#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kly n ALA 2 N 0.00 0.00 -0.01 3.17 0.00 -1.26 -4.30 120.51 118.10 2kly n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2kly n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2kly n ALA 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kly n GLY 3 N 0.00 2.18 0.18 0.00 0.00 -1.26 -4.03 105.19 102.26 2kly n GLY 3 Ca 0.00 0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.05 2kly n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kly h THR 4 N 0.00 1.25 -0.15 2.61 1.03 -1.94 0.26 112.91 115.98 2kly h THR 4 Ca 0.00 -1.47 -0.02 0.00 -0.01 0.00 0.00 66.41 64.91 2kly h THR 4 Cb 0.00 1.80 -0.01 0.00 -1.07 0.00 0.00 68.15 68.88 2kly h THR 4 CO 0.00 0.41 0.03 0.00 -0.01 0.00 0.00 175.52 175.96 2kly h ALA 5 N 1.58 0.20 -0.47 0.00 0.00 -1.70 -0.46 119.26 118.42 2kly h ALA 5 Ca -0.00 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2kly h ALA 5 Cb 0.77 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2kly h ALA 5 CO 0.05 -0.16 0.30 -0.07 0.00 0.00 0.00 179.25 179.38 2kly h LEU 6 N 0.05 0.51 -0.93 0.00 3.38 -1.75 -0.62 115.31 115.96 2kly h LEU 6 Ca 0.05 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.11 2kly h LEU 6 Cb 0.27 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.82 2kly h LEU 6 CO 0.00 0.37 0.57 0.11 0.09 0.00 0.00 178.44 179.58 2kly h LYS 7 N 0.61 0.92 -0.04 1.13 1.57 -0.35 0.36 116.57 120.77 2kly h LYS 7 Ca 0.18 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2kly h LYS 7 Cb -0.05 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.05 2kly h LYS 7 CO -0.05 0.61 0.01 -0.09 -0.57 0.00 0.00 179.45 179.36 2kly h ARG 8 N 0.95 0.06 0.00 3.15 9.65 -0.48 -2.24 114.38 125.48 2kly h ARG 8 Ca 0.44 -0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 59.25 2kly h ARG 8 Cb 0.37 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.94 2kly h ARG 8 CO -0.24 0.25 -0.27 -0.07 2.80 0.00 0.00 179.97 182.44 2kly h LEU 9 N -0.14 0.00 -0.42 3.80 3.38 -0.44 0.60 115.31 122.09 2kly h LEU 9 Ca 0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 2kly h LEU 9 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2kly h LEU 9 CO -0.00 0.27 -0.20 0.24 0.09 0.00 0.00 178.44 178.84 2kly h MET 10 N 0.00 0.88 -0.39 1.13 2.86 -0.21 0.19 114.93 119.39 2kly h MET 10 Ca -0.00 -0.38 -0.04 0.00 -2.06 0.00 0.00 59.70 57.22 2kly h MET 10 Cb 0.62 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.23 2kly h MET 10 CO 0.04 1.03 0.10 0.00 1.06 0.00 0.00 176.91 179.14 2kly h ALA 11 N 0.83 0.52 -0.27 6.32 0.00 -0.72 -0.73 119.26 125.21 2kly h ALA 11 Ca 0.10 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2kly h ALA 11 Cb 0.76 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2kly h ALA 11 CO 0.06 0.19 0.09 0.93 0.00 0.00 0.00 179.25 180.52 2kly h GLU 12 N 0.49 0.21 -0.05 0.00 4.39 -0.78 -1.47 114.58 117.36 2kly h GLU 12 Ca 0.12 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.83 2kly h GLU 12 Cb 0.30 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.85 2kly h GLU 12 CO 0.00 0.14 -0.50 -0.92 -1.16 0.00 0.00 179.01 176.57 2kly h TYR 13 N 0.21 -1.48 -0.75 4.33 3.20 -0.45 -2.40 116.97 119.63 2kly h TYR 13 Ca 0.12 0.05 0.12 0.00 3.14 0.00 0.00 58.73 62.16 2kly h TYR 13 Cb 0.08 0.65 -0.08 0.00 1.54 0.00 0.00 36.73 38.92 2kly h TYR 13 CO -0.13 -0.52 0.35 0.87 -1.64 0.00 0.00 178.16 177.09 2kly h LYS 14 N -0.59 0.54 -0.47 1.82 1.57 -0.86 -1.42 116.57 117.15 2kly h LYS 14 Ca 0.02 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2kly h LYS 14 Cb 0.66 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 2kly h LYS 14 CO -0.36 0.36 0.12 1.96 -0.57 0.00 0.00 179.45 180.95 2kly h GLN 15 N 0.55 0.71 0.00 3.15 1.08 -0.93 0.24 115.11 119.90 2kly h GLN 15 Ca 0.39 -0.13 -0.03 0.00 -1.45 0.00 0.00 58.65 57.44 2kly h GLN 15 Cb 0.51 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.82 2kly h GLN 15 CO -0.33 0.64 -0.12 -0.07 -0.95 0.00 0.00 178.83 178.00 2kly h LEU 16 N 0.69 0.00 0.06 1.46 3.38 -0.80 0.37 115.31 120.47 2kly h LEU 16 Ca 0.16 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 2kly h LEU 16 Cb 0.25 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.01 2kly h LEU 16 CO -0.00 0.12 -0.44 0.74 0.09 0.00 0.00 178.44 178.95 2kly h THR 17 N 0.00 1.60 -0.16 0.22 2.02 0.17 -3.07 112.91 113.69 2kly h THR 17 Ca -0.00 -2.33 -0.02 0.00 0.77 0.00 0.00 66.41 64.83 2kly h THR 17 Cb 0.46 3.13 -0.01 0.00 -1.74 0.00 0.00 68.15 70.00 2kly h THR 17 CO 0.02 0.64 0.03 -0.07 0.37 0.00 0.00 175.52 176.50 2kly h LEU 18 N -0.57 0.26 -6.52 2.58 4.07 -0.50 -3.41 115.31 111.22 2kly h LEU 18 Ca -0.07 -0.26 -0.53 0.00 0.08 0.00 0.00 57.88 57.10 2kly h LEU 18 Cb 1.30 -0.07 -0.37 0.00 1.08 0.00 0.00 40.66 42.60 2kly h LEU 18 CO 0.08 0.45 -0.81 0.20 -1.08 0.00 0.00 178.44 177.28 2kly s ASN 19 N -5.70 2.53 -0.31 -0.43 0.01 0.13 -5.09 114.94 106.07 2kly s ASN 19 Ca -0.14 -2.05 -0.29 0.00 -0.71 0.00 0.00 52.86 49.67 2kly s ASN 19 Cb 0.06 -0.17 0.00 0.00 0.41 0.00 0.00 41.25 41.56 2kly s ASN 19 CO 0.71 -0.30 1.33 -2.84 -1.51 0.00 0.00 177.10 174.49 2kly s PRO 20 N 1.15 3.86 0.20 -0.60 0.02 -1.16 -4.42 135.00 134.06 2kly s PRO 20 Ca 0.18 1.21 -0.29 0.00 0.02 0.00 0.00 61.00 62.12 2kly s PRO 20 Cb -0.21 -3.91 -0.16 0.00 0.02 0.00 0.00 34.50 30.24 2kly s PRO 20 CO 0.00 -1.19 0.71 -2.30 -0.33 0.00 0.00 177.00 173.89 2kly n PRO 21 N 7.44 0.38 -1.99 5.54 -0.01 -1.26 -4.85 135.00 140.25 2kly n PRO 21 Ca 0.15 0.13 -0.42 0.00 -0.01 0.00 0.00 63.50 63.35 2kly n PRO 21 Cb 0.47 -1.28 -0.03 0.00 -0.01 0.00 0.00 33.50 32.65 2kly n PRO 