#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pwh s ALA 2 N 0.00 2.37 0.54 -5.12 0.00 -1.26 -5.04 121.76 113.25 1pwh s ALA 2 Ca 0.00 -2.05 0.41 0.00 0.00 0.00 0.00 51.96 50.31 1pwh s ALA 2 Cb 0.00 0.62 1.60 0.00 0.00 0.00 0.00 23.12 25.35 1pwh s ALA 2 CO 0.00 -0.29 1.73 0.00 0.00 0.00 0.00 175.76 177.20 1pwh h ALA 3 N 2.12 3.33 0.00 0.00 0.00 -2.08 -2.31 119.26 120.32 1pwh h ALA 3 Ca -0.41 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 1pwh h ALA 3 Cb 1.24 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 1pwh h ALA 3 CO 0.70 -1.75 -0.08 1.04 0.00 0.00 0.00 179.25 179.16 1pwh n GLN 4 N -4.12 1.20 -0.03 0.00 3.00 -1.26 -3.97 117.38 112.20 1pwh n GLN 4 Ca 0.31 -0.52 -0.06 0.00 -0.01 0.00 0.00 57.00 56.73 1pwh n GLN 4 Cb 1.48 -1.67 -0.02 0.00 0.00 0.00 0.00 30.24 30.02 1pwh n GLN 4 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1pwh n GLU 5 N 2.41 0.13 -4.33 -1.09 4.07 -0.87 -5.02 120.64 115.94 1pwh n GLU 5 Ca 0.22 0.05 -0.18 0.00 -0.06 0.00 0.00 57.16 57.19 1pwh n GLU 5 Cb 0.56 -0.83 -0.14 0.00 -0.06 0.00 0.00 31.44 30.97 1pwh n GLU 5 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 1pwh s SER 6 N -5.26 1.04 0.16 4.31 0.01 -1.26 -5.04 113.70 107.66 1pwh s SER 6 Ca -0.08 -0.20 0.10 0.00 1.31 0.00 0.00 55.95 57.08 1pwh s SER 6 Cb 0.03 -0.10 -0.12 0.00 0.21 0.00 0.00 66.02 66.03 1pwh s SER 6 CO 0.11 0.08 1.27 -0.07 0.41 0.00 0.00 173.24 175.05 1pwh h LEU 7 N 5.79 0.00-10.61 2.44 3.38 -1.89 -3.46 115.31 110.97 1pwh h LEU 7 Ca -0.31 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.21 1pwh h LEU 7 Cb 1.18 0.00 0.08 0.00 0.09 0.00 0.00 40.66 42.01 1pwh h LEU 7 CO 0.49 0.82 0.15 -1.38 0.09 0.00 0.00 178.44 178.61 1pwh s HIS 8 N -2.79 2.48 0.12 1.13 -3.43 -1.26 -4.83 115.29 106.70 1pwh s HIS 8 Ca 0.01 0.15 0.04 0.00 -0.80 0.00 0.00 55.06 54.46 1pwh s HIS 8 Cb 0.09 -3.12 -0.04 0.00 -1.43 0.00 0.00 32.58 28.08 1pwh s HIS 8 CO 0.80 -1.45 -0.10 0.14 -2.00 0.00 0.00 174.74 172.12 1pwh s VAL 9 N -3.15 1.04 -0.04 -5.38 -7.23 -1.26 -5.05 120.40 99.31 1pwh s VAL 9 Ca 0.62 -1.84 -0.30 0.00 -1.81 0.00 0.00 61.98 58.65 1pwh s VAL 9 Cb -0.09 -1.60 -0.04 0.00 0.56 0.00 0.00 36.38 35.21 1pwh s VAL 9 CO 0.44 -0.65 1.30 -0.54 -0.31 0.00 0.00 175.10 175.33 1pwh s LYS 10 N -3.26 4.31 0.20 4.82 1.02 -1.26 -4.92 119.74 120.64 1pwh s LYS 10 Ca 0.11 1.80 0.04 0.00 0.02 0.00 0.00 55.97 57.94 1pwh s LYS 10 Cb -0.00 -3.59 -0.03 0.00 -0.52 0.00 0.00 37.83 33.68 1pwh s LYS 10 CO -0.00 -0.53 0.29 0.95 -0.92 0.00 0.00 175.35 175.14 1pwh s THR 11 N 2.46 5.12 0.71 2.17 -4.23 -1.26 -5.08 115.64 115.53 1pwh s THR 11 Ca 0.59 -0.92 -0.16 0.00 -1.18 0.00 0.00 61.69 60.02 1pwh s THR 11 Cb -0.27 -3.71 0.02 0.00 1.34 0.00 0.00 72.50 69.89 1pwh s THR 11 CO 0.23 -0.21 1.25 -2.84 -0.54 0.00 0.00 174.62 172.51 1pwh s PRO 12 N -3.57 2.22 -0.53 3.99 0.02 -1.26 -4.77 135.00 131.10 1pwh s PRO 12 Ca 0.34 1.91 0.04 0.00 0.02 0.00 0.00 61.00 63.30 1pwh s PRO 12 Cb -0.10 -1.83 0.13 0.00 0.02 0.00 0.00 34.50 32.73 1pwh s PRO 12 CO 0.28 -1.81 0.28 -1.17 -0.33 0.00 0.00 177.00 174.25 1pwh s LEU 13 N -4.89 4.32 0.15 -5.54 2.96 -1.26 -1.32 118.68 113.10 1pwh s LEU 13 Ca 0.78 -3.08 -0.30 0.00 -0.22 0.00 0.00 54.13 51.31 1pwh s LEU 13 Cb -0.33 -1.63 -0.07 0.00 0.50 0.00 0.00 46.19 44.66 1pwh s LEU 13 CO 0.44 -0.22 0.97 -0.60 -1.32 0.00 0.00 176.35 175.62 1pwh s ARG 14 N -0.38 4.72 -0.41 1.98 3.52 0.12 -4.79 118.95 123.71 1pwh s ARG 14 Ca 0.18 1.49 -0.23 0.00 -0.13 0.00 0.00 55.73 57.04 1pwh s ARG 14 Cb -0.24 -3.34 0.02 0.00 -1.56 0.00 0.00 34.95 29.82 1pwh s ARG 14 CO -0.01 0.26 0.78 0.34 -0.81 0.00 0.00 175.30 175.86 1pwh s ASP 15 N -0.28 6.47 -0.39 -2.12 3.68 -1.26 0.61 116.67 123.38 1pwh s ASP 15 Ca 0.46 0.09 -0.18 0.00 2.13 0.00 0.00 52.55 55.05 1pwh s ASP 15 Cb -0.25 -2.39 0.01 0.00 -1.45 0.00 0.00 42.92 38.84 1pwh s ASP 15 CO 0.31 -0.84 0.49 -0.55 0.13 0.00 0.00 175.17 174.71 1pwh s SER 16 N 2.01 6.26 0.26 -0.34 0.15 -0.49 -4.92 113.70 116.63 1pwh s SER 16 Ca 0.30 -0.33 0.08 0.00 0.70 0.00 0.00 55.95 56.70 1pwh s SER 16 Cb -0.13 -2.25 0.33 0.00 -1.71 0.00 0.00 66.02 62.26 1pwh s SER 16 CO 0.20 -0.55 1.60 0.24 1.20 0.00 0.00 173.24 175.93 1pwh h MET 17 N 8.63 0.09 0.74 5.44 2.86 -1.95 -2.48 114.93 128.25 1pwh h MET 17 Ca -0.27 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.27 1pwh h MET 17 Cb 1.12 0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.79 1pwh h MET 17 CO 0.79 0.66 -0.36 0.00 1.06 0.00 0.00 176.91 179.07 1pwh h ALA 18 N 1.32 -1.00 0.00 6.32 0.00 -1.92 -2.54 119.26 121.44 1pwh h ALA 18 Ca -0.01 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1pwh h ALA 18 Cb 1.08 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1pwh h ALA 18 CO 0.08 -0.93 -0.17 -0.07 0.00 0.00 0.00 179.25 178.16 1pwh h LEU 19 N -1.25 0.00 -0.93 0.00 4.07 -1.93 -2.23 115.31 113.04 1pwh h LEU 19 Ca -0.10 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.75 1pwh h LEU 19 Cb 0.77 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.50 1pwh h LEU 19 CO 0.17 0.17 -0.49 0.28 -1.08 0.00 0.00 178.44 177.49 1pwh h SER 20 N 0.00 0.11 -0.24 -0.43 0.02 -1.45 0.53 113.55 112.09 1pwh h SER 20 Ca -0.00 -0.05 -0.11 0.00 -0.84 0.00 0.00 61.79 60.79 1pwh h SER 20 Cb 0.63 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 1pwh h SER 20 CO 0.02 0.59 -0.27 0.50 -1.14 0.00 0.00 176.83 176.53 1pwh h LYS 21 N 0.09 0.61 -0.29 3.45 3.64 -0.96 -0.64 116.57 122.47 1pwh h LYS 21 Ca 0.00 -0.34 -0.13 0.00 -1.27 0.00 0.00 60.65 58.92 1pwh h LYS 21 Cb 0.90 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 1pwh h LYS 21 CO 0.07 0.94 -0.34 0.28 -2.27 0.00 0.00 179.45 178.12 1pwh h VAL 22 N 0.32 1.29 0.00 2.00 2.07 -1.23 -3.22 116.25 117.48 1pwh h VAL 22 Ca 0.03 -1.48 0.00 0.00 0.82 0.00 0.00 66.70 66.07 1pwh h VAL 22 Cb 0.84 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1pwh h VAL 22 CO 0.07 0.48 -0.33 0.00 0.02 0.00 0.00 177.57 177.80 1pwh h ALA 23 N 1.08 0.78 0.00 1.67 0.00 -0.84 -3.48 119.26 118.47 1pwh h ALA 23 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1pwh h ALA 23 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1pwh h ALA 23 CO 0.07 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.73 1pwh n GLY 24 N 1.30 0.36 3.34 0.00 0.00 -0.26 -4.80 105.19 105.13 1pwh n GLY 24 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 1pwh n GLY 24 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1pwh s THR 25 N -1.80 0.04 -0.02 2.61 -1.32 -1.16 -5.01 115.64 108.98 1pwh s THR 25 Ca 0.00 -0.35 -0.37 0.00 -1.21 0.00 0.00 61.69 59.76 1pwh s THR 25 Cb 0.00 -0.86 -0.15 0.00 -1.51 0.00 0.00 72.50 69.97 1pwh s THR 25 CO 0.00 -0.19 1.55 -0.24 -2.21 0.00 0.00 174.62 173.53 1pwh n SER 26 N 0.81 2.27 -4.05 8.08 2.88 -1.26 -4.45 113.62 117.90 1pwh n SER 26 Ca -0.19 1.09 -0.28 0.00 -1.33 0.00 0.00 58.87 58.15 1pwh n SER 26 Cb 0.58 -1.23 -0.17 0.00 -0.75 0.00 0.00 64.21 62.64 1pwh n SER 26 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1pwh s VAL 27 N 1.79 1.44 0.02 2.46 1.01 -1.26 -0.84 120.40 125.02 1pwh s VAL 27 Ca 0.88 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 62.29 1pwh s VAL 27 Cb -0.92 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1pwh s VAL 27 CO 0.51 0.43 -0.07 -0.36 0.00 0.00 0.00 175.10 175.61 1pwh s PHE 28 N 0.97 2.87 -0.11 5.22 2.99 0.27 -1.40 117.98 128.79 1pwh s PHE 28 Ca -0.07 -0.06 0.02 0.00 0.00 0.00 0.00 56.93 56.82 1pwh s PHE 28 Cb -0.15 -1.58 -0.01 0.00 0.00 0.00 0.00 43.02 41.29 1pwh s PHE 28 CO -0.01 0.38 -0.18 -0.51 -0.00 0.00 0.00 175.22 174.90 1pwh s LEU 29 N -1.59 2.43 -0.64 -0.37 1.43 0.20 -0.30 118.68 119.85 1pwh s LEU 29 Ca 0.18 -0.42 -0.17 0.00 -1.03 0.00 0.00 54.13 52.69 1pwh s LEU 29 Cb -0.11 -1.51 0.13 0.00 0.03 0.00 0.00 46.19 44.73 1pwh s LEU 29 CO 0.09 0.18 0.69 -0.75 0.23 0.00 0.00 176.35 176.79 1pwh s LYS 30 N 0.23 3.15 -0.34 1.70 2.47 -0.64 0.14 119.74 126.45 1pwh s LYS 30 Ca -0.12 -1.63 -0.22 0.00 -1.56 0.00 0.00 55.97 52.44 1pwh s LYS 30 Cb -0.16 -4.35 -0.23 0.00 -1.46 0.00 0.00 37.83 31.64 1pwh s LYS 30 CO 0.06 -1.46 1.67 -1.33 0.16 0.00 0.00 175.35 174.45 1pwh n MET 31 N 5.69 0.69 0.00 4.03 2.81 -0.43 -2.05 117.12 127.85 1pwh n MET 31 Ca -0.05 -1.25 0.15 0.00 -1.81 0.00 0.00 57.70 54.74 1pwh n MET 31 Cb 0.43 -2.57 0.89 0.00 -0.71 0.00 0.00 33.22 31.26 1pwh n MET 31 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1pwh n ASP 32 N 7.52 0.00 0.06 7.83 9.92 -1.07 -2.13 116.55 138.69 1pwh n ASP 32 Ca 0.41 -0.83 0.11 0.00 -0.53 0.00 0.00 54.79 53.96 1pwh n ASP 32 Cb 0.33 -0.05 0.45 0.00 -0.64 0.00 0.00 41.12 41.21 1pwh n ASP 32 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1pwh n SER 33 N -1.05 0.37 0.07 -2.24 3.41 -1.09 -2.35 113.62 110.74 1pwh n SER 33 Ca 0.22 0.56 0.12 0.00 -0.26 0.00 0.00 58.87 59.51 1pwh n SER 33 Cb 0.13 -0.65 0.27 0.00 -0.26 0.00 0.00 64.21 63.69 1pwh n SER 33 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1pwh n SER 34 N -1.88 0.73 -4.38 4.04 7.64 -0.90 -4.55 113.62 114.32 1pwh n SER 34 Ca 0.04 0.29 -0.32 0.00 1.01 0.00 0.00 58.87 59.89 1pwh n SER 34 Cb 0.28 -0.21 0.14 0.00 -1.01 0.00 0.00 64.21 63.42 1pwh n SER 34 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pwh n GLN 35 N -2.15 -0.82 -0.19 1.43 1.13 -0.99 -4.87 117.38 110.93 1pwh n GLN 35 Ca 0.04 -0.21 -0.01 0.00 -1.94 0.00 0.00 57.00 54.89 1pwh n GLN 35 Cb 0.43 -1.83 0.09 0.00 0.11 0.00 0.00 30.24 29.05 1pwh n GLN 35 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1pwh h PRO 36 N -1.79 0.30 -0.02 -1.09 0.11 -1.88 -2.48 132.00 125.16 1pwh h PRO 36 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1pwh h PRO 36 Cb 1.31 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1pwh h PRO 36 CO 0.36 0.20 -0.00 -1.13 -0.21 0.00 0.00 178.00 177.22 1pwh n SER 37 N -5.07 1.58 0.00 -2.05 3.41 -1.26 -4.92 113.62 105.31 1pwh n SER 37 Ca 0.08 -1.52 0.00 0.00 -0.26 0.00 0.00 58.87 57.16 1pwh n SER 37 Cb 0.27 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1pwh n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pwh n GLY 38 N 1.19 0.61 3.57 5.00 0.00 -0.93 -4.70 105.19 109.92 1pwh n GLY 38 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 1pwh n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pwh s SER 39 N -2.83 -0.30 0.66 1.61 1.04 -1.24 -2.30 113.70 110.33 1pwh s SER 39 Ca 0.00 -0.44 0.39 0.00 0.48 0.00 0.00 55.95 56.38 1pwh s SER 39 Cb 0.00 0.61 2.16 0.00 0.10 0.00 0.00 66.02 68.88 1pwh s SER 39 CO 0.00 -1.09 2.25 2.19 0.98 0.00 0.00 173.24 177.57 1pwh h PHE 40 N 2.14 0.00 -1.23 5.02 -5.15 -1.47 -3.12 116.94 113.12 1pwh h PHE 40 Ca -0.28 0.00 0.36 0.00 -0.20 0.00 0.00 57.97 57.86 1pwh h PHE 40 Cb 1.27 0.00 -0.10 0.00 0.22 0.00 0.00 35.95 37.34 1pwh h PHE 40 CO 0.35 0.00 0.82 0.87 -2.00 0.00 0.00 178.31 178.35 1pwh h LYS 41 N 0.00 0.17 0.00 6.09 1.79 -1.89 -0.90 116.57 121.84 1pwh h LYS 41 Ca 0.01 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1pwh h LYS 41 Cb 0.18 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.79 1pwh h LYS 41 CO -0.00 0.11 -0.03 0.97 -1.08 0.00 0.00 179.45 179.42 1pwh h ILE 42 N 0.18 