#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 0.09 -6.59 4.33 -1.53 -2.00 -3.43 114.93 105.80 3khu h MET 1 Ca 0.00 -0.01 -0.53 0.00 -3.44 0.00 0.00 59.70 55.73 3khu h MET 1 Cb 0.00 -0.02 0.01 0.00 -0.55 0.00 0.00 31.60 31.04 3khu h MET 1 CO 0.00 0.06 0.59 0.12 0.14 0.00 0.00 176.91 177.81 3khu s PHE 2 N -6.18 3.40 -0.14 1.39 5.36 -1.26 -5.01 117.98 115.53 3khu s PHE 2 Ca -0.13 1.31 0.01 0.00 -0.96 0.00 0.00 56.93 57.16 3khu s PHE 2 Cb 0.14 -3.47 0.02 0.00 -0.34 0.00 0.00 43.02 39.37 3khu s PHE 2 CO 0.71 -1.42 -0.17 -2.00 -1.46 0.00 0.00 175.22 170.88 3khu s GLU 3 N 0.36 2.53 -0.26 10.12 2.12 -1.26 -4.61 118.70 127.70 3khu s GLU 3 Ca 0.56 -0.66 -0.29 0.00 0.36 0.00 0.00 54.97 54.94 3khu s GLU 3 Cb -0.32 -2.19 0.01 0.00 0.26 0.00 0.00 34.13 31.89 3khu s GLU 3 CO 0.33 -0.14 1.12 0.42 -0.54 0.00 0.00 175.26 176.45 3khu s ILE 4 N 1.18 4.50 -0.01 -3.70 1.01 -1.26 -4.90 121.20 118.02 3khu s ILE 4 Ca -0.01 1.77 0.07 0.00 0.00 0.00 0.00 60.65 62.48 3khu s ILE 4 Cb -0.14 -4.28 -0.10 0.00 0.01 0.00 0.00 42.46 37.95 3khu s ILE 4 CO -0.07 -0.31 0.15 0.29 0.00 0.00 0.00 174.94 175.00 3khu n LYS 5 N 6.66 0.27 -4.27 2.79 5.02 -1.26 -4.88 118.16 122.49 3khu n LYS 5 Ca 0.13 -0.06 -0.20 0.00 -2.02 0.00 0.00 58.31 56.15 3khu n LYS 5 Cb 0.46 -1.15 -0.16 0.00 -0.02 0.00 0.00 35.03 34.16 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 -2.45 0.95 -0.08 1.97 1.02 -1.26 -1.26 119.74 118.64 3khu s LYS 6 Ca -0.02 -0.19 0.04 0.00 0.02 0.00 0.00 55.97 55.81 3khu s LYS 6 Cb 0.04 -0.90 0.00 0.00 -0.52 0.00 0.00 37.83 36.46 3khu s LYS 6 CO 0.27 -0.02 -0.20 0.42 -0.92 0.00 0.00 175.35 174.91 3khu s ILE 7 N 0.67 1.72 -0.11 2.17 1.01 0.43 -1.07 121.20 126.03 3khu s ILE 7 Ca -0.10 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.72 3khu s ILE 7 Cb -0.13 -1.50 -0.02 0.00 0.01 0.00 0.00 42.46 40.82 3khu s ILE 7 CO 0.01 0.48 -0.11 0.00 0.00 0.00 0.00 174.94 175.32 3khu s ILE 10 N 1.14 4.21 0.00 0.00 1.01 0.06 -1.25 121.20 126.37 3khu s ILE 10 Ca -0.08 0.89 0.00 0.00 0.00 0.00 0.00 60.65 61.46 3khu s ILE 10 Cb -0.20 -4.61 0.00 0.00 0.01 0.00 0.00 42.46 37.66 3khu s ILE 10 CO -0.05 -1.11 0.00 0.61 0.00 0.00 0.00 174.94 174.39 3khu n GLY 11 N 4.98 2.35 2.73 6.18 0.00 0.69 -0.65 105.19 121.47 3khu n GLY 11 Ca 0.08 -0.92 -0.36 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 0.33 6.07 -1.97 4.61 0.00 -1.23 -4.23 120.51 124.09 3khu n ALA 12 Ca 0.00 -4.13 0.00 0.00 0.00 0.00 0.00 53.44 49.31 3khu n ALA 12 Cb 0.00 -1.54 0.00 0.00 0.00 0.00 0.00 19.45 17.91 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 -0.55 1.87 0.19 0.00 0.00 -1.26 -4.55 105.19 100.89 3khu n GLY 13 Ca 0.50 -1.93 -0.00 0.00 0.00 0.00 0.00 46.02 44.59 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 0.15 0.00 1.61 3.20 -1.94 -2.83 116.97 117.16 3khu h TYR 14 Ca 0.00 -0.04 -0.16 0.00 3.14 0.00 0.00 58.73 61.67 3khu h TYR 14 Cb 0.00 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 3khu h TYR 14 CO 0.00 0.51 -0.93 0.28 -1.64 0.00 0.00 178.16 176.38 3khu h VAL 15 N 0.11 0.98 -0.45 1.81 2.07 -1.94 -3.39 116.25 115.45 3khu h VAL 15 Ca 0.01 -2.09 -0.04 0.00 0.82 0.00 0.00 66.70 65.40 3khu h VAL 15 Cb 0.76 2.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.72 3khu h VAL 15 CO 0.06 0.33 0.12 1.23 0.02 0.00 0.00 177.57 179.33 3khu h GLY 16 N -1.00 0.76 0.75 2.17 0.00 -1.73 -2.18 103.07 101.84 3khu h GLY 16 Ca -0.25 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.59 3khu h GLY 16 CO -0.15 0.44 -0.21 -1.33 0.00 0.00 0.00 176.54 175.29 3khu h GLY 17 N 0.59 -0.62 0.99 4.60 0.00 -1.67 -1.30 103.07 105.65 3khu h GLY 17 Ca 0.14 0.23 -0.05 0.00 0.00 0.00 0.00 47.33 47.65 3khu h GLY 17 CO 0.00 -0.23 0.16 -2.55 0.00 0.00 0.00 176.54 173.93 3khu h PRO 18 N -0.85 0.88 -0.15 4.80 0.11 -1.76 -0.31 132.00 134.72 3khu h PRO 18 Ca -0.06 -0.20 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 3khu h PRO 18 Cb 0.56 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 3khu h PRO 18 CO 0.10 0.80 0.06 1.15 -0.21 0.00 0.00 178.00 179.91 3khu h THR 19 N 0.78 1.15 0.00 -1.15 2.02 -1.41 -1.40 112.91 112.90 3khu h THR 19 Ca 0.18 -0.45 -0.09 0.00 0.77 0.00 0.00 66.41 66.81 3khu h THR 19 Cb 0.30 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 3khu h THR 19 CO -0.00 0.14 -0.43 0.00 0.37 0.00 0.00 175.52 175.60 3khu h SER 21 N 0.00 0.65 -0.51 0.00 0.02 -0.79 -1.56 113.55 111.36 3khu h SER 21 Ca -0.00 -0.31 -0.07 0.00 -0.84 0.00 0.00 61.79 60.57 3khu h SER 21 Cb 0.85 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.20 3khu h SER 21 CO 0.06 0.80 0.05 0.58 -1.14 0.00 0.00 176.83 177.18 3khu h VAL 22 N 0.48 1.26 -0.19 2.27 2.07 -1.02 -1.37 116.25 119.75 3khu h VAL 22 Ca 0.11 -1.00 0.05 0.00 0.82 0.00 0.00 66.70 66.68 3khu h VAL 22 Cb 0.47 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 3khu h VAL 22 CO 0.02 0.35 -0.13 0.40 0.02 0.00 0.00 177.57 178.23 3khu h ILE 23 N 0.74 0.62 -0.48 4.57 2.04 -1.21 -0.68 117.51 123.10 3khu h ILE 23 Ca 0.15 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.08 3khu h ILE 23 Cb 0.45 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 37.09 3khu h ILE 23 CO 0.02 0.00 0.15 0.00 0.00 0.00 0.00 178.15 178.32 3khu h ALA 24 N 1.01 0.58 -0.85 1.87 0.00 -1.12 0.12 119.26 120.87 3khu h ALA 24 Ca 0.11 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.13 3khu h ALA 24 Cb 0.30 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 3khu h ALA 24 CO -0.27 -0.25 0.56 1.25 0.00 0.00 0.00 179.25 180.54 3khu h HIS 25 N 0.31 1.03 0.00 0.00 -0.00 -0.67 -2.71 115.15 113.11 3khu h HIS 25 Ca 0.23 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.63 3khu h HIS 25 Cb 0.27 -0.34 0.00 0.00 -0.00 0.00 0.00 27.41 27.33 3khu h HIS 25 CO -0.18 0.60 -0.76 -1.33 -0.00 0.00 0.00 177.93 176.27 3khu n MET 26 N -4.44 0.26 -3.51 5.26 2.81 -0.32 -4.52 117.12 112.66 3khu n MET 26 Ca 0.11 0.04 -0.27 0.00 -1.81 0.00 0.00 57.70 55.78 3khu n MET 26 Cb 0.10 -1.63 -0.09 0.00 -0.71 0.00 0.00 33.22 30.88 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 4.84 0.00 -0.17 0.00 0.11 -1.79 -1.16 132.00 133.83 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 0.61 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.79 3khu n GLU 29 N -3.47 1.86 -4.34 1.05 -0.58 -1.26 -4.81 120.64 109.10 3khu n GLU 29 Ca -0.03 -1.29 -0.34 0.00 -0.42 0.00 0.00 57.16 55.08 3khu n GLU 29 Cb 0.09 -1.42 -0.11 0.00 -0.57 0.00 0.00 31.44 29.42 3khu n GLU 29 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3khu s ILE 30 N -1.78 4.13 -0.15 -3.67 1.01 -0.44 -4.92 121.20 115.38 3khu s ILE 30 Ca 0.34 -0.28 -0.23 0.00 0.00 0.00 0.00 60.65 60.47 3khu s ILE 30 Cb 0.19 -2.80 -0.02 0.00 0.01 0.00 0.00 42.46 39.83 3khu s ILE 30 CO 0.28 0.51 0.74 -0.60 0.00 0.00 0.00 174.94 175.87 3khu s ARG 31 N 0.07 4.31 -0.17 2.79 3.52 -0.39 -4.84 118.95 124.25 3khu s ARG 31 Ca 0.01 0.86 0.01 0.00 -0.13 0.00 0.00 55.73 56.48 3khu s ARG 31 Cb -0.13 -3.54 0.02 0.00 -1.56 0.00 0.00 34.95 29.75 3khu s ARG 31 CO 0.02 -0.19 -0.16 0.08 -0.81 0.00 0.00 175.30 174.25 3khu s VAL 32 N 1.68 1.76 -0.24 7.11 1.01 0.70 -0.42 120.40 131.99 3khu s VAL 32 Ca 0.35 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3khu s VAL 32 Cb -0.17 -1.65 0.04 0.00 0.00 0.00 0.00 36.38 34.60 3khu s VAL 32 CO 0.13 0.44 -0.11 -0.89 0.00 0.00 0.00 175.10 174.67 3khu s THR 33 N 1.40 2.36 -0.23 3.92 2.01 0.35 -0.95 115.64 124.51 3khu s THR 33 Ca 0.04 -1.33 -0.14 0.00 0.31 0.00 0.00 61.69 60.57 3khu s THR 33 Cb -0.13 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 3khu s THR 33 CO -0.11 0.14 0.34 -0.69 -0.69 0.00 0.00 174.62 173.61 3khu s VAL 34 N 1.20 5.23 0.23 3.82 1.01 0.99 -1.18 120.40 131.71 3khu s VAL 34 Ca -0.04 0.55 0.09 0.00 0.00 0.00 0.00 61.98 62.59 3khu s VAL 34 Cb -0.18 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 3khu s VAL 34 CO -0.06 0.25 -0.16 0.68 0.00 0.00 0.00 175.10 175.81 3khu s VAL 35 N 1.42 1.99 -0.17 2.92 -7.23 -0.38 -1.75 120.40 117.19 3khu s VAL 35 Ca 0.15 -2.28 -0.28 0.00 -1.81 0.00 0.00 61.98 57.77 3khu s VAL 35 Cb -0.15 -2.15 0.09 0.00 0.56 0.00 0.00 36.38 34.74 3khu s VAL 35 CO 0.08 -0.52 0.82 -0.62 -0.31 0.00 0.00 175.10 174.55 3khu s ASP 36 N -3.39 -0.58 0.37 4.85 -1.08 -1.19 -0.23 116.67 115.43 3khu s ASP 36 Ca 0.25 0.87 0.14 0.00 -0.52 0.00 0.00 52.55 53.29 3khu s ASP 36 Cb -0.02 0.79 0.72 0.00 -1.46 0.00 0.00 42.92 42.95 3khu s ASP 36 CO 0.10 -0.37 1.81 -0.37 0.52 0.00 0.00 175.17 176.85 3khu h VAL 37 N 3.28 1.21 -2.24 1.11 -1.51 -1.92 -3.41 116.25 112.77 3khu h VAL 37 Ca -0.26 -1.34 -0.53 0.00 -1.23 0.00 0.00 66.70 63.34 3khu h VAL 37 Cb 1.16 1.74 -0.07 0.00 -2.13 0.00 0.00 31.29 31.98 3khu h VAL 37 CO 0.23 0.38 1.14 0.21 -1.23 0.00 0.00 177.57 178.30 3khu s ASN 38 N -6.84 5.94 0.20 4.19 3.84 -1.26 -4.88 114.94 116.13 3khu s ASN 38 Ca -0.02 -0.28 -0.11 0.00 0.21 0.00 0.00 52.86 52.66 3khu s ASN 38 Cb 0.14 -2.55 0.13 0.00 -0.55 0.00 0.00 41.25 38.41 3khu s ASN 38 CO 0.72 -1.97 1.83 -0.08 -2.79 0.00 0.00 177.10 174.81 3khu h GLU 39 N 11.23 0.95 -0.85 0.43 4.81 -2.00 -2.50 114.58 126.65 3khu h GLU 39 Ca -0.27 -0.09 0.07 0.00 -0.13 0.00 0.00 59.36 58.95 3khu h GLU 39 Cb 1.08 -0.20 -0.07 0.00 0.63 0.00 0.00 28.75 30.20 3khu h GLU 39 CO 1.27 0.68 0.52 1.03 -0.73 0.00 0.00 179.01 181.77 3khu h SER 40 N 0.95 0.79 -0.34 1.04 0.87 -1.98 -1.29 113.55 113.59 3khu h SER 40 Ca 0.25 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.71 3khu h SER 40 Cb -0.02 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 3khu h SER 40 CO -0.05 0.49 -0.27 -0.09 -0.53 0.00 0.00 176.83 176.39 3khu h ARG 41 N 0.92 0.78 -0.34 2.24 2.43 -1.88 -1.88 114.38 116.64 3khu h ARG 41 Ca 0.38 -0.39 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 3khu h ARG 41 Cb 0.24 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 3khu h ARG 41 CO -0.20 1.01 0.20 0.82 -1.51 0.00 0.00 179.97 180.29 3khu h ILE 42 N 0.56 1.04 -0.51 1.20 1.08 -1.20 -1.40 117.51 118.27 3khu h ILE 42 Ca 0.06 -0.14 0.08 0.00 -0.39 0.00 0.00 64.86 64.47 3khu h ILE 42 Cb 0.83 0.60 -0.06 0.00 -3.07 0.00 0.00 36.82 35.12 3khu h ILE 42 CO 0.07 0.07 0.17 0.78 -0.69 0.00 0.00 178.15 178.55 3khu h ASN 43 N 0.40 0.15 -0.71 1.72 2.35 -1.15 -1.10 115.58 117.24 3khu h ASN 43 Ca 0.13 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 3khu h ASN 43 Cb 0.00 0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.40 3khu h ASN 43 CO -0.06 0.11 0.42 0.00 -1.65 0.00 0.00 177.43 176.24 3khu h ALA 44 N 1.36 1.37 -0.07 -0.83 0.00 -0.87 -0.08 119.26 120.14 3khu h ALA 44 Ca 0.25 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 3khu h ALA 44 Cb 0.29 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3khu h ALA 44 CO -0.27 0.53 -0.18 -1.49 0.00 0.00 0.00 179.25 177.84 3khu h TRP 45 N 1.00 0.12 -0.21 0.00 4.06 -0.47 -2.27 115.95 118.18 3khu h TRP 45 Ca 0.26 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.19 3khu h TRP 45 Cb -0.01 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.12 3khu h TRP 45 CO 0.01 0.29 0.00 0.09 -3.56 0.00 0.00 178.44 175.27 3khu n ASN 46 N -4.28 1.26 -4.87 -3.49 3.02 -0.12 -4.93 115.26 101.85 3khu n ASN 46 Ca -0.02 -1.89 -0.26 0.00 -0.03 0.00 0.00 54.58 52.38 3khu n ASN 46 Cb 0.27 -0.14 -0.02 0.00 -0.61 0.00 0.00 39.78 39.28 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 -1.16 4.58 0.04 6.41 1.04 -0.73 -5.04 113.70 118.84 3khu s SER 47 Ca 0.20 -1.24 0.28 0.00 0.48 0.00 0.00 55.95 55.68 3khu s SER 47 Cb 0.11 0.25 1.11 0.00 0.10 0.00 0.00 66.02 67.59 3khu s SER 47 CO 0.15 -0.98 1.87 -2.65 0.98 0.00 0.00 173.24 172.60 3khu n PRO 48 N -1.63 0.05 -3.78 4.02 -0.02 -1.26 -4.54 135.00 127.84 3khu n PRO 48 Ca -0.03 0.04 -0.36 0.00 -2.02 0.00 0.00 63.50 61.13 3khu n PRO 48 Cb 0.64 -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 3.33 0.44 3.45 2.01 -1.26 -5.10 115.64 115.49 3khu s THR 49 Ca 0.13 -2.34 -0.24 0.00 0.31 0.00 0.00 61.69 59.55 3khu s THR 49 Cb 0.18 -3.26 -0.08 0.00 0.01 0.00 0.00 72.50 69.35 3khu s THR 49 CO 0.55 -0.74 1.26 -0.76 -0.69 0.00 0.00 174.62 174.24 3khu s LEU 50 N 0.78 4.11 0.18 4.42 1.43 -1.26 -4.70 118.68 123.63 3khu s LEU 50 Ca 0.11 2.54 0.24 0.00 -1.03 0.00 0.00 54.13 55.99 3khu s LEU 50 Cb -0.22 -4.06 0.91 0.00 0.03 0.00 0.00 46.19 42.85 3khu s LEU 50 CO -0.04 -0.95 