#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3khu h MET 1 N 0.00 -0.07 -6.59 4.33 4.05 -2.00 -3.43 114.93 111.22 3khu h MET 1 Ca 0.00 0.00 -0.53 0.00 -0.28 0.00 0.00 59.70 58.90 3khu h MET 1 Cb 0.00 0.02 0.01 0.00 -0.80 0.00 0.00 31.60 30.83 3khu h MET 1 CO 0.00 -0.05 0.55 0.12 0.23 0.00 0.00 176.91 177.76 3khu s PHE 2 N -6.18 3.45 -0.14 1.39 5.36 -1.26 -5.02 117.98 115.58 3khu s PHE 2 Ca -0.13 1.39 0.01 0.00 -0.96 0.00 0.00 56.93 57.24 3khu s PHE 2 Cb 0.07 -3.41 0.02 0.00 -0.34 0.00 0.00 43.02 39.36 3khu s PHE 2 CO 0.66 -1.18 -0.17 -2.00 -1.46 0.00 0.00 175.22 171.08 3khu s GLU 3 N 0.31 2.52 -0.23 10.12 2.12 -1.26 -4.61 118.70 127.68 3khu s GLU 3 Ca 0.55 -0.66 -0.28 0.00 0.36 0.00 0.00 54.97 54.93 3khu s GLU 3 Cb -0.31 -2.17 0.01 0.00 0.26 0.00 0.00 34.13 31.92 3khu s GLU 3 CO 0.33 -0.12 1.01 0.42 -0.54 0.00 0.00 175.26 176.36 3khu s ILE 4 N 1.14 4.71 -0.09 -3.70 1.01 -1.26 -4.90 121.20 118.10 3khu s ILE 4 Ca -0.02 1.97 0.06 0.00 0.00 0.00 0.00 60.65 62.66 3khu s ILE 4 Cb -0.14 -4.28 -0.08 0.00 0.01 0.00 0.00 42.46 37.96 3khu s ILE 4 CO -0.06 -0.16 0.16 0.29 0.00 0.00 0.00 174.94 175.18 3khu n LYS 5 N 6.21 1.71 -3.94 2.79 5.02 -1.26 -4.88 118.16 123.81 3khu n LYS 5 Ca 0.11 -0.04 -0.18 0.00 -2.02 0.00 0.00 58.31 56.19 3khu n LYS 5 Cb 0.46 -1.02 -0.16 0.00 -0.02 0.00 0.00 35.03 34.29 3khu n LYS 5 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3khu s LYS 6 N -2.14 0.36 -0.06 1.97 1.02 -1.26 -1.32 119.74 118.32 3khu s LYS 6 Ca -0.01 0.07 0.05 0.00 0.02 0.00 0.00 55.97 56.10 3khu s LYS 6 Cb 0.04 -0.55 -0.01 0.00 -0.52 0.00 0.00 37.83 36.80 3khu s LYS 6 CO 0.24 -0.14 -0.22 0.42 -0.92 0.00 0.00 175.35 174.73 3khu s ILE 7 N 1.09 1.86 -0.12 2.17 1.01 0.81 -0.86 121.20 127.14 3khu s ILE 7 Ca -0.09 -0.94 -0.00 0.00 0.00 0.00 0.00 60.65 59.62 3khu s ILE 7 Cb -0.14 -1.59 -0.02 0.00 0.01 0.00 0.00 42.46 40.73 3khu s ILE 7 CO -0.02 0.52 -0.12 0.00 0.00 0.00 0.00 174.94 175.32 3khu s ILE 10 N 1.33 4.37 0.00 0.00 1.01 -0.01 -0.59 121.20 127.31 3khu s ILE 10 Ca 0.01 0.71 0.00 0.00 0.00 0.00 0.00 60.65 61.37 3khu s ILE 10 Cb -0.16 -4.51 0.00 0.00 0.01 0.00 0.00 42.46 37.80 3khu s ILE 10 CO -0.05 -0.97 0.00 0.61 0.00 0.00 0.00 174.94 174.53 3khu n GLY 11 N 4.98 2.36 2.82 6.18 0.00 0.68 -0.48 105.19 121.73 3khu n GLY 11 Ca 0.06 -0.88 -0.38 0.00 0.00 0.00 0.00 46.02 44.82 3khu n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3khu n ALA 12 N 0.19 6.20 -2.07 4.61 0.00 -1.22 -4.18 120.51 124.04 3khu n ALA 12 Ca 0.00 -4.22 0.00 0.00 0.00 0.00 0.00 53.44 49.22 3khu n ALA 12 Cb 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 19.45 17.70 3khu n ALA 12 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3khu n GLY 13 N -0.47 2.24 0.26 0.00 0.00 -1.26 -4.55 105.19 101.41 3khu n GLY 13 Ca 0.50 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.55 3khu n GLY 13 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3khu h TYR 14 N 0.00 0.45 0.00 1.61 3.20 -1.94 -2.77 116.97 117.52 3khu h TYR 14 Ca 0.00 -0.05 -0.16 0.00 3.14 0.00 0.00 58.73 61.66 3khu h TYR 14 Cb 0.00 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 3khu h TYR 14 CO 0.00 0.50 -0.89 0.28 -1.64 0.00 0.00 178.16 176.41 3khu h VAL 15 N 0.41 1.11 -0.28 1.81 2.07 -1.93 -3.39 116.25 116.04 3khu h VAL 15 Ca 0.08 -2.17 -0.04 0.00 0.82 0.00 0.00 66.70 65.39 3khu h VAL 15 Cb 0.38 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 3khu h VAL 15 CO 0.02 0.38 0.03 1.23 0.02 0.00 0.00 177.57 179.24 3khu h GLY 16 N -1.00 0.51 0.89 2.17 0.00 -1.73 -2.34 103.07 101.57 3khu h GLY 16 Ca -0.24 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 46.69 3khu h GLY 16 CO -0.15 0.33 -0.39 -1.33 0.00 0.00 0.00 176.54 175.00 3khu h GLY 17 N 0.28 -1.15 0.83 4.60 0.00 -1.65 -1.72 103.07 104.25 3khu h GLY 17 Ca 0.08 0.43 0.03 0.00 0.00 0.00 0.00 47.33 47.87 3khu h GLY 17 CO 0.01 -0.42 0.30 -2.55 0.00 0.00 0.00 176.54 173.88 3khu h PRO 18 N -1.23 0.57 0.26 4.80 0.11 -1.76 -0.29 132.00 134.47 3khu h PRO 18 Ca -0.11 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.95 3khu h PRO 18 Cb 0.85 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.83 3khu h PRO 18 CO 0.18 0.38 -0.16 1.15 -0.21 0.00 0.00 178.00 179.34 3khu h THR 19 N 0.59 0.66 0.00 -1.15 2.02 -1.45 -0.85 112.91 112.73 3khu h THR 19 Ca 0.22 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.34 3khu h THR 19 Cb 0.06 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 3khu h THR 19 CO -0.12 0.00 -0.29 0.00 0.37 0.00 0.00 175.52 175.49 3khu h SER 21 N 0.00 0.90 -0.42 0.00 0.02 -0.67 -1.91 113.55 111.46 3khu h SER 21 Ca -0.00 -0.41 -0.08 0.00 -0.84 0.00 0.00 61.79 60.46 3khu h SER 21 Cb 0.75 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 3khu h SER 21 CO 0.04 1.11 -0.05 0.58 -1.14 0.00 0.00 176.83 177.37 3khu h VAL 22 N 0.69 1.27 -0.35 2.27 2.07 -0.61 -1.75 116.25 119.83 3khu h VAL 22 Ca 0.09 -1.11 0.05 0.00 0.82 0.00 0.00 66.70 66.55 3khu h VAL 22 Cb 0.78 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 31.63 3khu h VAL 22 CO 0.06 0.38 0.06 0.40 0.02 0.00 0.00 177.57 178.49 3khu h ILE 23 N 0.61 0.81 -0.81 4.57 2.04 -1.20 -0.73 117.51 122.79 3khu h ILE 23 Ca 0.11 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.92 3khu h ILE 23 Cb 0.55 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 3khu h ILE 23 CO 0.03 0.03 0.54 0.00 0.00 0.00 0.00 178.15 178.75 3khu h ALA 24 N 1.27 1.03 -0.65 1.87 0.00 -1.22 0.86 119.26 122.43 3khu h ALA 24 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3khu h ALA 24 Cb 0.20 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3khu h ALA 24 CO -0.23 0.44 0.38 1.25 0.00 0.00 0.00 179.25 181.08 3khu h HIS 25 N 1.10 0.85 0.00 0.00 -0.00 -0.48 -2.96 115.15 113.65 3khu h HIS 25 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.67 3khu h HIS 25 Cb -0.12 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 27.01 3khu h HIS 25 CO -0.02 0.57 -1.02 -1.33 -0.00 0.00 0.00 177.93 176.13 3khu n MET 26 N -4.40 0.37 -3.61 5.26 2.81 -0.36 -4.57 117.12 112.62 3khu n MET 26 Ca 0.06 0.02 -0.27 0.00 -1.81 0.00 0.00 57.70 55.70 3khu n MET 26 Cb 0.07 -1.65 -0.10 0.00 -0.71 0.00 0.00 33.22 30.84 3khu n MET 26 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3khu h PRO 28 N 5.12 0.00 -0.08 0.00 0.11 -1.81 -1.70 132.00 133.65 3khu h PRO 28 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 3khu h PRO 28 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 3khu h PRO 28 CO 0.62 0.01 0.00 -0.85 -0.21 0.00 0.00 178.00 177.57 3khu n GLU 29 N -3.48 1.92 -4.05 1.05 0.00 -1.26 -4.81 120.64 110.01 3khu n GLU 29 Ca -0.03 -1.35 -0.35 0.00 0.00 0.00 0.00 57.16 55.43 3khu n GLU 29 Cb 0.10 -1.46 -0.10 0.00 0.00 0.00 0.00 31.44 29.98 3khu n GLU 29 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 3khu s ILE 30 N -1.92 4.73 -0.22 3.84 1.01 -0.64 -4.92 121.20 123.08 3khu s ILE 30 Ca 0.34 -0.06 -0.23 0.00 0.00 0.00 0.00 60.65 60.71 3khu s ILE 30 Cb 0.20 -3.12 -0.01 0.00 0.01 0.00 0.00 42.46 39.54 3khu s ILE 30 CO 0.31 0.48 0.75 -0.60 0.00 0.00 0.00 174.94 175.88 3khu s ARG 31 N 0.24 4.19 -0.20 2.79 3.52 -0.43 -4.84 118.95 124.22 3khu s ARG 31 Ca 0.04 0.81 -0.01 0.00 -0.13 0.00 0.00 55.73 56.44 3khu s ARG 31 Cb -0.12 -3.62 0.01 0.00 -1.56 0.00 0.00 34.95 29.66 3khu s ARG 31 CO 0.01 -0.41 -0.14 0.08 -0.81 0.00 0.00 175.30 174.02 3khu s VAL 32 N 2.49 2.52 -0.27 7.11 1.01 0.60 -0.14 120.40 133.73 3khu s VAL 32 Ca 0.32 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.51 3khu s VAL 32 Cb -0.16 -2.11 0.05 0.00 0.00 0.00 0.00 36.38 34.17 3khu s VAL 32 CO 0.09 0.48 -0.08 -0.89 0.00 0.00 0.00 175.10 174.69 3khu s THR 33 N 1.35 2.41 -0.15 3.92 2.01 0.24 -0.62 115.64 124.80 3khu s THR 33 Ca 0.05 -1.53 -0.18 0.00 0.31 0.00 0.00 61.69 60.34 3khu s THR 33 Cb -0.14 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.95 3khu s THR 33 CO -0.09 -0.02 0.49 -0.69 -0.69 0.00 0.00 174.62 173.61 3khu s VAL 34 N 1.15 5.16 0.19 3.82 1.01 0.17 -1.22 120.40 130.68 3khu s VAL 34 Ca -0.07 0.96 0.07 0.00 0.00 0.00 0.00 61.98 62.94 3khu s VAL 34 Cb -0.20 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 3khu s VAL 34 CO -0.04 0.27 -0.14 0.68 0.00 0.00 0.00 175.10 175.87 3khu s VAL 35 N 0.98 1.68 -0.13 2.92 -7.23 0.24 -1.28 120.40 117.57 3khu s VAL 35 Ca 0.25 -2.16 -0.29 0.00 -1.81 0.00 0.00 61.98 57.97 3khu s VAL 35 Cb -0.15 -2.00 0.08 0.00 0.56 0.00 0.00 36.38 34.87 3khu s VAL 35 CO 0.10 -0.58 0.75 -0.62 -0.31 0.00 0.00 175.10 174.44 3khu s ASP 36 N -3.23 -0.64 0.39 4.85 -1.08 -1.18 -0.23 116.67 115.55 3khu s ASP 36 Ca 0.21 0.88 0.19 0.00 -0.52 0.00 0.00 52.55 53.32 3khu s ASP 36 Cb -0.01 0.77 0.76 0.00 -1.46 0.00 0.00 42.92 42.98 3khu s ASP 36 CO 0.06 -0.46 1.77 -0.37 0.52 0.00 0.00 175.17 176.70 3khu h VAL 37 N 3.24 0.85 -2.52 1.11 -1.51 -1.92 -3.41 116.25 112.10 3khu h VAL 37 Ca -0.27 -1.39 -0.54 0.00 -1.23 0.00 0.00 66.70 63.27 3khu h VAL 37 Cb 1.15 1.85 -0.07 0.00 -2.13 0.00 0.00 31.29 32.09 3khu h VAL 37 CO 0.28 0.34 1.07 0.21 -1.23 0.00 0.00 177.57 178.23 3khu s ASN 38 N -6.43 6.14 0.16 4.19 3.84 -1.26 -4.89 114.94 116.69 3khu s ASN 38 Ca -0.00 -0.22 -0.15 0.00 0.21 0.00 0.00 52.86 52.69 3khu s ASN 38 Cb 0.11 -2.56 0.04 0.00 -0.55 0.00 0.00 41.25 38.30 3khu s ASN 38 CO 0.68 -1.81 1.81 -0.08 -2.79 0.00 0.00 177.10 174.90 3khu h GLU 39 N 10.44 0.51 -0.96 0.43 4.81 -2.00 -2.70 114.58 125.11 3khu h GLU 39 Ca -0.27 -0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.02 3khu h GLU 39 Cb 1.06 -0.11 -0.08 0.00 0.63 0.00 0.00 28.75 30.25 3khu h GLU 39 CO 1.25 0.34 0.60 1.03 -0.73 0.00 0.00 179.01 181.49 3khu h SER 40 N 0.52 0.90 -0.30 1.04 0.87 -1.98 -0.92 113.55 113.69 3khu h SER 40 Ca 0.17 0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.64 3khu h SER 40 Cb -0.01 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 61.80 3khu h SER 40 CO -0.07 0.52 -0.29 -0.09 -0.53 0.00 0.00 176.83 176.38 3khu h ARG 41 N 1.00 0.73 -0.46 2.24 2.43 -1.91 -1.78 114.38 116.62 3khu h ARG 41 Ca 0.45 -0.38 0.03 0.00 -0.81 0.00 0.00 59.98 59.27 3khu h ARG 41 Cb 0.35 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 3khu h ARG 41 CO -0.23 1.00 0.26 0.82 -1.51 0.00 0.00 179.97 180.31 3khu h ILE 42 N 0.48 1.02 -0.58 1.20 1.08 -1.13 -1.19 117.51 118.39 3khu h ILE 42 Ca 0.05 -0.18 0.06 0.00 -0.39 0.00 0.00 64.86 64.41 3khu h ILE 42 Cb 0.86 0.46 -0.06 0.00 -3.07 0.00 0.00 36.82 35.01 3khu h ILE 42 CO 0.07 0.09 0.28 0.78 -0.69 0.00 0.00 178.15 178.68 3khu h ASN 43 N 0.52 0.37 -0.96 1.72 2.35 -1.08 -1.06 115.58 117.44 3khu h ASN 43 Ca 0.19 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3khu h ASN 43 Cb 0.05 -0.02 -0.05 0.00 0.05 0.00 0.00 38.32 38.35 3khu h ASN 43 CO -0.10 0.24 0.61 0.00 -1.65 0.00 0.00 177.43 176.52 3khu h ALA 44 N 1.34 1.22 0.00 -0.83 0.00 -0.88 -0.90 119.26 119.21 3khu h ALA 44 Ca 0.27 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3khu h ALA 44 Cb 0.23 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3khu h ALA 44 CO -0.21 0.65 -0.16 -1.49 0.00 0.00 0.00 179.25 178.04 3khu h TRP 45 N 1.32 0.00 -0.33 0.00 4.06 -0.52 -1.89 115.95 118.58 3khu h TRP 45 Ca 0.35 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.30 3khu h TRP 45 Cb -0.10 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.06 3khu h TRP 45 CO 0.00 0.16 0.00 0.09 -3.56 0.00 0.00 178.44 175.13 3khu n ASN 46 N -4.34 1.91 -4.88 -3.49 3.02 -0.41 -4.94 115.26 102.13 3khu n ASN 46 Ca -0.03 -2.04 -0.27 0.00 -0.03 0.00 0.00 54.58 52.22 3khu n ASN 46 Cb 0.23 -0.25 -0.02 0.00 -0.61 0.00 0.00 39.78 39.13 3khu n ASN 46 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3khu s SER 47 N -0.94 4.56 0.04 6.41 1.04 -0.71 -5.04 113.70 119.06 3khu s SER 47 Ca 0.23 -1.30 0.28 0.00 0.48 0.00 0.00 55.95 55.63 3khu s SER 47 Cb 0.12 0.43 1.05 0.00 0.10 0.00 0.00 66.02 67.72 3khu s SER 47 CO 0.15 -1.07 1.83 -2.65 0.98 0.00 0.00 173.24 172.47 3khu n PRO 48 N -1.69 0.06 -3.76 4.02 -0.02 -1.26 -4.56 135.00 127.79 3khu n PRO 48 Ca -0.04 0.04 -0.36 0.00 -2.02 0.00 0.00 63.50 61.12 3khu n PRO 48 Cb 0.65 -1.56 -0.11 0.00 -0.02 0.00 0.00 33.50 32.45 3khu n PRO 48 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3khu s THR 49 N -3.02 3.38 0.53 3.45 2.01 -1.26 -5.10 115.64 115.62 3khu s THR 49 Ca 0.13 -2.17 -0.21 0.00 0.31 0.00 0.00 61.69 59.75 3khu s THR 49 Cb 0.17 -3.30 -0.06 0.00 0.01 0.00 0.00 72.50 69.33 3khu s THR 49 CO 0.57 -0.72 1.21 -0.76 -0.69 0.00 0.00 174.62 174.23 3khu s LEU 50 N 0.98 3.85 0.18 4.42 1.43 -1.26 -4.69 118.68 123.59 3khu s LEU 50 Ca 0.09 2.40 0.26 0.00 -1.03 0.00 0.00 54.13 55.85 3khu s LEU 50 Cb -0.23 -4.39 0.90 0.00 0.03 0.00 0.00 46.19 42.50 3khu s LEU 50 CO -0.04 -1.28 1.77 -0.81 0.23 0.00 0.00 176.35 176.23 3khu n PRO 51 N -1.01 0.20 -4.85 1.29 -0.04 -1.26 -4.57 135.00 124.77 3khu n PRO 51 Ca 0.10 0.23 -0.33 0.00 -0.04 0.00 0.00 63.50 63.46 3khu n PRO 51 Cb 0.48 -1.77 -0.15 0.00 -0.04 0.00 0.00 33.50 32.03 3khu n PRO 51 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3khu s ILE 52 N -3.12 2.78 -0.30 0.52 -1.09 -1.26 -5.10 121.20 113.62 3khu s ILE 52 Ca 0.10 -0.76 -0.17 0.00 -2.23 0.00 0.00 60.65 57.59 3khu s ILE 52 Cb 0.13 -2.15 -0.02 0.00 -1.58 0.00 0.00 42.46 38.84 3khu s ILE 52 CO 0.54 0.53 0.47 -0.47 -1.23 0.00 0.00 174.94 174.78 3khu s TYR 53 N 0.41 3.23 -0.04 3.97 5.04 -1.26 -4.98 117.35 123.71 3khu s TYR 53 Ca -0.12 0.38 -0.02 0.00 -2.44 0.00 0.00 57.07 54.87 3khu s TYR 53 Cb -0.16 -2.75 0.02 0.00 0.35 0.00 0.00 41.96 39.42 3khu s TYR 53 CO 0.06 -0.37 0.09 -1.21 -1.34 0.00 0.00 175.55 172.78 3khu s GLU 54 N 2.26 0.07 0.21 4.97 0.41 -1.26 -4.84 118.70 120.52 3khu s GLU 54 Ca 0.18 0.22 -0.32 0.00 -0.41 0.00 0.00 54.97 54.64 3khu s GLU 54 Cb -0.16 -0.09 -0.14 0.00 -1.78 0.00 0.00 34.13 31.96 3khu s GLU 54 CO 0.11 -0.10 1.37 -2.30 -0.49 0.00 0.00 175.26 173.85 3khu n PRO 55 N 3.68 1.81 0.00 0.39 -0.02 -1.26 -2.09 135.00 137.51 3khu n PRO 55 Ca -0.20 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 3khu n PRO 55 Cb 0.55 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 3khu n PRO 55 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3khu n GLY 56 N 2.26 2.69 0.22 -1.23 0.00 -1.26 -4.44 105.19 103.42 3khu n GLY 56 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 3khu n GLY 56 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3khu h LEU 57 N 0.00 0.76 -0.53 0.99 5.85 -1.84 -2.49 115.31 118.06 3khu h LEU 57 Ca 0.00 -0.45 0.08 0.00 0.84 0.00 0.00 57.88 58.35 3khu h LEU 57 Cb 0.00 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 40.75 3khu h LEU 57 CO 0.00 1.05 0.16 0.50 -0.34 0.00 0.00 178.44 179.81 3khu h LYS 58 N 0.48 0.31 -0.04 1.25 3.64 -1.90 -0.86 116.57 119.43 3khu h LYS 58 Ca 0.06 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.28 3khu h LYS 58 Cb 0.82 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 3khu h LYS 58 CO 0.07 0.20 -0.60 1.05 -2.27 0.00 0.00 179.45 177.90 3khu h GLU 59 N 0.31 0.15 -0.01 1.90 9.09 -1.92 -1.03 114.58 123.08 3khu h GLU 59 Ca 0.26 -0.10 -0.00 0.00 0.05 0.00 0.00 59.36 59.57 3khu h GLU 59 Cb 0.32 0.01 -0.00 0.00 -1.65 0.00 0.00 28.75 27.44 3khu h GLU 59 CO -0.30 0.70 -0.00 0.28 0.05 0.00 0.00 179.01 179.74 3khu h VAL 60 N 0.11 1.30 -0.50 -1.06 2.07 -1.10 -2.42 116.25 114.65 3khu h VAL 60 Ca -0.01 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 3khu h VAL 60 Cb 1.08 1.89 -0.02 0.00 -1.52 0.00 0.00 31.29 32.71 3khu h VAL 60 CO 0.09 0.23 0.28 0.58 0.02 0.00 0.00 177.57 178.77 3khu h VAL 61 N -0.36 1.17 0.00 2.57 2.07 -1.03 -2.72 116.25 117.95 3khu h VAL 61 Ca 0.00 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 3khu h VAL 61 Cb 0.38 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3khu h VAL 61 CO 0.00 0.18 -0.18 -0.33 0.02 0.00 0.00 177.57 177.26 3khu h GLU 62 N 0.67 0.00 0.00 1.57 5.08 -1.20 0.11 114.58 120.82 3khu h GLU 62 