0.30 0.00 1.86 6.09 -1.87 0.75 117.51 124.82 1pwh h ILE 42 Ca 0.69 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.99 1pwh h ILE 42 Cb 2.20 1.14 0.00 0.00 0.47 0.00 0.00 36.82 40.63 1pwh h ILE 42 CO -0.26 0.03 0.00 0.54 -3.07 0.00 0.00 178.15 175.39 1pwh n ARG 43 N -3.45 0.00 -0.13 2.19 1.74 -0.34 -0.82 116.66 115.85 1pwh n ARG 43 Ca -0.02 0.34 -0.13 0.00 -0.77 0.00 0.00 57.85 57.27 1pwh n ARG 43 Cb 0.14 -1.30 -0.02 0.00 -1.02 0.00 0.00 32.46 30.26 1pwh n ARG 43 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1pwh h GLY 44 N 0.00 0.98 1.07 -0.13 0.00 -1.68 -2.37 103.07 100.94 1pwh h GLY 44 Ca 0.00 -0.95 -0.10 0.00 0.00 0.00 0.00 47.33 46.28 1pwh h GLY 44 CO 0.00 0.86 -0.04 -2.22 0.00 0.00 0.00 176.54 175.14 1pwh h ILE 45 N 0.72 1.27 -0.22 2.60 1.08 -0.98 -1.85 117.51 120.13 1pwh h ILE 45 Ca 0.08 -1.18 -0.05 0.00 -0.39 0.00 0.00 64.86 63.32 1pwh h ILE 45 Cb 0.88 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 35.53 1pwh h ILE 45 CO 0.08 0.42 -0.09 1.23 -0.69 0.00 0.00 178.15 179.10 1pwh h GLY 46 N 0.88 0.37 0.99 5.37 0.00 -0.97 -1.46 103.07 108.25 1pwh h GLY 46 Ca 0.15 -0.22 -0.13 0.00 0.00 0.00 0.00 47.33 47.13 1pwh h GLY 46 CO 0.04 0.21 -0.32 0.84 0.00 0.00 0.00 176.54 177.30 1pwh h HIS 47 N 0.33 0.87 -0.50 5.60 -0.00 -1.00 -0.13 115.15 120.32 1pwh h HIS 47 Ca 0.07 -0.27 -0.03 0.00 -0.00 0.00 0.00 60.37 60.13 1pwh h HIS 47 Cb 0.36 -0.18 -0.02 0.00 -0.00 0.00 0.00 27.41 27.57 1pwh h HIS 47 CO 0.01 1.03 0.18 1.25 -0.00 0.00 0.00 177.93 180.40 1pwh h LEU 48 N 0.46 0.70 0.40 0.26 6.46 -1.00 -1.40 115.31 121.18 1pwh h LEU 48 Ca 0.04 -0.18 -0.02 0.00 -0.12 0.00 0.00 57.88 57.60 1pwh h LEU 48 Cb 0.90 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.65 1pwh h LEU 48 CO 0.08 0.70 -0.19 0.00 -0.62 0.00 0.00 178.44 178.40 1pwh h LYS 50 N -0.74 0.45 0.28 0.00 1.63 -0.95 0.53 116.57 117.77 1pwh h LYS 50 Ca -0.05 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.70 1pwh h LYS 50 Cb 0.51 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.04 1pwh h LYS 50 CO 0.09 0.30 -0.14 1.98 -3.45 0.00 0.00 179.45 178.23 1pwh h MET 51 N 0.47 -0.36 0.00 1.90 4.05 -1.17 -2.00 114.93 117.82 1pwh h MET 51 Ca 0.52 0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.96 1pwh h MET 51 Cb 0.92 0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 31.80 1pwh h MET 51 CO -0.47 -0.04 -0.02 0.87 0.23 0.00 0.00 176.91 177.48 1pwh h LYS 52 N -0.74 0.00 0.00 0.39 6.56 -0.14 -1.32 116.57 121.32 1pwh h LYS 52 Ca -0.04 0.00 -0.21 0.00 -1.06 0.00 0.00 60.65 59.34 1pwh h LYS 52 Cb 0.50 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.17 1pwh h LYS 52 CO 0.06 0.02 -0.82 0.00 -2.06 0.00 0.00 179.45 176.65 1pwh h ALA 53 N 1.98 0.10 0.00 3.86 0.00 0.13 -2.35 119.26 122.98 1pwh h ALA 53 Ca -0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1pwh h ALA 53 Cb 0.04 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1pwh h ALA 53 CO 0.00 0.51 0.00 1.63 0.00 0.00 0.00 179.25 181.39 1pwh n LYS 54 N -4.05 0.27 0.00 0.00 4.76 -0.74 -1.16 118.16 117.25 1pwh n LYS 54 Ca -0.11 0.11 0.11 0.00 -2.87 0.00 0.00 58.31 55.56 1pwh n LYS 54 Cb 0.78 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 32.51 1pwh n LYS 54 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 1pwh n GLN 55 N -1.25 0.45 0.00 1.97 7.27 -0.58 -4.98 117.38 120.26 1pwh n GLN 55 Ca 0.09 -0.34 0.00 0.00 0.07 0.00 0.00 57.00 56.81 1pwh n GLN 55 Cb 0.13 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.28 1pwh n GLN 55 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1pwh n GLY 56 N 1.46 0.53 3.58 1.69 0.00 -0.30 -5.06 105.19 107.08 1pwh n GLY 56 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1pwh n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pwh n LYS 58 N -0.75 1.51 -3.62 0.00 4.76 0.13 -4.83 118.16 115.37 1pwh n LYS 58 Ca 0.13 -1.10 -0.01 0.00 -2.87 0.00 0.00 58.31 54.47 1pwh n LYS 58 Cb 0.47 -0.96 -0.06 0.00 -1.84 0.00 0.00 35.03 32.64 1pwh n LYS 58 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1pwh s HIS 59 N -0.61 -0.42 -0.05 2.13 2.46 -1.12 -4.30 115.29 113.38 1pwh s HIS 59 Ca 0.00 0.83 -0.08 0.00 0.47 0.00 0.00 55.06 56.29 1pwh s HIS 59 Cb 0.00 0.25 -0.05 0.00 -0.13 0.00 0.00 32.58 32.66 1pwh s HIS 59 CO 0.00 -0.21 0.23 -0.06 -2.47 0.00 0.00 174.74 172.23 1pwh s PHE 60 N 1.34 3.61 -0.07 3.88 0.40 -1.02 -1.01 117.98 125.12 1pwh s PHE 60 Ca -0.08 0.61 0.03 0.00 -0.60 0.00 0.00 56.93 56.89 1pwh s PHE 60 Cb -0.03 -2.01 0.01 0.00 0.51 0.00 0.00 43.02 41.50 1pwh s PHE 60 CO -0.14 0.68 -0.14 0.08 0.70 0.00 0.00 175.22 176.40 1pwh s VAL 61 N -1.14 1.29 -0.03 -0.44 1.01 -0.40 -0.43 120.40 120.26 1pwh s VAL 61 Ca 0.21 -0.57 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 1pwh s VAL 61 Cb -0.13 -1.16 0.03 0.00 0.00 0.00 0.00 36.38 35.11 1pwh s VAL 61 CO 0.10 0.39 0.05 0.00 0.00 0.00 0.00 175.10 175.64 1pwh s SER 63 N 1.50 6.48 0.15 0.00 1.04 -1.26 -0.07 113.70 121.53 1pwh s SER 63 Ca -0.04 0.57 -0.13 0.00 0.48 0.00 0.00 55.95 56.83 1pwh s SER 63 Cb -0.13 -2.28 0.01 0.00 0.10 0.00 0.00 66.02 63.73 1pwh s SER 63 CO -0.03 -0.21 0.36 -0.55 0.98 0.00 0.00 173.24 173.78 1pwh s SER 64 N 1.33 -0.10 0.00 7.02 0.15 0.58 -4.35 113.70 118.34 1pwh s SER 64 Ca 0.22 -0.58 0.22 0.00 0.70 0.00 0.00 55.95 56.50 1pwh s SER 64 Cb -0.15 0.47 0.63 0.00 -1.71 0.00 0.00 66.02 65.25 1pwh s SER 64 CO 0.09 -0.89 1.49 0.00 1.20 0.00 0.00 173.24 175.13 1pwh n ALA 65 N -0.22 2.49 0.00 5.45 0.00 -1.26 -4.08 120.51 122.89 1pwh n ALA 65 Ca -0.12 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.65 1pwh n ALA 65 Cb 0.63 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1pwh n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pwh n GLY 66 N 1.25 4.03 0.13 0.00 0.00 -1.26 -4.78 105.19 104.56 1pwh n GLY 66 Ca 0.17 -0.83 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 1pwh n GLY 66 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1pwh h ASN 67 N 1.01 0.59 0.11 1.61 2.35 -1.97 -1.16 115.58 118.13 1pwh h ASN 67 Ca 0.00 -0.92 -0.09 0.00 -0.55 0.00 0.00 56.30 54.74 1pwh h ASN 67 Cb 0.00 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 1pwh h ASN 67 CO 0.00 1.64 -0.30 0.00 -1.65 0.00 0.00 177.43 177.12 1pwh h ALA 68 N 0.08 1.21 -0.08 -0.83 0.00 -1.95 -0.92 119.26 116.77 1pwh h ALA 68 Ca -0.26 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.18 1pwh h ALA 68 Cb 1.93 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.61 1pwh h ALA 68 CO 0.17 0.52 -0.51 0.78 0.00 0.00 0.00 179.25 180.21 1pwh h GLY 69 N 1.05 0.23 0.98 0.00 0.00 -1.90 -1.05 103.07 102.38 1pwh h GLY 69 Ca 0.04 -0.25 -0.16 0.00 0.00 0.00 0.00 47.33 46.96 1pwh h GLY 69 CO 0.05 0.23 -0.50 -0.33 0.00 0.00 0.00 176.54 175.98 1pwh h MET 70 N 0.17 0.65 -0.75 4.80 2.07 -0.59 -1.43 114.93 119.84 1pwh h MET 70 Ca 0.00 -0.46 -0.02 0.00 -2.07 0.00 0.00 59.70 57.15 1pwh h MET 70 Cb 0.96 0.08 -0.04 0.00 -1.87 0.00 0.00 31.60 30.73 1pwh h MET 70 CO 0.08 1.08 0.40 0.00 1.07 0.00 0.00 176.91 179.55 1pwh h ALA 71 N 0.57 1.29 -0.27 6.32 0.00 -1.05 -0.34 119.26 125.79 1pwh h ALA 71 Ca -0.01 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1pwh h ALA 71 Cb 1.12 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1pwh h ALA 71 CO 0.11 0.57 -0.19 1.15 0.00 0.00 0.00 179.25 180.88 1pwh h THR 72 N 1.05 1.31 -0.40 0.00 2.02 -1.13 -0.17 112.91 115.59 1pwh h THR 72 Ca 0.27 -1.33 -0.08 0.00 0.77 0.00 0.00 66.41 66.04 1pwh h THR 72 Cb 0.04 1.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 1pwh h THR 72 CO -0.04 0.42 -0.08 0.00 0.37 0.00 0.00 175.52 176.19 1pwh h ALA 73 N 0.71 1.12 -0.25 6.16 0.00 -0.97 -1.04 119.26 125.00 1pwh h ALA 73 Ca 0.05 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.51 1pwh h ALA 73 Cb 0.73 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1pwh h ALA 73 CO 0.05 0.55 -0.50 -0.92 0.00 0.00 0.00 179.25 178.44 1pwh h TYR 74 N 0.63 0.98 -0.62 0.00 3.20 -0.99 -2.57 116.97 117.59 1pwh h TYR 74 Ca 0.11 -0.36 -0.04 0.00 3.14 0.00 0.00 58.73 61.59 1pwh h TYR 74 Cb 0.51 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1pwh h TYR 74 CO 0.02 1.16 0.22 0.00 -1.64 0.00 0.00 178.16 177.92 1pwh h ALA 75 N 0.64 0.81 0.10 1.82 0.00 -0.77 -2.47 119.26 119.39 1pwh h ALA 75 Ca 0.01 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1pwh h ALA 75 Cb 1.10 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1pwh h ALA 75 CO 0.11 0.46 -0.17 0.00 0.00 0.00 0.00 179.25 179.65 1pwh h ALA 76 N 1.08 -0.28 -0.29 0.00 0.00 -1.16 0.11 119.26 118.72 1pwh h ALA 76 Ca 0.20 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.14 1pwh h ALA 76 Cb 0.25 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1pwh h ALA 76 CO -0.01 -0.69 -0.03 -0.09 0.00 0.00 0.00 179.25 178.42 1pwh h ARG 77 N -0.33 0.05 -0.62 0.00 2.43 -1.37 0.22 114.38 114.76 1pwh h ARG 77 Ca 0.02 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1pwh h ARG 77 Cb 0.35 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 1pwh h ARG 77 CO -0.10 0.03 0.37 0.00 -1.51 0.00 0.00 179.97 178.76 1pwh h ARG 78 N 0.05 0.83 -0.27 0.20 2.47 -1.11 -0.72 114.38 115.84 1pwh h ARG 78 Ca 0.14 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1pwh h ARG 78 Cb 0.20 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 28.34 1pwh h ARG 78 CO -0.26 0.59 0.00 1.28 0.56 0.00 0.00 179.97 182.13 1pwh n LEU 79 N -4.41 1.74 -3.58 3.04 4.77 0.35 -4.92 117.00 113.99 1pwh n LEU 79 Ca 0.06 -0.81 -0.25 0.00 -0.03 0.00 0.00 56.01 54.98 1pwh n LEU 79 Cb 0.07 -0.18 0.06 0.00 -2.33 0.00 0.00 43.42 41.05 1pwh n LEU 79 CO 0.37 0.41 0.18 0.61 -1.33 0.00 0.00 177.39 177.62 1pwh n GLY 80 N 1.08 -0.53 3.32 -0.72 0.00 0.59 -5.01 105.19 103.91 1pwh n GLY 80 Ca 0.13 0.23 -0.18 0.00 0.00 0.00 0.00 46.02 46.20 1pwh n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pwh s LEU 81 N -7.21 2.53 0.82 0.99 1.43 -0.04 -5.01 118.68 112.20 1pwh s LEU 81 Ca 0.56 -0.99 -0.12 0.00 -1.03 0.00 0.00 54.13 52.55 1pwh s LEU 81 Cb -0.26 -0.61 0.09 0.00 0.03 0.00 0.00 46.19 45.44 1pwh s LEU 81 CO 0.69 -0.19 1.10 -2.84 0.23 0.00 0.00 176.35 175.35 1pwh s PRO 82 N -3.54 1.86 -0.25 1.29 0.02 -1.26 -4.07 135.00 129.05 1pwh s PRO 82 Ca 0.20 0.59 -0.23 0.00 0.02 0.00 0.00 61.00 61.58 1pwh s PRO 82 Cb -0.01 -1.90 0.06 0.00 0.02 0.00 0.00 34.50 32.68 1pwh s PRO 82 CO 0.05 -1.77 0.66 0.00 -0.33 0.00 0.00 177.00 175.62 1pwh s ALA 83 N -3.16 -1.63 -0.07 -1.55 0.00 -1.26 -2.43 121.76 111.66 1pwh s ALA 83 Ca 0.61 1.87 0.03 0.00 0.00 0.00 0.00 51.96 54.48 1pwh s ALA 83 Cb -0.15 -1.09 0.01 0.00 0.00 0.00 0.00 23.12 21.89 1pwh s ALA 83 CO 0.54 -0.31 -0.16 0.99 0.00 0.00 0.00 175.76 176.81 1pwh s THR 84 N 0.39 1.46 -0.21 0.00 2.01 0.43 -0.91 115.64 118.81 1pwh s THR 84 Ca -0.00 -0.68 -0.03 0.00 0.31 0.00 0.00 61.69 61.29 1pwh s THR 84 Cb -0.05 -1.29 -0.00 0.00 0.01 0.00 0.00 72.50 71.17 1pwh s THR 84 CO 0.00 0.43 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.65 1pwh s ILE 85 N 0.49 3.12 -0.28 1.82 -1.09 0.30 -1.72 121.20 123.85 1pwh s ILE 85 Ca -0.15 -0.58 -0.14 0.00 -2.23 0.00 0.00 60.65 57.55 1pwh s ILE 85 Cb -0.16 -2.40 -0.04 