1.73 -0.81 0.23 0.00 0.00 176.35 176.51 3khu n PRO 51 N -0.21 0.17 -4.81 1.29 -0.04 -1.26 -4.48 135.00 125.67 3khu n PRO 51 Ca 0.06 0.28 -0.33 0.00 -0.04 0.00 0.00 63.50 63.47 3khu n PRO 51 Cb 0.45 -1.76 -0.15 0.00 -0.04 0.00 0.00 33.50 32.00 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 -3.16 2.78 -0.32 0.52 -1.09 -1.26 -5.10 121.20 113.56 3khu s ILE 52 Ca 0.08 -0.75 -0.17 0.00 -2.23 0.00 0.00 60.65 57.57 3khu s ILE 52 Cb 0.11 -2.15 -0.01 0.00 -1.58 0.00 0.00 42.46 38.83 3khu s ILE 52 CO 0.46 0.53 0.48 -0.47 -1.23 0.00 0.00 174.94 174.71 3khu s TYR 53 N 0.45 3.21 -0.04 3.97 5.04 -1.26 -4.98 117.35 123.74 3khu s TYR 53 Ca -0.11 0.29 -0.02 0.00 -2.44 0.00 0.00 57.07 54.79 3khu s TYR 53 Cb -0.16 -2.80 0.02 0.00 0.35 0.00 0.00 41.96 39.37 3khu s TYR 53 CO 0.05 -0.42 0.09 -1.21 -1.34 0.00 0.00 175.55 172.72 3khu s GLU 54 N 2.29 0.07 0.21 4.97 0.41 -1.26 -4.85 118.70 120.54 3khu s GLU 54 Ca 0.18 0.20 -0.32 0.00 -0.41 0.00 0.00 54.97 54.62 3khu s GLU 54 Cb -0.16 -0.07 -0.13 0.00 -1.78 0.00 0.00 34.13 31.99 3khu s GLU 54 CO 0.12 -0.08 1.51 -2.30 -0.49 0.00 0.00 175.26 174.01 3khu n PRO 55 N 3.58 2.20 0.00 0.39 -0.02 -1.26 -2.03 135.00 137.86 3khu n PRO 55 Ca -0.19 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3khu n PRO 55 Cb 0.55 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 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 2.72 2.48 0.12 -1.23 0.00 -1.26 -4.46 105.19 103.56 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 0.33 -0.61 0.99 5.85 -1.83 -2.63 115.31 117.42 3khu h LEU 57 Ca 0.00 -0.48 0.12 0.00 0.84 0.00 0.00 57.88 58.35 3khu h LEU 57 Cb 0.00 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 40.85 3khu h LEU 57 CO 0.00 0.75 0.12 0.50 -0.34 0.00 0.00 178.44 179.47 3khu h LYS 58 N -0.08 0.24 -0.04 1.25 3.64 -1.91 -0.34 116.57 119.33 3khu h LYS 58 Ca 0.02 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 3khu h LYS 58 Cb 0.65 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 3khu h LYS 58 CO 0.03 0.16 -0.56 1.05 -2.27 0.00 0.00 179.45 177.86 3khu h GLU 59 N 0.25 0.10 -0.04 1.90 9.09 -1.94 -0.55 114.58 123.39 3khu h GLU 59 Ca 0.32 -0.07 -0.01 0.00 0.05 0.00 0.00 59.36 59.65 3khu h GLU 59 Cb 0.48 0.01 -0.00 0.00 -1.65 0.00 0.00 28.75 27.59 3khu h GLU 59 CO -0.42 0.63 -0.01 0.28 0.05 0.00 0.00 179.01 179.54 3khu h VAL 60 N 0.08 1.30 -0.27 -1.06 2.07 -0.98 -2.54 116.25 114.85 3khu h VAL 60 Ca -0.00 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.59 3khu h VAL 60 Cb 1.01 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.60 3khu h VAL 60 CO 0.08 0.25 0.15 0.58 0.02 0.00 0.00 177.57 178.65 3khu h VAL 61 N -0.27 1.11 0.00 2.57 2.07 -0.93 -2.86 116.25 117.94 3khu h VAL 61 Ca 0.01 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 3khu h VAL 61 Cb 0.41 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 3khu h VAL 61 CO 0.00 0.11 -0.13 -0.33 0.02 0.00 0.00 177.57 177.25 3khu h GLU 62 N 0.33 0.00 0.00 1.57 5.08 -1.14 0.19 114.58 120.61 3khu h GLU 62 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3khu h GLU 62 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3khu h GLU 62 CO -0.02 0.13 0.00 0.66 -1.00 0.00 0.00 179.01 178.78 3khu h SER 63 N 0.00 0.00 0.00 1.42 4.64 -1.21 -3.38 113.55 115.03 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 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 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 4.14 0.00 0.00 3.52 0.61 -1.14 118.95 126.08 3khu s ARG 65 Ca 0.00 2.54 0.00 0.00 -0.13 0.00 0.00 55.73 58.14 3khu s ARG 65 Cb 0.00 -3.04 0.00 0.00 -1.56 0.00 0.00 34.95 30.35 3khu s ARG 65 CO 0.00 -0.61 0.00 0.41 -0.81 0.00 0.00 175.30 174.29 3khu n GLY 66 N 2.22 2.55 0.13 8.12 0.00 -0.15 -4.84 105.19 113.21 3khu n GLY 66 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 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 0.22 0.00 1.61 5.02 -0.29 -4.87 118.16 117.85 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 -0.86 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 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 -3.36 0.83 -4.24 4.39 6.94 -0.98 -5.04 115.26 113.81 3khu n ASN 68 Ca -0.06 -1.24 -0.33 0.00 -0.02 0.00 0.00 54.58 52.94 3khu n ASN 68 Cb 0.22 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.48 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 -0.24 2.34 0.01 -4.53 2.96 -1.04 -0.21 118.68 117.97 3khu s LEU 69 Ca 0.00 -0.51 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 3khu s LEU 69 Cb 0.00 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 45.16 3khu s LEU 69 CO 0.00 0.10 -0.10 -0.36 -1.32 0.00 0.00 176.35 174.67 3khu s PHE 70 N 0.74 0.88 -0.13 5.38 0.08 -0.12 -0.98 117.98 123.83 3khu s PHE 70 Ca -0.07 -0.24 0.03 0.00 0.12 0.00 0.00 56.93 56.76 3khu s PHE 70 Cb -0.16 -0.55 0.01 0.00 -0.57 0.00 0.00 43.02 41.75 3khu s PHE 70 CO 0.01 -0.01 -0.22 -0.06 -0.10 0.00 0.00 175.22 174.84 3khu s PHE 71 N -0.50 2.65 0.04 0.36 0.08 -1.26 -0.00 117.98 119.35 3khu s PHE 71 Ca 0.01 -1.24 -0.15 0.00 0.12 0.00 0.00 56.93 55.67 3khu s PHE 71 Cb -0.05 -1.79 0.02 0.00 -0.57 0.00 0.00 43.02 40.63 3khu s PHE 71 CO 0.00 -0.55 0.34 0.45 -0.10 0.00 0.00 175.22 175.36 3khu s SER 72 N 0.69 -0.18 0.00 1.36 0.15 -0.72 -4.94 113.70 110.07 3khu s SER 72 Ca -0.10 -0.12 0.26 0.00 0.70 0.00 0.00 55.95 56.68 3khu s SER 72 Cb -0.16 0.38 0.59 0.00 -1.71 0.00 0.00 66.02 65.11 3khu s SER 72 CO 0.01 -0.62 1.46 0.35 1.20 0.00 0.00 173.24 175.64 3khu n THR 73 N 0.58 0.00 -2.69 6.45 -2.24 -1.26 -3.14 114.28 111.98 3khu n THR 73 Ca -0.19 -0.15 -0.43 0.00 -2.27 0.00 0.00 64.05 61.01 3khu n THR 73 Cb 0.59 0.58 -0.00 0.00 -2.10 0.00 0.00 70.33 69.40 3khu n THR 73 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3khu s ASN 74 N -2.51 6.87 0.07 3.42 3.84 -1.26 -4.77 114.94 120.60 3khu s ASN 74 Ca 0.23 -2.50 -0.20 0.00 0.21 0.00 0.00 52.86 50.60 3khu s ASN 74 Cb 0.19 -2.52 -0.10 0.00 -0.55 0.00 0.00 41.25 38.26 3khu s ASN 74 CO 0.54 -1.08 1.51 0.40 -2.79 0.00 0.00 177.10 175.68 3khu h ILE 75 N 5.43 1.25 -0.18 -5.21 2.04 -1.91 -3.04 117.51 115.89 3khu h ILE 75 Ca 0.38 -0.84 0.01 0.00 1.00 0.00 0.00 64.86 65.41 3khu h ILE 75 Cb 0.89 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 38.37 3khu h ILE 75 CO 1.39 0.26 0.08 0.44 0.00 0.00 0.00 178.15 180.31 3khu h ASP 76 N 0.10 0.12 0.45 1.72 3.32 -1.99 -1.58 116.42 118.57 3khu h ASP 76 Ca 0.06 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.99 3khu h ASP 76 Cb 0.37 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 3khu h ASP 76 CO 0.01 0.09 -0.55 0.44 -1.72 0.00 0.00 179.24 177.52 3khu h ASP 77 N 0.18 0.11 -0.41 6.45 3.32 -1.96 -1.36 116.42 122.75 3khu h ASP 77 Ca 0.07 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 3khu h ASP 77 Cb 0.02 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 3khu h ASP 77 CO -0.06 0.64 0.12 0.00 -1.72 0.00 0.00 179.24 178.22 3khu h ALA 78 N 1.37 0.54 -0.34 3.45 0.00 -1.33 -2.20 119.26 120.75 3khu h ALA 78 Ca -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3khu h ALA 78 Cb 0.99 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 3khu h ALA 78 CO 0.08 0.19 0.19 0.82 0.00 0.00 0.00 179.25 180.53 3khu h ILE 79 N 0.52 1.13 -0.57 0.00 2.04 -1.12 -2.92 117.51 116.59 3khu h ILE 79 Ca 0.13 -0.33 0.05 0.00 1.00 0.00 0.00 64.86 65.71 3khu h ILE 79 Cb 0.27 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 3khu h ILE 79 CO -0.00 0.13 0.29 0.50 0.00 0.00 0.00 178.15 179.07 3khu h LYS 80 N 0.43 0.54 0.00 2.37 3.64 -0.99 -2.22 116.57 120.34 3khu h LYS 80 Ca 0.12 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3khu h LYS 80 Cb 0.05 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 3khu h LYS 80 CO -0.02 0.36 -0.12 0.39 -2.27 0.00 0.00 179.45 177.79 3khu n GLU 81 N -4.86 0.19 -2.80 1.90 1.02 -0.85 -4.86 120.64 110.39 3khu n GLU 81 Ca 0.06 0.13 -0.38 0.00 -0.02 0.00 0.00 57.16 56.95 3khu n GLU 81 Cb 0.16 -1.70 -0.06 0.00 -0.02 0.00 0.00 31.44 29.82 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 -3.08 3.28 -0.00 0.62 0.00 -0.84 -4.84 121.76 116.90 3khu s ALA 82 Ca 0.11 0.53 -0.16 0.00 0.00 0.00 0.00 51.96 52.44 3khu s ALA 82 Cb 0.14 -3.16 -0.34 0.00 0.00 0.00 0.00 23.12 19.76 3khu s ALA 82 CO 0.61 0.20 0.90 -0.44 0.00 0.00 0.00 175.76 177.03 3khu h ASP 83 N 3.63 0.74 -3.36 0.00 3.32 -1.42 -3.46 116.42 115.85 3khu h ASP 83 Ca -0.46 -0.93 -0.62 0.00 0.02 0.00 0.00 57.03 55.05 3khu h ASP 83 Cb 1.20 -0.24 -0.33 0.00 0.22 0.00 0.00 39.33 40.17 3khu h ASP 83 CO 0.66 1.68 -0.85 -0.22 -1.72 0.00 0.00 179.24 178.79 3khu s LEU 84 N -7.58 1.92 -0.29 1.55 2.96 -0.96 -1.11 118.68 115.17 3khu s LEU 84 Ca -0.12 -0.46 -0.02 0.00 -0.22 0.00 0.00 54.13 53.31 3khu s LEU 84 Cb 0.04 -1.19 0.04 0.00 0.50 0.00 0.00 46.19 45.58 3khu s LEU 84 CO 0.91 0.11 -0.01 -0.69 -1.32 0.00 0.00 176.35 175.34 3khu s VAL 85 N 0.49 3.00 0.06 1.68 1.01 0.12 -0.83 120.40 125.92 3khu s VAL 85 Ca -0.17 -1.27 -0.28 0.00 0.00 0.00 0.00 61.98 60.26 3khu s VAL 85 Cb -0.17 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 3khu s VAL 85 CO 0.06 -0.03 0.89 -0.36 0.00 0.00 0.00 175.10 175.67 3khu s PHE 86 N 1.28 3.74 -0.37 5.22 0.08 0.10 -0.90 117.98 127.14 3khu s PHE 86 Ca -0.04 1.64 -0.13 0.00 0.12 0.00 0.00 56.93 58.52 3khu s PHE 86 Cb -0.19 -2.98 -0.00 0.00 -0.57 0.00 0.00 43.02 39.28 3khu s PHE 86 CO -0.02 0.18 0.26 0.42 -0.10 0.00 0.00 175.22 175.96 3khu s ILE 87 N 0.22 5.21 -0.33 0.64 1.01 0.07 -0.76 121.20 127.25 3khu s ILE 87 Ca 0.45 -0.42 0.13 0.00 0.00 0.00 0.00 60.65 60.81 3khu s ILE 87 Cb -0.22 -3.76 0.46 0.00 0.01 0.00 0.00 42.46 38.95 3khu s ILE 87 CO 0.27 -0.12 1.08 -0.24 0.00 0.00 0.00 174.94 175.92 3khu n SER 88 N 5.11 3.05 -4.93 3.58 2.88 0.18 -1.11 113.62 122.38 3khu n SER 88 Ca -0.12 -3.03 -0.23 0.00 -1.33 0.00 0.00 58.87 54.16 3khu n SER 88 Cb 0.49 -0.46 -0.03 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 -4.22 5.08 0.55 2.46 -7.23 -1.24 -4.47 120.40 111.33 3khu s VAL 89 Ca 0.37 -0.99 -0.18 0.00 -1.81 0.00 0.00 61.98 59.37 3khu s VAL 89 Cb 0.40 -3.71 -0.06 0.00 0.56 0.00 0.00 36.38 33.57 3khu s VAL 89 CO -0.04 -0.26 1.07 0.21 -0.31 0.00 0.00 175.10 175.77 3khu s ASN 90 N -3.71 5.93 -0.52 4.85 2.47 -1.26 -4.74 114.94 117.95 3khu s ASN 90 Ca 0.34 1.94 0.04 0.00 0.42 0.00 0.00 52.86 55.59 3khu s ASN 90 Cb -0.09 -2.55 0.13 0.00 -1.45 0.00 0.00 41.25 37.29 3khu s ASN 90 CO 0.28 -1.07 0.27 0.42 -3.72 0.00 0.00 177.10 173.28 3khu s THR 91 N -2.14 2.49 0.62 -5.21 -4.23 -1.26 -4.70 115.64 101.20 3khu s THR 91 Ca 0.67 -3.30 -0.15 0.00 -1.18 0.00 0.00 61.69 57.72 3khu s THR 91 Cb -0.18 -2.72 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 3khu s THR 91 CO 0.29 -0.82 1.08 -2.16 -0.54 0.00 0.00 174.62 172.46 3khu s PRO 92 N -0.30 3.14 0.34 3.99 0.04 -1.26 -4.52 135.00 136.43 3khu s PRO 92 Ca 0.17 1.26 -0.29 0.00 0.04 0.00 0.00 61.00 62.18 3khu s PRO 92 Cb -0.25 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 32.18 3khu s PRO 92 CO -0.01 -0.96 1.53 2.41 0.04 0.00 0.00 177.00 180.01 3khu n THR 93 N -2.19 1.53 -1.78 1.26 -1.04 -1.26 -0.22 114.28 110.58 3khu n THR 93 Ca 0.09 -0.38 -0.42 0.00 -2.04 0.00 0.00 64.05 61.30 3khu n THR 93 Cb 0.53 -1.95 -0.02 0.00 -1.82 0.00 0.00 70.33 67.07 3khu n THR 93 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3khu s LYS 94 N -1.33 4.13 -0.00 -2.82 1.02 -0.22 -4.76 119.74 115.74 3khu s LYS 94 Ca 0.58 2.57 0.21 0.00 0.02 0.00 0.00 55.97 59.35 3khu s LYS 94 Cb -0.49 -3.03 -0.24 0.00 -0.52 0.00 0.00 37.83 33.54 3khu s LYS 94 CO 0.56 -0.64 0.82 0.25 -0.92 0.00 0.00 175.35 175.42 3khu n THR 95 N 2.40 0.00 -4.09 2.17 -2.24 -1.26 -0.82 114.28 110.45 3khu n THR 95 Ca 0.09 -0.09 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 3khu n THR 95 Cb 0.37 0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 69.35 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 -3.05 0.75 0.00 4.78 -0.85 -1.26 -4.80 117.35 112.91 3khu s TYR 96 Ca 0.05 -1.07 0.00 0.00 -0.52 0.00 0.00 57.07 55.53 3khu s TYR 96 Cb 0.15 -0.28 0.00 0.00 0.38 0.00 0.00 41.96 42.21 3khu s TYR 96 CO 0.86 -0.69 0.00 0.41 -1.52 0.00 0.00 175.55 174.61 3khu n GLY 97 N -0.23 -1.22 3.69 5.49 0.00 -1.26 -4.40 105.19 107.25 3khu n GLY 97 Ca -0.03 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.30 