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3khu h GLU 62 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3khu h GLU 62 CO -0.03 0.18 0.00 0.66 -1.00 0.00 0.00 179.01 178.82 3khu h SER 63 N 0.00 0.00 0.00 1.42 4.64 -1.10 -3.37 113.55 115.14 3khu h SER 63 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3khu h SER 63 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 3khu h SER 63 CO 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 3khu s ARG 65 N 0.00 4.15 0.00 0.00 3.52 0.36 -1.06 118.95 125.92 3khu s ARG 65 Ca 0.00 2.52 0.00 0.00 -0.13 0.00 0.00 55.73 58.12 3khu s ARG 65 Cb 0.00 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.31 3khu s ARG 65 CO 0.00 -0.67 0.00 0.41 -0.81 0.00 0.00 175.30 174.23 3khu n GLY 66 N 3.43 2.48 0.02 8.12 0.00 -0.34 -4.88 105.19 114.03 3khu n GLY 66 Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 3khu n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3khu n LYS 67 N -2.00 0.13 0.00 1.61 5.02 -0.22 -4.87 118.16 117.83 3khu n LYS 67 Ca 0.00 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 3khu n LYS 67 Cb 0.00 -0.76 0.00 0.00 -0.02 0.00 0.00 35.03 34.25 3khu n LYS 67 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3khu n ASN 68 N -2.96 0.90 -4.30 4.39 6.94 -1.01 -5.03 115.26 114.18 3khu n ASN 68 Ca -0.03 -1.21 -0.33 0.00 -0.02 0.00 0.00 54.58 52.99 3khu n ASN 68 Cb 0.12 0.00 -0.15 0.00 -2.36 0.00 0.00 39.78 37.39 3khu n ASN 68 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3khu s LEU 69 N -0.21 2.61 -0.00 -4.53 2.96 -1.06 -0.29 118.68 118.17 3khu s LEU 69 Ca 0.00 -0.42 0.02 0.00 -0.22 0.00 0.00 54.13 53.51 3khu s LEU 69 Cb 0.00 -1.61 -0.01 0.00 0.50 0.00 0.00 46.19 45.08 3khu s LEU 69 CO 0.00 0.08 -0.07 -0.36 -1.32 0.00 0.00 176.35 174.69 3khu s PHE 70 N 0.83 0.58 -0.16 5.38 0.08 0.21 -1.20 117.98 123.71 3khu s PHE 70 Ca -0.04 -0.14 0.00 0.00 0.12 0.00 0.00 56.93 56.87 3khu s PHE 70 Cb -0.15 -0.37 0.00 0.00 -0.57 0.00 0.00 43.02 41.93 3khu s PHE 70 CO 0.00 -0.01 -0.16 -0.06 -0.10 0.00 0.00 175.22 174.89 3khu s PHE 71 N -0.25 2.77 0.00 0.36 0.08 -1.26 0.43 117.98 120.11 3khu s PHE 71 Ca 0.01 -1.10 -0.16 0.00 0.12 0.00 0.00 56.93 55.80 3khu s PHE 71 Cb -0.03 -1.89 0.03 0.00 -0.57 0.00 0.00 43.02 40.56 3khu s PHE 71 CO -0.00 -0.51 0.35 0.45 -0.10 0.00 0.00 175.22 175.41 3khu s SER 72 N 0.85 -0.22 0.00 1.36 0.15 -0.41 -4.94 113.70 110.49 3khu s SER 72 Ca -0.05 0.06 0.26 0.00 0.70 0.00 0.00 55.95 56.92 3khu s SER 72 Cb -0.15 0.35 0.61 0.00 -1.71 0.00 0.00 66.02 65.12 3khu s SER 72 CO -0.01 -0.53 1.48 0.35 1.20 0.00 0.00 173.24 175.73 3khu n THR 73 N 0.98 0.00 -2.58 6.45 -2.24 -1.26 -3.11 114.28 112.52 3khu n THR 73 Ca -0.20 -0.25 -0.43 0.00 -2.27 0.00 0.00 64.05 60.89 3khu n THR 73 Cb 0.57 0.77 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 3khu n THR 73 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3khu n ASN 74 N 0.05 4.92 -0.06 3.42 2.85 -1.26 -4.78 115.26 120.39 3khu n ASN 74 Ca 0.14 -2.93 -0.11 0.00 -0.11 0.00 0.00 54.58 51.57 3khu n ASN 74 Cb 0.41 -1.70 -0.05 0.00 1.24 0.00 0.00 39.78 39.68 3khu n ASN 74 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 3khu h ILE 75 N 5.24 1.21 -0.53 -1.44 2.04 -1.91 -2.96 117.51 119.17 3khu h ILE 75 Ca 0.43 -0.66 0.01 0.00 1.00 0.00 0.00 64.86 65.64 3khu h ILE 75 Cb 0.85 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 3khu h ILE 75 CO 1.46 0.21 0.35 0.44 0.00 0.00 0.00 178.15 180.60 3khu h ASP 76 N 0.13 0.61 0.62 1.72 3.32 -1.99 -1.26 116.42 119.57 3khu h ASP 76 Ca 0.06 -0.02 -0.14 0.00 0.02 0.00 0.00 57.03 56.96 3khu h ASP 76 Cb 0.27 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 3khu h ASP 76 CO 0.00 0.44 -0.66 0.44 -1.72 0.00 0.00 179.24 177.74 3khu h ASP 77 N 0.72 0.03 -0.31 6.45 3.32 -1.96 -1.81 116.42 122.86 3khu h ASP 77 Ca 0.19 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.19 3khu h ASP 77 Cb -0.08 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3khu h ASP 77 CO -0.04 0.68 0.05 0.00 -1.72 0.00 0.00 179.24 178.21 3khu h ALA 78 N 1.32 0.41 -0.33 3.45 0.00 -1.26 -2.46 119.26 120.39 3khu h ALA 78 Ca -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 3khu h ALA 78 Cb 1.16 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3khu h ALA 78 CO 0.09 0.10 0.16 0.82 0.00 0.00 0.00 179.25 180.41 3khu h ILE 79 N 0.33 1.15 -0.57 0.00 2.04 -1.19 -2.89 117.51 116.38 3khu h ILE 79 Ca 0.09 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.58 3khu h ILE 79 Cb 0.34 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.20 3khu h ILE 79 CO 0.01 0.16 0.27 0.50 0.00 0.00 0.00 178.15 179.08 3khu h LYS 80 N 0.39 0.49 0.00 2.37 3.64 -1.16 -2.01 116.57 120.30 3khu h LYS 80 Ca 0.11 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3khu h LYS 80 Cb 0.11 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3khu h LYS 80 CO -0.01 0.32 -0.08 0.39 -2.27 0.00 0.00 179.45 177.79 3khu n GLU 81 N -4.91 0.10 -2.92 1.90 1.02 -0.94 -4.85 120.64 110.04 3khu n GLU 81 Ca 0.07 0.07 -0.38 0.00 -0.02 0.00 0.00 57.16 56.90 3khu n GLU 81 Cb 0.19 -1.61 -0.06 0.00 -0.02 0.00 0.00 31.44 29.94 3khu n GLU 81 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3khu s ALA 82 N -3.04 3.36 0.04 0.62 0.00 -0.76 -4.86 121.76 117.13 3khu s ALA 82 Ca 0.12 0.40 -0.13 0.00 0.00 0.00 0.00 51.96 52.35 3khu s ALA 82 Cb 0.16 -3.02 -0.34 0.00 0.00 0.00 0.00 23.12 19.92 3khu s ALA 82 CO 0.58 0.26 1.04 -0.44 0.00 0.00 0.00 175.76 177.19 3khu h ASP 83 N 3.80 0.74 -3.61 0.00 3.32 -1.33 -3.46 116.42 115.88 3khu h ASP 83 Ca -0.47 -0.79 -0.55 0.00 0.02 0.00 0.00 57.03 55.24 3khu h ASP 83 Cb 1.20 -0.24 -0.32 0.00 0.22 0.00 0.00 39.33 40.18 3khu h ASP 83 CO 0.66 1.62 -0.83 -0.22 -1.72 0.00 0.00 179.24 178.75 3khu s LEU 84 N -7.47 1.80 -0.28 1.55 2.96 -1.02 -1.27 118.68 114.95 3khu s LEU 84 Ca -0.08 -0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 53.48 3khu s LEU 84 Cb 0.05 -0.93 0.05 0.00 0.50 0.00 0.00 46.19 45.85 3khu s LEU 84 CO 0.93 0.09 -0.03 -0.69 -1.32 0.00 0.00 176.35 175.34 3khu s VAL 85 N 0.37 2.85 0.07 1.68 1.01 0.19 -1.08 120.40 125.49 3khu s VAL 85 Ca -0.10 -1.34 -0.30 0.00 0.00 0.00 0.00 61.98 60.23 3khu s VAL 85 Cb -0.14 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 3khu s VAL 85 CO 0.04 -0.03 1.07 -0.36 0.00 0.00 0.00 175.10 175.82 3khu s PHE 86 N 1.25 3.61 -0.40 5.22 0.08 0.04 -0.84 117.98 126.93 3khu s PHE 86 Ca -0.05 1.58 -0.16 0.00 0.12 0.00 0.00 56.93 58.42 3khu s PHE 86 Cb -0.19 -3.23 0.01 0.00 -0.57 0.00 0.00 43.02 39.04 3khu s PHE 86 CO -0.02 -0.48 0.38 0.42 -0.10 0.00 0.00 175.22 175.42 3khu s ILE 87 N 0.60 5.15 -0.38 0.64 1.01 0.73 -0.83 121.20 128.12 3khu s ILE 87 Ca 0.53 -0.32 0.10 0.00 0.00 0.00 0.00 60.65 60.96 3khu s ILE 87 Cb -0.26 -3.95 0.44 0.00 0.01 0.00 0.00 42.46 38.70 3khu s ILE 87 CO 0.30 -0.31 1.07 -0.24 0.00 0.00 0.00 174.94 175.77 3khu n SER 88 N 5.44 3.61 -4.94 3.58 2.88 0.37 -1.09 113.62 123.46 3khu n SER 88 Ca -0.09 -3.33 -0.22 0.00 -1.33 0.00 0.00 58.87 53.91 3khu n SER 88 Cb 0.48 -0.47 -0.02 0.00 -0.75 0.00 0.00 64.21 63.45 3khu n SER 88 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3khu s VAL 89 N -4.63 5.14 0.57 2.46 -7.23 -1.25 -4.42 120.40 111.03 3khu s VAL 89 Ca 0.41 -1.03 -0.18 0.00 -1.81 0.00 0.00 61.98 59.37 3khu s VAL 89 Cb 0.41 -3.78 -0.05 0.00 0.56 0.00 0.00 36.38 33.53 3khu s VAL 89 CO -0.09 -0.31 1.10 0.54 -0.31 0.00 0.00 175.10 176.03 3khu s ASN 90 N -3.90 5.68 -0.52 4.85 4.22 -1.26 -4.76 114.94 119.26 3khu s ASN 90 Ca 0.34 2.05 0.04 0.00 -2.14 0.00 0.00 52.86 53.15 3khu s ASN 90 Cb -0.09 -2.56 0.13 0.00 1.28 0.00 0.00 41.25 40.01 3khu s ASN 90 CO 0.28 -1.24 0.27 0.42 -2.04 0.00 0.00 177.10 174.80 3khu s THR 91 N -2.02 2.44 0.62 0.54 -4.23 -1.26 -4.67 115.64 107.05 3khu s THR 91 Ca 0.69 -3.28 -0.14 0.00 -1.18 0.00 0.00 61.69 57.78 3khu s THR 91 Cb -0.21 -2.69 -0.03 0.00 1.34 0.00 0.00 72.50 70.91 3khu s THR 91 CO 0.30 -0.83 1.05 -2.16 -0.54 0.00 0.00 174.62 172.45 3khu s PRO 92 N -0.28 3.27 0.32 3.99 0.04 -1.26 -4.51 135.00 136.57 3khu s PRO 92 Ca 0.18 1.11 -0.29 0.00 0.04 0.00 0.00 61.00 62.03 3khu s PRO 92 Cb -0.24 -2.03 -0.11 0.00 0.04 0.00 0.00 34.50 32.16 3khu s PRO 92 CO -0.01 -0.85 1.55 0.99 0.04 0.00 0.00 177.00 178.72 3khu s THR 93 N -2.65 2.09 0.26 1.26 2.01 -1.26 -0.38 115.64 116.98 3khu s THR 93 Ca 0.61 0.08 -0.31 0.00 0.31 0.00 0.00 61.69 62.39 3khu s THR 93 Cb -0.15 -3.05 -0.12 0.00 0.01 0.00 0.00 72.50 69.19 3khu s THR 93 CO 0.42 0.02 1.66 0.29 -0.69 0.00 0.00 174.62 176.31 3khu n LYS 94 N 1.58 2.76 0.00 4.92 5.02 -0.15 -4.78 118.16 127.51 3khu n LYS 94 Ca 0.06 0.99 0.10 0.00 -2.02 0.00 0.00 58.31 57.43 3khu n LYS 94 Cb 0.38 -2.80 -0.10 0.00 -0.02 0.00 0.00 35.03 32.49 3khu n LYS 94 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3khu n THR 95 N 2.96 0.00 -4.07 -0.18 -2.24 -1.26 -0.08 114.28 109.41 3khu n THR 95 Ca 0.12 -0.06 -0.10 0.00 -2.27 0.00 0.00 64.05 61.74 3khu n THR 95 Cb 0.36 1.03 -0.08 0.00 -2.10 0.00 0.00 70.33 69.54 3khu n THR 95 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3khu s TYR 96 N -2.83 0.68 0.00 4.78 -0.85 -1.26 -4.82 117.35 113.05 3khu s TYR 96 Ca 0.09 -1.00 0.00 0.00 -0.52 0.00 0.00 57.07 55.63 3khu s TYR 96 Cb 0.15 -0.21 0.00 0.00 0.38 0.00 0.00 41.96 42.28 3khu s TYR 96 CO 0.79 -0.73 0.00 0.41 -1.52 0.00 0.00 175.55 174.50 3khu n GLY 97 N -0.25 -1.05 3.67 5.49 0.00 -1.26 -4.36 105.19 107.43 3khu n GLY 97 Ca -0.03 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 3khu n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3khu s MET 98 N 0.00 4.24 0.00 1.61 -1.94 -1.26 -2.03 119.30 119.92 3khu s MET 98 Ca 0.00 1.91 0.00 0.00 -1.71 0.00 0.00 55.69 55.89 3khu s MET 98 Cb 0.00 -3.75 0.00 0.00 2.01 0.00 0.00 34.83 33.09 3khu s MET 98 CO 0.00 -0.69 0.00 0.41 -0.01 0.00 0.00 175.02 174.73 3khu n GLY 99 N 3.75 0.55 3.58 -0.03 0.00 -1.26 -4.86 105.19 106.93 3khu n GLY 99 Ca 0.14 -0.67 -0.57 0.00 0.00 0.00 0.00 46.02 44.92 3khu n GLY 99 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3khu n LYS 100 N -2.75 0.59 -0.91 1.61 4.81 -0.86 -0.39 118.16 120.25 3khu n LYS 100 Ca 0.00 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.65 3khu n LYS 100 Cb 0.00 -1.79 0.00 0.00 0.02 0.00 0.00 35.03 33.26 3khu n LYS 100 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3khu n GLY 101 N 2.45 0.97 1.21 3.14 0.00 0.88 -4.72 105.19 109.11 3khu n GLY 101 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3khu n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3khu n ARG 102 N -2.00 0.00 -2.24 1.61 1.74 -0.49 -4.97 116.66 110.30 3khu n ARG 102 Ca 0.00 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.71 3khu n ARG 102 Cb 0.00 -0.15 -0.00 0.00 -1.02 0.00 0.00 32.46 31.28 3khu n ARG 102 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3khu s ALA 103 N -1.60 2.90 0.23 7.54 0.00 0.47 -3.66 121.76 127.64 3khu s ALA 103 Ca 0.00 0.92 -0.20 0.00 0.00 0.00 0.00 51.96 52.69 3khu s ALA 103 Cb 0.00 -3.38 -0.08 0.00 0.00 0.00 0.00 23.12 19.65 3khu s ALA 103 CO 0.00 -0.71 0.73 0.00 0.00 0.00 0.00 175.76 175.78 3khu s ALA 104 N -1.59 3.40 -0.42 0.00 0.00 -1.26 -0.98 121.76 120.91 3khu s ALA 104 Ca 0.66 0.17 -0.18 0.00 0.00 0.00 0.00 51.96 52.62 3khu s ALA 104 Cb -0.28 -2.83 0.02 0.00 0.00 0.00 0.00 23.12 20.03 3khu s ALA 104 CO 0.33 0.32 0.46 0.34 0.00 0.00 0.00 175.76 177.21 3khu s ASP 105 N -1.69 6.21 -0.02 0.00 -1.08 0.49 -4.72 116.67 115.85 3khu s ASP 105 Ca 0.44 -0.63 0.04 0.00 -0.52 0.00 0.00 52.55 51.88 3khu s ASP 105 Cb -0.16 -2.23 0.16 0.00 -1.46 0.00 0.00 42.92 39.23 3khu s ASP 105 CO 0.21 -0.59 0.97 0.18 0.52 0.00 0.00 175.17 176.45 3khu n LEU 106 N 5.66 1.40 -0.18 -1.34 4.77 -1.26 -4.13 117.00 121.91 3khu n LEU 106 Ca -0.07 -0.71 -0.01 0.00 -0.03 0.00 0.00 56.01 55.19 3khu n LEU 106 Cb 0.47 -0.30 0.09 0.00 -2.33 0.00 0.00 43.42 41.35 3khu n LEU 106 CO 0.47 0.27 0.96 0.07 -1.33 0.00 0.00 177.39 177.83 3khu h LYS 107 N 0.93 0.35 -0.23 3.23 2.10 -1.93 -0.76 116.57 120.26 3khu h LYS 107 Ca 0.00 -0.02 -0.20 0.00 -2.00 0.00 0.00 60.65 58.43 3khu h LYS 107 Cb 0.49 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 3khu h LYS 107 CO 0.05 0.23 -0.63 1.88 -2.00 0.00 0.00 179.45 178.98 3khu h TYR 108 N 0.36 1.03 -0.63 0.07 0.05 -1.84 -0.85 116.97 115.16 3khu h TYR 108 Ca 0.28 -0.40 -0.01 0.00 0.05 0.00 0.00 58.73 58.65 3khu h TYR 108 Cb 0.34 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 37.87 3khu h TYR 108 CO -0.18 1.22 0.35 0.82 -1.05 0.00 0.00 178.16 179.32 3khu h ILE 109 N 0.59 1.20 -0.45 -2.88 1.08 -1.75 -1.10 117.51 114.20 3khu h ILE 109 Ca -0.01 -0.50 -0.03 0.00 -0.39 0.00 0.00 64.86 63.93 3khu h ILE 109 Cb 1.24 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.35 3khu h ILE 109 CO 0.13 0.22 0.17 -0.08 -0.69 0.00 0.00 178.15 177.90 3khu h GLU 110 N 0.86 0.68 -0.59 2.37 4.81 -0.92 -1.27 114.58 120.53 3khu h GLU 110 Ca 0.22 -0.13 0.01 0.00 -0.13 0.00 0.00 59.36 59.33 3khu h GLU 110 Cb 0.04 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 3khu h GLU 110 CO -0.04 0.63 0.38 0.00 -0.73 0.00 0.00 179.01 179.26 3khu h ALA 111 N 1.02 0.75 -0.50 2.92 0.00 -0.90 -0.87 119.26 121.68 3khu h ALA 111 Ca 0.15 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.06 3khu h ALA 111 Cb 0.21 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3khu h ALA 111 CO -0.01 0.16 0.26 0.00 0.00 0.00 0.00 179.25 179.66 3khu h ALA 113 N 1.26 0.92 -0.48 0.00 0.00 -0.56 0.25 119.26 120.64 3khu h ALA 113 Ca 0.21 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 3khu h ALA 113 Cb 0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3khu h ALA 113 CO -0.14 0.43 -0.11 0.00 0.00 0.00 0.00 179.25 179.43 3khu h ARG 114 N 0.99 0.93 -0.49 0.00 3.08 -0.95 -2.17 114.38 115.76 3khu h ARG 114 Ca 0.25 -0.35 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 3khu h ARG 114 Cb 0.03 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 3khu h ARG 114 CO -0.04 1.01 0.09 -0.09 -1.07 0.00 0.00 179.97 179.87 3khu h ARG 115 N 0.78 0.81 -0.39 0.04 9.65 -0.80 -1.76 114.38 122.70 3khu h ARG 115 Ca 0.12 -0.21 0.03 0.00 -1.10 0.00 0.00 59.98 58.82 3khu h ARG 115 Cb 0.67 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 29.12 3khu h ARG 115 CO 0.05 0.80 0.20 0.82 2.80 0.00 0.00 179.97 184.64 3khu h ILE 116 N 0.69 0.99 -0.28 1.20 2.04 -0.38 -1.72 117.51 120.03 3khu h ILE 116 Ca 0.15 -0.14 -0.12 0.00 1.00 0.00 0.00 64.86 65.75 3khu h ILE 116 Cb 0.37 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 3khu h ILE 116 CO 0.01 0.07 -0.31 1.62 0.00 0.00 0.00 178.15 179.54 3khu h VAL 117 N 0.41 1.28 -0.91 1.67 3.04 -1.27 -2.43 116.25 118.04 3khu h VAL 117 Ca 0.17 -1.42 0.01 0.00 -1.01 0.00 0.00 66.70 64.44 3khu h VAL 117 Cb 0.06 1.40 -0.04 0.00 -2.01 0.00 0.00 31.29 30.70 3khu h VAL 117 CO -0.11 0.46 0.60 -0.61 -1.01 0.00 0.00 177.57 176.90 3khu h GLN 118 N 0.51 1.20 -0.60 4.17 4.15 -0.90 -3.05 115.11 120.59 3khu h GLN 118 Ca 0.06 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.41 3khu h GLN 118 Cb 0.79 -0.27 0.00 0.00 0.21 0.00 0.00 27.48 28.21 3khu h GLN 118 CO 0.06 0.79 0.00 0.09 -1.93 0.00 0.00 178.83 177.85 3khu n ASN 119 N -4.39 4.59 -4.31 -0.69 3.02 -0.69 -4.99 115.26 107.80 3khu n ASN 119 Ca 0.10 -2.46 -0.27 0.00 -0.03 0.00 0.00 54.58 51.92 3khu n ASN 119 Cb 0.02 -0.55 -0.14 0.00 -0.61 0.00 0.00 39.78 38.50 3khu n ASN 119 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3khu s SER 120 N -1.00 2.84 0.06 6.41 0.01 -0.95 -3.94 113.70 117.13 3khu s SER 120 Ca 0.49 -0.62 -0.04 0.00 1.31 0.00 0.00 55.95 57.09 3khu s SER 120 Cb 0.32 -0.22 -0.02 0.00 0.21 0.00 0.00 66.02 66.30 3khu s SER 120 CO 0.23 0.17 0.05 0.20 0.41 0.00 0.00 173.24 174.30 3khu s ASN 121 N -1.51 0.33 0.56 2.44 0.01 -1.26 -4.97 114.94 110.54 3khu s ASN 121 Ca 0.10 -0.83 0.00 0.00 -0.71 0.00 0.00 52.86 51.42 3khu s ASN 121 Cb -0.10 0.25 0.00 0.00 