#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6k s LEU 23 N 0.00 3.39 -0.83 2.45 1.02 -0.11 -4.91 118.68 119.68 3h6k s LEU 23 Ca 0.00 -1.22 -0.21 0.00 0.02 0.00 0.00 54.13 52.72 3h6k s LEU 23 Cb 0.00 -2.57 -0.19 0.00 0.02 0.00 0.00 46.19 43.45 3h6k s LEU 23 CO 0.00 -1.95 2.20 -3.20 0.02 0.00 0.00 176.35 173.42 3h6k n ASN 24 N 10.71 0.80 -3.60 2.29 5.15 -1.26 -4.68 115.26 124.67 3h6k n ASN 24 Ca 0.36 -1.51 -0.03 0.00 -0.60 0.00 0.00 54.58 52.79 3h6k n ASN 24 Cb 0.49 -1.39 -0.02 0.00 -0.53 0.00 0.00 39.78 38.34 3h6k n ASN 24 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 3h6k s GLU 25 N 8.20 0.37 -0.06 1.20 2.12 -1.26 -5.16 118.70 124.11 3h6k s GLU 25 Ca 0.91 -0.16 -0.16 0.00 0.36 0.00 0.00 54.97 55.93 3h6k s GLU 25 Cb -0.24 0.16 -0.05 0.00 0.26 0.00 0.00 34.13 34.26 3h6k s GLU 25 CO 0.19 -0.17 0.41 -2.00 -0.54 0.00 0.00 175.26 173.16 3h6k s GLU 26 N -2.48 4.11 0.23 4.30 2.56 -1.26 -5.03 118.70 121.13 3h6k s GLU 26 Ca 0.10 0.37 -0.32 0.00 0.00 0.00 0.00 54.97 55.13 3h6k s GLU 26 Cb 0.00 -3.32 -0.12 0.00 2.00 0.00 0.00 34.13 32.69 3h6k s GLU 26 CO -0.05 0.45 1.67 0.34 -0.56 0.00 0.00 175.26 177.11 3h6k n PHE 27 N 2.70 2.73 -5.12 5.30 7.35 -1.26 -5.00 117.46 124.16 3h6k n PHE 27 Ca -0.11 0.13 -0.30 0.00 -0.76 0.00 0.00 57.45 56.40 3h6k n PHE 27 Cb 0.52 -2.64 -0.17 0.00 0.35 0.00 0.00 39.48 37.55 3h6k n PHE 27 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 3h6k s ARG 28 N 0.62 2.52 0.59 -4.13 0.52 -1.26 -5.02 118.95 112.79 3h6k s ARG 28 Ca 0.72 -0.81 0.29 0.00 -0.52 0.00 0.00 55.73 55.41 3h6k s ARG 28 Cb -0.52 -2.04 1.51 0.00 0.52 0.00 0.00 34.95 34.42 3h6k s ARG 28 CO 0.38 0.26 1.93 -1.35 0.02 0.00 0.00 175.30 176.54 3h6k h PRO 29 N 6.39 0.00 0.00 3.54 0.11 -1.99 0.40 132.00 140.44 3h6k h PRO 29 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3h6k h PRO 29 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3h6k h PRO 29 CO 0.47 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.65 3h6k n GLU 30 N -3.69 0.13 -0.08 1.05 4.71 -1.26 -2.50 120.64 118.99 3h6k n GLU 30 Ca 0.07 0.17 0.13 0.00 -0.01 0.00 0.00 57.16 57.52 3h6k n GLU 30 Cb 0.60 -1.67 0.52 0.00 -1.01 0.00 0.00 31.44 29.88 3h6k n GLU 30 CO 0.00 0.00 0.00 0.52 0.09 0.00 0.00 177.13 177.74 3h6k h MET 31 N 0.00 0.36 -0.02 3.49 2.86 -1.29 -2.31 114.93 118.01 3h6k h MET 31 Ca 0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3h6k h MET 31 Cb 0.54 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.12 3h6k h MET 31 CO 0.00 0.24 -0.05 1.28 1.06 0.00 0.00 176.91 179.44 3h6k n LEU 32 N -4.46 2.32 -4.72 1.22 4.77 -1.04 -4.81 117.00 110.28 3h6k n LEU 32 Ca 0.10 -0.78 -0.42 0.00 -0.03 0.00 0.00 56.01 54.88 3h6k n LEU 32 Cb 0.40 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 3h6k n LEU 32 CO 0.34 0.39 1.14 -1.58 -1.33 0.00 0.00 177.39 176.35 3h6k s GLN 33 N -2.06 4.27 0.00 3.23 0.74 -0.87 -2.22 119.66 122.75 3h6k s GLN 33 Ca 0.31 2.22 0.00 0.00 0.05 0.00 0.00 55.36 57.94 3h6k s GLN 33 Cb 0.20 -3.20 0.00 0.00 1.10 0.00 0.00 33.01 31.11 3h6k s GLN 33 CO 0.34 -0.52 0.00 0.41 -0.55 0.00 0.00 175.29 174.97 3h6k n GLY 34 N 3.57 0.32 3.74 2.59 0.00 -0.75 -4.93 105.19 109.73 3h6k n GLY 34 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 3h6k n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6k s LYS 35 N -0.85 4.56 -0.45 1.61 -0.14 -0.94 -4.67 119.74 118.86 3h6k s LYS 35 Ca 0.00 1.81 -0.20 0.00 -1.36 0.00 0.00 55.97 56.22 3h6k s LYS 35 Cb 0.00 -3.24 0.03 0.00 -1.68 0.00 0.00 37.83 32.94 3h6k s LYS 35 CO 0.00 0.03 0.61 0.15 -0.76 0.00 0.00 175.35 175.39 3h6k s LYS 36 N -0.56 3.23 -0.04 1.68 1.02 -1.26 -0.67 119.74 123.13 3h6k s LYS 36 Ca 0.50 -0.50 0.04 0.00 0.02 0.00 0.00 55.97 56.02 3h6k s LYS 36 Cb -0.31 -3.98 -0.00 0.00 -0.52 0.00 0.00 37.83 33.02 3h6k s LYS 36 CO 0.37 -1.02 -0.14 0.08 -0.92 0.00 0.00 175.35 173.72 3h6k s VAL 37 N 2.70 1.18 -0.11 3.17 1.01 -0.25 -0.52 120.40 127.59 3h6k s VAL 37 Ca 0.20 -0.58 -0.05 0.00 0.00 0.00 0.00 61.98 61.56 3h6k s VAL 37 Cb -0.15 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 3h6k s VAL 37 CO 0.17 0.35 0.07 -0.63 0.00 0.00 0.00 175.10 175.06 3h6k s ILE 38 N 0.10 4.94 -0.16 2.22 1.01 -0.25 -1.37 121.20 127.70 3h6k s ILE 38 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 60.65 60.60 3h6k s ILE 38 Cb -0.10 -3.13 0.04 0.00 0.01 0.00 0.00 42.46 39.28 3h6k s ILE 38 CO 0.01 0.60 -0.04 -0.69 0.00 0.00 0.00 174.94 174.83 3h6k s VAL 39 N -0.88 0.99 0.67 2.92 1.01 -0.57 -0.71 120.40 123.84 3h6k s VAL 39 Ca 0.13 -0.56 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 3h6k s VAL 39 Cb -0.12 -1.20 0.06 0.00 0.00 0.00 0.00 36.38 35.12 3h6k s VAL 39 CO 0.03 0.10 0.95 0.42 0.00 0.00 0.00 175.10 176.60 3h6k s THR 40 N 1.68 2.37 -1.15 3.92 -4.23 -0.40 -2.51 115.64 115.32 3h6k s THR 40 Ca 0.01 -0.40 -0.21 0.00 -1.18 0.00 0.00 61.69 59.91 3h6k s THR 40 Cb -0.15 -2.98 0.03 0.00 1.34 0.00 0.00 72.50 70.74 3h6k s THR 40 CO -0.07 0.00 0.40 0.61 -0.54 0.00 0.00 174.62 175.01 3h6k n GLY 41 N -2.77 -0.52 1.07 3.99 0.00 -0.88 -4.05 105.19 102.03 3h6k n GLY 41 Ca 0.09 0.24 0.06 0.00 0.00 0.00 0.00 46.02 46.41 3h6k n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6k n ALA 42 N -4.42 3.31 1.02 4.61 0.00 -0.19 -3.92 120.51 120.91 3h6k n ALA 42 Ca -0.16 -2.37 0.12 0.00 0.00 0.00 0.00 53.44 51.03 3h6k n ALA 42 Cb 0.53 -0.79 0.27 0.00 0.00 0.00 0.00 19.45 19.46 3h6k n ALA 42 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3h6k n SER 43 N -0.47 0.53 -1.30 0.00 3.41 -1.26 -3.70 113.62 110.83 3h6k n SER 43 Ca 0.24 -0.28 -0.01 0.00 -0.26 0.00 0.00 58.87 58.56 3h6k n SER 43 Cb 0.97 0.22 0.00 0.00 -0.26 0.00 0.00 64.21 65.14 3h6k n SER 43 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3h6k n LYS 44 N -1.43 0.14 0.00 4.33 2.85 -1.26 -4.79 118.16 117.99 3h6k n LYS 44 Ca 0.06 -0.28 0.00 0.00 -1.05 0.00 0.00 58.31 57.04 3h6k n LYS 44 Cb 0.34 0.36 0.00 0.00 -0.65 0.00 0.00 35.03 35.08 3h6k n LYS 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3h6k n GLY 45 N -0.09 1.35 0.28 2.58 0.00 -1.26 -1.51 105.19 106.54 3h6k n GLY 45 Ca -0.01 -0.35 0.04 0.00 0.00 0.00 0.00 46.02 45.70 3h6k n GLY 45 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3h6k h ILE 46 N 0.00 1.12 -0.11 -0.61 2.04 -1.89 -2.32 117.51 115.73 3h6k h ILE 46 Ca 0.00 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.48 3h6k h ILE 46 Cb 0.00 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 3h6k h ILE 46 CO 0.00 0.14 0.02 1.23 0.00 0.00 0.00 178.15 179.54 3h6k h GLY 47 N 0.53 0.12 0.66 5.37 0.00 -1.60 -0.68 103.07 107.47 3h6k h GLY 47 Ca 0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 3h6k h GLY 47 CO -0.01 0.00 -0.39 -0.09 0.00 0.00 0.00 176.54 176.05 3h6k h ARG 48 N 0.07 -0.82 -0.95 4.80 2.43 -0.74 -2.01 114.38 117.16 3h6k h ARG 48 Ca 0.05 0.06 0.14 0.00 -0.81 0.00 0.00 59.98 59.41 3h6k h ARG 48 Cb 0.04 0.19 -0.08 0.00 -0.42 0.00 0.00 29.97 29.70 3h6k h ARG 48 CO -0.06 -0.55 0.60 0.93 -1.51 0.00 0.00 179.97 179.38 3h6k h GLU 49 N -0.85 0.80 -0.39 0.20 4.39 -1.36 0.85 114.58 118.22 3h6k h GLU 49 Ca -0.04 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 3h6k h GLU 49 Cb 0.74 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 3h6k h GLU 49 CO -0.03 0.53 0.19 0.52 -1.16 0.00 0.00 179.01 179.06 3h6k h MET 50 N 0.82 0.56 -0.47 2.33 2.86 -0.98 -1.40 114.93 118.65 3h6k h MET 50 Ca 0.48 -0.08 0.01 0.00 -2.06 0.00 0.00 59.70 58.06 3h6k h MET 50 Cb 0.65 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 3h6k h MET 50 CO -0.25 0.48 0.30 0.00 1.06 0.00 0.00 176.91 178.50 3h6k h ALA 51 N 1.05 0.59 0.34 6.32 0.00 -0.13 0.17 119.26 127.61 3h6k h ALA 51 Ca 0.13 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3h6k h ALA 51 Cb 0.10 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3h6k h ALA 51 CO -0.02 0.01 -0.19 1.88 0.00 0.00 0.00 179.25 180.93 3h6k h TYR 52 N 0.60 -0.49 -0.42 0.00 0.05 -1.09 0.49 116.97 116.12 3h6k h TYR 52 Ca 0.18 -0.01 0.09 0.00 0.05 0.00 0.00 58.73 59.04 3h6k h TYR 52 Cb -0.03 0.17 -0.09 0.00 1.01 0.00 0.00 36.73 37.79 3h6k h TYR 52 CO -0.05 -0.30 -0.19 0.45 -1.05 0.00 0.00 178.16 177.01 3h6k h HIS 53 N -0.50 -0.49 -0.60 4.88 3.86 -0.99 0.78 115.15 122.10 3h6k h HIS 53 Ca -0.04 0.05 0.11 0.00 -1.16 0.00 0.00 60.37 59.33 3h6k h HIS 53 Cb 0.40 0.28 -0.04 0.00 1.06 0.00 0.00 27.41 29.11 3h6k h HIS 53 CO -0.07 -0.28 0.41 -0.07 0.86 0.00 0.00 177.93 178.78 3h6k h LEU 54 N -0.11 0.32 -0.10 2.43 3.38 -0.34 -1.96 115.31 118.92 3h6k h LEU 54 Ca 0.20 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.09 3h6k h LEU 54 Cb 0.43 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3h6k h LEU 54 CO -0.49 0.19 -0.31 0.00 0.09 0.00 0.00 178.44 177.92 3h6k h ALA 55 N 1.70 0.17 -0.05 1.53 0.00 0.13 -0.68 119.26 122.07 3h6k h ALA 55 Ca 0.28 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.78 3h6k h ALA 55 Cb 0.64 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3h6k h ALA 55 CO -0.07 0.21 0.05 0.87 0.00 0.00 0.00 179.25 180.31 3h6k h LYS 56 N -0.06 0.00 -0.23 0.00 1.57 -0.35 0.12 116.57 117.61 3h6k h LYS 56 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3h6k h LYS 56 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.25 3h6k h LYS 56 CO 0.07 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.62 3h6k n MET 57 N -3.98 1.84 -1.72 3.15 2.81 -0.97 -4.90 117.12 113.36 3h6k n MET 57 Ca -0.02 -1.28 -0.02 0.00 -1.81 0.00 0.00 57.70 54.57 3h6k n MET 57 Cb 0.14 -1.39 -0.00 0.00 -0.71 0.00 0.00 33.22 31.26 3h6k n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h6k n GLY 58 N 1.17 0.37 3.80 3.03 0.00 0.01 -3.05 105.19 110.52 3h6k n GLY 58 Ca 0.16 -0.85 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 3h6k n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6k s ALA 59 N -2.11 2.69 -0.14 4.61 0.00 -0.27 -1.81 121.76 124.74 3h6k s ALA 59 Ca 0.00 0.38 -0.26 0.00 0.00 0.00 0.00 51.96 52.08 3h6k s ALA 59 Cb 0.00 -3.24 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 3h6k s ALA 59 CO 0.00 -0.92 0.87 -1.01 0.00 0.00 0.00 175.76 174.70 3h6k s HIS 60 N -2.50 3.46 -0.10 0.00 3.76 0.15 -1.33 115.29 118.73 3h6k s HIS 60 Ca 0.63 1.35 0.03 0.00 -0.15 0.00 0.00 55.06 56.92 3h6k s HIS 60 Cb -0.16 -3.05 -0.00 0.00 1.11 0.00 0.00 32.58 30.48 3h6k s HIS 60 CO 0.39 -0.21 -0.22 0.08 -0.85 0.00 0.00 174.74 173.94 3h6k s VAL 61 N 2.01 2.28 -0.12 -0.90 1.01 0.12 -1.09 120.40 123.71 3h6k s VAL 61 Ca 0.41 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.46 3h6k s VAL 61 Cb -0.17 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 3h6k s VAL 61 CO 0.14 0.55 -0.18 -0.69 0.00 0.00 0.00 175.10 174.93 3h6k s VAL 62 N 0.27 2.55 0.16 2.92 1.01 -0.47 -0.97 120.40 125.87 3h6k s VAL 62 Ca -0.15 -0.84 0.09 0.00 0.00 0.00 0.00 61.98 61.08 3h6k s VAL 62 Cb -0.17 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 3h6k s VAL 62 CO 0.08 0.54 -0.14 0.68 0.00 0.00 0.00 175.10 176.25 3h6k s VAL 63 N 0.42 2.98 0.17 2.92 -7.23 -0.46 -1.51 120.40 117.69 3h6k s VAL 63 Ca -0.13 -1.66 -0.00 0.00 -1.81 0.00 0.00 61.98 58.38 3h6k s VAL 63 Cb -0.17 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 3h6k s VAL 63 CO 0.06 -0.05 0.06 0.28 -0.31 0.00 0.00 175.10 175.14 3h6k s THR 64 N -1.53 0.29 -1.40 5.32 -1.32 -1.04 -1.76 115.64 114.20 3h6k s THR 64 Ca 0.22 -1.95 0.00 0.00 -1.21 0.00 0.00 61.69 58.75 3h6k s THR 64 Cb -0.09 -2.21 0.00 0.00 -1.51 0.00 0.00 72.50 68.69 3h6k s THR 64 CO 0.13 -0.34 0.00 0.00 -2.21 0.00 0.00 174.62 172.20 3h6k n ALA 65 N -0.21 0.00 -0.13 11.08 0.00 -1.25 -1.02 120.51 128.99 3h6k n ALA 65 Ca -0.04 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.17 3h6k n ALA 65 Cb 0.64 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.98 3h6k n ALA 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h6k n ARG 66 N 0.00 0.63 -2.44 0.00 1.74 -1.21 -0.79 116.66 114.59 3h6k n ARG 66 Ca 0.00 0.22 -0.42 0.00 -0.77 0.00 0.00 57.85 56.88 3h6k n ARG 66 Cb 0.00 -1.53 -0.02 0.00 -1.02 0.00 0.00 32.46 29.89 3h6k n ARG 66 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3h6k s SER 67 N -6.97 6.29 0.34 0.55 0.01 -1.26 -4.19 113.70 108.48 3h6k s SER 67 Ca -0.36 0.40 0.05 0.00 1.31 0.00 0.00 55.95 57.36 3h6k s SER 67 Cb 0.11 -2.55 0.63 0.00 0.21 0.00 0.00 66.02 64.43 3h6k s SER 67 CO 0.56 -1.55 1.89 0.07 0.41 0.00 0.00 173.24 174.62 3h6k h LYS 68 N 10.51 0.52 0.77 12.44 2.10 -1.97 -1.95 116.57 138.99 3h6k h LYS 68 Ca -0.26 -0.10 -0.04 0.00 -2.00 0.00 0.00 60.65 58.25 3h6k h LYS 68 Cb 1.09 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.34 3h6k h LYS 68 CO 1.15 0.53 -0.42 1.49 -2.00 0.00 0.00 179.45 180.20 3h6k h GLU 69 N 0.50 -1.06 -0.07 0.07 4.81 -2.00 -0.28 114.58 116.54 3h6k h GLU 69 Ca 0.11 0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 3h6k h GLU 69 Cb 0.30 0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 3h6k h GLU 69 CO 0.01 -0.71 -0.06 1.79 -0.73 0.00 0.00 179.01 179.31 3h6k h THR 70 N -1.10 1.09 -0.19 0.32 1.35 -1.92 -2.72 112.91 109.73 3h6k h THR 70 Ca -0.10 -0.38 -0.02 0.00 -0.55 0.00 0.00 66.41 65.36 3h6k h THR 70 Cb 0.87 1.10 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 3h6k h THR 70 CO 0.14 0.12 0.04 -0.07 -0.25 0.00 0.00 175.52 175.50 3h6k h LEU 71 N 0.10 0.29 -0.41 3.87 3.38 -1.05 -2.80 115.31 118.69 3h6k h LEU 71 Ca 0.02 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.80 3h6k h LEU 71 Cb 0.17 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3h6k h LEU 71 CO 0.01 0.45 0.18 1.56 0.09 0.00 0.00 178.44 180.73 3h6k h GLN 72 N 0.12 0.37 -0.83 1.13 4.20 -0.75 -1.16 115.11 118.19 3h6k h GLN 72 Ca 0.06 -0.02 0.14 0.00 0.06 0.00 0.00 58.65 58.89 3h6k h GLN 72 Cb 0.27 -0.08 -0.09 0.00 0.30 0.00 0.00 27.48 27.88 3h6k h GLN 72 CO 0.00 0.24 0.42 -0.22 -0.67 0.00 0.00 178.83 178.61 3h6k h LYS 73 N 0.38 0.60 -0.56 1.46 3.64 -1.47 0.83 116.57 121.45 3h6k h LYS 73 Ca 0.18 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.46 3h6k h LYS 73 Cb 0.12 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 3h6k h LYS 73 CO -0.15 0.40 0.11 0.28 -2.27 0.00 0.00 179.45 177.82 3h6k h VAL 74 N 0.62 1.25 -0.23 2.00 2.07 -1.09 -2.42 116.25 118.45 3h6k h VAL 74 Ca 0.45 -0.94 -0.05 0.00 0.82 0.00 0.00 66.70 66.98 3h6k h VAL 74 Cb 0.62 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3h6k h VAL 74 CO -0.35 0.34 -0.07 0.58 0.02 0.00 0.00 177.57 178.08 3h6k h VAL 75 N 0.81 1.19 0.37 2.57 2.07 0.07 -1.23 116.25 122.10 3h6k h VAL 75 Ca 0.17 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 3h6k h VAL 75 Cb 0.39 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 3h6k h VAL 75 CO 0.01 0.25 -0.18 0.28 0.02 0.00 0.00 177.57 177.96 3h6k h SER 76 N 0.35 -0.42 0.05 0.57 0.02 -0.60 -2.64 113.55 110.88 3h6k h SER 76 Ca 0.07 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 3h6k h SER 76 Cb 0.36 0.11 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 3h6k h SER 76 CO 0.02 -0.24 -0.05 -0.74 -1.14 0.00 0.00 176.83 174.67 3h6k h HIS 77 N -0.56 0.00 -0.14 3.45 6.17 -0.94 -2.64 115.15 120.48 3h6k h HIS 77 Ca -0.05 0.00 -0.08 0.00 0.71 0.00 0.00 60.37 60.95 3h6k h HIS 77 Cb 0.42 0.00 -0.00 0.00 2.52 0.00 0.00 27.41 30.35 3h6k h HIS 77 CO -0.03 0.05 -0.23 0.00 0.71 0.00 0.00 177.93 178.43 3h6k h LEU 79 N 0.02 0.58 -0.12 0.00 3.38 -1.10 -2.41 115.31 115.66 3h6k h LEU 79 Ca 0.01 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.01 3h6k h LEU 79 Cb 0.80 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 3h6k h LEU 79 CO 0.05 0.42 -0.14 -0.33 0.09 0.00 0.00 178.44 178.52 3h6k h GLU 80 N 0.69 -0.18 0.00 1.13 5.08 -1.61 -2.68 114.58 117.01 3h6k h GLU 80 Ca 0.20 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3h6k h GLU 80 Cb -0.05 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3h6k h GLU 80 CO -0.06 -0.12 0.19 -0.07 -1.00 0.00 0.00 179.01 177.95 3h6k h LEU 81 N -0.18 0.00 0.00 1.33 3.38 -1.17 -3.43 115.31 115.24 3h6k h LEU 81 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3h6k h LEU 81 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3h6k h LEU 81 CO -0.23 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.91 3h6k n GLY 82 N -1.20 1.83 3.69 0.83 0.00 -1.01 -4.22 105.19 105.11 3h6k n GLY 82 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3h6k n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6k s ALA 83 N -2.00 3.64 0.59 4.61 0.00 -1.03 -4.09 121.76 123.48 3h6k s ALA 83 Ca 0.00 1.08 0.29 0.00 0.00 0.00 0.00 51.96 53.32 3h6k s ALA 83 Cb 0.00 -3.65 1.51 0.00 0.00 0.00 0.00 23.12 20.98 3h6k s ALA 83 CO 0.00 -1.01 1.93 0.00 0.00 0.00 0.00 175.76 176.68 3h6k h ALA 84 N 8.06 2.11 -1.35 0.00 0.00 -1.24 -3.42 119.26 123.42 3h6k h ALA 84 Ca -0.41 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 54.62 3h6k h ALA 84 Cb 1.19 0.03 -0.27 0.00 0.00 0.00 0.00 17.79 18.74 3h6k h ALA 84 CO 0.92 -0.64 0.68 -1.54 0.00 0.00 0.00 179.25 178.67 3h6k s SER 85 N -5.31 -0.25 -0.05 0.00 1.04 -1.22 -4.90 113.70 103.00 3h6k s SER 85 Ca -0.04 0.39 -0.02 0.00 0.48 0.00 0.00 55.95 56.76 3h6k s SER 85 Cb 0.15 0.37 0.03 0.00 0.10 0.00 0.00 66.02 66.68 3h6k s SER 85 CO 0.55 -0.15 0.12 0.00 0.98 0.00 0.00 173.24 174.74 3h6k s ALA 86 N -0.42 -0.19 0.10 5.32 0.00 -1.25 0.16 121.76 125.47 3h6k s ALA 86 Ca 0.04 0.58 -0.01 0.00 0.00 0.00 0.00 51.96 52.56 3h6k s ALA 86 Cb -0.03 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 3h6k s ALA 86 CO -0.07 -0.14 0.03 -1.01 0.00 0.00 0.00 175.76 174.57 3h6k s HIS 87 N 1.07 0.69 0.07 0.00 3.76 -0.15 -4.98 115.29 115.76 3h6k s HIS 87 Ca -0.08 -1.14 0.03 0.00 -0.15 0.00 0.00 55.06 53.71 3h6k s HIS 87 Cb -0.11 -0.42 -0.03 0.00 1.11 0.00 0.00 32.58 33.12 3h6k s HIS 87 CO -0.05 -0.47 -0.09 1.52 -0.85 0.00 0.00 174.74 174.81 3h6k s TYR 88 N -3.99 0.88 -0.03 1.40 -0.85 -1.26 -1.36 117.35 112.14 3h6k s TYR 88 Ca 0.16 -0.64 -0.01 0.00 -0.52 0.00 0.00 57.07 56.07 3h6k s TYR 88 Cb 0.08 -0.50 0.03 0.00 0.38 0.00 0.00 41.96 41.94 3h6k s TYR 88 CO -0.03 -0.06 0.06 0.42 -1.52 0.00 0.00 175.55 174.41 3h6k s ILE 89 N -2.19 -0.05 0.02 -3.49 1.01 -0.72 -4.94 121.20 110.85 3h6k s ILE 89 