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 4.28 0.00 1.61 -1.94 -1.26 -2.11 119.30 119.89 3khu s MET 98 Ca 0.00 1.98 0.00 0.00 -1.71 0.00 0.00 55.69 55.96 3khu s MET 98 Cb 0.00 -3.55 0.00 0.00 2.01 0.00 0.00 34.83 33.29 3khu s MET 98 CO 0.00 -0.57 0.00 0.41 -0.01 0.00 0.00 175.02 174.85 3khu n GLY 99 N 3.64 0.51 3.60 -0.03 0.00 -1.26 -4.85 105.19 106.80 3khu n GLY 99 Ca 0.13 -0.60 -0.54 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.84 0.96 -0.79 1.61 4.81 -0.90 -0.54 118.16 120.47 3khu n LYS 100 Ca 0.00 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 3khu n LYS 100 Cb 0.00 -1.98 0.00 0.00 0.02 0.00 0.00 35.03 33.07 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 2.66 1.03 0.96 3.14 0.00 0.00 -4.75 105.19 108.23 3khu n GLY 101 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.41 1.61 1.74 -0.56 -4.96 116.66 110.07 3khu n ARG 102 Ca 0.00 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 3khu n ARG 102 Cb 0.00 -0.20 -0.02 0.00 -1.02 0.00 0.00 32.46 31.22 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 -1.48 2.96 0.32 7.54 0.00 0.30 -3.65 121.76 127.75 3khu s ALA 103 Ca 0.00 0.78 -0.19 0.00 0.00 0.00 0.00 51.96 52.55 3khu s ALA 103 Cb 0.00 -3.32 -0.09 0.00 0.00 0.00 0.00 23.12 19.71 3khu s ALA 103 CO 0.00 -0.45 0.82 0.00 0.00 0.00 0.00 175.76 176.12 3khu s ALA 104 N -1.69 3.26 -0.43 0.00 0.00 -1.26 -1.06 121.76 120.58 3khu s ALA 104 Ca 0.63 0.24 -0.16 0.00 0.00 0.00 0.00 51.96 52.67 3khu s ALA 104 Cb -0.24 -2.94 0.03 0.00 0.00 0.00 0.00 23.12 19.98 3khu s ALA 104 CO 0.29 0.26 0.38 0.34 0.00 0.00 0.00 175.76 177.02 3khu s ASP 105 N -1.98 6.15 -0.02 0.00 -1.08 0.70 -4.73 116.67 115.71 3khu s ASP 105 Ca 0.52 -0.88 0.05 0.00 -0.52 0.00 0.00 52.55 51.73 3khu s ASP 105 Cb -0.13 -2.19 0.19 0.00 -1.46 0.00 0.00 42.92 39.32 3khu s ASP 105 CO 0.18 -0.54 1.04 0.18 0.52 0.00 0.00 175.17 176.55 3khu n LEU 106 N 5.37 1.43 -0.32 -1.34 4.77 -1.26 -4.16 117.00 121.49 3khu n LEU 106 Ca -0.10 -0.72 0.06 0.00 -0.03 0.00 0.00 56.01 55.23 3khu n LEU 106 Cb 0.47 -0.26 0.22 0.00 -2.33 0.00 0.00 43.42 41.51 3khu n LEU 106 CO 0.44 0.29 1.15 0.07 -1.33 0.00 0.00 177.39 178.01 3khu h LYS 107 N 1.11 0.75 0.05 3.23 2.10 -1.94 -0.67 116.57 121.21 3khu h LYS 107 Ca 0.00 -0.05 -0.25 0.00 -2.00 0.00 0.00 60.65 58.36 3khu h LYS 107 Cb 0.46 -0.17 0.01 0.00 -0.90 0.00 0.00 32.23 31.63 3khu h LYS 107 CO 0.04 0.50 -1.06 1.88 -2.00 0.00 0.00 179.45 178.81 3khu h TYR 108 N 0.77 0.65 -0.42 0.07 0.05 -1.84 -0.68 116.97 115.56 3khu h TYR 108 Ca 0.46 -0.39 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 3khu h TYR 108 Cb 0.56 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 3khu h TYR 108 CO -0.05 1.23 0.20 0.82 -1.05 0.00 0.00 178.16 179.31 3khu h ILE 109 N 0.20 1.18 -0.51 -2.88 1.08 -1.73 -1.55 117.51 113.30 3khu h ILE 109 Ca -0.11 -0.50 -0.04 0.00 -0.39 0.00 0.00 64.86 63.81 3khu h ILE 109 Cb 1.72 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 36.18 3khu h ILE 109 CO 0.18 0.19 0.14 -0.08 -0.69 0.00 0.00 178.15 177.90 3khu h GLU 110 N 0.55 0.80 -0.72 2.37 4.81 -1.05 -0.13 114.58 121.20 3khu h GLU 110 Ca 0.15 -0.18 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 3khu h GLU 110 Cb 0.12 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.34 3khu h GLU 110 CO -0.02 0.76 0.45 0.00 -0.73 0.00 0.00 179.01 179.47 3khu h ALA 111 N 1.01 0.95 -0.56 2.92 0.00 -0.96 -1.06 119.26 121.56 3khu h ALA 111 Ca 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3khu h ALA 111 Cb 0.30 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3khu h ALA 111 CO -0.00 0.23 0.30 0.00 0.00 0.00 0.00 179.25 179.78 3khu h ALA 113 N 1.14 0.65 -0.49 0.00 0.00 -0.38 0.90 119.26 121.08 3khu h ALA 113 Ca 0.20 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 3khu h ALA 113 Cb 0.05 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3khu h ALA 113 CO -0.03 0.10 -0.08 0.00 0.00 0.00 0.00 179.25 179.24 3khu h ARG 114 N 0.70 0.91 -0.46 0.00 3.08 -1.06 -2.12 114.38 115.43 3khu h ARG 114 Ca 0.19 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 3khu h ARG 114 Cb -0.08 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3khu h ARG 114 CO -0.04 0.98 0.20 -0.09 -1.07 0.00 0.00 179.97 179.95 3khu h ARG 115 N 0.76 0.68 -0.38 0.04 9.65 -1.09 -1.85 114.38 122.19 3khu h ARG 115 Ca 0.13 -0.12 0.04 0.00 -1.10 0.00 0.00 59.98 58.93 3khu h ARG 115 Cb 0.62 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 29.05 3khu h ARG 115 CO 0.04 0.60 0.14 0.82 2.80 0.00 0.00 179.97 184.38 3khu h ILE 116 N 0.60 0.91 -0.23 1.20 2.04 -0.56 -1.75 117.51 119.71 3khu h ILE 116 Ca 0.16 -0.11 -0.11 0.00 1.00 0.00 0.00 64.86 65.80 3khu h ILE 116 Cb 0.17 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3khu h ILE 116 CO -0.02 0.06 -0.33 1.62 0.00 0.00 0.00 178.15 179.48 3khu h VAL 117 N 0.31 1.29 -0.78 1.67 3.04 -1.32 -2.37 116.25 118.08 3khu h VAL 117 Ca 0.17 -1.43 -0.02 0.00 -1.01 0.00 0.00 66.70 64.41 3khu h VAL 117 Cb 0.14 1.47 -0.04 0.00 -2.01 0.00 0.00 31.29 30.85 3khu h VAL 117 CO -0.17 0.45 0.42 -0.61 -1.01 0.00 0.00 177.57 176.65 3khu h GLN 118 N 0.42 1.08 -0.54 4.17 4.15 -0.92 -3.13 115.11 120.34 3khu h GLN 118 Ca 0.05 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.35 3khu h GLN 118 Cb 0.79 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 28.26 3khu h GLN 118 CO 0.06 0.80 0.00 0.09 -1.93 0.00 0.00 178.83 177.85 3khu n ASN 119 N -4.35 4.85 -4.29 -0.69 3.02 -0.70 -4.98 115.26 108.13 3khu n ASN 119 Ca 0.08 -2.68 -0.27 0.00 -0.03 0.00 0.00 54.58 51.68 3khu n ASN 119 Cb 0.10 -0.59 -0.14 0.00 -0.61 0.00 0.00 39.78 38.54 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 -1.05 2.70 0.05 6.41 0.01 -0.93 -3.97 113.70 116.92 3khu s SER 120 Ca 0.49 -0.58 -0.02 0.00 1.31 0.00 0.00 55.95 57.16 3khu s SER 120 Cb 0.35 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 66.33 3khu s SER 120 CO 0.19 0.17 -0.00 0.20 0.41 0.00 0.00 173.24 174.20 3khu s ASN 121 N -1.37 0.39 0.46 2.44 0.01 -1.26 -4.96 114.94 110.65 3khu s ASN 121 Ca 0.09 -0.83 0.00 0.00 -0.71 0.00 0.00 52.86 51.41 3khu s ASN 121 Cb -0.09 0.19 0.00 0.00 0.41 0.00 0.00 41.25 41.76 3khu s ASN 121 CO 0.03 -0.54 0.00 0.61 -1.51 0.00 0.00 177.10 175.69 3khu n GLY 122 N 0.46 0.53 3.67 0.66 0.00 -1.12 -4.76 105.19 104.63 3khu n GLY 122 Ca -0.17 -0.84 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 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 3.32 0.05 1.61 5.04 -1.26 -0.85 117.35 125.26 3khu s TYR 123 Ca 0.00 0.18 -0.08 0.00 -2.44 0.00 0.00 57.07 54.73 3khu s TYR 123 Cb 0.00 -2.13 -0.00 0.00 0.35 0.00 0.00 41.96 40.18 3khu s TYR 123 CO 0.00 0.19 0.16 0.15 -1.34 0.00 0.00 175.55 174.70 3khu s LYS 124 N 0.45 0.70 -0.19 4.97 1.02 -0.89 -4.85 119.74 120.95 3khu s LYS 124 Ca 0.05 -0.78 -0.05 0.00 0.02 0.00 0.00 55.97 55.21 3khu s LYS 124 Cb -0.12 0.28 -0.03 0.00 -0.52 0.00 0.00 37.83 37.44 3khu s LYS 124 CO -0.00 -0.20 0.01 0.42 -0.92 0.00 0.00 175.35 174.66 3khu s ILE 125 N -2.98 4.11 -0.21 2.17 1.01 -0.27 -1.41 121.20 123.62 3khu s ILE 125 Ca -0.02 -0.26 -0.03 0.00 0.00 0.00 0.00 60.65 60.34 3khu s ILE 125 Cb 0.01 -2.85 -0.00 0.00 0.01 0.00 0.00 42.46 39.63 3khu s ILE 125 CO -0.06 0.44 -0.08 -0.69 0.00 0.00 0.00 174.94 174.55 3khu s VAL 126 N 0.82 3.07 -0.13 2.92 1.01 0.15 0.10 120.40 128.35 3khu s VAL 126 Ca 0.01 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.41 3khu s VAL 126 Cb -0.14 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.88 3khu s VAL 126 CO 0.02 0.45 -0.18 -0.89 0.00 0.00 0.00 175.10 174.50 3khu s THR 127 N 1.40 1.75 -0.01 3.92 2.01 -0.08 -1.14 115.64 123.50 3khu s THR 127 Ca 0.05 -0.79 -0.30 0.00 0.31 0.00 0.00 61.69 60.96 3khu s THR 127 Cb -0.14 -1.58 -0.05 0.00 0.01 0.00 0.00 72.50 70.74 3khu s THR 127 CO -0.05 0.49 1.36 -1.61 -0.69 0.00 0.00 174.62 174.12 3khu s GLU 128 N 0.97 4.30 -0.03 4.92 2.02 -0.42 -0.75 118.70 129.70 3khu s GLU 128 Ca -0.05 1.90 0.02 0.00 0.02 0.00 0.00 54.97 56.86 3khu s GLU 128 Cb -0.15 -3.57 -0.03 0.00 0.10 0.00 0.00 34.13 30.48 3khu s GLU 128 CO -0.03 -0.55 -0.01 1.17 0.02 0.00 0.00 175.26 175.87 3khu n LYS 129 N 5.33 2.29 -2.06 1.61 4.81 -0.27 -0.74 118.16 129.14 3khu n LYS 129 Ca 0.13 0.01 -0.28 0.00 -0.87 0.00 0.00 58.31 57.29 3khu n LYS 129 Cb 0.44 -1.08 0.06 0.00 0.02 0.00 0.00 35.03 34.48 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 -3.74 4.97 0.07 3.14 0.01 -1.21 -3.23 113.70 113.71 3khu s SER 130 Ca -0.03 0.76 -0.31 0.00 1.31 0.00 0.00 55.95 57.68 3khu s SER 130 Cb 0.01 -1.44 -0.06 0.00 0.21 0.00 0.00 66.02 64.74 3khu s SER 130 CO 0.12 -1.56 1.25 -0.89 0.41 0.00 0.00 173.24 172.56 3khu s THR 131 N -3.35 3.86 0.12 1.44 2.01 -1.26 -4.87 115.64 113.60 3khu s THR 131 Ca 0.59 1.33 0.05 0.00 0.31 0.00 0.00 61.69 63.98 3khu s THR 131 Cb -0.11 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 3khu s THR 131 CO 0.48 0.10 -0.12 0.68 -0.69 0.00 0.00 174.62 175.07 3khu s VAL 132 N 1.12 1.19 0.72 3.82 -7.23 -1.26 -4.46 120.40 114.30 3khu s VAL 132 Ca 0.60 -1.81 -0.12 0.00 -1.81 0.00 0.00 61.98 58.85 3khu s VAL 132 Cb -0.31 -1.58 0.03 0.00 0.56 0.00 0.00 36.38 35.07 3khu s VAL 132 CO 0.29 -0.55 1.08 -2.16 -0.31 0.00 0.00 175.10 173.45 3khu s PRO 133 N -3.03 2.64 0.35 4.82 0.04 -1.26 -4.94 135.00 133.61 3khu s PRO 133 Ca 0.10 1.13 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 3khu s PRO 133 Cb -0.02 -1.95 -0.11 0.00 0.04 0.00 0.00 34.50 32.46 3khu s PRO 133 CO 0.02 -1.35 1.49 0.08 0.04 0.00 0.00 177.00 177.28 3khu s VAL 134 N -2.84 2.13 0.00 -0.36 1.01 -1.26 -2.05 120.40 117.04 3khu s VAL 134 Ca 0.61 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.72 3khu s VAL 134 Cb -0.16 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.14 3khu s VAL 134 CO 0.52 0.03 0.00 0.54 0.00 0.00 0.00 175.10 176.19 3khu n ARG 135 N 0.89 0.00 -0.08 2.72 1.74 -1.26 -4.95 116.66 115.72 3khu n ARG 135 Ca 0.02 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.04 3khu n ARG 135 Cb 0.39 -0.67 -0.00 0.00 -1.02 0.00 0.00 32.46 31.15 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 0.23 -0.73 7.54 0.00 -1.78 -1.82 119.26 122.71 3khu h ALA 136 Ca 0.00 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.07 3khu h ALA 136 Cb 0.00 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 3khu h ALA 136 CO 0.00 -0.43 0.48 0.00 0.00 0.00 0.00 179.25 179.29 3khu h ALA 137 N 1.27 1.73 -0.52 0.00 0.00 -1.93 -0.39 119.26 119.42 3khu h ALA 137 Ca 0.14 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3khu h ALA 137 Cb 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3khu h ALA 137 CO -0.26 0.15 0.15 1.49 0.00 0.00 0.00 179.25 180.78 3khu h GLU 138 N 0.73 0.78 -0.20 0.00 4.81 -1.77 -1.14 114.58 117.79 3khu h GLU 138 Ca 0.32 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.36 3khu h GLU 138 Cb 0.30 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3khu h GLU 138 CO -0.11 0.69 -0.04 0.77 -0.73 0.00 0.00 179.01 179.58 3khu h SER 139 N 0.75 0.38 -0.21 1.04 0.02 -0.50 -1.22 113.55 113.82 3khu h SER 139 Ca 0.17 -0.36 0.03 0.00 -0.84 0.00 0.00 61.79 60.79 3khu h SER 139 Cb 0.25 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.65 3khu h SER 139 CO -0.01 0.65 -0.00 0.40 -1.14 0.00 0.00 176.83 176.74 3khu h ILE 140 N 0.10 0.85 -0.84 3.27 2.04 -1.10 -1.65 117.51 120.17 3khu h ILE 140 Ca 0.05 -0.02 0.09 0.00 1.00 0.00 0.00 64.86 65.98 3khu h ILE 140 Cb 0.49 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.29 3khu h ILE 140 CO 0.02 0.01 0.55 -0.09 0.00 0.00 0.00 178.15 178.64 3khu h ARG 141 N 0.06 0.80 -0.39 2.37 9.65 -1.05 -1.64 114.38 124.19 3khu h ARG 141 Ca 0.10 -0.05 -0.11 0.00 -1.10 0.00 0.00 59.98 58.82 3khu h ARG 141 Cb 0.12 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.51 3khu h ARG 141 CO -0.17 0.53 -0.20 0.00 2.80 0.00 0.00 179.97 182.93 3khu h ARG 142 N 0.83 0.82 -0.61 0.20 -0.00 -0.34 0.52 114.38 115.80 3khu h ARG 142 Ca 0.39 -0.36 -0.03 0.00 -0.50 0.00 0.00 59.98 59.48 3khu h ARG 142 Cb 0.39 -0.02 -0.03 0.00 0.00 0.00 0.00 29.97 30.32 3khu h ARG 142 CO -0.15 0.99 0.28 0.82 0.00 0.00 0.00 179.97 181.91 3khu h ILE 143 N 0.62 1.22 -0.10 2.04 2.04 -0.78 -0.80 117.51 121.75 3khu h ILE 143 Ca 0.08 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 