0.41 0.00 0.00 41.25 41.81 3khu s ASN 121 CO 0.03 -0.63 0.00 0.61 -1.51 0.00 0.00 177.10 175.61 3khu n GLY 122 N 0.15 1.15 3.73 0.66 0.00 -1.18 -4.78 105.19 104.92 3khu n GLY 122 Ca -0.15 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 44.80 3khu n GLY 122 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3khu s TYR 123 N 0.00 3.40 0.04 1.61 5.04 -1.26 0.12 117.35 126.30 3khu s TYR 123 Ca 0.00 0.30 -0.14 0.00 -2.44 0.00 0.00 57.07 54.79 3khu s TYR 123 Cb 0.00 -2.07 0.02 0.00 0.35 0.00 0.00 41.96 40.25 3khu s TYR 123 CO 0.00 0.36 0.30 0.15 -1.34 0.00 0.00 175.55 175.01 3khu s LYS 124 N 0.01 0.80 -0.21 4.97 1.02 -0.88 -4.86 119.74 120.60 3khu s LYS 124 Ca 0.08 -0.50 -0.06 0.00 0.02 0.00 0.00 55.97 55.51 3khu s LYS 124 Cb -0.12 0.35 -0.03 0.00 -0.52 0.00 0.00 37.83 37.51 3khu s LYS 124 CO -0.00 -0.25 0.03 0.42 -0.92 0.00 0.00 175.35 174.63 3khu s ILE 125 N -2.52 4.25 -0.19 2.17 1.01 -0.40 -0.99 121.20 124.53 3khu s ILE 125 Ca -0.05 -0.21 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 3khu s ILE 125 Cb -0.01 -2.94 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 3khu s ILE 125 CO -0.03 0.42 -0.07 -0.69 0.00 0.00 0.00 174.94 174.56 3khu s VAL 126 N 0.96 3.29 -0.11 2.92 1.01 0.17 -0.63 120.40 128.01 3khu s VAL 126 Ca 0.03 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3khu s VAL 126 Cb -0.14 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.79 3khu s VAL 126 CO 0.02 0.46 -0.14 -0.89 0.00 0.00 0.00 175.10 174.55 3khu s THR 127 N 1.08 1.41 -0.04 3.92 2.01 -0.02 -0.77 115.64 123.23 3khu s THR 127 Ca 0.01 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.13 3khu s THR 127 Cb -0.15 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 3khu s THR 127 CO -0.01 0.42 1.24 -1.61 -0.69 0.00 0.00 174.62 173.98 3khu s GLU 128 N 1.10 4.34 -0.04 4.92 2.02 -0.70 -0.19 118.70 130.14 3khu s GLU 128 Ca -0.05 1.73 0.05 0.00 0.02 0.00 0.00 54.97 56.73 3khu s GLU 128 Cb -0.14 -3.55 -0.08 0.00 0.10 0.00 0.00 34.13 30.45 3khu s GLU 128 CO -0.03 -0.47 0.05 1.17 0.02 0.00 0.00 175.26 176.01 3khu n LYS 129 N 5.20 2.21 -2.74 1.61 4.81 -0.25 -0.79 118.16 128.20 3khu n LYS 129 Ca 0.11 -0.02 -0.20 0.00 -0.87 0.00 0.00 58.31 57.33 3khu n LYS 129 Cb 0.46 -1.14 0.04 0.00 0.02 0.00 0.00 35.03 34.40 3khu n LYS 129 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 3khu s SER 130 N -3.39 5.31 0.01 3.14 0.01 -1.23 -3.10 113.70 114.45 3khu s SER 130 Ca -0.03 -0.17 -0.30 0.00 1.31 0.00 0.00 55.95 56.77 3khu s SER 130 Cb 0.02 -0.72 -0.05 0.00 0.21 0.00 0.00 66.02 65.48 3khu s SER 130 CO 0.24 -1.10 1.25 -0.89 0.41 0.00 0.00 173.24 173.14 3khu s THR 131 N -2.68 4.01 0.16 1.44 2.01 -1.26 -4.86 115.64 114.46 3khu s THR 131 Ca 0.57 1.40 0.06 0.00 0.31 0.00 0.00 61.69 64.04 3khu s THR 131 Cb -0.10 -3.90 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 3khu s THR 131 CO 0.37 0.05 -0.14 0.68 -0.69 0.00 0.00 174.62 174.90 3khu s VAL 132 N 1.72 1.49 0.69 3.82 -7.23 -1.26 -4.48 120.40 115.15 3khu s VAL 132 Ca 0.59 -2.01 -0.12 0.00 -1.81 0.00 0.00 61.98 58.63 3khu s VAL 132 Cb -0.29 -1.83 0.01 0.00 0.56 0.00 0.00 36.38 34.83 3khu s VAL 132 CO 0.26 -0.56 1.07 -2.16 -0.31 0.00 0.00 175.10 173.41 3khu s PRO 133 N -3.32 2.81 0.37 4.82 0.04 -1.26 -4.94 135.00 133.51 3khu s PRO 133 Ca 0.17 1.12 -0.28 0.00 0.04 0.00 0.00 61.00 62.05 3khu s PRO 133 Cb -0.02 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.45 3khu s PRO 133 CO 0.04 -1.21 1.43 0.08 0.04 0.00 0.00 177.00 177.38 3khu s VAL 134 N -2.79 2.24 0.00 -0.36 1.01 -1.26 -2.05 120.40 117.18 3khu s VAL 134 Ca 0.61 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.83 3khu s VAL 134 Cb -0.16 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.07 3khu s VAL 134 CO 0.50 0.06 0.00 0.54 0.00 0.00 0.00 175.10 176.19 3khu n ARG 135 N 0.51 0.00 -0.20 2.72 1.74 -1.26 -4.95 116.66 115.22 3khu n ARG 135 Ca 0.01 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.08 3khu n ARG 135 Cb 0.40 -0.92 0.10 0.00 -1.02 0.00 0.00 32.46 31.01 3khu n ARG 135 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3khu h ALA 136 N 0.00 0.78 -0.85 7.54 0.00 -1.78 -2.40 119.26 122.54 3khu h ALA 136 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3khu h ALA 136 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3khu h ALA 136 CO 0.00 -0.14 0.49 0.00 0.00 0.00 0.00 179.25 179.61 3khu h ALA 137 N 1.38 1.26 -0.71 0.00 0.00 -1.93 -1.80 119.26 117.47 3khu h ALA 137 Ca 0.29 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.11 3khu h ALA 137 Cb 0.31 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3khu h ALA 137 CO -0.26 0.62 0.47 1.49 0.00 0.00 0.00 179.25 181.57 3khu h GLU 138 N 1.18 0.91 -0.26 0.00 4.81 -1.86 -0.75 114.58 118.60 3khu h GLU 138 Ca 0.30 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.42 3khu h GLU 138 Cb -0.02 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 3khu h GLU 138 CO -0.05 0.60 -0.07 0.77 -0.73 0.00 0.00 179.01 179.53 3khu h SER 139 N 0.94 0.52 -0.12 1.04 0.02 -0.96 -0.74 113.55 114.24 3khu h SER 139 Ca 0.27 -0.37 0.02 0.00 -0.84 0.00 0.00 61.79 60.86 3khu h SER 139 Cb -0.07 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 3khu h SER 139 CO -0.06 0.76 0.02 0.40 -1.14 0.00 0.00 176.83 176.81 3khu h ILE 140 N 0.26 0.94 -0.80 3.27 2.04 -0.99 -1.69 117.51 120.55 3khu h ILE 140 Ca 0.07 -0.02 0.08 0.00 1.00 0.00 0.00 64.86 65.98 3khu h ILE 140 Cb 0.54 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 3khu h ILE 140 CO 0.03 0.01 0.52 -0.09 0.00 0.00 0.00 178.15 178.62 3khu h ARG 141 N 0.07 0.80 -0.49 2.37 9.65 -1.04 -1.64 114.38 124.10 3khu h ARG 141 Ca 0.05 -0.05 -0.12 0.00 -1.10 0.00 0.00 59.98 58.77 3khu h ARG 141 Cb 0.05 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.43 3khu h ARG 141 CO -0.07 0.53 -0.16 0.00 2.80 0.00 0.00 179.97 183.07 3khu h ARG 142 N 0.82 0.98 -0.29 0.20 3.08 -0.28 -0.17 114.38 118.72 3khu h ARG 142 Ca 0.35 -0.39 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 3khu h ARG 142 Cb 0.31 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3khu h ARG 142 CO -0.13 1.07 0.12 0.82 -1.07 0.00 0.00 179.97 180.78 3khu h ILE 143 N 0.84 1.17 -0.31 2.04 2.04 -0.79 -1.50 117.51 121.00 3khu h ILE 143 Ca 0.12 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 3khu h ILE 143 Cb 0.73 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 3khu h ILE 143 CO 0.06 0.18 0.19 -0.26 0.00 0.00 0.00 178.15 178.32 3khu h PHE 144 N 0.32 0.40 0.00 1.37 0.04 -1.17 -2.13 116.94 115.77 3khu h PHE 144 Ca 0.10 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.83 3khu h PHE 144 Cb 0.17 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 3khu h PHE 144 CO -0.01 0.29 -0.17 -0.44 -0.60 0.00 0.00 178.31 177.38 3khu h ASP 145 N 0.40 0.00 1.16 2.17 3.32 -0.89 -2.50 116.42 120.08 3khu h ASP 145 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3khu h ASP 145 Cb -0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3khu h ASP 145 CO -0.02 0.17 -0.31 0.00 -1.72 0.00 0.00 179.24 177.36 3khu n ALA 146 N -2.48 2.62 -2.73 3.45 0.00 -0.58 -4.25 120.51 116.54 3khu n ALA 146 Ca -0.02 -0.14 -0.22 0.00 0.00 0.00 0.00 53.44 53.06 3khu n ALA 146 Cb 0.24 -1.32 -0.01 0.00 0.00 0.00 0.00 19.45 18.36 3khu n ALA 146 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3khu n ASN 147 N -2.17 3.47 -4.85 0.00 3.02 -0.83 -5.08 115.26 108.82 3khu n ASN 147 Ca 0.04 -3.41 -0.32 0.00 -0.03 0.00 0.00 54.58 50.87 3khu n ASN 147 Cb 0.43 -0.52 -0.05 0.00 -0.61 0.00 0.00 39.78 39.04 3khu n ASN 147 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3khu s THR 148 N -4.36 4.62 0.09 3.41 -1.32 -1.21 -4.91 115.64 111.96 3khu s THR 148 Ca 0.43 1.02 0.04 0.00 -1.21 0.00 0.00 61.69 61.97 3khu s THR 148 Cb 0.37 -3.68 -0.03 0.00 -1.51 0.00 0.00 72.50 67.65 3khu s THR 148 CO -0.12 -0.46 -0.12 -0.54 -2.21 0.00 0.00 174.62 171.17 3khu s LYS 149 N -3.61 0.85 0.16 7.08 1.02 -1.26 -5.08 119.74 118.90 3khu s LYS 149 Ca 0.56 -1.08 -0.34 0.00 0.02 0.00 0.00 55.97 55.14 3khu s LYS 149 Cb -0.10 -0.68 -0.14 0.00 -0.52 0.00 0.00 37.83 36.38 3khu s LYS 149 CO 0.25 0.13 1.46 -2.30 -0.92 0.00 0.00 175.35 173.97 3khu n PRO 150 N 0.86 1.84 -0.76 -1.68 -0.02 -1.26 -1.79 135.00 132.18 3khu n PRO 150 Ca -0.18 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 3khu n PRO 150 Cb 0.56 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3khu n PRO 150 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3khu n ASN 151 N 2.82 -0.89 -4.61 2.55 3.02 -1.26 -4.80 115.26 112.09 3khu n ASN 151 Ca 0.16 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.28 3khu n ASN 151 Cb 0.27 -1.60 -0.03 0.00 -0.61 0.00 0.00 39.78 37.81 3khu n ASN 151 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3khu s LEU 152 N 0.00 3.94 -0.39 3.41 2.96 -0.74 -3.09 118.68 124.77 3khu s LEU 152 Ca 0.00 0.69 0.02 0.00 -0.22 0.00 0.00 54.13 54.62 3khu s LEU 152 Cb 0.00 -3.36 0.12 0.00 0.50 0.00 0.00 46.19 43.44 3khu s LEU 152 CO 0.00 -0.91 0.16 0.21 -1.32 0.00 0.00 176.35 174.49 3khu s ASN 153 N 1.88 4.08 -0.18 3.68 2.47 0.12 -4.77 114.94 122.23 3khu s ASN 153 Ca 0.41 -2.26 -0.09 0.00 0.42 0.00 0.00 52.86 51.34 3khu s ASN 153 Cb -0.11 -1.18 -0.05 0.00 -1.45 0.00 0.00 41.25 38.46 3khu s ASN 153 CO 0.19 -0.33 0.12 -0.76 -3.72 0.00 0.00 177.10 172.60 3khu s LEU 154 N 0.79 4.21 -0.09 3.21 1.43 -1.26 -2.07 118.68 124.91 3khu s LEU 154 Ca 0.14 0.28 0.01 0.00 -1.03 0.00 0.00 54.13 53.52 3khu s LEU 154 Cb -0.21 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 43.91 3khu s LEU 154 CO -0.09 0.24 -0.10 -1.10 0.23 0.00 0.00 176.35 175.53 3khu s GLN 155 N -0.02 2.93 -0.18 1.70 -1.52 -0.16 -4.98 119.66 117.43 3khu s GLN 155 Ca 0.09 -0.62 -0.04 0.00 -1.95 0.00 0.00 55.36 52.85 3khu s GLN 155 Cb -0.11 -2.58 -0.02 0.00 -0.22 0.00 0.00 33.01 30.08 3khu s GLN 155 CO -0.00 0.50 -0.03 0.08 -0.25 0.00 0.00 175.29 175.58 3khu s VAL 156 N -0.38 3.77 0.30 1.09 1.01 -1.26 0.41 120.40 125.34 3khu s VAL 156 Ca 0.05 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.72 3khu s VAL 156 Cb -0.12 -2.68 -0.06 0.00 0.00 0.00 0.00 36.38 33.52 3khu s VAL 156 CO 0.02 0.46 -0.08 -0.76 0.00 0.00 0.00 175.10 174.74 3khu s LEU 157 N 0.76 2.57 -0.11 3.92 1.43 0.05 -4.61 118.68 122.70 3khu s LEU 157 Ca -0.01 -1.18 0.01 0.00 -1.03 0.00 0.00 54.13 51.92 3khu s LEU 157 Cb -0.14 -0.77 -0.02 0.00 0.03 0.00 0.00 46.19 45.28 3khu s LEU 157 CO 0.02 -0.28 -0.15 -0.55 0.23 0.00 0.00 176.35 175.62 3khu s SER 158 N -3.50 3.89 -0.41 2.29 0.15 0.15 -1.72 113.70 114.55 3khu s SER 158 Ca 0.30 -0.33 0.06 0.00 0.70 0.00 0.00 55.95 56.69 3khu s SER 158 Cb 0.03 -1.38 0.22 0.00 -1.71 0.00 0.00 66.02 63.17 3khu s SER 158 CO 0.13 0.21 0.50 -3.20 1.20 0.00 0.00 173.24 172.08 3khu n ASN 159 N 3.22 -0.56 -4.73 5.45 4.05 0.03 0.27 115.26 123.00 3khu n ASN 159 Ca -0.18 -2.64 -0.36 0.00 0.45 0.00 0.00 54.58 51.85 3khu n ASN 159 Cb 0.53 -0.25 0.07 0.00 1.23 0.00 0.00 39.78 41.36 3khu n ASN 159 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 177.26 171.37 3khu s PRO 160 N -0.44 2.52 0.13 1.20 0.02 -1.25 -4.35 135.00 132.83 3khu s PRO 160 Ca 0.34 1.95 0.03 0.00 0.02 0.00 0.00 61.00 63.34 3khu s PRO 160 Cb 0.12 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.74 3khu s PRO 160 CO -0.15 -1.59 0.17 -0.65 -0.33 0.00 0.00 177.00 174.45 3khu s GLN 161 N -3.50 3.12 -0.47 5.54 1.11 -1.18 -4.63 119.66 119.65 3khu s GLN 161 Ca 0.80 -0.70 0.09 0.00 0.01 0.00 0.00 55.36 55.55 3khu s GLN 161 Cb -0.34 -2.80 0.36 0.00 -1.01 0.00 0.00 33.01 29.21 3khu s GLN 161 CO 0.40 0.53 0.87 1.19 0.01 0.00 0.00 175.29 178.29 3khu n PHE 162 N -0.15 2.26 -3.67 0.91 3.72 -1.26 -4.98 117.46 114.30 3khu n PHE 162 Ca -0.08 -3.81 -0.37 0.00 -0.05 0.00 0.00 57.45 53.15 3khu n PHE 162 Cb 0.53 -0.43 -0.07 0.00 -0.94 0.00 0.00 39.48 38.58 3khu n PHE 162 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3khu s LEU 163 N -3.03 4.33 -0.03 4.37 1.43 -1.26 -4.91 118.68 119.59 3khu s LEU 163 Ca 0.44 0.55 -0.01 0.00 -1.03 0.00 0.00 54.13 54.09 3khu s LEU 163 Cb 0.33 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.23 3khu s LEU 163 CO -0.11 0.26 0.05 0.00 0.23 0.00 0.00 176.35 176.77 3khu s ALA 164 N -0.35 3.46 0.14 4.21 0.00 -1.26 -5.02 121.76 122.93 3khu s ALA 164 Ca 0.16 -0.86 -0.34 0.00 0.00 0.00 0.00 51.96 50.93 3khu s ALA 164 Cb -0.13 -1.52 -0.13 0.00 0.00 0.00 0.00 23.12 21.33 3khu s ALA 164 CO 0.05 0.65 1.63 -1.91 0.00 0.00 0.00 175.76 176.18 3khu n GLU 165 N 1.52 2.21 0.00 0.00 0.00 -1.26 -1.93 120.64 121.18 3khu n GLU 165 Ca -0.15 0.80 0.00 0.00 0.00 0.00 0.00 57.16 57.81 3khu n GLU 165 Cb 0.53 -2.58 0.00 0.00 0.00 0.00 0.00 31.44 29.39 3khu n GLU 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3khu n GLY 166 N 3.57 2.96 0.22 8.31 0.00 -1.26 -4.83 105.19 114.17 3khu n GLY 166 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 3khu n GLY 166 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3khu n THR 167 N -2.00 1.32 -0.24 2.61 -2.24 -0.82 -4.55 114.28 108.36 3khu n THR 167 Ca 0.00 -1.61 0.01 0.00 -2.27 0.00 0.00 64.05 60.18 3khu n THR 167 Cb 0.00 -0.01 0.13 0.00 -2.10 0.00 0.00 70.33 68.35 3khu n THR 167 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3khu h ALA 168 N 0.03 0.96 -0.25 6.98 0.00 -1.86 0.10 119.26 125.21 3khu h ALA 168 Ca -0.00 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3khu h ALA 168 Cb 1.13 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3khu h ALA 168 CO 0.00 -0.06 -0.06 0.82 0.00 0.00 0.00 179.25 179.95 3khu h ILE 169 N 0.58 1.28 -0.85 0.00 1.08 -1.90 -1.55 117.51 116.16 3khu h ILE 169 Ca 0.34 -1.07 -0.02 0.00 -0.39 0.00 0.00 64.86 63.73 3khu h ILE 169 Cb 0.37 1.48 -0.04 0.00 -3.07 0.00 0.00 36.82 35.55 3khu h ILE 169 CO -0.27 0.33 0.47 0.11 -0.69 0.00 0.00 178.15 178.10 3khu h LYS 170 N 0.22 1.19 0.00 2.37 1.57 -1.80 0.35 116.57 120.46 3khu h LYS 170 Ca 0.06 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 3khu h LYS 170 Cb 0.53 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 3khu h LYS 170 CO 0.02 0.86 -0.15 -0.44 -0.57 0.00 0.00 179.45 179.17 3khu h ASP 171 N 1.19 0.00 0.30 0.86 3.32 -0.78 -0.66 116.42 120.66 3khu h ASP 171 Ca 0.30 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 57.02 3khu h ASP 171 Cb 0.02 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 3khu h ASP 171 CO -0.05 0.15 -1.85 0.18 -1.72 0.00 0.00 179.24 175.95 3khu n LEU 172 N -3.60 1.79 0.11 1.55 4.77 -0.60 -3.48 117.00 117.53 3khu n LEU 172 Ca -0.01 0.31 -0.17 0.00 -0.03 0.00 0.00 56.01 56.11 3khu n LEU 172 Cb 0.29 -0.50 -0.13 0.00 -2.33 0.00 0.00 43.42 40.75 3khu n LEU 172 CO 0.31 0.63 -0.05 0.11 -1.33 0.00 0.00 177.39 177.06 3khu h LYS 173 N 0.04 0.35 -2.13 3.23 1.57 -0.84 -3.39 116.57 115.41 3khu h LYS 173 Ca -0.36 -0.56 -0.55 0.00 -1.87 0.00 0.00 60.65 57.32 3khu h LYS 173 Cb 2.03 0.20 -0.41 0.00 0.08 0.00 0.00 32.23 34.13 3khu h LYS 173 CO 0.09 1.25 -0.90 0.09 -0.57 0.00 0.00 179.45 179.40 3khu n ASN 174 N -3.60 2.40 -4.78 0.86 3.02 -0.27 -4.89 115.26 108.00 3khu n ASN 174 Ca -0.10 -3.25 -0.36 0.00 -0.03 0.00 0.00 54.58 50.84 3khu n ASN 174 Cb 1.01 -0.61 -0.03 0.00 -0.61 0.00 0.00 39.78 39.54 3khu n ASN 174 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3khu s PRO 175 N -2.59 3.97 0.23 3.52 0.04 -1.23 -4.70 135.00 134.24 3khu s PRO 175 Ca 0.42 1.58 -0.07 0.00 0.04 0.00 0.00 61.00 62.97 3khu s PRO 175 Cb 0.27 -2.43 0.20 0.00 0.04 0.00 0.00 34.50 32.57 3khu s PRO 175 CO -0.09 -0.33 1.85 -0.44 0.04 0.00 0.00 177.00 178.03 3khu h ASP 176 N 2.21 1.10 -5.03 6.66 3.32 -1.94 -3.45 116.42 119.28 3khu h ASP 176 Ca -0.49 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 56.43 3khu h ASP 176 Cb 1.23 -0.28 -0.12 0.00 0.22 0.00 0.00 39.33 40.38 3khu h ASP 176 CO 0.61 0.88 0.11 0.00 -1.72 0.00 0.00 179.24 179.12 3khu s ARG 177 N -5.85 1.21 -0.10 3.56 3.03 -1.26 -4.89 118.95 114.66 