Ca 0.00 0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.86 3h6k s ILE 89 Cb -0.04 -0.12 -0.04 0.00 0.01 0.00 0.00 42.46 42.27 3h6k s ILE 89 CO -0.01 0.07 -0.02 0.00 0.00 0.00 0.00 174.94 174.99 3h6k s ALA 90 N 0.95 3.21 0.00 9.38 0.00 -1.26 -3.80 121.76 130.23 3h6k s ALA 90 Ca -0.08 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.87 3h6k s ALA 90 Cb -0.11 -1.24 0.00 0.00 0.00 0.00 0.00 23.12 21.77 3h6k s ALA 90 CO -0.03 0.65 0.00 0.41 0.00 0.00 0.00 175.76 176.79 3h6k n GLY 91 N 1.22 -0.06 3.53 0.00 0.00 0.03 -4.99 105.19 104.92 3h6k n GLY 91 Ca -0.14 -1.11 -0.34 0.00 0.00 0.00 0.00 46.02 44.44 3h6k n GLY 91 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3h6k s THR 92 N -2.00 3.60 -2.10 2.61 -1.32 -1.26 -3.34 115.64 111.83 3h6k s THR 92 Ca 0.00 -0.50 0.27 0.00 -1.21 0.00 0.00 61.69 60.25 3h6k s THR 92 Cb 0.00 -2.49 0.73 0.00 -1.51 0.00 0.00 72.50 69.22 3h6k s THR 92 CO 0.00 0.57 1.98 0.23 -2.21 0.00 0.00 174.62 175.18 3h6k n MET 93 N 2.65 1.16 0.21 7.08 0.00 -1.26 -2.13 117.12 124.82 3h6k n MET 93 Ca -0.18 -0.23 0.06 0.00 0.00 0.00 0.00 57.70 57.35 3h6k n MET 93 Cb 0.53 -1.44 0.54 0.00 0.00 0.00 0.00 33.22 32.85 3h6k n MET 93 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 3h6k h GLU 94 N 0.52 0.08 -4.95 0.03 5.08 -1.94 -3.40 114.58 110.00 3h6k h GLU 94 Ca 0.00 -0.01 -0.69 0.00 -1.00 0.00 0.00 59.36 57.66 3h6k h GLU 94 Cb 0.11 -0.01 -0.18 0.00 0.50 0.00 0.00 28.75 29.17 3h6k h GLU 94 CO 0.00 0.14 0.00 0.34 -1.00 0.00 0.00 179.01 178.49 3h6k s ASP 95 N -6.99 6.23 0.46 1.42 2.15 -0.91 -4.93 116.67 114.09 3h6k s ASP 95 Ca -0.05 -0.86 0.23 0.00 0.43 0.00 0.00 52.55 52.31 3h6k s ASP 95 Cb 0.16 -2.28 1.12 0.00 -0.30 0.00 0.00 42.92 41.62 3h6k s ASP 95 CO 0.69 -0.83 1.94 0.24 -0.17 0.00 0.00 175.17 177.04 3h6k h MET 96 N 8.94 0.00 -0.14 4.34 2.86 -1.85 -1.34 114.93 127.73 3h6k h MET 96 Ca -0.27 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.26 3h6k h MET 96 Cb 1.10 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 3h6k h MET 96 CO 0.93 0.22 -0.40 1.15 1.06 0.00 0.00 176.91 179.87 3h6k h THR 97 N 0.00 1.31 -0.31 2.22 2.02 -1.94 -1.33 112.91 114.88 3h6k h THR 97 Ca -0.00 -1.52 -0.17 0.00 0.77 0.00 0.00 66.41 65.48 3h6k h THR 97 Cb 0.55 1.64 -0.00 0.00 -1.74 0.00 0.00 68.15 68.59 3h6k h THR 97 CO 0.03 0.46 -0.49 0.15 0.37 0.00 0.00 175.52 176.04 3h6k h PHE 98 N 0.27 1.09 -0.23 3.16 3.57 -1.59 -2.70 116.94 120.51 3h6k h PHE 98 Ca 0.03 -0.37 0.06 0.00 3.53 0.00 0.00 57.97 61.21 3h6k h PHE 98 Cb 0.83 -0.21 -0.06 0.00 2.79 0.00 0.00 35.95 39.30 3h6k h PHE 98 CO 0.02 1.20 -0.18 0.00 -2.23 0.00 0.00 178.31 177.11 3h6k h ALA 99 N 0.70 -0.04 -0.21 2.41 0.00 -0.80 0.20 119.26 121.52 3h6k h ALA 99 Ca 0.03 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3h6k h ALA 99 Cb 1.09 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 3h6k h ALA 99 CO 0.11 -0.60 0.12 1.49 0.00 0.00 0.00 179.25 180.36 3h6k h GLU 100 N -0.18 0.24 0.00 0.00 4.81 -1.27 -3.00 114.58 115.17 3h6k h GLU 100 Ca 0.13 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 3h6k h GLU 100 Cb 0.38 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 3h6k h GLU 100 CO -0.34 0.16 -0.40 1.96 -0.73 0.00 0.00 179.01 179.66 3h6k h GLN 101 N 0.24 0.00 -0.03 1.92 4.20 -1.12 -3.04 115.11 117.28 3h6k h GLN 101 Ca 0.08 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.73 3h6k h GLN 101 Cb -0.00 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 3h6k h GLN 101 CO -0.04 0.40 -0.27 0.35 -0.67 0.00 0.00 178.83 178.60 3h6k h PHE 102 N 0.00 0.06 0.17 2.96 3.57 -0.82 -1.21 116.94 121.67 3h6k h PHE 102 Ca -0.00 -0.01 -0.32 0.00 3.53 0.00 0.00 57.97 61.17 3h6k h PHE 102 Cb 0.93 -0.01 0.01 0.00 2.79 0.00 0.00 35.95 39.66 3h6k h PHE 102 CO 0.00 0.32 -1.53 0.28 -2.23 0.00 0.00 178.31 175.16 3h6k h VAL 103 N 0.05 1.19 -0.46 1.41 2.07 -1.57 -1.31 116.25 117.62 3h6k h VAL 103 Ca 0.01 -2.75 -0.09 0.00 0.82 0.00 0.00 66.70 64.69 3h6k h VAL 103 Cb 0.51 2.86 -0.02 0.00 -1.52 0.00 0.00 31.29 33.12 3h6k h VAL 103 CO 0.04 0.84 -0.05 0.00 0.02 0.00 0.00 177.57 178.42 3h6k h ALA 104 N 0.34 0.63 -0.46 1.67 0.00 -1.53 -0.78 119.26 119.12 3h6k h ALA 104 Ca -0.25 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.30 3h6k h ALA 104 Cb 2.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 3h6k h ALA 104 CO 0.20 0.47 0.08 1.96 0.00 0.00 0.00 179.25 181.96 3h6k h GLN 105 N 0.69 0.76 -0.46 0.00 4.20 -1.26 -1.73 115.11 117.30 3h6k h GLN 105 Ca 0.12 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 3h6k h GLN 105 Cb 0.57 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 3h6k h GLN 105 CO 0.03 0.78 0.25 0.00 -0.67 0.00 0.00 178.83 179.22 3h6k h ALA 106 N 0.95 0.59 -0.56 3.87 0.00 -1.19 -2.23 119.26 120.67 3h6k h ALA 106 Ca 0.14 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.08 3h6k h ALA 106 Cb 0.38 -0.18 -0.11 0.00 0.00 0.00 0.00 17.79 17.88 3h6k h ALA 106 CO 0.01 0.11 -0.17 0.78 0.00 0.00 0.00 179.25 179.97 3h6k h GLY 107 N 0.60 0.33 -0.06 0.00 0.00 -0.91 -2.14 103.07 100.89 3h6k h GLY 107 Ca 0.16 0.23 0.02 0.00 0.00 0.00 0.00 47.33 47.74 3h6k h GLY 107 CO -0.03 -0.22 -0.44 0.50 0.00 0.00 0.00 176.54 176.35 3h6k h LYS 108 N -0.04 -0.49 0.00 4.80 1.57 -0.94 0.16 116.57 121.64 3h6k h LYS 108 Ca 0.27 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 3h6k h LYS 108 Cb 0.45 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.87 3h6k h LYS 108 CO -0.60 -0.33 0.15 -0.07 -0.57 0.00 0.00 179.45 178.03 3h6k h LEU 109 N -0.51 0.00 0.00 2.94 3.38 -0.81 -2.72 115.31 117.58 3h6k h LEU 109 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3h6k h LEU 109 Cb 0.57 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 3h6k h LEU 109 CO -0.33 0.00 -1.21 0.23 0.09 0.00 0.00 178.44 177.22 3h6k n MET 110 N -2.72 0.55 -1.30 1.13 2.81 -0.99 -5.02 117.12 111.57 3h6k n MET 110 Ca -0.02 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.83 3h6k n MET 110 Cb 0.20 -1.10 0.00 0.00 -0.71 0.00 0.00 33.22 31.61 3h6k n MET 110 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h6k n GLY 111 N 2.32 0.73 0.00 3.03 0.00 0.54 -4.97 105.19 106.84 3h6k n GLY 111 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3h6k n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6k n GLY 112 N -1.42 1.26 2.93 -0.02 0.00 -0.96 -5.05 105.19 101.93 3h6k n GLY 112 Ca 0.00 -1.97 -0.15 0.00 0.00 0.00 0.00 46.02 43.90 3h6k n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h6k s LEU 113 N 0.00 0.02 -0.27 0.99 2.96 -1.26 -4.70 118.68 116.42 3h6k s LEU 113 Ca 0.00 0.43 -0.06 0.00 -0.22 0.00 0.00 54.13 54.29 3h6k s LEU 113 Cb 0.00 0.48 -0.15 0.00 0.50 0.00 0.00 46.19 47.02 3h6k s LEU 113 CO 0.00 -0.22 -0.29 0.47 -1.32 0.00 0.00 176.35 174.99 3h6k n ASP 114 N 5.05 1.97 -3.93 3.68 8.00 0.33 -4.00 116.55 127.65 3h6k n ASP 114 Ca -0.11 0.09 -0.24 0.00 0.71 0.00 0.00 54.79 55.24 3h6k n ASP 114 Cb 0.50 -0.60 -0.17 0.00 -0.02 0.00 0.00 41.12 40.83 3h6k n ASP 114 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3h6k s MET 115 N -2.52 1.37 -0.26 -1.24 1.75 -0.95 0.12 119.30 117.57 3h6k s MET 115 Ca -0.37 -0.25 -0.06 0.00 -1.25 0.00 0.00 55.69 53.77 3h6k s MET 115 Cb 0.12 -1.32 -0.01 0.00 2.84 0.00 0.00 34.83 36.46 3h6k s MET 115 CO 0.55 -0.13 0.04 -1.17 -0.65 0.00 0.00 175.02 173.65 3h6k s LEU 116 N 1.22 3.43 -0.44 4.11 2.96 0.08 -1.09 118.68 128.95 3h6k s LEU 116 Ca -0.05 -0.48 -0.06 0.00 -0.22 0.00 0.00 54.13 53.33 3h6k s LEU 116 Cb -0.14 -1.85 0.11 0.00 0.50 0.00 0.00 46.19 44.82 3h6k s LEU 116 CO -0.02 -0.09 0.27 -0.63 -1.32 0.00 0.00 176.35 174.55 3h6k s ILE 117 N 1.52 3.73 -0.29 6.68 1.01 0.12 -0.34 121.20 133.62 3h6k s ILE 117 Ca 0.05 -1.92 -0.25 0.00 0.00 0.00 0.00 60.65 58.53 3h6k s ILE 117 Cb -0.16 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.82 3h6k s ILE 117 CO 0.01 -0.72 0.86 -0.76 0.00 0.00 0.00 174.94 174.32 3h6k s LEU 118 N 1.25 4.06 0.00 2.97 1.43 0.31 -1.27 118.68 127.43 3h6k s LEU 118 Ca 0.07 0.84 0.00 0.00 -1.03 0.00 0.00 54.13 54.00 3h6k s LEU 118 Cb -0.24 -3.20 0.00 0.00 0.03 0.00 0.00 46.19 42.78 3h6k s LEU 118 CO -0.02 -0.64 0.00 -3.20 0.23 0.00 0.00 176.35 172.71 3h6k n ASN 119 N 6.28 0.00 -4.75 2.29 5.15 -1.26 -1.58 115.26 121.38 3h6k n ASN 119 Ca 0.06 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.69 3h6k n ASN 119 Cb 0.48 0.00 0.04 0.00 -0.53 0.00 0.00 39.78 39.77 3h6k n ASN 119 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 3h6k s HIS 120 N -0.66 2.42 -0.02 1.20 -3.43 -1.26 -4.84 115.29 108.71 3h6k s HIS 120 Ca 0.00 1.54 -0.04 0.00 -0.80 0.00 0.00 55.06 55.75 3h6k s HIS 120 Cb 0.00 -3.41 0.00 0.00 -1.43 0.00 0.00 32.58 27.75 3h6k s HIS 120 CO 0.00 -2.09 0.10 0.96 -2.00 0.00 0.00 174.74 171.70 3h6k s ILE 121 N -1.78 0.05 0.54 -5.38 -4.36 -1.26 -4.71 121.20 104.30 3h6k s ILE 121 Ca 0.75 -0.39 -0.21 0.00 -0.26 0.00 0.00 60.65 60.54 3h6k s ILE 121 Cb -0.28 -0.27 -0.05 0.00 1.25 0.00 0.00 42.46 43.11 3h6k s ILE 121 CO 0.35 -0.21 1.26 1.07 0.24 0.00 0.00 174.94 177.64 3h6k n THR 122 N 2.25 3.69 -2.31 8.37 5.66 -1.26 -4.86 114.28 125.82 3h6k n THR 122 Ca -0.18 -0.50 -0.41 0.00 -3.05 0.00 0.00 64.05 59.91 3h6k n THR 122 Cb 0.57 -1.52 -0.03 0.00 -1.55 0.00 0.00 70.33 67.80 3h6k n THR 122 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 3h6k s ASN 123 N -0.96 7.00 0.19 1.09 0.01 -1.26 -5.00 114.94 116.02 3h6k s ASN 123 Ca 0.72 2.31 0.04 0.00 -0.71 0.00 0.00 52.86 55.22 3h6k s ASN 123 Cb -0.43 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 38.57 3h6k s ASN 123 CO 0.49 -0.44 -0.05 -0.89 -1.51 0.00 0.00 177.10 174.71 3h6k s THR 124 N -0.02 1.07 0.15 1.60 2.01 -1.26 -5.08 115.64 114.10 3h6k s THR 124 Ca 0.54 -2.04 -0.01 0.00 0.31 0.00 0.00 61.69 60.49 3h6k s THR 124 Cb -0.34 -2.09 0.00 0.00 0.01 0.00 0.00 72.50 70.08 3h6k s THR 124 CO 0.38 -0.54 0.21 -1.54 -0.69 0.00 0.00 174.62 172.44 3h6k n SER 125 N -0.30 -0.58 -4.54 3.53 3.41 -1.26 -4.94 113.62 108.93 3h6k n SER 125 Ca -0.08 -1.80 -0.42 0.00 -0.26 0.00 0.00 58.87 56.31 3h6k n SER 125 Cb 0.62 1.09 -0.08 0.00 -0.26 0.00 0.00 64.21 65.58 3h6k n SER 125 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h6k s LEU 126 N 0.00 4.43 -0.04 1.04 1.43 -1.26 -4.84 118.68 119.44 3h6k s LEU 126 Ca 0.12 -0.15 -0.08 0.00 -1.03 0.00 0.00 54.13 53.00 3h6k s LEU 126 Cb -0.00 -2.60 0.01 0.00 0.03 0.00 0.00 46.19 43.63 3h6k s LEU 126 CO 0.09 -0.55 0.18 0.20 0.23 0.00 0.00 176.35 176.50 3h6k s ASN 127 N 1.81 -0.11 0.20 2.29 -0.87 -1.02 -5.07 114.94 112.16 3h6k s ASN 127 Ca 0.19 0.14 -0.30 0.00 -1.57 0.00 0.00 52.86 51.31 3h6k s ASN 127 Cb -0.15 0.32 -0.09 0.00 -0.02 0.00 0.00 41.25 41.31 3h6k s ASN 127 CO 0.14 -0.22 1.38 -0.76 -2.57 0.00 0.00 177.10 175.08 3h6k s LEU 128 N -0.59 4.40 -0.09 0.60 1.43 -1.26 -3.91 118.68 119.26 3h6k s LEU 128 Ca -0.07 2.50 -0.30 0.00 -1.03 0.00 0.00 54.13 55.23 3h6k s LEU 128 Cb -0.04 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.54 3h6k s LEU 128 CO 0.01 -0.63 1.26 0.12 0.23 0.00 0.00 176.35 177.35 3h6k s PHE 129 N 0.29 2.99 0.02 0.29 5.36 -1.26 -4.88 117.98 120.79 3h6k s PHE 129 Ca 0.60 1.06 -0.03 0.00 -0.96 0.00 0.00 56.93 57.59 3h6k s PHE 129 Cb -0.39 -3.50 -0.01 0.00 -0.34 0.00 0.00 43.02 38.78 3h6k s PHE 129 CO 0.38 -1.67 -0.06 0.72 -1.46 0.00 0.00 175.22 173.13 3h6k n HIS 130 N 5.77 0.00 -1.10 10.12 8.25 -1.26 -4.98 115.22 132.02 3h6k n HIS 130 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 3h6k n HIS 130 Cb 0.45 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.48 3h6k n HIS 130 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3h6k n ASP 131 N -3.39 0.00 -4.58 0.41 9.92 -1.26 -5.01 116.55 112.64 3h6k n ASP 131 Ca -0.02 -1.00 -0.42 0.00 -0.53 0.00 0.00 54.79 52.81 3h6k n ASP 131 Cb 0.09 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.57 3h6k n ASP 131 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3h6k s ASP 132 N 0.00 6.73 0.35 -2.24 -1.08 -1.26 -4.61 116.67 114.55 3h6k s ASP 132 Ca 0.00 -2.34 0.26 0.00 -0.52 0.00 0.00 52.55 49.95 3h6k s ASP 132 Cb 0.00 -2.58 0.85 0.00 -1.46 0.00 0.00 42.92 39.73 3h6k s ASP 132 CO 0.00 -1.29 1.76 -0.29 0.52 0.00 0.00 175.17 175.87 3h6k h ILE 133 N 5.68 0.00 0.05 4.11 6.09 -1.99 -2.94 117.51 128.50 3h6k h ILE 133 Ca 0.42 -0.55 -0.26 0.00 -1.37 0.00 0.00 64.86 63.10 3h6k h ILE 133 Cb 0.88 1.49 0.01 0.00 0.47 0.00 0.00 36.82 39.67 3h6k h ILE 133 CO 1.45 0.00 -1.08 -0.74 -3.07 0.00 0.00 178.15 174.71 3h6k h HIS 134 N 0.00 0.80 0.00 2.19 2.76 -2.00 -2.45 115.15 116.45 3h6k h HIS 134 Ca 0.00 -0.47 -0.12 0.00 -2.20 0.00 0.00 60.37 57.58 3h6k h HIS 134 Cb 0.67 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.53 3h6k h HIS 134 CO 0.00 1.31 -0.57 1.25 -1.30 0.00 0.00 177.93 178.62 3h6k h HIS 135 N 0.26 0.00 -0.19 5.26 -0.00 -1.93 -2.14 115.15 116.42 3h6k h HIS 135 Ca -0.13 0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.17 3h6k h HIS 135 Cb 1.74 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 29.15 3h6k h HIS 135 CO 0.08 0.57 -0.17 0.28 -0.00 0.00 0.00 177.93 178.69 3h6k h VAL 136 N 0.00 1.33 -0.36 5.26 2.07 -1.50 -1.92 116.25 121.13 3h6k h VAL 136 Ca -0.01 -1.32 -0.04 0.00 0.82 0.00 0.00 66.70 66.16 3h6k h VAL 136 Cb 1.03 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 3h6k h VAL 136 CO 0.07 0.40 0.09 -0.09 0.02 0.00 0.00 177.57 178.06 3h6k h ARG 137 N 0.11 0.58 -0.35 1.57 2.43 -1.43 -1.64 114.38 115.65 3h6k h ARG 137 Ca 0.03 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3h6k h ARG 137 Cb 0.70 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 3h6k h ARG 137 CO 0.04 0.62 0.23 -0.22 -1.51 0.00 0.00 179.97 179.13 3h6k h LYS 138 N 0.44 0.45 -0.71 0.20 3.64 -1.40 0.12 116.57 119.30 3h6k h LYS 138 Ca 0.11 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.54 3h6k h LYS 138 Cb 0.30 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 31.96 3h6k h LYS 138 CO 0.00 0.30 0.39 0.77 -2.27 0.00 0.00 179.45 178.64 3h6k h SER 139 N 0.46 0.57 -0.77 4.20 0.02 -1.35 0.36 113.55 117.04 3h6k h SER 139 Ca 0.13 0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 61.06 3h6k h SER 139 Cb -0.05 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 3h6k h SER 139 CO -0.03 0.35 0.28 0.24 -1.14 0.00 0.00 176.83 176.53 3h6k h MET 140 N 0.70 1.18 -0.02 3.45 2.86 -0.32 0.44 114.93 123.22 3h6k h MET 140 Ca 0.33 -0.23 -0.02 0.00 -2.06 0.00 0.00 59.70 57.72 3h6k h MET 140 Cb 0.25 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.73 3h6k h MET 140 CO -0.21 0.98 -0.05 0.93 1.06 0.00 0.00 176.91 179.62 3h6k h GLU 141 N 1.14 0.06 0.01 1.72 4.39 -0.35 -0.25 114.58 121.30 3h6k h GLU 141 Ca 0.25 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.91 3h6k h GLU 141 Cb 0.26 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 3h6k h GLU 141 CO -0.01 0.67 -0.01 0.28 -1.16 0.00 0.00 179.01 178.78 3h6k h VAL 142 N -0.53 1.42 0.00 3.13 2.07 -0.97 -0.21 116.25 121.14 3h6k h VAL 142 Ca -0.00 -1.97 0.00 0.00 0.82 0.00 0.00 66.70 65.55 3h6k h VAL 142 Cb 0.67 2.63 0.00 0.00 -1.52 0.00 0.00 31.29 33.08 3h6k h VAL 142 CO 0.01 0.46 0.00 0.78 0.02 0.00 0.00 177.57 178.85 3h6k h ASN 143 N -0.96 0.00 0.00 0.57 2.35 -1.08 -3.39 115.58 113.07 3h6k h ASN 143 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3h6k h ASN 143 Cb 0.77 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.14 3h6k h ASN 143 CO 0.00 0.00 0.00 0.33 -1.65 0.00 0.00 177.43 176.11 3h6k n PHE 144 N -2.33 -1.28 -0.11 1.19 7.35 -1.08 -4.79 117.46 116.41 3h6k n PHE 144 Ca 0.02 0.23 -0.05 0.00 -0.76 0.00 0.00 57.45 56.88 3h6k n PHE 144 Cb 0.24 0.50 0.01 0.00 0.35 0.00 0.00 39.48 40.58 3h6k n PHE 144 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 3h6k h LEU 145 N 0.00 -0.30 -1.92 -2.13 5.85 -0.93 -0.51 115.31 115.36 3h6k h LEU 145 Ca 0.00 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.86 3h6k h LEU 145 Cb 0.00 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 3h6k h LEU 145 CO 0.00 -0.10 0.13 0.77 -0.34 0.00 0.00 178.44 178.90 3h6k h SER 146 N 0.02 0.09 -0.63 1.25 4.64 -1.23 0.11 113.55 117.80 3h6k h SER 146 Ca 0.18 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.48 3h6k h SER 146 Cb 0.27 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 3h6k h SER 146 CO -0.36 0.06 0.31 1.88 -0.87 0.00 0.00 176.83 177.85 3h6k h TYR 147 N 0.11 0.90 -0.42 4.77 -1.99 -1.32 0.81 116.97 119.82 3h6k h TYR 147 Ca 0.08 -0.04 -0.03 0.00 2.00 0.00 0.00 58.73 60.75 3h6k h TYR 147 Cb 0.20 -0.28 -0.02 0.00 2.00 0.00 0.00 36.73 38.63 3h6k h TYR 147 CO -0.00 0.67 0.15 0.28 -0.00 0.00 0.00 178.16 179.26 3h6k h VAL 148 N 0.86 1.17 0.09 -2.88 2.07 -0.39 0.42 116.25 117.60 3h6k h VAL 148 Ca 0.22 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 3h6k h VAL 148 Cb 0.10 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 3h6k h VAL 148 CO -0.03 0.21 -0.05 0.58 0.02 0.00 0.00 177.57 178.30 3h6k h VAL 149 N 0.59 1.14 -0.64 2.57 2.07 -0.17 -1.77 116.25 120.05 3h6k h VAL 149 Ca 0.14 -1.11 0.12 0.00 0.82 0.00 0.00 66.70 66.67 3h6k h VAL 149 Cb 0.15 1.83 -0.09 0.00 -1.52 0.00 0.00 31.29 31.66 3h6k h VAL 149 CO -0.01 0.26 0.18 -0.07 0.02 0.00 0.00 177.57 177.95 3h6k h LEU 150 N -0.66 0.09 -0.52 2.57 3.38 -0.84 -0.04 115.31 119.28 3h6k h LEU 150 Ca -0.01 0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.10 3h6k h LEU 150 Cb 0.53 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 3h6k h LEU 150 CO 0.02 0.04 0.29 0.74 0.09 0.00 0.00 178.44 179.63 3h6k h THR 151 N 0.32 1.01 -0.60 0.22 2.02 -0.80 0.08 112.91 115.16 3h6k h THR 151 Ca 0.34 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 67.29 3h6k h THR 151 Cb 0.50 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.27 3h6k h THR 151 CO -0.40 0.10 0.25 0.58 0.37 0.00 0.00 175.52 176.43 3h6k h VAL 152 N 0.57 1.23 -0.88 3.16 2.07 -0.63 -0.44 116.25 121.34 3h6k h VAL 152 Ca 0.22 -0.69 0.09 0.00 0.82 0.00 0.00 66.70 67.15 3h6k h VAL 152 Cb 0.07 0.56 -0.07 0.00 -1.52 0.00 0.00 31.29 30.33 3h6k h VAL 152 CO -0.12 0.27 0.52 0.00 0.02 0.00 0.00 177.57 178.26 3h6k h ALA 153 N 1.10 1.26 0.00 1.67 0.00 -0.34 -3.20 119.26 