#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xlr s HIS 2 N 0.00 -0.19 0.37 0.66 5.04 -1.26 -5.02 115.29 114.89 1xlr s HIS 2 Ca 0.00 0.43 0.11 0.00 -1.54 0.00 0.00 55.06 54.06 1xlr s HIS 2 Cb 0.00 0.45 0.89 0.00 0.04 0.00 0.00 32.58 33.96 1xlr s HIS 2 CO 0.00 -0.11 1.87 -1.35 -2.34 0.00 0.00 174.74 172.81 1xlr h PRO 3 N 3.23 0.59 -0.15 2.88 0.11 -2.06 -1.32 132.00 135.28 1xlr h PRO 3 Ca -0.24 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.72 1xlr h PRO 3 Cb 1.19 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1xlr h PRO 3 CO 0.18 0.39 -0.39 0.00 -0.21 0.00 0.00 178.00 177.97 1xlr h ALA 4 N 1.61 1.05 -0.08 -0.75 0.00 -1.99 -1.51 119.26 117.59 1xlr h ALA 4 Ca 0.45 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 1xlr h ALA 4 Cb 0.83 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1xlr h ALA 4 CO -0.20 0.60 -0.57 -0.07 0.00 0.00 0.00 179.25 179.01 1xlr h LEU 5 N 0.28 0.27 -0.22 0.00 -0.00 -1.66 -0.51 115.31 113.46 1xlr h LEU 5 Ca 0.03 -0.15 -0.01 0.00 -0.00 0.00 0.00 57.88 57.75 1xlr h LEU 5 Cb 0.81 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.39 1xlr h LEU 5 CO 0.06 0.78 0.09 0.74 -0.00 0.00 0.00 178.44 180.11 1xlr h THR 6 N 0.18 1.17 -0.60 0.22 2.02 -1.04 -2.06 112.91 112.79 1xlr h THR 6 Ca -0.00 -0.51 0.02 0.00 0.77 0.00 0.00 66.41 66.69 1xlr h THR 6 Cb 1.06 1.09 -0.03 0.00 -1.74 0.00 0.00 68.15 68.52 1xlr h THR 6 CO 0.09 0.17 0.38 1.56 0.37 0.00 0.00 175.52 178.09 1xlr h GLN 7 N 0.21 0.74 -0.83 6.66 4.20 -1.00 -2.76 115.11 122.33 1xlr h GLN 7 Ca 0.07 -0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.82 1xlr h GLN 7 Cb 0.18 -0.17 -0.07 0.00 0.30 0.00 0.00 27.48 27.73 1xlr h GLN 7 CO -0.01 0.49 0.49 1.25 -0.67 0.00 0.00 178.83 180.39 1xlr h LEU 8 N 0.77 0.74 0.00 1.46 6.46 -0.85 -2.06 115.31 121.82 1xlr h LEU 8 Ca 0.23 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 58.03 1xlr h LEU 8 Cb -0.03 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 39.79 1xlr h LEU 8 CO -0.08 0.45 0.00 0.54 -0.62 0.00 0.00 178.44 178.73 1xlr n ARG 9 N -4.69 0.03 0.00 1.25 1.74 -0.80 -2.65 116.66 111.55 1xlr n ARG 9 Ca 0.13 0.19 0.12 0.00 -0.77 0.00 0.00 57.85 57.52 1xlr n ARG 9 Cb 0.23 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.34 1xlr n ARG 9 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xlr n ALA 10 N -1.47 3.18 -1.75 7.54 0.00 -0.78 -4.98 120.51 122.25 1xlr n ALA 10 Ca 0.05 -0.56 -0.40 0.00 0.00 0.00 0.00 53.44 52.53 1xlr n ALA 10 Cb 0.20 -0.93 0.02 0.00 0.00 0.00 0.00 19.45 18.74 1xlr n ALA 10 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xlr n LEU 11 N 0.01 5.02 -4.28 0.00 4.77 -1.08 -4.84 117.00 116.60 1xlr n LEU 11 Ca 0.12 1.10 -0.33 0.00 -0.03 0.00 0.00 56.01 56.87 1xlr n LEU 11 Cb 0.44 -1.59 -0.16 0.00 -2.33 0.00 0.00 43.42 39.79 1xlr n LEU 11 CO 0.25 -0.28 -0.50 -0.13 -1.33 0.00 0.00 177.39 175.39 1xlr s ARG 12 N -2.47 3.20 0.21 3.23 0.52 -1.00 -4.87 118.95 117.76 1xlr s ARG 12 Ca 0.62 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 55.07 1xlr s ARG 12 Cb -0.45 -2.49 -0.04 0.00 0.52 0.00 0.00 34.95 32.50 1xlr s ARG 12 CO 0.57 0.15 0.37 0.71 0.02 0.00 0.00 175.30 177.11 1xlr s TYR 13 N 0.46 3.48 0.03 -0.53 1.51 -1.26 -1.66 117.35 119.38 1xlr s TYR 13 Ca -0.13 0.18 0.02 0.00 -1.01 0.00 0.00 57.07 56.14 1xlr s TYR 13 Cb -0.17 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 39.92 1xlr s TYR 13 CO 0.05 0.41 0.00 -1.54 -1.11 0.00 0.00 175.55 173.36 1xlr s SER 14 N -3.49 5.08 0.34 2.29 1.04 -1.13 -5.00 113.70 112.83 1xlr s SER 14 Ca 0.36 -0.06 0.11 0.00 0.48 0.00 0.00 55.95 56.84 1xlr s SER 14 Cb -0.10 -1.29 0.59 0.00 0.10 0.00 0.00 66.02 65.32 1xlr s SER 14 CO 0.30 0.25 1.75 0.50 0.98 0.00 0.00 173.24 177.02 1xlr h LYS 15 N 4.07 0.03 -5.73 4.02 3.64 -2.00 -3.41 116.57 117.20 1xlr h LYS 15 Ca -0.48 -0.02 -0.66 0.00 -1.27 0.00 0.00 60.65 58.22 1xlr h LYS 15 Cb 1.17 -0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.86 1xlr h LYS 15 CO 0.58 0.47 -0.57 -2.00 -2.27 0.00 0.00 179.45 175.66 1xlr s GLU 16 N -4.04 3.32 -0.11 1.90 2.12 -1.26 -5.01 118.70 115.62 1xlr s GLU 16 Ca -0.03 -0.32 -0.30 0.00 0.36 0.00 0.00 54.97 54.69 1xlr s GLU 16 Cb 0.14 -2.99 -0.02 0.00 0.26 0.00 0.00 34.13 31.52 1xlr s GLU 16 CO 0.74 0.63 1.23 0.42 -0.54 0.00 0.00 175.26 177.74 1xlr s ILE 17 N -0.66 4.28 0.68 -3.70 1.01 -1.26 -4.91 121.20 116.65 1xlr s ILE 17 Ca 0.11 1.58 -0.16 0.00 0.00 0.00 0.00 60.65 62.18 1xlr s ILE 17 Cb -0.12 -4.02 0.01 0.00 0.01 0.00 0.00 42.46 38.35 1xlr s ILE 17 CO 0.02 -0.07 1.19 -2.16 0.00 0.00 0.00 174.94 173.92 1xlr s PRO 18 N 2.86 2.47 -1.34 2.79 0.04 -1.26 -4.90 135.00 135.66 1xlr s PRO 18 Ca 0.55 1.71 -0.15 0.00 0.04 0.00 0.00 61.00 63.15 1xlr s PRO 18 Cb -0.23 -1.88 0.09 0.00 0.04 0.00 0.00 34.50 32.52 1xlr s PRO 18 CO 0.18 -1.57 1.90 0.00 0.04 0.00 0.00 177.00 177.55 1xlr n ALA 19 N -2.38 4.60 -1.94 8.56 0.00 -1.26 -4.95 120.51 123.14 1xlr n ALA 19 Ca 0.13 -3.98 -0.25 0.00 0.00 0.00 0.00 53.44 49.33 1xlr n ALA 19 Cb 0.50 -3.42 0.07 0.00 0.00 0.00 0.00 19.45 16.61 1xlr n ALA 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xlr s LEU 20 N 2.48 2.86 0.53 0.00 1.43 -1.26 -5.02 118.68 119.70 1xlr s LEU 20 Ca 0.48 0.35 -0.20 0.00 -1.03 0.00 0.00 54.13 53.72 1xlr s LEU 20 Cb 0.08 -2.97 -0.06 0.00 0.03 0.00 0.00 46.19 43.27 1xlr s LEU 20 CO -0.00 -1.63 1.18 1.51 0.23 0.00 0.00 176.35 177.63 1xlr s ASP 21 N -4.54 5.67 0.50 2.29 -4.77 -1.26 -4.80 116.67 109.75 1xlr s ASP 21 Ca 0.61 2.32 0.33 0.00 -3.30 0.00 0.00 52.55 52.51 1xlr s ASP 21 Cb -0.10 -2.60 1.81 0.00 -1.09 0.00 0.00 42.92 40.95 1xlr s ASP 21 CO 0.45 -1.26 2.02 1.55 0.70 0.00 0.00 175.17 