0.00 -1.58 0.00 0.00 42.46 38.28 1pwh s ILE 85 CO 0.05 0.45 0.32 -0.69 -1.23 0.00 0.00 174.94 173.84 1pwh s VAL 86 N 1.37 5.21 0.03 2.92 1.01 0.89 -0.81 120.40 131.03 1pwh s VAL 86 Ca 0.05 0.43 0.04 0.00 0.00 0.00 0.00 61.98 62.50 1pwh s VAL 86 Cb -0.14 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 1pwh s VAL 86 CO -0.04 0.17 -0.12 0.54 0.00 0.00 0.00 175.10 175.65 1pwh s VAL 87 N 1.98 0.92 0.69 2.92 0.11 0.05 -0.30 120.40 126.77 1pwh s VAL 87 Ca 0.13 -0.85 -0.14 0.00 -2.93 0.00 0.00 61.98 58.19 1pwh s VAL 87 Cb -0.16 -0.84 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 1pwh s VAL 87 CO 0.10 -0.00 1.11 -2.16 -3.33 0.00 0.00 175.10 170.81 1pwh s PRO 88 N -0.97 2.65 0.39 1.54 0.04 -1.26 -1.54 135.00 135.85 1pwh s PRO 88 Ca 0.00 1.33 0.22 0.00 0.04 0.00 0.00 61.00 62.59 1pwh s PRO 88 Cb -0.07 -1.94 1.19 0.00 0.04 0.00 0.00 34.50 33.73 1pwh s PRO 88 CO 0.01 -1.36 1.64 0.66 0.04 0.00 0.00 177.00 177.99 1pwh h SER 89 N -0.29 0.00 0.92 6.66 4.64 0.31 -0.34 113.55 125.45 1pwh h SER 89 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1pwh h SER 89 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1pwh h SER 89 CO 0.53 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.84 1pwh n THR 90 N -2.33 0.62 -2.35 2.95 -2.24 -1.26 -4.79 114.28 104.88 1pwh n THR 90 Ca -0.01 0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 1pwh n THR 90 Cb 0.16 -0.82 -0.03 0.00 -2.10 0.00 0.00 70.33 67.53 1pwh n THR 90 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1pwh s THR 91 N -3.11 3.73 0.14 4.28 -1.32 -0.14 -4.96 115.64 114.27 1pwh s THR 91 Ca 0.09 1.31 -0.34 0.00 -1.21 0.00 0.00 61.69 61.53 1pwh s THR 91 Cb 0.12 -3.84 -0.14 0.00 -1.51 0.00 0.00 72.50 67.14 1pwh s THR 91 CO 0.44 0.14 1.58 -2.65 -2.21 0.00 0.00 174.62 171.92 1pwh n PRO 92 N 3.48 2.09 -0.28 7.08 -0.02 -1.26 -4.86 135.00 141.23 1pwh n PRO 92 Ca 0.08 0.76 0.20 0.00 -2.02 0.00 0.00 63.50 62.52 1pwh n PRO 92 Cb 0.45 -2.52 0.50 0.00 -0.02 0.00 0.00 33.50 31.91 1pwh n PRO 92 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pwh h ALA 93 N 6.01 2.18 0.00 3.55 0.00 -1.94 0.37 119.26 129.43 1pwh h ALA 93 Ca -0.45 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1pwh h ALA 93 Cb 1.26 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1pwh h ALA 93 CO 0.88 -0.52 -0.23 1.25 0.00 0.00 0.00 179.25 180.63 1pwh h LEU 94 N 0.43 0.00 0.13 0.00 7.12 -1.99 -1.64 115.31 119.36 1pwh h LEU 94 Ca 0.52 0.00 -0.28 0.00 0.13 0.00 0.00 57.88 58.26 1pwh h LEU 94 Cb 1.28 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.41 1pwh h LEU 94 CO -0.23 0.23 -1.27 0.74 -0.13 0.00 0.00 178.44 177.79 1pwh h THR 95 N 0.00 1.47 -0.00 1.05 2.02 -0.64 -2.62 112.91 114.19 1pwh h THR 95 Ca -0.00 -3.05 0.01 0.00 0.77 0.00 0.00 66.41 64.14 1pwh h THR 95 Cb 0.46 2.93 -0.02 0.00 -1.74 0.00 0.00 68.15 69.79 1pwh h THR 95 CO 0.03 0.89 -0.06 0.40 0.37 0.00 0.00 175.52 177.14 1pwh h ILE 96 N 0.07 0.83 -0.68 3.11 1.08 -0.52 0.18 117.51 121.58 1pwh h ILE 96 Ca -0.14 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.30 1pwh h ILE 96 Cb 1.98 0.83 -0.03 0.00 -3.07 0.00 0.00 36.82 36.53 1pwh h ILE 96 CO 0.20 0.00 0.31 -0.33 -0.69 0.00 0.00 178.15 177.64 1pwh h GLU 97 N -0.11 1.00 -0.56 2.37 4.39 -1.41 -1.94 114.58 118.32 1pwh h GLU 97 Ca 0.03 -0.16 0.06 0.00 0.34 0.00 0.00 59.36 59.63 1pwh h GLU 97 Cb 0.15 -0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 28.57 1pwh h GLU 97 CO -0.07 0.80 0.27 -0.09 -1.16 0.00 0.00 179.01 178.76 1pwh h ARG 98 N 0.96 0.49 -0.14 2.33 9.65 -1.03 0.89 114.38 127.53 1pwh h ARG 98 Ca 0.23 -0.03 0.03 0.00 -1.10 0.00 0.00 59.98 59.11 1pwh h ARG 98 Cb 0.14 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 1pwh h ARG 98 CO -0.03 0.33 -0.05 -0.07 2.80 0.00 0.00 179.97 182.94 1pwh h LEU 99 N 0.51 -0.19 -0.61 3.80 4.07 -0.15 -2.48 115.31 120.27 1pwh h LEU 99 Ca 0.26 0.05 0.06 0.00 0.08 0.00 0.00 57.88 58.33 1pwh h LEU 99 Cb 0.21 0.11 -0.06 0.00 1.08 0.00 0.00 40.66 42.00 1pwh h LEU 99 CO -0.20 -0.07 0.31 0.11 -1.08 0.00 0.00 178.44 177.50 1pwh h LYS 100 N -0.03 0.55 0.00 1.13 1.57 -0.53 -1.17 116.57 118.08 1pwh h LYS 100 Ca 0.07 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1pwh h LYS 100 Cb 0.14 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 1pwh h LYS 100 CO -0.16 0.36 -0.01 -0.91 -0.57 0.00 0.00 179.45 178.16 1pwh h ASN 101 N 0.56 0.00 0.00 0.86 2.35 -0.41 0.75 115.58 119.69 1pwh h ASN 101 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1pwh h ASN 101 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1pwh h ASN 101 CO -0.21 0.01 0.00 -0.62 -1.65 0.00 0.00 177.43 174.96 1pwh n GLU 102 N -3.37 0.96 -0.38 0.81 -0.58 -0.45 -4.86 120.64 112.77 1pwh n GLU 102 Ca -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 1pwh n GLU 102 Cb 0.09 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.47 1pwh n GLU 102 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1pwh n GLY 103 N 0.91 0.74 3.92 0.62 0.00 0.26 -4.70 105.19 106.95 1pwh n GLY 103 Ca 0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 1pwh n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pwh s ALA 104 N -2.42 3.48 -0.10 4.61 0.00 -1.18 -4.75 121.76 121.39 1pwh s ALA 104 Ca 0.00 -0.70 -0.09 0.00 0.00 0.00 0.00 51.96 51.17 1pwh s ALA 104 Cb 0.00 -2.45 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 1pwh s ALA 104 CO 0.00 -0.43 0.20 0.99 0.00 0.00 0.00 175.76 176.52 1pwh s THR 105 N -2.72 5.40 -0.05 0.00 2.01 -0.09 -4.16 115.64 116.03 1pwh s THR 105 Ca 0.48 0.35 0.04 0.00 0.31 0.00 0.00 61.69 62.87 1pwh s THR 105 Cb -0.10 -3.48 -0.02 0.00 0.01 0.00 0.00 72.50 68.90 1pwh s THR 105 CO 0.43 0.59 -0.15 -0.69 -0.69 0.00 0.00 174.62 174.10 1pwh s VAL 106 N -0.86 2.97 -0.17 3.82 1.01 -1.26 0.11 120.40 126.02 1pwh s VAL 106 Ca 0.16 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.38 1pwh s VAL 106 Cb -0.13 -2.15 0.04 0.00 0.00 0.00 0.00 36.38 34.14 1pwh s VAL 106 CO 0.05 0.59 -0.05 -0.70 0.00 0.00 0.00 175.10 174.99 1pwh s GLU 107 N -0.69 1.47 0.00 2.72 2.56 0.01 -4.94 118.70 119.84 1pwh s GLU 107 Ca 0.11 -0.55 -0.15 0.00 0.00 0.00 0.00 54.97 54.38 1pwh s GLU 107 Cb -0.11 -2.05 -0.06 0.00 2.00 0.00 0.00 34.13 33.92 1pwh s GLU 107 CO 0.00 -0.44 0.42 0.08 -0.56 0.00 0.00 175.26 174.77 1pwh s VAL 108 N 1.61 5.01 -0.33 3.70 1.01 -1.26 -0.77 120.40 129.38 1pwh s VAL 108 Ca 0.00 0.87 0.05 0.00 0.00 0.00 0.00 61.98 62.90 1pwh s VAL 108 Cb -0.15 -3.73 0.18 0.00 0.00 0.00 0.00 36.38 32.68 1pwh s VAL 108 CO -0.08 0.57 0.53 0.54 0.00 0.00 0.00 175.10 176.67 1pwh s VAL 109 N -1.05 -0.83 0.30 2.92 0.11 -0.59 -4.93 120.40 116.32 1pwh s VAL 109 Ca 0.24 -0.18 0.00 0.00 -2.93 0.00 0.00 61.98 59.11 1pwh s VAL 109 Cb -0.17 -0.72 0.00 0.00 -1.53 0.00 0.00 36.38 33.96 1pwh s VAL 109 CO 0.14 -0.14 0.00 0.61 -3.33 0.00 0.00 175.10 172.38 1pwh n GLY 110 N 5.04 -1.69 0.21 6.54 0.00 -1.26 -4.43 105.19 109.60 1pwh n GLY 110 Ca 0.06 -1.04 0.10 0.00 0.00 0.00 0.00 46.02 45.15 1pwh n GLY 110 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1pwh n GLU 111 N -3.86 0.53 -3.07 1.61 0.28 -1.26 0.90 120.64 115.77 1pwh n GLU 111 Ca 0.01 -0.41 -0.41 0.00 -0.16 0.00 0.00 57.16 56.19 1pwh n GLU 111 Cb 0.58 -1.49 -0.06 0.00 1.43 0.00 0.00 31.44 31.91 1pwh n GLU 111 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 1pwh s MET 112 N -2.77 4.18 0.56 3.44 -1.94 -1.26 -4.84 119.30 116.66 1pwh s MET 112 Ca 0.12 0.66 0.27 0.00 -1.71 0.00 0.00 55.69 55.03 1pwh s MET 112 Cb 0.17 -3.61 1.47 0.00 2.01 0.00 0.00 34.83 34.87 1pwh s MET 112 CO 0.74 -0.33 1.99 1.25 -0.01 0.00 0.00 175.02 178.66 1pwh h LEU 113 N 8.56 0.00 -1.35 -0.03 6.46 -1.91 0.58 115.31 127.63 1pwh h LEU 113 Ca -0.29 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.43 1pwh h LEU 113 Cb 1.13 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.04 1pwh h LEU 113 CO 0.79 0.00 -0.02 0.44 -0.62 0.00 0.00 178.44 179.03 1pwh h ASP 114 N 0.00 0.38 0.57 1.25 3.32 -1.95 -0.91 116.42 119.09 1pwh h ASP 114 Ca 0.21 -0.07 -0.16 0.00 0.02 0.00 0.00 57.03 57.04 1pwh h ASP 114 Cb 0.97 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.40 1pwh h ASP 114 CO -0.00 0.46 -0.72 -0.08 -1.72 0.00 0.00 179.24 177.18 1pwh h GLU 115 N 0.40 0.12 -0.07 3.56 4.81 -1.21 -0.93 114.58 121.26 1pwh h GLU 115 Ca 0.09 -0.10 -0.20 0.00 -0.13 0.00 0.00 59.36 59.02 1pwh h GLU 115 Cb 0.29 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 1pwh h GLU 115 CO 0.01 0.79 -0.78 0.00 -0.73 0.00 0.00 179.01 178.29 1pwh h ALA 116 N 1.18 0.51 -0.32 2.92 0.00 -1.28 -1.73 119.26 120.54 1pwh h ALA 116 Ca -0.02 -0.63 -0.10 0.00 0.00 0.00 0.00 54.91 54.16 1pwh h ALA 116 Cb 1.27 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1pwh h ALA 116 CO 0.10 0.76 -0.21 0.82 0.00 0.00 0.00 179.25 180.73 1pwh h ILE 117 N 0.30 1.29 0.05 0.00 2.04 -1.09 -1.40 117.51 118.70 1pwh h ILE 117 Ca -0.04 -1.34 0.01 0.00 1.00 0.00 0.00 64.86 64.48 1pwh h ILE 117 Cb 1.38 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.91 1pwh h ILE 117 CO 0.14 0.43 -0.12 -0.61 0.00 0.00 0.00 178.15 178.00 1pwh h GLN 118 N 0.46 -0.22 -0.44 2.37 4.15 -1.13 -0.18 115.11 120.12 1pwh h GLN 118 Ca 0.06 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.49 1pwh h GLN 118 Cb 0.76 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.47 1pwh h GLN 118 CO 0.06 -0.14 0.25 1.25 -1.93 0.00 0.00 178.83 178.31 1pwh h LEU 119 N -0.22 0.55 -0.63 -2.39 5.85 -1.29 -0.49 115.31 116.68 1pwh h LEU 119 Ca 0.02 -0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1pwh h LEU 119 Cb 0.25 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.09 1pwh h LEU 119 CO -0.08 0.47 0.34 0.00 -0.34 0.00 0.00 178.44 178.83 1pwh h ALA 120 N 1.10 0.84 -0.12 1.25 0.00 -0.98 0.01 119.26 121.36 1pwh h ALA 120 Ca 0.16 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 1pwh h ALA 120 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1pwh h ALA 120 CO -0.03 0.01 -0.54 0.87 0.00 0.00 0.00 179.25 179.57 1pwh h LYS 121 N 0.64 0.35 -0.45 0.00 1.57 -0.79 -1.54 116.57 116.35 1pwh h LYS 121 Ca 0.28 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1pwh h LYS 121 Cb 0.18 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1pwh h LYS 121 CO -0.18 0.80 0.08 0.00 -0.57 0.00 0.00 179.45 179.58 1pwh h ALA 122 N 1.16 1.31 -0.26 3.86 0.00 -0.35 0.15 119.26 125.13 1pwh h ALA 122 Ca 0.01 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1pwh h ALA 122 Cb 1.04 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1pwh h ALA 122 CO 0.09 0.48 -0.21 -0.07 0.00 0.00 0.00 179.25 179.55 1pwh h LEU 123 N 0.66 0.63 -1.01 0.00 3.38 -0.65 -1.63 115.31 116.68 1pwh h LEU 123 Ca 0.15 -0.45 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 1pwh h LEU 123 Cb 0.29 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1pwh h LEU 123 CO 0.00 0.95 0.43 -0.08 0.09 0.00 0.00 178.44 179.83 1pwh h GLU 124 N 0.32 1.12 0.00 1.13 4.81 -0.61 -2.34 114.58 119.01 1pwh h GLU 124 Ca 0.05 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.09 1pwh h GLU 124 Cb 0.75 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 