119.74 3h6k h ALA 153 Ca 0.20 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 3h6k h ALA 153 Cb 0.18 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3h6k h ALA 153 CO -0.02 0.17 -1.30 0.00 0.00 0.00 0.00 179.25 178.10 3h6k h ALA 154 N 1.47 0.62 -0.56 0.00 0.00 -0.59 -3.40 119.26 116.78 3h6k h ALA 154 Ca 0.42 -0.63 0.10 0.00 0.00 0.00 0.00 54.91 54.80 3h6k h ALA 154 Cb 0.35 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 3h6k h ALA 154 CO -0.24 0.68 0.12 1.25 0.00 0.00 0.00 179.25 181.06 3h6k h LEU 155 N 0.00 0.01 -0.50 0.00 5.85 -1.08 -0.16 115.31 119.42 3h6k h LEU 155 Ca -0.12 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.76 3h6k h LEU 155 Cb 1.43 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 42.52 3h6k h LEU 155 CO 0.03 0.02 -0.51 -0.65 -0.34 0.00 0.00 178.44 177.00 3h6k h PRO 156 N 0.26 -0.26 -0.46 5.25 0.11 -1.78 0.94 132.00 136.06 3h6k h PRO 156 Ca 0.29 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.40 3h6k h PRO 156 Cb 0.41 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 3h6k h PRO 156 CO -0.37 -0.17 0.22 0.52 -0.21 0.00 0.00 178.00 177.99 3h6k h MET 157 N -0.27 0.63 0.00 1.05 2.86 -1.61 -2.52 114.93 115.08 3h6k h MET 157 Ca 0.08 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 3h6k h MET 157 Cb 0.49 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 3h6k h MET 157 CO -0.62 0.49 -0.31 -0.07 1.06 0.00 0.00 176.91 177.47 3h6k h LEU 158 N 0.64 0.00 -0.14 1.22 3.38 -0.18 -2.77 115.31 117.45 3h6k h LEU 158 Ca 0.16 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.96 3h6k h LEU 158 Cb 0.06 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.82 3h6k h LEU 158 CO -0.02 0.31 -0.59 0.11 0.09 0.00 0.00 178.44 178.34 3h6k h LYS 159 N 0.00 0.65 -0.71 1.13 1.57 -0.40 0.21 116.57 119.03 3h6k h LYS 159 Ca -0.00 -0.51 -0.04 0.00 -1.87 0.00 0.00 60.65 58.23 3h6k h LYS 159 Cb 0.82 0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 3h6k h LYS 159 CO 0.04 1.13 0.29 1.96 -0.57 0.00 0.00 179.45 182.30 3h6k h GLN 160 N 0.31 1.04 -0.20 3.15 4.20 -1.47 -2.68 115.11 119.46 3h6k h GLN 160 Ca -0.03 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.50 3h6k h GLN 160 Cb 1.22 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.82 3h6k h GLN 160 CO 0.12 0.84 0.00 -1.13 -0.67 0.00 0.00 178.83 177.99 3h6k n SER 161 N -4.30 2.23 -4.18 1.46 3.41 -1.05 -4.92 113.62 106.26 3h6k n SER 161 Ca 0.06 -1.79 -0.31 0.00 -0.26 0.00 0.00 58.87 56.58 3h6k n SER 161 Cb 0.17 -0.13 -0.05 0.00 -0.26 0.00 0.00 64.21 63.94 3h6k n SER 161 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3h6k n ASN 162 N 0.70 -0.56 -2.43 4.04 3.02 -0.59 -4.91 115.26 114.54 3h6k n ASN 162 Ca 0.17 -1.12 0.00 0.00 -0.03 0.00 0.00 54.58 53.60 3h6k n ASN 162 Cb 0.43 -2.38 0.00 0.00 -0.61 0.00 0.00 39.78 37.21 3h6k n ASN 162 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h6k n GLY 163 N -2.00 0.35 2.89 7.41 0.00 0.64 -4.77 105.19 109.71 3h6k n GLY 163 Ca -0.21 -1.65 -0.13 0.00 0.00 0.00 0.00 46.02 44.04 3h6k n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6k s SER 164 N -1.00 -0.03 -0.14 1.61 0.01 0.12 -1.94 113.70 112.34 3h6k s SER 164 Ca 0.00 0.08 -0.09 0.00 1.31 0.00 0.00 55.95 57.26 3h6k s SER 164 Cb 0.00 0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.25 3h6k s SER 164 CO 0.00 -0.04 0.16 -0.63 0.41 0.00 0.00 173.24 173.14 3h6k s ILE 165 N 0.28 5.44 -0.12 1.44 1.01 0.21 -0.74 121.20 128.71 3h6k s ILE 165 Ca -0.02 0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.90 3h6k s ILE 165 Cb -0.03 -3.45 0.02 0.00 0.01 0.00 0.00 42.46 39.00 3h6k s ILE 165 CO -0.01 0.56 -0.14 -0.69 0.00 0.00 0.00 174.94 174.65 3h6k s VAL 166 N -0.57 1.47 -0.23 2.92 1.01 0.53 -1.63 120.40 123.91 3h6k s VAL 166 Ca 0.14 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.52 3h6k s VAL 166 Cb -0.12 -1.37 0.05 0.00 0.00 0.00 0.00 36.38 34.94 3h6k s VAL 166 CO 0.03 0.44 -0.10 -0.69 0.00 0.00 0.00 175.10 174.78 3h6k s VAL 167 N 1.17 1.81 -0.19 2.92 1.01 0.29 -0.53 120.40 126.88 3h6k s VAL 167 Ca -0.03 -1.27 -0.24 0.00 0.00 0.00 0.00 61.98 60.44 3h6k s VAL 167 Cb -0.14 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.29 3h6k s VAL 167 CO -0.04 0.06 0.81 -0.69 0.00 0.00 0.00 175.10 175.23 3h6k s VAL 168 N 1.29 4.88 0.00 2.92 1.01 -0.62 -0.93 120.40 128.96 3h6k s VAL 168 Ca -0.05 1.56 0.00 0.00 0.00 0.00 0.00 61.98 63.49 3h6k s VAL 168 Cb -0.18 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.09 3h6k s VAL 168 CO -0.07 0.01 0.00 -0.24 0.00 0.00 0.00 175.10 174.80 3h6k n SER 169 N 5.43 0.49 -3.67 3.32 2.88 0.29 -4.86 113.62 117.51 3h6k n SER 169 Ca 0.04 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.48 3h6k n SER 169 Cb 0.48 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.92 3h6k n SER 169 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3h6k s SER 170 N 1.00 -0.37 0.47 -3.46 0.01 -1.24 -2.60 113.70 107.51 3h6k s SER 170 Ca 0.00 -0.35 0.15 0.00 1.31 0.00 0.00 55.95 57.06 3h6k s SER 170 Cb 0.00 0.64 1.13 0.00 0.21 0.00 0.00 66.02 68.00 3h6k s SER 170 CO 0.00 -1.13 2.04 -0.07 0.41 0.00 0.00 173.24 174.49 3h6k h LEU 171 N 2.06 0.22 -0.57 2.44 3.38 -1.57 0.06 115.31 121.34 3h6k h LEU 171 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3h6k h LEU 171 Cb 1.28 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.98 3h6k h LEU 171 CO 0.33 0.14 0.00 0.00 0.09 0.00 0.00 178.44 179.00 3h6k n ALA 172 N -2.54 1.71 -0.01 1.53 0.00 -1.26 -0.67 120.51 119.26 3h6k n ALA 172 Ca 0.06 0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.67 3h6k n ALA 172 Cb 0.30 -1.38 0.28 0.00 0.00 0.00 0.00 19.45 18.65 3h6k n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6k n GLY 173 N 0.10 2.07 0.00 0.00 0.00 0.00 -4.35 105.19 103.00 3h6k n GLY 173 Ca 0.03 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.29 3h6k n GLY 173 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h6k n LYS 174 N 1.54 2.43 -4.39 1.61 4.76 -0.56 -3.98 118.16 119.56 3h6k n LYS 174 Ca 0.22 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.46 3h6k n LYS 174 Cb 0.60 -0.90 -0.09 0.00 -1.84 0.00 0.00 35.03 32.80 3h6k n LYS 174 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3h6k s VAL 175 N -1.79 0.60 -0.21 -0.18 -7.23 0.15 -5.12 120.40 106.61 3h6k s VAL 175 Ca 0.00 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.08 3h6k s VAL 175 Cb 0.00 -2.55 -0.04 0.00 0.56 0.00 0.00 36.38 34.34 3h6k s VAL 175 CO 0.00 0.00 0.10 0.00 -0.31 0.00 0.00 175.10 174.89 3h6k s ALA 176 N -3.49 3.45 0.04 1.32 0.00 -1.26 -4.33 121.76 117.49 3h6k s ALA 176 Ca 0.34 -0.85 0.04 0.00 0.00 0.00 0.00 51.96 51.49 3h6k s ALA 176 Cb 0.06 -2.09 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 3h6k s ALA 176 CO 0.16 -0.05 -0.12 0.71 0.00 0.00 0.00 175.76 176.45 3h6k s TYR 177 N 0.79 1.08 0.52 0.00 2.02 -1.26 -5.09 117.35 115.41 3h6k s TYR 177 Ca 0.05 -0.38 -0.17 0.00 -0.37 0.00 0.00 57.07 56.20 3h6k s TYR 177 Cb -0.13 -0.64 -0.07 0.00 -0.40 0.00 0.00 41.96 40.72 3h6k s TYR 177 CO 0.02 0.02 1.01 -1.25 -1.57 0.00 0.00 175.55 173.78 3h6k s PRO 178 N -1.28 3.80 0.00 -1.71 0.04 -1.26 -4.01 135.00 130.59 3h6k s PRO 178 Ca -0.01 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.12 3h6k s PRO 178 Cb -0.08 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.35 3h6k s PRO 178 CO 0.01 -0.40 0.00 -1.33 0.04 0.00 0.00 177.00 175.32 3h6k n MET 179 N -1.51 -0.02 -2.67 4.56 2.81 -1.25 -4.86 117.12 114.18 3h6k n MET 179 Ca 0.07 0.00 -0.08 0.00 -1.81 0.00 0.00 57.70 55.89 3h6k n MET 179 Cb 0.54 -2.67 0.04 0.00 -0.71 0.00 0.00 33.22 30.41 3h6k n MET 179 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 3h6k n VAL 180 N -2.16 1.38 0.51 2.03 0.24 -1.26 -2.45 118.33 116.63 3h6k n VAL 180 Ca 0.00 -3.25 -0.20 0.00 -2.04 0.00 0.00 64.34 58.85 3h6k n VAL 180 Cb 0.00 0.64 -0.10 0.00 -1.47 0.00 0.00 33.84 32.92 3h6k n VAL 180 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h6k h ALA 181 N 2.70 -1.30 -0.40 2.33 0.00 -1.85 0.44 119.26 121.18 3h6k h ALA 181 Ca -0.04 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.60 3h6k h ALA 181 Cb 1.24 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 19.51 3h6k h ALA 181 CO 0.40 -1.22 0.24 0.00 0.00 0.00 0.00 179.25 178.67 3h6k h ALA 182 N -1.29 0.50 -0.33 0.00 0.00 -1.93 -1.00 119.26 115.20 3h6k h ALA 182 Ca -0.13 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.81 3h6k h ALA 182 Cb 1.00 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 3h6k h ALA 182 CO 0.22 -0.08 0.07 -0.92 0.00 0.00 0.00 179.25 178.54 3h6k h TYR 183 N 0.50 0.11 -0.24 0.00 3.20 -1.92 -2.52 116.97 116.09 3h6k h TYR 183 Ca 0.15 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 3h6k h TYR 183 Cb -0.02 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 3h6k h TYR 183 CO -0.06 0.02 0.09 0.77 -1.64 0.00 0.00 178.16 177.34 3h6k h SER 184 N 0.18 0.34 -0.83 -2.11 0.02 -0.34 -1.92 113.55 108.90 3h6k h SER 184 Ca 0.16 -0.17 0.17 0.00 -0.84 0.00 0.00 61.79 61.10 3h6k h SER 184 Cb 0.17 -0.09 -0.11 0.00 0.14 