3khu h ILE 143 Cb 0.76 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.34 3khu h ILE 143 CO 0.06 0.26 0.04 -0.26 0.00 0.00 0.00 178.15 178.24 3khu h PHE 144 N 0.84 0.15 -0.30 1.37 0.04 -1.12 -2.36 116.94 115.55 3khu h PHE 144 Ca 0.21 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.97 3khu h PHE 144 Cb 0.14 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.23 3khu h PHE 144 CO 0.00 0.26 0.18 -0.44 -0.60 0.00 0.00 178.31 177.71 3khu h ASP 145 N -0.00 0.35 1.17 2.17 3.32 -0.78 -2.32 116.42 120.34 3khu h ASP 145 Ca 0.03 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3khu h ASP 145 Cb 0.17 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.63 3khu h ASP 145 CO -0.00 0.27 -0.23 0.00 -1.72 0.00 0.00 179.24 177.56 3khu n ALA 146 N -2.49 2.57 -2.56 3.45 0.00 -0.32 -4.11 120.51 117.05 3khu n ALA 146 Ca 0.01 -0.12 -0.22 0.00 0.00 0.00 0.00 53.44 53.11 3khu n ALA 146 Cb 0.08 -1.35 0.01 0.00 0.00 0.00 0.00 19.45 18.18 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 -2.09 3.78 -4.84 0.00 3.02 -0.88 -5.08 115.26 109.17 3khu n ASN 147 Ca 0.05 -3.44 -0.32 0.00 -0.03 0.00 0.00 54.58 50.83 3khu n ASN 147 Cb 0.42 -0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 39.08 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 -4.80 4.41 0.09 3.41 -1.32 -1.20 -4.93 115.64 111.30 3khu s THR 148 Ca 0.42 1.15 0.03 0.00 -1.21 0.00 0.00 61.69 62.09 3khu s THR 148 Cb 0.41 -3.66 -0.03 0.00 -1.51 0.00 0.00 72.50 67.70 3khu s THR 148 CO -0.13 -0.67 -0.10 -0.54 -2.21 0.00 0.00 174.62 170.98 3khu s LYS 149 N -4.09 0.80 0.18 7.08 1.02 -1.26 -5.09 119.74 118.38 3khu s LYS 149 Ca 0.60 -1.11 -0.33 0.00 0.02 0.00 0.00 55.97 55.14 3khu s LYS 149 Cb -0.11 -0.48 -0.14 0.00 -0.52 0.00 0.00 37.83 36.59 3khu s LYS 149 CO 0.33 0.07 1.52 -2.30 -0.92 0.00 0.00 175.35 174.05 3khu n PRO 150 N 0.65 2.10 -0.90 -1.68 -0.02 -1.26 -2.06 135.00 131.83 3khu n PRO 150 Ca -0.17 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3khu n PRO 150 Cb 0.57 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 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 3.00 -2.77 -4.66 2.55 3.02 -1.26 -4.79 115.26 110.35 3khu n ASN 151 Ca 0.15 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.29 3khu n ASN 151 Cb 0.29 -1.78 -0.04 0.00 -0.61 0.00 0.00 39.78 37.65 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 4.13 -0.37 3.41 2.96 -0.88 -2.78 118.68 125.16 3khu s LEU 152 Ca 0.00 1.10 0.00 0.00 -0.22 0.00 0.00 54.13 55.01 3khu s LEU 152 Cb 0.00 -3.20 0.12 0.00 0.50 0.00 0.00 46.19 43.61 3khu s LEU 152 CO 0.00 -0.45 0.18 0.21 -1.32 0.00 0.00 176.35 174.97 3khu s ASN 153 N 1.24 3.57 -0.17 3.68 2.47 -0.03 -4.79 114.94 120.91 3khu s ASN 153 Ca 0.36 -2.11 -0.08 0.00 0.42 0.00 0.00 52.86 51.46 3khu s ASN 153 Cb -0.16 -0.76 -0.04 0.00 -1.45 0.00 0.00 41.25 38.84 3khu s ASN 153 CO 0.10 -0.34 0.09 -0.76 -3.72 0.00 0.00 177.10 172.48 3khu s LEU 154 N 1.06 4.03 -0.08 3.21 1.43 -1.26 -2.10 118.68 124.97 3khu s LEU 154 Ca 0.15 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.45 3khu s LEU 154 Cb -0.21 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 43.96 3khu s LEU 154 CO -0.10 0.22 -0.07 -1.10 0.23 0.00 0.00 176.35 175.54 3khu s GLN 155 N 0.08 2.87 -0.18 1.70 -1.52 -0.50 -4.99 119.66 117.12 3khu s GLN 155 Ca 0.07 -0.55 -0.03 0.00 -1.95 0.00 0.00 55.36 52.90 3khu s GLN 155 Cb -0.12 -2.63 -0.02 0.00 -0.22 0.00 0.00 33.01 30.03 3khu s GLN 155 CO 0.00 0.60 -0.05 0.08 -0.25 0.00 0.00 175.29 175.67 3khu s VAL 156 N -0.64 3.55 0.21 1.09 1.01 -1.26 0.29 120.40 124.66 3khu s VAL 156 Ca 0.10 -0.46 0.08 0.00 0.00 0.00 0.00 61.98 61.70 3khu s VAL 156 Cb -0.12 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 3khu s VAL 156 CO 0.02 0.46 -0.14 -0.76 0.00 0.00 0.00 175.10 174.68 3khu s LEU 157 N 0.88 2.55 -0.09 3.92 1.43 -0.29 -4.59 118.68 122.50 3khu s LEU 157 Ca -0.01 -1.03 0.03 0.00 -1.03 0.00 0.00 54.13 52.08 3khu s LEU 157 Cb -0.15 -0.67 -0.02 0.00 0.03 0.00 0.00 46.19 45.38 3khu s LEU 157 CO 0.01 -0.18 -0.17 -0.55 0.23 0.00 0.00 176.35 175.69 3khu s SER 158 N -3.33 3.73 -0.44 2.29 0.15 0.19 -1.31 113.70 114.98 3khu s SER 158 Ca 0.23 -0.35 0.05 0.00 0.70 0.00 0.00 55.95 56.59 3khu s SER 158 Cb -0.00 -1.18 0.19 0.00 -1.71 0.00 0.00 66.02 63.31 3khu s SER 158 CO 0.07 0.24 0.49 -3.20 1.20 0.00 0.00 173.24 172.05 3khu n ASN 159 N 3.02 -1.32 -4.74 5.45 4.05 0.08 -0.01 115.26 121.79 3khu n ASN 159 Ca -0.18 -2.60 -0.31 0.00 0.45 0.00 0.00 54.58 51.94 3khu n ASN 159 Cb 0.52 0.17 0.11 0.00 1.23 0.00 0.00 39.78 41.81 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 0.15 1.88 0.12 1.20 0.02 -1.24 -4.27 135.00 132.86 3khu s PRO 160 Ca 0.32 1.21 0.05 0.00 0.02 0.00 0.00 61.00 62.60 3khu s PRO 160 Cb 0.06 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.69 3khu s PRO 160 CO -0.15 -1.92 0.06 -0.65 -0.33 0.00 0.00 177.00 174.01 3khu s GLN 161 N -4.85 2.73 -0.45 5.54 1.11 -1.20 -4.68 119.66 117.86 3khu s GLN 161 Ca 0.63 -0.84 0.09 0.00 0.01 0.00 0.00 55.36 55.25 3khu s GLN 161 Cb -0.18 -2.60 0.35 0.00 -1.01 0.00 0.00 33.01 29.57 3khu s GLN 161 CO 0.57 0.52 0.84 1.19 0.01 0.00 0.00 175.29 178.42 3khu n PHE 162 N 0.17 1.92 -3.60 0.91 3.72 -1.26 -4.99 117.46 114.33 3khu n PHE 162 Ca -0.09 -3.81 -0.36 0.00 -0.05 0.00 0.00 57.45 53.13 3khu n PHE 162 Cb 0.53 -0.43 -0.07 0.00 -0.94 0.00 0.00 39.48 38.57 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 -2.93 4.27 -0.05 4.37 1.43 -1.26 -4.90 118.68 119.60 3khu s LEU 163 Ca 0.43 0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 54.00 3khu s LEU 163 Cb 0.33 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 3khu s LEU 163 CO -0.10 0.16 0.06 0.00 0.23 0.00 0.00 176.35 176.69 3khu s ALA 164 N 0.19 3.50 0.07 4.21 0.00 -1.26 -5.01 121.76 123.47 3khu s ALA 164 Ca 0.15 -0.82 -0.34 0.00 0.00 0.00 0.00 51.96 50.95 3khu s ALA 164 Cb -0.13 -1.58 -0.13 0.00 0.00 0.00 0.00 23.12 21.27 3khu s ALA 164 CO 0.04 0.64 1.66 -1.91 0.00 0.00 0.00 175.76 176.19 3khu n GLU 165 N 1.66 2.09 0.00 0.00 0.00 -1.26 -1.66 120.64 121.47 3khu n GLU 165 Ca -0.16 0.76 0.00 0.00 0.00 0.00 0.00 57.16 57.75 3khu n GLU 165 Cb 0.53 -2.54 0.00 0.00 0.00 0.00 0.00 31.44 29.43 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 3.69 1.75 0.31 8.31 0.00 -1.26 -4.85 105.19 113.14 3khu n GLY 166 Ca 0.19 0.00 0.05 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 0.97 -0.16 2.61 -2.24 -0.67 -4.62 114.28 108.17 3khu n THR 167 Ca 0.00 -1.19 -0.02 0.00 -2.27 0.00 0.00 64.05 60.57 3khu n THR 167 Cb 0.00 0.13 0.06 0.00 -2.10 0.00 0.00 70.33 68.42 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 0.48 -0.23 6.98 0.00 -1.86 0.37 119.26 125.03 3khu h ALA 168 Ca -0.00 0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3khu h ALA 168 Cb 1.20 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 3khu h ALA 168 CO 0.00 -0.39 -0.05 0.82 0.00 0.00 0.00 179.25 179.63 3khu h ILE 169 N 0.11 1.28 -0.82 0.00 1.08 -1.91 -0.54 117.51 116.71 3khu h ILE 169 Ca 0.26 -1.04 -0.02 0.00 -0.39 0.00 0.00 64.86 63.67 3khu h ILE 169 Cb 0.39 1.49 -0.04 0.00 -3.07 0.00 0.00 36.82 35.59 3khu h ILE 169 CO -0.43 0.32 0.44 0.11 -0.69 0.00 0.00 178.15 177.90 3khu h LYS 170 N 0.18 1.16 -0.21 2.37 1.57 -1.81 0.13 116.57 119.96 3khu h LYS 170 Ca 0.06 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3khu h LYS 170 Cb 0.50 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3khu h LYS 170 CO 0.02 0.86 -0.01 -0.44 -0.57 0.00 0.00 179.45 179.31 3khu h ASP 171 N 1.16 0.29 0.33 0.86 3.32 -0.51 -0.95 116.42 120.92 3khu h ASP 171 Ca 0.29 -0.04 -0.33 0.00 0.02 0.00 0.00 57.03 56.97 3khu h ASP 171 Cb 0.05 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.53 3khu h ASP 171 CO -0.04 0.35 -1.60 -0.07 -1.72 0.00 0.00 179.24 176.16 3khu h LEU 172 N 0.31 0.54 0.05 1.55 3.38 -0.42 -3.13 115.31 117.59 3khu h LEU 172 Ca 0.07 -0.74 -0.25 0.00 0.09 0.00 0.00 57.88 57.06 3khu h LEU 172 Cb 0.23 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3khu h LEU 172 CO 0.01 1.61 -1.13 0.11 0.09 0.00 0.00 178.44 179.13 3khu h LYS 173 N 0.09 0.17 -2.07 1.13 1.57 -0.69 -3.39 116.57 113.39 3khu h LYS 173 Ca -0.28 -0.28 -0.56 0.00 -1.87 0.00 0.00 60.65 57.66 3khu h LYS 173 Cb 2.07 0.10 -0.40 0.00 0.08 0.00 0.00 32.23 34.08 3khu h LYS 173 CO 0.19 1.12 -0.96 -1.71 -0.57 0.00 0.00 179.45 177.52 3khu n ASN 174 N -3.48 1.54 -4.78 0.86 5.15 -0.37 -4.91 115.26 109.28 3khu n ASN 174 Ca -0.05 -3.02 -0.37 0.00 -0.60 0.00 0.00 54.58 50.54 3khu n ASN 174 Cb 0.98 -0.64 -0.05 0.00 -0.53 0.00 0.00 39.78 39.54 3khu n ASN 174 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3khu s PRO 175 N -1.92 4.41 0.25 1.20 0.04 -1.18 -4.70 135.00 133.10 3khu s PRO 175 Ca 0.38 1.47 -0.05 0.00 0.04 0.00 0.00 61.00 62.84 3khu s PRO 175 Cb 0.21 -2.74 0.32 0.00 0.04 0.00 0.00 34.50 32.33 3khu s PRO 175 CO -0.08 0.09 1.89 -0.44 0.04 0.00 0.00 177.00 178.50 3khu h ASP 176 N 2.98 1.02 -5.02 6.66 3.32 -1.94 -3.44 116.42 119.99 3khu h ASP 176 Ca -0.47 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 3khu h ASP 176 Cb 1.20 -0.23 -0.12 0.00 0.22 0.00 0.00 39.33 40.41 3khu h ASP 176 CO 0.64 0.69 0.15 0.00 -1.72 0.00 0.00 179.24 179.00 3khu s ARG 177 N -6.08 1.29 -0.10 3.56 3.03 -1.26 -4.89 118.95 114.49 3khu s ARG 177 Ca -0.13 -0.57 0.00 0.00 2.03 0.00 0.00 55.73 57.07 3khu s ARG 177 Cb 0.19 0.57 -0.02 0.00 -1.03 0.00 0.00 34.95 34.65 3khu s ARG 177 CO 0.81 -0.56 -0.11 0.08 -1.13 0.00 0.00 175.30 174.39 3khu s VAL 178 N -3.78 3.31 -0.15 4.99 1.01 -0.12 -4.98 120.40 120.68 3khu s VAL 178 Ca 0.02 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.43 3khu s VAL 178 Cb -0.01 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 34.01 3khu s VAL 178 CO -0.11 0.55 -0.20 -0.22 0.00 0.00 0.00 175.10 175.12 3khu s LEU 179 N -0.11 2.04 -0.08 3.92 2.96 -1.26 0.02 118.68 126.16 3khu s LEU 179 Ca -0.00 -0.60 -0.00 0.00 -0.22 0.00 0.00 54.13 53.31 3khu s LEU 179 Cb -0.13 -1.40 0.02 0.00 0.50 0.00 0.00 46.19 45.18 3khu s LEU 179 CO 0.03 0.03 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.41 3khu s ILE 180 N 1.08 0.77 0.02 6.68 1.01 -0.50 -3.66 121.20 126.59 3khu s ILE 180 Ca -0.01 -0.16 0.06 0.00 0.00 0.00 0.00 60.65 60.53 3khu s ILE 180 Cb -0.14 -0.81 -0.03 0.00 0.01 0.00 0.00 42.46 41.49 3khu s ILE 180 CO -0.07 0.31 -0.14 -0.83 0.00 0.00 0.00 174.94 174.20 3khu s GLY 181 N 1.51 1.61 0.32 6.18 0.00 0.98 -1.60 107.32 116.31 3khu s GLY 181 Ca -0.00 -1.11 -0.19 0.00 0.00 0.00 0.00 44.72 43.41 3khu s GLY 181 CO -0.04 -0.98 0.76 -0.32 0.00 0.00 0.00 173.10 172.51 3khu s GLY 182 N -1.32 0.09 0.65 0.20 0.00 -0.86 -0.64 107.32 105.44 3khu s GLY 182 Ca 0.15 -0.48 -0.16 0.00 0.00 0.00 0.00 44.72 44.23 3khu s GLY 182 CO 0.05 -0.15 1.16 0.99 0.00 0.00 0.00 173.10 175.15 3khu s ASP 183 N -2.98 4.93 0.00 1.64 -0.00 -1.26 -3.17 116.67 115.82 3khu s ASP 183 Ca 0.13 2.20 0.00 0.00 -0.00 0.00 0.00 52.55 54.88 3khu s ASP 183 Cb -0.06 -2.57 0.00 0.00 -0.00 0.00 0.00 42.92 40.29 3khu s ASP 183 CO 0.09 -1.76 0.90 -0.62 -0.00 0.00 0.00 175.17 173.78 3khu n GLU 184 N -2.21 0.94 -2.42 8.23 1.02 -1.26 -3.71 120.64 121.22 3khu n GLU 184 Ca 0.12 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 57.00 3khu n GLU 184 Cb 0.51 -1.04 0.03 0.00 -0.02 0.00 0.00 31.44 30.92 3khu n GLU 184 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3khu s THR 185 N -1.92 3.63 0.20 2.62 -4.23 -1.26 -4.88 115.64 109.81 3khu s THR 185 Ca 0.00 -0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.38 3khu s THR 185 Cb 0.00 -3.44 0.14 0.00 1.34 0.00 0.00 72.50 70.54 3khu s THR 185 CO 0.00 -0.45 1.85 -0.65 -0.54 0.00 0.00 174.62 174.84 3khu h PRO 186 N -0.16 0.98 -0.50 3.99 0.11 -1.99 0.18 132.00 134.61 3khu h PRO 186 Ca -0.45 -0.08 0.04 0.00 0.11 0.00 0.00 66.00 65.62 3khu h PRO 186 Cb 1.26 -0.21 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 3khu h PRO 186 CO 0.60 0.68 0.25 0.93 -0.21 0.00 0.00 178.00 180.26 3khu h GLU 187 N 0.99 0.48 -0.34 1.05 3.07 -1.94 -1.36 114.58 116.53 3khu h GLU 187 Ca 0.26 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.09 3khu h GLU 187 Cb -0.06 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.73 3khu h GLU 187 CO -0.05 0.32 0.18 0.78 -1.40 0.00 0.00 179.01 178.84 3khu h GLY 188 N 