1pwh h GLU 124 CO 0.05 0.83 -0.28 -0.22 -0.73 0.00 0.00 179.01 178.66 1pwh h LYS 125 N 1.13 0.00 -0.26 1.92 3.64 -0.63 -3.31 116.57 119.05 1pwh h LYS 125 Ca 0.28 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.58 1pwh h LYS 125 Cb 0.04 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.81 1pwh h LYS 125 CO -0.04 0.28 -0.05 0.09 -2.27 0.00 0.00 179.45 177.46 1pwh n ASN 126 N -3.26 2.98 -3.35 4.20 3.02 -0.62 -4.89 115.26 113.35 1pwh n ASN 126 Ca 0.02 -3.40 -0.12 0.00 -0.03 0.00 0.00 54.58 51.05 1pwh n ASN 126 Cb 0.57 -0.57 -0.08 0.00 -0.61 0.00 0.00 39.78 39.08 1pwh n ASN 126 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1pwh s ASN 127 N -2.37 0.75 0.20 6.41 0.01 -0.92 -5.01 114.94 114.02 1pwh s ASN 127 Ca 0.42 -0.32 -0.32 0.00 -0.71 0.00 0.00 52.86 51.93 1pwh s ASN 127 Cb 0.37 0.91 -0.15 0.00 0.41 0.00 0.00 41.25 42.79 1pwh s ASN 127 CO 0.03 -0.35 1.26 -2.65 -1.51 0.00 0.00 177.10 173.89 1pwh n PRO 128 N 5.34 1.53 0.00 -0.60 -0.02 -1.26 -1.47 135.00 138.53 1pwh n PRO 128 Ca -0.02 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1pwh n PRO 128 Cb 0.49 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1pwh n PRO 128 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pwh n GLY 129 N 2.06 2.62 3.73 -1.23 0.00 -1.26 -4.88 105.19 106.23 1pwh n GLY 129 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1pwh n GLY 129 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pwh s TRP 130 N -2.21 3.74 -0.07 1.61 0.52 -0.54 0.22 118.94 122.21 1pwh s TRP 130 Ca 0.00 1.72 0.04 0.00 0.02 0.00 0.00 56.10 57.89 1pwh s TRP 130 Cb 0.00 -3.13 -0.00 0.00 -1.15 0.00 0.00 33.47 29.19 1pwh s TRP 130 CO 0.00 -0.08 -0.20 0.08 0.02 0.00 0.00 176.95 176.76 1pwh s VAL 131 N -0.01 1.73 0.03 4.03 1.01 -0.18 -4.76 120.40 122.26 1pwh s VAL 131 Ca 0.48 -0.86 -0.28 0.00 0.00 0.00 0.00 61.98 61.32 1pwh s VAL 131 Cb -0.25 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 1pwh s VAL 131 CO 0.31 0.49 0.88 -0.47 0.00 0.00 0.00 175.10 176.31 1pwh s TYR 132 N 0.17 3.71 -0.34 5.22 6.14 -1.26 -1.27 117.35 129.71 1pwh s TYR 132 Ca -0.10 1.61 -0.03 0.00 0.64 0.00 0.00 57.07 59.18 1pwh s TYR 132 Cb -0.15 -2.98 0.07 0.00 0.42 0.00 0.00 41.96 39.31 1pwh s TYR 132 CO 0.05 0.13 0.09 0.42 0.64 0.00 0.00 175.55 176.88 1pwh s ILE 133 N 0.46 3.29 0.58 3.14 -1.09 0.12 -4.93 121.20 122.77 1pwh s ILE 133 Ca 0.45 -1.52 -0.19 0.00 -2.23 0.00 0.00 60.65 57.16 1pwh s ILE 133 Cb -0.21 -2.99 -0.04 0.00 -1.58 0.00 0.00 42.46 37.64 1pwh s ILE 133 CO 0.26 -0.30 1.21 -0.55 -1.23 0.00 0.00 174.94 174.33 1pwh s SER 134 N 1.48 5.26 0.18 3.58 0.15 -1.26 -4.10 113.70 118.98 1pwh s SER 134 Ca -0.00 2.40 0.25 0.00 0.70 0.00 0.00 55.95 59.29 1pwh s SER 134 Cb -0.21 -2.60 0.91 0.00 -1.71 0.00 0.00 66.02 62.41 1pwh s SER 134 CO -0.01 -1.55 1.75 -2.65 1.20 0.00 0.00 173.24 171.98 1pwh n PRO 135 N -1.50 0.18 0.00 5.44 -0.02 -1.26 -4.72 135.00 133.12 1pwh n PRO 135 Ca 0.13 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1pwh n PRO 135 Cb 0.49 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 1pwh n PRO 135 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1pwh n PHE 136 N -2.08 0.00 -3.66 6.00 1.16 -1.26 -4.90 117.46 112.72 1pwh n PHE 136 Ca 0.04 0.00 -0.39 0.00 -1.87 0.00 0.00 57.45 55.23 1pwh n PHE 136 Cb 0.33 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.09 1pwh n PHE 136 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 1pwh s ASP 137 N -1.17 5.53 -0.29 5.98 3.84 -1.26 -4.30 116.67 124.99 1pwh s ASP 137 Ca 0.00 -1.41 -0.16 0.00 -0.00 0.00 0.00 52.55 50.98 1pwh s ASP 137 Cb 0.00 -1.94 0.13 0.00 -1.38 0.00 0.00 42.92 39.72 1pwh s ASP 137 CO 0.00 -0.47 0.88 -0.62 -0.00 0.00 0.00 175.17 174.96 1pwh s ASP 138 N 1.87 -0.68 0.52 2.11 3.68 -1.26 -4.91 116.67 118.00 1pwh s ASP 138 Ca 0.02 1.05 0.30 0.00 2.13 0.00 0.00 52.55 56.05 1pwh s ASP 138 Cb -0.22 1.37 1.43 0.00 -1.45 0.00 0.00 42.92 44.05 1pwh s ASP 138 CO 0.02 -0.16 1.89 1.55 0.13 0.00 0.00 175.17 178.60 1pwh h PRO 139 N 6.59 0.05 -0.70 4.34 0.13 -2.00 0.11 132.00 140.51 1pwh h PRO 139 Ca -0.27 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.85 1pwh h PRO 139 Cb 1.19 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1pwh h PRO 139 CO 0.17 0.03 0.40 -0.07 -0.23 0.00 0.00 178.00 178.30 1pwh h LEU 140 N 0.05 0.85 -0.16 1.56 -0.00 -1.96 0.21 115.31 115.86 1pwh h LEU 140 Ca 0.42 -0.08 0.03 0.00 -0.00 0.00 0.00 57.88 58.25 1pwh h LEU 140 Cb 1.60 -0.22 -0.03 0.00 -0.00 0.00 0.00 40.66 42.02 1pwh h LEU 140 CO -0.03 0.68 -0.01 0.40 -0.00 0.00 0.00 178.44 179.49 1pwh h ILE 141 N 0.95 0.88 -0.35 1.22 1.08 -0.96 -0.55 117.51 119.78 1pwh h ILE 141 Ca 0.25 -0.02 -0.00 0.00 -0.39 0.00 0.00 64.86 64.70 1pwh h ILE 141 Cb 0.00 0.83 -0.02 0.00 -3.07 0.00 0.00 36.82 34.57 1pwh h ILE 141 CO -0.04 0.01 0.21 -0.50 -0.69 0.00 0.00 178.15 177.14 1pwh h TRP 142 N 0.05 0.47 -0.74 1.37 6.55 -1.21 -1.42 115.95 121.01 1pwh h TRP 142 Ca 0.07 -0.00 0.12 0.00 0.95 0.00 0.00 58.89 60.04 1pwh h TRP 142 Cb 0.09 -0.15 -0.09 0.00 -0.86 0.00 0.00 29.16 28.15 1pwh h TRP 142 CO -0.16 0.34 0.33 1.49 -1.05 0.00 0.00 178.44 179.39 1pwh h GLU 143 N 0.46 0.50 -0.53 0.49 4.57 -0.08 -1.48 114.58 118.51 1pwh h GLU 143 Ca 0.13 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.20 1pwh h GLU 143 Cb 0.01 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 1pwh h GLU 143 CO -0.02 0.33 0.05 0.78 -1.18 0.00 0.00 179.01 178.96 1pwh h GLY 144 N 0.51 0.97 2.00 1.92 0.00 -0.61 -2.62 103.07 105.24 1pwh h GLY 144 Ca 0.39 -0.68 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 1pwh h GLY 144 CO -0.35 0.63 -0.09 0.45 0.00 0.00 0.00 176.54 177.18 1pwh h HIS 145 N 0.78 0.00 -1.14 5.60 3.86 -0.31 -2.64 115.15 121.29 1pwh h HIS 145 Ca 0.16 0.00 0.32 0.00 -1.16 0.00 0.00 60.37 59.69 1pwh h HIS 145 Cb 0.46 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 28.85 1pwh h HIS 145 CO 0.03 0.09 0.77 1.15 0.86 0.00 0.00 177.93 180.84 1pwh h THR 146 N 0.00 0.42 -0.86 2.45 2.02 -0.91 -0.63 112.91 115.40 1pwh h THR 146 Ca -0.00 -0.07 0.20 0.00 0.77 0.00 0.00 66.41 67.31 1pwh h THR 146 Cb 0.23 0.21 -0.06 0.00 -1.74 0.00 0.00 68.15 66.79 1pwh h THR 146 CO 0.01 0.04 0.58 0.77 0.37 0.00 0.00 175.52 177.29 1pwh h SER 147 N 0.20 0.33 -0.44 4.18 4.64 -1.63 -1.66 113.55 119.16 1pwh h SER 147 Ca 0.61 0.03 0.03 0.00 -0.47 0.00 0.00 61.79 61.99 1pwh h SER 147 Cb 1.96 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 63.99 1pwh h SER 147 CO -0.19 0.14 0.24 0.25 -0.87 0.00 0.00 176.83 176.39 1pwh h LEU 148 N 0.33 0.36 -0.50 5.97 6.46 -1.35 -1.33 115.31 125.25 1pwh h LEU 148 Ca 0.44 0.01 -0.16 0.00 -0.12 0.00 0.00 57.88 58.05 1pwh h LEU 148 Cb 1.20 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 41.06 1pwh h LEU 148 CO -0.14 0.26 -0.54 0.58 -0.62 0.00 0.00 178.44 177.98 1pwh h VAL 149 N 0.47 1.31 -0.65 1.05 2.07 -1.49 -2.37 116.25 116.65 1pwh h VAL 149 Ca 0.18 -1.77 0.06 0.00 0.82 0.00 0.00 66.70 65.99 1pwh h VAL 149 Cb 0.06 1.74 -0.06 0.00 -1.52 0.00 0.00 31.29 31.51 1pwh h VAL 149 CO -0.11 0.55 0.35 0.11 0.02 0.00 0.00 177.57 178.49 1pwh h LYS 150 N 0.46 0.62 -0.47 1.57 1.57 -1.11 0.59 116.57 119.79 1pwh h LYS 150 Ca 0.01 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1pwh h LYS 150 Cb 1.09 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.23 1pwh h LYS 150 CO 0.10 0.41 0.19 0.93 -0.57 0.00 0.00 179.45 180.51 1pwh h GLU 151 N 0.64 0.66 -0.29 3.15 5.08 -1.06 -1.78 114.58 120.98 1pwh h GLU 151 Ca 0.29 -0.09 -0.17 0.00 -1.00 0.00 0.00 59.36 58.39 1pwh h GLU 151 Cb 0.21 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 1pwh h GLU 151 CO -0.19 0.55 -0.51 -0.07 -1.00 0.00 0.00 179.01 177.79 1pwh h LEU 152 N 0.66 0.90 -0.38 1.33 3.38 -0.63 -2.28 115.31 118.28 1pwh h LEU 152 Ca 0.16 -0.46 0.03 0.00 0.09 0.00 0.00 57.88 57.70 1pwh h LEU 152 Cb 0.13 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1pwh h LEU 152 CO -0.02 1.24 0.19 0.50 0.09 0.00 0.00 178.44 180.44 1pwh h LYS 153 N 0.64 0.38 0.00 1.13 1.63 -0.32 0.15 116.57 120.18 1pwh h LYS 153 Ca 0.02 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1pwh h LYS 153 Cb 1.10 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.64 1pwh h LYS 153 CO 0.11 0.25 -0.10 1.05 -3.45 0.00 0.00 179.45 177.32 1pwh h GLU 154 N 0.39 0.00 0.09 1.90 4.11 -1.33 -3.33 114.58 116.41 1pwh h GLU 154 Ca 0.16 0.00 -0.37 0.00 0.07 0.00 0.00 59.36 59.22 1pwh h GLU 154 Cb 0.07 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 1pwh h GLU 154 CO -0.11 0.10 -2.10 2.41 0.07 0.00 0.00 179.01 179.37 1pwh n THR 155 N -3.15 1.71 -2.51 -1.06 -1.04 -0.86 -4.96 114.28 102.41 1pwh n THR 155 Ca 0.02 -0.64 -0.39 0.00 -2.04 0.00 0.00 64.05 61.01 1pwh n THR 155 Cb 0.49 -1.64 -0.04 0.00 -1.82 0.00 0.00 70.33 67.32 1pwh n THR 155 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1pwh s LEU 156 N -6.90 4.37 0.12 -4.42 1.43 0.49 -4.98 118.68 108.80 1pwh s LEU 156 Ca -0.25 2.17 -0.07 0.00 -1.03 0.00 0.00 54.13 54.95 1pwh s LEU 156 Cb 0.07 -3.87 -0.11 0.00 0.03 0.00 0.00 46.19 42.30 1pwh s LEU 156 CO 0.73 -0.30 1.29 0.28 0.23 0.00 0.00 176.35 178.59 1pwh h SER 157 N 3.23 0.64 -4.66 2.29 0.02 -1.89 -3.47 113.55 109.72 1pwh h SER 157 Ca -0.47 -0.50 -0.21 0.00 -0.84 0.00 0.00 61.79 59.76 1pwh h SER 157 Cb 1.21 -0.20 -0.15 0.00 0.14 0.00 0.00 62.40 63.41 1pwh h SER 157 CO 0.65 1.29 -0.69 0.00 -1.14 0.00 0.00 176.83 176.94 1pwh s ALA 158 N -3.35 0.94 0.46 3.77 0.00 -1.26 -5.13 121.76 117.18 1pwh s ALA 158 Ca -0.07 -1.34 -0.24 0.00 0.00 0.00 0.00 51.96 50.31 1pwh s ALA 158 Cb 0.09 0.17 -0.07 0.00 0.00 0.00 0.00 23.12 23.31 1pwh s ALA 158 CO 0.88 -0.25 1.26 -1.59 0.00 0.00 0.00 175.76 176.07 1pwh s LYS 159 N -3.84 3.71 0.81 0.00 -2.85 -1.26 -4.98 119.74 111.32 1pwh s LYS 159 Ca 0.12 2.03 -0.11 0.00 -1.00 0.00 0.00 55.97 57.01 1pwh s LYS 159 Cb 0.06 -2.52 0.08 0.00 -2.06 0.00 0.00 37.83 33.38 1pwh s LYS 159 CO -0.05 -0.67 1.09 -1.25 0.10 0.00 0.00 175.35 174.57 1pwh s PRO 160 N -2.55 1.99 0.35 1.78 0.04 -1.26 -4.86 135.00 130.49 1pwh s PRO 160 Ca 0.62 0.89 0.18 0.00 0.04 0.00 0.00 61.00 62.74 1pwh s PRO 160 Cb -0.35 -1.89 0.45 0.00 0.04 0.00 0.00 34.50 32.75 1pwh s PRO 160 CO 0.43 -1.75 1.62 0.78 0.04 0.00 0.00 177.00 178.12 1pwh h GLY 161 N -1.19 0.00 -3.24 0.56 0.00 -1.13 -3.46 103.07 94.61 1pwh h GLY 161 Ca -0.46 0.00 0.30 0.00 0.00 0.00 0.00 47.33 47.17 1pwh h GLY 161 CO 0.55 0.00 0.84 0.00 0.00 0.00 0.00 176.54 177.93 1pwh s ALA 162 N -3.31 -2.18 -0.05 3.60 0.00 -1.26 -4.21 121.76 114.34 1pwh s ALA 162 Ca 0.02 1.13 0.01 0.00 0.00 0.00 0.00 51.96 53.12 1pwh s ALA 162 Cb 0.09 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.36 1pwh s ALA 162 CO 0.70 -0.85 -0.06 0.96 0.00 0.00 0.00 175.76 176.51 1pwh s ILE 163 N -2.38 0.67 -0.12 0.00 -5.25 -0.82 -0.61 121.20 112.69 1pwh s ILE 163 Ca 0.12 -0.20 -0.08 0.00 -0.99 0.00 0.00 60.65 59.50 1pwh s ILE 163 Cb 0.02 -0.66 -0.04 0.00 2.95 0.00 0.00 42.46 44.73 1pwh s ILE 163 CO -0.04 0.25 0.17 -0.69 -1.79 0.00 0.00 174.94 172.84 1pwh s VAL 164 N 0.84 5.45 0.06 8.37 1.01 0.53 -1.25 120.40 135.42 1pwh s VAL 