3khu s ARG 177 Ca -0.13 -0.56 -0.01 0.00 2.03 0.00 0.00 55.73 57.07 3khu s ARG 177 Cb 0.17 0.55 -0.03 0.00 -1.03 0.00 0.00 34.95 34.61 3khu s ARG 177 CO 0.82 -0.51 -0.06 0.08 -1.13 0.00 0.00 175.30 174.50 3khu s VAL 178 N -3.77 3.73 -0.14 4.99 1.01 -0.11 -4.97 120.40 121.14 3khu s VAL 178 Ca 0.02 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.56 3khu s VAL 178 Cb -0.00 -2.56 0.02 0.00 0.00 0.00 0.00 36.38 33.84 3khu s VAL 178 CO -0.12 0.57 -0.18 -0.22 0.00 0.00 0.00 175.10 175.15 3khu s LEU 179 N -0.42 1.88 -0.08 3.92 2.96 -1.26 -0.24 118.68 125.44 3khu s LEU 179 Ca 0.06 -0.52 -0.00 0.00 -0.22 0.00 0.00 54.13 53.45 3khu s LEU 179 Cb -0.12 -1.27 0.02 0.00 0.50 0.00 0.00 46.19 45.33 3khu s LEU 179 CO 0.02 0.02 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.38 3khu s ILE 180 N 1.08 0.78 -0.03 6.68 1.01 -0.44 -3.75 121.20 126.53 3khu s ILE 180 Ca -0.03 -0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.47 3khu s ILE 180 Cb -0.14 -0.82 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 3khu s ILE 180 CO -0.05 0.31 -0.08 -0.83 0.00 0.00 0.00 174.94 174.29 3khu s GLY 181 N 1.49 1.69 0.26 6.18 0.00 0.14 -1.15 107.32 115.94 3khu s GLY 181 Ca -0.01 -0.97 -0.20 0.00 0.00 0.00 0.00 44.72 43.53 3khu s GLY 181 CO -0.04 -0.80 0.68 -0.32 0.00 0.00 0.00 173.10 172.62 3khu s GLY 182 N -1.10 -0.10 0.73 0.20 0.00 -0.87 -0.67 107.32 105.50 3khu s GLY 182 Ca 0.14 -0.26 -0.15 0.00 0.00 0.00 0.00 44.72 44.45 3khu s GLY 182 CO 0.04 -0.11 1.20 0.99 0.00 0.00 0.00 173.10 175.22 3khu s ASP 183 N -2.91 4.24 0.00 1.64 -0.00 -1.26 -3.41 116.67 114.97 3khu s ASP 183 Ca 0.11 2.35 0.00 0.00 -0.00 0.00 0.00 52.55 55.00 3khu s ASP 183 Cb -0.05 -2.59 0.00 0.00 -0.00 0.00 0.00 42.92 40.28 3khu s ASP 183 CO 0.04 -2.23 0.84 -1.84 -0.00 0.00 0.00 175.17 171.98 3khu n GLU 184 N -2.69 0.96 -2.33 8.23 -0.00 -1.26 -3.62 120.64 119.93 3khu n GLU 184 Ca 0.13 0.00 -0.27 0.00 -0.00 0.00 0.00 57.16 57.02 3khu n GLU 184 Cb 0.50 -1.12 0.03 0.00 -0.00 0.00 0.00 31.44 30.86 3khu n GLU 184 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 3khu s THR 185 N -1.76 3.59 0.22 3.84 -4.23 -1.26 -4.88 115.64 111.16 3khu s THR 185 Ca 0.00 0.05 -0.08 0.00 -1.18 0.00 0.00 61.69 60.47 3khu s THR 185 Cb 0.00 -3.44 0.18 0.00 1.34 0.00 0.00 72.50 70.58 3khu s THR 185 CO 0.00 -0.47 1.87 -0.65 -0.54 0.00 0.00 174.62 174.83 3khu h PRO 186 N -0.24 0.98 -0.58 3.99 0.11 -1.99 -0.91 132.00 133.35 3khu h PRO 186 Ca -0.45 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.52 3khu h PRO 186 Cb 1.26 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 3khu h PRO 186 CO 0.61 0.65 0.05 0.93 -0.21 0.00 0.00 178.00 180.02 3khu h GLU 187 N 1.01 1.00 -0.28 1.05 4.39 -1.94 -1.67 114.58 118.15 3khu h GLU 187 Ca 0.31 -0.30 0.03 0.00 0.34 0.00 0.00 59.36 59.75 3khu h GLU 187 Cb -0.02 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 3khu h GLU 187 CO -0.10 0.97 0.08 0.78 -1.16 0.00 0.00 179.01 179.58 3khu h GLY 188 N 0.90 0.33 1.70 -3.84 0.00 -1.69 -1.57 103.07 98.90 3khu h GLY 188 Ca 0.17 -0.04 -0.10 0.00 0.00 0.00 0.00 47.33 47.36 3khu h GLY 188 CO 0.02 0.01 -0.34 1.46 0.00 0.00 0.00 176.54 177.70 3khu h GLN 189 N 0.19 0.34 -0.58 4.80 1.08 -1.02 -1.17 115.11 118.74 3khu h GLN 189 Ca 0.13 -0.14 -0.06 0.00 -1.45 0.00 0.00 58.65 57.13 3khu h GLN 189 Cb 0.11 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 3khu h GLN 189 CO -0.15 0.64 0.14 -0.09 -0.95 0.00 0.00 178.83 178.42 3khu h ARG 190 N 0.29 0.94 -0.44 1.46 2.43 -0.93 -0.82 114.38 117.30 3khu h ARG 190 Ca 0.04 -0.23 -0.03 0.00 -0.81 0.00 0.00 59.98 58.95 3khu h ARG 190 Cb 0.74 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.15 3khu h ARG 190 CO 0.06 0.87 0.16 0.00 -1.51 0.00 0.00 179.97 179.54 3khu h ALA 191 N 1.03 0.58 -0.16 2.80 0.00 -0.78 -2.04 119.26 120.69 3khu h ALA 191 Ca 0.18 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3khu h ALA 191 Cb 0.35 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3khu h ALA 191 CO 0.00 0.21 0.05 0.28 0.00 0.00 0.00 179.25 179.79 3khu h VAL 192 N 0.57 0.96 -0.38 0.00 2.07 -1.01 -2.11 116.25 116.35 3khu h VAL 192 Ca 0.14 -0.04 0.08 0.00 0.82 0.00 0.00 66.70 67.70 3khu h VAL 192 Cb 0.23 0.81 -0.07 0.00 -1.52 0.00 0.00 31.29 30.75 3khu h VAL 192 CO -0.01 0.02 -0.09 -0.61 0.02 0.00 0.00 177.57 176.91 3khu h GLN 193 N 0.13 0.01 -0.87 1.57 -0.00 -1.04 0.04 115.11 114.95 3khu h GLN 193 Ca 0.07 -0.00 0.07 0.00 -0.00 0.00 0.00 58.65 58.79 3khu h GLN 193 Cb 0.05 -0.00 -0.07 0.00 0.00 0.00 0.00 27.48 27.46 3khu h GLN 193 CO -0.08 0.01 0.53 0.00 0.00 0.00 0.00 178.83 179.29 3khu h ALA 194 N 1.38 1.21 -0.12 3.38 0.00 -0.85 -0.62 119.26 123.64 3khu h ALA 194 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 3khu h ALA 194 Cb 0.28 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.86 3khu h ALA 194 CO -0.38 0.25 -0.78 1.25 0.00 0.00 0.00 179.25 179.58 3khu h LEU 195 N 0.95 0.79 -0.63 0.00 5.85 -0.76 -2.89 115.31 118.61 3khu h LEU 195 Ca 0.39 -0.53 0.10 0.00 0.84 0.00 0.00 57.88 58.68 3khu h LEU 195 Cb 0.23 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 40.95 3khu h LEU 195 CO -0.19 1.31 0.25 0.00 -0.34 0.00 0.00 178.44 179.46 3khu h ALA 197 N 1.43 2.08 0.28 0.00 0.00 -0.93 0.25 119.26 122.38 3khu h ALA 197 Ca 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3khu h ALA 197 Cb 0.40 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3khu h ALA 197 CO -0.31 -0.18 -0.13 0.28 0.00 0.00 0.00 179.25 178.91 3khu h VAL 198 N 0.24 0.76 0.00 0.00 2.07 -1.21 -3.09 116.25 115.02 3khu h VAL 198 Ca 0.19 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 3khu h VAL 198 Cb 0.45 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 3khu h VAL 198 CO -0.04 0.10 -0.16 1.88 0.02 0.00 0.00 177.57 179.37 3khu h TYR 199 N -0.63 0.00 0.00 1.57 -1.99 -1.03 -2.29 116.97 112.59 3khu h TYR 199 Ca -0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.69 3khu h TYR 199 Cb 0.45 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.18 3khu h TYR 199 CO 0.01 0.16 0.00 0.39 -0.00 0.00 0.00 178.16 178.72 3khu n GLU 200 N -4.30 0.03 0.29 4.88 1.02 0.81 -0.60 120.64 122.76 3khu n GLU 200 Ca -0.02 0.40 0.17 0.00 -0.02 0.00 0.00 57.16 57.68 3khu n GLU 200 Cb 0.23 -1.58 0.89 0.00 -0.02 0.00 0.00 31.44 30.96 3khu n GLU 200 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3khu h HIS 201 N 0.00 0.00 0.00 -0.32 3.86 -1.46 -3.36 115.15 113.87 3khu h HIS 201 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3khu h HIS 201 Cb 0.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.61 3khu h HIS 201 CO 0.00 0.05 0.00 -2.67 0.86 0.00 0.00 177.93 176.17 3khu n TRP 202 N -3.41 0.00 -5.06 2.45 2.14 -0.54 -4.99 117.44 108.02 3khu n TRP 202 Ca -0.02 0.00 -0.32 0.00 2.07 0.00 0.00 57.50 59.23 3khu n TRP 202 Cb 0.18 0.01 -0.16 0.00 -0.81 0.00 0.00 31.31 30.54 3khu n TRP 202 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 3khu s VAL 203 N 0.00 2.48 0.44 -1.67 1.01 0.23 -4.99 120.40 117.90 3khu s VAL 203 Ca 0.00 -0.89 -0.25 0.00 0.00 0.00 0.00 61.98 60.84 3khu s VAL 203 Cb 0.00 -1.97 -0.08 0.00 0.00 0.00 0.00 36.38 34.33 3khu s VAL 203 CO 0.00 0.56 1.36 -2.84 0.00 0.00 0.00 175.10 174.18 3khu s PRO 204 N 0.05 3.75 0.35 2.72 0.02 -1.26 -4.25 135.00 136.37 3khu s PRO 204 Ca -0.08 2.28 0.11 0.00 0.02 0.00 0.00 61.00 63.33 3khu s PRO 204 Cb -0.15 -2.65 0.88 0.00 0.02 0.00 0.00 34.50 32.60 3khu s PRO 204 CO 0.05 -0.71 1.80 -0.09 -0.33 0.00 0.00 177.00 177.72 3khu h ARG 205 N 2.38 0.60 0.00 5.54 9.65 -1.95 -0.76 114.38 129.84 3khu h ARG 205 Ca -0.50 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.34 3khu h ARG 205 Cb 1.26 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.70 3khu h ARG 205 CO 0.61 0.40 0.00 -0.85 2.80 0.00 0.00 179.97 182.93 3khu n GLU 206 N -4.67 0.15 -0.04 0.20 0.00 -1.26 -1.75 120.64 113.26 3khu n GLU 206 Ca 0.22 0.33 0.12 0.00 0.00 0.00 0.00 57.16 57.84 3khu n GLU 206 Cb 0.64 -1.76 0.35 0.00 0.00 0.00 0.00 31.44 30.68 3khu n GLU 206 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3khu n LYS 207 N -2.03 1.95 -3.70 3.44 5.02 -0.29 -4.84 118.16 117.72 3khu n LYS 207 Ca 0.03 -1.39 -0.37 0.00 -2.02 0.00 0.00 58.31 54.56 3khu n LYS 207 Cb 0.25 -1.46 -0.12 0.00 -0.02 0.00 0.00 35.03 33.68 3khu n LYS 207 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3khu s ILE 208 N -1.89 4.62 -0.15 -0.18 1.01 -0.72 -0.94 121.20 122.96 3khu s ILE 208 Ca 0.34 -0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.86 3khu s ILE 208 Cb 0.20 -3.20 -0.02 0.00 0.01 0.00 0.00 42.46 39.45 3khu s ILE 208 CO 0.31 0.28 -0.08 -0.22 0.00 0.00 0.00 174.94 175.23 3khu s LEU 209 N 1.65 3.00 -0.09 2.97 2.96 0.67 -4.96 118.68 124.88 3khu s LEU 209 Ca 0.06 -0.23 0.00 0.00 -0.22 0.00 0.00 54.13 53.75 3khu s LEU 209 Cb -0.16 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.80 3khu s LEU 209 CO 0.06 0.16 -0.09 0.42 -1.32 0.00 0.00 176.35 175.58 3khu s THR 210 N 0.42 3.50 0.34 3.68 -4.23 -1.26 -1.33 115.64 116.76 3khu s THR 210 Ca -0.07 -0.54 0.03 0.00 -1.18 0.00 0.00 61.69 59.93 3khu s THR 210 Cb -0.15 -2.45 -0.01 0.00 1.34 0.00 0.00 72.50 71.24 3khu s THR 210 CO 0.04 0.57 0.38 0.35 -0.54 0.00 0.00 174.62 175.42 3khu n THR 211 N 2.67 0.00 -1.75 3.99 -2.24 -0.30 -4.98 114.28 111.67 3khu n THR 211 Ca -0.18 -2.05 -0.30 0.00 -2.27 0.00 0.00 64.05 59.25 3khu n THR 211 Cb 0.53 1.13 0.06 0.00 -2.10 0.00 0.00 70.33 69.95 3khu n THR 211 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3khu s ASN 212 N -3.20 5.15 0.19 3.42 2.20 -1.26 -2.05 114.94 119.38 3khu s ASN 212 Ca 0.34 1.23 -0.11 0.00 -0.94 0.00 0.00 52.86 53.37 3khu s ASN 212 Cb 0.00 -2.01 0.10 0.00 -2.00 0.00 0.00 41.25 37.34 3khu s ASN 212 CO 0.24 -1.54 1.79 0.74 -2.94 0.00 0.00 177.10 175.39 3khu h THR 213 N -0.79 1.21 -0.25 0.54 2.02 -1.81 -2.21 112.91 111.63 3khu h THR 213 Ca -0.46 -0.56 -0.00 0.00 0.77 0.00 0.00 66.41 66.16 3khu h THR 213 Cb 1.25 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 3khu h THR 213 CO 0.62 0.24 0.14 -0.50 0.37 0.00 0.00 175.52 176.38 3khu h TRP 214 N 0.89 0.33 -0.91 3.16 6.55 -1.93 -1.91 115.95 122.13 3khu h TRP 214 Ca 0.23 -0.01 0.11 0.00 0.95 0.00 0.00 58.89 60.17 3khu h TRP 214 Cb 0.07 -0.11 -0.08 0.00 -0.86 0.00 0.00 29.16 28.18 3khu h TRP 214 CO -0.00 0.28 0.55 0.77 -1.05 0.00 0.00 178.44 178.98 3khu h SER 215 N 0.29 0.79 -0.09 -3.49 0.02 -1.87 -0.43 113.55 108.78 3khu h SER 215 Ca 0.09 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 3khu h SER 215 Cb 0.05 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.48 3khu h SER 215 CO -0.01 0.44 -0.02 -1.28 -1.14 0.00 0.00 176.83 174.82 3khu h SER 216 N 0.89 0.16 -0.38 3.07 0.87 -1.12 0.12 113.55 117.17 3khu h SER 216 Ca 0.44 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 3khu h SER 216 Cb 0.42 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 3khu h SER 216 CO -0.26 0.48 0.25 -0.33 -0.53 0.00 0.00 176.83 176.44 3khu h GLU 217 N -0.15 0.50 -0.32 2.24 5.08 -1.05 -2.82 114.58 118.06 3khu h GLU 217 Ca 0.02 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.25 3khu h GLU 217 Cb 0.41 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 3khu h GLU 217 CO 0.01 0.34 -0.20 1.25 -1.00 0.00 0.00 179.01 179.40 3khu h LEU 218 N 0.51 0.59 -1.06 1.33 5.85 -0.99 -2.94 115.31 118.60 3khu h LEU 218 Ca 0.14 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.68 3khu h LEU 218 Cb -0.05 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.77 3khu h LEU 218 CO -0.03 0.80 0.63 0.28 -0.34 0.00 0.00 178.44 179.78 3khu h SER 219 N 0.53 1.10 -0.08 1.25 0.02 -0.51 -0.23 113.55 115.62 3khu h SER 219 Ca 0.08 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 3khu h SER 219 Cb 0.64 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 3khu h SER 219 CO 0.05 0.79 0.03 0.50 -1.14 0.00 0.00 176.83 177.06 3khu h LYS 220 N 1.29 0.12 -0.20 3.45 1.63 -1.37 0.16 116.57 121.66 3khu h LYS 220 Ca 0.35 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 60.12 3khu h LYS 220 Cb -0.14 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.46 3khu h LYS 220 CO -0.08 0.26 0.11 -0.07 -3.45 0.00 0.00 179.45 176.22 3khu h LEU 221 N -0.04 0.26 -0.77 5.20 3.38 -1.54 -2.79 115.31 119.01 3khu h LEU 221 Ca 0.03 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 3khu h LEU 221 Cb 0.18 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3khu h LEU 221 CO -0.00 0.27 0.34 0.00 0.09 0.00 0.00 178.44 179.14 3khu h ALA 222 N 1.00 1.00 -0.29 1.53 0.00 -0.88 0.87 119.26 122.49 3khu h ALA 222 Ca 0.07 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.83 3khu h ALA 222 Cb 0.07 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3khu h ALA 222 CO -0.01 0.59 0.12 0.00 0.00 0.00 0.00 179.25 179.95 3khu h ALA 223 N 1.17 0.33 -0.81 0.00 0.00 -0.49 0.37 119.26 119.84 3khu h ALA 223 Ca 0.26 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 3khu h ALA 223 Cb 0.17 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 3khu h ALA 223 CO -0.03 -0.28 0.32 -0.91 0.00 0.00 0.00 179.25 178.36 3khu h ASN 224 N 0.26 1.11 -0.52 0.00 2.35 -1.20 -1.04 115.58 116.54 3khu h ASN 224 Ca 0.12 -0.17 0.03 0.00 -0.55 0.00 0.00 56.30 55.73 3khu h ASN 224 Cb 0.07 -0.29 -0.04 0.00 0.05 0.00 0.00 38.32 38.11 3khu h ASN 224 CO -0.11 0.98 0.30 0.00 -1.65 0.00 0.00 177.43 176.95 3khu h ALA 225 N 1.18 0.67 -0.73 -0.83 0.00 0.63 0.68 119.26 120.86 3khu h ALA 225 Ca 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3khu h ALA 225 Cb 0.21 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3khu h ALA 225 CO -0.02 -0.01 0.48 0.74 0.00 0.00 0.00 179.25 180.44 3khu h PHE 226 N 0.59 0.93 -0.11 0.00 -1.00 0.15 0.12 116.94 117.63 3khu h PHE 226 Ca 0.22 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 61.00 3khu h PHE 226 Cb 0.05 -0.31 -0.00 0.00 3.61 0.00 0.00 35.95 39.30 3khu h PHE 226 CO -0.07 0.60 0.03 -0.07 -1.61 0.00 0.00 178.31 177.18 3khu h LEU 227 N 0.99 0.17 -1.16 1.54 3.38 -0.68 -2.19 115.31 117.36 3khu h LEU 227 Ca 0.27 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3khu h LEU 227 Cb -0.10 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3khu h LEU 227 CO -0.06 0.35 0.18 0.00 0.09 0.00 0.00 178.44 179.00 3khu h ALA 228 N 0.83 1.34 -0.94 1.53 0.00 -0.61 -2.38 119.26 119.02 3khu h ALA 228 Ca 0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3khu h ALA 228 Cb 0.24 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3khu h ALA 228 CO 0.00 0.49 0.56 0.37 0.00 0.00 0.00 179.25 180.67 3khu h GLN 229 N 0.75 1.29 -0.38 0.00 4.15 -0.45 0.28 115.11 120.75 3khu h GLN 229 Ca 0.18 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.47 3khu h GLN 229 Cb 0.20 -0.27 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 3khu h GLN 229 CO -0.01 0.91 0.25 0.00 -1.93 0.00 0.00 178.83 178.04 3khu h ARG 230 N 1.31 0.51 -0.16 1.69 3.08 -0.87 0.38 114.38 120.32 3khu h ARG 230 Ca 0.34 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.33 3khu h ARG 230 Cb -0.04 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 3khu h ARG 230 CO -0.06 0.35 0.03 0.82 -1.07 0.00 0.00 179.97 180.03 3khu h ILE 231 N 0.51 1.22 -0.89 2.04 2.04 -1.19 -1.03 117.51 120.20 3khu h ILE 231 Ca 0.14 -0.70 0.02 0.00 1.00 0.00 0.00 64.86 65.31 3khu h ILE 231 Cb -0.04 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.38 3khu h ILE 231 CO -0.03 0.21 0.59 0.28 0.00 0.00 0.00 178.15 179.20 3khu h SER 232 N 0.04 1.01 -0.05 1.72 0.02 -0.73 0.13 113.55 115.70 3khu h SER 232 Ca 0.05 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3khu h SER 232 Cb 0.30 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 3khu h SER 232 CO 0.00 0.72 0.03 0.28 -1.14 0.00 0.00 176.83 176.72 3khu h SER 233 N 1.18 0.05 0.06 3.07 0.02 0.16 0.22 113.55 118.30 3khu h SER 233 Ca 0.34 -0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.19 3khu h SER 233 Cb -0.09 