21 CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 175.50 173.66 2kly s GLU 22 N -1.01 4.24 -0.62 -0.52 -1.05 -1.26 -1.71 118.70 116.77 2kly s GLU 22 Ca 0.65 2.30 0.00 0.00 -0.15 0.00 0.00 54.97 57.77 2kly s GLU 22 Cb -0.90 -3.17 0.00 0.00 -0.44 0.00 0.00 34.13 29.63 2kly s GLU 22 CO 0.57 -0.54 0.00 0.41 0.95 0.00 0.00 175.26 176.64 2kly n GLY 23 N 3.46 0.81 3.10 -3.83 0.00 -1.26 -4.98 105.19 102.49 2kly n GLY 23 Ca 0.12 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 2kly n GLY 23 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kly s ILE 24 N -2.11 1.88 -0.28 -0.61 -1.09 -0.69 -1.33 121.20 116.96 2kly s ILE 24 Ca 0.00 -0.84 0.02 0.00 -2.23 0.00 0.00 60.65 57.60 2kly s ILE 24 Cb 0.00 -1.70 0.08 0.00 -1.58 0.00 0.00 42.46 39.25 2kly s ILE 24 CO 0.00 0.51 -0.02 -0.69 -1.23 0.00 0.00 174.94 173.51 2kly s VAL 25 N 1.22 1.83 -0.07 2.92 1.01 -1.02 -4.60 120.40 121.69 2kly s VAL 25 Ca 0.02 -1.66 -0.07 0.00 0.00 0.00 0.00 61.98 60.27 2kly s VAL 25 Cb -0.14 -2.15 0.02 0.00 0.00 0.00 0.00 36.38 34.11 2kly s VAL 25 CO -0.09 -0.28 0.19 0.00 0.00 0.00 0.00 175.10 174.92 2kly s ALA 26 N 1.21 -0.48 0.17 5.51 0.00 -1.26 0.31 121.76 127.22 2kly s ALA 26 Ca -0.00 0.49 -0.24 0.00 0.00 0.00 0.00 51.96 52.21 2kly s ALA 26 Cb -0.19 -0.28 0.06 0.00 0.00 0.00 0.00 23.12 22.71 2kly s ALA 26 CO -0.08 -0.11 0.95 0.20 0.00 0.00 0.00 175.76 176.72 2kly s GLY 27 N -0.05 -0.17 0.25 0.00 0.00 -0.58 -5.01 107.32 101.77 2kly s GLY 27 Ca -0.01 0.02 -0.31 0.00 0.00 0.00 0.00 44.72 44.42 2kly s GLY 27 CO 0.00 0.24 1.65 -1.05 0.00 0.00 0.00 173.10 173.94 2kly n PRO 28 N -0.50 2.71 0.28 2.90 -0.02 -1.26 -0.51 135.00 138.59 2kly n PRO 28 Ca -0.06 0.97 0.16 0.00 -2.02 0.00 0.00 63.50 62.55 2kly n PRO 28 Cb 0.60 -2.78 0.77 0.00 -0.02 0.00 0.00 33.50 32.08 2kly n PRO 28 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 2kly h MET 29 N 5.67 0.00 -1.85 -0.52 4.05 -1.00 -3.40 114.93 117.88 2kly h MET 29 Ca -0.45 0.00 0.02 0.00 -0.28 0.00 0.00 59.70 58.99 2kly h MET 29 Cb 1.22 0.00 -0.23 0.00 -0.80 0.00 0.00 31.60 31.79 2kly h MET 29 CO 0.87 0.00 0.21 1.21 0.23 0.00 0.00 176.91 179.42 2kly s ASN 30 N -4.59 -0.70 -0.31 1.39 2.47 -1.26 -4.97 114.94 106.97 2kly s ASN 30 Ca -0.03 1.26 -0.04 0.00 0.42 0.00 0.00 52.86 54.46 2kly s ASN 30 Cb 0.10 1.28 -0.12 0.00 -1.45 0.00 0.00 41.25 41.06 2kly s ASN 30 CO 0.33 -0.21 2.22 -0.62 -3.72 0.00 0.00 177.10 175.10 2kly n GLU 31 N 3.14 1.46 0.00 0.43 -0.58 -1.26 -1.53 120.64 122.30 2kly n GLU 31 Ca -0.16 -0.87 0.00 0.00 -0.42 0.00 0.00 57.16 55.72 2kly n GLU 31 Cb 0.57 -2.01 0.00 0.00 -0.57 0.00 0.00 31.44 29.43 2kly n GLU 31 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 2kly n GLU 32 N 3.21 0.00 -3.04 3.49 -0.00 -1.26 -5.04 120.64 118.00 2kly n GLU 32 Ca 0.31 0.00 -0.44 0.00 -0.00 0.00 0.00 57.16 57.03 2kly n GLU 32 Cb 0.39 -0.10 -0.05 0.00 -0.00 0.00 0.00 31.44 31.68 2kly n GLU 32 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 2kly s ASN 33 N -1.52 6.21 0.00 -1.84 2.47 -0.58 -4.88 114.94 114.79 2kly s ASN 33 Ca 0.00 -1.09 0.26 0.00 0.42 0.00 0.00 52.86 52.46 2kly s ASN 33 Cb 0.00 -2.34 0.65 0.00 -1.45 0.00 0.00 41.25 38.11 2kly s ASN 33 CO 0.00 -1.15 1.52 0.49 -3.72 0.00 0.00 177.10 174.24 2kly n PHE 34 N 6.73 0.00 0.99 0.43 3.01 -1.26 -3.89 117.46 123.47 2kly n PHE 34 Ca -0.06 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.51 2kly n PHE 34 Cb 0.44 -0.01 0.32 0.00 -0.01 0.00 0.00 39.48 40.23 2kly n PHE 34 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2kly n PHE 35 N 0.59 0.27 -3.69 1.38 3.72 -1.26 -4.72 117.46 113.76 2kly n PHE 35 Ca 0.16 -0.14 -0.17 0.00 -0.05 0.00 0.00 57.45 57.25 2kly n PHE 35 Cb 0.46 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.83 2kly n PHE 35 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2kly s GLU 36 N -1.73 0.00 0.20 -1.08 2.02 -1.25 -0.13 118.70 116.74 2kly s GLU 36 Ca 0.34 0.45 0.09 0.00 0.02 0.00 0.00 54.97 55.87 2kly s GLU 36 Cb 0.19 -0.33 -0.05 0.00 0.10 0.00 0.00 34.13 34.05 2kly s GLU 36 CO 0.28 -0.28 -0.17 -1.58 0.02 0.00 0.00 175.26 173.53 2kly s TRP 37 N 2.01 1.84 0.10 1.61 0.52 -0.02 -0.55 118.94 124.46 2kly s TRP 37 Ca 0.01 -0.50 0.10 0.00 0.02 0.00 0.00 56.10 55.73 2kly s TRP 37 Cb -0.12 -0.87 -0.04 0.00 -1.15 0.00 0.00 33.47 31.30 2kly s TRP 37 CO -0.05 0.40 -0.24 -1.21 0.02 0.00 0.00 176.95 175.87 2kly s GLU 38 N -3.29 1.35 0.01 4.98 2.02 0.33 -0.11 118.70 123.99 2kly s GLU 38 Ca 0.21 -1.23 -0.03 0.00 0.02 0.00 0.00 54.97 53.94 2kly s GLU 38 Cb -0.03 -1.70 -0.01 0.00 0.10 0.00 0.00 34.13 32.49 2kly s GLU 38 CO 0.08 0.41 0.05 0.00 0.02 0.00 0.00 175.26 175.82 2kly s ALA 39 N -1.05 -0.11 -0.23 5.21 0.00 0.62 -1.52 121.76 124.69 2kly s ALA 39 Ca 0.11 -0.29 -0.05 0.00 0.00 0.00 0.00 51.96 51.72 2kly s ALA 39 Cb -0.10 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.10 2kly s ALA 39 CO 0.05 -0.16 0.00 -0.51 0.00 0.00 0.00 175.76 175.13 2kly s LEU 40 N -1.23 3.12 -0.53 0.00 1.02 0.15 -0.12 118.68 121.09 2kly s LEU 40 Ca -0.13 -0.31 -0.15 0.00 0.02 0.00 0.00 54.13 53.55 2kly s LEU 40 Cb -0.08 -1.81 0.12 0.00 0.02 0.00 0.00 46.19 44.44 2kly s LEU 40 CO 0.00 -0.02 0.48 -0.63 0.02 0.00 0.00 176.35 176.20 2kly s ILE 41 N 1.47 5.15 -0.30 -0.59 -1.09 0.56 -2.42 121.20 123.98 2kly s ILE 41 Ca 0.05 -1.47 -0.29 0.00 -2.23 0.00 0.00 60.65 56.72 2kly s ILE 41 Cb -0.15 -4.28 -0.00 0.00 -1.58 0.00 0.00 42.46 36.46 2kly s ILE 41 CO -0.00 -0.83 1.34 -0.04 -1.23 0.00 0.00 174.94 174.18 2kly s MET 42 N 1.59 3.89 0.00 2.79 -1.94 -0.44 -1.42 119.30 123.76 2kly s MET 42 Ca 0.03 1.28 -0.36 0.00 -1.71 0.00 0.00 55.69 54.93 2kly s MET 42 Cb -0.29 -3.90 -0.15 0.00 2.01 0.00 0.00 34.83 32.50 2kly s MET 42 CO 0.03 -1.16 1.59 0.41 -0.01 0.00 0.00 175.02 175.88 2kly n GLY 43 N 4.39 0.92 3.66 -0.03 0.00 0.11 -4.82 105.19 109.43 2kly n GLY 43 Ca 0.15 0.77 -0.59 0.00 0.00 0.00 0.00 46.02 46.35 2kly n GLY 43 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2kly n PRO 44 N 4.14 0.71 -2.14 1.61 -0.02 -1.26 -3.84 135.00 134.21 2kly n PRO 44 Ca 0.20 0.26 -0.34 0.00 -2.02 0.00 0.00 63.50 61.60 2kly n PRO 44 Cb 0.23 -1.86 0.01 0.00 -0.02 0.00 0.00 33.50 31.85 2kly n PRO 44 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2kly s GLU 45 N 2.21 3.24 -0.90 -0.52 2.02 -1.26 -2.92 118.70 120.56 2kly s GLU 45 Ca 0.96 1.53 0.00 0.00 0.02 0.00 0.00 54.97 57.48 2kly s GLU 45 Cb -1.17 -2.00 0.00 0.00 0.10 0.00 0.00 34.13 31.06 2kly s GLU 45 CO 0.64 -0.93 0.00 -3.47 0.02 0.00 0.00 175.26 171.52 2kly n ASP 46 N -1.59 -3.90 -4.27 -0.19 2.03 -1.26 -4.96 116.55 102.41 2kly n ASP 46 Ca 0.11 0.18 -0.27 0.00 0.52 0.00 0.00 54.79 55.33 2kly n ASP 46 Cb 0.51 -2.34 -0.08 0.00 -0.72 0.00 0.00 41.12 38.49 2kly n ASP 46 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2kly s THR 47 N -2.34 0.76 0.14 5.18 -4.23 -1.19 -5.02 115.64 108.93 2kly s THR 47 Ca 0.00 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.79 2kly s THR 47 Cb 0.00 -2.35 0.30 0.00 1.34 0.00 0.00 72.50 71.80 2kly s THR 47 CO 0.00 0.00 1.91 0.00 -0.54 0.00 0.00 174.62 175.99 2kly n PHE 49 N -3.29 0.42 -1.71 0.00 3.72 -1.26 -3.78 117.46 111.56 2kly n PHE 49 Ca 0.00 -0.21 -0.41 0.00 -0.05 0.00 0.00 57.45 56.78 2kly n PHE 49 Cb 0.36 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.91 2kly n PHE 49 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 2kly n GLU 50 N 0.92 2.07 0.00 -1.08 2.13 -1.03 -2.40 120.64 121.25 2kly n GLU 50 Ca 0.18 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.73 2kly n GLU 50 Cb 0.46 -2.43 0.00 0.00 0.27 0.00 0.00 31.44 29.74 2kly n GLU 50 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2kly n PHE 51 N -0.05 0.00 -1.75 4.31 3.72 -1.25 -4.95 117.46 117.50 2kly n PHE 51 Ca 0.06 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.13 2kly n PHE 51 Cb 0.39 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.98 2kly n PHE 51 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2kly s GLY 52 N -1.41 2.11 -0.33 1.37 0.00 -1.01 -4.77 107.32 103.28 2kly s GLY 52 Ca 0.00 0.50 -0.00 0.00 0.00 0.00 0.00 44.72 45.22 2kly s GLY 52 CO 0.00 0.85 0.12 0.14 0.00 0.00 0.00 173.10 174.21 2kly s VAL 53 N -2.40 0.93 -0.38 1.40 1.01 -1.26 0.09 120.40 119.79 2kly s VAL 53 Ca 0.66 -1.58 -0.11 0.00 0.00 0.00 0.00 61.98 60.96 2kly s VAL 53 Cb -0.20 -1.70 0.03 0.00 0.00 0.00 0.00 36.38 34.52 2kly s VAL 53 CO 0.42 -0.72 0.21 -0.36 0.00 0.00 0.00 175.10 174.66 2kly s PHE 54 N 1.42 3.25 0.36 5.22 0.08 -0.51 -4.53 117.98 123.28 2kly s PHE 54 Ca 0.11 -1.02 -0.24 0.00 0.12 0.00 0.00 56.93 55.90 2kly s PHE 54 Cb -0.18 -2.48 -0.10 0.00 -0.57 0.00 0.00 43.02 39.69 2kly s PHE 54 CO -0.21 -0.67 0.95 -1.25 -0.10 0.00 0.00 175.22 173.94 2kly s PRO 55 N 1.54 4.44 0.15 0.24 0.04 -1.26 -0.33 135.00 139.83 2kly s PRO 55 Ca 0.02 1.27 -0.10 0.00 0.04 0.00 0.00 61.00 62.23 2kly s PRO 55 Cb -0.20 -2.57 -0.00 0.00 0.04 0.00 0.00 34.50 31.77 2kly s PRO 55 CO 0.06 0.15 0.29 0.00 0.04 0.00 0.00 177.00 177.55 2kly s ALA 56 N -1.81 -0.15 -0.07 8.56 0.00 0.83 -0.66 121.76 128.46 2kly s ALA 56 Ca 0.55 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.80 2kly s ALA 56 Cb -0.15 0.79 -0.00 0.00 0.00 0.00 0.00 23.12 23.75 2kly s ALA 56 CO 0.20 -0.63 -0.22 0.42 0.00 0.00 0.00 175.76 175.53 2kly s ILE 57 N -3.94 1.83 -0.28 0.00 1.01 0.27 -0.27 121.20 119.82 2kly s ILE 57 Ca 0.14 -0.91 -0.08 0.00 0.00 0.00 0.00 60.65 59.80 2kly s ILE 57 Cb 0.03 -1.57 -0.01 0.00 0.01 0.00 0.00 42.46 40.92 2kly s ILE 57 CO -0.03 0.51 0.09 -0.76 0.00 0.00 0.00 174.94 174.76 2kly s LEU 58 N 0.13 3.74 -0.26 2.97 1.02 0.84 -1.98 118.68 125.15 2kly s LEU 58 Ca -0.10 -0.47 -0.09 0.00 0.02 0.00 0.00 54.13 53.49 2kly s LEU 58 Cb -0.15 -1.92 -0.04 0.00 0.02 0.00 0.00 46.19 44.10 2kly s LEU 58 CO 0.05 -0.13 0.12 -0.55 0.02 0.00 0.00 176.35 175.86 2kly s SER 59 N 1.57 5.56 -0.13 2.29 0.15 0.68 -0.84 113.70 122.98 2kly s SER 59 Ca 0.05 -0.10 -0.06 0.00 0.70 0.00 0.00 55.95 56.53 2kly s SER 59 Cb -0.16 -2.01 -0.04 0.00 -1.71 0.00 0.00 66.02 62.09 2kly s SER 59 CO 0.04 -0.03 0.11 -0.36 1.20 0.00 0.00 173.24 174.20 2kly s PHE 60 N 1.59 3.48 0.60 3.44 0.08 0.82 0.11 117.98 128.10 2kly s PHE 60 Ca 0.06 0.42 -0.10 0.00 0.12 0.00 0.00 56.93 57.44 2kly s PHE 60 Cb -0.15 -1.95 -0.03 0.00 -0.57 0.00 0.00 43.02 40.32 2kly s PHE 60 CO 0.07 0.61 0.98 -1.25 -0.10 0.00 0.00 175.22 175.52 2kly s PRO 61 N -0.76 3.51 0.00 0.24 0.04 -1.26 -4.82 135.00 131.94 2kly s PRO 61 Ca 0.13 0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.76 2kly s PRO 61 Cb -0.12 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2kly s PRO 61 CO 0.03 -0.53 1.15 1.28 0.04 0.00 0.00 177.00 178.97 2kly n LEU 62 N -2.66 3.19 0.00 -3.56 4.77 -1.26 -2.26 117.00 115.21 2kly n LEU 62 Ca 0.05 -1.48 0.00 0.00 -0.03 0.00 0.00 56.01 54.54 2kly n LEU 62 Cb 0.55 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2kly n LEU 62 CO 0.57 0.58 0.12 0.47 -1.33 0.00 0.00 177.39 177.80 2kly n ASP 63 N 1.20 0.00 -4.77 -1.43 8.00 -1.26 0.44 116.55 118.73 2kly n ASP 63 Ca 0.00 -1.00 -0.40 0.00 0.71 0.00 0.00 54.79 54.10 2kly n ASP 63 Cb 0.37 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.47 2kly n ASP 63 