164 Ca -0.12 0.27 -0.26 0.00 0.00 0.00 0.00 61.98 61.87 1pwh s VAL 164 Cb -0.15 -3.44 0.06 0.00 0.00 0.00 0.00 36.38 32.86 1pwh s VAL 164 CO 0.01 0.60 0.60 -1.48 0.00 0.00 0.00 175.10 174.83 1pwh s LEU 165 N -0.88 -0.46 0.23 3.92 0.05 -0.73 -1.17 118.68 119.62 1pwh s LEU 165 Ca 0.15 0.29 0.02 0.00 0.05 0.00 0.00 54.13 54.64 1pwh s LEU 165 Cb -0.12 2.45 -0.04 0.00 -2.05 0.00 0.00 46.19 46.43 1pwh s LEU 165 CO 0.04 -0.78 0.39 -0.94 -0.55 0.00 0.00 176.35 174.51 1pwh s SER 166 N -2.01 6.34 -0.07 1.48 1.04 -1.26 0.61 113.70 119.84 1pwh s SER 166 Ca -0.05 0.25 0.05 0.00 0.48 0.00 0.00 55.95 56.69 1pwh s SER 166 Cb -0.01 -1.94 -0.01 0.00 0.10 0.00 0.00 66.02 64.16 1pwh s SER 166 CO -0.02 -0.08 -0.22 -0.69 0.98 0.00 0.00 173.24 173.20 1pwh s VAL 167 N -1.96 2.28 0.00 5.02 1.01 0.03 -4.78 120.40 122.00 1pwh s VAL 167 Ca 0.36 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.36 1pwh s VAL 167 Cb -0.10 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.43 1pwh s VAL 167 CO 0.30 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1pwh n GLY 168 N 2.94 0.01 0.00 4.51 0.00 -1.26 -4.79 105.19 106.60 1pwh n GLY 168 Ca -0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.91 1pwh n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwh n GLY 169 N 3.20 -0.51 0.00 -0.02 0.00 -1.26 -4.19 105.19 102.41 1pwh n GLY 169 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1pwh n GLY 169 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwh n GLY 170 N 1.69 0.87 0.21 -0.02 0.00 -1.26 -1.79 105.19 104.90 1pwh n GLY 170 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 1pwh n GLY 170 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1pwh h GLY 171 N 0.00 0.72 1.02 -0.02 0.00 -1.93 0.34 103.07 103.20 1pwh h GLY 171 Ca 0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 47.01 1pwh h GLY 171 CO 0.00 0.23 0.04 -2.00 0.00 0.00 0.00 176.54 174.80 1pwh h LEU 172 N 0.65 0.90 -0.39 3.11 5.85 -1.90 -1.04 115.31 122.48 1pwh h LEU 172 Ca 0.20 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 1pwh h LEU 172 Cb -0.03 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 1pwh h LEU 172 CO -0.07 0.96 0.23 0.25 -0.34 0.00 0.00 178.44 179.48 1pwh h LEU 173 N 0.80 0.47 -0.68 2.25 6.46 -1.68 -0.63 115.31 122.30 1pwh h LEU 173 Ca 0.16 -0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.84 1pwh h LEU 173 Cb 0.48 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.26 1pwh h LEU 173 CO 0.02 0.39 0.36 0.00 -0.62 0.00 0.00 178.44 178.59 1pwh h GLY 175 N 0.94 0.23 1.64 0.00 0.00 -0.76 -2.14 103.07 102.99 1pwh h GLY 175 Ca 0.24 -0.13 -0.27 0.00 0.00 0.00 0.00 47.33 47.17 1pwh h GLY 175 CO -0.04 0.12 -1.22 -2.08 0.00 0.00 0.00 176.54 173.33 1pwh h VAL 176 N 0.21 1.50 -0.02 4.60 2.07 -0.45 -1.84 116.25 122.32 1pwh h VAL 176 Ca 0.05 -3.04 -0.19 0.00 0.82 0.00 0.00 66.70 64.33 1pwh h VAL 176 Cb 0.31 2.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.99 1pwh h VAL 176 CO 0.02 0.89 -0.83 -0.37 0.02 0.00 0.00 177.57 177.30 1pwh h VAL 177 N 0.08 1.45 -0.22 2.57 -1.51 -1.23 0.31 116.25 117.70 1pwh h VAL 177 Ca -0.13 -2.45 -0.03 0.00 -1.23 0.00 0.00 66.70 62.87 1pwh h VAL 177 Cb 1.94 2.35 -0.01 0.00 -2.13 0.00 0.00 31.29 33.44 1pwh h VAL 177 CO 0.20 0.72 0.04 -0.61 -1.23 0.00 0.00 177.57 176.69 1pwh h GLN 178 N 0.15 0.37 -0.03 5.19 4.15 -1.45 -1.68 115.11 121.81 1pwh h GLN 178 Ca -0.04 -0.10 -0.00 0.00 0.77 0.00 0.00 58.65 59.28 1pwh h GLN 178 Cb 1.43 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 29.08 1pwh h GLN 178 CO 0.13 0.50 0.02 0.78 -1.93 0.00 0.00 178.83 178.33 1pwh h GLY 179 N 0.17 0.05 0.30 2.39 0.00 -1.26 -1.71 103.07 103.02 1pwh h GLY 179 Ca 0.07 -0.02 0.22 0.00 0.00 0.00 0.00 47.33 47.59 1pwh h GLY 179 CO 0.00 0.02 0.60 1.41 0.00 0.00 0.00 176.54 178.58 1pwh h LEU 180 N -0.03 0.27 0.19 3.11 4.07 -0.85 -1.76 115.31 120.32 1pwh h LEU 180 Ca 0.01 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 57.99 1pwh h LEU 180 Cb 0.08 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.80 1pwh h LEU 180 CO -0.00 0.11 -0.09 0.03 -1.08 0.00 0.00 178.44 177.40 1pwh h ARG 181 N 0.27 -0.24 0.00 1.13 3.08 -0.62 0.49 114.38 118.48 1pwh h ARG 181 Ca 0.45 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.52 1pwh h ARG 181 Cb 1.32 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.42 1pwh h ARG 181 CO -0.12 0.13 0.00 -0.85 -1.07 0.00 0.00 179.97 178.06 1pwh n GLU 182 N -4.94 0.45 -0.00 0.04 0.28 -0.71 -2.00 120.64 113.77 1pwh n GLU 182 Ca -0.07 0.01 0.05 0.00 -0.16 0.00 0.00 57.16 56.99 1pwh n GLU 182 Cb 0.24 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.55 1pwh n GLU 182 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1pwh n VAL 183 N -1.02 0.00 -0.47 3.84 0.31 -0.69 -5.00 118.33 115.29 1pwh n VAL 183 Ca 0.11 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1pwh n VAL 183 Cb 0.06 0.97 0.00 0.00 -0.91 0.00 0.00 33.84 33.95 1pwh n VAL 183 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pwh n GLY 184 N 1.29 0.73 1.90 2.92 0.00 -0.85 -4.97 105.19 106.20 1pwh n GLY 184 Ca 0.02 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 1pwh n GLY 184 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1pwh n TRP 185 N -2.47 2.48 0.60 1.61 8.01 0.17 -4.77 117.44 123.06 1pwh n TRP 185 Ca 0.00 -2.29 0.05 0.00 -1.31 0.00 0.00 57.50 53.95 1pwh n TRP 185 Cb 0.00 -0.67 0.29 0.00 -2.01 0.00 0.00 31.31 28.92 1pwh n TRP 185 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.69 175.83 1pwh n GLU 186 N -0.87 0.29 0.00 -0.99 0.00 -1.07 -1.73 120.64 116.27 1pwh n GLU 186 Ca 0.46 0.03 0.10 0.00 0.00 0.00 0.00 57.16 57.76 1pwh n GLU 186 Cb 0.90 -1.50 0.05 0.00 0.00 0.00 0.00 31.44 30.89 1pwh n GLU 186 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1pwh n ASP 187 N -1.04 2.36 -4.63 -1.84 3.85 -1.26 -4.74 116.55 109.23 1pwh n ASP 187 Ca 0.07 -1.68 -0.43 0.00 -0.71 0.00 0.00 54.79 52.04 1pwh n ASP 187 Cb 0.04 0.21 -0.02 0.00 -1.35 0.00 0.00 41.12 40.00 1pwh n ASP 187 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1pwh s VAL 188 N -1.97 4.34 0.60 2.12 1.01 -0.71 -4.98 120.40 120.81 1pwh s VAL 188 Ca 0.21 1.53 -0.18 0.00 0.00 0.00 0.00 61.98 63.54 1pwh s VAL 188 Cb 0.17 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1pwh s VAL 188 CO 0.37 -0.49 1.13 -2.16 0.00 0.00 0.00 175.10 173.95 1pwh s PRO 189 N 3.89 3.08 -0.07 2.72 0.04 -1.26 -4.80 135.00 138.60 1pwh s PRO 189 Ca 0.50 1.55 0.02 0.00 0.04 0.00 0.00 61.00 63.12 1pwh s PRO 189 Cb -0.14 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 1pwh s PRO 189 CO 0.19 -1.06 -0.12 0.42 0.04 0.00 0.00 177.00 176.47 1pwh s ILE 190 N -1.98 3.21 -0.44 0.56 1.01 0.11 -1.94 121.20 121.73 1pwh s ILE 190 Ca 0.71 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 60.67 1pwh s ILE 190 Cb -0.23 -2.29 0.12 0.00 0.01 0.00 0.00 42.46 40.07 1pwh s ILE 190 CO 0.33 0.58 0.25 -0.63 0.00 0.00 0.00 174.94 175.47 1pwh s ILE 191 N -0.52 3.44 -0.19 2.92 1.01 -0.38 0.42 121.20 127.91 1pwh s ILE 191 Ca 0.07 -2.13 -0.27 0.00 0.00 0.00 0.00 60.65 58.32 1pwh s ILE 191 Cb -0.12 -3.34 -0.01 0.00 0.01 0.00 0.00 42.46 39.01 1pwh s ILE 191 CO 0.02 -0.72 0.93 0.00 0.00 0.00 0.00 174.94 175.16 1pwh s ALA 192 N 1.02 3.57 0.00 9.38 0.00 0.90 -1.78 121.76 134.85 1pwh s ALA 192 Ca 0.09 0.12 0.04 0.00 0.00 0.00 0.00 51.96 52.21 1pwh s ALA 192 Cb -0.23 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 1pwh s ALA 192 CO -0.04 -0.80 -0.11 -1.64 0.00 0.00 0.00 175.76 173.17 1pwh s MET 193 N 2.54 2.43 0.13 0.00 -1.94 0.20 -0.76 119.30 121.90 1pwh s MET 193 Ca 0.41 -0.77 -0.18 0.00 -1.71 0.00 0.00 55.69 53.44 1pwh s MET 193 Cb -0.16 -2.41 0.04 0.00 2.01 0.00 0.00 34.83 34.31 1pwh s MET 193 CO 0.11 0.59 0.45 -1.83 -0.01 0.00 0.00 175.02 174.33 1pwh s GLU 194 N -1.29 1.10 0.26 2.03 -1.05 -1.01 -0.79 118.70 117.96 1pwh s GLU 194 Ca 0.15 -0.62 -0.05 0.00 -0.15 0.00 0.00 54.97 54.29 1pwh s GLU 194 Cb -0.11 0.49 -0.05 0.00 -0.44 0.00 0.00 34.13 34.02 1pwh s GLU 194 CO 0.06 -0.44 0.53 0.95 0.95 0.00 0.00 175.26 177.31 1pwh s THR 195 N -3.68 5.03 0.08 1.83 -4.23 -1.25 -0.06 115.64 113.36 1pwh s THR 195 Ca 0.02 0.10 -0.31 0.00 -1.18 0.00 0.00 61.69 60.32 1pwh s THR 195 Cb 0.01 -3.71 -0.06 0.00 1.34 0.00 0.00 72.50 70.08 1pwh s THR 195 CO -0.11 -0.25 1.26 0.12 -0.54 0.00 0.00 174.62 175.09 1pwh s PHE 196 N -2.00 3.38 0.00 3.99 2.19 -0.11 -1.94 117.98 123.49 1pwh s PHE 196 Ca 0.44 1.20 0.00 0.00 0.33 0.00 0.00 56.93 58.90 1pwh s PHE 196 Cb -0.11 -3.50 0.00 0.00 -1.31 0.00 0.00 43.02 38.10 1pwh s PHE 196 CO 0.28 -1.61 0.00 0.41 1.83 0.00 0.00 175.22 176.13 1pwh n GLY 197 N 3.27 0.83 1.96 13.12 0.00 -1.26 -4.34 105.19 118.78 1pwh n GLY 197 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 1pwh n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pwh n ALA 198 N -0.88 2.83 -1.70 4.61 0.00 -0.82 -0.28 120.51 124.27 1pwh n ALA 198 Ca 0.00 -1.84 -0.34 0.00 0.00 0.00 0.00 53.44 51.26 1pwh n ALA 198 Cb 0.00 -0.70 -0.00 0.00 0.00 0.00 0.00 19.45 18.75 1pwh n ALA 198 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1pwh n HIS 199 N -0.28 2.35 0.22 0.00 1.44 -1.06 -4.51 115.22 113.38 1pwh n HIS 199 Ca -0.06 -2.17 0.05 0.00 -2.01 0.00 0.00 57.72 53.54 1pwh n HIS 199 Cb 0.91 -1.28 0.48 0.00 0.12 0.00 0.00 29.99 30.22 1pwh n HIS 199 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1pwh h SER 200 N 2.94 0.00 -0.19 4.39 4.64 -1.87 -0.72 113.55 122.74 1pwh h SER 200 Ca 0.49 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.63 1pwh h SER 200 Cb 0.36 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1pwh h SER 200 CO 1.19 0.23 -0.60 0.15 -0.87 0.00 0.00 176.83 176.93 1pwh h PHE 201 N 0.00 0.97 -0.61 4.77 -0.00 -1.88 -2.59 116.94 117.60 1pwh h PHE 201 Ca -0.00 -0.39 -0.08 0.00 -0.00 0.00 0.00 57.97 57.49 1pwh h PHE 201 Cb 0.43 -0.16 -0.02 0.00 -0.00 0.00 0.00 35.95 36.19 1pwh h PHE 201 CO 0.00 1.20 0.05 1.25 -0.00 0.00 0.00 178.31 180.81 1pwh h HIS 202 N 0.46 1.11 -0.37 0.41 2.76 -1.85 -2.05 115.15 115.63 1pwh h HIS 202 Ca -0.02 -0.17 -0.00 0.00 -2.20 0.00 0.00 60.37 57.97 1pwh h HIS 202 Cb 1.22 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 29.86 1pwh h HIS 202 CO 0.09 0.97 0.22 0.00 -1.30 0.00 0.00 177.93 177.91 1pwh h ALA 203 N 1.00 0.47 0.14 5.26 0.00 -1.15 -0.54 119.26 124.44 1pwh h ALA 203 Ca 0.18 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1pwh h ALA 203 Cb 0.49 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1pwh h ALA 203 CO 0.02 -0.04 -0.17 0.00 0.00 0.00 0.00 179.25 179.06 1pwh h ALA 204 N 1.10 -0.32 -0.29 0.00 0.00 -1.27 -1.53 119.26 116.95 1pwh h ALA 204 Ca 0.13 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1pwh h ALA 204 Cb -0.00 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1pwh h ALA 204 CO -0.03 -0.71 0.12 0.28 0.00 0.00 0.00 179.25 178.92 1pwh h VAL 205 N -0.36 0.96 -0.47 0.00 2.07 -1.24 0.72 116.25 117.93 1pwh h VAL 205 Ca 0.01 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 67.45 1pwh h VAL 205 Cb 0.35 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1pwh h VAL 205 CO -0.06 0.05 