0.49 0.51 1.83 -3.84 0.00 -1.57 -2.51 103.07 97.97 3khu h GLY 188 Ca 0.22 -0.23 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 3khu h GLY 188 CO -0.15 0.22 -0.43 1.46 0.00 0.00 0.00 176.54 177.64 3khu h GLN 189 N 0.42 0.19 -0.46 4.80 1.08 -0.77 -1.14 115.11 119.23 3khu h GLN 189 Ca 0.12 -0.09 0.01 0.00 -1.45 0.00 0.00 58.65 57.24 3khu h GLN 189 Cb 0.07 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.47 3khu h GLN 189 CO -0.02 0.59 0.29 -0.09 -0.95 0.00 0.00 178.83 178.65 3khu h ARG 190 N 0.16 0.56 -0.24 1.46 2.43 -1.12 -1.53 114.38 116.11 3khu h ARG 190 Ca 0.01 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 3khu h ARG 190 Cb 0.83 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 3khu h ARG 190 CO 0.06 0.37 -0.09 0.00 -1.51 0.00 0.00 179.97 178.81 3khu h ALA 191 N 1.19 0.33 -0.56 2.80 0.00 -1.03 -2.34 119.26 119.65 3khu h ALA 191 Ca 0.18 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 54.85 3khu h ALA 191 Cb -0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 3khu h ALA 191 CO -0.07 0.16 0.30 0.28 0.00 0.00 0.00 179.25 179.92 3khu h VAL 192 N 0.21 0.97 -0.79 0.00 2.07 -1.07 -2.16 116.25 115.48 3khu h VAL 192 Ca 0.06 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.33 3khu h VAL 192 Cb 0.57 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 3khu h VAL 192 CO 0.03 0.10 0.30 1.56 0.02 0.00 0.00 177.57 179.59 3khu h GLN 193 N 0.57 1.18 -0.62 1.57 4.20 -1.19 -0.64 115.11 120.18 3khu h GLN 193 Ca 0.25 -0.22 0.02 0.00 0.06 0.00 0.00 58.65 58.75 3khu h GLN 193 Cb 0.14 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 3khu h GLN 193 CO -0.16 0.96 0.40 0.00 -0.67 0.00 0.00 178.83 179.36 3khu h ALA 194 N 1.18 0.80 -0.15 3.87 0.00 -0.99 0.02 119.26 123.98 3khu h ALA 194 Ca 0.26 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.96 3khu h ALA 194 Cb 0.23 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3khu h ALA 194 CO -0.02 0.18 -0.63 1.25 0.00 0.00 0.00 179.25 180.04 3khu h LEU 195 N 0.81 0.63 -0.50 0.00 5.85 -1.04 -2.59 115.31 118.46 3khu h LEU 195 Ca 0.24 -0.36 0.06 0.00 0.84 0.00 0.00 57.88 58.65 3khu h LEU 195 Cb -0.05 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 3khu h LEU 195 CO -0.07 1.10 0.20 0.00 -0.34 0.00 0.00 178.44 179.33 3khu h ALA 197 N 1.31 2.10 0.40 0.00 0.00 -0.61 0.10 119.26 122.56 3khu h ALA 197 Ca 0.23 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 3khu h ALA 197 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3khu h ALA 197 CO -0.21 -0.29 -0.19 0.28 0.00 0.00 0.00 179.25 178.83 3khu h VAL 198 N 0.00 0.54 -0.01 0.00 2.07 -1.23 -3.07 116.25 114.55 3khu h VAL 198 Ca 0.11 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.14 3khu h VAL 198 Cb 0.46 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 3khu h VAL 198 CO -0.00 0.08 0.01 1.88 0.02 0.00 0.00 177.57 179.56 3khu h TYR 199 N -0.84 0.00 0.00 1.57 -1.99 -0.96 -2.33 116.97 112.41 3khu h TYR 199 Ca -0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.68 3khu h TYR 199 Cb 0.54 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.27 3khu h TYR 199 CO 0.01 0.00 0.00 0.39 -0.00 0.00 0.00 178.16 178.56 3khu n GLU 200 N -4.50 0.09 0.29 4.88 1.02 0.23 -1.09 120.64 121.56 3khu n GLU 200 Ca -0.03 0.41 0.13 0.00 -0.02 0.00 0.00 57.16 57.65 3khu n GLU 200 Cb 0.10 -1.71 0.84 0.00 -0.02 0.00 0.00 31.44 30.65 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 -1.49 -3.36 115.15 113.84 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 0.22 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.69 3khu h HIS 201 CO 0.00 0.01 0.00 -2.67 0.86 0.00 0.00 177.93 176.13 3khu n TRP 202 N -4.03 0.00 -4.60 2.45 2.14 -0.62 -5.00 117.44 107.78 3khu n TRP 202 Ca -0.03 0.00 -0.33 0.00 2.07 0.00 0.00 57.50 59.21 3khu n TRP 202 Cb 0.09 0.00 -0.14 0.00 -0.81 0.00 0.00 31.31 30.45 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 3.12 0.43 -1.67 1.01 -0.25 -4.99 120.40 118.05 3khu s VAL 203 Ca 0.00 -0.62 -0.26 0.00 0.00 0.00 0.00 61.98 61.09 3khu s VAL 203 Cb 0.00 -2.33 -0.09 0.00 0.00 0.00 0.00 36.38 33.95 3khu s VAL 203 CO 0.00 0.51 1.45 -2.65 0.00 0.00 0.00 175.10 174.40 3khu n PRO 204 N 3.75 2.37 -0.28 2.72 -0.02 -1.26 -4.30 135.00 137.99 3khu n PRO 204 Ca -0.18 0.84 0.16 0.00 -2.02 0.00 0.00 63.50 62.29 3khu n PRO 204 Cb 0.52 -2.64 0.43 0.00 -0.02 0.00 0.00 33.50 31.79 3khu n PRO 204 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3khu h ARG 205 N 2.48 0.56 0.00 -0.52 9.65 -1.95 0.37 114.38 124.97 3khu h ARG 205 Ca -0.51 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.34 3khu h ARG 205 Cb 1.26 -0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 29.72 3khu h ARG 205 CO 0.62 0.37 -0.00 1.05 2.80 0.00 0.00 179.97 184.81 3khu h GLU 206 N 0.58 0.00 -0.10 0.20 -0.00 -2.03 -1.81 114.58 111.42 3khu h GLU 206 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.85 3khu h GLU 206 Cb 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.73 3khu h GLU 206 CO -0.23 0.00 0.00 1.63 -0.00 0.00 0.00 179.01 180.41 3khu n LYS 207 N -3.17 2.32 -3.60 1.06 5.02 0.12 -4.84 118.16 115.06 3khu n LYS 207 Ca -0.03 -1.93 -0.40 0.00 -2.02 0.00 0.00 58.31 53.93 3khu n LYS 207 Cb 0.08 -1.47 -0.11 0.00 -0.02 0.00 0.00 35.03 33.50 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 -1.91 4.78 -0.19 -0.18 1.01 -0.68 -0.95 121.20 123.09 3khu s ILE 208 Ca 0.31 -0.49 -0.07 0.00 0.00 0.00 0.00 60.65 60.39 3khu s ILE 208 Cb 0.21 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 3khu s ILE 208 CO 0.30 -0.04 0.06 -0.22 0.00 0.00 0.00 174.94 175.04 3khu s LEU 209 N 1.63 3.74 -0.07 2.97 2.96 0.10 -4.97 118.68 125.04 3khu s LEU 209 Ca 0.04 0.04 0.03 0.00 -0.22 0.00 0.00 54.13 54.03 3khu s LEU 209 Cb -0.18 -1.95 -0.02 0.00 0.50 0.00 0.00 46.19 44.55 3khu s LEU 209 CO 0.07 0.16 -0.17 0.42 -1.32 0.00 0.00 176.35 175.51 3khu s THR 210 N 0.48 2.78 0.22 3.68 -4.23 -1.26 -1.41 115.64 115.90 3khu s THR 210 Ca 0.03 -0.80 0.03 0.00 -1.18 0.00 0.00 61.69 59.76 3khu s THR 210 Cb -0.13 -2.09 -0.01 0.00 1.34 0.00 0.00 72.50 71.61 3khu s THR 210 CO 0.01 0.57 0.24 0.35 -0.54 0.00 0.00 174.62 175.24 3khu n THR 211 N 2.81 0.00 -1.90 3.99 -2.24 -0.63 -4.98 114.28 111.33 3khu n THR 211 Ca -0.17 -1.46 -0.30 0.00 -2.27 0.00 0.00 64.05 59.84 3khu n THR 211 Cb 0.52 0.78 0.04 0.00 -2.10 0.00 0.00 70.33 69.57 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 -2.51 5.62 0.25 3.42 2.20 -1.26 -2.03 114.94 120.63 3khu s ASN 212 Ca 0.24 1.18 -0.06 0.00 -0.94 0.00 0.00 52.86 53.28 3khu s ASN 212 Cb 0.01 -2.04 0.26 0.00 -2.00 0.00 0.00 41.25 37.47 3khu s ASN 212 CO 0.17 -1.23 1.88 0.74 -2.94 0.00 0.00 177.10 175.72 3khu h THR 213 N -0.57 1.25 -0.41 0.54 2.02 -1.78 -2.18 112.91 111.79 3khu h THR 213 Ca -0.45 -0.60 -0.03 0.00 0.77 0.00 0.00 66.41 66.10 3khu h THR 213 Cb 1.24 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 3khu h THR 213 CO 0.63 0.28 0.15 -0.50 0.37 0.00 0.00 175.52 176.45 3khu h TRP 214 N 1.23 0.64 -0.87 3.16 6.55 -1.93 -2.03 115.95 122.71 3khu h TRP 214 Ca 0.31 -0.06 0.04 0.00 0.95 0.00 0.00 58.89 60.14 3khu h TRP 214 Cb 0.00 -0.19 -0.05 0.00 -0.86 0.00 0.00 29.16 28.06 3khu h TRP 214 CO 0.01 0.58 0.57 0.77 -1.05 0.00 0.00 178.44 179.31 3khu h SER 215 N 0.51 0.91 0.03 -3.49 0.02 -1.84 -0.68 113.55 109.02 3khu h SER 215 Ca 0.13 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3khu h SER 215 Cb 0.22 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3khu h SER 215 CO -0.01 0.62 -0.01 -1.28 -1.14 0.00 0.00 176.83 175.00 3khu h SER 216 N 1.05 -0.03 -0.53 3.07 0.87 -1.22 0.14 113.55 116.89 3khu h SER 216 Ca 0.35 -0.42 0.03 0.00 -1.23 0.00 0.00 61.79 60.52 3khu h SER 216 Cb 0.07 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 3khu h SER 216 CO -0.11 0.41 0.31 -0.33 -0.53 0.00 0.00 176.83 176.57 3khu h GLU 217 N -0.48 0.60 -0.16 2.24 5.08 -1.18 -2.87 114.58 117.80 3khu h GLU 217 Ca -0.00 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 3khu h GLU 217 Cb 0.45 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3khu h GLU 217 CO 0.01 0.40 -0.39 1.25 -1.00 0.00 0.00 179.01 179.28 3khu h LEU 218 N 0.62 0.37 -1.00 1.33 5.85 -1.08 -3.09 115.31 118.31 3khu h LEU 218 Ca 0.22 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.73 3khu h LEU 218 Cb 0.04 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 3khu h LEU 218 CO -0.10 0.73 0.09 0.28 -0.34 0.00 0.00 178.44 179.09 3khu h SER 219 N 0.30 0.76 -0.17 1.25 0.02 -0.75 0.25 113.55 115.21 3khu h SER 219 Ca 0.03 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 3khu h SER 219 Cb 0.82 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 3khu h SER 219 CO 0.07 0.78 0.08 0.50 -1.14 0.00 0.00 176.83 177.11 3khu h LYS 220 N 0.77 0.25 -0.35 3.45 1.63 -1.43 0.31 116.57 121.20 3khu h LYS 220 Ca 0.16 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.88 3khu h LYS 220 Cb 0.34 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.92 3khu h LYS 220 CO 0.01 0.28 0.03 -0.07 -3.45 0.00 0.00 179.45 176.25 3khu h LEU 221 N 0.15 0.58 -0.72 5.20 3.38 -1.58 -2.87 115.31 119.46 3khu h LEU 221 Ca 0.06 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 3khu h LEU 221 Cb 0.11 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3khu h LEU 221 CO -0.01 0.72 0.20 0.00 0.09 0.00 0.00 178.44 179.44 3khu h ALA 222 N 0.88 0.94 -0.30 1.53 0.00 -0.85 -0.58 119.26 120.89 3khu h ALA 222 Ca 0.10 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.78 3khu h ALA 222 Cb 0.40 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3khu h ALA 222 CO 0.01 0.65 0.18 0.00 0.00 0.00 0.00 179.25 180.09 3khu h ALA 223 N 1.10 0.37 -0.36 0.00 0.00 -0.88 0.70 119.26 120.19 3khu h ALA 223 Ca 0.23 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 3khu h ALA 223 Cb 0.35 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3khu h ALA 223 CO -0.00 -0.19 -0.11 -0.91 0.00 0.00 0.00 179.25 178.04 3khu h ASN 224 N 0.36 0.60 -0.77 0.00 2.35 -1.26 -1.63 115.58 115.22 3khu h ASN 224 Ca 0.12 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 3khu h ASN 224 Cb -0.01 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.16 3khu h ASN 224 CO -0.05 0.74 0.44 0.00 -1.65 0.00 0.00 177.43 176.91 3khu h ALA 225 N 1.32 0.99 -0.28 -0.83 0.00 -0.18 -0.14 119.26 120.14 3khu h ALA 225 Ca 0.10 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 3khu h ALA 225 Cb 0.52 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3khu h ALA 225 CO 0.03 0.48 -0.35 0.74 0.00 0.00 0.00 179.25 180.16 3khu h PHE 226 N 1.07 0.72 -0.18 0.00 -1.00 -0.57 0.18 116.94 117.15 3khu h PHE 226 Ca 0.27 -0.19 -0.04 0.00 2.81 0.00 0.00 57.97 60.82 3khu h PHE 226 Cb 0.01 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 39.40 3khu h PHE 226 CO -0.00 0.88 -0.04 -0.07 -1.61 0.00 0.00 178.31 177.47 3khu h LEU 227 N 0.52 0.35 -1.20 1.54 3.38 -0.97 -2.11 115.31 116.81 3khu h LEU 227 Ca 0.06 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 3khu h LEU 227 Cb 0.84 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 3khu h LEU 227 CO 0.07 0.63 0.22 0.00 0.09 0.00 0.00 178.44 179.46 3khu h ALA 228 N 0.73 1.37 -0.78 1.53 0.00 -0.95 -2.39 119.26 118.77 3khu h ALA 228 Ca 0.05 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3khu h ALA 228 Cb 0.48 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3khu h ALA 228 CO 0.02 0.47 0.30 0.37 0.00 0.00 0.00 179.25 180.41 3khu h GLN 229 N 0.77 1.17 -0.61 0.00 4.15 -0.72 -0.66 115.11 119.21 3khu h GLN 229 Ca 0.19 -0.22 0.01 0.00 0.77 0.00 0.00 58.65 59.40 3khu h GLN 229 Cb 0.14 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 3khu h GLN 229 CO -0.02 0.95 0.40 0.00 -1.93 0.00 0.00 178.83 178.24 3khu h ARG 230 N 1.14 0.79 -0.17 1.69 3.08 -0.86 0.25 114.38 120.30 3khu h ARG 230 Ca 0.26 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.23 3khu h ARG 230 Cb 0.23 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 3khu h ARG 230 CO -0.02 0.52 -0.02 0.82 -1.07 0.00 0.00 179.97 180.21 3khu h ILE 231 N 0.82 1.27 -0.30 2.04 2.04 -1.29 -1.41 117.51 120.68 3khu h ILE 231 Ca 0.23 -0.92 -0.02 0.00 1.00 0.00 0.00 64.86 65.15 3khu h ILE 231 Cb -0.08 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 3khu h ILE 231 CO -0.05 0.27 0.11 0.28 0.00 0.00 0.00 178.15 178.76 3khu h SER 232 N 0.03 0.37 -0.00 1.72 0.02 -0.85 0.19 113.55 115.03 3khu h SER 232 Ca 0.04 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3khu h SER 232 Cb 0.43 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.87 3khu h SER 232 CO 0.01 0.35 -0.00 0.28 -1.14 0.00 0.00 176.83 176.33 3khu h SER 233 N 0.42 0.00 0.44 3.07 0.02 -0.29 0.17 113.55 117.37 3khu h SER 233 Ca 0.10 -0.40 -0.10 0.00 -0.84 0.00 0.00 61.79 60.55 3khu h SER 233 Cb 0.10 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 3khu h SER 233 CO -0.01 0.41 -0.45 -0.29 -1.14 0.00 0.00 176.83 175.34 3khu h ILE 234 N -0.40 1.33 -0.75 3.27 6.09 -1.03 -1.07 117.51 124.94 3khu h ILE 234 Ca 0.00 -1.56 -0.05 0.00 -1.37 0.00 0.00 64.86 61.88 3khu h ILE 234 Cb 0.40 1.83 -0.03 0.00 0.47 0.00 0.00 36.82 39.49 3khu h ILE 234 CO 0.00 0.45 0.29 0.78 -3.07 0.00 0.00 178.15 176.60 3khu h ASN 235 N 0.02 1.04 -0.80 2.19 2.35 -0.47 -0.81 115.58 119.10 3khu h ASN 235 Ca -0.00 -0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 55.58 3khu h ASN 235 Cb 0.81 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.87 3khu h ASN 235 CO 0.06 0.93 0.48 0.77 -1.65 0.00 0.00 177.43 178.02 3khu h SER 236 N 1.10 0.96 -0.04 5.81 4.64 0.57 -1.09 113.55 125.50 3khu h SER 236 Ca 0.25 -0.06 -0.03 0.00 -0.47 0.00 0.00 61.79 61.47 3khu h SER 236 Cb 0.22 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3khu h SER 236 CO -0.02 0.74 -0.06 0.40 -0.87 0.00 0.00 176.83 177.03 3khu h ILE 237 N 1.10 1.14 -0.32 0.95 1.08 -1.02 -2.46 117.51 117.98 3khu h ILE 237 Ca 0.29 -0.58 -0.04 0.00 -0.39 0.00 0.00 64.86 64.14 3khu h ILE 237 Cb -0.04 1.