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 3khu h SER 233 CO -0.08 0.03 -0.31 -0.29 -1.14 0.00 0.00 176.83 175.04 3khu h ILE 234 N 0.06 1.28 -0.49 3.27 6.09 -0.78 -1.49 117.51 125.44 3khu h ILE 234 Ca 0.02 -1.35 -0.06 0.00 -1.37 0.00 0.00 64.86 62.10 3khu h ILE 234 Cb -0.00 1.48 -0.02 0.00 0.47 0.00 0.00 36.82 38.74 3khu h ILE 234 CO -0.01 0.42 0.06 0.78 -3.07 0.00 0.00 178.15 176.33 3khu h ASN 235 N 0.33 0.74 -0.70 2.19 2.35 -0.47 0.90 115.58 120.91 3khu h ASN 235 Ca 0.04 -0.15 -0.05 0.00 -0.55 0.00 0.00 56.30 55.59 3khu h ASN 235 Cb 0.72 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 3khu h ASN 235 CO 0.05 0.77 0.23 0.77 -1.65 0.00 0.00 177.43 177.60 3khu h SER 236 N 0.74 1.02 -0.54 5.81 4.64 0.33 -1.40 113.55 124.15 3khu h SER 236 Ca 0.16 -0.20 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 3khu h SER 236 Cb 0.36 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 3khu h SER 236 CO 0.01 0.95 0.31 0.40 -0.87 0.00 0.00 176.83 177.63 3khu h ILE 237 N 1.03 1.17 -0.81 0.95 1.08 -0.73 -2.54 117.51 117.67 3khu h ILE 237 Ca 0.23 -0.43 0.05 0.00 -0.39 0.00 0.00 64.86 64.32 3khu h ILE 237 Cb 0.29 0.41 -0.05 0.00 -3.07 0.00 0.00 36.82 34.41 3khu h ILE 237 CO -0.01 0.19 0.53 0.77 -0.69 0.00 0.00 178.15 178.94 3khu h SER 238 N 0.78 0.81 -0.48 1.72 4.64 0.29 0.11 113.55 121.42 3khu h SER 238 Ca 0.20 -0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.40 3khu h SER 238 Cb 0.02 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 61.92 3khu h SER 238 CO -0.03 0.54 -0.16 0.00 -0.87 0.00 0.00 176.83 176.30 3khu h ALA 239 N 1.55 0.67 -0.77 5.18 0.00 -1.17 -1.97 119.26 122.76 3khu h ALA 239 Ca 0.34 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3khu h ALA 239 Cb 0.15 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3khu h ALA 239 CO -0.11 0.62 0.27 1.25 0.00 0.00 0.00 179.25 181.27 3khu h LEU 240 N 0.82 1.09 -0.52 0.00 7.12 -1.14 -2.07 115.31 120.60 3khu h LEU 240 Ca 0.12 -0.19 -0.00 0.00 0.13 0.00 0.00 57.88 57.93 3khu h LEU 240 Cb 0.73 -0.28 -0.03 0.00 -0.53 0.00 0.00 40.66 40.55 3khu h LEU 240 CO 0.06 0.99 0.32 0.00 -0.13 0.00 0.00 178.44 179.68 3khu h GLU 242 N 0.71 0.46 0.00 0.00 5.08 -0.97 -1.00 114.58 118.86 3khu h GLU 242 Ca 0.19 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3khu h GLU 242 Cb -0.03 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.13 3khu h GLU 242 CO -0.04 0.37 -0.13 0.00 -1.00 0.00 0.00 179.01 178.21 3khu h ALA 243 N 1.70 0.93 0.00 3.43 0.00 -0.87 -3.39 119.26 121.07 3khu h ALA 243 Ca 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3khu h ALA 243 Cb 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3khu h ALA 243 CO -0.01 0.00 -1.15 0.25 0.00 0.00 0.00 179.25 178.33 3khu n THR 244 N -2.89 0.09 0.00 0.00 -2.24 -0.75 -5.03 114.28 103.47 3khu n THR 244 Ca 0.04 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 3khu n THR 244 Cb 0.51 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 3khu n THR 244 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3khu n GLY 245 N 2.61 0.22 3.69 3.38 0.00 -0.42 -5.08 105.19 109.59 3khu n GLY 245 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 3khu n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3khu s ALA 246 N -2.00 1.58 -0.11 4.61 0.00 -1.22 -4.88 121.76 119.74 3khu s ALA 246 Ca 0.00 0.49 0.03 0.00 0.00 0.00 0.00 51.96 52.48 3khu s ALA 246 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.72 3khu s ALA 246 CO 0.00 -2.57 -0.22 0.34 0.00 0.00 0.00 175.76 173.31 3khu s ASP 247 N -2.84 3.22 0.40 0.00 2.15 -1.26 -4.49 116.67 113.85 3khu s ASP 247 Ca 0.65 -0.54 0.11 0.00 0.43 0.00 0.00 52.55 53.21 3khu s ASP 247 Cb -0.21 -1.45 0.84 0.00 -0.30 0.00 0.00 42.92 41.79 3khu s ASP 247 CO 0.58 0.14 1.92 1.62 -0.17 0.00 0.00 175.17 179.26 3khu h VAL 248 N 5.70 1.18 -0.18 1.11 3.04 -1.58 -1.59 116.25 123.92 3khu h VAL 248 Ca -0.23 -0.81 -0.18 0.00 -1.01 0.00 0.00 66.70 64.47 3khu h VAL 248 Cb 1.22 1.31 -0.00 0.00 -2.01 0.00 0.00 31.29 31.82 3khu h VAL 248 CO 0.50 0.24 -0.63 -0.33 -1.01 0.00 0.00 177.57 176.35 3khu h GLU 249 N 0.13 0.64 -0.43 4.17 4.39 -1.94 0.15 114.58 121.69 3khu h GLU 249 Ca 0.02 -0.44 -0.02 0.00 0.34 0.00 0.00 59.36 59.26 3khu h GLU 249 Cb 0.40 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 3khu h GLU 249 CO 0.03 1.06 0.18 0.93 -1.16 0.00 0.00 179.01 180.05 3khu h GLU 250 N 0.47 0.64 -0.41 2.33 5.08 -1.79 -1.49 114.58 119.41 3khu h GLU 250 Ca -0.01 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 3khu h GLU 250 Cb 1.20 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 3khu h GLU 250 CO 0.12 0.58 0.03 0.28 -1.00 0.00 0.00 179.01 179.02 3khu h VAL 251 N 0.55 1.25 -0.56 3.13 2.07 -1.19 -1.90 116.25 119.60 3khu h VAL 251 Ca 0.14 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.71 3khu h VAL 251 Cb 0.18 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 3khu h VAL 251 CO -0.01 0.33 0.37 0.00 0.02 0.00 0.00 177.57 178.27 3khu h ALA 252 N 0.91 0.71 -0.54 1.67 0.00 -0.64 -0.15 119.26 121.22 3khu h ALA 252 Ca 0.12 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3khu h ALA 252 Cb 0.43 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3khu h ALA 252 CO 0.02 0.16 0.31 1.15 0.00 0.00 0.00 179.25 180.88 3khu h THR 253 N 0.76 1.18 -0.40 0.00 2.02 -1.11 0.58 112.91 115.94 3khu h THR 253 Ca 0.20 -0.43 -0.07 0.00 0.77 0.00 0.00 66.41 66.89 3khu h THR 253 Cb -0.08 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3khu h THR 253 CO -0.04 0.18 -0.01 0.00 0.37 0.00 0.00 175.52 176.02 3khu h ALA 254 N 1.14 0.54 -0.17 6.16 0.00 -0.70 -2.33 119.26 123.90 3khu h ALA 254 Ca 0.19 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3khu h ALA 254 Cb 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3khu h ALA 254 CO -0.03 0.32 0.09 0.82 0.00 0.00 0.00 179.25 180.45 3khu h ILE 255 N 0.53 1.11 0.00 0.00 2.04 -0.93 -3.20 117.51 117.07 3khu h ILE 255 Ca 0.11 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.67 3khu h ILE 255 Cb 0.49 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3khu h ILE 255 CO 0.02 0.10 0.00 0.61 0.00 0.00 0.00 178.15 178.88 3khu n GLY 256 N -0.90 -1.27 0.08 5.37 0.00 0.18 -2.19 105.19 106.47 3khu n GLY 256 Ca -0.04 0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.16 3khu n GLY 256 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3khu n MET 257 N -2.10 0.20 -2.29 1.61 2.81 -0.90 -2.93 117.12 113.52 3khu n MET 257 Ca 0.03 0.19 -0.43 0.00 -1.81 0.00 0.00 57.70 55.68 3khu n MET 257 Cb 0.24 -1.75 -0.02 0.00 -0.71 0.00 0.00 33.22 30.98 3khu n MET 257 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3khu s ASP 258 N -4.19 6.61 0.20 7.83 -1.08 -0.93 -4.89 116.67 120.22 3khu s ASP 258 Ca 0.11 1.49 0.21 0.00 -0.52 0.00 0.00 52.55 53.84 3khu s ASP 258 Cb 0.13 -2.54 0.89 0.00 -1.46 0.00 0.00 42.92 39.95 3khu s ASP 258 CO 0.56 -1.08 1.65 0.00 0.52 0.00 0.00 175.17 176.81 3khu n GLN 259 N 7.31 0.15 0.17 4.34 6.02 -1.26 -0.99 117.38 133.12 3khu n GLN 259 Ca 0.16 0.38 0.05 0.00 -0.01 0.00 0.00 57.00 57.59 3khu n GLN 259 Cb 0.46 -1.78 0.15 0.00 1.02 0.00 0.00 30.24 30.09 3khu n GLN 259 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3khu h ARG 260 N 0.00 0.00 0.09 -1.09 3.08 -1.94 -3.31 114.38 111.20 3khu h ARG 260 Ca 0.00 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.68 3khu h ARG 260 Cb 0.33 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 3khu h ARG 260 CO 0.00 0.38 -2.15 -0.89 -1.07 0.00 0.00 179.97 176.23 3khu n ILE 261 N -3.27 1.69 0.00 2.04 5.41 -0.42 -5.11 119.36 119.70 3khu n ILE 261 Ca 0.02 -0.63 0.00 0.00 1.00 0.00 0.00 62.75 63.14 3khu n ILE 261 Cb 0.63 -1.63 0.00 0.00 -0.71 0.00 0.00 39.64 37.93 3khu n ILE 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3khu n GLY 262 N 2.08 -2.50 0.93 7.39 0.00 -0.16 -4.83 105.19 108.10 3khu n GLY 262 Ca -0.36 -1.46 0.09 0.00 0.00 0.00 0.00 46.02 44.29 3khu n GLY 262 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3khu n ASN 263 N -1.93 3.15 -4.93 1.61 0.23 -1.15 -4.35 115.26 107.89 3khu n ASN 263 Ca 0.00 -1.91 -0.26 0.00 -0.53 0.00 0.00 54.58 51.88 3khu n ASN 263 Cb 0.00 -0.24 -0.02 0.00 -2.08 0.00 0.00 39.78 37.44 3khu n ASN 263 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 3khu s LYS 264 N -1.20 3.54 -1.44 -3.83 -0.14 -1.26 -4.49 119.74 110.92 3khu s LYS 264 Ca 0.32 -0.22 -0.08 0.00 -1.36 0.00 0.00 55.97 54.63 3khu s LYS 264 Cb 0.18 -2.70 0.02 0.00 -1.68 0.00 0.00 37.83 33.65 3khu s LYS 264 CO 0.25 0.23 0.97 1.19 -0.76 0.00 0.00 175.35 177.23 3khu n PHE 265 N -1.21 -2.52 -1.64 3.18 0.99 -1.26 -4.89 117.46 110.11 3khu n PHE 265 Ca -0.04 0.84 0.06 0.00 -0.00 0.00 0.00 57.45 58.31 3khu n PHE 265 Cb 0.55 -4.70 0.16 0.00 -1.00 0.00 0.00 39.48 34.48 3khu n PHE 265 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 3khu n LEU 266 N -4.65 2.26 -4.53 4.37 4.77 -1.26 -3.86 117.00 114.10 3khu n LEU 266 Ca -0.02 -3.33 -0.43 0.00 -0.03 0.00 0.00 56.01 52.20 3khu n LEU 266 Cb 0.57 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 41.20 3khu n LEU 266 CO 0.60 1.08 0.48 -0.54 -1.33 0.00 0.00 177.39 177.69 3khu s LYS 267 N -2.54 3.38 0.65 3.23 3.01 -1.26 -4.86 119.74 121.34 3khu s LYS 267 Ca 0.34 -0.19 -0.17 0.00 -1.01 0.00 0.00 55.97 54.94 3khu s LYS 267 Cb 0.34 -3.93 -0.01 0.00 -1.01 0.00 0.00 37.83 33.22 3khu s LYS 267 CO -0.06 -1.05 1.24 0.00 0.51 0.00 0.00 175.35 175.99 3khu s ALA 268 N 3.07 2.37 0.27 5.17 0.00 -1.26 -4.96 121.76 126.43 3khu s ALA 268 Ca 0.27 1.05 -0.19 0.00 0.00 0.00 0.00 51.96 53.08 3khu s ALA 268 Cb -0.13 -3.49 0.02 0.00 0.00 0.00 0.00 23.12 19.51 3khu s ALA 268 CO 0.21 -1.51 0.67 -1.54 0.00 0.00 0.00 175.76 173.59 3khu s SER 269 N -1.64 -0.22 0.57 0.00 1.04 -1.26 -4.76 113.70 107.42 3khu s SER 269 Ca 0.78 -0.68 0.28 0.00 0.48 0.00 0.00 55.95 56.81 3khu s SER 269 Cb -0.33 0.70 1.70 0.00 0.10 0.00 0.00 66.02 68.20 3khu s SER 269 CO 0.39 -1.31 2.21 1.62 0.98 0.00 0.00 173.24 177.13 3khu h VAL 270 N 2.05 0.58 0.00 5.02 3.04 -1.40 -3.46 116.25 122.08 3khu h VAL 270 Ca -0.21 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.38 3khu h VAL 270 Cb 1.25 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 3khu h VAL 270 CO 0.26 0.03 0.00 0.61 -1.01 0.00 0.00 177.57 177.45 3khu n GLY 271 N -1.22 4.03 3.76 3.17 0.00 -1.26 -3.18 105.19 110.49 3khu n GLY 271 Ca -0.03 -0.61 -0.37 0.00 0.00 0.00 0.00 46.02 45.02 3khu n GLY 271 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3khu s PHE 272 N -1.59 2.56 0.00 1.61 -0.12 -1.26 -4.52 117.98 114.67 3khu s PHE 272 Ca 0.00 1.50 0.00 0.00 -0.05 0.00 0.00 56.93 58.38 3khu s PHE 272 Cb 0.00 -3.49 0.00 0.00 -0.63 0.00 0.00 43.02 38.90 3khu s PHE 272 CO 0.00 -2.05 0.00 0.41 -0.05 0.00 0.00 175.22 173.53 3khu n GLY 273 N 0.50 5.25 0.00 1.99 0.00 -1.26 -4.69 105.19 106.98 3khu n GLY 273 Ca 0.11 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.53 3khu n GLY 273 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3khu n GLY 274 N 0.94 1.86 0.12 -0.02 0.00 0.18 -4.68 105.19 103.58 3khu n GLY 274 Ca 0.00 -1.97 0.15 0.00 0.00 0.00 0.00 46.02 44.20 3khu n GLY 274 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3khu n SER 275 N 0.00 0.42 -0.11 1.61 3.41 -1.26 -4.23 113.62 113.45 3khu n SER 275 Ca 0.00 -0.77 -0.20 0.00 -0.26 0.00 0.00 58.87 57.64 3khu n SER 275 Cb 0.00 -0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 63.82 3khu n SER 275 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3khu h PHE 277 N -0.94 -0.28 -0.23 0.00 0.04 -1.84 0.75 116.94 114.45 3khu h PHE 277 Ca -0.39 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.37 3khu h PHE 277 Cb 1.31 0.09 -0.01 0.00 2.20 0.00 0.00 35.95 39.54 3khu h PHE 277 CO -0.22 0.10 0.12 0.37 -0.60 0.00 0.00 178.31 178.08 3khu h GLN 278 N -0.79 0.32 -0.27 1.51 4.15 -1.89 -1.19 115.11 116.95 3khu h GLN 278 Ca -0.03 -0.04 0.06 0.00 0.77 0.00 0.00 58.65 59.40 3khu h GLN 278 Cb 0.51 -0.06 -0.05 0.00 0.21 0.00 0.00 27.48 28.08 3khu h GLN 278 CO 0.05 0.31 -0.08 -0.22 -1.93 0.00 0.00 178.83 176.97 3khu h LYS 279 N 0.25 -0.01 -0.40 1.69 3.64 -1.80 -0.19 116.57 119.74 3khu h LYS 279 Ca 0.08 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.35 3khu h LYS 279 Cb 0.09 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3khu h LYS 279 CO -0.01 -0.01 -0.18 -0.44 -2.27 0.00 0.00 179.45 176.55 3khu h ASP 280 N -0.01 0.85 -0.37 4.20 3.32 -0.67 -1.12 116.42 122.62 3khu h ASP 280 Ca 0.13 -0.40 -0.04 0.00 0.02 0.00 0.00 57.03 56.75 3khu h ASP 280 Cb 0.21 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3khu h ASP 280 CO -0.29 1.06 0.09 0.58 -1.72 0.00 0.00 179.24 178.96 3khu h VAL 281 N 0.64 1.23 -0.31 -1.35 2.07 -1.05 0.48 116.25 117.96 3khu h VAL 281 Ca 0.09 -0.77 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 3khu h VAL 281 Cb 0.73 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 3khu h VAL 281 CO 0.06 0.26 0.04 -0.07 0.02 0.00 0.00 177.57 177.88 3khu h LEU 282 N 0.44 0.41 -0.65 2.57 3.38 -0.98 0.53 115.31 121.02 3khu h LEU 282 Ca 0.11 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 3khu h LEU 282 Cb 0.31 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3khu h LEU 282 CO 0.00 0.45 -0.10 -1.13 0.09 0.00 0.00 178.44 177.74 3khu h ASN 283 N 0.44 0.95 -0.32 -0.43 -0.73 -0.56 -1.35 115.58 113.58 3khu h ASN 283 Ca 0.10 -0.30 -0.02 0.00 1.87 0.00 0.00 56.30 57.95 3khu h ASN 283 Cb 0.22 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.54 3khu h ASN 283 CO 0.00 1.06 0.13 0.25 -0.37 0.00 0.00 177.43 178.50 3khu h LEU 284 N 0.85 0.44 -0.54 0.34 5.85 -0.25 0.78 115.31 122.78 3khu h LEU 284 Ca 0.14 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.72 3khu h LEU 284 Cb 0.64 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 3khu h LEU 284 CO 0.04 0.49 0.31 0.58 -0.34 0.00 0.00 178.44 179.52 3khu h VAL 285 N 0.37 1.01 -0.59 1.05 2.07 -0.83 -1.84 116.25 117.49 3khu h VAL 285 Ca 0.11 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 3khu h VAL 285 Cb 0.19 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3khu h VAL 285 CO -0.01 0.11 0.25 0.22 0.02 0.00 0.00 177.57 178.16 3khu h TYR 286 N 0.60 0.88 -0.67 1.57 3.20 -1.01 -1.78 116.97 119.77 3khu h TYR 286 Ca 0.23 -0.06 0.11 0.00 3.14 0.00 0.00 58.73 62.15 3khu h TYR 286 Cb 0.08 -0.27 -0.08 0.00 1.54 0.00 0.00 36.73 38.00 3khu h TYR 286 CO -0.08 0.70 0.26 1.25 -1.64 0.00 0.00 178.16 178.65 3khu h LEU 287 N 0.81 0.26 -0.36 2.82 5.85 -0.41 -0.73 115.31 123.54 3khu h LEU 287 Ca 0.20 0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 3khu h LEU 287 Cb 0.18 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 3khu h LEU 287 CO -0.02 0.13 0.08 0.00 -0.34 0.00 0.00 178.44 178.29 3khu h GLU 289 N 0.44 0.87 0.00 0.00 5.08 -0.93 -0.21 114.58 119.83 3khu h GLU 289 Ca 0.11 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 3khu h GLU 289 Cb 0.32 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 3khu h GLU 289 CO 0.00 0.62 -0.09 0.00 -1.00 0.00 0.00 179.01 178.54 3khu h ALA 290 N 1.20 1.84 -0.52 3.43 0.00 -0.64 -2.36 119.26 122.22 3khu h ALA 290 Ca 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3khu h ALA 290 Cb -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3khu h ALA 290 CO -0.04 0.12 0.00 1.28 0.00 0.00 0.00 179.25 180.60 3khu n LEU 291 N -4.42 3.84 -3.72 0.00 4.77 -0.42 -4.93 117.00 112.12 3khu n LEU 291 Ca -0.03 -1.93 -0.24 0.00 -0.03 0.00 0.00 56.01 53.78 3khu n LEU 291 Cb 0.17 -0.51 0.04 0.00 -2.33 0.00 0.00 43.42 40.80 3khu n LEU 291 CO 0.35 0.67 0.05 0.59 -1.33 0.00 0.00 177.39 177.71 3khu n ASN 292 N 0.87 -3.00 -3.22 -1.43 3.02 -0.89 -4.95 115.26 105.65 3khu n ASN 292 Ca 0.20 -0.75 -0.27 0.00 -0.03 0.00 0.00 54.58 53.74 3khu n ASN 292 Cb 0.72 -4.26 -0.06 0.00 -0.61 0.00 0.00 39.78 35.57 3khu n ASN 292 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3khu n LEU 293 N -4.47 4.03 0.16 3.41 4.77 -0.15 -4.92 117.00 119.82 3khu n LEU 293 Ca -0.16 -5.54 0.02 0.00 -0.03 0.00 0.00 56.01 50.31 3khu n LEU 293 Cb 0.62 -0.61 0.38 0.00 -2.33 0.00 0.00 43.42 41.48 3khu n LEU 293 CO 0.69 2.18 0.81 1.55 -1.33 0.00 0.00 177.39 181.29 3khu h PRO 294 N 3.69 0.11 -0.62 3.23 0.13 -1.90 -1.05 132.00 135.58 3khu h PRO 294 Ca 0.17 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 65.21 3khu h PRO 294 Cb 0.60 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.69 3khu h PRO 294 CO 0.83 0.36 0.15 0.93 -0.23 0.00 0.00 178.00 180.04 3khu h GLU 295 N 0.10 0.97 -0.20 0.86 3.07 -1.95 0.56 114.58 118.00 3khu h GLU 295 Ca 0.02 -0.22 -0.19 0.00 -0.50 0.00 0.00 59.36 58.46 3khu h GLU 295 Cb 0.51 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.29 3khu h GLU 295 CO 0.04 0.87 -0.65 0.28 -1.40 0.00 0.00 179.01 178.15 3khu h VAL 296 N 0.93 1.30 0.10 3.13 2.07 -1.79 -1.97 116.25 120.02 3khu h VAL 296 Ca 0.20 -1.88 -0.00 0.00 0.82 0.00 0.00 66.70 65.84 3khu h VAL 296 Cb 0.34 1.