0.00 0.00 62.40 62.52 3h6k h SER 184 CO -0.21 0.42 0.37 0.00 -1.14 0.00 0.00 176.83 176.27 3h6k h ALA 185 N 0.93 1.25 -0.26 3.77 0.00 -1.07 0.97 119.26 124.86 3h6k h ALA 185 Ca 0.08 0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 3h6k h ALA 185 Cb 0.19 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3h6k h ALA 185 CO -0.01 -0.22 -0.50 0.66 0.00 0.00 0.00 179.25 179.19 3h6k h SER 186 N 0.48 0.79 -0.21 0.00 4.64 -0.99 0.80 113.55 119.04 3h6k h SER 186 Ca 0.48 -0.40 -0.07 0.00 -0.47 0.00 0.00 61.79 61.33 3h6k h SER 186 Cb 0.78 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3h6k h SER 186 CO -0.44 1.15 -0.14 0.11 -0.87 0.00 0.00 176.83 176.63 3h6k h LYS 187 N 0.56 0.48 -0.85 4.77 1.79 -0.87 -1.63 116.57 120.82 3h6k h LYS 187 Ca 0.02 -0.23 0.11 0.00 -2.18 0.00 0.00 60.65 58.38 3h6k h LYS 187 Cb 1.06 -0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.63 3h6k h LYS 187 CO 0.10 0.78 0.48 0.74 -1.08 0.00 0.00 179.45 180.48 3h6k h PHE 188 N 0.17 0.87 -0.47 -1.35 0.04 -0.77 -1.88 116.94 113.55 3h6k h PHE 188 Ca 0.04 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.81 3h6k h PHE 188 Cb 0.66 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.53 3h6k h PHE 188 CO 0.07 0.32 0.17 0.00 -0.60 0.00 0.00 178.31 178.28 3h6k h ALA 189 N 1.49 0.61 -0.56 2.45 0.00 -0.53 -1.50 119.26 121.22 3h6k h ALA 189 Ca 0.42 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.27 3h6k h ALA 189 Cb 0.44 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 17.97 3h6k h ALA 189 CO -0.27 0.24 0.13 -0.07 0.00 0.00 0.00 179.25 179.28 3h6k h LEU 190 N 0.62 0.04 0.23 0.00 3.38 -0.94 0.14 115.31 118.78 3h6k h LEU 190 Ca 0.15 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.23 3h6k h LEU 190 Cb 0.23 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3h6k h LEU 190 CO -0.01 0.04 -0.37 -0.78 0.09 0.00 0.00 178.44 177.41 3h6k h ASP 191 N 0.27 -1.04 0.02 -0.43 3.58 -0.81 0.20 116.42 118.22 3h6k h ASP 191 Ca 0.28 0.10 0.02 0.00 0.42 0.00 0.00 57.03 57.86 3h6k h ASP 191 Cb 0.39 0.37 -0.03 0.00 1.72 0.00 0.00 39.33 41.78 3h6k h ASP 191 CO -0.35 -0.48 -0.19 1.23 -2.88 0.00 0.00 179.24 176.57 3h6k h GLY 192 N -0.67 -0.28 0.79 -0.78 0.00 -0.92 -0.36 103.07 100.84 3h6k h GLY 192 Ca 0.00 0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.55 3h6k h GLY 192 CO -0.15 -0.18 -0.08 -2.75 0.00 0.00 0.00 176.54 173.38 3h6k h PHE 193 N -0.32 -0.22 -0.05 5.60 3.04 -0.63 -2.43 116.94 121.93 3h6k h PHE 193 Ca 0.05 -0.01 -0.21 0.00 3.98 0.00 0.00 57.97 61.78 3h6k h PHE 193 Cb 0.39 0.07 0.00 0.00 2.56 0.00 0.00 35.95 38.97 3h6k h PHE 193 CO -0.23 0.03 -0.86 0.74 -2.02 0.00 0.00 178.31 175.98 3h6k h PHE 194 N -0.45 0.69 -0.46 0.41 -1.00 -0.51 -0.56 116.94 115.06 3h6k h PHE 194 Ca -0.02 -0.34 0.01 0.00 2.81 0.00 0.00 57.97 60.43 3h6k h PHE 194 Cb 0.35 -0.09 -0.03 0.00 3.61 0.00 0.00 35.95 39.79 3h6k h PHE 194 CO -0.00 1.14 0.29 0.77 -1.61 0.00 0.00 178.31 178.90 3h6k h SER 195 N 0.30 0.49 -0.86 2.17 0.02 -1.18 0.25 113.55 114.73 3h6k h SER 195 Ca -0.06 -0.01 0.02 0.00 -0.84 0.00 0.00 61.79 60.90 3h6k h SER 195 Cb 1.47 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.85 3h6k h SER 195 CO 0.15 0.35 0.57 -1.28 -1.14 0.00 0.00 176.83 175.48 3h6k h SER 196 N 0.59 0.96 -0.34 3.07 0.87 -1.15 -2.46 113.55 115.09 3h6k h SER 196 Ca 0.18 -0.02 -0.15 0.00 -1.23 0.00 0.00 61.79 60.56 3h6k h SER 196 Cb -0.03 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 3h6k h SER 196 CO -0.06 0.68 -0.38 0.40 -0.53 0.00 0.00 176.83 176.94 3h6k h ILE 197 N 1.12 1.28 -0.43 2.23 1.08 -0.55 -2.88 117.51 119.36 3h6k h ILE 197 Ca 0.33 -1.55 0.09 0.00 -0.39 0.00 0.00 64.86 63.33 3h6k h ILE 197 Cb -0.06 1.39 -0.09 0.00 -3.07 0.00 0.00 36.82 34.99 3h6k h ILE 197 CO -0.08 0.52 -0.23 -0.09 -0.69 0.00 0.00 178.15 177.58 3h6k h ARG 198 N 0.73 -0.14 -0.67 2.37 2.43 -0.49 -0.30 114.38 118.31 3h6k h ARG 198 Ca 0.06 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.30 3h6k h ARG 198 Cb 0.96 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.50 3h6k h ARG 198 CO 0.09 -0.09 0.44 0.87 -1.51 0.00 0.00 179.97 179.77 3h6k h LYS 199 N -0.15 0.67 -0.29 0.20 6.56 -1.45 0.06 116.57 122.18 3h6k h LYS 199 Ca 0.20 -0.04 -0.03 0.00 -1.06 0.00 0.00 60.65 59.72 3h6k h LYS 199 Cb 0.46 -0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 31.96 3h6k h LYS 199 CO -0.51 0.45 0.08 0.93 -2.06 0.00 0.00 179.45 178.33 3h6k h GLU 200 N 0.69 0.46 -0.31 3.15 5.08 -0.90 -1.51 114.58 121.24 3h6k h GLU 200 Ca 0.28 -0.11 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3h6k h GLU 200 Cb 0.23 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 3h6k h GLU 200 CO -0.09 0.53 0.21 1.88 -1.00 0.00 0.00 179.01 180.54 3h6k h TYR 201 N 0.30 0.38 0.28 4.33 0.05 -0.20 0.11 116.97 122.22 3h6k h TYR 201 Ca 0.09 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.87 3h6k h TYR 201 Cb 0.28 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 37.89 3h6k h TYR 201 CO 0.01 0.24 -0.13 0.77 -1.05 0.00 0.00 178.16 178.00 3h6k h SER 202 N 0.41 -0.31 0.67 3.88 0.02 -0.52 0.14 113.55 117.83 3h6k h SER 202 Ca 0.12 -0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 3h6k h SER 202 Cb -0.03 0.08 0.01 0.00 0.14 0.00 0.00 62.40 62.60 3h6k h SER 202 CO -0.03 -0.14 -0.32 -0.37 -1.14 0.00 0.00 176.83 174.84 3h6k h VAL 203 N -0.47 0.32 0.00 2.27 -1.51 -0.81 -2.99 116.25 113.06 3h6k h VAL 203 Ca -0.04 -0.08 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 3h6k h VAL 203 Cb 0.36 0.35 0.00 0.00 -2.13 0.00 0.00 31.29 29.87 3h6k h VAL 203 CO 0.06 0.01 0.00 -1.54 -1.23 0.00 0.00 177.57 174.87 3h6k n SER 204 N -5.45 0.10 -4.07 4.19 3.41 0.35 -4.88 113.62 107.26 3h6k n SER 204 Ca -0.13 -1.86 -0.32 0.00 -0.26 0.00 0.00 58.87 56.30 3h6k n SER 204 Cb 0.37 -0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 64.26 3h6k n SER 204 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h6k n ARG 205 N -0.44 -3.82 -2.83 4.33 1.74 0.28 -4.95 116.66 110.96 3h6k n ARG 205 Ca 0.00 0.44 -0.41 0.00 -0.77 0.00 0.00 57.85 57.11 3h6k n ARG 205 Cb 0.02 -5.06 -0.04 0.00 -1.02 0.00 0.00 32.46 26.37 3h6k n ARG 205 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h6k s VAL 206 N -3.47 4.89 -1.15 1.55 1.01 0.05 -4.98 120.40 118.30 3h6k s VAL 206 Ca 0.52 1.79 -0.03 0.00 0.00 0.00 0.00 61.98 64.26 3h6k s VAL 206 Cb -0.28 -4.20 0.24 0.00 0.00 0.00 0.00 36.38 32.14 3h6k s VAL 206 CO 0.89 0.10 2.05 -3.20 0.00 0.00 0.00 175.10 174.94 3h6k n ASN 207 N 4.57 7.62 -4.01 3.32 5.15 -1.26 -4.65 115.26 126.01 3h6k n ASN 207 Ca 0.05 -3.46 -0.29 0.00 -0.60 0.00 0.00 54.58 50.27 3h6k n ASN 207 Cb 0.50 -1.25 -0.17 0.00 -0.53 0.00 0.00 39.78 38.33 3h6k n ASN 207 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3h6k s VAL 208 N -3.00 1.47 0.28 3.44 1.01 -1.26 -4.11 120.40 118.23 3h6k s VAL 208 Ca 0.45 -0.58 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 3h6k s VAL 208 Cb 0.19 -1.39 -0.09 0.00 0.00 0.00 0.00 36.38 35.09 3h6k s VAL 208 CO -0.11 0.44 1.00 -0.94 0.00 0.00 0.00 175.10 175.49 3h6k s SER 209 N 1.42 7.40 -0.21 3.32 1.04 -0.82 -4.86 113.70 120.98 3h6k s SER 209 Ca 0.03 2.04 -0.01 0.00 0.48 0.00 0.00 55.95 58.48 3h6k s SER 209 Cb -0.13 -2.61 0.01 0.00 0.10 0.00 0.00 66.02 63.39 3h6k s SER 209 CO -0.08 -0.03 -0.11 -0.63 0.98 0.00 0.00 173.24 173.36 3h6k s ILE 210 N -1.29 2.69 -0.23 -1.02 1.01 -1.26 0.63 121.20 121.74 3h6k s ILE 210 Ca 0.45 -0.84 -0.03 0.00 0.00 0.00 0.00 60.65 60.23 3h6k s ILE 210 Cb -0.26 -2.24 0.00 0.00 0.01 0.00 0.00 42.46 39.97 3h6k s ILE 210 CO 0.33 0.40 -0.05 -0.89 0.00 0.00 0.00 174.94 174.73 3h6k s THR 211 N 1.35 3.20 -0.21 2.92 2.01 -0.64 -4.44 115.64 119.82 3h6k s THR 211 Ca 0.04 -0.67 -0.13 0.00 0.31 0.00 0.00 61.69 61.24 3h6k s THR 211 Cb -0.15 -2.50 -0.05 0.00 0.01 0.00 0.00 72.50 69.81 3h6k s THR 211 CO -0.07 0.35 0.27 -0.22 -0.69 0.00 0.00 174.62 174.25 3h6k s LEU 212 N 1.43 4.15 -0.21 4.42 2.96 -0.34 -0.55 118.68 130.54 3h6k s LEU 212 Ca 0.04 0.32 -0.06 0.00 -0.22 0.00 0.00 54.13 54.21 3h6k s LEU 212 Cb -0.15 -2.29 -0.02 0.00 0.50 0.00 0.00 46.19 44.22 3h6k s LEU 212 CO -0.04 0.02 0.01 0.00 -1.32 0.00 0.00 176.35 175.02 3h6k s VAL 214 N 1.12 4.32 -0.11 0.00 1.01 0.77 0.11 120.40 127.62 3h6k s VAL 214 Ca 0.03 -2.07 -0.12 0.00 0.00 0.00 0.00 61.98 59.82 3h6k s VAL 214 Cb -0.14 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 3h6k s VAL 214 CO 0.02 -0.83 0.26 -0.76 0.00 0.00 0.00 175.10 173.79 3h6k s LEU 215 N 0.97 4.34 0.00 3.92 1.43 -1.07 -2.10 118.68 126.17 3h6k s LEU 215 Ca 0.09 0.58 0.00 0.00 -1.03 0.00 0.00 54.13 53.78 3h6k s LEU 215 Cb -0.23 -2.32 0.00 0.00 0.03 0.00 0.00 46.19 43.67 3h6k s LEU 215 CO -0.02 0.25 0.00 0.61 0.23 0.00 0.00 176.35 177.42 3h6k n GLY 216 N 2.62 -0.25 3.67 -3.19 0.00 0.57 -1.55 105.19 107.05 3h6k n GLY 216 Ca -0.15 -1.75 -0.45 0.00 0.00 0.00 0.00 46.02 43.67 3h6k n GLY 216 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3h6k n LEU 217 N 0.00 3.89 -4.57 0.99 7.94 -1.26 -4.91 117.00 119.08 3h6k n LEU 217 Ca 0.00 0.92 -0.32 0.00 -1.11 0.00 0.00 56.01 55.50 3h6k n LEU 217 Cb 0.00 -1.47 -0.11 0.00 0.53 0.00 0.00 43.42 42.38 3h6k n LEU 217 CO 0.00 0.10 -0.40 -0.63 -1.11 0.00 0.00 177.39 175.35 3h6k s ILE 218 N 4.37 3.53 -1.54 1.96 -1.09 -1.26 -1.71 121.20 125.45 3h6k s ILE 218 Ca 0.91 -0.79 -0.11 0.00 -2.23 0.00 0.00 60.65 58.42 3h6k s ILE 218 Cb -0.54 -2.52 -0.03 0.00 -1.58 0.00 0.00 42.46 37.80 3h6k s ILE 218 CO 0.46 0.41 2.65 -0.90 -1.23 0.00 0.00 174.94 176.33 3h6k n ASP 219 N 1.65 6.88 -4.88 3.58 3.85 -0.22 -4.70 116.55 122.71 3h6k n ASP 219 Ca -0.16 -2.71 -0.30 0.00 -0.71 0.00 0.00 54.79 50.92 3h6k n ASP 219 Cb 0.52 -1.58 -0.02 0.00 -1.35 0.00 0.00 41.12 38.69 3h6k n ASP 219 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 3h6k s THR 220 N 2.34 4.79 0.26 2.12 -4.23 -1.26 -4.59 115.64 115.07 3h6k s THR 220 Ca 0.60 0.59 0.29 0.00 -1.18 0.00 0.00 61.69 61.99 3h6k s THR 220 Cb 0.16 -3.77 0.30 0.00 1.34 0.00 0.00 72.50 70.53 3h6k s THR 220 CO -0.07 -0.66 1.98 1.05 -0.54 0.00 0.00 174.62 176.38 3h6k h GLU 221 N 0.86 0.00 0.11 3.99 4.11 -1.98 -1.67 114.58 120.00 3h6k h GLU 221 Ca -0.47 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 58.70 3h6k h GLU 221 Cb 1.