0.31 0.50 0.02 0.00 0.00 177.57 178.39 1pwh h LYS 206 N 0.27 0.60 -0.07 1.57 1.63 -0.89 -2.59 116.57 117.10 1pwh h LYS 206 Ca 0.12 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.89 1pwh h LYS 206 Cb 0.07 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 31.56 1pwh h LYS 206 CO -0.11 0.40 0.00 0.39 -3.45 0.00 0.00 179.45 176.68 1pwh n GLU 207 N -4.47 2.28 -0.69 1.90 1.02 -0.59 -4.97 120.64 115.12 1pwh n GLU 207 Ca 0.04 -1.87 0.00 0.00 -0.02 0.00 0.00 57.16 55.31 1pwh n GLU 207 Cb 0.07 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 1pwh n GLU 207 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pwh n GLY 208 N 1.35 0.89 3.17 0.62 0.00 0.21 -4.96 105.19 106.46 1pwh n GLY 208 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 1pwh n GLY 208 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pwh s LYS 209 N -0.28 0.64 0.08 1.61 0.00 -1.06 -5.00 119.74 115.73 1pwh s LYS 209 Ca 0.00 -0.55 -0.31 0.00 0.00 0.00 0.00 55.97 55.11 1pwh s LYS 209 Cb 0.00 0.27 -0.07 0.00 0.00 0.00 0.00 37.83 38.02 1pwh s LYS 209 CO 0.00 -0.18 1.40 -0.48 0.00 0.00 0.00 175.35 176.09 1pwh s LEU 210 N -1.87 4.36 0.37 2.77 2.34 -1.26 -4.30 118.68 121.08 1pwh s LEU 210 Ca -0.08 2.27 0.08 0.00 0.06 0.00 0.00 54.13 56.46 1pwh s LEU 210 Cb -0.03 -3.58 -0.05 0.00 -0.56 0.00 0.00 46.19 41.98 1pwh s LEU 210 CO -0.02 -0.68 0.15 0.68 -1.06 0.00 0.00 176.35 175.42 1pwh s VAL 211 N 1.51 2.70 -0.17 1.48 -7.23 -1.26 -5.00 120.40 112.43 1pwh s VAL 211 Ca 0.65 -1.71 0.01 0.00 -1.81 0.00 0.00 61.98 59.12 1pwh s VAL 211 Cb -0.35 -2.96 0.02 0.00 0.56 0.00 0.00 36.38 33.64 1pwh s VAL 211 CO 0.29 -0.11 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.88 1pwh s THR 212 N -2.50 2.12 -0.13 5.32 2.01 -1.26 -4.45 115.64 116.75 1pwh s THR 212 Ca 0.39 -0.93 -0.29 0.00 0.31 0.00 0.00 61.69 61.16 1pwh s THR 212 Cb 0.00 -1.88 -0.04 0.00 0.01 0.00 0.00 72.50 70.60 1pwh s THR 212 CO 0.22 0.54 1.53 -0.76 -0.69 0.00 0.00 174.62 175.47 1pwh s LEU 213 N 1.13 4.17 0.42 4.42 1.02 0.11 -4.89 118.68 125.07 1pwh s LEU 213 Ca 0.01 1.92 0.11 0.00 0.02 0.00 0.00 54.13 56.19 1pwh s LEU 213 Cb -0.14 -3.53 0.95 0.00 0.02 0.00 0.00 46.19 43.49 1pwh s LEU 213 CO -0.09 -0.96 2.02 1.55 0.02 0.00 0.00 176.35 178.89 1pwh h PRO 214 N 9.46 0.46 -3.64 1.29 0.13 -1.98 -3.43 132.00 134.29 1pwh h PRO 214 Ca -0.34 -0.03 -0.17 0.00 -0.87 0.00 0.00 66.00 64.59 1pwh h PRO 214 Cb 1.15 -0.10 -0.23 0.00 0.13 0.00 0.00 31.00 31.95 1pwh h PRO 214 CO 0.97 0.31 -0.59 0.15 -0.23 0.00 0.00 178.00 178.61 1pwh s LYS 215 N -5.44 0.31 -0.63 0.86 1.02 -1.26 -5.08 119.74 109.52 1pwh s LYS 215 Ca -0.08 -0.27 -0.19 0.00 0.02 0.00 0.00 55.97 55.45 1pwh s LYS 215 Cb 0.19 0.13 0.11 0.00 -0.52 0.00 0.00 37.83 37.73 1pwh s LYS 215 CO 0.74 -0.06 0.74 0.42 -0.92 0.00 0.00 175.35 176.26 1pwh s ILE 216 N -0.91 4.85 -2.25 2.17 -1.09 -1.26 -4.86 121.20 117.84 1pwh s ILE 216 Ca -0.10 -1.10 0.20 0.00 -2.23 0.00 0.00 60.65 57.42 1pwh s ILE 216 Cb -0.06 -4.51 0.44 0.00 -1.58 0.00 0.00 42.46 36.75 1pwh s ILE 216 CO 0.00 -1.15 1.45 1.07 -1.23 0.00 0.00 174.94 175.08 1pwh n THR 217 N 5.47 0.42 -2.89 2.92 5.66 0.61 -4.94 114.28 121.53 1pwh n THR 217 Ca -0.06 -0.55 -0.26 0.00 -3.05 0.00 0.00 64.05 60.13 1pwh n THR 217 Cb 0.43 0.53 0.00 0.00 -1.55 0.00 0.00 70.33 69.74 1pwh n THR 217 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1pwh s SER 218 N -1.37 6.15 0.40 1.09 0.15 -0.93 -4.85 113.70 114.33 1pwh s SER 218 Ca 0.34 0.67 0.21 0.00 0.70 0.00 0.00 55.95 57.87 1pwh s SER 218 Cb 0.19 -2.03 0.27 0.00 -1.71 0.00 0.00 66.02 62.73 1pwh s SER 218 CO 0.26 -0.55 1.55 -0.37 1.20 0.00 0.00 173.24 175.33 1pwh h VAL 219 N 0.37 0.19 0.00 4.45 -1.51 -1.92 -3.38 116.25 114.45 1pwh h VAL 219 Ca -0.48 -1.27 -0.69 0.00 -1.23 0.00 0.00 66.70 63.04 1pwh h VAL 219 Cb 1.22 2.07 -0.02 0.00 -2.13 0.00 0.00 31.29 32.44 1pwh h VAL 219 CO 0.61 0.11 2.99 0.00 -1.23 0.00 0.00 177.57 180.04 1pwh n ALA 220 N -2.13 5.15 0.21 5.19 0.00 -1.26 -4.76 120.51 122.90 1pwh n ALA 220 Ca 0.03 -3.74 0.16 0.00 0.00 0.00 0.00 53.44 49.90 1pwh n ALA 220 Cb 0.58 -3.55 0.81 0.00 0.00 0.00 0.00 19.45 17.29 1pwh n ALA 220 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1pwh h LYS 221 N 6.36 0.00 0.00 0.00 1.79 -1.97 -0.64 116.57 122.11 1pwh h LYS 221 Ca 0.55 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.02 1pwh h LYS 221 Cb 0.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 1pwh h LYS 221 CO 1.90 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 180.27 1pwh n ALA 222 N -2.38 1.62 0.79 3.86 0.00 -1.26 -0.49 120.51 122.64 1pwh n ALA 222 Ca 0.01 -0.04 0.09 0.00 0.00 0.00 0.00 53.44 53.50 1pwh n ALA 222 Cb 0.29 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 1pwh n ALA 222 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1pwh n LEU 223 N -1.53 1.47 -2.68 0.00 4.32 -0.25 -4.74 117.00 113.59 1pwh n LEU 223 Ca 0.03 -0.69 -0.05 0.00 -0.02 0.00 0.00 56.01 55.28 1pwh n LEU 223 Cb 0.16 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 41.94 1pwh n LEU 223 CO 0.13 0.29 1.09 0.61 -1.22 0.00 0.00 177.39 178.29 1pwh n GLY 224 N 1.27 1.79 3.31 -0.72 0.00 0.35 -4.50 105.19 106.70 1pwh n GLY 224 Ca 0.06 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 1pwh n GLY 224 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pwh s VAL 225 N 3.32 4.61 0.62 1.61 1.01 -1.26 -4.78 120.40 125.53 1pwh s VAL 225 Ca 0.15 -1.28 0.24 0.00 0.00 0.00 0.00 61.98 61.10 1pwh s VAL 225 Cb 0.06 -3.80 0.32 0.00 0.00 0.00 0.00 36.38 32.96 1pwh s VAL 225 CO -0.01 -0.54 1.56 0.78 0.00 0.00 0.00 175.10 176.90 1pwh h ASN 226 N 8.54 0.00 -2.42 3.32 4.21 -1.87 -3.39 115.58 123.97 1pwh h ASN 226 Ca -0.25 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.20 1pwh h ASN 226 Cb 1.09 0.00 -0.26 0.00 -1.12 0.00 0.00 38.32 38.04 1pwh h ASN 226 CO 0.81 0.00 -0.31 0.28 -1.29 0.00 0.00 177.43 176.91 1pwh s THR 227 N -4.39 -0.71 0.82 2.81 -1.32 -1.26 0.08 115.64 111.67 1pwh s THR 227 Ca -0.03 0.13 -0.12 0.00 -1.21 0.00 0.00 61.69 60.46 1pwh s THR 227 Cb 0.12 -0.74 0.09 0.00 -1.51 0.00 0.00 72.50 70.46 1pwh s THR 227 CO 0.40 0.05 1.15 0.68 -2.21 0.00 0.00 174.62 174.70 1pwh s VAL 228 N 2.64 2.41 0.62 5.08 -7.23 -1.26 -4.97 120.40 117.70 1pwh s VAL 228 Ca -0.03 0.16 -0.18 0.00 -1.81 0.00 0.00 61.98 60.12 1pwh s VAL 228 Cb -0.12 -2.46 -0.02 0.00 0.56 0.00 0.00 36.38 34.34 1pwh s VAL 228 CO -0.14 -0.15 1.20 -0.83 -0.31 0.00 0.00 175.10 174.87 1pwh s GLY 229 N -2.59 2.64 0.32 2.32 0.00 -0.74 -4.91 107.32 104.36 1pwh s GLY 229 Ca 0.68 0.96 0.00 0.00 0.00 0.00 0.00 44.72 46.37 1pwh s GLY 229 CO 0.53 1.35 1.95 0.00 0.00 0.00 0.00 173.10 176.93 1pwh h ALA 230 N 0.62 1.43 -0.35 3.20 0.00 -1.93 -2.05 119.26 120.19 1pwh h ALA 230 Ca -0.50 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.27 1pwh h ALA 230 Cb 1.29 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1pwh h ALA 230 CO 0.54 0.48 -0.00 0.37 0.00 0.00 0.00 179.25 180.64 1pwh h GLN 231 N 0.89 0.54 0.54 0.00 5.75 -1.95 0.97 115.11 121.85 1pwh h GLN 231 Ca 0.23 -0.12 -0.03 0.00 -0.15 0.00 0.00 58.65 58.59 1pwh h GLN 231 Cb 0.00 -0.08 0.01 0.00 1.07 0.00 0.00 27.48 28.48 1pwh h GLN 231 CO -0.04 0.57 -0.26 1.15 -2.65 0.00 0.00 178.83 177.60 1pwh h THR 232 N 0.51 0.45 -0.76 2.39 2.02 -1.67 -0.54 112.91 115.32 1pwh h THR 232 Ca 0.11 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1pwh h THR 232 Cb 0.34 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 1pwh h THR 232 CO 0.01 0.02 0.48 0.25 0.37 0.00 0.00 175.52 176.65 1pwh h LEU 233 N -0.81 0.89 -0.46 2.58 5.85 -1.31 -2.56 115.31 119.50 1pwh h LEU 233 Ca -0.07 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.65 1pwh h LEU 233 Cb 0.59 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 1pwh h LEU 233 CO 0.12 0.68 0.19 0.50 -0.34 0.00 0.00 178.44 179.59 1pwh h LYS 234 N 1.03 0.37 0.00 1.25 3.64 -0.64 -1.45 116.57 120.77 1pwh h LYS 234 Ca 0.27 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 1pwh h LYS 234 Cb -0.07 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.66 1pwh h LYS 234 CO -0.05 0.24 -0.06 -0.07 -2.27 0.00 0.00 179.45 177.24 1pwh h LEU 235 N 0.38 0.00 -1.32 5.20 4.07 -0.70 -2.73 115.31 120.21 1pwh h LEU 235 Ca 0.21 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.22 1pwh h LEU 235 Cb 0.18 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.87 1pwh h LEU 235 CO -0.19 0.06 0.49 0.15 -1.08 0.00 0.00 178.44 177.87 1pwh h PHE 236 N 0.00 0.85 0.00 1.13 3.04 -0.92 -1.11 116.94 119.93 1pwh h PHE 236 Ca -0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 1pwh h PHE 236 Cb 0.18 -0.28 0.00 0.00 2.56 0.00 0.00 35.95 38.41 1pwh h PHE 236 CO 0.00 0.47 -0.38 0.66 -2.02 0.00 0.00 178.31 177.05 1pwh n TYR 237 N -4.47 0.14 -0.03 0.41 4.02 -1.03 -4.04 117.16 112.17 1pwh n TYR 237 Ca 0.10 0.04 0.02 0.00 -0.01 0.00 0.00 57.90 58.06 1pwh n TYR 237 Cb 0.17 -0.42 -0.14 0.00 -0.02 0.00 0.00 39.34 38.93 1pwh n TYR 237 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1pwh n GLU 238 N -1.64 0.66 -4.27 -0.72 1.02 -0.65 -4.98 120.64 110.06 1pwh n GLU 238 Ca 0.05 -0.06 -0.20 0.00 -0.02 0.00 0.00 57.16 56.93 1pwh n GLU 238 Cb 0.36 -1.58 -0.12 0.00 -0.02 0.00 0.00 31.44 30.08 1pwh n GLU 238 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1pwh s HIS 239 N -3.08 1.38 -0.63 -0.32 2.46 -0.51 -5.07 115.29 109.52 1pwh s HIS 239 Ca -0.08 -0.42 -0.26 0.00 0.47 0.00 0.00 55.06 54.77 1pwh s HIS 239 Cb 0.10 -0.79 -0.04 0.00 -0.13 0.00 0.00 32.58 31.73 1pwh s HIS 239 CO 0.86 0.09 2.00 -1.25 -2.47 0.00 0.00 174.74 173.97 1pwh s PRO 240 N -1.61 2.47 -0.09 2.88 0.04 -1.26 -4.72 135.00 132.70 1pwh s PRO 240 Ca 0.01 0.64 0.03 0.00 0.04 0.00 0.00 61.00 61.73 1pwh s PRO 240 Cb -0.09 -4.53 0.01 0.00 0.04 0.00 0.00 34.50 29.92 1pwh s PRO 240 CO 0.02 -3.00 -0.19 0.42 0.04 0.00 0.00 177.00 174.29 1pwh s ILE 241 N 10.07 1.71 -0.22 0.56 1.01 -1.26 -0.71 121.20 132.37 1pwh s ILE 241 Ca 0.75 -0.81 -0.13 0.00 0.00 0.00 0.00 60.65 60.45 1pwh s ILE 241 Cb -0.13 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 1pwh s ILE 241 CO 0.18 0.48 0.28 -0.36 0.00 0.00 0.00 174.94 175.53 1pwh s PHE 242 N 0.54 3.35 -0.39 3.97 0.40 0.17 -4.95 117.98 121.06 1pwh s PHE 242 Ca -0.16 0.44 -0.14 0.00 -0.60 0.00 0.00 56.93 56.47 1pwh s PHE 242 Cb -0.17 -2.39 0.02 0.00 0.51 0.00 0.00 43.02 40.98 1pwh s PHE 242 CO 0.06 0.04 0.27 0.45 0.70 0.00 0.00 175.22 176.74 1pwh s SER 243 N 1.00 6.02 0.11 1.36 0.15 -1.26 -0.07 113.70 121.01 1pwh s SER 243 Ca 0.14 -0.85 0.10 0.00 0.70 0.00 0.00 55.95 56.03 1pwh s SER 243 Cb -0.14 -2.13 -0.04 0.00 -1.71 0.00 0.00 66.02 62.01 1pwh s SER 243 CO 0.06 -0.41 -0.24 -1.61 1.20 0.00 0.00 173.24 172.24 1pwh s GLU 244 N 1.66 1.60 -0.07 5.44 8.01 0.06 -4.99 118.70 130.41 1pwh s GLU 244 Ca 0.05 -1.25 0.03 0.00 0.01 0.00 0.00 54.97 53.81 1pwh s GLU 244 Cb -0.19 -1.99 0.01 0.00 -4.31 0.00 0.00 34.13 27.65 1pwh s GLU 244 CO 0.09 0.47 -0.15 0.54 0.01 0.00 0.00 175.26 176.22 1pwh s VAL 245 N -1.04 1.37 0.25 2.63 0.11 -1.26 -2.40 120.40 120.06 1pwh s VAL 245 Ca 0.15 -0.63 0.11 0.00 -2.93 0.00 0.00 61.98 58.68 