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2kly s TYR 64 N 0.00 2.64 -0.40 1.24 5.04 -0.96 0.07 117.35 124.98 2kly s TYR 64 Ca 0.00 1.33 0.04 0.00 -2.44 0.00 0.00 57.07 56.00 2kly s TYR 64 Cb 0.00 -3.80 0.60 0.00 0.35 0.00 0.00 41.96 39.11 2kly s TYR 64 CO 0.00 -2.52 1.81 -0.35 -1.34 0.00 0.00 175.55 173.15 2kly n PRO 65 N -0.04 2.20 0.09 4.97 -0.04 -1.26 -3.75 135.00 137.17 2kly n PRO 65 Ca 0.04 -2.67 -0.22 0.00 -0.04 0.00 0.00 63.50 60.61 2kly n PRO 65 Cb 0.43 -2.05 -0.14 0.00 -0.04 0.00 0.00 33.50 31.69 2kly n PRO 65 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2kly h LEU 66 N 1.09 0.74 -9.66 1.53 3.38 -0.72 -3.31 115.31 108.36 2kly h LEU 66 Ca 0.55 -0.89 -0.66 0.00 0.09 0.00 0.00 57.88 56.97 2kly h LEU 66 Cb 2.64 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 43.07 2kly h LEU 66 CO 0.96 1.56 -0.51 -0.44 0.09 0.00 0.00 178.44 180.11 2kly s SER 67 N -7.32 6.18 0.25 -0.43 0.01 -0.70 -4.86 113.70 106.83 2kly s SER 67 Ca -0.11 0.35 -0.31 0.00 1.31 0.00 0.00 55.95 57.19 2kly s SER 67 Cb 0.04 -1.93 -0.11 0.00 0.21 0.00 0.00 66.02 64.22 2kly s SER 67 CO 0.90 0.34 1.65 -2.84 0.41 0.00 0.00 173.24 173.69 2kly s PRO 68 N -1.44 4.13 0.74 12.44 0.02 -1.26 -4.47 135.00 145.16 2kly s PRO 68 Ca 0.20 2.57 -0.12 0.00 0.02 0.00 0.00 61.00 63.68 2kly s PRO 68 Cb -0.12 -3.05 0.04 0.00 0.02 0.00 0.00 34.50 31.38 2kly s PRO 68 CO 0.10 -0.68 1.09 -1.25 -0.33 0.00 0.00 177.00 175.94 2kly s PRO 69 N 0.32 2.43 0.05 5.54 0.04 -1.26 -4.77 135.00 137.34 2kly s PRO 69 Ca 0.69 1.22 0.01 0.00 0.04 0.00 0.00 61.00 62.95 2kly s PRO 69 Cb -0.48 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 2kly s PRO 69 CO 0.40 -1.52 0.12 0.21 0.04 0.00 0.00 177.00 176.25 2kly s LYS 70 N -4.70 3.11 -0.22 4.56 2.20 0.12 -4.96 119.74 119.85 2kly s LYS 70 Ca 0.62 -0.55 -0.10 0.00 -0.36 0.00 0.00 55.97 55.59 2kly s LYS 70 Cb -0.18 -2.87 0.08 0.00 -1.51 0.00 0.00 37.83 33.36 2kly s LYS 70 CO 0.52 0.60 0.50 1.41 -0.36 0.00 0.00 175.35 178.02 2kly s MET 71 N -2.23 0.46 -0.01 4.03 -2.45 -1.26 -0.23 119.30 117.61 2kly s MET 71 Ca 0.29 1.03 -0.10 0.00 -1.25 0.00 0.00 55.69 55.66 2kly s MET 71 Cb -0.12 0.23 0.01 0.00 1.25 0.00 0.00 34.83 36.19 2kly s MET 71 CO 0.21 -0.19 0.21 -0.98 1.05 0.00 0.00 175.02 175.32 2kly s ARG 72 N 1.99 0.55 0.14 4.11 1.70 -0.84 -0.05 118.95 126.57 2kly s ARG 72 Ca -0.07 -0.31 -0.24 0.00 -0.47 0.00 0.00 55.73 54.64 2kly s ARG 72 Cb -0.09 0.24 -0.08 0.00 -0.57 0.00 0.00 34.95 34.45 2kly s ARG 72 CO -0.15 -0.14 0.74 -0.06 -1.08 0.00 0.00 175.30 174.61 2kly s PHE 73 N -1.34 3.88 -0.07 5.89 0.08 -0.55 -0.56 117.98 125.32 2kly s PHE 73 Ca -0.14 1.56 -0.09 0.00 0.12 0.00 0.00 56.93 58.39 2kly s PHE 73 Cb -0.07 -2.72 -0.29 0.00 -0.57 0.00 0.00 43.02 39.37 2kly s PHE 73 CO 0.03 0.52 0.59 1.79 -0.10 0.00 0.00 175.22 178.04 2kly h THR 74 N 3.40 0.85 -3.85 0.64 1.35 -1.23 -3.42 112.91 110.63 2kly h THR 74 Ca -0.47 -2.48 -0.46 0.00 -0.55 0.00 0.00 66.41 62.45 2kly h THR 74 Cb 1.21 2.68 0.11 0.00 -1.73 0.00 0.00 68.15 70.41 2kly h THR 74 CO 0.66 0.86 0.32 0.00 -0.25 0.00 0.00 175.52 177.11 2kly s GLU 76 N -5.51 3.50 0.05 0.00 2.56 -1.26 -4.99 118.70 113.05 2kly s GLU 76 Ca 0.65 2.20 -0.08 0.00 0.00 0.00 0.00 54.97 57.75 2kly s GLU 76 Cb -0.08 -2.46 -0.00 0.00 2.00 0.00 0.00 34.13 33.58 2kly s GLU 76 CO 0.48 -0.89 0.15 1.41 -0.56 0.00 0.00 175.26 175.85 2kly s MET 77 N -2.65 0.70 -0.29 4.30 -2.45 -1.26 -4.83 119.30 112.82 2kly s MET 77 Ca 0.65 -0.79 0.01 0.00 -1.25 0.00 0.00 55.69 54.32 2kly s MET 77 Cb -0.39 0.28 0.15 0.00 1.25 0.00 0.00 34.83 36.12 2kly s MET 77 CO 0.48 -0.20 0.37 0.12 1.05 0.00 0.00 175.02 176.85 2kly s PHE 78 N -3.00 -0.84 -0.13 4.11 5.36 -1.26 -5.02 117.98 117.20 2kly s PHE 78 Ca -0.02 0.16 -0.14 0.00 -0.96 0.00 0.00 56.93 55.97 2kly s PHE 78 Cb 0.01 -0.25 0.04 0.00 -0.34 0.00 0.00 43.02 42.48 2kly s PHE 78 CO -0.06 -0.97 0.39 -1.58 -1.46 0.00 0.00 175.22 171.54 2kly s HIS 79 N 2.48 -0.41 0.00 10.12 2.46 -1.26 -4.86 115.29 123.82 2kly s HIS 79 Ca 0.10 0.96 0.00 0.00 0.47 0.00 0.00 55.06 56.59 2kly s HIS 79 Cb -0.13 0.15 0.00 0.00 -0.13 0.00 0.00 32.58 32.47 2kly s HIS 79 CO -0.31 -0.25 0.92 -0.35 -2.47 0.00 0.00 174.74 172.28 2kly n PRO 80 N 2.60 0.46 -0.50 2.88 -0.04 -1.26 -1.57 135.00 137.58 2kly n PRO 80 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2kly n PRO 80 Cb 0.57 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 2kly n PRO 80 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2kly n ASN 81 N 1.75 0.00 -4.01 3.54 2.85 -1.26 -4.59 115.26 113.53 2kly n ASN 81 Ca 0.00 -1.03 -0.27 0.00 -0.11 0.00 0.00 54.58 53.17 2kly n ASN 81 Cb 0.23 -0.01 -0.17 0.00 1.24 0.00 0.00 39.78 41.08 2kly n ASN 81 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2kly s ILE 82 N 0.00 1.27 1.01 -1.44 -1.09 -0.61 -2.01 121.20 118.34 2kly s ILE 82 Ca 0.00 -0.51 -0.12 0.00 -2.23 0.00 0.00 60.65 57.79 2kly s ILE 82 Cb 0.00 -1.18 0.19 0.00 -1.58 0.00 0.00 42.46 39.89 2kly s ILE 82 CO 0.00 0.39 1.08 -0.31 -1.23 0.00 0.00 174.94 174.88 2kly s TYR 83 N 1.01 2.01 0.38 3.97 2.02 -0.09 -4.28 117.35 122.37 2kly s TYR 83 Ca -0.07 1.07 0.17 0.00 -0.37 0.00 0.00 57.07 57.86 2kly s TYR 83 Cb -0.15 -3.23 0.95 0.00 -0.40 0.00 0.00 41.96 39.13 2kly s TYR 83 CO -0.01 -2.97 1.91 -1.00 -1.57 0.00 0.00 175.55 171.91 2kly h PRO 84 N -1.96 0.00 -0.04 -1.71 0.13 -1.90 -0.47 132.00 126.05 2kly h PRO 84 Ca -0.55 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2kly h PRO 84 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2kly h PRO 84 CO 0.56 0.27 0.00 -0.40 -0.23 0.00 0.00 