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 3khu h VAL 296 CO 0.00 0.59 -0.07 0.00 0.02 0.00 0.00 177.57 178.12 3khu h ALA 297 N 0.74 -0.16 -0.35 1.67 0.00 -0.79 -2.05 119.26 118.32 3khu h ALA 297 Ca -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3khu h ALA 297 Cb 1.25 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 3khu h ALA 297 CO 0.13 -0.60 0.12 0.00 0.00 0.00 0.00 179.25 178.91 3khu h ARG 298 N -0.17 0.49 0.51 0.00 3.08 -0.88 -0.47 114.38 116.94 3khu h ARG 298 Ca -0.01 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 3khu h ARG 298 Cb 0.15 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3khu h ARG 298 CO 0.00 0.43 -0.24 -0.92 -1.07 0.00 0.00 179.97 178.17 3khu h TYR 299 N 0.49 -0.63 0.00 3.04 3.20 -0.89 -3.16 116.97 119.02 3khu h TYR 299 Ca 0.12 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.88 3khu h TYR 299 Cb 0.13 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 3khu h TYR 299 CO 0.00 -0.35 -0.45 -1.49 -1.64 0.00 0.00 178.16 174.23 3khu h TRP 300 N -0.77 0.00 -0.07 -3.82 4.06 -1.14 -2.79 115.95 111.43 3khu h TRP 300 Ca -0.07 0.00 0.02 0.00 2.06 0.00 0.00 58.89 60.90 3khu h TRP 300 Cb 0.56 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.72 3khu h TRP 300 CO -0.02 0.45 0.05 0.37 -3.56 0.00 0.00 178.44 175.73 3khu h GLN 301 N 0.00 0.00 -0.01 0.49 5.75 -1.07 -1.25 115.11 119.03 3khu h GLN 301 Ca -0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 3khu h GLN 301 Cb 0.81 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.36 3khu h GLN 301 CO 0.06 0.00 -0.04 1.96 -2.65 0.00 0.00 178.83 178.16 3khu h GLN 302 N 0.00 0.01 -0.88 1.69 1.08 -1.46 -0.46 115.11 115.08 3khu h GLN 302 Ca 0.03 -0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.24 3khu h GLN 302 Cb 0.14 -0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.52 3khu h GLN 302 CO -0.00 0.05 0.58 0.28 -0.95 0.00 0.00 178.83 178.79 3khu h VAL 303 N 0.01 1.23 -0.05 -0.54 2.07 -1.40 -1.11 116.25 116.46 3khu h VAL 303 Ca 0.00 -0.43 -0.08 0.00 0.82 0.00 0.00 66.70 67.01 3khu h VAL 303 Cb 0.08 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 3khu h VAL 303 CO 0.01 0.23 -0.28 0.40 0.02 0.00 0.00 177.57 177.94 3khu h ILE 304 N 1.20 1.44 -0.55 4.57 1.08 -1.38 -2.82 117.51 121.06 3khu h ILE 304 Ca 0.32 -1.73 0.02 0.00 -0.39 0.00 0.00 64.86 63.09 3khu h ILE 304 Cb -0.13 2.39 -0.03 0.00 -3.07 0.00 0.00 36.82 35.99 3khu h ILE 304 CO -0.07 0.49 0.37 0.44 -0.69 0.00 0.00 178.15 178.69 3khu h ASP 305 N -0.24 0.60 -0.23 1.72 3.32 -1.02 0.70 116.42 121.26 3khu h ASP 305 Ca -0.02 -0.01 -0.16 0.00 0.02 0.00 0.00 57.03 56.86 3khu h ASP 305 Cb 0.94 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.35 3khu h ASP 305 CO 0.06 0.42 -0.48 -0.03 -1.72 0.00 0.00 179.24 177.49 3khu h MET 306 N 0.70 0.73 -0.64 3.56 4.05 -1.26 -1.06 114.93 121.02 3khu h MET 306 Ca 0.21 -0.48 0.02 0.00 -0.28 0.00 0.00 59.70 59.17 3khu h MET 306 Cb -0.01 0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 30.81 3khu h MET 306 CO -0.05 1.10 0.40 -0.97 0.23 0.00 0.00 176.91 177.62 3khu h ASN 307 N 0.46 0.66 -0.40 1.39 -1.24 -1.11 0.15 115.58 115.50 3khu h ASN 307 Ca 0.01 -0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.94 3khu h ASN 307 Cb 1.09 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.97 3khu h ASN 307 CO 0.11 0.47 -0.02 0.44 -1.29 0.00 0.00 177.43 177.14 3khu h ASP 308 N 0.79 0.77 -0.43 1.15 3.32 -0.74 -2.07 116.42 119.21 3khu h ASP 308 Ca 0.25 -0.19 -0.15 0.00 0.02 0.00 0.00 57.03 56.96 3khu h ASP 308 Cb -0.01 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 3khu h ASP 308 CO -0.09 0.84 -0.30 0.22 -1.72 0.00 0.00 179.24 178.19 3khu h TYR 309 N 0.74 1.14 -0.60 4.55 3.20 -0.90 -1.55 116.97 123.55 3khu h TYR 309 Ca 0.14 -0.31 -0.01 0.00 3.14 0.00 0.00 58.73 61.69 3khu h TYR 309 Cb 0.47 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 3khu h TYR 309 CO 0.02 1.14 0.33 0.37 -1.64 0.00 0.00 178.16 178.38 3khu h GLN 310 N 0.81 0.84 -0.54 1.82 5.75 -0.64 0.10 115.11 123.26 3khu h GLN 310 Ca 0.09 -0.10 -0.08 0.00 -0.15 0.00 0.00 58.65 58.41 3khu h GLN 310 Cb 0.89 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.26 3khu h GLN 310 CO 0.08 0.65 0.04 0.00 -2.65 0.00 0.00 178.83 176.94 3khu h ARG 311 N 0.82 0.92 -0.28 1.69 3.08 -1.27 -2.60 114.38 116.73 3khu h ARG 311 Ca 0.21 -0.27 -0.18 0.00 0.07 0.00 0.00 59.98 59.81 3khu h ARG 311 Cb 0.05 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 3khu h ARG 311 CO -0.03 0.92 -0.53 -0.09 -1.07 0.00 0.00 179.97 179.16 3khu h ARG 312 N 0.80 0.83 -0.03 0.04 2.43 -0.75 -1.75 114.38 115.96 3khu h ARG 312 Ca 0.16 -0.52 -0.15 0.00 -0.81 0.00 0.00 59.98 58.66 3khu h ARG 312 Cb 0.48 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 3khu h ARG 312 CO 0.02 1.15 -0.65 0.07 -1.51 0.00 0.00 179.97 179.05 3khu h ARG 313 N 0.64 0.11 -0.00 0.20 0.11 -0.81 0.13 114.38 114.77 3khu h ARG 313 Ca 0.02 -0.09 -0.00 0.00 0.10 0.00 0.00 59.98 60.01 3khu h ARG 313 Cb 1.13 0.02 -0.00 0.00 1.11 0.00 0.00 29.97 32.23 3khu h ARG 313 CO 0.12 0.72 0.00 0.35 0.10 0.00 0.00 179.97 181.26 3khu h PHE 314 N 0.08 0.00 -0.59 4.08 3.57 -1.32 -0.85 116.94 121.91 3khu h PHE 314 Ca -0.01 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.57 3khu h PHE 314 Cb 1.16 -0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.84 3khu h PHE 314 CO 0.01 0.13 0.25 0.00 -2.23 0.00 0.00 178.31 176.47 3khu h ALA 315 N 0.87 0.77 -0.62 2.41 0.00 -1.11 -2.06 119.26 119.52 3khu h ALA 315 Ca 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3khu h ALA 315 Cb 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3khu h ALA 315 CO -0.00 -0.14 0.29 0.77 0.00 0.00 0.00 179.25 180.17 3khu h SER 316 N 0.47 0.79 -0.43 0.00 0.02 -0.80 -1.28 113.55 112.32 3khu h SER 316 Ca 0.29 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.15 3khu h SER 316 Cb 0.30 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 3khu h SER 316 CO -0.26 0.68 0.25 0.03 -1.14 0.00 0.00 176.83 176.40 3khu h ARG 317 N 0.88 0.58 -0.20 3.45 3.08 -0.46 0.20 114.38 121.91 3khu h ARG 317 Ca 0.22 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.22 3khu h ARG 317 Cb 0.10 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 3khu h ARG 317 CO -0.03 0.44 0.09 0.82 -1.07 0.00 0.00 179.97 180.22 3khu h ILE 318 N 0.57 0.98 -0.28 2.04 2.04 -0.99 0.69 117.51 122.56 3khu h ILE 318 Ca 0.15 -0.07 -0.08 0.00 1.00 0.00 0.00 64.86 65.87 3khu h ILE 318 Cb 0.01 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 3khu h ILE 318 CO -0.03 0.04 -0.15 0.40 0.00 0.00 0.00 178.15 178.41 3khu h ILE 319 N 0.19 1.30 -0.60 -0.67 2.04 -0.96 -1.87 117.51 116.94 3khu h ILE 319 Ca 0.08 -1.24 -0.00 0.00 1.00 0.00 0.00 64.86 64.69 3khu h ILE 319 Cb 0.03 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 3khu h ILE 319 CO -0.07 0.39 0.36 0.44 0.00 0.00 0.00 178.15 179.28 3khu h ASP 320 N 0.32 0.72 -0.02 1.72 3.32 -0.89 0.44 116.42 122.03 3khu h ASP 320 Ca 0.06 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3khu h ASP 320 Cb 0.67 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 3khu h ASP 320 CO 0.04 0.57 -0.03 0.28 -1.72 0.00 0.00 179.24 178.38 3khu h SER 321 N 0.81 0.14 -0.59 6.45 0.02 -0.41 -0.85 113.55 119.12 3khu h SER 321 Ca 0.21 -0.02 -0.31 0.00 -0.84 0.00 0.00 61.79 60.84 3khu h SER 321 Cb -0.02 -0.04 -0.18 0.00 0.14 0.00 0.00 62.40 62.31 3khu h SER 321 CO -0.04 0.21 0.40 0.18 -1.14 0.00 0.00 176.83 176.44 3khu n LEU 322 N -4.40 5.32 -1.13 5.07 4.77 -0.74 -4.87 117.00 121.01 3khu n LEU 322 Ca -0.01 -2.80 -0.13 0.00 -0.03 0.00 0.00 56.01 53.05 3khu n LEU 322 Cb 0.17 -0.73 -0.04 0.00 -2.33 0.00 0.00 43.42 40.50 3khu n LEU 322 CO 0.36 0.86 -0.13 0.49 -1.33 0.00 0.00 177.39 177.63 3khu n PHE 323 N -0.43 -0.21 -1.50 -1.77 0.99 -0.32 -2.70 117.46 111.52 3khu n PHE 323 Ca 0.35 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.66 3khu n PHE 323 Cb 1.15 -2.46 -0.06 0.00 -1.00 0.00 0.00 39.48 37.10 3khu n PHE 323 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 3khu n ASN 324 N -0.15 -4.75 -3.73 4.37 5.15 0.11 -4.98 115.26 111.27 3khu n ASN 324 Ca -0.13 0.33 -0.15 0.00 -0.60 0.00 0.00 54.58 54.02 3khu n ASN 324 Cb 0.48 -3.58 -0.16 0.00 -0.53 0.00 0.00 39.78 36.00 3khu n ASN 324 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 3khu s THR 325 N -2.56 -0.09 0.00 -0.44 -1.32 -1.10 -5.00 115.64 105.13 3khu s THR 325 Ca 0.00 0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.73 3khu s THR 325 Cb 0.00 -0.18 0.00 0.00 -1.51 0.00 0.00 72.50 70.81 3khu s THR 325 CO 0.00 0.10 0.37 0.52 -2.21 0.00 0.00 174.62 173.41 3khu n VAL 326 N 4.51 0.09 -1.68 5.08 0.31 -1.26 -4.86 118.33 120.53 3khu n VAL 326 Ca -0.21 -0.34 -0.49 0.00 -0.01 0.00 0.00 64.34 63.29 3khu n VAL 326 Cb 0.51 1.30 -0.05 0.00 -0.91 0.00 0.00 33.84 34.69 3khu n VAL 326 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3khu n THR 327 N -0.05 0.38 -1.05 2.52 -1.04 -1.06 -1.21 114.28 112.77 3khu n THR 327 Ca 0.00 -0.07 -0.02 0.00 -2.04 0.00 0.00 64.05 61.93 3khu n THR 327 Cb 0.14 -1.68 -0.01 0.00 -1.82 0.00 0.00 70.33 66.96 3khu n THR 327 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3khu n ASP 328 N 5.50 -5.18 -4.73 8.00 8.00 0.43 -4.93 116.55 123.64 3khu n ASP 328 Ca 0.21 0.04 -0.40 0.00 0.71 0.00 0.00 54.79 55.36 3khu n ASP 328 Cb 0.27 -2.83 -0.05 0.00 -0.02 0.00 0.00 41.12 38.50 3khu n ASP 328 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3khu s LYS 329 N -1.68 4.44 -0.03 -1.24 1.02 -0.35 -4.70 119.74 117.20 3khu s LYS 329 Ca 0.00 0.92 -0.30 0.00 0.02 0.00 0.00 55.97 56.61 3khu s LYS 329 Cb 0.00 -3.42 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 3khu s LYS 329 CO 0.00 0.15 0.98 0.21 -0.92 0.00 0.00 175.35 175.77 3khu s LYS 330 N 0.49 4.52 -0.03 1.68 2.20 -1.26 -0.93 119.74 126.42 3khu s LYS 330 Ca 0.37 1.40 0.01 0.00 -0.36 0.00 0.00 55.97 57.40 3khu s LYS 330 Cb -0.18 -3.48 0.01 0.00 -1.51 0.00 0.00 37.83 32.67 3khu s LYS 330 CO 0.19 -0.11 -0.05 0.42 -0.36 0.00 0.00 175.35 175.45 3khu s ILE 331 N 1.24 0.48 -0.18 5.43 1.01 -0.32 -0.71 121.20 128.16 3khu s ILE 331 Ca 0.51 -0.14 -0.19 0.00 0.00 0.00 0.00 60.65 60.82 3khu s ILE 331 Cb -0.20 -0.48 -0.03 0.00 0.01 0.00 0.00 42.46 41.75 3khu s ILE 331 CO 0.25 0.19 0.56 0.00 0.00 0.00 0.00 174.94 175.94 3khu s ALA 332 N 0.59 3.52 -0.35 9.38 0.00 -0.66 -1.03 121.76 133.22 3khu s ALA 332 Ca -0.07 -0.30 -0.11 0.00 0.00 0.00 0.00 51.96 51.47 3khu s ALA 332 Cb -0.11 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.17 3khu s ALA 332 CO -0.00 -0.39 0.21 0.42 0.00 0.00 0.00 175.76 176.00 3khu s ILE 333 N 1.52 4.85 -0.39 0.00 -1.09 -0.41 -0.55 121.20 125.14 3khu s ILE 333 Ca 0.27 -0.51 -0.11 0.00 -2.23 0.00 0.00 60.65 58.06 3khu s ILE 333 Cb -0.16 -3.56 0.03 0.00 -1.58 0.00 0.00 42.46 37.19 3khu s ILE 333 CO 0.10 -0.07 0.23 -0.76 -1.23 0.00 0.00 174.94 173.21 3khu s LEU 334 N 1.63 4.84 0.00 2.97 1.43 0.20 -1.44 118.68 128.33 3khu s LEU 334 Ca 0.04 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.09 3khu s LEU 334 Cb -0.18 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.00 3khu s LEU 334 CO 0.08 -0.42 0.00 0.61 0.23 0.00 0.00 176.35 176.85 3khu n GLY 335 N 5.01 1.61 0.00 -3.19 0.00 -0.20 -1.42 105.19 107.00 3khu n GLY 335 Ca -0.12 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3khu n GLY 335 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3khu n PHE 336 N 2.71 0.00 -1.08 1.61 7.35 -1.26 -4.25 117.46 122.55 3khu n PHE 336 Ca 0.00 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.36 3khu n PHE 336 Cb 0.00 0.00 0.13 0.00 0.35 0.00 0.00 39.48 39.96 3khu n PHE 336 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3khu s ALA 337 N -1.85 1.82 -0.32 3.13 0.00 -1.26 -4.54 121.76 118.74 3khu s ALA 337 Ca 0.00 0.76 0.27 0.00 0.00 0.00 0.00 51.96 52.99 3khu s ALA 337 Cb 0.00 -3.47 0.96 0.00 0.00 0.00 0.00 23.12 20.61 3khu s ALA 337 CO 0.00 -2.31 1.80 0.27 0.00 0.00 0.00 175.76 175.52 3khu h PHE 338 N -1.05 0.00 -3.13 0.00 -5.15 -1.65 -3.44 116.94 102.52 3khu h PHE 338 Ca -0.46 0.00 0.01 0.00 -0.20 0.00 0.00 57.97 57.33 3khu h PHE 338 Cb 1.29 0.00 -0.04 0.00 0.22 0.00 0.00 35.95 37.41 3khu h PHE 338 CO 0.48 0.00 0.18 -1.59 -2.00 0.00 0.00 178.31 175.38 3khu s LYS 339 N -3.38 1.89 0.81 6.09 -2.85 -1.26 -4.50 119.74 116.55 3khu s LYS 339 Ca 0.05 -1.18 -0.11 0.00 -1.00 0.00 0.00 55.97 53.72 3khu s LYS 339 Cb 0.09 0.59 0.08 0.00 -2.06 0.00 0.00 37.83 36.53 3khu s LYS 339 CO 0.53 -0.86 1.09 -1.59 0.10 0.00 0.00 175.35 174.62 3khu s LYS 340 N -3.45 1.94 -1.22 1.78 -2.85 -1.26 -4.21 119.74 110.47 3khu s LYS 340 Ca 0.15 0.81 -0.05 0.00 -1.00 0.00 0.00 55.97 55.88 3khu s LYS 340 Cb -0.05 -1.89 0.01 0.00 -2.06 0.00 0.00 37.83 33.84 3khu s LYS 340 CO 0.09 -1.77 0.60 -0.25 0.10 0.00 0.00 175.35 174.13 3khu n ASP 341 N -3.56 -5.32 -3.54 0.03 8.00 -1.26 -4.99 116.55 105.91 3khu n ASP 341 Ca 0.07 -0.28 -0.11 0.00 0.71 0.00 0.00 54.79 55.18 3khu n ASP 341 Cb 0.55 -4.10 -0.04 0.00 -0.02 0.00 0.00 41.12 37.51 3khu n ASP 341 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3khu s THR 342 N -3.10 0.04 -2.40 -3.53 -1.32 -1.26 -4.88 115.64 99.19 3khu s THR 342 Ca 0.30 -0.32 0.23 0.00 -1.21 0.00 0.00 61.69 60.69 3khu s THR 342 Cb -0.13 -1.08 0.07 0.00 -1.51 0.00 0.00 72.50 69.84 3khu s THR 342 CO 0.37 -0.17 1.15 0.61 -2.21 0.00 0.00 174.62 174.36 3khu n GLY 343 N -0.23 0.40 3.71 6.08 0.00 -1.26 -4.60 105.19 109.29 3khu n GLY 343 Ca -0.17 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 3khu n GLY 343 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3khu s ASP 344 N -2.29 6.90 0.00 1.61 -1.08 -1.26 -4.54 116.67 116.01 3khu s ASP 344 Ca 0.22 2.20 0.11 0.00 -0.52 0.00 0.00 52.55 54.56 3khu s ASP 344 Cb 0.19 -2.58 0.18 0.00 -1.46 0.00 0.00 42.92 39.25 3khu s ASP 344 CO 0.47 -0.61 1.03 0.35 0.52 0.00 0.00 175.17 176.92 3khu n THR 345 N 4.06 0.43 -1.70 1.71 -2.24 -1.26 -1.91 114.28 113.37 3khu n THR 345 Ca 0.11 -0.72 -0.43 0.00 -2.27 0.00 0.00 64.05 60.75 3khu n THR 345 Cb 0.44 0.92 -0.03 0.00 -2.10 0.00 0.00 70.33 69.55 3khu n THR 345 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3khu n ARG 346 N 0.58 2.73 -2.03 -0.78 1.74 -1.26 -1.58 116.66 116.06 3khu n ARG 346 Ca 0.09 0.99 -0.12 0.00 -0.77 0.00 0.00 57.85 58.04 3khu n ARG 346 Cb 0.34 -2.86 -0.02 0.00 -1.02 0.00 0.00 32.46 28.90 3khu n ARG 346 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3khu n GLU 347 N 4.85 -1.88 -2.13 5.56 -0.58 -1.26 -0.65 120.64 124.55 3khu n GLU 347 Ca 0.17 0.62 -0.41 0.00 -0.42 0.00 0.00 57.16 57.13 3khu n GLU 347 Cb 0.36 -5.08 -0.02 0.00 -0.57 0.00 0.00 31.44 26.12 3khu n GLU 347 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3khu s SER 348 N -2.02 6.79 0.59 1.62 0.15 -0.62 -3.89 113.70 116.33 3khu s SER 348 Ca 0.00 2.62 0.29 0.00 0.70 0.00 0.00 55.95 59.56 3khu s SER 348 