178.63 1xlr h PRO 22 N 1.38 0.00 -0.14 2.11 0.13 -1.99 -2.00 132.00 131.49 1xlr h PRO 22 Ca -0.50 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.52 1xlr h PRO 22 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1xlr h PRO 22 CO 0.57 0.00 -0.33 1.96 -0.23 0.00 0.00 178.00 179.97 1xlr h GLN 23 N 0.00 0.47 -0.39 0.86 4.20 -2.01 -1.97 115.11 116.27 1xlr h GLN 23 Ca 0.00 -0.32 -0.12 0.00 0.06 0.00 0.00 58.65 58.27 1xlr h GLN 23 Cb 0.01 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1xlr h GLN 23 CO 0.00 0.93 -0.23 1.25 -0.67 0.00 0.00 178.83 180.11 1xlr h LEU 24 N 0.08 0.80 -1.15 1.46 5.85 -1.84 -3.01 115.31 117.49 1xlr h LEU 24 Ca -0.00 -0.29 -0.08 0.00 0.84 0.00 0.00 57.88 58.35 1xlr h LEU 24 Cb 0.93 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1xlr h LEU 24 CO 0.07 1.00 -0.24 -0.07 -0.34 0.00 0.00 178.44 178.86 1xlr h LEU 25 N 0.68 0.29 -0.52 2.25 3.38 -1.31 -2.11 115.31 117.97 1xlr h LEU 25 Ca 0.09 -0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.05 1xlr h LEU 25 Cb 0.75 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.36 1xlr h LEU 25 CO 0.06 0.54 0.18 0.44 0.09 0.00 0.00 178.44 179.75 1xlr h ASP 26 N 0.26 0.17 0.14 -0.43 3.45 -1.21 -1.26 116.42 117.54 1xlr h ASP 26 Ca 0.04 0.07 -0.01 0.00 0.43 0.00 0.00 57.03 57.56 1xlr h ASP 26 Cb 0.57 0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.40 1xlr h ASP 26 CO 0.04 0.12 -0.07 -0.50 -1.57 0.00 0.00 179.24 177.26 1xlr h TRP 27 N 0.35 -0.18 -0.02 4.55 4.06 -1.50 -2.96 115.95 120.25 1xlr h TRP 27 Ca 0.25 -0.00 -0.09 0.00 2.06 0.00 0.00 58.89 61.11 1xlr h TRP 27 Cb 0.28 0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 28.49 1xlr h TRP 27 CO -0.17 0.12 -0.40 -0.07 -3.56 0.00 0.00 178.44 174.36 1xlr h LEU 28 N -0.47 0.05 -1.22 -4.49 3.38 -1.25 -3.03 115.31 108.27 1xlr h LEU 28 Ca -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1xlr h LEU 28 Cb 0.37 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1xlr h LEU 28 CO 0.03 0.45 -0.01 0.18 0.09 0.00 0.00 178.44 179.18 1xlr n LEU 29 N -4.06 1.91 -4.54 1.67 4.77 -0.49 -4.99 117.00 111.28 1xlr n LEU 29 Ca -0.02 -0.64 -0.55 0.00 -0.03 0.00 0.00 56.01 54.78 1xlr n LEU 29 Cb 0.44 -0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.46 1xlr n LEU 29 CO 0.40 0.32 0.71 -0.11 -1.33 0.00 0.00 177.39 177.38 1xlr n LEU 30 N 0.48 0.81 -2.77 2.23 7.94 -1.12 -4.83 117.00 119.75 1xlr n LEU 30 Ca 0.17 1.14 -0.29 0.00 -1.11 0.00 0.00 56.01 55.93 1xlr n LEU 30 Cb 0.42 -1.06 -0.07 0.00 0.53 0.00 0.00 43.42 43.24 1xlr n LEU 30 CO 0.16 -1.51 2.12 -0.62 -1.11 0.00 0.00 177.39 176.43 1xlr n GLU 31 N 1.96 3.10 -3.71 1.96 1.02 -1.26 -4.81 120.64 118.90 1xlr n GLU 31 Ca 0.19 -2.29 -0.00 0.00 -0.02 0.00 0.00 57.16 55.04 1xlr n GLU 31 Cb 0.15 -2.35 -0.00 0.00 -0.02 0.00 0.00 31.44 29.22 1xlr n GLU 31 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1xlr s ASP 32 N 1.06 -0.08 1.12 1.62 -1.08 -1.26 -4.98 116.67 113.06 1xlr s ASP 32 Ca 0.62 -0.26 -0.18 0.00 -0.52 0.00 0.00 52.55 52.20 1xlr s ASP 32 Cb 0.28 0.28 0.25 0.00 -1.46 0.00 0.00 42.92 42.28 1xlr s ASP 32 CO -0.11 -0.53 1.16 -0.94 0.52 0.00 0.00 175.17 175.27 1xlr s SER 33 N -3.06 1.68 0.00 -0.34 1.04 -1.26 -4.97 113.70 106.79 1xlr s SER 33 Ca 0.15 0.60 0.28 0.00 0.48 0.00 0.00 55.95 57.46 1xlr s SER 33 Cb 0.02 -0.84 1.10 0.00 0.10 0.00 0.00 66.02 66.40 1xlr s SER 33 CO -0.01 -3.65 1.78 0.23 0.98 0.00 0.00 173.24 172.57 1xlr n MET 34 N -4.44 0.86 -0.05 4.02 2.81 -1.26 -4.60 117.12 114.47 1xlr n MET 34 Ca 0.13 -0.38 -0.12 0.00 -1.81 0.00 0.00 57.70 55.52 1xlr n MET 34 Cb 0.59 -1.49 -0.08 0.00 -0.71 0.00 0.00 33.22 31.53 1xlr n MET 34 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1xlr h THR 35 N 0.93 0.00 -0.03 2.03 2.02 -1.94 0.22 112.91 116.15 1xlr h THR 35 Ca 0.00 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.06 1xlr h THR 35 Cb 0.40 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 1xlr h THR 35 CO 0.00 0.00 -0.52 0.11 0.37 0.00 0.00 175.52 175.48 1xlr h LYS 36 N -0.41 0.09 -0.38 6.66 1.79 -1.92 -2.03 116.57 120.37 1xlr h LYS 36 Ca 0.04 -0.05 -0.08 0.00 -2.18 0.00 0.00 60.65 58.38 1xlr h LYS 36 Cb 0.52 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.15 1xlr h LYS 36 CO -0.40 0.59 -0.09 -0.09 -1.08 0.00 0.00 179.45 178.38 1xlr h ARG 37 N 0.07 0.65 -0.03 3.15 1.12 -1.73 0.43 114.38 118.04 1xlr h ARG 37 Ca -0.00 -0.20 -0.23 0.00 -1.11 0.00 0.00 59.98 58.44 1xlr h ARG 37 Cb 0.95 -0.07 0.01 0.00 -0.01 0.00 0.00 29.97 30.85 1xlr h ARG 37 CO 0.07 0.74 -0.92 0.74 -3.11 0.00 0.00 179.97 177.49 1xlr h PHE 38 N 0.60 0.77 -0.70 2.20 0.04 -0.69 -3.10 116.94 116.06 1xlr h PHE 38 Ca 0.11 -0.40 -0.02 0.00 2.80 0.00 0.00 57.97 60.47 1xlr h PHE 38 Cb 0.52 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.54 1xlr h PHE 38 CO 0.02 1.21 0.38 0.93 -0.60 0.00 0.00 178.31 180.25 1xlr h GLU 39 N 0.31 0.98 -0.49 1.51 5.08 -0.96 -2.10 114.58 118.91 1xlr h GLU 39 Ca -0.08 -0.11 0.14 0.00 -1.00 0.00 0.00 59.36 58.31 1xlr h GLU 39 Cb 1.55 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.59 1xlr h GLU 39 CO 0.17 0.72 0.42 0.37 -1.00 0.00 0.00 179.01 179.69 1xlr h GLN 40 N 0.98 0.00 0.00 2.33 4.15 -0.84 0.64 115.11 122.37 1xlr h GLN 40 Ca 0.25 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.67 1xlr h GLN 40 Cb 0.