178.00 178.20 2kly n ASP 85 N -4.00 0.25 0.00 1.44 5.75 -1.26 -4.83 116.55 113.90 2kly n ASP 85 Ca -0.02 -1.88 0.00 0.00 -0.01 0.00 0.00 54.79 52.88 2kly n ASP 85 Cb 0.34 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 2kly n ASP 85 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2kly n GLY 86 N 0.63 1.39 3.65 6.12 0.00 -0.19 -4.70 105.19 112.10 2kly n GLY 86 Ca 0.04 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.60 2kly n GLY 86 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2kly n ARG 87 N -2.00 1.85 -3.30 1.61 0.63 -1.25 -1.48 116.66 112.72 2kly n ARG 87 Ca 0.00 0.66 -0.38 0.00 -0.92 0.00 0.00 57.85 57.21 2kly n ARG 87 Cb 0.00 -2.35 -0.06 0.00 0.45 0.00 0.00 32.46 30.50 2kly n ARG 87 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2kly s VAL 88 N 0.41 5.00 0.07 5.15 1.01 0.93 -0.91 120.40 132.06 2kly s VAL 88 Ca 0.76 1.08 0.08 0.00 0.00 0.00 0.00 61.98 63.89 2kly s VAL 88 Cb -0.73 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 31.77 2kly s VAL 88 CO 0.45 0.44 -0.21 0.00 0.00 0.00 0.00 175.10 175.77 2kly s ILE 90 N -0.97 0.01 0.18 0.00 -4.36 -1.26 -4.86 121.20 109.94 2kly s ILE 90 Ca 0.07 -0.05 -0.19 0.00 -0.26 0.00 0.00 60.65 60.22 2kly s ILE 90 Cb -0.09 -1.01 0.13 0.00 1.25 0.00 0.00 42.46 42.74 2kly s ILE 90 CO 0.03 -0.03 1.61 0.28 0.24 0.00 0.00 174.94 177.07 2kly h SER 91 N 2.14 -0.92 0.00 4.36 0.02 -1.86 -0.23 113.55 117.08 2kly h SER 91 Ca -0.33 0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2kly h SER 91 Cb 1.29 0.48 -0.00 0.00 0.14 0.00 0.00 62.40 64.31 2kly h SER 91 CO 0.39 -0.28 -0.00 -0.29 -1.14 0.00 0.00 176.83 175.51 2kly h ILE 92 N -0.14 0.90 -0.23 3.27 2.10 -1.89 0.21 117.51 121.72 2kly h ILE 92 Ca 0.23 -0.01 0.00 0.00 1.08 0.00 0.00 64.86 66.16 2kly h ILE 92 Cb 0.51 1.01 0.00 0.00 -1.09 0.00 0.00 36.82 37.25 2kly h ILE 92 CO -0.60 0.00 0.00 0.18 -1.08 0.00 0.00 178.15 176.65 2kly n LEU 93 N -4.38 2.06 -0.02 2.19 4.77 -0.11 -0.77 117.00 120.74 2kly n LEU 93 Ca -0.03 -1.04 0.00 0.00 -0.03 0.00 0.00 56.01 54.91 2kly n LEU 93 Cb 0.09 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 2kly n LEU 93 CO 0.33 0.37 0.00 1.41 -1.33 0.00 0.00 177.39 178.16 2kly n HIS 94 N 0.25 0.00 -2.70 -1.77 8.25 0.45 -4.81 115.22 114.89 2kly n HIS 94 Ca 0.09 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.49 2kly n HIS 94 Cb 0.41 -0.02 0.09 0.00 1.12 0.00 0.00 29.99 31.59 2kly n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2kly n ALA 95 N -0.01 -1.03 -1.67 -1.41 0.00 0.45 -2.00 120.51 114.84 2kly n ALA 95 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 53.44 52.37 2kly n ALA 95 Cb 0.01 -1.54 0.00 0.00 0.00 0.00 0.00 19.45 17.91 2kly n ALA 95 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2kly n PRO 96 N 0.07 3.22 -0.60 0.00 -0.04 -1.26 -3.75 135.00 132.65 2kly n PRO 96 Ca -0.03 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.37 2kly n PRO 96 Cb 0.74 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 34.11 2kly n PRO 96 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2kly n GLY 97 N 5.00 2.23 2.27 0.55 0.00 -1.26 -4.39 105.19 109.60 2kly n GLY 97 Ca 0.00 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 45.11 2kly n GLY 97 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kly n ASP 98 N 2.42 5.64 -2.35 1.61 2.03 -1.26 -4.93 116.55 119.72 2kly n ASP 98 Ca 0.22 -3.68 -0.04 0.00 0.52 0.00 0.00 54.79 51.81 2kly n ASP 98 Cb 0.55 -0.91 -0.03 0.00 -0.72 0.00 0.00 41.12 40.01 2kly n ASP 98 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2kly n ASP 99 N -1.02 -1.23 -4.47 1.67 2.03 -1.26 -3.43 116.55 108.84 2kly n ASP 99 Ca 0.61 1.04 -0.45 0.00 0.52 0.00 0.00 54.79 56.51 2kly n ASP 99 Cb 1.18 -4.30 -0.01 0.00 -0.72 0.00 0.00 41.12 37.27 2kly n ASP 99 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 2kly n PRO 100 N 1.24 0.59 0.00 -0.67 -0.02 -1.26 0.05 135.00 134.93 2kly n PRO 100 Ca -0.30 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 2kly n PRO 100 Cb 0.46 -1.40 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 2kly n PRO 100 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2kly n MET 101 N 0.83 0.00 0.00 -0.52 2.81 -1.26 -4.27 117.12 114.71 2kly n MET 101 Ca 0.13 0.00 0.14 0.00 -1.81 0.00 0.00 57.70 56.16 2kly n MET 101 Cb 0.32 -0.07 0.80 0.00 -0.71 0.00 0.00 33.22 33.55 2kly n MET 101 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2kly n GLY 102 N 0.00 -0.95 0.17 3.03 0.00 -0.71 -4.82 105.19 101.91 2kly n GLY 102 Ca 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 2kly n GLY 102 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2kly n TYR 103 N -1.07 -3.07 -0.95 1.61 0.18 0.11 -4.87 117.16 109.10 2kly n TYR 103 Ca 0.19 -0.05 0.13 0.00 1.88 0.00 0.00 57.90 60.05 2kly n TYR 103 Cb 0.12 -0.06 -0.03 0.00 -0.38 0.00 0.00 39.34 39.00 2kly n TYR 103 CO 0.00 0.00 0.00 -1.91 -2.08 0.00 0.00 176.86 172.87 2kly n GLU 104 N -1.64 -1.92 0.00 -3.48 0.00 -0.85 -4.79 120.64 107.96 2kly n GLU 104 Ca 0.01 1.28 0.00 0.00 0.00 0.00 0.00 57.16 58.45 2kly n GLU 104 Cb 0.03 -2.34 0.00 0.00 0.00 0.00 0.00 31.44 29.13 2kly n GLU 104 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2kly n SER 105 N -3.17 0.00 -1.00 4.31 2.88 -1.26 -2.87 113.62 112.51 2kly n SER 105 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 2kly n SER 105 Cb 0.43 0.00 0.24 0.00 -0.75 0.00 0.00 64.21 64.14 2kly n SER 105 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2kly n SER 106 N 2.30 3.65 -4.65 -3.46 3.41 -1.26 -4.94 113.62 108.66 2kly n SER 106 Ca 0.00 -2.25 -0.43 0.00 -0.26 0.00 