Cb 0.00 -2.64 1.80 0.00 -1.71 0.00 0.00 66.02 63.47 3khu s SER 348 CO 0.00 -0.55 2.25 0.28 1.20 0.00 0.00 173.24 176.42 3khu h SER 349 N 4.03 0.00 -0.11 5.45 0.02 -1.84 -0.88 113.55 120.22 3khu h SER 349 Ca -0.48 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.45 3khu h SER 349 Cb 1.22 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 3khu h SER 349 CO 0.70 0.00 0.01 0.28 -1.14 0.00 0.00 176.83 176.68 3khu h SER 350 N 0.00 0.25 -0.33 3.07 0.02 -1.86 -0.18 113.55 114.53 3khu h SER 350 Ca 0.00 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 3khu h SER 350 Cb 0.02 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 3khu h SER 350 CO -0.00 0.29 0.12 0.40 -1.14 0.00 0.00 176.83 176.50 3khu h ILE 351 N 0.28 1.19 -0.03 3.27 2.04 -1.43 -1.16 117.51 121.68 3khu h ILE 351 Ca 0.07 -0.61 -0.26 0.00 1.00 0.00 0.00 64.86 65.06 3khu h ILE 351 Cb 0.17 0.99 0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3khu h ILE 351 CO 0.00 0.21 -0.99 1.88 0.00 0.00 0.00 178.15 179.26 3khu h TYR 352 N 0.38 1.00 -0.54 1.37 -1.99 -1.41 -0.32 116.97 115.46 3khu h TYR 352 Ca 0.11 -0.53 -0.02 0.00 2.00 0.00 0.00 58.73 60.29 3khu h TYR 352 Cb 0.22 -0.12 -0.02 0.00 2.00 0.00 0.00 36.73 38.80 3khu h TYR 352 CO 0.00 1.36 0.24 0.82 -0.00 0.00 0.00 178.16 180.58 3khu h ILE 353 N 0.40 1.21 -0.63 -2.88 1.08 -1.07 -1.61 117.51 114.01 3khu h ILE 353 Ca -0.11 -0.62 0.00 0.00 -0.39 0.00 0.00 64.86 63.74 3khu h ILE 353 Cb 1.63 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 35.96 3khu h ILE 353 CO 0.19 0.24 0.40 0.28 -0.69 0.00 0.00 178.15 178.57 3khu h SER 354 N 0.73 0.75 -0.81 1.72 0.02 -1.04 -2.20 113.55 112.72 3khu h SER 354 Ca 0.18 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.05 3khu h SER 354 Cb 0.15 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.47 3khu h SER 354 CO -0.02 0.57 0.36 0.11 -1.14 0.00 0.00 176.83 176.71 3khu h LYS 355 N 0.86 1.19 -0.93 3.45 1.57 -0.76 0.24 116.57 122.19 3khu h LYS 355 Ca 0.23 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3khu h LYS 355 Cb -0.06 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.01 3khu h LYS 355 CO -0.05 0.94 0.57 1.88 -0.57 0.00 0.00 179.45 182.22 3khu h TYR 356 N 1.17 1.21 -0.10 -1.35 0.99 -0.76 -0.87 116.97 117.26 3khu h TYR 356 Ca 0.28 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.82 3khu h TYR 356 Cb 0.16 -0.40 -0.00 0.00 1.00 0.00 0.00 36.73 37.49 3khu h TYR 356 CO 0.02 0.79 -0.73 -0.07 -0.00 0.00 0.00 178.16 178.17 3khu h LEU 357 N 1.27 0.57 -1.10 3.88 3.38 -0.93 -3.01 115.31 119.38 3khu h LEU 357 Ca 0.33 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3khu h LEU 357 Cb -0.07 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 3khu h LEU 357 CO -0.06 1.12 0.39 0.24 0.09 0.00 0.00 178.44 180.22 3khu h MET 358 N 0.33 1.02 0.00 1.13 2.86 -0.49 -1.50 114.93 118.28 3khu h MET 358 Ca -0.03 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 3khu h MET 358 Cb 1.32 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.78 3khu h MET 358 CO 0.13 0.76 0.00 -3.47 1.06 0.00 0.00 176.91 175.39 3khu n ASP 359 N -4.35 0.53 -0.84 1.22 2.03 -0.37 -0.69 116.55 114.08 3khu n ASP 359 Ca 0.07 0.65 0.12 0.00 0.52 0.00 0.00 54.79 56.15 3khu n ASP 359 Cb 0.11 -0.75 0.26 0.00 -0.72 0.00 0.00 41.12 40.02 3khu n ASP 359 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3khu n GLU 360 N -2.10 2.14 -1.44 -0.67 -0.58 -0.63 -4.97 120.64 112.38 3khu n GLU 360 Ca 0.02 -1.68 0.00 0.00 -0.42 0.00 0.00 57.16 55.08 3khu n GLU 360 Cb 0.19 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 3khu n GLU 360 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3khu n GLY 361 N 1.32 0.38 3.78 0.62 0.00 0.14 -2.57 105.19 108.86 3khu n GLY 361 Ca 0.17 -1.01 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 3khu n GLY 361 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3khu s ALA 362 N -2.00 2.76 -0.56 4.61 0.00 -0.83 -0.42 121.76 125.31 3khu s ALA 362 Ca 0.00 0.73 -0.18 0.00 0.00 0.00 0.00 51.96 52.51 3khu s ALA 362 Cb 0.00 -3.32 0.11 0.00 0.00 0.00 0.00 23.12 19.91 3khu s ALA 362 CO 0.00 -0.61 0.60 -1.01 0.00 0.00 0.00 175.76 174.74 3khu s HIS 363 N -1.88 3.11 0.04 0.00 3.76 -0.10 -4.74 115.29 115.48 3khu s HIS 363 Ca 0.70 -1.07 -0.22 0.00 -0.15 0.00 0.00 55.06 54.32 3khu s HIS 363 Cb -0.21 -3.86 -0.06 0.00 1.11 0.00 0.00 32.58 29.57 3khu s HIS 363 CO 0.25 -1.14 0.67 -0.51 -0.85 0.00 0.00 174.74 173.16 3khu s LEU 364 N 2.19 4.46 -0.25 0.89 1.43 0.10 -1.17 118.68 126.33 3khu s LEU 364 Ca 0.08 1.33 0.02 0.00 -1.03 0.00 0.00 54.13 54.53 3khu s LEU 364 Cb -0.26 -3.07 0.06 0.00 0.03 0.00 0.00 46.19 42.94 3khu s LEU 364 CO 0.05 0.10 -0.10 -1.00 0.23 0.00 0.00 176.35 175.63 3khu s HIS 365 N -0.34 3.05 -0.18 0.29 3.76 -0.20 -0.73 115.29 120.94 3khu s HIS 365 Ca 0.34 -2.16 -0.04 0.00 -0.15 0.00 0.00 55.06 53.04 3khu s HIS 365 Cb -0.20 -1.85 -0.03 0.00 1.11 0.00 0.00 32.58 31.62 3khu s HIS 365 CO 0.20 -0.85 -0.02 0.42 -0.85 0.00 0.00 174.74 173.65 3khu s ILE 366 N 1.18 3.97 -0.09 0.60 1.01 -0.01 -1.29 121.20 126.57 3khu s ILE 366 Ca -0.08 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.28 3khu s ILE 366 Cb -0.19 -2.77 0.01 0.00 0.01 0.00 0.00 42.46 39.52 3khu s ILE 366 CO -0.06 0.46 -0.15 -0.47 0.00 0.00 0.00 174.94 174.72 3khu s TYR 367 N 0.64 1.83 -0.01 3.97 5.04 -0.52 -0.66 117.35 127.65 3khu s TYR 367 Ca -0.01 -0.76 -0.00 0.00 -2.44 0.00 0.00 57.07 53.86 3khu s TYR 367 Cb -0.14 -1.31 0.01 0.00 0.35 0.00 0.00 41.96 40.88 3khu s TYR 367 CO 0.02 -0.37 0.02 0.34 -1.34 0.00 0.00 175.55 174.22 3khu s ASP 368 N 0.71 0.03 0.00 4.32 -1.08 -1.26 -1.03 116.67 118.35 3khu s ASP 368 Ca -0.13 0.03 0.15 0.00 -0.52 0.00 0.00 52.55 52.08 3khu s ASP 368 Cb -0.16 -0.02 0.65 0.00 -1.46 0.00 0.00 42.92 41.93 3khu s ASP 368 CO 0.03 -0.06 1.48 -0.81 0.52 0.00 0.00 175.17 176.34 3khu n PRO 369 N 3.58 0.01 0.00 4.34 -0.04 -1.26 -4.20 135.00 137.42 3khu n PRO 369 Ca -0.19 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 3khu n PRO 369 Cb 0.56 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 3khu n PRO 369 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3khu n LYS 370 N -1.49 1.94 -2.10 0.54 3.00 -1.26 -5.05 118.16 113.74 3khu n LYS 370 Ca 0.04 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.93 3khu n LYS 370 Cb 0.18 -0.67 -0.03 0.00 0.00 0.00 0.00 35.03 34.51 3khu n LYS 370 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3khu s VAL 371 N -1.19 3.45 0.44 3.15 1.01 -1.26 -4.69 120.40 121.31 3khu s VAL 371 Ca 0.00 0.85 -0.25 0.00 0.00 0.00 0.00 61.98 62.58 3khu s VAL 371 Cb 0.00 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.75 3khu s VAL 371 CO 0.00 -0.01 1.33 -2.84 0.00 0.00 0.00 175.10 173.59 3khu s PRO 372 N 2.58 3.78 0.41 2.72 0.02 -1.26 -4.83 135.00 138.43 3khu s PRO 372 Ca 0.68 2.21 0.07 0.00 0.02 0.00 0.00 61.00 63.98 3khu s PRO 372 Cb -0.35 -2.65 0.87 0.00 0.02 0.00 0.00 34.50 32.40 3khu s PRO 372 CO 0.29 -0.67 2.06 0.07 -0.33 0.00 0.00 177.00 178.42 3khu h ARG 373 N 2.39 0.52 -0.85 5.54 0.11 -1.97 -1.92 114.38 118.21 3khu h ARG 373 Ca -0.50 -0.03 -0.00 0.00 0.10 0.00 0.00 59.98 59.54 3khu h ARG 373 Cb 1.26 -0.12 -0.04 0.00 1.11 0.00 0.00 29.97 32.18 3khu h ARG 373 CO 0.61 0.35 0.51 0.93 0.10 0.00 0.00 179.97 182.47 3khu h GLU 374 N 0.54 1.14 -0.48 0.08 3.07 -2.00 -1.88 114.58 115.05 3khu h GLU 374 Ca 0.14 -0.10 -0.13 0.00 -0.50 0.00 0.00 59.36 58.78 3khu h GLU 374 Cb -0.06 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 27.59 3khu h GLU 374 CO -0.03 0.80 -0.19 0.37 -1.40 0.00 0.00 179.01 178.55 3khu h GLN 375 N 1.16 0.97 -0.78 2.33 5.75 -1.73 -1.64 115.11 121.18 3khu h GLN 375 Ca 0.30 -0.40 -0.01 0.00 -0.15 0.00 0.00 58.65 58.39 3khu h GLN 375 Cb -0.06 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.42 3khu h GLN 375 CO -0.06 1.07 0.44 0.82 -2.65 0.00 0.00 178.83 178.46 3khu h ILE 376 N 0.85 1.23 -0.32 2.39 2.04 -1.31 0.81 117.51 123.20 3khu h ILE 376 Ca 0.12 -0.55 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 3khu h ILE 376 Cb 0.76 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 3khu h ILE 376 CO 0.06 0.25 0.09 0.58 0.00 0.00 0.00 178.15 179.13 3khu h VAL 377 N 1.07 1.21 -0.42 1.67 2.07 -1.19 -2.02 116.25 118.64 3khu h VAL 377 Ca 0.28 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 3khu h VAL 377 Cb 0.01 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3khu h VAL 377 CO -0.05 0.24 0.21 0.58 0.02 0.00 0.00 177.57 178.57 3khu h VAL 378 N 0.35 1.17 -0.71 2.57 2.07 -0.93 -2.58 116.25 118.19 3khu h VAL 378 Ca 0.10 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 3khu h VAL 378 Cb 0.28 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 3khu h VAL 378 CO -0.00 0.19 0.41 0.44 0.02 0.00 0.00 177.57 178.62 3khu h ASP 379 N 0.54 0.87 -0.26 0.57 3.32 -0.66 -2.04 116.42 118.76 3khu h ASP 379 Ca 0.15 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3khu h ASP 379 Cb 0.10 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.43 3khu h ASP 379 CO -0.02 0.68 0.00 0.18 -1.72 0.00 0.00 179.24 178.36 3khu n LEU 380 N -4.38 1.87 -4.93 1.55 4.77 -0.78 -4.93 117.00 110.17 3khu n LEU 380 Ca 0.07 -0.85 -0.27 0.00 -0.03 0.00 0.00 56.01 54.94 3khu n LEU 380 Cb 0.08 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 40.97 3khu n LEU 380 CO 0.37 0.42 -0.02 -0.44 -1.33 0.00 0.00 177.39 176.39 3khu s SER 381 N -1.33 6.37 0.12 -1.43 0.01 -0.77 -4.68 113.70 111.98 3khu s SER 381 Ca 0.30 0.31 -0.30 0.00 1.31 0.00 0.00 55.95 57.56 3khu s SER 381 Cb 0.16 -1.97 -0.06 0.00 0.21 0.00 0.00 66.02 64.36 3khu s SER 381 CO 0.23 -0.01 1.10 -1.00 0.41 0.00 0.00 173.24 173.97 3khu s HIS 382 N -1.82 3.57 0.00 2.43 3.76 -1.26 -4.97 115.29 117.00 3khu s HIS 382 Ca 0.37 1.54 0.00 0.00 -0.15 0.00 0.00 55.06 56.82 3khu s HIS 382 Cb -0.11 -3.28 0.00 0.00 1.11 0.00 0.00 32.58 30.30 3khu s HIS 382 CO 0.29 -0.67 0.33 -0.35 -0.85 0.00 0.00 174.74 173.49 3khu n PRO 383 N 3.00 0.00 -3.58 8.40 -0.04 -1.26 -5.12 135.00 136.40 3khu n PRO 383 Ca 0.05 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.35 3khu n PRO 383 Cb 0.47 -1.43 -0.06 0.00 -0.04 0.00 0.00 33.50 32.44 3khu n PRO 383 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3khu s ASP 388 N 2.52 -0.50 0.05 3.54 -1.08 -1.26 -5.30 116.67 114.62 3khu s ASP 388 Ca 0.00 0.43 -0.18 0.00 -0.52 0.00 0.00 52.55 52.28 3khu s ASP 388 Cb 0.00 0.48 -0.17 0.00 -1.46 0.00 0.00 42.92 41.78 3khu s ASP 388 CO 0.00 -0.61 1.26 -0.78 0.52 0.00 0.00 175.17 175.55 3khu h ASP 389 N 3.09 0.59 -0.21 -0.34 1.82 -1.99 -3.24 116.42 116.15 3khu h ASP 389 Ca -0.29 -0.61 0.05 0.00 -0.39 0.00 0.00 57.03 55.79 3khu h ASP 389 Cb 1.17 -0.17 -0.05 0.00 0.68 0.00 0.00 39.33 40.96 3khu h ASP 389 CO 0.40 1.10 -0.10 1.56 -1.61 0.00 0.00 179.24 180.59 3khu h GLN 390 N 0.11 -0.08 -0.57 0.28 4.20 -1.99 -0.61 115.11 116.46 3khu h GLN 390 Ca -0.02 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.74 3khu h GLN 390 Cb 1.05 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.81 3khu h GLN 390 CO 0.09 -0.05 0.31 0.28 -0.67 0.00 0.00 178.83 178.79 3khu h VAL 391 N -0.08 0.98 -0.27 -0.54 2.07 -1.84 0.91 116.25 117.49 3khu h VAL 391 Ca 0.11 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 3khu h VAL 391 Cb 0.25 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 3khu h VAL 391 CO -0.26 0.11 0.11 -1.28 0.02 0.00 0.00 177.57 176.27 3khu h SER 392 N 0.60 0.37 -0.61 0.57 0.87 -1.49 0.07 113.55 113.93 3khu h SER 392 Ca 0.25 -0.17 -0.06 0.00 -1.23 0.00 0.00 61.79 60.58 3khu h SER 392 Cb 0.12 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 3khu h SER 392 CO -0.15 0.44 0.15 0.03 -0.53 0.00 0.00 176.83 176.77 3khu h ARG 393 N 0.29 0.97 0.00 2.24 3.08 -0.89 -3.40 114.38 116.67 3khu h ARG 393 Ca 0.09 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.91 3khu h ARG 393 Cb 0.19 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3khu h ARG 393 CO -0.01 0.89 -1.14 1.28 -1.07 0.00 0.00 179.97 179.92 3khu n LEU 394 N -4.35 0.10 -4.31 3.04 4.77 0.30 -4.99 117.00 111.55 3khu n LEU 394 Ca 0.03 -0.12 -0.34 0.00 -0.03 0.00 0.00 56.01 55.55 3khu n LEU 394 Cb 0.24 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.18 3khu n LEU 394 CO 0.41 0.02 -0.44 -0.69 -1.33 0.00 0.00 177.39 175.37 3khu s VAL 395 N -2.39 3.02 -0.06 4.08 1.01 -0.00 -0.73 120.40 125.33 3khu s VAL 395 Ca -0.02 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.38 3khu s VAL 395 Cb 0.06 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 3khu s VAL 395 CO 0.35 0.49 -0.24 -0.89 0.00 0.00 0.00 175.10 174.81 3khu s THR 396 N 0.89 2.14 -0.32 3.92 2.01 0.09 -4.77 115.64 119.60 3khu s THR 396 Ca -0.03 -1.04 -0.12 0.00 0.31 0.00 0.00 61.69 60.81 3khu s THR 396 Cb -0.15 -1.78 -0.03 0.00 0.01 0.00 0.00 72.50 70.56 3khu s THR 396 CO -0.00 0.57 0.23 -0.63 -0.69 0.00 0.00 174.62 174.10 3khu s ILE 397 N -0.17 5.29 0.26 1.82 -1.09 -1.26 -0.83 121.20 125.22 3khu s ILE 397 Ca -0.03 -0.09 -0.14 0.00 -2.23 0.00 0.00 60.65 58.17 3khu s ILE 397 Cb -0.14 -3.66 -0.08 0.00 -1.58 0.00 0.00 42.46 37.00 3khu s ILE 397 CO 0.04 0.07 0.65 -0.44 -1.23 0.00 0.00 174.94 174.03 3khu s SER 398 N 1.73 6.76 0.14 3.58 0.01 0.17 -4.90 113.70 121.20 3khu s SER 398 Ca 0.07 1.15 0.23 0.00 1.31 0.00 0.00 55.95 58.70 3khu s SER 398 Cb -0.17 -2.32 0.09 0.00 0.21 0.00 0.00 66.02 63.83 3khu s SER 398 CO 0.11 -0.10 1.09 2.29 0.41 0.00 0.00 173.24 177.04 3khu n LYS 399 N -0.02 0.46 -3.84 12.44 0.00 -1.26 -4.62 118.16 121.32 3khu n LYS 399 Ca 0.01 0.08 -0.09 0.00 -0.00 0.00 0.00 58.31 58.30 3khu n LYS 399 Cb 0.52 -1.73 -0.06 0.00 -0.00 0.00 0.00 35.03 33.76 3khu n LYS 399 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 3khu s ASP 400 N -4.75 -0.02 0.46 -5.58 1.47 -1.26 -5.06 116.67 101.93 3khu s ASP 400 Ca 0.02 -0.66 0.24 0.00 1.18 0.00 0.00 52.55 53.33 3khu s ASP 400 Cb 0.12 0.43 1.07 0.00 -0.34 0.00 0.00 42.92 44.20 3khu s ASP 400 CO 0.78 -0.86 1.90 -0.65 0.68 0.00 0.00 175.17 177.02 3khu h PRO 401 N 2.53 0.00 -0.07 2.11 0.11 -1.96 -2.90 132.00 131.82 3khu h PRO 401 Ca -0.32 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.60 3khu h PRO 401 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3khu h PRO 401 CO 0.49 0.21 -0.76 1.88 -0.21 0.00 0.00 178.00 179.62 3khu h TYR 402 N 0.00 0.54 -0.46 0.65 0.05 -1.98 -1.80 116.97 113.97 3khu h TYR 402 Ca -0.00 -0.25 0.03 0.00 0.05 0.00 0.00 58.73 58.56 3khu h TYR 402 Cb 0.62 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 38.24 3khu h TYR 402 CO 0.00 1.01 0.26 0.93 -1.05 0.00 0.00 178.16 179.31 3khu h GLU 403 N 0.26 0.50 -0.87 4.88 5.08 -1.92 -2.07 114.58 120.44 3khu h GLU 403 Ca -0.04 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3khu h GLU 403 Cb 1.34 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 3khu h GLU 403 CO 0.13 0.33 0.51 0.00 -1.00 0.00 0.00 179.01 178.97 3khu h ALA 404 N 1.22 1.11 -0.00 3.43 0.00 -1.32 -2.74 119.26 120.97 3khu h ALA 404 Ca 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3khu h ALA 404 Cb 0.05 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.49 3khu h ALA 404 CO -0.11 0.60 -0.36 0.00 0.00 0.00 0.00 179.25 179.38 3khu s ASP 406 N -2.99 6.13 -0.14 0.00 -1.08 -0.78 -1.45 116.67 116.35 3khu s ASP 406 Ca 0.12 1.59 0.00 0.00 -0.52 0.00 0.00 52.55 53.74 3khu s ASP 406 Cb 0.18 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 39.11 3khu s ASP 406 CO 0.65 -1.47 0.00 0.61 0.52 0.00 0.00 175.17 175.48 3khu n GLY 407 N 5.03 0.50 3.84 2.66 0.00 0.48 -5.00 105.19 112.70 3khu n GLY 407 Ca 0.21 -0.31 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 3khu n GLY 407 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3khu s ALA 408 N -1.93 3.15 0.01 4.61 0.00 -0.52 -4.38 121.76 122.69 3khu s ALA 408 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 51.96 52.16 3khu s ALA 408 Cb 0.00 -3.00 -0.27 0.00 0.00 0.00 