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.78 3khu h ILE 237 CO -0.05 0.19 0.04 0.77 -0.69 0.00 0.00 178.15 178.40 3khu h SER 238 N 0.23 0.44 -0.34 1.72 4.64 0.17 0.30 113.55 120.70 3khu h SER 238 Ca 0.05 -0.07 -0.14 0.00 -0.47 0.00 0.00 61.79 61.16 3khu h SER 238 Cb 0.26 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 3khu h SER 238 CO 0.01 0.48 -0.32 0.00 -0.87 0.00 0.00 176.83 176.13 3khu h ALA 239 N 1.58 0.69 -0.52 5.18 0.00 -1.13 -2.44 119.26 122.62 3khu h ALA 239 Ca 0.11 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 3khu h ALA 239 Cb 0.25 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3khu h ALA 239 CO 0.00 0.67 0.02 1.25 0.00 0.00 0.00 179.25 181.19 3khu h LEU 240 N 0.73 0.83 -0.51 0.00 5.85 -1.20 -2.54 115.31 118.47 3khu h LEU 240 Ca 0.08 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 3khu h LEU 240 Cb 0.89 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 3khu h LEU 240 CO 0.08 0.88 0.26 0.00 -0.34 0.00 0.00 178.44 179.33 3khu h GLU 242 N 0.68 0.00 0.00 0.00 5.08 -1.04 -1.14 114.58 118.16 3khu h GLU 242 Ca 0.18 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 3khu h GLU 242 Cb 0.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 3khu h GLU 242 CO -0.03 0.08 -0.50 0.00 -1.00 0.00 0.00 179.01 177.56 3khu h ALA 243 N 1.92 0.76 0.00 3.43 0.00 -0.99 -3.40 119.26 120.98 3khu h ALA 243 Ca -0.00 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3khu h ALA 243 Cb 0.14 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3khu h ALA 243 CO 0.01 0.05 -1.21 0.25 0.00 0.00 0.00 179.25 178.36 3khu n THR 244 N -2.91 0.20 0.00 0.00 -2.24 -0.72 -5.03 114.28 103.58 3khu n THR 244 Ca 0.02 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 3khu n THR 244 Cb 0.56 -0.80 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 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 2.76 0.59 3.62 3.38 0.00 -0.46 -5.09 105.19 110.00 3khu n GLY 245 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.04 0.79 -0.11 4.61 0.00 -1.22 -4.85 121.76 118.93 3khu s ALA 246 Ca 0.00 0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.19 3khu s ALA 246 Cb 0.00 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 19.80 3khu s ALA 246 CO 0.00 -3.06 -0.17 0.34 0.00 0.00 0.00 175.76 172.86 3khu s ASP 247 N -2.76 2.59 0.45 0.00 2.15 -1.26 -4.46 116.67 113.37 3khu s ASP 247 Ca 0.67 -0.47 0.16 0.00 0.43 0.00 0.00 52.55 53.34 3khu s ASP 247 Cb -0.23 -1.17 1.04 0.00 -0.30 0.00 0.00 42.92 42.26 3khu s ASP 247 CO 0.60 0.05 1.98 1.62 -0.17 0.00 0.00 175.17 179.25 3khu h VAL 248 N 5.90 1.05 -0.10 1.11 3.04 -1.64 -0.82 116.25 124.80 3khu h VAL 248 Ca -0.30 -0.70 -0.20 0.00 -1.01 0.00 0.00 66.70 64.49 3khu h VAL 248 Cb 1.19 1.39 0.00 0.00 -2.01 0.00 0.00 31.29 31.86 3khu h VAL 248 CO 0.50 0.19 -0.76 -0.33 -1.01 0.00 0.00 177.57 176.16 3khu h GLU 249 N 0.00 0.52 -0.07 4.17 4.39 -1.94 0.15 114.58 121.80 3khu h GLU 249 Ca -0.00 -0.43 -0.00 0.00 0.34 0.00 0.00 59.36 59.26 3khu h GLU 249 Cb 0.37 0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.11 3khu h GLU 249 CO 0.03 1.06 0.04 0.93 -1.16 0.00 0.00 179.01 179.91 3khu h GLU 250 N 0.35 0.10 -0.44 2.33 5.08 -1.69 -1.75 114.58 118.56 3khu h GLU 250 Ca -0.04 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3khu h GLU 250 Cb 1.35 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.56 3khu h GLU 250 CO 0.14 0.11 0.17 0.28 -1.00 0.00 0.00 179.01 178.71 3khu h VAL 251 N 0.06 1.21 -0.95 3.13 2.07 -1.02 -1.53 116.25 119.22 3khu h VAL 251 Ca 0.03 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3khu h VAL 251 Cb 0.03 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 3khu h VAL 251 CO -0.00 0.24 0.61 0.00 0.02 0.00 0.00 177.57 178.43 3khu h ALA 252 N 1.02 1.28 -0.34 1.67 0.00 -0.69 -0.27 119.26 121.94 3khu h ALA 252 Ca 0.15 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3khu h ALA 252 Cb 0.21 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3khu h ALA 252 CO -0.01 0.65 -0.04 1.15 0.00 0.00 0.00 179.25 181.00 3khu h THR 253 N 1.30 1.27 -0.28 0.00 2.02 -0.90 -0.79 112.91 115.53 3khu h THR 253 Ca 0.35 -1.06 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 3khu h THR 253 Cb -0.12 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 3khu h THR 253 CO -0.07 0.35 0.10 0.00 0.37 0.00 0.00 175.52 176.26 3khu h ALA 254 N 0.83 0.36 -0.23 6.16 0.00 -0.65 -2.36 119.26 123.38 3khu h ALA 254 Ca 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3khu h ALA 254 Cb 0.52 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3khu h ALA 254 CO 0.03 -0.02 0.14 0.82 0.00 0.00 0.00 179.25 180.22 3khu h ILE 255 N 0.29 1.08 0.00 0.00 2.04 -1.06 -3.09 117.51 116.77 3khu h ILE 255 Ca 0.09 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.77 3khu h ILE 255 Cb 0.22 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 3khu h ILE 255 CO -0.00 0.08 0.00 1.23 0.00 0.00 0.00 178.15 179.45 3khu h GLY 256 N 0.29 0.00 2.00 5.37 0.00 -0.89 -1.99 103.07 107.85 3khu h GLY 256 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 3khu h GLY 256 CO -0.02 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.55 3khu n MET 257 N -2.34 0.18 -2.27 4.80 2.81 -0.91 -2.98 117.12 116.41 3khu n MET 257 Ca 0.03 0.23 -0.43 0.00 -1.81 0.00 0.00 57.70 55.72 3khu n MET 257 Cb 0.28 -1.74 -0.02 0.00 -0.71 0.00 0.00 33.22 31.02 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 -4.08 6.51 0.18 7.83 -1.08 -0.75 -4.89 116.67 120.39 3khu s ASP 258 Ca 0.09 1.40 0.18 0.00 -0.52 0.00 0.00 52.55 53.71 3khu s ASP 258 Cb 0.13 -2.54 0.81 0.00 -1.46 0.00 0.00 42.92 39.86 3khu s ASP 258 CO 0.51 -1.18 1.56 0.00 0.52 0.00 0.00 175.17 176.58 3khu n GLN 259 N 7.51 0.11 0.16 4.34 6.02 -1.26 -0.68 117.38 133.57 3khu n GLN 259 Ca 0.17 0.43 0.04 0.00 -0.01 0.00 0.00 57.00 57.63 3khu n GLN 259 Cb 0.46 -1.75 0.13 0.00 1.02 0.00 0.00 30.24 30.10 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 0.06 -1.09 3.08 -1.94 -3.32 114.38 111.18 3khu h ARG 260 Ca 0.00 0.00 -0.38 0.00 0.07 0.00 0.00 59.98 59.67 3khu h ARG 260 Cb 0.22 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 3khu h ARG 260 CO 0.00 0.45 -2.21 -0.89 -1.07 0.00 0.00 179.97 176.24 3khu n ILE 261 N -3.30 1.64 0.00 2.04 5.41 -0.27 -5.11 119.36 119.77 3khu n ILE 261 Ca 0.01 -0.60 0.00 0.00 1.00 0.00 0.00 62.75 63.16 3khu n ILE 261 Cb 0.66 -1.60 0.00 0.00 -0.71 0.00 0.00 39.64 37.99 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 2.09 -2.50 0.83 7.39 0.00 0.14 -4.82 105.19 108.32 3khu n GLY 262 Ca -0.39 -1.46 0.07 0.00 0.00 0.00 0.00 46.02 44.24 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 -2.03 3.39 -4.92 1.61 0.23 -1.16 -4.38 115.26 108.00 3khu n ASN 263 Ca 0.00 -2.29 -0.28 0.00 -0.53 0.00 0.00 54.58 51.47 3khu n ASN 263 Cb 0.00 -0.35 -0.03 0.00 -2.08 0.00 0.00 39.78 37.31 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 -1.53 3.52 -1.35 -3.83 -0.14 -1.26 -4.53 119.74 110.62 3khu s LYS 264 Ca 0.32 -0.33 -0.08 0.00 -1.36 0.00 0.00 55.97 54.52 3khu s LYS 264 Cb 0.20 -2.86 0.01 0.00 -1.68 0.00 0.00 37.83 33.50 3khu s LYS 264 CO 0.16 0.43 1.14 1.19 -0.76 0.00 0.00 175.35 177.51 3khu n PHE 265 N -0.47 -2.74 -1.81 3.18 3.72 -1.26 -4.91 117.46 113.18 3khu n PHE 265 Ca -0.05 1.00 0.06 0.00 -0.05 0.00 0.00 57.45 58.41 3khu n PHE 265 Cb 0.53 -4.97 0.14 0.00 -0.94 0.00 0.00 39.48 34.24 3khu n PHE 265 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3khu n LEU 266 N -4.86 2.02 -4.51 4.37 4.77 -1.26 -3.84 117.00 113.69 3khu n LEU 266 Ca -0.04 -3.09 -0.43 0.00 -0.03 0.00 0.00 56.01 52.43 3khu n LEU 266 Cb 0.58 -0.34 -0.06 0.00 -2.33 0.00 0.00 43.42 41.27 3khu n LEU 266 CO 0.65 0.99 0.45 -0.54 -1.33 0.00 0.00 177.39 177.61 3khu s LYS 267 N -2.09 3.28 0.61 3.23 3.01 -1.26 -4.84 119.74 121.68 3khu s LYS 267 Ca 0.34 -0.38 -0.19 0.00 -1.01 0.00 0.00 55.97 54.72 3khu s LYS 267 Cb 0.34 -3.98 -0.03 0.00 -1.01 0.00 0.00 37.83 33.15 3khu s LYS 267 CO -0.08 -1.11 1.24 0.00 0.51 0.00 0.00 175.35 175.91 3khu n ALA 268 N 6.46 1.05 -3.57 5.17 0.00 -1.26 -4.96 120.51 123.40 3khu n ALA 268 Ca -0.01 0.03 -0.08 0.00 0.00 0.00 0.00 53.44 53.38 3khu n ALA 268 Cb 0.47 -2.29 -0.03 0.00 0.00 0.00 0.00 19.45 17.60 3khu n ALA 268 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3khu s SER 269 N -1.24 -0.21 0.56 0.00 1.04 -1.26 -4.77 113.70 107.82 3khu s SER 269 Ca 0.79 -0.69 0.29 0.00 0.48 0.00 0.00 55.95 56.82 3khu s SER 269 Cb -0.40 0.66 1.64 0.00 0.10 0.00 0.00 66.02 68.02 3khu s SER 269 CO 0.44 -1.24 2.15 1.62 0.98 0.00 0.00 173.24 177.19 3khu h VAL 270 N 2.10 0.51 0.00 5.02 3.04 -1.53 -3.46 116.25 121.93 3khu h VAL 270 Ca -0.23 -0.31 0.00 0.00 -1.01 0.00 0.00 66.70 65.15 3khu h VAL 270 Cb 1.25 1.21 0.00 0.00 -2.01 0.00 0.00 31.29 31.74 3khu h VAL 270 CO 0.29 0.07 0.00 0.61 -1.01 0.00 0.00 177.57 177.52 3khu n GLY 271 N -0.92 3.95 3.77 3.17 0.00 -1.26 -2.99 105.19 110.90 3khu n GLY 271 Ca -0.02 -0.64 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.76 2.73 0.00 1.61 -0.12 -1.26 -4.51 117.98 114.67 3khu s PHE 272 Ca 0.00 1.54 0.00 0.00 -0.05 0.00 0.00 56.93 58.42 3khu s PHE 272 Cb 0.00 -3.34 0.00 0.00 -0.63 0.00 0.00 43.02 39.05 3khu s PHE 272 CO 0.00 -1.59 0.00 0.41 -0.05 0.00 0.00 175.22 173.99 3khu n GLY 273 N 0.29 5.74 0.00 1.99 0.00 -1.26 -4.68 105.19 107.28 3khu n GLY 273 Ca 0.10 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.61 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 1.29 1.45 0.04 -0.02 0.00 0.98 -4.62 105.19 104.30 3khu n GLY 274 Ca 0.00 -1.90 0.15 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.21 0.14 -0.10 1.61 3.41 -1.26 -4.27 113.62 112.94 3khu n SER 275 Ca 0.00 -0.71 -0.19 0.00 -0.26 0.00 0.00 58.87 57.71 3khu n SER 275 Cb 0.00 -0.10 -0.06 0.00 -0.26 0.00 0.00 64.21 63.79 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 -0.85 -0.56 -0.13 0.00 0.04 -1.82 -0.34 116.94 113.29 3khu h PHE 277 Ca -0.39 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.36 3khu h PHE 277 Cb 1.29 0.18 -0.01 0.00 2.20 0.00 0.00 35.95 39.62 3khu h PHE 277 CO -0.18 -0.24 0.07 0.37 -0.60 0.00 0.00 178.31 177.74 3khu h GLN 278 N -0.87 0.18 -0.44 1.51 4.15 -1.89 -0.24 115.11 117.51 3khu h GLN 278 Ca -0.06 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.40 3khu h GLN 278 Cb 0.57 -0.04 -0.05 0.00 0.21 0.00 0.00 27.48 28.17 3khu h GLN 278 CO 0.10 0.18 0.14 -0.22 -1.93 0.00 0.00 178.83 177.10 3khu h LYS 279 N 0.13 0.29 -0.26 1.69 3.64 -1.80 -0.45 116.57 119.81 3khu h LYS 279 Ca 0.05 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.29 3khu h LYS 279 Cb 0.05 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3khu