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 3h6k h GLU 221 CO 0.63 0.12 -1.22 1.15 0.07 0.00 0.00 179.01 179.77 3h6k h THR 222 N 0.00 1.52 0.11 -1.06 2.02 -1.96 -2.92 112.91 110.63 3h6k h THR 222 Ca -0.00 -3.11 -0.01 0.00 0.77 0.00 0.00 66.41 64.06 3h6k h THR 222 Cb 0.50 2.92 0.00 0.00 -1.74 0.00 0.00 68.15 69.84 3h6k h THR 222 CO 0.02 0.90 -0.05 0.00 0.37 0.00 0.00 175.52 176.76 3h6k h ALA 223 N 0.64 -0.15 0.00 6.16 0.00 -1.77 -2.75 119.26 121.40 3h6k h ALA 223 Ca -0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 3h6k h ALA 223 Cb 1.94 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.79 3h6k h ALA 223 CO 0.19 -0.30 -0.06 0.52 0.00 0.00 0.00 179.25 179.60 3h6k h MET 224 N -0.72 0.00 -0.36 0.00 2.86 -1.45 0.10 114.93 115.37 3h6k h MET 224 Ca -0.02 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.52 3h6k h MET 224 Cb 0.54 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 3h6k h MET 224 CO 0.03 0.06 -0.18 0.87 1.06 0.00 0.00 176.91 178.74 3h6k h LYS 225 N 0.00 0.76 0.00 1.72 1.57 -1.56 -2.98 116.57 116.09 3h6k h LYS 225 Ca -0.00 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 3h6k h LYS 225 Cb 0.13 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3h6k h LYS 225 CO 0.01 0.95 -0.17 0.00 -0.57 0.00 0.00 179.45 179.67 3h6k h ALA 226 N 0.79 0.89 0.00 3.86 0.00 -0.71 -3.29 119.26 120.80 3h6k h ALA 226 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3h6k h ALA 226 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3h6k h ALA 226 CO 0.05 0.00 -1.41 0.28 0.00 0.00 0.00 179.25 178.17 3h6k n VAL 227 N -2.30 0.14 -1.70 0.00 0.31 0.16 -4.36 118.33 110.57 3h6k n VAL 227 Ca 0.05 -0.35 -0.43 0.00 -0.01 0.00 0.00 64.34 63.60 3h6k n VAL 227 Cb 0.44 0.16 -0.03 0.00 -0.91 0.00 0.00 33.84 33.51 3h6k n VAL 227 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3h6k s SER 228 N -4.23 5.97 0.00 4.52 0.01 -1.13 -1.99 113.70 116.85 3h6k s SER 228 Ca -0.01 2.15 0.00 0.00 1.31 0.00 0.00 55.95 59.40 3h6k s SER 228 Cb 0.14 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.85 3h6k s SER 228 CO 0.85 -1.52 0.00 0.61 0.41 0.00 0.00 173.24 173.60 3h6k n GLY 229 N 5.14 2.91 0.07 3.44 0.00 -1.26 -4.82 105.19 110.67 3h6k n GLY 229 Ca 0.24 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 45.39 3h6k n GLY 229 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3h6k h ILE 230 N 0.00 1.39 -3.30 -0.61 5.03 -1.86 -3.44 117.51 114.72 3h6k h ILE 230 Ca 0.00 -1.21 -0.67 0.00 -0.12 0.00 0.00 64.86 62.87 3h6k h ILE 230 Cb 0.00 2.13 -0.33 0.00 -3.03 0.00 0.00 36.82 35.58 3h6k h ILE 230 CO 0.00 0.32 -0.87 0.68 -0.68 0.00 0.00 178.15 177.60 3h6k s VAL 231 N -4.22 1.99 -0.38 1.67 -7.23 -0.84 -5.09 120.40 106.29 3h6k s VAL 231 Ca -0.16 -0.96 -0.11 0.00 -1.81 0.00 0.00 61.98 58.94 3h6k s VAL 231 Cb 0.02 -1.74 0.03 0.00 0.56 0.00 0.00 36.38 35.26 3h6k s VAL 231 CO 0.69 0.54 0.22 -1.00 -0.31 0.00 0.00 175.10 175.24 3h6k s HIS 232 N 0.54 3.25 0.11 2.82 0.09 -1.26 -4.72 115.29 116.11 3h6k s HIS 232 Ca -0.14 -0.95 -0.25 0.00 -0.00 0.00 0.00 55.06 53.72 3h6k s HIS 232 Cb -0.17 -2.47 0.08 0.00 -0.00 0.00 0.00 32.58 30.02 3h6k s HIS 232 CO 0.05 -0.65 0.69 0.00 -0.00 0.00 0.00 174.74 174.82 3h6k s MET 233 N 1.56 1.14 0.24 1.40 0.00 -1.26 -5.16 119.30 117.22 3h6k s MET 233 Ca 0.02 -0.40 -0.24 0.00 0.00 0.00 0.00 55.69 55.07 3h6k s MET 233 Cb -0.19 0.53 -0.09 0.00 0.00 0.00 0.00 34.83 35.08 3h6k s MET 233 CO 0.07 -0.50 0.82 -1.14 0.00 0.00 0.00 175.02 174.28 3h6k s GLN 234 N -3.49 4.50 -0.24 3.16 0.74 -1.26 -5.05 119.66 118.02 3h6k s GLN 234 Ca 0.02 1.15 -0.09 0.00 0.05 0.00 0.00 55.36 56.49 3h6k s GLN 234 Cb -0.01 -3.01 -0.04 0.00 1.10 0.00 0.00 33.01 31.05 3h6k s GLN 234 CO -0.11 0.43 0.11 0.00 -0.55 0.00 0.00 175.29 175.16 3h6k s ALA 235 N -1.40 3.35 0.69 1.58 0.00 -1.26 -4.68 121.76 120.03 3h6k s ALA 235 Ca 0.43 -1.01 -0.14 0.00 0.00 0.00 0.00 51.96 51.23 3h6k s ALA 235 Cb -0.20 -2.16 0.02 0.00 0.00 0.00 0.00 23.12 20.77 3h6k s ALA 235 CO 0.24 -0.32 1.13 0.00 0.00 0.00 0.00 175.76 176.81 3h6k s ALA 236 N 1.30 2.36 0.58 0.00 0.00 -0.69 -4.59 121.76 120.72 3h6k s ALA 236 Ca 0.06 0.58 -0.20 0.00 0.00 0.00 0.00 51.96 52.40 3h6k s ALA 236 Cb -0.15 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 3h6k s ALA 236 CO 0.05 -1.47 1.26 -1.25 0.00 0.00 0.00 175.76 174.36 3h6k s PRO 237 N -4.14 3.01 0.31 0.00 0.04 -1.26 -1.05 135.00 131.91 3h6k s PRO 237 Ca 0.68 1.99 0.19 0.00 0.04 0.00 0.00 61.00 63.89 3h6k s PRO 237 Cb -0.22 -2.06 0.14 0.00 0.04 0.00 0.00 34.50 32.41 3h6k s PRO 237 CO 0.44 -1.21 1.41 1.57 0.04 0.00 0.00 177.00 179.25 3h6k h LYS 238 N 1.10 0.00 -0.14 4.56 2.10 -1.94 -2.99 116.57 119.26 3h6k h LYS 238 Ca -0.51 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.10 3h6k h LYS 238 Cb 1.30 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.63 3h6k h LYS 238 CO 0.56 0.25 -0.09 0.93 -2.00 0.00 0.00 179.45 179.10 3h6k h GLU 239 N 0.00 0.31 -0.01 0.07 3.07 -1.96 -0.92 114.58 115.15 3h6k h GLU 239 Ca -0.02 -0.15 -0.17 0.00 -0.50 0.00 0.00 59.36 58.52 3h6k h GLU 239 Cb 1.22 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.11 3h6k h GLU 239 CO 0.03 0.66 -0.80 0.93 -1.40 0.00 0.00 179.01 178.44 3h6k h GLU 240 N -0.04 0.10 -0.00 2.33 3.07 -1.98 -2.69 114.58 115.37 3h6k h GLU 240 Ca 0.03 -0.10 0.03 0.00 -0.50 0.00 0.00 59.36 58.81 3h6k h GLU 240 Cb 0.58 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.48 3h6k h GLU 240 CO 0.03 0.84 -0.17 0.00 -1.40 0.00 0.00 179.01 178.30 3h6k h ALA 242 N 0.64 0.26 -0.39 0.00 0.00 -1.11 -1.51 119.26 117.15 3h6k h ALA 242 Ca 0.06 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3h6k h ALA 242 Cb 0.35 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3h6k h ALA 242 CO -0.17 -0.34 0.20 1.25 0.00 0.00 0.00 179.25 180.19 3h6k h LEU 243 N 0.18 0.29 -0.85 0.00 5.85 -1.31 -2.06 115.31 117.40 3h6k h LEU 243 Ca 0.10 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.92 3h6k h LEU 243 Cb 0.08 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 3h6k h LEU 243 CO -0.11 0.21 0.51 -0.33 -0.34 0.00 0.00 178.44 178.38 3h6k h GLU 244 N 0.40 0.86 -0.59 1.25 4.39 -0.55 -0.25 114.58 120.10 3h6k h GLU 244 Ca 0.16 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.76 3h6k h GLU 244 Cb 0.07 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 3h6k h GLU 244 CO -0.11 0.57 0.17 0.82 -1.16 0.00 0.00 179.01 179.30 3h6k h ILE 245 N 0.89 1.24 -0.68 3.13 2.04 -0.99 -2.21 117.51 120.94 3h6k h ILE 245 Ca 0.39 -0.85 -0.04 0.00 1.00 0.00 0.00 64.86 65.37 3h6k h ILE 245 Cb 0.28 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 3h6k h ILE 245 CO -0.21 0.32 0.29 0.40 0.00 0.00 0.00 178.15 178.94 3h6k h ILE 246 N 0.84 1.24 -0.39 -0.67 2.04 -0.63 -2.81 117.51 117.14 3h6k h ILE 246 Ca 0.19 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.30 3h6k h ILE 246 Cb 0.31 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 3h6k h ILE 246 CO -0.00 0.29 0.17 0.11 0.00 0.00 0.00 178.15 178.72 3h6k h LYS 247 N 0.96 0.58 -0.63 2.37 1.57 -0.95 -0.33 116.57 120.14 3h6k h LYS 247 Ca 0.23 -0.10 0.09 0.00 -1.87 0.00 0.00 60.65 59.00 3h6k h LYS 247 Cb 0.18 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 3h6k h LYS 247 CO -0.02 0.54 0.42 0.78 -0.57 0.00 0.00 179.45 180.60 3h6k h GLY 248 N 0.49 0.67 1.12 3.86 0.00 -1.27 0.19 103.07 108.12 3h6k h GLY 248 Ca 0.13 -0.20 -0.34 0.00 0.00 0.00 0.00 47.33 46.92 3h6k h GLY 248 CO -0.01 0.12 -1.61 -1.33 0.00 0.00 0.00 176.54 173.71 3h6k h GLY 249 N 0.48 0.51 0.80 4.60 0.00 -1.24 -0.33 103.07 107.89 3h6k h GLY 249 Ca 0.29 -1.30 0.03 0.00 0.00 0.00 0.00 47.33 46.35 3h6k h GLY 249 CO -0.09 1.13 0.12 0.00 0.00 0.00 0.00 176.54 177.71 3h6k h ALA 250 N 0.18 0.35 -0.03 3.60 0.00 -0.66 -1.96 119.26 120.74 3h6k h ALA 250 Ca -0.29 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3h6k h ALA 250 Cb 2.