0.00 23.12 19.85 3khu s ALA 408 CO 0.00 0.11 0.86 0.45 0.00 0.00 0.00 175.76 177.19 3khu h HIS 409 N 1.78 0.37 -3.79 0.00 3.86 -1.19 -1.47 115.15 114.71 3khu h HIS 409 Ca -0.48 -0.27 -0.15 0.00 -1.16 0.00 0.00 60.37 58.31 3khu h HIS 409 Cb 1.18 -0.01 -0.20 0.00 1.06 0.00 0.00 27.41 29.44 3khu h HIS 409 CO 0.62 1.32 -0.59 0.00 0.86 0.00 0.00 177.93 180.15 3khu s ALA 410 N -2.62 -0.06 -0.17 2.45 0.00 -1.25 -1.93 121.76 118.17 3khu s ALA 410 Ca -0.08 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 3khu s ALA 410 Cb 0.07 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.35 3khu s ALA 410 CO 0.85 -0.22 -0.11 0.08 0.00 0.00 0.00 175.76 176.36 3khu s VAL 411 N -1.79 3.00 -0.24 0.00 1.01 0.33 -1.65 120.40 121.06 3khu s VAL 411 Ca -0.12 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.24 3khu s VAL 411 Cb -0.06 -2.30 0.06 0.00 0.00 0.00 0.00 36.38 34.07 3khu s VAL 411 CO -0.01 0.49 -0.11 -0.69 0.00 0.00 0.00 175.10 174.78 3khu s VAL 412 N 0.94 2.03 -0.27 2.92 1.01 0.29 -0.21 120.40 127.10 3khu s VAL 412 Ca -0.02 -1.47 -0.15 0.00 0.00 0.00 0.00 61.98 60.34 3khu s VAL 412 Cb -0.15 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 3khu s VAL 412 CO -0.01 0.02 0.36 -0.63 0.00 0.00 0.00 175.10 174.85 3khu s ILE 413 N 1.18 5.18 -0.07 2.22 1.01 -0.24 -0.62 121.20 129.86 3khu s ILE 413 Ca -0.07 0.55 0.04 0.00 0.00 0.00 0.00 60.65 61.17 3khu s ILE 413 Cb -0.19 -3.69 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 3khu s ILE 413 CO -0.06 0.16 0.11 0.00 0.00 0.00 0.00 174.94 175.16 3khu s THR 415 N -1.96 0.79 -0.07 0.00 2.01 -1.23 -4.76 115.64 110.43 3khu s THR 415 Ca -0.00 -0.36 -0.00 0.00 0.31 0.00 0.00 61.69 61.64 3khu s THR 415 Cb 0.03 -0.71 0.05 0.00 0.01 0.00 0.00 72.50 71.88 3khu s THR 415 CO 0.16 0.25 1.91 -1.84 -0.69 0.00 0.00 174.62 174.41 3khu n GLU 416 N 3.33 1.17 -1.71 4.92 0.00 -1.26 -4.68 120.64 122.41 3khu n GLU 416 Ca -0.19 -0.34 -0.43 0.00 0.00 0.00 0.00 57.16 56.21 3khu n GLU 416 Cb 0.54 -1.13 -0.03 0.00 0.00 0.00 0.00 31.44 30.82 3khu n GLU 416 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 3khu n TRP 417 N 1.15 2.66 0.04 -1.84 7.02 -1.26 -4.80 117.44 120.41 3khu n TRP 417 Ca 0.07 0.17 0.13 0.00 -1.02 0.00 0.00 57.50 56.85 3khu n TRP 417 Cb 0.53 -2.61 0.59 0.00 -2.42 0.00 0.00 31.31 27.40 3khu n TRP 417 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3khu h ASP 418 N 5.85 0.16 0.13 -0.99 3.32 -2.02 -2.19 116.42 120.68 3khu h ASP 418 Ca -0.45 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.59 3khu h ASP 418 Cb 1.22 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 3khu h ASP 418 CO 0.88 0.10 -0.07 0.00 -1.72 0.00 0.00 179.24 178.43 3khu h MET 419 N 0.18 0.00 0.00 3.56 -0.00 -1.99 -2.99 114.93 113.69 3khu h MET 419 Ca 0.19 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.83 3khu h MET 419 Cb 0.50 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.10 3khu h MET 419 CO -0.03 0.07 -0.24 0.74 -0.00 0.00 0.00 176.91 177.45 3khu h PHE 420 N 0.00 0.00 0.00 -0.10 0.04 -1.77 -1.27 116.94 113.84 3khu h PHE 420 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3khu h PHE 420 Cb 0.15 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.30 3khu h PHE 420 CO 0.00 0.24 0.00 1.57 -0.60 0.00 0.00 178.31 179.52 3khu h LYS 421 N 0.00 0.00 -0.02 1.51 2.10 -1.72 -3.27 116.57 115.17 3khu h LYS 421 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3khu h LYS 421 Cb 0.53 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 3khu h LYS 421 CO 0.03 0.00 -0.14 0.39 -2.00 0.00 0.00 179.45 177.73 3khu n GLU 422 N -2.63 1.69 -1.31 0.07 -0.58 -0.49 -4.98 120.64 112.41 3khu n GLU 422 Ca 0.02 -1.26 -0.33 0.00 -0.42 0.00 0.00 57.16 55.18 3khu n GLU 422 Cb 0.33 -1.47 0.10 0.00 -0.57 0.00 0.00 31.44 29.82 3khu n GLU 422 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3khu s LEU 423 N -2.17 3.19 -0.97 -4.62 1.43 -1.19 -4.91 118.68 109.44 3khu s LEU 423 Ca 0.28 2.18 -0.22 0.00 -1.03 0.00 0.00 54.13 55.34 3khu s LEU 423 Cb 0.20 -4.57 0.06 0.00 0.03 0.00 0.00 46.19 41.91 3khu s LEU 423 CO 0.40 -2.29 1.36 -0.62 0.23 0.00 0.00 176.35 175.42 3khu s ASP 424 N -2.45 6.49 0.42 2.29 -1.08 -1.26 -4.84 116.67 116.24 3khu s ASP 424 Ca 0.70 -1.47 0.23 0.00 -0.52 0.00 0.00 52.55 51.48 3khu s ASP 424 Cb -0.25 -2.53 0.72 0.00 -1.46 0.00 0.00 42.92 39.40 3khu s ASP 424 CO 0.49 -1.45 1.74 1.88 0.52 0.00 0.00 175.17 178.34 3khu h TYR 425 N 9.62 0.00 -0.31 -5.34 -1.99 -1.97 -2.02 116.97 114.97 3khu h TYR 425 Ca 0.14 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.84 3khu h TYR 425 Cb 1.02 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.73 3khu h TYR 425 CO 1.24 0.23 0.09 1.49 -0.00 0.00 0.00 178.16 181.21 3khu h GLU 426 N 0.00 0.48 -0.19 4.88 4.81 -1.99 -0.26 114.58 122.30 3khu h GLU 426 Ca -0.00 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 3khu h GLU 426 Cb 0.89 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 3khu h GLU 426 CO 0.03 0.53 0.09 -0.09 -0.73 0.00 0.00 179.01 178.84 3khu h ARG 427 N 0.34 0.28 -0.54 1.92 2.43 -1.92 -2.69 114.38 114.21 3khu h ARG 427 Ca 0.10 -0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.28 3khu h ARG 427 Cb 0.25 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.71 3khu h ARG 427 CO -0.00 0.33 0.26 0.82 -1.51 0.00 0.00 179.97 179.87 3khu h ILE 428 N 0.17 0.93 -0.44 1.20 2.04 -1.24 -2.75 117.51 117.43 3khu h ILE 428 Ca 0.07 -0.17 0.06 0.00 1.00 0.00 0.00 64.86 65.81 3khu h ILE 428 Cb 0.15 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 36.56 3khu h ILE 428 CO -0.01 0.09 0.15 -0.74 0.00 0.00 0.00 178.15 177.64 3khu h HIS 429 N 0.50 0.26 -1.00 1.37 2.76 -0.81 -2.59 115.15 115.64 3khu h HIS 429 Ca 0.24 0.02 0.18 0.00 -2.20 0.00 0.00 60.37 58.62 3khu h HIS 429 Cb 0.17 -0.05 -0.11 0.00 1.55 0.00 0.00 27.41 28.98 3khu h HIS 429 CO -0.11 0.09 0.61 0.87 -1.30 0.00 0.00 177.93 178.09 3khu h LYS 430 N 0.31 0.75 -0.23 5.26 1.57 -1.17 -2.25 116.57 120.82 3khu h LYS 430 Ca 0.21 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 3khu h LYS 430 Cb 0.21 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3khu h LYS 430 CO -0.22 0.50 0.00 1.63 -0.57 0.00 0.00 179.45 180.79 3khu n LYS 431 N -4.76 2.40 -2.83 3.15 5.02 -1.01 -4.93 118.16 115.19 3khu n LYS 431 Ca 0.23 -2.12 -0.33 0.00 -2.02 0.00 0.00 58.31 54.07 3khu n LYS 431 Cb 0.55 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 34.02 3khu n LYS 431 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3khu s MET 432 N -1.69 4.11 0.58 1.97 -1.94 -0.85 -0.38 119.30 121.10 3khu s MET 432 Ca 0.34 0.96 -0.18 0.00 -1.71 0.00 0.00 55.69 55.10 3khu s MET 432 Cb 0.21 -2.24 -0.04 0.00 2.01 0.00 0.00 34.83 34.77 3khu s MET 432 CO 0.31 -0.02 1.11 -0.51 -0.01 0.00 0.00 175.02 175.90 3khu s LEU 433 N -3.30 3.63 -0.02 -0.03 1.43 -0.56 -4.89 118.68 114.94 3khu s LEU 433 Ca 0.59 2.08 0.05 0.00 -1.03 0.00 0.00 54.13 55.82 3khu s LEU 433 Cb -0.09 -4.57 -0.03 0.00 0.03 0.00 0.00 46.19 41.53 3khu s LEU 433 CO 0.18 -1.31 -0.16 -0.54 0.23 0.00 0.00 176.35 174.75 3khu s LYS 434 N -3.58 2.35 0.36 1.70 -0.14 -1.26 -3.22 119.74 115.95 3khu s LYS 434 Ca 0.70 -0.80 -0.27 0.00 -1.36 0.00 0.00 55.97 54.25 3khu s LYS 434 Cb -0.22 -2.30 -0.09 0.00 -1.68 0.00 0.00 37.83 33.54 3khu s LYS 434 CO 0.32 0.59 1.17 -1.25 -0.76 0.00 0.00 175.35 175.42 3khu s PRO 435 N -0.95 4.25 -0.21 -1.68 0.04 -1.26 -5.15 135.00 130.04 3khu s PRO 435 Ca 0.12 1.88 -0.10 0.00 0.04 0.00 0.00 61.00 62.95 3khu s PRO 435 Cb -0.11 -2.86 -0.05 0.00 0.04 0.00 0.00 34.50 31.53 3khu s PRO 435 CO 0.02 -0.16 0.14 0.00 0.04 0.00 0.00 177.00 177.03 3khu s ALA 436 N -1.32 3.65 0.02 8.56 0.00 -1.20 -4.86 121.76 126.62 3khu s ALA 436 Ca 0.53 -0.76 0.07 0.00 0.00 0.00 0.00 51.96 51.80 3khu s ALA 436 Cb -0.32 -2.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.56 3khu s ALA 436 CO 0.41 0.04 -0.21 -0.06 0.00 0.00 0.00 175.76 175.95 3khu s PHE 437 N 0.59 2.49 -0.13 0.00 0.40 -0.81 -1.42 117.98 119.09 3khu s PHE 437 Ca 0.08 -0.31 0.03 0.00 -0.60 0.00 0.00 56.93 56.13 3khu s PHE 437 Cb -0.12 -1.47 0.01 0.00 0.51 0.00 0.00 43.02 41.95 3khu s PHE 437 CO 0.00 0.18 -0.22 0.42 0.70 0.00 0.00 175.22 176.29 3khu s ILE 438 N -0.83 2.06 -0.30 0.64 1.01 -0.15 -0.51 121.20 123.12 3khu s ILE 438 Ca 0.13 -0.99 -0.02 0.00 0.00 0.00 0.00 60.65 59.78 3khu s ILE 438 Cb -0.10 -1.81 0.05 0.00 0.01 0.00 0.00 42.46 40.61 3khu s ILE 438 CO 0.03 0.55 -0.00 -0.36 0.00 0.00 0.00 174.94 175.16 3khu s PHE 439 N 0.70 3.27 -0.54 3.97 0.08 0.70 -1.20 117.98 124.96 3khu s PHE 439 Ca -0.10 -1.90 -0.19 0.00 0.12 0.00 0.00 56.93 54.86 3khu s PHE 439 Cb -0.16 -2.12 0.08 0.00 -0.57 0.00 0.00 43.02 40.25 3khu s PHE 439 CO 0.01 -0.81 0.65 0.34 -0.10 0.00 0.00 175.22 175.31 3khu s ASP 440 N 1.25 6.20 0.00 1.36 -1.08 -0.25 -1.08 116.67 123.08 3khu s ASP 440 Ca -0.05 -1.15 0.21 0.00 -0.52 0.00 0.00 52.55 51.04 3khu s ASP 440 Cb -0.20 -2.29 1.02 0.00 -1.46 0.00 0.00 42.92 40.00 3khu s ASP 440 CO -0.01 -0.98 1.69 0.61 0.52 0.00 0.00 175.17 177.00 3khu n GLY 441 N 5.22 -0.49 0.00 2.66 0.00 0.50 -3.09 105.19 109.99 3khu n GLY 441 Ca -0.08 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3khu n GLY 441 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3khu n ARG 442 N -0.35 0.27 -2.40 1.61 5.12 -1.26 -0.98 116.66 118.68 3khu n ARG 442 Ca 0.16 -0.46 -0.20 0.00 -1.93 0.00 0.00 57.85 55.41 3khu n ARG 442 Cb 0.18 -0.66 -0.01 0.00 -1.16 0.00 0.00 32.46 30.81 3khu n ARG 442 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3khu n ARG 443 N -0.07 -1.73 0.17 5.56 5.12 -1.26 -4.90 116.66 119.55 3khu n ARG 443 Ca 0.00 0.98 0.05 0.00 -1.93 0.00 0.00 57.85 56.95 3khu n ARG 443 Cb 0.28 -5.64 0.19 0.00 -1.16 0.00 0.00 32.46 26.13 3khu n ARG 443 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 3khu h VAL 444 N 0.00 0.81 -0.56 1.55 -1.51 -1.95 -3.24 116.25 111.34 3khu h VAL 444 Ca -0.48 -1.83 0.00 0.00 -1.23 0.00 0.00 66.70 63.16 3khu h VAL 444 Cb 1.36 2.17 0.00 0.00 -2.13 0.00 0.00 31.29 32.69 3khu h VAL 444 CO 0.57 0.41 0.00 0.18 -1.23 0.00 0.00 177.57 177.50 3khu n LEU 445 N -3.34 4.12 -4.57 4.19 4.77 -1.26 -4.77 117.00 116.14 3khu n LEU 445 Ca 0.01 -2.08 -0.43 0.00 -0.03 0.00 0.00 56.01 53.48 3khu n LEU 445 Cb 0.62 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 3khu n LEU 445 CO 0.38 0.71 0.48 0.47 -1.33 0.00 0.00 177.39 178.11 3khu n ASP 446 N 0.96 0.90 0.00 -1.43 9.92 -1.23 -1.81 116.55 123.86 3khu n ASP 446 Ca 0.22 1.10 0.00 0.00 -0.53 0.00 0.00 54.79 55.58 3khu n ASP 446 Cb 0.77 -1.27 0.00 0.00 -0.64 0.00 0.00 41.12 39.98 3khu n ASP 446 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3khu n GLY 447 N 1.31 2.93 1.09 0.44 0.00 -1.26 -4.83 105.19 104.88 3khu n GLY 447 Ca 0.10 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.22 3khu n GLY 447 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3khu n LEU 448 N 0.00 3.47 -0.08 0.99 4.77 -0.75 -4.69 117.00 120.70 3khu n LEU 448 Ca 0.00 -1.78 -0.12 0.00 -0.03 0.00 0.00 56.01 54.09 3khu n LEU 448 Cb 0.00 -0.33 -0.05 0.00 -2.33 0.00 0.00 43.42 40.72 3khu n LEU 448 CO 0.00 0.82 0.72 0.45 -1.33 0.00 0.00 177.39 178.05 3khu h HIS 449 N 3.76 0.51 -0.37 -1.77 3.86 -1.88 -1.63 115.15 117.63 3khu h HIS 449 Ca 0.00 -0.11 0.05 0.00 -1.16 0.00 0.00 60.37 59.15 3khu h HIS 449 Cb 0.91 -0.13 -0.04 0.00 1.06 0.00 0.00 27.41 29.20 3khu h HIS 449 CO 0.33 0.67 0.11 -0.91 0.86 0.00 0.00 177.93 178.99 3khu h ASN 450 N 0.21 0.10 -0.69 2.45 2.35 -1.96 -0.37 115.58 117.66 3khu h ASN 450 Ca 0.06 0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 3khu h ASN 450 Cb 0.50 0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.88 3khu h ASN 450 CO 0.02 0.09 0.32 -0.08 -1.65 0.00 0.00 177.43 176.13 3khu h GLU 451 N 0.25 1.02 -0.37 0.81 4.81 -1.86 -0.04 114.58 119.21 3khu h GLU 451 Ca 0.17 -0.15 -0.16 0.00 -0.13 0.00 0.00 59.36 59.09 3khu h GLU 451 Cb 0.17 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 3khu h GLU 451 CO -0.19 0.81 -0.39 -0.07 -0.73 0.00 0.00 179.01 178.43 3khu h LEU 452 N 1.01 0.99 -0.28 1.64 3.38 -0.83 -1.57 115.31 119.65 3khu h LEU 452 Ca 0.24 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 3khu h LEU 452 Cb 0.14 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3khu h LEU 452 CO -0.03 1.26 0.18 1.56 0.09 0.00 0.00 178.44 181.50 3khu h GLN 453 N 0.74 0.38 -0.71 1.13 4.20 -0.79 -1.33 115.11 118.72 3khu h GLN 453 Ca 0.06 -0.03 0.07 0.00 0.06 0.00 0.00 58.65 58.81 3khu h GLN 453 Cb 0.99 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 28.63 3khu h GLN 453 CO 0.10 0.28 0.40 1.15 -0.67 0.00 0.00 178.83 180.08 3khu h THR 454 N 0.37 0.95 -0.55 -0.54 2.02 -0.80 0.14 112.91 114.50 3khu h THR 454 Ca 0.10 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 67.05 3khu h THR 454 Cb -0.01 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 66.55 3khu h THR 454 CO -0.02 0.13 0.37 0.40 0.37 0.00 0.00 175.52 176.77 3khu h ILE 455 N 0.72 1.11 0.00 3.11 2.04 -1.07 -3.46 117.51 119.96 3khu h ILE 455 Ca 0.33 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.94 3khu h ILE 455 Cb 0.23 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 3khu h ILE 455 CO -0.20 0.13 0.00 0.61 0.00 0.00 0.00 178.15 178.69 3khu n GLY 456 N -1.46 0.45 3.80 5.37 0.00 0.49 -5.04 105.19 108.80 3khu n GLY 456 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 3khu n GLY 456 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3khu s PHE 457 N -1.23 3.03 -0.40 1.61 0.40 -0.60 -4.67 117.98 116.13 3khu s PHE 457 Ca 0.00 1.58 -0.21 0.00 -0.60 0.00 0.00 56.93 57.69 3khu s PHE 457 Cb 0.00 -3.04 0.01 0.00 0.51 0.00 0.00 43.02 40.50 3khu s PHE 457 CO 0.00 -0.77 0.69 -0.65 0.70 0.00 0.00 175.22 175.19 3khu s GLN 458 N -3.27 3.54 -0.19 0.44 -0.21 -0.51 -4.20 119.66 115.26 3khu s GLN 458 Ca 0.67 -0.05 -0.05 0.00 0.02 0.00 0.00 55.36 55.95 3khu s GLN 458 Cb -0.16 -3.87 -0.03 0.00 1.00 0.00 0.00 33.01 29.96 3khu s GLN 458 CO 0.20 -0.89 -0.00 -1.50 -2.12 0.00 0.00 175.29 170.97 3khu s ILE 459 N 2.90 4.06 0.06 1.08 1.10 -1.26 -0.98 121.20 128.17 3khu s ILE 459 Ca 0.26 -0.28 0.05 0.00 -0.51 0.00 0.00 60.65 60.17 3khu s ILE 459 Cb -0.14 -2.82 -0.03 0.00 0.15 0.00 0.00 42.46 39.63 3khu s ILE 459 CO 0.18 0.45 -0.14 -1.61 -2.11 0.00 0.00 174.94 171.70 3khu s GLU 460 N 0.74 0.87 0.07 3.50 2.02 -0.34 -4.98 118.70 120.58 3khu s GLU 460 Ca 0.00 -0.89 -0.05 0.00 0.02 0.00 0.00 54.97 54.05 3khu s GLU 460 Cb -0.14 -0.88 -0.02 0.00 0.10 0.00 0.00 34.13 33.19 3khu s GLU 460 CO 0.02 0.20 0.10 -0.08 0.02 0.00 0.00 175.26 175.52 3khu s THR 461 N -1.11 0.17 0.45 3.63 -1.32 -1.26 -1.09 115.64 115.11 3khu s THR 461 Ca -0.01 -1.46 -0.24 0.00 -1.21 0.00 0.00 61.69 58.77 3khu s THR 461 Cb -0.09 -1.44 -0.08 0.00 -1.51 0.00 0.00 72.50 69.39 3khu s THR 461 CO 0.02 -0.79 1.24 0.27 -2.21 0.00 0.00 174.62 173.15 3khu s ILE 462 N -3.89 2.81 -0.45 5.08 -4.36 -1.18 -3.17 121.20 116.03 3khu s ILE 462 Ca 0.06 0.65 0.00 0.00 -0.26 0.00 0.00 60.65 61.10 3khu s ILE 462 Cb 0.06 -3.35 0.00 0.00 1.25 0.00 0.00 42.46 40.42 3khu s ILE 462 CO -0.10 0.04 0.00 0.61 0.24 0.00 0.00 174.94 175.72 3khu n GLY 463 N 0.59 0.70 2.74 6.27 0.00 -1.24 -4.85 105.19 109.40 3khu n GLY 463 Ca 0.06 -0.87 -0.19 0.00 0.00 0.00 0.00 46.02 45.02 3khu n GLY 463 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3khu s LYS 464 N -2.41 0.12 0.32 1.61 2.20 -1.19 -1.46 119.74 118.93 3khu s LYS 464 Ca 0.00 0.22 -0.29 0.00 -0.36 0.00 0.00 55.97 55.54 3khu s LYS 464 Cb 0.00 -0.51 -0.10 0.00 -1.51 0.00 0.00 37.83 35.70 3khu s LYS 464 CO 0.00 -0.24 1.36 0.21 -0.36 0.00 0.00 175.35 176.32 3khu s LYS 465 N 1.62 4.30 0.00 4.03 2.20 -1.26 -4.66 119.74 125.96 3khu s LYS 465 Ca -0.02 2.29 0.25 0.00 -0.36 0.00 0.00 55.97 58.13 3khu s LYS 465 Cb -0.13 -3.07 1.51 0.00 -1.51 0.00 0.00 37.83 34.64 3khu s LYS 465 CO -0.03 -0.29 1.87 0.28 -0.36 0.00 0.00 175.35 176.81