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.73 1xlr h GLN 40 CO -0.04 0.00 0.00 1.04 -1.93 0.00 0.00 178.83 177.90 1xlr n GLN 41 N -4.06 0.51 -1.18 1.69 1.13 -0.79 -4.85 117.38 109.84 1xlr n GLN 41 Ca 0.09 0.04 0.00 0.00 -1.94 0.00 0.00 57.00 55.19 1xlr n GLN 41 Cb 0.62 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.47 1xlr n GLN 41 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1xlr n GLY 42 N 0.34 0.96 3.19 1.08 0.00 0.20 -5.09 105.19 105.86 1xlr n GLY 42 Ca 0.13 -0.32 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1xlr n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xlr s LYS 43 N -2.33 0.89 -0.17 1.61 -0.14 -1.12 -5.03 119.74 113.45 1xlr s LYS 43 Ca 0.00 -1.33 -0.08 0.00 -1.36 0.00 0.00 55.97 53.21 1xlr s LYS 43 Cb 0.00 -0.35 -0.04 0.00 -1.68 0.00 0.00 37.83 35.75 1xlr s LYS 43 CO 0.00 0.02 0.09 0.99 -0.76 0.00 0.00 175.35 175.69 1xlr s THR 44 N -3.34 5.03 -0.08 2.17 2.01 -1.26 -4.31 115.64 115.86 1xlr s THR 44 Ca 0.12 0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.15 1xlr s THR 44 Cb 0.03 -3.25 -0.03 0.00 0.01 0.00 0.00 72.50 69.25 1xlr s THR 44 CO -0.03 0.49 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.69 1xlr s VAL 45 N 0.07 4.20 0.02 3.82 1.01 -1.26 -0.96 120.40 127.29 1xlr s VAL 45 Ca 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1xlr s VAL 45 Cb -0.12 -2.76 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 1xlr s VAL 45 CO 0.00 0.60 -0.03 -0.94 0.00 0.00 0.00 175.10 174.73 1xlr s SER 46 N -0.85 0.25 -0.15 3.32 1.04 -0.58 -5.00 113.70 111.73 1xlr s SER 46 Ca 0.13 -0.51 -0.06 0.00 0.48 0.00 0.00 55.95 55.99 1xlr s SER 46 Cb -0.11 0.10 -0.04 0.00 0.10 0.00 0.00 66.02 66.07 1xlr s SER 46 CO 0.02 -0.30 0.08 -0.69 0.98 0.00 0.00 173.24 173.32 1xlr s VAL 47 N -1.49 4.93 -0.21 5.02 1.01 -1.26 -0.83 120.40 127.57 1xlr s VAL 47 Ca -0.16 0.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 1xlr s VAL 47 Cb -0.10 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 1xlr s VAL 47 CO -0.01 0.53 0.03 -0.89 0.00 0.00 0.00 175.10 174.76 1xlr s THR 48 N -0.26 4.19 -0.09 3.92 2.01 0.38 -4.91 115.64 120.88 1xlr s THR 48 Ca 0.09 -0.23 -0.30 0.00 0.31 0.00 0.00 61.69 61.56 1xlr s THR 48 Cb -0.12 -2.91 -0.02 0.00 0.01 0.00 0.00 72.50 69.46 1xlr s THR 48 CO 0.01 0.41 1.06 -0.32 -0.69 0.00 0.00 174.62 175.09 1xlr s MET 49 N 1.08 4.41 -0.25 4.92 1.75 -1.26 -1.20 119.30 128.74 1xlr s MET 49 Ca 0.03 1.46 -0.10 0.00 -1.25 0.00 0.00 55.69 55.83 1xlr s MET 49 Cb -0.14 -3.54 -0.16 0.00 2.84 0.00 0.00 34.83 33.82 1xlr s MET 49 CO 0.02 -0.35 -0.16 -0.89 -0.65 0.00 0.00 175.02 173.00 1xlr n ILE 50 N 4.56 1.55 -3.64 10.11 2.08 0.75 -4.95 119.36 129.82 1xlr n ILE 50 Ca 0.09 -0.41 -0.12 0.00 0.56 0.00 0.00 62.75 62.87 1xlr n ILE 50 Cb 0.48 -1.76 -0.07 0.00 -0.75 0.00 0.00 39.64 37.54 1xlr n ILE 50 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 1xlr s ARG 51 N -2.49 0.79 -0.09 0.38 3.52 -0.93 -4.51 118.95 115.62 1xlr s ARG 51 Ca -0.35 1.06 -0.08 0.00 -0.13 0.00 0.00 55.73 56.23 1xlr s ARG 51 Cb 0.11 0.33 0.03 0.00 -1.56 0.00 0.00 34.95 33.85 1xlr s ARG 51 CO 0.57 -0.11 0.24 -2.00 -0.81 0.00 0.00 175.30 173.18 1xlr s GLU 52 N 0.75 0.27 0.00 5.12 2.12 -1.26 -0.82 118.70 124.89 1xlr s GLU 52 Ca -0.03 0.36 0.00 0.00 0.36 0.00 0.00 54.97 55.66 1xlr s GLU 52 Cb -0.05 0.11 0.00 0.00 0.26 0.00 0.00 34.13 34.45 1xlr s GLU 52 CO -0.05 -0.05 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 1xlr n GLY 53 N 3.10 0.31 3.78 -1.50 0.00 -0.89 -5.00 105.19 104.99 1xlr n GLY 53 Ca -0.14 -1.48 -0.39 0.00 0.00 0.00 0.00 46.02 44.01 1xlr n GLY 53 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xlr s PHE 54 N -1.74 3.85 0.07 1.61 0.40 -1.26 -0.89 117.98 120.02 1xlr s PHE 54 Ca 0.00 1.61 -0.01 0.00 -0.60 0.00 0.00 56.93 57.93 1xlr s PHE 54 Cb 0.00 -2.76 -0.04 0.00 0.51 0.00 0.00 43.02 40.73 1xlr s PHE 54 CO 0.00 0.46 -0.02 0.14 0.70 0.00 0.00 175.22 176.50 1xlr s VAL 55 N -1.25 0.22 0.48 -0.44 -7.23 0.80 -4.93 120.40 108.05 1xlr s VAL 55 Ca 0.38 -1.83 0.03 0.00 -1.81 0.00 0.00 61.98 58.74 1xlr s VAL 55 Cb -0.22 -1.63 0.01 0.00 0.56 0.00 0.00 36.38 35.11 1xlr s VAL 55 CO 0.25 -0.89 0.68 -1.61 -0.31 0.00 0.00 175.10 173.22 1xlr s GLU 56 N -3.94 2.80 0.35 4.82 2.02 -1.26 -0.38 118.70 123.11 1xlr s GLU 56 Ca 0.10 -0.80 0.15 0.00 0.02 0.00 0.00 54.97 54.44 1xlr s GLU 56 Cb 0.08 -2.59 1.08 0.00 0.10 0.00 0.00 34.13 32.80 1xlr s GLU 56 CO -0.08 -0.43 1.68 1.96 0.02 0.00 0.00 175.26 178.41 1xlr h GLN 57 N 0.35 0.34 0.00 1.61 4.20 -1.84 -1.16 115.11 118.61 1xlr h GLN 57 Ca -0.43 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.25 1xlr h GLN 57 Cb 1.28 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.98 1xlr h GLN 57 CO 0.52 0.23 -0.01 -0.91 -0.67 0.00 0.00 178.83 177.99 1xlr h ASN 58 N 0.35 0.00 0.19 1.46 -0.26 -1.98 -1.21 115.58 114.12 1xlr h ASN 58 Ca 0.72 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.46 1xlr h ASN 58 Cb 1.66 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.92 1xlr h ASN 58 CO -0.56 0.01 -0.09 -0.62 -1.06 0.00 0.00 177.43 175.11 1xlr n GLU 59 N -3.30 1.02 -2.56 0.81 1.02 -0.44 -4.26 120.64 112.94 1xlr n GLU 59 Ca -0.03 -0.44 -0.16 0.00 -0.02 0.00 0.00 57.16 56.51 1xlr n GLU 59 Cb 0.10 -1.49 0.02 0.00 -0.02 0.00 0.00 31.44 30.05 1xlr n GLU 59 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1xlr n ILE 60 N -0.61 1.67 -0.24 -3.67 -5.35 -0.46 -4.93 119.36 105.77 1xlr n ILE 60 Ca 0.17 -3.87 0.13 0.00 -0.27 0.00 0.00 62.75 58.91 1xlr n ILE 60 Cb 0.29 -0.17 0.41 0.00 -1.74 0.00 0.00 39.64 38.43 1xlr n ILE 60 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1xlr h PRO 61 N 2.74 0.60 -0.08 6.28 0.13 -1.74 -0.68 132.00 139.25 1xlr h PRO 61 Ca 0.09 -0.04 -0.18 0.00 -0.87 0.00 0.00 66.00 65.00 1xlr h PRO 61 Cb 1.11 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 1xlr h PRO 61 CO 0.63 0.39 -0.73 0.93 -0.23 0.00 0.00 178.00 179.00 1xlr h GLU 62 N 0.61 0.40 0.03 0.86 3.07 -1.94 -3.36 114.58 