h LYS 279 CO -0.01 0.19 -0.30 -0.44 -2.27 0.00 0.00 179.45 176.62 3khu h ASP 280 N 0.30 0.71 -0.58 4.20 3.32 -0.74 -1.88 116.42 121.74 3khu h ASP 280 Ca 0.21 -0.49 -0.04 0.00 0.02 0.00 0.00 57.03 56.72 3khu h ASP 280 Cb 0.22 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 3khu h ASP 280 CO -0.23 1.06 0.20 0.58 -1.72 0.00 0.00 179.24 179.14 3khu h VAL 281 N 0.38 1.24 -0.23 -1.35 2.07 -0.88 -0.04 116.25 117.43 3khu h VAL 281 Ca 0.03 -0.78 -0.05 0.00 0.82 0.00 0.00 66.70 66.73 3khu h VAL 281 Cb 0.88 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3khu h VAL 281 CO 0.07 0.30 -0.07 -0.07 0.02 0.00 0.00 177.57 177.82 3khu h LEU 282 N 0.82 0.34 -0.59 2.57 3.38 -1.08 0.11 115.31 120.86 3khu h LEU 282 Ca 0.19 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.97 3khu h LEU 282 Cb 0.25 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3khu h LEU 282 CO -0.01 0.45 -0.24 -1.13 0.09 0.00 0.00 178.44 177.61 3khu h ASN 283 N 0.34 0.89 -0.26 -0.43 -0.73 -0.78 -0.98 115.58 113.63 3khu h ASN 283 Ca 0.07 -0.34 -0.01 0.00 1.87 0.00 0.00 56.30 57.90 3khu h ASN 283 Cb 0.35 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 38.68 3khu h ASN 283 CO 0.02 1.09 0.14 0.25 -0.37 0.00 0.00 177.43 178.55 3khu h LEU 284 N 0.75 0.33 -0.70 0.34 5.85 -0.28 -0.69 115.31 120.93 3khu h LEU 284 Ca 0.10 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.77 3khu h LEU 284 Cb 0.78 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.67 3khu h LEU 284 CO 0.06 0.34 0.41 0.58 -0.34 0.00 0.00 178.44 179.49 3khu h VAL 285 N 0.30 1.01 -0.35 1.05 2.07 -0.75 -1.19 116.25 118.40 3khu h VAL 285 Ca 0.09 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 3khu h VAL 285 Cb 0.09 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 3khu h VAL 285 CO -0.01 0.14 0.09 0.22 0.02 0.00 0.00 177.57 178.03 3khu h TYR 286 N 0.76 0.58 -0.73 1.57 3.20 -0.96 -1.51 116.97 119.89 3khu h TYR 286 Ca 0.30 -0.07 0.09 0.00 3.14 0.00 0.00 58.73 62.20 3khu h TYR 286 Cb 0.14 -0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.17 3khu h TYR 286 CO -0.06 0.58 0.37 1.25 -1.64 0.00 0.00 178.16 178.66 3khu h LEU 287 N 0.41 0.50 -0.47 2.82 5.85 -0.41 -0.66 115.31 123.34 3khu h LEU 287 Ca 0.11 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3khu h LEU 287 Cb 0.29 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 3khu h LEU 287 CO -0.00 0.28 0.17 0.00 -0.34 0.00 0.00 178.44 178.55 3khu h GLU 289 N 0.62 0.88 0.00 0.00 5.08 -0.36 0.63 114.58 121.43 3khu h GLU 289 Ca 0.15 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 3khu h GLU 289 Cb 0.23 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3khu h GLU 289 CO -0.01 0.61 -0.18 0.00 -1.00 0.00 0.00 179.01 178.43 3khu h ALA 290 N 1.22 1.38 -0.53 3.43 0.00 -0.81 -2.22 119.26 121.73 3khu h ALA 290 Ca 0.24 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3khu h ALA 290 Cb -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3khu h ALA 290 CO -0.05 0.23 0.00 1.28 0.00 0.00 0.00 179.25 180.71 3khu n LEU 291 N -3.86 2.89 -3.17 0.00 4.77 -0.45 -4.94 117.00 112.24 3khu n LEU 291 Ca -0.02 -1.45 -0.19 0.00 -0.03 0.00 0.00 56.01 54.32 3khu n LEU 291 Cb 0.28 -0.36 0.07 0.00 -2.33 0.00 0.00 43.42 41.08 3khu n LEU 291 CO 0.33 0.70 0.18 0.59 -1.33 0.00 0.00 177.39 177.86 3khu n ASN 292 N 1.03 -4.68 -3.27 -1.43 3.02 -0.83 -4.96 115.26 104.13 3khu n ASN 292 Ca 0.18 -0.49 -0.27 0.00 -0.03 0.00 0.00 54.58 53.97 3khu n ASN 292 Cb 0.46 -4.47 -0.07 0.00 -0.61 0.00 0.00 39.78 35.10 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 -4.21 3.94 0.07 3.41 4.77 0.17 -4.92 117.00 120.23 3khu n LEU 293 Ca -0.07 -5.51 -0.02 0.00 -0.03 0.00 0.00 56.01 50.38 3khu n LEU 293 Cb 0.58 -0.61 0.24 0.00 -2.33 0.00 0.00 43.42 41.29 3khu n LEU 293 CO 0.55 2.15 0.70 1.55 -1.33 0.00 0.00 177.39 181.01 3khu h PRO 294 N 3.81 0.31 -0.63 3.23 0.13 -1.90 -1.75 132.00 135.19 3khu h PRO 294 Ca 0.18 -0.13 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 3khu h PRO 294 Cb 0.62 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.70 3khu h PRO 294 CO 0.83 0.61 0.34 0.93 -0.23 0.00 0.00 178.00 180.48 3khu h GLU 295 N 0.27 0.87 -0.15 0.86 3.07 -1.95 -0.68 114.58 116.86 3khu h GLU 295 Ca 0.03 -0.09 -0.10 0.00 -0.50 0.00 0.00 59.36 58.70 3khu h GLU 295 Cb 0.73 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 3khu h GLU 295 CO 0.06 0.65 -0.30 0.28 -1.40 0.00 0.00 179.01 178.30 3khu h VAL 296 N 0.88 1.36 -0.32 3.13 2.07 -1.78 -1.94 116.25 119.65 3khu h VAL 296 Ca 0.22 -1.55 0.07 0.00 0.82 0.00 0.00 66.70 66.26 3khu h VAL 296 Cb 0.03 1.99 -0.07 0.00 -1.52 0.00 0.00 31.29 31.72 3khu h VAL 296 CO -0.04 0.46 -0.13 0.00 0.02 0.00 0.00 177.57 177.89 3khu h ALA 297 N 0.56 0.14 -0.60 1.67 0.00 -1.15 -1.26 119.26 118.61 3khu h ALA 297 Ca 0.01 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3khu h ALA 297 Cb 0.89 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 3khu h ALA 297 CO 0.07 -0.51 0.17 0.00 0.00 0.00 0.00 179.25 178.98 3khu h ARG 298 N -0.07 0.92 0.00 0.00 3.08 -1.11 -0.61 114.38 116.59 3khu h ARG 298 Ca 0.16 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3khu h ARG 298 Cb 0.31 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.22 3khu h ARG 298 CO -0.37 0.80 -0.02 -0.92 -1.07 0.00 0.00 179.97 178.39 3khu h TYR 299 N 0.89 -0.05 0.00 3.04 3.20 -0.50 -3.04 116.97 120.50 3khu h TYR 299 Ca 0.20 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.94 3khu h TYR 299 Cb 0.28 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 3khu h TYR 299 CO 0.02 -0.03 -0.60 -1.49 -1.64 0.00 0.00 178.16 174.41 3khu h TRP 300 N -0.04 0.00 -0.07 -3.82 4.06 -1.06 -3.05 115.95 111.97 3khu h TRP 300 Ca 0.01 0.00 0.02 0.00 2.06 0.00 0.00 58.89 60.98 3khu h TRP 300 Cb 0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.21 3khu h TRP 300 CO -0.10 0.60 0.06 0.37 -3.56 0.00 0.00 178.44 175.82 3khu h GLN 301 N 0.00 0.00 0.00 0.49 5.75 -0.99 -0.41 115.11 119.94 3khu h GLN 301 Ca -0.01 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 3khu h GLN 301 Cb 1.16 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.71 3khu h GLN 301 CO 0.08 0.00 -0.09 1.96 -2.65 0.00 0.00 178.83 178.13 3khu h GLN 302 N 0.00 0.00 -0.46 1.69 1.08 -1.48 0.08 115.11 116.02 3khu h GLN 302 Ca 0.03 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.22 3khu h GLN 302 Cb 0.15 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.56 3khu h GLN 302 CO -0.00 0.09 0.25 0.28 -0.95 0.00 0.00 178.83 178.50 3khu h VAL 303 N 0.00 1.16 -0.02 -0.54 2.07 -1.25 -1.20 116.25 116.47 3khu h VAL 303 Ca -0.00 -0.43 -0.14 0.00 0.82 0.00 0.00 66.70 66.95 3khu h VAL 303 Cb 0.27 0.62 0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3khu h VAL 303 CO 0.01 0.17 -0.55 0.40 0.02 0.00 0.00 177.57 177.63 3khu h ILE 304 N 0.60 1.42 -0.81 4.57 1.08 -1.44 -2.59 117.51 120.34 3khu h ILE 304 Ca 0.16 -2.01 0.06 0.00 -0.39 0.00 0.00 64.86 62.69 3khu h ILE 304 Cb 0.06 2.53 -0.05 0.00 -3.07 0.00 0.00 36.82 36.28 3khu h ILE 304 CO -0.03 0.58 0.53 0.44 -0.69 0.00 0.00 178.15 178.99 3khu h ASP 305 N -0.10 0.78 -0.34 1.72 3.32 -0.99 0.10 116.42 120.92 3khu h ASP 305 Ca -0.06 0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.83 3khu h ASP 305 Cb 1.25 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.63 3khu h ASP 305 CO 0.11 0.50 -0.43 -0.03 -1.72 0.00 0.00 179.24 177.67 3khu h MET 306 N 0.89 0.91 -0.52 3.56 4.05 -1.23 -0.17 114.93 122.41 3khu h MET 306 Ca 0.35 -0.50 -0.03 0.00 -0.28 0.00 0.00 59.70 59.24 3khu h MET 306 Cb 0.23 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.04 3khu h MET 306 CO -0.12 1.15 0.20 -0.97 0.23 0.00 0.00 176.91 177.40 3khu h ASN 307 N 0.73 0.73 -0.81 1.39 -1.24 -0.91 0.26 115.58 115.72 3khu h ASN 307 Ca 0.05 -0.18 -0.04 0.00 0.71 0.00 0.00 56.30 56.85 3khu h ASN 307 Cb 1.02 -0.19 -0.04 0.00 0.73 0.00 0.00 38.32 39.85 3khu h ASN 307 CO 0.10 0.71 0.36 0.44 -1.29 0.00 0.00 177.43 177.75 3khu h ASP 308 N 0.71 1.09 -0.54 1.15 3.32 -0.63 -2.06 116.42 119.45 3khu h ASP 308 Ca 0.17 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 3khu h ASP 308 Cb 0.21 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3khu h ASP 308 CO -0.01 0.94 0.03 0.22 -1.72 0.00 0.00 179.24 178.69 3khu h TYR 309 N 1.17 1.02 -0.65 4.55 3.20 -0.57 -0.84 116.97 124.85 3khu h TYR 309 Ca 0.28 -0.17 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 3khu h TYR 309 Cb 0.16 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 3khu h TYR 309 CO 0.02 0.93 0.36 0.37 -1.64 0.00 0.00 178.16 178.20 3khu h GLN 310 N 0.83 0.90 -0.26 1.82 5.75 -0.64 0.36 115.11 123.87 3khu h GLN 310 Ca 0.16 -0.10 -0.02 0.00 -0.15 0.00 0.00 58.65 58.53 3khu h GLN 310 Cb 0.50 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 3khu h GLN 310 CO 0.02 0.67 0.07 0.00 -2.65 0.00 0.00 178.83 176.94 3khu h ARG 311 N 0.88 0.41 -0.53 1.69 3.08 -1.17 -2.65 114.38 116.08 3khu h ARG 311 Ca 0.23 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 60.12 3khu h ARG 311 Cb 0.03 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 3khu h ARG 311 CO -0.04 0.50 0.11 -0.09 -1.07 0.00 0.00 179.97 179.38 3khu h ARG 312 N 0.24 0.87 -0.05 0.04 2.43 -0.63 -1.18 114.38 116.10 3khu h ARG 312 Ca 0.08 -0.22 -0.13 0.00 -0.81 0.00 0.00 59.98 58.90 3khu h ARG 312 Cb 0.27 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 3khu h ARG 312 CO 0.00 0.84 -0.56 0.07 -1.51 0.00 0.00 179.97 178.81 3khu h ARG 313 N 0.76 0.15 -0.16 0.20 0.11 -0.99 0.12 114.38 114.57 3khu h ARG 313 Ca 0.16 -0.09 -0.01 0.00 0.10 0.00 0.00 59.98 60.14 3khu h ARG 313 Cb 0.38 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 3khu h ARG 313 CO 0.01 0.67 0.07 0.35 0.10 0.00 0.00 179.97 181.16 3khu h PHE 314 N 0.12 0.24 -0.72 4.08 3.57 -1.08 -0.66 116.94 122.49 3khu h PHE 314 Ca -0.00 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.52 3khu h PHE 314 Cb 1.02 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 39.64 3khu h PHE 314 CO 0.01 0.29 0.44 0.00 -2.23 0.00 0.00 178.31 176.83 3khu h ALA 315 N 0.92 0.96 -0.45 2.41 0.00 -0.80 -2.39 119.26 119.92 3khu h ALA 315 Ca 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3khu h ALA 315 Cb 0.15 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3khu h ALA 315 CO -0.01 0.19 0.12 0.77 0.00 0.00 0.00 179.25 180.32 3khu h SER 316 N 0.84 0.61 -0.36 0.00 0.02 -0.45 -1.50 113.55 112.71 3khu h SER 316 Ca 0.30 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 3khu h SER 316 Cb 0.08 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 3khu h SER 316 CO -0.14 0.60 0.17 0.03 -1.14 0.00 0.00 176.83 176.35 3khu h ARG 317 N 0.65 0.53 -0.32 3.45 3.08 -0.63 0.80 114.38 121.94 3khu h ARG 317 Ca 0.15 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.13 3khu h ARG 317 Cb 0.23 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 3khu h ARG 317 CO -0.00 0.49 0.17 0.82 -1.07 0.00 0.00 179.97 180.37 3khu h ILE 318 N 0.45 1.01 -0.26 2.04 2.04 -1.07 0.29 117.51 122.01 3khu h ILE 318 Ca 0.12 -0.12 -0.09 0.00 1.00 0.00 0.00 64.86 65.78 3khu h ILE 318 Cb 0.14 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 3khu h ILE 318 CO -0.01 0.06 -0.18 0.40 0.00 0.00 0.00 178.15 178.42 3khu h ILE 319 N 0.35 1.31 -0.60 -0.67 2.04 -1.05 -1.66 117.51 117.23 3khu h ILE 319 Ca 0.13 -1.30 0.02 0.00 1.00 0.00 0.00 64.86 64.70 3khu h ILE 319 Cb 0.03 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3khu h ILE 319 CO -0.08 0.41 0.38 -0.78 0.00 0.00 0.00 178.15 178.09 3khu h ASP 320 N 0.29 0.65 0.08 1.72 3.58 -0.72 0.47 116.42 122.48 3khu h ASP 320 Ca 0.05 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.46 3khu h ASP 320 Cb 0.71 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.61 3khu h ASP 320 CO 0.05 0.46 -0.11 0.28 -2.88 0.00 0.00 179.24 177.04 3khu h SER 321 N 0.77 0.07 -0.65 2.28 0.02 -0.55 -1.34 113.55 114.15 3khu h SER 321 Ca 0.23 -0.01 -0.37 0.00 -0.84 0.00 0.00 61.79 60.80 3khu h SER 321 Cb -0.03 -0.02 -0.20 0.00 0.14 0.00 0.00 62.40 62.29 3khu h SER 321 CO -0.08 0.19 0.47 0.18 -1.14 0.00 0.00 176.83 176.45 3khu n LEU 322 N -4.37 5.87 -1.11 5.07 4.77 -0.66 -4.89 117.00 121.69 3khu n LEU 322 Ca -0.02 -3.10 -0.13 0.00 -0.03 0.00 0.00 56.01 52.73 3khu n LEU 322 Cb 0.20 -0.81 -0.05 0.00 -2.33 0.00 