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.90 3h6k h ALA 250 CO 0.22 -0.27 0.00 1.28 0.00 0.00 0.00 179.25 180.48 3h6k n LEU 251 N -5.00 0.37 -3.73 0.00 4.77 0.02 -4.91 117.00 108.53 3h6k n LEU 251 Ca -0.01 -0.15 -0.27 0.00 -0.03 0.00 0.00 56.01 55.55 3h6k n LEU 251 Cb 0.09 -0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.20 3h6k n LEU 251 CO 0.30 0.08 0.14 0.54 -1.33 0.00 0.00 177.39 177.11 3h6k n ARG 252 N -0.56 -6.21 -1.94 3.23 1.74 -0.74 -0.94 116.66 111.24 3h6k n ARG 252 Ca 0.16 0.69 -0.33 0.00 -0.77 0.00 0.00 57.85 57.60 3h6k n ARG 252 Cb 0.13 -5.63 0.02 0.00 -1.02 0.00 0.00 32.46 25.96 3h6k n ARG 252 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3h6k s GLN 253 N -6.44 3.18 -0.01 5.56 -0.21 -0.17 -4.00 119.66 117.57 3h6k s GLN 253 Ca 0.61 1.20 -0.25 0.00 0.02 0.00 0.00 55.36 56.94 3h6k s GLN 253 Cb -0.29 -2.01 -0.19 0.00 1.00 0.00 0.00 33.01 31.51 3h6k s GLN 253 CO 0.75 -0.92 1.28 0.93 -2.12 0.00 0.00 175.29 175.21 3h6k h GLU 254 N 0.23 0.07 -4.47 2.91 5.08 -1.88 -3.35 114.58 113.16 3h6k h GLU 254 Ca -0.46 -0.04 -0.22 0.00 -1.00 0.00 0.00 59.36 57.64 3h6k h GLU 254 Cb 1.22 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.29 3h6k h GLU 254 CO 0.57 0.55 -0.71 -1.21 -1.00 0.00 0.00 179.01 177.20 3h6k s GLU 255 N -4.23 0.62 -0.00 2.33 2.02 -1.26 -1.20 118.70 116.98 3h6k s GLU 255 Ca -0.16 -1.00 0.04 0.00 0.02 0.00 0.00 54.97 53.87 3h6k s GLU 255 Cb 0.02 -0.14 -0.01 0.00 0.10 0.00 0.00 34.13 34.10 3h6k s GLU 255 CO 0.69 -0.01 -0.12 0.08 0.02 0.00 0.00 175.26 175.92 3h6k s VAL 256 N -2.52 0.96 -0.04 2.63 1.01 -0.18 -4.92 120.40 117.34 3h6k s VAL 256 Ca -0.01 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 61.44 3h6k s VAL 256 Cb -0.02 -0.82 -0.01 0.00 0.00 0.00 0.00 36.38 35.53 3h6k s VAL 256 CO -0.03 0.21 -0.23 -0.31 0.00 0.00 0.00 175.10 174.74 3h6k s TYR 257 N -0.39 2.16 -0.07 5.22 4.12 -1.26 -0.16 117.35 126.97 3h6k s TYR 257 Ca 0.04 -0.53 -0.03 0.00 0.02 0.00 0.00 57.07 56.57 3h6k s TYR 257 Cb -0.05 -1.41 0.04 0.00 -1.52 0.00 0.00 41.96 39.02 3h6k s TYR 257 CO -0.00 -0.12 0.17 -0.47 0.02 0.00 0.00 175.55 175.15 3h6k s TYR 258 N -0.33 -0.20 -0.29 2.71 6.14 -0.89 -4.96 117.35 119.54 3h6k s TYR 258 Ca 0.03 0.55 -0.23 0.00 0.64 0.00 0.00 57.07 58.06 3h6k s TYR 258 Cb -0.11 -0.06 0.16 0.00 0.42 0.00 0.00 41.96 42.37 3h6k s TYR 258 CO 0.01 -0.18 1.19 0.34 0.64 0.00 0.00 175.55 177.55 3h6k s ASP 259 N 1.23 -0.28 0.41 4.32 -1.08 -1.26 -0.31 116.67 119.70 3h6k s ASP 259 Ca -0.09 0.51 0.21 0.00 -0.52 0.00 0.00 52.55 52.66 3h6k s ASP 259 Cb -0.11 0.68 1.17 0.00 -1.46 0.00 0.00 42.92 43.20 3h6k s ASP 259 CO -0.07 -0.09 1.76 0.77 0.52 0.00 0.00 175.17 178.07 3h6k h SER 260 N 4.24 0.39 -4.02 -0.34 4.64 -1.87 -3.43 113.55 113.16 3h6k h SER 260 Ca -0.28 0.08 -0.44 0.00 -0.47 0.00 0.00 61.79 60.68 3h6k h SER 260 Cb 1.18 0.02 0.16 0.00 -0.31 0.00 0.00 62.40 63.45 3h6k h SER 260 CO 0.16 0.05 0.32 -0.55 -0.87 0.00 0.00 176.83 175.94 3h6k s SER 261 N -5.18 2.84 -0.05 4.97 0.15 -1.26 -5.02 113.70 110.15 3h6k s SER 261 Ca -0.08 0.58 0.01 0.00 0.70 0.00 0.00 55.95 57.16 3h6k s SER 261 Cb 0.26 -0.86 -0.04 0.00 -1.71 0.00 0.00 66.02 63.67 3h6k s SER 261 CO 0.80 -2.93 -0.03 0.00 1.20 0.00 0.00 173.24 172.27 3h6k n LEU 262 N -3.96 2.26 -0.16 3.45 -0.00 -1.26 -4.47 117.00 112.85 3h6k n LEU 262 Ca 0.12 -0.02 -0.08 0.00 -0.00 0.00 0.00 56.01 56.02 3h6k n LEU 262 Cb 0.60 -0.12 -0.07 0.00 -0.00 0.00 0.00 43.42 43.83 3h6k n LEU 262 CO 0.50 0.48 0.49 4.11 -0.00 0.00 0.00 177.39 182.97 3h6k h TRP 263 N 0.00 -1.18 -0.13 1.47 0.09 -1.97 -3.15 115.95 111.08 3h6k h TRP 263 Ca -0.12 0.07 0.01 0.00 0.09 0.00 0.00 58.89 58.93 3h6k h TRP 263 Cb 1.22 0.57 -0.02 0.00 0.08 0.00 0.00 29.16 31.00 3h6k h TRP 263 CO 0.00 -0.30 -0.11 1.79 0.09 0.00 0.00 178.44 179.92 3h6k h THR 264 N -0.17 0.00 -0.20 0.12 1.35 -1.96 -2.85 112.91 109.20 3h6k h THR 264 Ca 0.07 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.99 3h6k h THR 264 Cb 0.35 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.76 3h6k h THR 264 CO -0.48 0.00 0.42 0.71 -0.25 0.00 0.00 175.52 175.93 3h6k h THR 265 N -0.04 0.16 0.00 6.82 1.35 -1.77 -2.03 112.91 117.40 3h6k h THR 265 Ca 0.02 0.00 -0.07 0.00 -0.55 0.00 0.00 66.41 65.81 3h6k h THR 265 Cb 0.10 0.62 -0.01 0.00 -1.73 0.00 0.00 68.15 67.13 3h6k h THR 265 CO -0.14 0.00 -0.93 -0.07 -0.25 0.00 0.00 175.52 174.13 3h6k h LEU 266 N 0.00 0.00 0.00 3.87 3.38 -1.49 -3.34 115.31 117.73 3h6k h LEU 266 Ca 0.10 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 3h6k h LEU 266 Cb 0.94 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 3h6k h LEU 266 CO -0.00 0.26 -1.08 -0.07 0.09 0.00 0.00 178.44 177.64 3h6k h LEU 267 N 0.00 0.00 -0.71 1.67 3.38 -1.42 -3.37 115.31 114.85 3h6k h LEU 267 Ca -0.05 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.99 3h6k h LEU 267 Cb 1.24 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.93 3h6k h LEU 267 CO 0.02 0.19 0.39 0.40 0.09 0.00 0.00 178.44 179.53 3h6k h ILE 268 N 0.00 0.93 -3.16 1.22 1.08 -1.68 -3.40 117.51 112.49 3h6k h ILE 268 Ca -0.05 -0.24 -0.54 0.00 -0.39 0.00 0.00 64.86 63.65 3h6k h ILE 268 Cb 1.19 0.18 0.08 0.00 -3.07 0.00 0.00 36.82 35.20 3h6k h ILE 268 CO 0.02 0.13 0.88 -1.14 -0.69 0.00 0.00 178.15 177.34 3h6k n ARG 269 N -4.80 2.66 -3.95 2.37 0.63 -1.26 -4.98 116.66 107.33 3h6k n ARG 269 Ca 0.10 0.95 -0.31 0.00 -0.92 0.00 0.00 57.85 57.67 3h6k n ARG 269 Cb 0.22 -2.73 -0.15 0.00 0.45 0.00 0.00 32.46 30.25 3h6k n ARG 269 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3h6k s ASN 270 N 0.55 4.57 0.15 6.15 3.84 -1.26 -4.99 114.94 123.96 3h6k s ASN 270 Ca 0.66 -2.11 -0.10 0.00 0.21 0.00 0.00 52.86 51.51 3h6k s ASN 270 Cb -0.51 -1.47 -0.01 0.00 -0.55 0.00 0.00 41.25 38.71 3h6k s ASN 270 CO 0.47 -0.38 1.49 -0.65 -2.79 0.00 0.00 177.10 175.25 3h6k h PRO 271 N 7.63 0.92 -1.00 0.43 0.11 -1.95 -2.25 132.00 135.87 3h6k h PRO 271 Ca -0.06 -0.47 0.15 0.00 0.11 0.00 0.00 66.00 65.73 3h6k h PRO 271 Cb 1.01 0.01 -0.09 0.00 0.11 0.00 0.00 31.00 32.04 3h6k h PRO 271 CO 0.52 1.13 0.62 0.66 -0.21 0.00 0.00 178.00 180.72 3h6k h SER 272 N 0.75 0.86 -0.46 -2.05 4.64 -1.99 0.32 113.55 115.62 3h6k h SER 272 Ca 0.06 0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 3h6k h SER 272 Cb 0.96 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.93 3h6k h SER 272 CO 0.09 0.40 0.25 -0.09 -0.87 0.00 0.00 176.83 176.61 3h6k h ARG 273 N 0.89 0.64 -0.41 4.77 2.43 -1.87 -1.64 114.38 119.19 3h6k h ARG 273 Ca 0.53 -0.08 0.05 0.00 -0.81 0.00 0.00 59.98 59.68 3h6k h ARG 273 Cb 0.67 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 3h6k h ARG 273 CO -0.31 0.51 0.28 -0.22 -1.51 0.00 0.00 179.97 178.72 3h6k h LYS 274 N 0.61 0.33 0.09 0.20 3.64 -0.31 -2.38 116.57 118.76 3h6k h LYS 274 Ca 0.16 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3h6k h LYS 274 Cb 0.05 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3h6k h LYS 274 CO -0.03 0.22 -0.05 0.82 -2.27 0.00 0.00 179.45 178.15 3h6k h ILE 275 N 0.34 1.14 0.00 2.00 2.04 0.30 -3.25 117.51 120.08 3h6k h ILE 275 Ca 0.18 -1.10 -0.05 0.00 1.00 0.00 0.00 64.86 64.90 3h6k h ILE 275 Cb 0.28 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 3h6k h ILE 275 CO -0.04 0.26 -0.22 -0.07 0.00 0.00 0.00 178.15 178.08 3h6k h LEU 276 N -0.65 0.00 0.00 1.44 3.38 -1.16 -2.41 115.31 115.91 3h6k h LEU 276 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3h6k h LEU 276 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3h6k h LEU 276 CO 0.02 0.22 0.00 -0.62 0.09 0.00 0.00 178.44 178.15 3h6k n GLU 277 N -4.09 0.32 0.06 1.13 1.02 -0.91 -1.15 120.64 117.01 3h6k n GLU 277 Ca -0.02 0.08 0.13 0.00 -0.02 0.00 0.00 57.16 57.33 3h6k n GLU 277 Cb 0.29 -1.50 0.33 0.00 -0.02 0.00 0.00 31.44 30.53 3h6k n GLU 277 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3h6k n PHE 278 N -1.15 0.54 -0.15 -0.32 3.72 -0.91 -4.06 117.46 115.13 3h6k n PHE 278 Ca 0.09 0.16 0.05 0.00 -0.05 0.00 0.00 57.45 57.69 3h6k n PHE 278 Cb 0.08 -0.68 0.35 0.00 -0.94 0.00 0.00 39.48 38.29 3h6k n PHE 278 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3h6k h LEU 279 N 0.00 0.65 -0.07 4.37 3.38 -1.33 -2.67 115.31 119.64 3h6k h LEU 279 Ca 0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3h6k h LEU 279 Cb 0.68 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3h6k h LEU 279 CO 0.00 0.44 -0.04 0.22 0.09 0.00 0.00 178.44 179.15 3h6k h TYR 280 N 0.76 0.17 0.00 1.13 3.20 -1.79 -3.44 116.97 116.99 3h6k h TYR 280 Ca 0.27 -0.04 -0.16 0.00 3.14 0.00 0.00 58.73 61.93 3h6k h TYR 280 Cb 0.12 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 3h6k h TYR 280 CO -0.00 0.54 0.53 -1.13 -1.64 0.00 0.00 178.16 176.46 3h6k n SER 281 N -4.76 0.11 0.00 -2.11 3.41 -1.01 -5.23 113.62 104.02 3h6k n SER 281 Ca -0.07 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3h6k n SER 281 Cb 0.27 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 3h6k n SER 281 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23