114.25 1xlr h GLU 62 Ca 0.43 -0.32 -0.29 0.00 -0.50 0.00 0.00 59.36 58.67 1xlr h GLU 62 Cb 0.77 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.71 1xlr h GLU 62 CO -0.18 0.96 -1.62 0.93 -1.40 0.00 0.00 179.01 177.70 1xlr h GLU 63 N 0.27 0.06 -1.00 2.33 3.07 -1.82 -3.41 114.58 114.08 1xlr h GLU 63 Ca -0.03 -0.11 0.21 0.00 -0.50 0.00 0.00 59.36 58.93 1xlr h GLU 63 Cb 1.30 0.04 -0.19 0.00 -0.84 0.00 0.00 28.75 29.06 1xlr h GLU 63 CO 0.12 0.73 -0.20 1.25 -1.40 0.00 0.00 179.01 179.51 1xlr h LEU 64 N 0.02 -0.85 -2.26 1.33 5.85 -1.29 0.33 115.31 118.44 1xlr h LEU 64 Ca -0.26 0.30 0.04 0.00 0.84 0.00 0.00 57.88 58.80 1xlr h LEU 64 Cb 1.98 0.60 -0.01 0.00 0.37 0.00 0.00 40.66 43.60 1xlr h LEU 64 CO 0.10 -0.34 0.23 -0.65 -0.34 0.00 0.00 178.44 177.44 1xlr h PRO 65 N 0.00 0.00 -0.03 5.25 0.11 -1.81 -1.74 132.00 133.78 1xlr h PRO 65 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 1xlr h PRO 65 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1xlr h PRO 65 CO -1.01 0.00 -0.02 1.28 -0.21 0.00 0.00 178.00 178.04 1xlr n LEU 66 N -3.52 2.93 -4.34 2.35 4.77 0.10 -4.99 117.00 114.29 1xlr n LEU 66 Ca 0.01 -0.98 -0.17 0.00 -0.03 0.00 0.00 56.01 54.84 1xlr n LEU 66 Cb 0.34 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.32 1xlr n LEU 66 CO 0.24 0.49 -0.34 -0.76 -1.33 0.00 0.00 177.39 175.69 1xlr s LEU 67 N -2.02 2.25 0.63 2.23 1.43 -0.66 -5.03 118.68 117.51 1xlr s LEU 67 Ca 0.28 -1.20 -0.19 0.00 -1.03 0.00 0.00 54.13 51.99 1xlr s LEU 67 Cb 0.20 -0.32 -0.02 0.00 0.03 0.00 0.00 46.19 46.08 1xlr s LEU 67 CO 0.31 -0.48 1.29 -2.16 0.23 0.00 0.00 176.35 175.54 1xlr s PRO 68 N -3.84 2.68 -0.24 1.29 0.04 -1.26 -4.92 135.00 128.75 1xlr s PRO 68 Ca 0.28 2.05 -0.21 0.00 0.04 0.00 0.00 61.00 63.16 1xlr s PRO 68 Cb 0.05 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.67 1xlr s PRO 68 CO 0.09 -1.50 0.64 0.15 0.04 0.00 0.00 177.00 176.42 1xlr s LYS 69 N -3.32 4.15 0.26 4.56 -0.14 -1.26 -5.00 119.74 118.99 1xlr s LYS 69 Ca 0.81 0.59 0.02 0.00 -1.36 0.00 0.00 55.97 56.02 1xlr s LYS 69 Cb -0.37 -3.63 -0.04 0.00 -1.68 0.00 0.00 37.83 32.12 1xlr s LYS 69 CO 0.40 -0.36 0.17 -1.21 -0.76 0.00 0.00 175.35 173.59 1xlr s GLU 70 N 2.32 1.44 0.37 1.68 2.02 -1.26 -5.06 118.70 120.21 1xlr s GLU 70 Ca 0.27 -1.79 0.20 0.00 0.02 0.00 0.00 54.97 53.66 1xlr s GLU 70 Cb -0.16 0.17 0.50 0.00 0.10 0.00 0.00 34.13 34.75 1xlr s GLU 70 CO 0.09 -0.46 1.64 0.77 0.02 0.00 0.00 175.26 177.32 1xlr h SER 71 N 2.40 0.00 -5.05 -0.19 0.02 -1.96 -3.43 113.55 105.34 1xlr h SER 71 Ca -0.33 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.54 1xlr h SER 71 Cb 1.25 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.62 1xlr h SER 71 CO 0.49 0.34 -0.14 -0.60 -1.14 0.00 0.00 176.83 175.78 1xlr s ARG 72 N -3.33 0.91 0.02 3.45 3.52 -1.26 -4.51 118.95 117.75 1xlr s ARG 72 Ca 0.02 -0.45 -0.01 0.00 -0.13 0.00 0.00 55.73 55.17 1xlr s ARG 72 Cb 0.09 0.40 -0.02 0.00 -1.56 0.00 0.00 34.95 33.86 1xlr s ARG 72 CO 0.69 -0.31 -0.01 0.71 -0.81 0.00 0.00 175.30 175.56 1xlr s TYR 73 N -2.67 0.28 -0.17 5.12 1.51 0.49 -2.44 117.35 119.47 1xlr s TYR 73 Ca -0.04 -0.58 -0.14 0.00 -1.01 0.00 0.00 57.07 55.29 1xlr s TYR 73 Cb -0.00 -0.21 -0.04 0.00 -0.11 0.00 0.00 41.96 41.59 1xlr s TYR 73 CO -0.04 -0.23 0.33 -0.46 -1.11 0.00 0.00 175.55 174.04 1xlr s TRP 74 N -1.85 3.43 -0.12 2.71 -0.11 0.79 -0.14 118.94 123.65 1xlr s TRP 74 Ca -0.12 0.60 -0.01 0.00 1.22 0.00 0.00 56.10 57.79 1xlr s TRP 74 Cb -0.07 -2.40 -0.02 0.00 -1.50 0.00 0.00 33.47 29.48 1xlr s TRP 74 CO -0.02 0.16 -0.08 -1.17 -4.62 0.00 0.00 176.95 171.21 1xlr s LEU 75 N 0.73 3.01 -0.11 5.86 2.96 -0.06 -0.63 118.68 130.44 1xlr s LEU 75 Ca 0.17 -0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 53.88 1xlr s LEU 75 Cb -0.14 -1.69 0.04 0.00 0.50 0.00 0.00 46.19 44.91 1xlr s LEU 75 CO 0.05 0.22 0.03 -0.60 -1.32 0.00 0.00 176.35 174.73 1xlr s ARG 76 N 0.05 0.43 -0.11 1.98 3.52 -0.41 -2.10 118.95 122.31 1xlr s ARG 76 Ca -0.02 -0.01 0.02 0.00 -0.13 0.00 0.00 55.73 55.59 1xlr s ARG 76 Cb -0.14 -1.32 0.01 0.00 -1.56 0.00 0.00 34.95 31.94 1xlr s ARG 76 CO 0.03 -0.45 -0.18 -1.21 -0.81 0.00 0.00 175.30 172.68 1xlr s GLU 77 N 2.00 2.53 0.23 5.12 2.02 0.00 -0.81 118.70 129.79 1xlr s GLU 77 Ca 0.03 -0.68 0.01 0.00 0.02 0.00 0.00 54.97 54.35 1xlr s GLU 77 Cb -0.14 -2.07 -0.05 0.00 0.10 0.00 0.00 34.13 31.98 1xlr s GLU 77 CO -0.06 -0.01 0.09 0.96 0.02 0.00 0.00 175.26 176.26 1xlr s ILE 78 N 0.81 0.49 -0.07 -1.63 -4.36 -0.62 -0.18 121.20 115.64 1xlr s ILE 78 Ca -0.09 -1.99 0.04 0.00 -0.26 0.00 0.00 60.65 58.35 1xlr s ILE 78 Cb -0.16 -2.52 -0.00 0.00 1.25 0.00 0.00 42.46 41.03 1xlr s ILE 78 CO 0.00 -0.09 -0.21 -0.22 0.24 0.00 0.00 174.94 174.66 1xlr s LEU 79 N -3.26 1.99 -0.20 0.37 0.20 -0.34 -1.59 118.68 115.84 1xlr s LEU 79 Ca 0.35 -0.47 -0.04 0.00 0.69 0.00 0.00 54.13 54.66 1xlr s LEU 79 Cb 0.07 -1.23 -0.02 0.00 -0.43 0.00 0.00 46.19 44.58 1xlr s LEU 79 CO 0.12 0.17 -0.02 -0.22 -0.29 0.00 0.00 176.35 176.10 1xlr s LEU 80 N 0.16 3.12 0.07 -0.68 2.96 0.11 -0.47 118.68 123.96 1xlr s LEU 80 Ca -0.10 -0.26 0.05 0.00 -0.22 0.00 0.00 54.13 53.60 1xlr s LEU 80 Cb -0.15 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 1xlr s LEU 80 CO 0.05 0.05 -0.03 -0.44 -1.32 0.00 0.00 176.35 174.67 1xlr s SER 81 N 1.05 4.85 -0.23 3.68 0.01 -0.01 -1.19 113.70 121.87 1xlr s SER 81 Ca 0.01 -0.20 -0.02 0.00 1.31 0.00 0.00 55.95 57.05 1xlr s SER 81 Cb -0.14 -1.12 0.01 0.00 0.21 0.00 0.00 66.02 64.97 1xlr s SER 81 CO 0.01 0.20 -0.07 0.00 0.41 0.00 0.00 173.24 173.79 1xlr s ALA 82 N -1.23 2.71 -1.52 1.44 0.00 0.16 -1.52 121.76 121.79 1xlr s ALA 82 Ca 0.23 