0.00 58.87 55.93 2kly n SER 106 Cb 0.00 -0.40 -0.02 0.00 -0.26 0.00 0.00 64.21 63.53 2kly n SER 106 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kly s ALA 107 N -1.47 3.59 -0.34 7.33 0.00 -1.14 -4.98 121.76 124.76 2kly s ALA 107 Ca 0.37 0.28 -0.29 0.00 0.00 0.00 0.00 51.96 52.31 2kly s ALA 107 Cb 0.22 -3.64 -0.00 0.00 0.00 0.00 0.00 23.12 19.70 2kly s ALA 107 CO 0.20 -1.30 1.45 -1.21 0.00 0.00 0.00 175.76 174.89 2kly s GLU 108 N 3.59 3.68 0.20 0.00 2.02 -1.26 -4.48 118.70 122.45 2kly s GLU 108 Ca 0.52 1.18 0.00 0.00 0.02 0.00 0.00 54.97 56.69 2kly s GLU 108 Cb -0.18 -4.00 0.00 0.00 0.10 0.00 0.00 34.13 30.04 2kly s GLU 108 CO 0.15 -1.43 0.00 0.54 0.02 0.00 0.00 175.26 174.54 2kly n ARG 109 N 7.84 0.00 -2.18 1.61 5.12 -1.26 -4.96 116.66 122.83 2kly n ARG 109 Ca 0.17 0.00 -0.40 0.00 -1.93 0.00 0.00 57.85 55.69 2kly n ARG 109 Cb 0.47 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.75 2kly n ARG 109 CO 0.00 0.00 0.00 -0.46 -1.93 0.00 0.00 177.63 175.24 2kly s TRP 110 N -1.41 3.12 0.34 -1.55 -0.11 0.05 -4.87 118.94 114.51 2kly s TRP 110 Ca 0.00 1.47 -0.07 0.00 1.22 0.00 0.00 56.10 58.71 2kly s TRP 110 Cb 0.00 -3.60 0.03 0.00 -1.50 0.00 0.00 33.47 28.40 2kly s TRP 110 CO 0.00 -1.63 0.58 0.43 -4.62 0.00 0.00 176.95 171.71 2kly n SER 111 N 0.79 -1.66 0.26 5.86 7.64 -1.26 -4.99 113.62 120.26 2kly n SER 111 Ca 0.00 -2.60 0.18 0.00 1.01 0.00 0.00 58.87 57.46 2kly n SER 111 Cb 0.43 2.90 0.92 0.00 -1.01 0.00 0.00 64.21 67.44 2kly n SER 111 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2kly h PRO 112 N 0.00 0.00 -0.60 1.43 0.11 -1.92 -3.05 132.00 127.97 2kly h PRO 112 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2kly h PRO 112 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2kly h PRO 112 CO 0.36 0.00 0.00 1.55 -0.21 0.00 0.00 178.00 179.70 2kly n VAL 113 N -2.78 2.15 0.04 3.15 3.14 -1.26 -4.39 118.33 118.38 2kly n VAL 113 Ca -0.02 -1.31 -0.01 0.00 -2.96 0.00 0.00 64.34 60.05 2kly n VAL 113 Cb 0.10 -0.01 -0.07 0.00 -1.06 0.00 0.00 33.84 32.80 2kly n VAL 113 CO 0.00 0.00 0.00 1.56 -6.46 0.00 0.00 176.83 171.93 2kly h GLN 114 N 3.89 0.00 -2.91 1.45 7.50 -1.92 -3.50 115.11 119.62 2kly h GLN 114 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2kly h GLN 114 Cb 1.61 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.14 2kly h GLN 114 CO 0.31 0.37 -0.23 -1.13 -1.50 0.00 0.00 178.83 176.65 2kly n SER 115 N -2.97 -2.17 -0.17 1.46 3.41 -1.26 -3.39 113.62 108.52 2kly n SER 115 Ca -0.08 0.73 0.24 0.00 -0.26 0.00 0.00 58.87 59.51 2kly n SER 115 Cb 0.85 -2.37 0.66 0.00 -0.26 0.00 0.00 64.21 63.08 2kly n SER 115 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2kly h VAL 116 N 1.77 0.62 0.13 -3.33 -1.51 -1.97 0.13 116.25 112.10 2kly h VAL 116 Ca 0.00 -0.04 -0.01 0.00 -1.23 0.00 0.00 66.70 65.42 2kly h VAL 116 Cb 0.00 0.49 0.00 0.00 -2.13 0.00 0.00 31.29 29.66 2kly h VAL 116 CO 0.00 0.02 -0.06 -0.08 -1.23 0.00 0.00 177.57 176.22 2kly h GLU 117 N 0.12 -0.17 -0.80 5.19 4.81 -1.93 -1.56 114.58 120.24 2kly h GLU 117 Ca 0.41 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.70 2kly h GLU 117 Cb 1.43 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.80 2kly h GLU 117 CO -0.05 0.24 0.52 0.87 -0.73 0.00 0.00 179.01 179.86 2kly h LYS 118 N -0.65 0.91 0.35 1.92 1.57 -1.27 0.20 116.57 119.60 2kly h LYS 118 Ca -0.02 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2kly h LYS 118 Cb 0.49 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2kly h LYS 118 CO 0.03 0.60 -0.17 0.82 -0.57 0.00 0.00 179.45 180.16 2kly h ILE 119 N 0.94 0.65 -0.10 1.86 2.04 -0.80 -2.11 117.51 119.99 2kly h ILE 119 Ca 0.33 -0.00 -0.07 0.00 1.00 0.00 0.00 64.86 66.12 2kly h ILE 119 Cb 0.12 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2kly h ILE 119 CO -0.10 0.00 -0.25 -0.07 0.00 0.00 0.00 178.15 177.72 2kly h LEU 120 N -0.48 0.17 -0.94 1.44 4.07 -0.59 0.29 115.31 119.28 2kly h LEU 120 Ca -0.05 -0.05 -0.07 0.00 0.08 0.00 0.00 57.88 57.80 2kly h LEU 120 Cb 0.37 -0.05 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 2kly h LEU 120 CO 0.08 0.43 0.06 -0.07 -1.08 0.00 0.00 178.44 177.86 2kly h LEU 121 N 0.16 0.80 -0.81 1.67 -0.00 -0.90 0.81 115.31 117.03 2kly h LEU 121 Ca 0.03 -0.17 -0.10 0.00 -0.00 0.00 0.00 57.88 57.63 2kly h LEU 121 Cb 0.54 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 40.97 2kly h LEU 121 CO 0.04 0.83 -0.23 -1.28 -0.00 0.00 0.00 178.44 177.79 2kly h SER 122 N 0.80 0.64 -0.03 -0.43 0.87 -0.50 -1.79 113.55 113.11 2kly h SER 122 Ca 0.16 -0.22 -0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2kly h SER 122 Cb 0.39 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2kly h SER 122 CO 0.01 0.86 0.01 0.58 -0.53 0.00 0.00 176.83 177.76 2kly h VAL 123 N 0.56 1.13 -0.55 2.23 2.07 -0.27 0.04 116.25 121.46 2kly h VAL 123 Ca 0.08 -0.39 0.05 0.00 0.82 0.00 0.00 66.70 67.27 2kly h VAL 123 Cb 0.70 1.34 -0.05 0.00 -1.52 0.00 0.00 31.29 31.76 2kly h VAL 123 CO 0.05 0.10 0.28 0.58 0.02 0.00 0.00 177.57 178.60 2kly h VAL 124 N -0.12 0.93 -0.30 2.57 2.07 -0.76 0.19 116.25 120.84 2kly h VAL 124 Ca 0.01 -0.18 -0.09 0.00 0.82 0.00 0.00 66.70 67.26 2kly h VAL 124 Cb 0.16 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2kly h VAL 124 CO -0.00 0.10 -0.18 0.28 0.02 0.00 0.00 177.57 177.79 2kly h SER 125 N 0.52 0.53 -0.15 0.57 0.02 -1.19 0.40 113.55 114.25 2kly h SER 125 Ca 0.25 -0.16 -0.10 0.00 -0.84 0.00 0.00 61.79 60.94 2kly h SER 125 Cb 0.18 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2kly h SER 125 CO -0.18 0.72 -0.23 -0.03 -1.14 0.00 0.00 