1pwh s VAL 245 Cb -0.10 -1.22 -0.05 0.00 -1.53 0.00 0.00 36.38 33.48 1pwh s VAL 245 CO 0.07 0.41 -0.19 -0.51 -3.33 0.00 0.00 175.10 171.54 1pwh s ILE 246 N 0.49 2.28 0.58 7.04 1.10 0.91 -4.90 121.20 128.70 1pwh s ILE 246 Ca -0.14 -2.28 -0.14 0.00 -0.51 0.00 0.00 60.65 57.58 1pwh s ILE 246 Cb -0.15 -2.20 -0.05 0.00 0.15 0.00 0.00 42.46 40.21 1pwh s ILE 246 CO 0.05 -0.39 1.01 -0.94 -2.11 0.00 0.00 174.94 172.56 1pwh s SER 247 N -3.29 6.34 0.28 4.50 1.04 -1.26 -0.93 113.70 120.37 1pwh s SER 247 Ca 0.26 1.52 -0.00 0.00 0.48 0.00 0.00 55.95 58.21 1pwh s SER 247 Cb -0.05 -2.49 0.49 0.00 0.10 0.00 0.00 66.02 64.07 1pwh s SER 247 CO 0.12 -0.79 1.88 0.44 0.98 0.00 0.00 173.24 175.87 1pwh h ASP 248 N 0.25 0.97 -0.12 7.02 3.45 -1.95 -1.42 116.42 124.62 1pwh h ASP 248 Ca -0.45 0.02 0.04 0.00 0.43 0.00 0.00 57.03 57.06 1pwh h ASP 248 Cb 1.19 -0.19 -0.04 0.00 -0.56 0.00 0.00 39.33 39.74 1pwh h ASP 248 CO 0.61 0.59 -0.11 1.56 -1.57 0.00 0.00 179.24 180.32 1pwh h GLN 249 N 1.09 -0.13 -0.32 3.56 7.50 -1.93 0.49 115.11 125.37 1pwh h GLN 249 Ca 0.44 0.01 0.01 0.00 0.50 0.00 0.00 58.65 59.60 1pwh h GLN 249 Cb 0.27 0.03 -0.02 0.00 0.05 0.00 0.00 27.48 27.82 1pwh h GLN 249 CO -0.19 -0.09 0.21 0.93 -1.50 0.00 0.00 178.83 178.19 1pwh h GLU 250 N -0.14 0.41 -0.07 1.46 5.08 -1.69 0.30 114.58 119.92 1pwh h GLU 250 Ca 0.08 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 1pwh h GLU 250 Cb 0.26 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.43 1pwh h GLU 250 CO -0.20 0.27 -0.54 0.00 -1.00 0.00 0.00 179.01 177.53 1pwh h ALA 251 N 1.80 0.16 -0.08 3.43 0.00 -0.49 -1.97 119.26 122.11 1pwh h ALA 251 Ca 0.12 -0.53 -0.12 0.00 0.00 0.00 0.00 54.91 54.38 1pwh h ALA 251 Cb -0.03 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1pwh h ALA 251 CO -0.03 0.38 -0.47 0.28 0.00 0.00 0.00 179.25 179.41 1pwh h VAL 252 N 0.06 1.34 -0.18 0.00 2.07 -0.46 -2.10 116.25 116.97 1pwh h VAL 252 Ca -0.05 -1.66 -0.08 0.00 0.82 0.00 0.00 66.70 65.73 1pwh h VAL 252 Cb 1.21 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 1pwh h VAL 252 CO 0.11 0.49 -0.26 0.74 0.02 0.00 0.00 177.57 178.67 1pwh h THR 253 N 0.16 1.25 -0.27 2.57 2.02 -0.42 -2.30 112.91 115.92 1pwh h THR 253 Ca 0.01 -1.20 -0.15 0.00 0.77 0.00 0.00 66.41 65.84 1pwh h THR 253 Cb 0.89 1.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.70 1pwh h THR 253 CO 0.07 0.37 -0.44 0.00 0.37 0.00 0.00 175.52 175.89 1pwh h ALA 254 N 1.43 0.73 -0.36 6.16 0.00 -0.72 -1.67 119.26 124.83 1pwh h ALA 254 Ca 0.05 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1pwh h ALA 254 Cb 0.62 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1pwh h ALA 254 CO 0.04 0.67 0.19 0.82 0.00 0.00 0.00 179.25 180.97 1pwh h ILE 255 N 0.55 1.01 -0.48 0.00 2.04 -0.88 0.21 117.51 119.96 1pwh h ILE 255 Ca 0.04 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1pwh h ILE 255 Cb 0.98 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1pwh h ILE 255 CO 0.09 0.07 0.26 -0.08 0.00 0.00 0.00 178.15 178.49 1pwh h GLU 256 N 0.40 0.66 -0.22 2.37 4.81 -1.29 -1.40 114.58 119.90 1pwh h GLU 256 Ca 0.15 -0.08 -0.20 0.00 -0.13 0.00 0.00 59.36 59.10 1pwh h GLU 256 Cb 0.03 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.29 1pwh h GLU 256 CO -0.08 0.52 -0.62 0.87 -0.73 0.00 0.00 179.01 178.96 1pwh h LYS 257 N 0.63 0.82 -0.53 1.92 1.57 -1.05 -3.26 116.57 116.67 1pwh h LYS 257 Ca 0.17 -0.58 -0.08 0.00 -1.87 0.00 0.00 60.65 58.29 1pwh h LYS 257 Cb 0.05 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1pwh h LYS 257 CO -0.03 1.20 0.03 0.35 -0.57 0.00 0.00 179.45 180.44 1pwh h PHE 258 N 0.58 0.98 -0.12 -1.35 3.57 -0.44 0.82 116.94 120.97 1pwh h PHE 258 Ca -0.01 -0.16 -0.04 0.00 3.53 0.00 0.00 57.97 61.29 1pwh h PHE 258 Cb 1.24 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1pwh h PHE 258 CO 0.08 0.89 -0.09 -0.24 -2.23 0.00 0.00 178.31 176.72 1pwh h VAL 259 N 0.78 1.14 0.16 1.41 3.04 -1.09 0.25 116.25 121.94 1pwh h VAL 259 Ca 0.15 -0.61 -0.29 0.00 -1.01 0.00 0.00 66.70 64.94 1pwh h VAL 259 Cb 0.48 1.15 0.01 0.00 -2.01 0.00 0.00 31.29 30.92 1pwh h VAL 259 CO 0.02 0.19 -1.35 0.44 -1.01 0.00 0.00 177.57 175.86 1pwh h ASP 260 N 0.18 0.51 -0.11 3.17 3.45 -1.55 -0.90 116.42 121.18 1pwh h ASP 260 Ca 0.04 -0.58 -0.16 0.00 0.43 0.00 0.00 57.03 56.76 1pwh h ASP 260 Cb 0.28 -0.17 0.01 0.00 -0.56 0.00 0.00 39.33 38.89 1pwh h ASP 260 CO 0.02 1.46 -0.56 0.44 -1.57 0.00 0.00 179.24 179.02 1pwh h ASP 261 N 0.09 0.68 0.00 6.45 3.45 -0.35 -3.38 116.42 123.36 1pwh h ASP 261 Ca -0.18 -0.64 0.00 0.00 0.43 0.00 0.00 57.03 56.64 1pwh h ASP 261 Cb 2.03 -0.20 0.00 0.00 -0.56 0.00 0.00 39.33 40.59 1pwh h ASP 261 CO 0.21 1.21 -0.14 -0.62 -1.57 0.00 0.00 179.24 178.34 1pwh n GLU 262 N -4.18 1.08 -2.05 3.56 -0.58 0.83 -4.94 120.64 114.37 1pwh n GLU 262 Ca -0.08 -1.57 -0.18 0.00 -0.42 0.00 0.00 57.16 54.91 1pwh n GLU 262 Cb 0.63 -0.95 -0.04 0.00 -0.57 0.00 0.00 31.44 30.51 1pwh n GLU 262 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1pwh n LYS 263 N -0.60 -1.67 -5.15 3.49 4.01 -0.34 -4.97 118.16 112.93 1pwh n LYS 263 Ca 0.05 0.95 -0.32 0.00 -0.51 0.00 0.00 58.31 58.49 1pwh n LYS 263 Cb 0.55 -5.47 -0.17 0.00 -0.51 0.00 0.00 35.03 29.43 1pwh n LYS 263 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1pwh s ILE 264 N -2.75 2.11 -0.41 -0.18 -1.09 -1.24 -4.98 121.20 112.65 1pwh s ILE 264 Ca 0.00 -1.00 -0.15 0.00 -2.23 0.00 0.00 60.65 57.27 1pwh s ILE 264 Cb 0.00 -1.81 0.02 0.00 -1.58 0.00 0.00 42.46 39.09 1pwh s ILE 264 CO 0.00 0.56 0.32 -0.22 -1.23 0.00 0.00 174.94 174.37 1pwh s LEU 265 N 0.39 5.05 0.36 2.97 2.96 -1.26 -2.82 118.68 126.33 1pwh s LEU 265 Ca -0.17 -0.84 0.08 0.00 -0.22 0.00 0.00 54.13 52.97 1pwh s LEU 265 Cb -0.18 -2.20 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 1pwh s LEU 265 CO 0.08 -0.46 0.22 0.68 -1.32 0.00 0.00 176.35 175.54 1pwh s VAL 266 N 1.76 3.02 0.63 1.68 -7.23 -1.26 -4.91 120.40 114.10 1pwh s VAL 266 Ca 0.06 -1.56 0.01 0.00 -1.81 0.00 0.00 61.98 58.68 1pwh s VAL 266 Cb -0.19 -3.04 0.08 0.00 0.56 0.00 0.00 36.38 33.80 1pwh s VAL 266 CO 0.11 -0.13 0.88 -1.83 -0.31 0.00 0.00 175.10 173.81 1pwh s GLU 267 N -3.93 2.10 0.24 4.82 -1.05 -1.02 -4.84 118.70 115.02 1pwh s GLU 267 Ca 0.40 -1.03 -0.06 0.00 -0.15 0.00 0.00 54.97 54.13 1pwh s GLU 267 Cb -0.03 -2.43 0.45 0.00 -0.44 0.00 0.00 34.13 31.68 1pwh s GLU 267 CO 0.24 -1.08 1.66 -1.35 0.95 0.00 0.00 175.26 175.69 1pwh h PRO 268 N -0.20 0.17 -0.74 -4.83 0.11 -1.89 0.57 132.00 125.20 1pwh h PRO 268 Ca -0.38 -0.01 0.16 0.00 0.11 0.00 0.00 66.00 65.88 1pwh h PRO 268 Cb 1.28 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.31 1pwh h PRO 268 CO 0.45 0.11 0.50 0.00 -0.21 0.00 0.00 178.00 178.86 1pwh h ALA 269 N 1.65 2.24 0.06 -0.75 0.00 -1.90 -0.42 119.26 120.14 1pwh h ALA 269 Ca 0.41 -0.00 -0.29 0.00 0.00 0.00 0.00 54.91 55.02 1pwh h ALA 269 Cb 0.72 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1pwh h ALA 269 CO -0.58 -0.45 -1.57 0.00 0.00 0.00 0.00 179.25 176.65 1pwh h GLY 271 N 2.45 0.00 1.04 0.00 0.00 0.56 -2.05 103.07 105.07 1pwh h GLY 271 Ca -0.24 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.01 1pwh h GLY 271 CO 0.12 0.00 0.03 0.00 0.00 0.00 0.00 176.54 176.69 1pwh h ALA 272 N 1.95 0.75 -0.24 3.60 0.00 -1.30 0.47 119.26 124.49 1pwh h ALA 272 Ca -0.00 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.48 1pwh h ALA 272 Cb 0.13 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1pwh h ALA 272 CO 0.01 0.55 -0.43 0.00 0.00 0.00 0.00 179.25 179.37 1pwh h ALA 273 N 0.97 0.37 -0.87 0.00 0.00 -1.53 -3.12 119.26 115.09 1pwh h ALA 273 Ca 0.16 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1pwh h ALA 273 Cb 0.50 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1pwh h ALA 273 CO 0.02 0.50 0.56 -0.07 0.00 0.00 0.00 179.25 180.26 1pwh h LEU 274 N 0.43 1.01 -1.77 0.00 3.38 -1.24 -1.18 115.31 115.95 1pwh h LEU 274 Ca 0.01 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.96 1pwh h LEU 274 Cb 1.03 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 1pwh h LEU 274 CO 0.10 0.75 0.43 0.00 0.09 0.00 0.00 178.44 179.80 1pwh h ALA 275 N 1.43 1.52 -0.26 1.53 0.00 -0.83 0.20 119.26 122.85 1pwh h ALA 275 Ca 0.32 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.30 1pwh h ALA 275 Cb -0.11 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1pwh h ALA 275 CO -0.07 -0.46 0.21 0.00 0.00 0.00 0.00 179.25 178.93 1pwh h ALA 276 N 1.20 2.13 0.00 0.00 0.00 -1.31 0.26 119.26 121.54 1pwh h ALA 276 Ca 0.03 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.62 1pwh h ALA 276 Cb 0.89 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 1pwh h ALA 276 CO -0.00 -0.34 -2.10 1.55 0.00 0.00 0.00 179.25 178.36 1pwh n VAL 277 N -4.25 1.09 -0.34 0.00 3.14 0.66 -1.28 118.33 117.35 1pwh n VAL 277 Ca 0.03 -0.33 -0.03 0.00 -2.96 0.00 0.00 64.34 61.05 1pwh n VAL 277 Cb 0.36 -1.52 0.09 0.00 -1.06 0.00 0.00 33.84 31.71 1pwh n VAL 277 CO 0.00 0.00 0.00 1.88 -6.46 0.00 0.00 176.83 172.25 1pwh h TYR 278 N -0.42 1.19 -0.08 1.45 0.99 -1.34 -1.68 116.97 117.09 1pwh h TYR 278 Ca -0.47 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.26 1pwh h TYR 278 Cb 1.53 -0.39 0.00 0.00 1.00 0.00 0.00 36.73 38.87 1pwh h TYR 278 CO -0.03 0.78 0.00 0.43 -0.00 0.00 0.00 178.16 179.35 1pwh n SER 279 N -4.40 1.29 -1.25 3.88 7.64 0.91 -4.94 113.62 116.75 1pwh n SER 279 Ca 0.10 -1.55 -0.11 0.00 1.01 0.00 0.00 58.87 58.33 1pwh n SER 279 Cb 0.05 -0.05 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1pwh n SER 279 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pwh n GLY 280 N 1.10 -0.07 0.19 0.23 0.00 -0.63 -4.95 105.19 101.05 1pwh n GLY 280 Ca 0.18 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 1pwh n GLY 280 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1pwh h VAL 281 N -0.03 1.25 -0.73 1.61 2.07 -1.36 -2.56 116.25 116.50 1pwh h VAL 281 Ca -0.26 -0.90 -0.06 0.00 0.82 0.00 0.00 66.70 66.31 1pwh h VAL 281 Cb 1.19 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 1pwh h VAL 281 CO 0.30 0.30 0.23 -0.37 0.02 0.00 0.00 177.57 178.05 1pwh h VAL 282 N 0.39 1.26 -0.30 2.57 -1.51 -1.75 -1.83 116.25 115.09 1pwh h VAL 282 Ca 0.10 -0.90 -0.03 0.00 -1.23 0.00 0.00 66.70 64.64 1pwh h VAL 282 Cb 0.40 0.46 -0.02 0.00 -2.13 0.00 0.00 31.29 30.01 1pwh h VAL 282 CO 0.01 0.35 0.05 0.00 -1.23 0.00 0.00 177.57 176.75 1pwh h ARG 284 N 0.43 0.94 -0.19 0.00 2.43 -1.00 0.73 114.38 117.72 1pwh h ARG 284 Ca 0.10 -0.50 -0.06 0.00 -0.81 0.00 0.00 59.98 58.71 1pwh h ARG 284 Cb 0.21 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1pwh h ARG 284 CO -0.00 1.15 -0.16 -0.07 -1.51 0.00 0.00 179.97 179.38 1pwh h LEU 285 N 0.76 0.31 -0.03 3.80 3.38 -0.53 0.10 115.31 123.11 1pwh h LEU 285 Ca 0.06 -0.08 -0.18 0.00 0.09 0.00 0.00 57.88 57.78 1pwh h LEU 285 Cb 0.98 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.66 1pwh h LEU 285 CO 0.10 0.49 -0.69 1.56 0.09 0.00 0.00 178.44 179.99 1pwh h GLN 286 N 0.30 0.51 -0.36 1.13 4.20 -0.83 0.41 115.11 120.46 1pwh h GLN 286 Ca 0.06 -0.52 -0.03 0.00 0.06 0.00 0.00 58.65 58.22 1pwh h