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 50.87 1xlr s ALA 82 Cb -0.11 -1.64 0.03 0.00 0.00 0.00 0.00 23.12 21.40 1xlr s ALA 82 CO 0.15 -0.57 0.29 -0.25 0.00 0.00 0.00 175.76 175.38 1xlr n ASP 83 N 4.73 -0.17 0.00 0.00 8.00 -0.14 -0.96 116.55 128.01 1xlr n ASP 83 Ca -0.18 -1.13 0.00 0.00 0.71 0.00 0.00 54.79 54.19 1xlr n ASP 83 Cb 0.49 -2.34 0.00 0.00 -0.02 0.00 0.00 41.12 39.25 1xlr n ASP 83 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xlr n GLY 84 N -2.12 2.62 3.54 0.44 0.00 -1.26 -5.02 105.19 103.39 1xlr n GLY 84 Ca -0.26 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 1xlr n GLY 84 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xlr s GLU 85 N -0.07 3.65 0.14 1.61 2.12 -0.14 -5.00 118.70 121.02 1xlr s GLU 85 Ca 0.00 -0.53 -0.32 0.00 0.36 0.00 0.00 54.97 54.48 1xlr s GLU 85 Cb 0.00 -3.72 -0.12 0.00 0.26 0.00 0.00 34.13 30.55 1xlr s GLU 85 CO 0.00 -0.34 1.76 -2.30 -0.54 0.00 0.00 175.26 173.84 1xlr n PRO 86 N 5.08 2.62 -0.01 4.30 -0.02 -1.26 -0.67 135.00 145.03 1xlr n PRO 86 Ca -0.13 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1xlr n PRO 86 Cb 0.51 -2.80 -0.04 0.00 -0.02 0.00 0.00 33.50 31.14 1xlr n PRO 86 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1xlr n TRP 87 N 4.82 0.00 -3.69 6.00 7.02 -0.34 -4.62 117.44 126.64 1xlr n TRP 87 Ca 0.18 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.51 1xlr n TRP 87 Cb 0.34 -0.19 -0.08 0.00 -2.42 0.00 0.00 31.31 28.97 1xlr n TRP 87 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 1xlr s LEU 88 N -3.86 0.40 0.02 -0.99 0.20 -1.12 -1.00 118.68 112.34 1xlr s LEU 88 Ca -0.02 0.31 0.08 0.00 0.69 0.00 0.00 54.13 55.18 1xlr s LEU 88 Cb 0.03 1.63 -0.02 0.00 -0.43 0.00 0.00 46.19 47.39 1xlr s LEU 88 CO 0.22 -0.48 -0.23 0.00 -0.29 0.00 0.00 176.35 175.57 1xlr s ALA 89 N -1.20 1.95 0.01 5.97 0.00 -0.54 0.09 121.76 128.04 1xlr s ALA 89 Ca -0.12 -1.08 -0.02 0.00 0.00 0.00 0.00 51.96 50.73 1xlr s ALA 89 Cb -0.04 -0.44 -0.01 0.00 0.00 0.00 0.00 23.12 22.64 1xlr s ALA 89 CO 0.06 0.46 0.03 0.00 0.00 0.00 0.00 175.76 176.30 1xlr s ALA 90 N -0.69 -0.04 -0.07 0.00 0.00 -0.62 -0.98 121.76 119.36 1xlr s ALA 90 Ca 0.09 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.74 1xlr s ALA 90 Cb -0.09 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.14 1xlr s ALA 90 CO 0.01 -0.14 -0.05 0.50 0.00 0.00 0.00 175.76 176.09 1xlr s ARG 91 N -1.07 1.03 -0.05 0.00 3.52 0.15 -1.59 118.95 120.93 1xlr s ARG 91 Ca -0.12 -0.11 0.06 0.00 -0.13 0.00 0.00 55.73 55.44 1xlr s ARG 91 Cb -0.07 -1.13 -0.01 0.00 -1.56 0.00 0.00 34.95 32.18 1xlr s ARG 91 CO -0.00 -0.19 -0.23 0.99 -0.81 0.00 0.00 175.30 175.06 1xlr s THR 92 N 1.43 1.92 -0.13 4.11 2.01 0.01 -0.57 115.64 124.42 1xlr s THR 92 Ca -0.02 -1.00 -0.00 0.00 0.31 0.00 0.00 61.69 60.98 1xlr s THR 92 Cb -0.13 -1.62 0.02 0.00 0.01 0.00 0.00 72.50 70.78 1xlr s THR 92 CO -0.03 0.54 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.63 1xlr s VAL 93 N -0.18 1.31 -0.18 3.82 1.01 -0.16 -1.29 120.40 124.73 1xlr s VAL 93 Ca -0.02 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1xlr s VAL 93 Cb -0.13 -1.26 0.01 0.00 0.00 0.00 0.00 36.38 35.00 1xlr s VAL 93 CO 0.03 0.41 -0.17 -0.69 0.00 0.00 0.00 175.10 174.68 1xlr s VAL 94 N 1.59 2.33 0.43 2.92 1.01 0.20 -1.37 120.40 127.50 1xlr s VAL 94 Ca 0.05 -0.85 -0.26 0.00 0.00 0.00 0.00 61.98 60.92 1xlr s VAL 94 Cb -0.13 -1.99 -0.09 0.00 0.00 0.00 0.00 36.38 34.17 1xlr s VAL 94 CO -0.09 0.52 1.39 -2.84 0.00 0.00 0.00 175.10 174.07 1xlr s PRO 95 N 1.27 3.83 0.57 2.72 0.02 -1.26 -0.15 135.00 142.01 1xlr s PRO 95 Ca 0.04 2.34 0.33 0.00 0.02 0.00 0.00 61.00 63.73 1xlr s PRO 95 Cb -0.13 -2.73 1.70 0.00 0.02 0.00 0.00 34.50 33.36 1xlr s PRO 95 CO -0.10 -0.67 2.14 -0.39 -0.33 0.00 0.00 177.00 177.65 1xlr h VAL 96 N 2.44 0.29 0.00 3.83 -1.51 -1.84 -1.15 116.25 118.31 1xlr h VAL 96 Ca -0.50 -0.38 -0.02 0.00 -1.23 0.00 0.00 66.70 64.57 1xlr h VAL 96 Cb 1.26 1.28 -0.00 0.00 -2.13 0.00 0.00 31.29 31.70 1xlr h VAL 96 CO 0.62 0.06 -0.10 0.77 -1.23 0.00 0.00 177.57 177.69 1xlr h SER 97 N 0.00 0.00 0.82 4.19 4.64 -1.90 -1.33 113.55 119.97 1xlr h SER 97 Ca -0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1xlr h SER 97 Cb 0.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1xlr h SER 97 CO 0.01 0.10 -0.32 0.74 -0.87 0.00 0.00 176.83 176.49 1xlr h THR 98 N 0.00 0.79 0.00 2.95 2.02 -1.50 -3.38 112.91 113.78 1xlr h THR 98 Ca -0.00 -1.34 -0.69 0.00 0.77 0.00 0.00 66.41 65.15 1xlr h THR 98 Cb 0.30 1.84 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 1xlr h THR 98 CO 0.01 0.31 2.90 0.18 0.37 0.00 0.00 175.52 179.29 1xlr n LEU 99 N -3.52 6.06 -3.88 2.58 4.77 -0.50 -4.64 117.00 117.86 1xlr n LEU 99 Ca -0.00 -3.77 -0.10 0.00 -0.03 0.00 0.00 56.01 52.11 1xlr n LEU 99 Cb 0.47 -1.50 -0.08 0.00 -2.33 0.00 0.00 43.42 39.98 1xlr n LEU 99 CO 0.35 0.68 -0.14 -0.94 -1.33 0.00 0.00 177.39 176.02 1xlr s SER 100 N 3.72 0.11 0.92 -1.43 1.04 -1.26 -4.54 113.70 112.26 1xlr s SER 100 Ca 0.50 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1xlr s SER 100 Cb 0.14 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1xlr s SER 100 CO -0.03 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.21 1xlr n GLY 101 N 0.47 0.91 0.39 7.32 0.00 -1.26 -2.46 105.19 110.56 1xlr n GLY 101 Ca -0.18 -0.65 0.18 0.00 0.00 0.00 0.00 46.02 45.37 1xlr n GLY 101 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xlr h PRO 102 N 0.00 0.24 0.00 1.61 0.11 -1.98 -2.11 132.00 129.88 1xlr h PRO 102 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1xlr h PRO 102 Cb 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.06 1xlr h PRO 102 CO 0.00 0.16 0.00 0.39 -0.21 0.00 0.00 178.00 178.34 1xlr n GLU 103 N -4.43 0.17 0.16 1.05 4.71 -1.03 -2.02 120.64 119.24 1xlr n GLU 103 Ca 0.13 0.53 0.17 0.00 -0.01 0.00 0.00 57.16 57.99 1xlr n GLU 103 Cb 0.59 -1.91 0.78 0.00 -1.01 0.00 0.00 31.44 29.89 1xlr n GLU 103 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1xlr h LEU 104 N 0.00 0.00 -2.42 -4.62 5.85 -1.44 -1.41 115.31 111.27 1xlr h LEU 104 Ca 0.00 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1xlr h LEU 104 Cb 0.