176.83 175.97 2kly h MET 126 N 0.48 0.60 0.03 3.45 1.85 -0.22 -1.48 114.93 119.65 2kly h MET 126 Ca 0.08 -0.23 -0.24 0.00 -0.61 0.00 0.00 59.70 58.71 2kly h MET 126 Cb 0.59 -0.03 0.00 0.00 0.43 0.00 0.00 31.60 32.59 2kly h MET 126 CO 0.04 0.78 -1.01 -0.07 -0.40 0.00 0.00 176.91 176.25 2kly h LEU 127 N 0.53 0.49 -0.26 3.39 3.38 -0.36 -3.02 115.31 119.45 2kly h LEU 127 Ca 0.08 -0.42 -0.16 0.00 0.09 0.00 0.00 57.88 57.47 2kly h LEU 127 Cb 0.68 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2kly h LEU 127 CO 0.05 1.24 -0.77 0.00 0.09 0.00 0.00 178.44 179.05 2kly h ALA 128 N 0.72 0.61 -2.87 1.53 0.00 -0.87 -3.40 119.26 114.97 2kly h ALA 128 Ca -0.09 -0.70 -0.58 0.00 0.00 0.00 0.00 54.91 53.54 2kly h ALA 128 Cb 1.67 -0.12 -0.40 0.00 0.00 0.00 0.00 17.79 18.94 2kly h ALA 128 CO 0.17 0.96 -0.78 -2.00 0.00 0.00 0.00 179.25 177.60 2kly s GLU 129 N -3.04 0.67 -0.35 0.00 2.56 -0.56 -4.82 118.70 113.16 2kly s GLU 129 Ca 0.01 -1.22 -0.33 0.00 0.00 0.00 0.00 54.97 53.43 2kly s GLU 129 Cb 0.10 -1.68 -0.10 0.00 2.00 0.00 0.00 34.13 34.46 2kly s GLU 129 CO 0.78 -1.10 2.24 -2.30 -0.56 0.00 0.00 175.26 174.32 2kly n PRO 130 N 4.43 1.26 -0.47 4.30 -0.02 -1.14 -4.47 135.00 138.89 2kly n PRO 130 Ca 0.03 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2kly n PRO 130 Cb 0.39 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 2kly n PRO 130 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2kly n ASN 131 N 10.83 0.00 0.00 2.55 2.85 -1.26 -4.93 115.26 125.30 2kly n ASN 131 Ca 0.39 -0.30 0.00 0.00 -0.11 0.00 0.00 54.58 54.56 2kly n ASN 131 Cb 0.30 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.32 2kly n ASN 131 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2kly n ASP 132 N -0.13 0.00 0.00 1.20 -0.08 -1.26 -4.83 116.55 111.45 2kly n ASP 132 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2kly n ASP 132 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2kly n ASP 132 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2kly n GLU 133 N -2.00 0.00 -3.05 -0.67 2.13 -1.26 -4.75 120.64 111.04 2kly n GLU 133 Ca 0.00 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.74 2kly n GLU 133 Cb 0.00 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.72 2kly n GLU 133 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2kly n SER 134 N 6.95 -7.05 -2.22 4.31 7.64 -1.26 -4.36 113.62 117.63 2kly n SER 134 Ca 0.00 0.65 -0.11 0.00 1.01 0.00 0.00 58.87 60.42 2kly n SER 134 Cb 0.00 -3.32 -0.12 0.00 -1.01 0.00 0.00 64.21 59.76 2kly n SER 134 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kly n GLY 135 N 0.63 2.67 0.00 0.23 0.00 -1.26 -4.28 105.19 103.18 2kly n GLY 135 Ca 0.00 -0.97 0.12 0.00 0.00 0.00 0.00 46.02 45.18 2kly n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kly n ALA 136 N 2.73 2.28 -3.37 4.61 0.00 -1.26 -4.41 120.51 121.09 2kly n ALA 136 Ca 0.36 -0.12 -0.16 0.00 0.00 0.00 0.00 53.44 53.52 2kly n ALA 136 Cb 0.67 -1.40 -0.08 0.00 0.00 0.00 0.00 19.45 18.64 2kly n ALA 136 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2kly s ASN 137 N -2.47 1.22 0.14 0.00 3.84 -1.26 -4.23 114.94 112.18 2kly s ASN 137 Ca 0.26 -1.25 -0.13 0.00 0.21 0.00 0.00 52.86 51.95 2kly s ASN 137 Cb 0.17 0.60 -0.01 0.00 -0.55 0.00 0.00 41.25 41.45 2kly s ASN 137 CO 0.36 -0.30 1.54 0.58 -2.79 0.00 0.00 177.10 176.49 2kly h VAL 138 N 5.48 1.27 -0.67 -5.21 2.07 -1.94 -1.73 116.25 115.52 2kly h VAL 138 Ca -0.01 -1.23 0.04 0.00 0.82 0.00 0.00 66.70 66.31 2kly h VAL 138 Cb 1.07 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 2kly h VAL 138 CO 0.24 0.42 0.41 -0.78 0.02 0.00 0.00 177.57 177.88 2kly h ASP 139 N 0.67 0.65 0.12 0.57 3.58 -1.98 0.39 116.42 120.43 2kly h ASP 139 Ca 0.11 0.01 -0.23 0.00 0.42 0.00 0.00 57.03 57.33 2kly h ASP 139 Cb 0.66 -0.13 0.01 0.00 1.72 0.00 0.00 39.33 41.59 2kly h ASP 139 CO 0.05 0.45 -0.92 0.00 -2.88 0.00 0.00 179.24 175.93 2kly h ALA 140 N 1.30 0.30 -0.02 -0.78 0.00 -1.88 -2.60 119.26 115.59 2kly h ALA 140 Ca 0.28 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2kly h ALA 140 Cb 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2kly h ALA 140 CO -0.12 0.74 -0.02 1.03 0.00 0.00 0.00 179.25 180.88 2kly h SER 141 N 0.35 0.05 0.22 0.00 0.87 -0.75 0.03 113.55 114.32 2kly h SER 141 Ca -0.09 -0.46 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 2kly h SER 141 Cb 1.55 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.48 2kly h SER 141 CO 0.17 0.50 -0.20 0.50 -0.53 0.00 0.00 176.83 177.28 2kly h LYS 142 N -0.40 -0.43 -0.33 2.24 3.64 -0.34 -0.09 116.57 120.87 2kly h LYS 142 Ca 0.00 0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2kly h LYS 142 Cb 0.49 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 2kly h LYS 142 CO 0.00 -0.29 0.19 1.98 -2.27 0.00 0.00 179.45 179.07 2kly h MET 143 N -0.44 0.46 -0.65 1.90 4.05 -1.51 0.28 114.93 119.01 2kly h MET 143 Ca -0.00 -0.05 0.12 0.00 -0.28 0.00 0.00 59.70 59.48 2kly h MET 143 Cb 0.41 -0.09 -0.08 0.00 -0.80 0.00 0.00 31.60 31.03 2kly h MET 143 CO -0.04 0.36 0.22 2.35 0.23 0.00 0.00 176.91 180.03 2kly h TRP 144 N 0.43 0.37 0.00 1.39 2.91 -0.73 0.39 115.95 120.70 2kly h TRP 144 Ca 0.12 0.03 -0.21 0.00 1.13 0.00 0.00 58.89 59.96 2kly h TRP 144 Cb 0.03 -0.06 -0.03 0.00 -0.51 0.00 0.00 29.16 28.58 2kly h TRP 144 CO -0.04 0.04 -1.12 0.00 -1.03 0.00 0.00 178.44 176.30 2kly h ARG 145 N 0.37 0.00 0.00 2.65 3.08 -0.69 -3.18 114.38 116.61 2kly h ARG 145 Ca 0.34 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.39 2kly h ARG 145 Cb 0.49 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 