00 0.00 42.92 40.32 2w5p s ASP 117 CO 0.45 -0.36 0.00 0.61 -0.17 0.00 0.00 175.17 175.69 2w5p n GLY 118 N 3.61 -0.30 3.68 2.66 0.00 -1.26 -4.66 105.19 108.92 2w5p n GLY 118 Ca 0.05 -1.37 -0.45 0.00 0.00 0.00 0.00 46.02 44.25 2w5p n GLY 118 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2w5p n GLN 119 N 0.62 2.30 -2.73 1.61 7.27 -1.26 -4.35 117.38 120.84 2w5p n GLN 119 Ca 0.00 0.83 -0.10 0.00 0.07 0.00 0.00 57.00 57.80 2w5p n GLN 119 Cb 0.00 -2.59 0.04 0.00 2.41 0.00 0.00 30.24 30.10 2w5p n GLN 119 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2w5p n GLN 120 N 3.21 1.13 0.00 3.69 6.02 0.13 -4.88 117.38 126.67 2w5p n GLN 120 Ca 0.15 -2.98 0.15 0.00 -0.01 0.00 0.00 57.00 54.32 2w5p n GLN 120 Cb 0.31 -1.07 0.87 0.00 1.02 0.00 0.00 30.24 31.36 2w5p n GLN 120 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2w5p n THR 121 N -0.11 0.00 -0.13 5.09 -2.24 -1.20 -2.20 114.28 113.49 2w5p n THR 121 Ca 0.09 -0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.97 2w5p n THR 121 Cb 0.81 -0.49 0.29 0.00 -2.10 0.00 0.00 70.33 68.84 2w5p n THR 121 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2w5p n ASN 122 N -1.12 3.64 -4.67 3.42 6.94 -1.26 -4.46 115.26 117.75 2w5p n ASN 122 Ca 0.20 -2.07 -0.44 0.00 -0.02 0.00 0.00 54.58 52.25 2w5p n ASN 122 Cb 0.17 -0.46 -0.04 0.00 -2.36 0.00 0.00 39.78 37.09 2w5p n ASN 122 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2w5p n THR 123 N 1.35 0.64 -1.78 5.53 -1.04 -0.94 -4.92 114.28 113.12 2w5p n THR 123 Ca 0.22 -0.11 -0.40 0.00 -2.04 0.00 0.00 64.05 61.72 2w5p n THR 123 Cb 0.60 -2.12 0.02 0.00 -1.82 0.00 0.00 70.33 67.01 2w5p n THR 123 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2w5p s PRO 124 N 4.03 3.60 0.56 -2.82 0.02 -1.26 -4.84 135.00 134.29 2w5p s PRO 124 Ca 0.89 2.42 -0.21 0.00 0.02 0.00 0.00 61.00 64.12 2w5p s PRO 124 Cb -0.54 -2.60 -0.05 0.00 0.02 0.00 0.00 34.50 31.33 2w5p s PRO 124 CO 0.45 -0.89 1.18 -2.30 -0.33 0.00 0.00 177.00 175.11 2w5p n PRO 125 N -0.32 1.33 -3.94 5.54 -0.02 -1.26 -4.84 135.00 131.49 2w5p n PRO 125 Ca 0.06 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2w5p n PRO 125 Cb 0.42 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2w5p n PRO 125 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w5p n GLY 126 N 1.00 -2.04 3.36 -1.23 0.00 -0.58 -4.96 105.19 100.75 2w5p n GLY 126 Ca 0.12 -1.25 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 2w5p n GLY 126 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2w5p s ASN 127 N -2.20 4.31 0.04 1.61 0.01 -1.26 -0.51 114.94 116.94 2w5p s ASN 127 Ca 0.00 -0.32 0.09 0.00 -0.71 0.00 0.00 52.86 51.91 2w5p s ASN 127 Cb 0.00 -1.71 -0.03 0.00 0.41 0.00 0.00 41.25 39.92 2w5p s ASN 127 CO 0.00 0.07 -0.24 -0.31 -1.51 0.00 0.00 177.10 175.11 2w5p s TYR 128 N 0.96 2.40 0.04 2.20 2.02 0.86 0.18 117.35 126.01 2w5p s TYR 128 Ca -0.01 -0.36 0.03 0.00 -0.37 0.00 0.00 57.07 56.36 2w5p s TYR 128 Cb -0.15 -1.41 -0.02 0.00 -0.40 0.00 0.00 41.96 39.98 2w5p s TYR 128 CO 0.00 0.17 -0.09 0.95 -1.57 0.00 0.00 175.55 175.02 2w5p s THR 129 N -0.85 0.62 -0.11 -0.71 -4.23 -0.15 -0.48 115.64 109.73 2w5p s THR 129 Ca 0.13 -1.03 -0.00 0.00 -1.18 0.00 0.00 61.69 59.60 2w5p s THR 129 Cb -0.10 -0.66 0.02 0.00 1.34 0.00 0.00 72.50 73.10 2w5p s THR 129 CO 0.03 -0.31 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.50 2w5p s LEU 130 N -1.46 1.27 -0.22 4.79 2.96 0.28 -1.32 118.68 124.97 2w5p s LEU 130 Ca -0.08 -0.32 -0.07 0.00 -0.22 0.00 0.00 54.13 53.44 2w5p s LEU 130 Cb -0.09 -0.88 -0.03 0.00 0.50 0.00 0.00 46.19 45.69 2w5p s LEU 130 CO 0.01 -0.10 0.05 -0.89 -1.32 0.00 0.00 176.35 174.09 2w5p s THR 131 N 1.62 4.30 -0.08 3.68 2.01 -1.26 -0.27 115.64 125.64 2w5p s THR 131 Ca 0.04 -0.19 0.04 0.00 0.31 0.00 0.00 61.69 61.89 2w5p s THR 131 Cb -0.13 -2.98 0.00 0.00 0.01 0.00 0.00 72.50 69.41 2w5p s THR 131 CO -0.08 0.38 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.28 2w5p s LEU 132 N 1.23 1.91 -0.13 4.42 1.43 -0.43 -1.43 118.68 125.68 2w5p s LEU 132 Ca 0.04 -0.44 -0.02 0.00 -1.03 0.00 0.00 54.13 52.68 2w5p s LEU 132 Cb -0.14 -1.15 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 2w5p s LEU 132 CO 0.03 0.12 -0.05 -0.89 0.23 0.00 0.00 176.35 175.79 2w5p s THR 133 N 0.38 3.77 0.50 5.49 2.01 0.58 -0.96 115.64 127.42 2w5p s THR 133 Ca -0.15 -0.42 -0.19 0.00 0.31 0.00 0.00 61.69 61.25 2w5p s THR 133 Cb -0.16 -2.62 -0.08 0.00 0.01 0.00 0.00 72.50 69.65 2w5p s THR 133 CO 0.06 0.53 1.01 -0.83 -0.69 0.00 0.00 174.62 174.70 2w5p s GLY 134 N 0.04 2.33 0.00 4.40 0.00 -0.44 -0.20 107.32 113.45 2w5p s GLY 134 Ca -0.01 0.44 0.00 0.00 0.00 0.00 0.00 44.72 45.15 2w5p s GLY 134 CO 0.03 0.74 0.00 0.61 0.00 0.00 0.00 173.10 174.48 2w5p n GLY 135 N -0.72 -0.59 3.08 0.20 0.00 -0.65 -0.95 105.19 105.56 2w5p n GLY 135 Ca 0.08 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.36 2w5p n GLY 135 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2w5p s TYR 136 N -3.25 0.60 0.02 1.61 1.13 -0.23 -1.28 117.35 115.95 2w5p s TYR 136 Ca 0.00 -0.79 0.03 0.00 -1.41 0.00 0.00 57.07 54.90 2w5p s TYR 136 Cb 0.00 -0.39 -0.04 0.00 -1.10 0.00 0.00 41.96 40.44 2w5p s TYR 136 CO 0.00 -0.21 -0.05 -0.46 -2.51 0.00 0.00 175.55 172.32 2w5p s TRP 137 N -2.79 2.93 -0.04 -3.49 -0.00 -0.37 0.15 118.94 115.32 2w5p s TRP 137 Ca 0.00 -0.02 -0.08 0.00 -0.00 0.00 0.00 56.10 56.00 2w5p s TRP 137 Cb -0.00 -1.60 0.01 0.00 -0.00 0.00 0.00 33.47 31.88 2w5p s TRP 137 CO -0.04 0.40 0.20 0.00 -0.00 0.00 0.00 176.95 177.51 2w5p s ALA 138 N -1.05 -0.49 -2.03 5.86 0.00 -0.55 -4.17 121.76 119.32 2w5p s ALA 138 Ca 0.19 0.31 0.32 0.00 0.00 0.00 0.00 51.96 52.77 2w5p s ALA 138 Cb -0.11 -0.13 1.85 0.00 0.00 0.00 0.00 23.12 24.73 2w5p s ALA 138 CO 0.09 -0.16 2.20 1.17 0.00 0.00 0.00 175.76 179.06