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 1xlr h LEU 104 CO 0.00 0.00 0.09 0.00 -0.34 0.00 0.00 178.44 178.19 1xlr h ALA 105 N 1.75 1.57 -0.13 1.25 0.00 -1.65 -0.91 119.26 121.13 1xlr h ALA 105 Ca 0.12 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1xlr h ALA 105 Cb 0.62 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1xlr h ALA 105 CO -0.00 -0.12 0.21 -0.07 0.00 0.00 0.00 179.25 179.27 1xlr h LEU 106 N 0.00 0.00 -0.06 0.00 3.38 -1.50 -1.04 115.31 116.09 1xlr h LEU 106 Ca 0.03 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.82 1xlr h LEU 106 Cb 0.20 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1xlr h LEU 106 CO -0.00 0.00 -0.87 -0.61 0.09 0.00 0.00 178.44 177.05 1xlr h GLN 107 N 0.00 0.00 -0.43 1.13 4.15 -1.37 -3.31 115.11 115.28 1xlr h GLN 107 Ca 0.06 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.41 1xlr h GLN 107 Cb 0.48 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.13 1xlr h GLN 107 CO -0.00 0.87 0.06 1.63 -1.93 0.00 0.00 178.83 179.45 1xlr n LYS 108 N -3.35 3.27 -0.02 1.69 5.02 -0.41 -4.68 118.16 119.68 1xlr n LYS 108 Ca 0.00 -3.00 -0.03 0.00 -2.02 0.00 0.00 58.31 53.26 1xlr n LYS 108 Cb 0.87 -2.00 0.20 0.00 -0.02 0.00 0.00 35.03 34.09 1xlr n LYS 108 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1xlr h LEU 109 N 2.23 0.56 0.00 -0.35 3.38 -1.60 -3.48 115.31 116.05 1xlr h LEU 109 Ca 0.09 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1xlr h LEU 109 Cb 1.77 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.37 1xlr h LEU 109 CO 0.41 0.74 0.00 0.61 0.09 0.00 0.00 178.44 180.29 1xlr n GLY 110 N -0.48 3.07 0.41 0.83 0.00 -1.26 -2.33 105.19 105.42 1xlr n GLY 110 Ca 0.00 -0.32 0.02 0.00 0.00 0.00 0.00 46.02 45.72 1xlr n GLY 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xlr n LYS 111 N 14.00 1.41 -3.02 1.61 5.02 -1.26 -4.78 118.16 131.14 1xlr n LYS 111 Ca 0.00 -0.47 -0.40 0.00 -2.02 0.00 0.00 58.31 55.42 1xlr n LYS 111 Cb 0.00 -1.29 -0.05 0.00 -0.02 0.00 0.00 35.03 33.67 1xlr n LYS 111 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1xlr s THR 112 N -1.64 5.01 0.28 -0.18 2.01 -0.98 -4.25 115.64 115.89 1xlr s THR 112 Ca 0.08 1.50 -0.29 0.00 0.31 0.00 0.00 61.69 63.30 1xlr s THR 112 Cb 0.05 -4.06 -0.09 0.00 0.01 0.00 0.00 72.50 68.41 1xlr s THR 112 CO 0.04 0.26 0.98 -2.16 -0.69 0.00 0.00 174.62 173.05 1xlr s PRO 113 N 0.74 4.70 0.47 4.92 0.04 -1.26 -4.97 135.00 139.63 1xlr s PRO 113 Ca 0.39 1.52 -0.24 0.00 0.04 0.00 0.00 61.00 62.71 1xlr s PRO 113 Cb -0.18 -3.10 -0.07 0.00 0.04 0.00 0.00 34.50 31.19 1xlr s PRO 113 CO 0.19 0.35 1.35 -1.17 0.04 0.00 0.00 177.00 177.76 1xlr s LEU 114 N -1.54 4.05 -0.20 -3.56 2.96 -1.26 -5.00 118.68 114.13 1xlr s LEU 114 Ca 0.45 2.74 -0.35 0.00 -0.22 0.00 0.00 54.13 56.75 1xlr s LEU 114 Cb -0.25 -4.06 0.14 0.00 0.50 0.00 0.00 46.19 42.52 1xlr s LEU 114 CO 0.32 -1.18 1.24 -0.83 -1.32 0.00 0.00 176.35 174.57 1xlr s GLY 115 N -0.79 -0.29 0.57 7.98 0.00 -1.26 -4.54 107.32 109.00 1xlr s GLY 115 Ca 0.63 1.61 0.26 0.00 0.00 0.00 0.00 44.72 47.23 1xlr s GLY 115 CO 0.50 0.53 2.15 3.21 0.00 0.00 0.00 173.10 179.48 1xlr h ARG 116 N 2.00 0.00 -0.10 2.90 3.08 -1.93 -1.26 114.38 119.07 1xlr h ARG 116 Ca -0.09 0.00 0.03 0.00 0.07 0.00 0.00 59.98 59.99 1xlr h ARG 116 Cb 1.16 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.21 1xlr h ARG 116 CO 0.22 0.00 0.13 0.10 -1.07 0.00 0.00 179.97 179.35 1xlr h TYR 117 N 0.00 0.00 0.00 3.04 -0.00 -1.98 -2.05 116.97 115.98 1xlr h TYR 117 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.79 1xlr h TYR 117 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.04 1xlr h TYR 117 CO 0.00 0.00 -0.21 -0.07 -0.00 0.00 0.00 178.16 177.88 1xlr h LEU 118 N 0.00 0.00 -3.20 0.10 3.38 -1.61 -3.37 115.31 110.61 1xlr h LEU 118 Ca 0.05 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 1xlr h LEU 118 Cb 0.30 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.96 1xlr h LEU 118 CO -0.00 0.03 -0.45 0.49 0.09 0.00 0.00 178.44 178.60 1xlr n PHE 119 N -2.25 0.69 -0.16 1.13 0.99 -0.77 -4.78 117.46 112.31 1xlr n PHE 119 Ca 0.05 -1.66 0.29 0.00 -0.00 0.00 0.00 57.45 56.13 1xlr n PHE 119 Cb 0.44 -0.33 0.70 0.00 -1.00 0.00 0.00 39.48 39.29 1xlr n PHE 119 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 1xlr h THR 120 N 1.19 0.35 0.11 4.37 2.02 -1.73 -1.15 112.91 118.05 1xlr h THR 120 Ca 0.11 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 1xlr h THR 120 Cb 1.21 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1xlr h THR 120 CO 0.22 0.00 -0.05 0.28 0.37 0.00 0.00 175.52 176.33 1xlr h SER 121 N 0.00 -0.12 -4.39 4.18 0.02 -1.94 -3.46 113.55 107.84 1xlr h SER 121 Ca 0.42 -0.33 -0.50 0.00 -0.84 0.00 0.00 61.79 60.54 1xlr h SER 121 Cb 1.94 0.03 0.08 0.00 0.14 0.00 0.00 62.40 64.59 1xlr h SER 121 CO -0.00 0.28 0.39 -0.55 -1.14 0.00 0.00 176.83 175.81 1xlr s SER 122 N -5.43 5.45 -0.09 3.07 0.15 -0.44 -5.05 113.70 111.35 1xlr s SER 122 Ca -0.15 1.32 -0.16 0.00 0.70 0.00 0.00 55.95 57.66 1xlr s SER 122 Cb 0.02 -2.18 -0.05 0.00 -1.71 0.00 0.00 66.02 62.10 1xlr s SER 122 CO 0.62 -1.36 0.41 0.28 1.20 0.00 0.00 173.24 174.38 1xlr