2kly h ARG 145 CO -0.37 0.80 -0.14 0.22 -1.07 0.00 0.00 179.97 179.41 2kly h ASP 146 N 0.00 0.00 -3.44 7.04 3.58 -0.11 -3.44 116.42 120.05 2kly h ASP 146 Ca -0.08 -0.08 -0.61 0.00 0.42 0.00 0.00 57.03 56.68 2kly h ASP 146 Cb 1.77 0.00 -0.40 0.00 1.72 0.00 0.00 39.33 42.42 2kly h ASP 146 CO 0.11 0.61 -0.74 -0.62 -2.88 0.00 0.00 179.24 175.72 2kly s ASP 147 N -5.67 3.80 0.53 2.28 -1.08 0.14 -4.97 116.67 111.69 2kly s ASP 147 Ca -0.05 -2.37 0.19 0.00 -0.52 0.00 0.00 52.55 49.80 2kly s ASP 147 Cb 0.00 -1.03 1.32 0.00 -1.46 0.00 0.00 42.92 41.76 2kly s ASP 147 CO 0.11 -0.31 2.10 0.08 0.52 0.00 0.00 175.17 177.68 2kly h ARG 148 N 7.09 0.00 -0.63 4.34 0.11 -1.63 -1.50 114.38 122.16 2kly h ARG 148 Ca -0.04 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 59.96 2kly h ARG 148 Cb 0.95 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.01 2kly h ARG 148 CO 0.48 0.00 0.09 0.93 0.10 0.00 0.00 179.97 181.58 2kly h GLU 149 N 0.00 1.05 -0.84 0.08 5.08 -1.89 0.14 114.58 118.20 2kly h GLU 149 Ca 0.08 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2kly h GLU 149 Cb 0.32 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 2kly h GLU 149 CO -0.00 0.98 0.53 1.96 -1.00 0.00 0.00 179.01 181.48 2kly h GLN 150 N 0.96 1.12 -0.13 2.33 1.08 -1.61 -1.70 115.11 117.15 2kly h GLN 150 Ca 0.19 -0.08 -0.03 0.00 -1.45 0.00 0.00 58.65 57.28 2kly h GLN 150 Cb 0.44 -0.24 -0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2kly h GLN 150 CO 0.01 0.76 -0.03 0.35 -0.95 0.00 0.00 178.83 178.98 2kly h PHE 151 N 1.14 0.28 -0.32 2.96 3.57 -1.14 -2.83 116.94 120.61 2kly h PHE 151 Ca 0.30 -0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.81 2kly h PHE 151 Cb -0.09 -0.07 -0.07 0.00 2.79 0.00 0.00 35.95 38.51 2kly h PHE 151 CO 0.00 0.53 -0.12 1.88 -2.23 0.00 0.00 178.31 178.38 2kly h TYR 152 N -0.05 -0.28 -0.41 0.41 0.05 -0.31 0.27 116.97 116.65 2kly h TYR 152 Ca 0.03 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.80 2kly h TYR 152 Cb 0.44 0.17 -0.02 0.00 1.01 0.00 0.00 36.73 38.34 2kly h TYR 152 CO 0.05 -0.19 0.06 1.57 -1.05 0.00 0.00 178.16 178.60 2kly h LYS 153 N -0.06 0.69 -0.07 4.88 2.10 -1.36 -0.88 116.57 121.87 2kly h LYS 153 Ca 0.16 -0.19 -0.10 0.00 -2.00 0.00 0.00 60.65 58.52 2kly h LYS 153 Cb 0.30 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.54 2kly h LYS 153 CO -0.36 0.73 -0.40 0.82 -2.00 0.00 0.00 179.45 178.25 2kly h ILE 154 N 0.54 1.30 -0.37 0.07 2.04 -1.22 0.24 117.51 120.11 2kly h ILE 154 Ca 0.12 -1.44 -0.05 0.00 1.00 0.00 0.00 64.86 64.49 2kly h ILE 154 Cb 0.39 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 2kly h ILE 154 CO 0.01 0.43 0.05 0.00 0.00 0.00 0.00 178.15 178.63 2kly h ALA 155 N 1.47 0.49 -0.22 1.87 0.00 -0.03 0.41 119.26 123.25 2kly h ALA 155 Ca 0.01 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 2kly h ALA 155 Cb 0.76 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2kly h ALA 155 CO 0.06 0.20 -0.16 0.87 0.00 0.00 0.00 179.25 180.22 2kly h LYS 156 N 0.45 0.37 -0.35 0.00 1.57 -0.89 -0.74 116.57 116.99 2kly h LYS 156 Ca 0.11 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2kly h LYS 156 Cb 0.38 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 2kly h LYS 156 CO 0.01 0.54 0.22 0.37 -0.57 0.00 0.00 179.45 180.01 2kly h GLN 157 N 0.35 0.47 -0.41 3.15 4.15 -0.48 -0.89 115.11 121.44 2kly h GLN 157 Ca 0.06 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.40 2kly h GLN 157 Cb 0.50 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 2kly h GLN 157 CO 0.03 0.34 0.08 0.82 -1.93 0.00 0.00 178.83 178.18 2kly h ILE 158 N 0.46 1.19 -0.08 2.39 1.08 -0.41 -1.98 117.51 120.16 2kly h ILE 158 Ca 0.13 -0.71 0.02 0.00 -0.39 0.00 0.00 64.86 63.91 2kly h ILE 158 Cb -0.01 0.79 -0.02 0.00 -3.07 0.00 0.00 36.82 34.51 2kly h ILE 158 CO -0.02 0.25 -0.05 0.58 -0.69 0.00 0.00 178.15 178.22 2kly h VAL 159 N 0.60 0.84 -0.68 1.67 2.07 -0.34 -0.84 116.25 119.57 2kly h VAL 159 Ca 0.14 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.66 2kly h VAL 159 Cb 0.26 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 2kly h VAL 159 CO -0.00 0.00 0.42 1.56 0.02 0.00 0.00 177.57 179.57 2kly h GLN 160 N -0.05 0.92 -0.41 1.57 4.20 -0.85 0.16 115.11 120.65 2kly h GLN 160 Ca 0.05 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.72 2kly h GLN 160 Cb 0.12 -0.20 -0.04 0.00 0.30 0.00 0.00 27.48 27.67 2kly h GLN 160 CO -0.12 0.64 0.19 0.87 -0.67 0.00 0.00 178.83 179.75 2kly h LYS 161 N 0.93 0.38 0.00 1.46 1.57 -1.01 -0.99 116.57 118.91 2kly h LYS 161 Ca 0.25 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.89 2kly h LYS 161 Cb -0.05 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 2kly h LYS 161 CO -0.05 0.25 -0.52 0.77 -0.57 0.00 0.00 179.45 179.33 2kly h SER 162 N 0.39 0.00 0.96 0.86 0.02 -0.84 -3.28 113.55 111.66 2kly h SER 162 Ca 0.18 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.91 2kly h SER 162 Cb 0.10 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 2kly h SER 162 CO -0.13 0.52 -1.02 -0.07 -1.14 0.00 0.00 176.83 174.99 2kly h LEU 163 N 0.00 0.04 0.00 5.07 3.38 -0.10 -3.43 115.31 120.28 2kly h LEU 163 Ca -0.01 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2kly h LEU 163 Cb 1.23 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2kly h LEU 163 CO 0.07 1.03 0.00 0.61 0.09 0.00 0.00 178.44 180.24 2kly n GLY 164 N 1.37 0.63 0.89 0.83 0.00 -0.43 -5.04 105.19 103.44 2kly n GLY 164 Ca -0.01 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.47 2kly n GLY 164 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79