GLN 286 Cb 0.46 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1pwh h GLN 286 CO 0.03 1.15 0.10 0.00 -0.67 0.00 0.00 178.83 179.44 1pwh h ALA 287 N 0.37 1.50 -0.00 3.87 0.00 -0.44 0.51 119.26 125.08 1pwh h ALA 287 Ca -0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1pwh h ALA 287 Cb 1.37 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1pwh h ALA 287 CO 0.14 0.37 -0.04 0.39 0.00 0.00 0.00 179.25 180.11 1pwh n GLU 288 N -4.35 0.31 -1.18 0.00 1.02 0.32 -4.91 120.64 111.83 1pwh n GLU 288 Ca 0.02 -0.03 -0.06 0.00 -0.02 0.00 0.00 57.16 57.07 1pwh n GLU 288 Cb 0.17 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.07 1pwh n GLU 288 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1pwh n ALA 289 N -1.32 -0.10 0.32 0.62 0.00 0.17 -4.89 120.51 115.31 1pwh n ALA 289 Ca 0.12 0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.78 1pwh n ALA 289 Cb 0.28 -0.98 0.12 0.00 0.00 0.00 0.00 19.45 18.87 1pwh n ALA 289 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pwh h ARG 290 N 0.11 0.00 -5.76 0.00 3.08 -1.17 -3.45 114.38 107.20 1pwh h ARG 290 Ca -0.13 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.32 1pwh h ARG 290 Cb 0.47 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.22 1pwh h ARG 290 CO 0.19 0.00 -0.85 -0.51 -1.07 0.00 0.00 179.97 177.73 1pwh s LEU 291 N -5.10 2.00 0.78 3.04 1.43 -0.75 -4.98 118.68 115.10 1pwh s LEU 291 Ca 0.04 -0.39 -0.11 0.00 -1.03 0.00 0.00 54.13 52.64 1pwh s LEU 291 Cb 0.10 -1.08 0.06 0.00 0.03 0.00 0.00 46.19 45.31 1pwh s LEU 291 CO 0.73 0.22 1.11 0.00 0.23 0.00 0.00 176.35 178.64 1pwh s GLN 292 N -0.25 2.10 -0.04 1.70 -2.07 -1.26 -4.26 119.66 115.57 1pwh s GLN 292 Ca 0.02 1.32 -0.02 0.00 -1.82 0.00 0.00 55.36 54.86 1pwh s GLN 292 Cb -0.10 -1.87 0.03 0.00 -1.09 0.00 0.00 33.01 29.98 1pwh s GLN 292 CO 0.01 -1.79 0.08 0.99 -1.32 0.00 0.00 175.29 173.26 1pwh s THR 293 N -2.70 -0.12 0.59 3.63 2.01 -1.26 -3.55 115.64 114.23 1pwh s THR 293 Ca 0.64 0.34 -0.18 0.00 0.31 0.00 0.00 61.69 62.80 1pwh s THR 293 Cb -0.20 -0.17 -0.04 0.00 0.01 0.00 0.00 72.50 72.11 1pwh s THR 293 CO 0.53 0.14 1.11 -2.16 -0.69 0.00 0.00 174.62 173.56 1pwh s PRO 294 N 1.81 3.17 -0.12 4.92 0.04 -1.26 -5.16 135.00 138.41 1pwh s PRO 294 Ca -0.00 1.48 -0.08 0.00 0.04 0.00 0.00 61.00 62.44 1pwh s PRO 294 Cb -0.12 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1pwh s PRO 294 CO -0.04 -0.97 0.16 -1.17 0.04 0.00 0.00 177.00 175.02 1pwh s LEU 295 N -4.23 4.38 0.58 -3.56 2.96 -1.23 -5.08 118.68 112.50 1pwh s LEU 295 Ca 0.70 0.48 -0.18 0.00 -0.22 0.00 0.00 54.13 54.91 1pwh s LEU 295 Cb -0.22 -2.12 -0.04 0.00 0.50 0.00 0.00 46.19 44.32 1pwh s LEU 295 CO 0.33 0.37 1.15 0.00 -1.32 0.00 0.00 176.35 176.88 1pwh s ALA 296 N -0.87 2.60 -0.38 5.97 0.00 -1.26 -4.69 121.76 123.13 1pwh s ALA 296 Ca 0.15 0.82 -0.45 0.00 0.00 0.00 0.00 51.96 52.48 1pwh s ALA 296 Cb -0.12 -3.38 -0.20 0.00 0.00 0.00 0.00 23.12 19.43 1pwh s ALA 296 CO 0.04 -0.98 1.52 -1.13 0.00 0.00 0.00 175.76 175.21 1pwh n SER 297 N -1.60 1.10 -4.90 0.00 3.41 -1.26 -2.58 113.62 107.79 1pwh n SER 297 Ca 0.12 1.17 -0.31 0.00 -0.26 0.00 0.00 58.87 59.59 1pwh n SER 297 Cb 0.51 -0.91 -0.04 0.00 -0.26 0.00 0.00 64.21 63.50 1pwh n SER 297 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 1pwh s LEU 298 N 2.48 4.21 -0.19 1.04 0.05 -0.02 -1.99 118.68 124.25 1pwh s LEU 298 Ca 1.02 0.67 -0.05 0.00 0.05 0.00 0.00 54.13 55.82 1pwh s LEU 298 Cb -1.42 -3.43 -0.03 0.00 -2.05 0.00 0.00 46.19 39.27 1pwh s LEU 298 CO 0.76 -0.02 -0.00 -0.69 -0.55 0.00 0.00 176.35 175.84 1pwh s VAL 299 N -1.78 3.97 -0.26 1.48 1.01 0.22 -0.56 120.40 124.49 1pwh s VAL 299 Ca 0.43 -0.31 -0.09 0.00 0.00 0.00 0.00 61.98 62.01 1pwh s VAL 299 Cb -0.12 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 1pwh s VAL 299 CO 0.25 0.44 0.11 -0.69 0.00 0.00 0.00 175.10 175.21 1pwh s VAL 300 N 0.88 4.67 -0.49 2.92 1.01 0.59 -0.34 120.40 129.64 1pwh s VAL 300 Ca 0.01 -0.05 -0.28 0.00 0.00 0.00 0.00 61.98 61.66 1pwh s VAL 300 Cb -0.14 -3.20 0.03 0.00 0.00 0.00 0.00 36.38 33.07 1pwh s VAL 300 CO 0.02 0.31 1.08 -0.63 0.00 0.00 0.00 175.10 175.88 1pwh s ILE 301 N 1.60 4.26 -1.08 2.22 1.01 -0.32 -1.62 121.20 127.28 1pwh s ILE 301 Ca 0.06 1.02 -0.20 0.00 0.00 0.00 0.00 60.65 61.54 1pwh s ILE 301 Cb -0.15 -4.57 0.09 0.00 0.01 0.00 0.00 42.46 37.84 1pwh s ILE 301 CO 0.06 -1.00 1.43 -0.69 0.00 0.00 0.00 174.94 174.73 1pwh s VAL 302 N 4.30 4.30 0.50 2.92 1.01 -0.87 -4.79 120.40 127.78 1pwh s VAL 302 Ca 0.44 -1.43 0.19 0.00 0.00 0.00 0.00 61.98 61.18 1pwh s VAL 302 Cb -0.08 -5.00 0.33 0.00 0.00 0.00 0.00 36.38 31.63 1pwh s VAL 302 CO 0.29 -1.81 2.05 0.00 0.00 0.00 0.00 175.10 175.63 1pwh n GLY 304 N -1.58 1.51 0.00 0.00 0.00 -1.26 -2.33 105.19 101.53 1pwh n GLY 304 Ca 0.05 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1pwh n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwh n GLY 305 N 0.00 2.71 0.01 -0.02 0.00 -0.97 -2.44 105.19 104.47 1pwh n GLY 305 Ca 0.00 -1.80 0.08 0.00 0.00 0.00 0.00 46.02 44.31 1pwh n GLY 305 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1pwh n SER 306 N 0.00 1.05 -2.84 1.61 7.64 -1.26 -4.54 113.62 115.28 1pwh n SER 306 Ca 0.00 -0.19 -0.17 0.00 1.01 0.00 0.00 58.87 59.52 1pwh n SER 306 Cb 0.00 1.61 -0.05 0.00 -1.01 0.00 0.00 64.21 64.76 1pwh n SER 306 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1pwh n ASN 307 N -1.94 4.40 -3.45 6.43 3.02 -1.26 -4.77 115.26 117.69 1pwh n ASN 307 Ca -0.02 -2.24 -0.11 0.00 -0.03 0.00 0.00 54.58 52.18 1pwh n ASN 307 Cb 0.40 -1.02 -0.02 0.00 -0.61 0.00 0.00 39.78 38.53 1pwh n ASN 307 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1pwh s ILE 308 N 2.83 0.00 0.04 2.41 1.10 -1.26 -4.62 121.20 121.70 1pwh s ILE 308 Ca 0.40 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.26 1pwh s ILE 308 Cb 0.13 -1.00 0.10 0.00 0.15 0.00 0.00 42.46 41.84 1pwh s ILE 308 CO -0.02 0.00 1.17 -0.94 -2.11 0.00 0.00 174.94 173.03 1pwh s SER 309 N -2.55 -0.10 0.22 4.50 1.04 -1.26 -4.96 113.70 110.59 1pwh s SER 309 Ca 0.01 -0.23 -0.09 0.00 0.48 0.00 0.00 55.95 56.13 1pwh s SER 309 Cb -0.01 0.28 0.19 0.00 0.10 0.00 0.00 66.02 66.58 1pwh s SER 309 CO -0.10 -0.52 1.88 -0.07 0.98 0.00 0.00 173.24 175.41 1pwh h LEU 310 N 2.00 0.97 -0.08 2.42 4.07 -2.02 -0.26 115.31 122.41 1pwh h LEU 310 Ca -0.28 -0.04 -0.01 0.00 0.08 0.00 0.00 57.88 57.63 1pwh h LEU 310 Cb 1.21 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 42.71 1pwh h LEU 310 CO 0.27 0.73 -0.01 0.00 -1.08 0.00 0.00 178.44 178.35 1pwh h ALA 311 N 1.29 0.11 -0.84 1.53 0.00 -2.00 -2.72 119.26 116.62 1pwh h ALA 311 Ca 0.30 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1pwh h ALA 311 Cb -0.10 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1pwh h ALA 311 CO -0.06 -0.20 0.56 1.96 0.00 0.00 0.00 179.25 181.50 1pwh h GLN 312 N -0.16 1.07 -0.88 0.00 4.20 -1.88 -0.48 115.11 116.97 1pwh h GLN 312 Ca 0.02 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1pwh h GLN 312 Cb 0.36 -0.24 -0.04 0.00 0.30 0.00 0.00 27.48 27.86 1pwh h GLN 312 CO 0.01 0.71 0.46 1.25 -0.67 0.00 0.00 178.83 180.58 1pwh h LEU 313 N 1.10 1.12 -0.23 1.46 7.12 -0.94 0.29 115.31 125.23 1pwh h LEU 313 Ca 0.32 -0.11 -0.21 0.00 0.13 0.00 0.00 57.88 58.01 1pwh h LEU 313 Cb -0.06 -0.29 0.01 0.00 -0.53 0.00 0.00 40.66 39.79 1pwh h LEU 313 CO -0.08 0.91 -0.69 1.56 -0.13 0.00 0.00 178.44 180.01 1pwh h GLN 314 N 1.24 0.81 -0.87 1.25 1.08 -1.12 -1.54 115.11 115.97 1pwh h GLN 314 Ca 0.31 -0.60 0.03 0.00 -1.45 0.00 0.00 58.65 56.93 1pwh h GLN 314 Cb 0.06 0.11 -0.05 0.00 -0.05 0.00 0.00 27.48 27.55 1pwh h GLN 314 CO -0.05 1.22 0.57 0.00 -0.95 0.00 0.00 178.83 179.62 1pwh h ALA 315 N 0.63 1.44 -0.27 3.87 0.00 -0.54 0.32 119.26 124.71 1pwh h ALA 315 Ca -0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1pwh h ALA 315 Cb 1.31 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1pwh h ALA 315 CO 0.14 0.49 -0.00 -0.07 0.00 0.00 0.00 179.25 179.81 1pwh h LEU 316 N 1.11 0.47 -0.71 0.00 4.07 -0.28 -1.69 115.31 118.28 1pwh h LEU 316 Ca 0.34 -0.31 -0.08 0.00 0.08 0.00 0.00 57.88 57.90 1pwh h LEU 316 Cb -0.02 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 41.57 1pwh h LEU 316 CO -0.09 0.67 0.07 0.11 -1.08 0.00 0.00 178.44 178.12 1pwh h LYS 317 N 0.26 1.06 -0.44 1.13 1.57 -0.67 -1.94 116.57 117.53 1pwh h LYS 317 Ca 0.08 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.47 1pwh h LYS 317 Cb 0.43 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1pwh h LYS 317 CO 0.01 0.99 -0.06 0.00 -0.57 0.00 0.00 179.45 179.83 1pwh h ALA 318 N 1.08 0.60 0.00 3.86 0.00 -0.91 0.29 119.26 124.17 1pwh h ALA 318 Ca 0.19 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1pwh h ALA 318 Cb 0.47 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1pwh h ALA 318 CO 0.02 0.45 -0.23 0.37 0.00 0.00 0.00 179.25 179.86 1pwh h GLN 319 N 0.65 0.00 -0.46 0.00 4.15 -1.16 -2.56 115.11 115.73 1pwh h GLN 319 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1pwh h GLN 319 Cb 0.58 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.27 1pwh h GLN 319 CO 0.03 0.23 0.00 1.28 -1.93 0.00 0.00 178.83 178.44 1pwh n LEU 320 N -3.99 3.51 -1.27 -2.39 4.77 -0.74 -4.96 117.00 111.92 1pwh n LEU 320 Ca -0.02 -1.65 -0.15 0.00 -0.03 0.00 0.00 56.01 54.17 1pwh n LEU 320 Cb 0.30 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1pwh n LEU 320 CO 0.35 0.79 -0.15 0.61 -1.33 0.00 0.00 177.39 177.66 1pwh n GLY 321 N 1.44 1.07 3.71 -0.72 0.00 -0.60 -4.96 105.19 105.14 1pwh n GLY 321 Ca 0.20 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1pwh n GLY 321 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pwh s LEU 322 N -3.59 4.37 -0.68 0.99 1.43 0.92 -3.33 118.68 118.79 1pwh s LEU 322 Ca 0.00 2.10 -0.01 0.00 -1.03 0.00 0.00 54.13 55.20 1pwh s LEU 322 Cb 0.00 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.64 1pwh s LEU 322 CO 0.00 -0.53 0.57 0.59 0.23 0.00 0.00 176.35 177.21 1pwh n ASN 323 N 3.97 -2.37 -3.50 2.29 3.02 -1.26 -4.66 115.26 112.74 1pwh n ASN 323 Ca 0.10 -0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.31 1pwh n ASN 323 Cb 0.45 -3.06 -0.03 0.00 -0.61 0.00 0.00 39.78 36.53 1pwh n ASN 323 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1pwh s GLU 324 N -4.89 0.55 0.07 3.52 2.02 -1.21 -5.13 118.70 113.63 1pwh s GLU 324 Ca 0.05 1.28 -0.33 0.00 0.02 0.00 0.00 54.97 55.99 1pwh s GLU 324 Cb -0.02 0.76 -0.12 0.00 0.10 0.00 0.00 34.13 34.85 1pwh s GLU 324 CO 0.41 -0.30 1.74 1.28 0.02 0.00 0.00 175.26 178.41 1pwh n LEU 325 N 5.42 3.42 0.00 1.80 4.77 -1.26 -4.93 117.00 126.21 1pwh n LEU 325 Ca -0.09 1.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.91 1pwh n LEU 325 Cb 0.50 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 1pwh n LEU 325 CO -0.02 -0.11 0.06 -0.11 -1.33 0.00 0.00 177.39 175.88 1pwh n LEU 326 N 5.01 0.00 0.00 2.23 0.00 -1.26 -5.18 117.00 117.80 1pwh n LEU 326 Ca 0.19 0.13 0.00 0.00 0.00 0.00 0.00 56.01 56.33 1pwh n LEU 326 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.73 1pwh n LEU 326 CO 0.67 0.00 0.00 0.29 0.00 0.00 0.00 177.39 178.35