s THR 123 N -3.22 5.17 -0.07 6.45 -1.32 -1.26 -4.88 115.64 116.50 1xlr s THR 123 Ca 0.58 0.82 0.05 0.00 -1.21 0.00 0.00 61.69 61.93 1xlr s THR 123 Cb -0.12 -3.74 -0.01 0.00 -1.51 0.00 0.00 72.50 67.12 1xlr s THR 123 CO 0.53 0.42 -0.24 -0.22 -2.21 0.00 0.00 174.62 172.91 1xlr s LEU 124 N 0.04 2.13 0.08 9.08 2.96 -1.26 -0.14 118.68 131.57 1xlr s LEU 124 Ca 0.23 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.56 1xlr s LEU 124 Cb -0.15 -1.40 -0.01 0.00 0.50 0.00 0.00 46.19 45.13 1xlr s LEU 124 CO 0.10 0.22 0.15 0.42 -1.32 0.00 0.00 176.35 175.92 1xlr s THR 125 N -0.01 0.16 -0.12 3.68 -4.23 -0.70 -4.99 115.64 109.42 1xlr s THR 125 Ca -0.08 -1.28 0.02 0.00 -1.18 0.00 0.00 61.69 59.17 1xlr s THR 125 Cb -0.15 -1.35 0.02 0.00 1.34 0.00 0.00 72.50 72.35 1xlr s THR 125 CO 0.05 -0.70 -0.15 -0.60 -0.54 0.00 0.00 174.62 172.67 1xlr s ARG 126 N -3.82 2.28 0.00 3.99 3.52 -1.26 -0.68 118.95 122.98 1xlr s ARG 126 Ca 0.05 -0.58 0.19 0.00 -0.13 0.00 0.00 55.73 55.26 1xlr s ARG 126 Cb 0.05 -1.95 0.16 0.00 -1.56 0.00 0.00 34.95 31.64 1xlr s ARG 126 CO -0.11 -0.09 1.11 -0.40 -0.81 0.00 0.00 175.30 175.00 1xlr n ASP 127 N 4.29 2.60 -3.64 -2.12 5.68 -0.80 -4.99 116.55 117.57 1xlr n ASP 127 Ca -0.19 -1.80 -0.09 0.00 -0.50 0.00 0.00 54.79 52.22 1xlr n ASP 127 Cb 0.51 -0.01 -0.07 0.00 -1.14 0.00 0.00 41.12 40.41 1xlr n ASP 127 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 1xlr s PHE 128 N -1.57 -0.53 -0.14 2.11 5.36 -1.25 -4.99 117.98 116.96 1xlr s PHE 128 Ca 0.23 1.24 -0.13 0.00 -0.96 0.00 0.00 56.93 57.31 1xlr s PHE 128 Cb 0.16 0.36 0.04 0.00 -0.34 0.00 0.00 43.02 43.24 1xlr s PHE 128 CO 0.24 -0.26 0.38 -1.50 -1.46 0.00 0.00 175.22 172.62 1xlr s ILE 129 N 0.43 -0.00 0.04 3.12 2.07 -1.26 -1.93 121.20 123.67 1xlr s ILE 129 Ca 0.01 0.01 0.03 0.00 -1.41 0.00 0.00 60.65 59.29 1xlr s ILE 129 Cb -0.05 -0.53 -0.02 0.00 0.13 0.00 0.00 42.46 41.99 1xlr s ILE 129 CO -0.07 0.01 -0.09 -1.61 -1.91 0.00 0.00 174.94 171.26 1xlr s GLU 130 N 0.34 0.59 -0.09 3.50 2.02 -0.31 -4.99 118.70 119.75 1xlr s GLU 130 Ca -0.01 -0.75 -0.05 0.00 0.02 0.00 0.00 54.97 54.18 1xlr s GLU 130 Cb -0.03 -0.42 -0.04 0.00 0.10 0.00 0.00 34.13 33.74 1xlr s GLU 130 CO -0.01 0.08 0.12 0.42 0.02 0.00 0.00 175.26 175.89 1xlr s ILE 131 N -1.25 5.25 0.26 -1.63 1.01 -1.26 -1.15 121.20 122.43 1xlr s ILE 131 Ca -0.07 0.05 0.02 0.00 0.00 0.00 0.00 60.65 60.65 1xlr s ILE 131 Cb -0.09 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 39.01 1xlr s ILE 131 CO 0.01 0.56 0.06 -0.83 0.00 0.00 0.00 174.94 174.74 1xlr s GLY 132 N -1.18 1.74 0.01 6.18 0.00 0.71 -2.85 107.32 111.93 1xlr s GLY 132 Ca 0.17 -1.87 -0.20 0.00 0.00 0.00 0.00 44.72 42.81 1xlr s GLY 132 CO 0.06 -1.66 0.45 1.09 0.00 0.00 0.00 173.10 173.04 1xlr s ARG 133 N -3.95 0.89 -0.23 2.90 1.70 -0.66 -0.86 118.95 118.74 1xlr s ARG 133 Ca 0.35 -0.20 -0.10 0.00 -0.47 0.00 0.00 55.73 55.31 1xlr s ARG 133 Cb 0.07 0.40 0.09 0.00 -0.57 0.00 0.00 34.95 34.95 1xlr s ARG 133 CO 0.12 -0.29 0.53 0.34 -1.08 0.00 0.00 175.30 174.92 1xlr s ASP 134 N -1.69 -0.67 -1.42 -2.89 3.68 -0.67 -2.39 116.67 110.63 1xlr s ASP 134 Ca -0.08 1.21 -0.01 0.00 2.13 0.00 0.00 52.55 55.79 1xlr s ASP 134 Cb -0.02 1.39 0.01 0.00 -1.45 0.00 0.00 42.92 42.85 1xlr s ASP 134 CO 0.02 -0.22 0.46 0.00 0.13 0.00 0.00 175.17 175.55 1xlr n ALA 135 N 4.84 -1.96 -0.23 3.66 0.00 -1.26 -0.71 120.51 124.85 1xlr n ALA 135 Ca -0.16 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1xlr n ALA 135 Cb 0.53 -1.65 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1xlr n ALA 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xlr n GLY 136 N -1.93 2.41 3.88 0.00 0.00 -1.26 -5.02 105.19 103.27 1xlr n GLY 136 Ca -0.29 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 1xlr n GLY 136 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xlr s LEU 137 N 0.00 4.23 -0.04 0.99 1.43 0.12 -5.08 118.68 120.33 1xlr s LEU 137 Ca 0.00 0.22 -0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1xlr s LEU 137 Cb 0.00 -2.78 -0.04 0.00 0.03 0.00 0.00 46.19 43.40 1xlr s LEU 137 CO 0.00 0.19 0.14 0.26 0.23 0.00 0.00 176.35 177.17 1xlr s TRP 138 N -1.44 3.47 0.23 0.29 0.52 -1.26 -1.67 118.94 119.07 1xlr s TRP 138 Ca 0.32 0.35 -0.06 0.00 0.02 0.00 0.00 56.10 56.72 1xlr s TRP 138 Cb -0.13 -1.83 -0.02 0.00 -1.15 0.00 0.00 33.47 30.34 1xlr s TRP 138 CO 0.25 0.63 0.30 0.20 0.02 0.00 0.00 176.95 178.35 1xlr s GLY 139 N -1.64 1.04 0.01 0.98 0.00 -0.04 -1.13 107.32 106.55 1xlr s GLY 139 Ca 0.23 -1.33 -0.16 0.00 0.00 0.00 0.00 44.72 43.46 1xlr s GLY 139 CO 0.13 -1.04 0.36 1.09 0.00 0.00 0.00 173.10 173.64 1xlr s ARG 140 N -4.06 0.79 -0.01 2.90 1.70 -0.62 -0.21 118.95 119.44 1xlr s ARG 140 Ca 0.31 -0.28 0.03 0.00 -0.47 0.00 0.00 55.73 55.32 1xlr s ARG 140 Cb 0.03 0.35 -0.00 0.00 -0.57 0.00 0.00 34.95 34.76 1xlr s ARG 140 CO 0.11 -0.24 -0.09 -0.98 -1.08 0.00 0.00 175.30 173.01 1xlr s ARG 141 N -1.90 0.82 0.01 3.89 1.70 -0.30 -1.25 118.95 121.92 1xlr s ARG 141 Ca -0.09 -0.33 0.03 0.00 -0.47 0.00 0.00 55.73 54.86 1xlr s ARG 141 Cb -0.03 -0.78 -0.01 0.00 -0.57 0.00 0.00 34.95 33.56 1xlr s ARG 141 CO 0.01 0.19 -0.09 -1.12 -1.08 0.00 0.00 175.30 173.21 1xlr s SER 142 N -0.13 1.00 -0.28 -2.89 0.01 -0.16 -1.16 113.70 110.08 1xlr s SER 142 Ca 0.02 -0.28 -0.09 0.00 1.31 0.00 0.00 55.95 56.91 1xlr s SER 142 Cb -0.05 -0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.09 1xlr s SER 142 CO -0.00 0.01 0.13 -0.60 0.41 0.00 0.00 173.24 173.19 1xlr s ARG 143 N -0.66 3.56 0.21 12.44 3.52 -0.82 -0.81 118.95 136.39 1xlr s ARG 143 Ca -0.00 -0.56 0.06 0.00 -0.13 0.00 0.00 55.73 55.10 1xlr s ARG 143 Cb -0.05 -3.49 -0.04 0.00 -1.56 0.00 0.00 34.95 29.81 1xlr s ARG 143 CO 0.00 -0.29 0.17 -0.51 -0.81 0.00 0.00 175.30 173.86 1xlr s LEU 144 N 1.64 3.82 -0.06 -0.88 1.43 -0.82 -1.91 118.68 121.89 1xlr s LEU 144 Ca 0.06 -0.19 0.02 0.00 -1.03 0.00 0.00 54.13 52.98 1xlr s LEU 144 Cb -0.16 -2.39 0.02 0.00 0.03 0.00 0.00 46.19 43.69 1xlr s LEU 144 CO 0.06 0.01 -0.09 -0.13 0.23 0.00 0.00 176.35 176.43 1xlr s ARG 145 N -3.50 1.43 -0.25 1.70 0.52 0.14 -1.37 118.95 117.62 1xlr s ARG 145 Ca 0.32 -0.31 -0.05 0.00 -0.52 0.00 0.00 55.73 55.17 1xlr s ARG 145 Cb -0.09 -1.27 -0.01 0.00 0.52 0.00 0.00 34.95 34.11 1xlr s ARG 145 CO 0.24 -0.04 0.02 -0.51 0.02 0.00 0.00 175.30 175.03 1xlr s LEU 146 N 0.86 3.31 -1.57 2.53 1.43 -0.25 -1.72 118.68 123.26 1xlr s LEU 146 Ca -0.11 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.40 1xlr s LEU 146 Cb -0.15 -1.82 0.09 0.00 0.03 0.00 0.00 46.19 44.35 1xlr s LEU 146 CO 0.01 -0.08 0.76 -1.20 0.23 0.00 0.00 176.35 176.07 1xlr n SER 147 N 4.84 -2.94 0.00 2.29 7.64 0.80 -0.74 113.62 125.52 1xlr n SER 147 Ca -0.17 -0.93 0.00 0.00 1.01 0.00 0.00 58.87 58.78 1xlr n SER 147 Cb 0.50 -3.23 0.00 0.00 -1.01 0.00 0.00 64.21 60.47 1xlr n SER 147 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xlr n GLY 148 N -1.63 2.85 3.70 0.23 0.00 -1.26 -5.00 105.19 104.07 1xlr n GLY 148 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 1xlr n GLY 148 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xlr s LYS 149 N 0.00 4.28 0.64 1.61 1.02 0.09 -4.95 119.74 122.42 1xlr s LYS 149 Ca 0.00 0.45 -0.10 0.00 0.02 0.00 0.00 55.97 56.33 1xlr s LYS 149 Cb 0.00 -3.49 -0.02 0.00 -0.52 0.00 0.00 37.83 33.80 1xlr s LYS 149 CO 0.00 0.02 1.02 -1.25 -0.92 0.00 0.00 175.35 174.22 1xlr s PRO 150 N 1.07 3.27 0.07 -1.68 0.04 -1.26 -1.09 135.00 135.42 1xlr s PRO 150 Ca 0.25 0.53 -0.18 0.00 0.04 0.00 0.00 61.00 61.65 1xlr s PRO 150 Cb -0.15 -2.10 0.04 0.00 0.04 0.00 0.00 34.50 32.32 1xlr s PRO 150 CO 0.10 -0.72 0.42 -0.48 0.04 0.00 0.00 177.00 176.36 1xlr s LEU 151 N -5.19 0.35 -0.11 -3.56 2.34 -0.47 -4.37 118.68 107.67 1xlr s LEU 151 Ca 0.55 -0.09 -0.00 0.00 0.06 0.00 0.00 54.13 54.65 1xlr s LEU 151 Cb -0.11 1.81 -0.02 0.00 -0.56 0.00 0.00 46.19 47.31 1xlr s LEU 151 CO 0.52 -0.73 -0.09 -0.22 -1.06 0.00 0.00 176.35 174.76 1xlr s LEU 152 N -2.27 2.95 -0.14 1.48 1.98 -0.47 -1.95 118.68 120.27 1xlr s LEU 152 Ca -0.02 -0.19 0.00 0.00 -2.89 0.00 0.00 54.13 51.03 1xlr s LEU 152 Cb 0.00 -1.67 0.02 0.00 0.66 0.00 0.00 46.19 45.21 1xlr s LEU 152 CO -0.06 0.23 -0.13 -0.22 -1.89 0.00 0.00 176.35 174.28 1xlr s LEU 153 N -0.04 1.60 -0.08 -0.68 2.96 0.01 -0.99 118.68 121.47 1xlr s LEU 153 Ca -0.01 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.47 1xlr s LEU 153 Cb -0.14 -1.11 -0.02 0.00 0.50 0.00 0.00 46.19 45.42 1xlr s LEU 153 CO 0.03 -0.06 -0.14 -0.89 -1.32 0.00 0.00 176.35 173.98 1xlr s THR 154 N 1.46 3.02 -0.02 3.68 2.01 0.27 -0.99 115.64 125.06 1xlr s THR 154 Ca 0.03 -0.71 0.03 0.00 0.31 0.00 0.00 61.69 61.36 1xlr s THR 154 Cb -0.13 -2.22 -0.00 0.00 0.01 0.00 0.00 72.50 70.16 1xlr s THR 154 CO -0.09 0.56 -0.12 -1.61 -0.69 0.00 0.00 174.62 172.68 1xlr s GLU 155 N -0.27 1.13 -0.13 4.92 2.02 -0.38 -0.67 118.70 125.32 1xlr s GLU 155 Ca 0.02 -0.41 0.02 0.00 0.02 0.00 0.00 54.97 54.62 1xlr s GLU 155 Cb -0.13 -1.05 -0.00 0.00 0.10 0.00 0.00 34.13 33.05 1xlr s GLU 155 CO 0.03 0.19 -0.19 -1.17 0.02 0.00 0.00 175.26 174.14 1xlr s LEU 156 N 0.00 2.31 -0.37 1.80 2.96 -0.15 -1.58 118.68 123.66 1xlr s LEU 156 Ca -0.01 -0.51 -0.18 0.00 -0.22 0.00 0.00 54.13 53.22 1xlr s LEU 156 Cb -0.08 -1.50 0.00 0.00 0.50 0.00 0.00 46.19 45.11 1xlr s LEU 156 CO 0.00 0.12 0.48 -0.36 -1.32 0.00 0.00 176.35 175.27 1xlr s PHE 157 N 0.61 3.17 0.50 5.38 0.40 -0.28 -1.46 117.98 126.30 1xlr s PHE 157 Ca -0.11 0.03 -0.20 0.00 -0.60 0.00 0.00 56.93 56.06 1xlr s PHE 157 Cb -0.16 -2.90 -0.07 0.00 0.51 0.00 0.00 43.02 40.39 1xlr s PHE 157 CO 0.03 -0.57 1.08 -0.51 0.70 0.00 0.00 175.22 175.95 1xlr s LEU 158 N 2.31 3.83 0.64 -0.37 1.43 -0.17 -4.39 118.68 121.96 1xlr s LEU 158 Ca 0.17 2.05 0.30 0.00 -1.03 0.00 0.00 54.13 55.62 1xlr s LEU 158 Cb -0.16 -4.54 1.62 0.00 0.03 0.00 0.00 46.19 43.15 1xlr s LEU 158 CO 0.13 -0.95 1.95 1.55 0.23 0.00 0.00 176.35 179.26 1xlr h PRO 159 N 1.47 0.00 0.00 1.29 0.13 -1.91 0.15 132.00 133.13 1xlr h PRO 159 Ca -0.50 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1xlr h PRO 159 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1xlr h PRO 159 CO 0.58 0.00 -0.02 0.00 -0.23 0.00 0.00 178.00 178.33 1xlr h ALA 160 N 1.44 1.00 -2.34 -0.56 0.00 -1.89 -3.44 119.26 113.48 1xlr h ALA 160 Ca 0.06 -0.02 -0.52 0.00 0.00 0.00 0.00 54.91 54.44 1xlr h ALA 160 Cb 0.75 -0.00 0.14 0.00 0.00 0.00 0.00 17.79 18.67 1xlr h ALA 160 CO -0.00 0.03 0.32 -1.54 0.00 0.00 0.00 179.25 178.05 1xlr s SER 161 N -5.82 4.41 0.00 0.00 1.04 0.51 -4.92 113.70 108.92 1xlr s SER 161 Ca 0.02 1.90 0.06 0.00 0.48 0.00 0.00 55.95 58.41 1xlr s SER 161 Cb 0.08 -2.53 0.35 0.00 0.10 0.00 0.00 66.02 64.03 1xlr s SER 161 CO 0.57 -2.10 0.93 -2.65 0.98 0.00 0.00 173.24 170.97 1xlr n PRO 162 N -3.44 0.15 0.23 4.02 -0.02 -1.26 -2.96 135.00 131.72 1xlr n PRO 162 Ca 0.10 0.10 0.12 0.00 -2.02 0.00 0.00 63.50 61.79 1xlr n PRO 162 Cb 0.53 -1.50 0.43 0.00 -0.02 0.00 0.00 33.50 32.94 1xlr n PRO 162 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1xlr h LEU 163 N 0.00 0.00 -1.75 2.45 4.07 -1.91 -3.52 115.31 114.66 1xlr h LEU 163 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1xlr h LEU 163 Cb 0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.77 1xlr h LEU 163 CO 0.00 0.14 0.00 -1.22 -1.08 0.00 0.00 178.44 176.28