0.00 43.42 40.43 3khu n LEU 322 CO 0.36 0.99 -0.13 0.49 -1.33 0.00 0.00 177.39 177.77 3khu n PHE 323 N -0.42 -0.12 -1.53 -1.77 0.99 -0.51 -2.56 117.46 111.54 3khu n PHE 323 Ca 0.40 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.69 3khu n PHE 323 Cb 1.07 -2.48 -0.06 0.00 -1.00 0.00 0.00 39.48 37.01 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 -0.20 -4.83 -3.80 4.37 5.15 0.12 -4.99 115.26 111.08 3khu n ASN 324 Ca -0.14 0.34 -0.17 0.00 -0.60 0.00 0.00 54.58 54.02 3khu n ASN 324 Cb 0.47 -3.71 -0.16 0.00 -0.53 0.00 0.00 39.78 35.85 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 -2.59 0.13 0.00 -0.44 -1.32 -1.06 -4.99 115.64 105.37 3khu s THR 325 Ca 0.00 0.12 0.00 0.00 -1.21 0.00 0.00 61.69 60.60 3khu s THR 325 Cb 0.00 -0.24 0.00 0.00 -1.51 0.00 0.00 72.50 70.75 3khu s THR 325 CO 0.00 0.14 0.50 0.52 -2.21 0.00 0.00 174.62 173.57 3khu n VAL 326 N 4.21 0.25 -1.67 5.08 0.31 -1.26 -4.84 118.33 120.41 3khu n VAL 326 Ca -0.25 -0.39 -0.47 0.00 -0.01 0.00 0.00 64.34 63.22 3khu n VAL 326 Cb 0.50 1.13 -0.04 0.00 -0.91 0.00 0.00 33.84 34.52 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 -0.12 0.23 -1.02 2.52 -1.04 -1.06 -1.16 114.28 112.63 3khu n THR 327 Ca 0.00 -0.04 -0.01 0.00 -2.04 0.00 0.00 64.05 61.96 3khu n THR 327 Cb 0.24 -1.64 -0.00 0.00 -1.82 0.00 0.00 70.33 67.10 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 4.67 -5.57 -4.74 8.00 8.00 0.02 -4.92 116.55 122.01 3khu n ASP 328 Ca 0.19 0.02 -0.40 0.00 0.71 0.00 0.00 54.79 55.31 3khu n ASP 328 Cb 0.29 -3.14 -0.05 0.00 -0.02 0.00 0.00 41.12 38.20 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 -1.80 4.49 -0.03 -1.24 1.02 -0.31 -4.70 119.74 117.18 3khu s LYS 329 Ca 0.00 1.06 -0.30 0.00 0.02 0.00 0.00 55.97 56.75 3khu s LYS 329 Cb 0.00 -3.38 -0.03 0.00 -0.52 0.00 0.00 37.83 33.90 3khu s LYS 329 CO 0.00 0.24 0.99 0.21 -0.92 0.00 0.00 175.35 175.87 3khu s LYS 330 N 0.11 4.52 -0.03 1.68 2.20 -1.26 -0.36 119.74 126.61 3khu s LYS 330 Ca 0.39 1.42 0.01 0.00 -0.36 0.00 0.00 55.97 57.43 3khu s LYS 330 Cb -0.20 -3.48 0.01 0.00 -1.51 0.00 0.00 37.83 32.65 3khu s LYS 330 CO 0.23 -0.12 -0.05 0.42 -0.36 0.00 0.00 175.35 175.47 3khu s ILE 331 N 1.26 0.51 -0.16 5.43 1.01 -0.04 -0.78 121.20 128.44 3khu s ILE 331 Ca 0.51 -0.17 -0.20 0.00 0.00 0.00 0.00 60.65 60.79 3khu s ILE 331 Cb -0.20 -0.50 -0.03 0.00 0.01 0.00 0.00 42.46 41.74 3khu s ILE 331 CO 0.26 0.19 0.57 0.00 0.00 0.00 0.00 174.94 175.96 3khu s ALA 332 N 0.51 3.50 -0.34 9.38 0.00 -0.58 -1.14 121.76 133.08 3khu s ALA 332 Ca -0.06 -0.24 -0.10 0.00 0.00 0.00 0.00 51.96 51.56 3khu s ALA 332 Cb -0.10 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 20.18 3khu s ALA 332 CO -0.00 -0.34 0.17 0.42 0.00 0.00 0.00 175.76 176.01 3khu s ILE 333 N 1.40 4.48 -0.45 0.00 -1.09 -0.12 -0.44 121.20 124.98 3khu s ILE 333 Ca 0.28 -0.72 -0.14 0.00 -2.23 0.00 0.00 60.65 57.83 3khu s ILE 333 Cb -0.16 -3.42 0.06 0.00 -1.58 0.00 0.00 42.46 37.37 3khu s ILE 333 CO 0.11 -0.11 0.35 -0.76 -1.23 0.00 0.00 174.94 173.31 3khu s LEU 334 N 1.56 5.42 0.00 2.97 1.43 -0.01 -1.16 118.68 128.89 3khu s LEU 334 Ca 0.03 -1.24 0.00 0.00 -1.03 0.00 0.00 54.13 51.89 3khu s LEU 334 Cb -0.18 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 43.89 3khu s LEU 334 CO 0.06 -0.58 0.00 0.61 0.23 0.00 0.00 176.35 176.67 3khu n GLY 335 N 5.15 2.21 0.00 -3.19 0.00 -0.09 -1.28 105.19 107.99 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 1.94 0.00 -1.01 1.61 7.35 -1.26 -4.28 117.46 121.81 3khu n PHE 336 Ca 0.00 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.37 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 -1.73 1.82 -0.33 3.13 0.00 -1.26 -4.56 121.76 118.83 3khu s ALA 337 Ca 0.00 0.59 0.27 0.00 0.00 0.00 0.00 51.96 52.82 3khu s ALA 337 Cb 0.00 -3.41 0.98 0.00 0.00 0.00 0.00 23.12 20.68 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 -1.31 0.00 -3.16 0.00 -5.15 -1.62 -3.44 116.94 102.25 3khu h PHE 338 Ca -0.44 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.31 3khu h PHE 338 Cb 1.27 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 37.40 3khu h PHE 338 CO 0.51 0.00 0.18 -1.59 -2.00 0.00 0.00 178.31 175.41 3khu s LYS 339 N -3.38 1.99 0.74 6.09 -2.85 -1.26 -4.48 119.74 116.59 3khu s LYS 339 Ca 0.05 -1.29 -0.11 0.00 -1.00 0.00 0.00 55.97 53.62 3khu s LYS 339 Cb 0.09 0.59 0.04 0.00 -2.06 0.00 0.00 37.83 36.49 3khu s LYS 339 CO 0.52 -0.91 1.08 -1.59 0.10 0.00 0.00 175.35 174.55 3khu s LYS 340 N -3.11 2.55 -0.97 1.78 -2.85 -1.26 -4.23 119.74 111.65 3khu s LYS 340 Ca 0.16 0.86 -0.04 0.00 -1.00 0.00 0.00 55.97 55.94 3khu s LYS 340 Cb -0.05 -1.95 0.00 0.00 -2.06 0.00 0.00 37.83 33.78 3khu s LYS 340 CO 0.10 -1.35 0.58 -0.25 0.10 0.00 0.00 175.35 174.53 3khu n ASP 341 N -3.29 -4.74 -3.59 0.03 8.00 -1.26 -5.00 116.55 106.70 3khu n ASP 341 Ca 0.07 -0.27 -0.11 0.00 0.71 0.00 0.00 54.79 55.20 3khu n ASP 341 Cb 0.54 -3.48 -0.03 0.00 -0.02 0.00 0.00 41.12 38.13 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 -3.08 0.03 -2.28 -3.53 -1.32 -1.26 -4.88 115.64 99.32 3khu s THR 342 Ca 0.29 -0.43 0.23 0.00 -1.21 0.00 0.00 61.69 60.56 3khu s THR 342 Cb -0.13 -1.25 0.05 0.00 -1.51 0.00 0.00 72.50 69.66 3khu s THR 342 CO 0.36 -0.13 1.12 0.61 -2.21 0.00 0.00 174.62 174.37 3khu n GLY 343 N -0.32 0.31 3.71 6.08 0.00 -1.26 -4.57 105.19 109.14 3khu n GLY 343 Ca -0.14 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 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 -2.30 6.90 0.00 1.61 -1.08 -1.26 -4.57 116.67 115.97 3khu s ASP 344 Ca 0.21 2.23 0.11 0.00 -0.52 0.00 0.00 52.55 54.57 3khu s ASP 344 Cb 0.18 -2.58 0.12 0.00 -1.46 0.00 0.00 42.92 39.18 3khu s ASP 344 CO 0.48 -0.60 0.91 0.35 0.52 0.00 0.00 175.17 176.83 3khu n THR 345 N 3.95 0.16 -1.68 1.71 -2.24 -1.26 -1.81 114.28 113.12 3khu n THR 345 Ca 0.11 -0.58 -0.45 0.00 -2.27 0.00 0.00 64.05 60.86 3khu n THR 345 Cb 0.44 1.11 -0.04 0.00 -2.10 0.00 0.00 70.33 69.74 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 0.59 2.50 -2.20 -0.78 1.74 -1.26 -1.09 116.66 116.15 3khu n ARG 346 Ca 0.07 0.91 -0.15 0.00 -0.77 0.00 0.00 57.85 57.91 3khu n ARG 346 Cb 0.29 -2.78 -0.02 0.00 -1.02 0.00 0.00 32.46 28.93 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 6.06 -1.87 -2.07 5.56 -0.58 -1.26 -0.02 120.64 126.46 3khu n GLU 347 Ca 0.20 0.78 -0.41 0.00 -0.42 0.00 0.00 57.16 57.31 3khu n GLU 347 Cb 0.34 -5.33 -0.02 0.00 -0.57 0.00 0.00 31.44 25.86 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 -2.10 6.72 0.51 1.62 0.15 -0.25 -3.94 113.70 116.41 3khu s SER 348 Ca 0.00 2.67 0.21 0.00 0.70 0.00 0.00 55.95 59.53 3khu s SER 348 Cb 0.00 -2.64 1.29 0.00 -1.71 0.00 0.00 66.02 62.97 3khu s SER 348 CO 0.00 -0.61 2.03 0.28 1.20 0.00 0.00 173.24 176.13 3khu h SER 349 N 4.21 0.08 -0.30 5.45 0.02 -1.83 -1.68 113.55 119.49 3khu h SER 349 Ca -0.47 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.52 3khu h SER 349 Cb 1.22 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 3khu h SER 349 CO 0.71 0.05 0.20 0.28 -1.14 0.00 0.00 176.83 176.93 3khu h SER 350 N 0.09 0.22 -0.19 3.07 0.02 -1.85 0.14 113.55 115.04 3khu h SER 350 Ca 0.20 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 3khu h SER 350 Cb 0.70 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 3khu h SER 350 CO -0.02 0.15 0.06 0.40 -1.14 0.00 0.00 176.83 176.28 3khu h ILE 351 N 0.25 1.18 -0.16 3.27 2.04 -1.58 -0.71 117.51 121.81 3khu h ILE 351 Ca 0.13 -0.57 -0.09 0.00 1.00 0.00 0.00 64.86 65.33 3khu h ILE 351 Cb 0.20 1.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3khu h ILE 351 CO -0.02 0.18 -0.25 1.88 0.00 0.00 0.00 178.15 179.94 3khu h TYR 352 N 0.13 0.55 -0.85 1.37 -1.99 -1.35 0.13 116.97 114.96 3khu h TYR 352 Ca 0.06 -0.19 -0.00 0.00 2.00 0.00 0.00 58.73 60.60 3khu h TYR 352 Cb 0.22 -0.11 -0.04 0.00 2.00 0.00 0.00 36.73 38.80 3khu h TYR 352 CO -0.00 0.87 0.52 0.82 -0.00 0.00 0.00 178.16 180.38 3khu h ILE 353 N 0.07 1.23 -0.38 -2.88 1.08 -1.04 -0.35 117.51 115.24 3khu h ILE 353 Ca 0.01 -0.49 -0.02 0.00 -0.39 0.00 0.00 64.86 63.98 3khu h ILE 353 Cb 0.82 0.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 3khu h ILE 353 CO 0.06 0.24 0.16 0.28 -0.69 0.00 0.00 178.15 178.19 3khu h SER 354 N 1.16 0.52 -0.91 1.72 0.02 -0.85 -2.46 113.55 112.75 3khu h SER 354 Ca 0.30 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3khu h SER 354 Cb -0.07 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.29 3khu h SER 354 CO -0.06 0.54 0.57 0.11 -1.14 0.00 0.00 176.83 176.86 3khu h LYS 355 N 0.47 1.22 -0.79 3.45 1.57 -0.08 0.28 116.57 122.69 3khu h LYS 355 Ca 0.13 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 3khu h LYS 355 Cb 0.18 -0.27 -0.04 0.00 0.08 0.00 0.00 32.23 32.18 3khu h LYS 355 CO -0.01 0.84 0.52 1.88 -0.57 0.00 0.00 179.45 182.11 3khu h TYR 356 N 1.25 0.98 -0.11 -1.35 0.99 -0.79 -0.88 116.97 117.05 3khu h TYR 356 Ca 0.33 0.02 -0.21 0.00 2.00 0.00 0.00 58.73 60.87 3khu h TYR 356 Cb -0.09 -0.33 0.01 0.00 1.00 0.00 0.00 36.73 37.32 3khu h TYR 356 CO 0.00 0.61 -0.75 -0.07 -0.00 0.00 0.00 178.16 177.95 3khu h LEU 357 N 1.05 0.85 -0.97 3.88 3.38 -0.85 -3.09 115.31 119.56 3khu h LEU 357 Ca 0.29 -0.65 0.07 0.00 0.09 0.00 0.00 57.88 57.68 3khu h LEU 357 Cb -0.09 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.34 3khu h LEU 357 CO -0.07 1.37 0.62 0.24 0.09 0.00 0.00 178.44 180.70 3khu h MET 358 N 0.39 1.07 -0.09 1.13 2.86 -0.69 0.07 114.93 119.67 3khu h MET 358 Ca -0.06 -0.06 0.03 0.00 -2.06 0.00 0.00 59.70 57.54 3khu h MET 358 Cb 1.39 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 32.80 3khu h MET 358 CO 0.15 0.71 0.12 -0.44 1.06 0.00 0.00 176.91 178.52 3khu h ASP 359 N 1.11 0.00 0.03 1.22 3.32 -1.08 0.16 116.42 121.18 3khu h ASP 359 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 3khu h ASP 359 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3khu h ASP 359 CO -0.19 0.00 -0.08 -0.62 -1.72 0.00 0.00 179.24 176.63 3khu n GLU 360 N -3.65 1.60 -1.08 3.56 -0.58 -0.04 -4.97 120.64 115.50 3khu n GLU 360 Ca -0.01 -1.07 0.00 0.00 -0.42 0.00 0.00 57.16 55.67 3khu n GLU 360 Cb 0.22 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 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 1.26 0.43 3.77 0.62 0.00 0.57 -2.56 105.19 109.28 3khu n GLY 361 Ca 0.16 -1.00 -0.35 0.00 0.00 0.00 0.00 46.02 44.83 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 2.64 -0.55 4.61 0.00 -0.92 -0.80 121.76 124.74 3khu s ALA 362 Ca 0.00 0.84 -0.18 0.00 0.00 0.00 0.00 51.96 52.62 3khu s ALA 362 Cb 0.00 -3.38 0.10 0.00 0.00 0.00 0.00 23.12 19.84 3khu s ALA 362 CO 0.00 -0.90 0.61 -1.01 0.00 0.00 0.00 175.76 174.46 3khu s HIS 363 N -1.78 3.08 0.02 0.00 3.76 0.51 -4.70 115.29 116.17 3khu s HIS 363 Ca 0.73 -0.94 -0.22 0.00 -0.15 0.00 0.00 55.06 54.48 3khu s HIS 363 Cb -0.25 -3.79 -0.05 0.00 1.11 0.00 0.00 32.58 29.60 3khu s HIS 363 CO 0.29 -1.13 0.66 -0.51 -0.85 0.00 0.00 174.74 173.20 3khu s LEU 364 N 2.34 4.43 -0.25 0.89 1.43 0.24 -0.86 118.68 126.91 3khu s LEU 364 Ca 0.10 1.28 0.01 0.00 -1.03 0.00 0.00 54.13 54.49 3khu s LEU 364 Cb -0.24 -3.05 0.05 0.00 0.03 0.00 0.00 46.19 42.98 3khu s LEU 364 CO 0.07 0.07 -0.10 -1.00 0.23 0.00 0.00 176.35 175.62 3khu s HIS 365 N -0.18 3.16 -0.18 0.29 3.76 -0.30 -0.59 115.29 121.26 3khu s HIS 365 Ca 0.34 -2.05 -0.05 0.00 -0.15 0.00 0.00 55.06 53.15 3khu s HIS 365 Cb -0.19 -1.97 -0.03 0.00 1.11 0.00 0.00 32.58 31.50 3khu s HIS 365 CO 0.20 -0.84 0.00 0.42 -0.85 0.00 0.00 174.74 173.67 3khu s ILE 366 N 1.18 4.15 -0.08 0.60 1.01 -0.16 -0.95 121.20 126.95 3khu s ILE 366 Ca -0.05 -0.26 0.03 0.00 0.00 0.00 0.00 60.65 60.37 3khu s ILE 366 Cb -0.18 -2.86 0.01 0.00 0.01 0.00 0.00 42.46 39.44 3khu s ILE 366 CO -0.06 0.46 -0.18 -0.47 0.00 0.00 0.00 174.94 174.69 3khu s TYR 367 N 0.64 2.00 -0.05 3.97 5.04 -0.31 -0.65 117.35 127.98 3khu s TYR 367 Ca -0.00 -0.79 -0.04 0.00 -2.44 0.00 0.00 57.07 53.80 3khu s TYR 367 Cb -0.14 -1.39 0.02 0.00 0.35 0.00 0.00 41.96 40.81 3khu s TYR 367 CO 0.02 -0.35 0.13 0.34 -1.34 0.00 0.00 175.55 174.35 3khu s ASP 368 N 0.51 -0.11 0.12 4.32 -1.08 -1.26 -0.91 116.67 118.25 3khu s ASP 368 Ca -0.17 0.26 0.22 0.00 -0.52 0.00 0.00 52.55 52.34 3khu s ASP 368 Cb -0.17 0.22 0.87 0.00 -1.46 0.00 0.00 42.92 42.37 3khu s ASP 368 CO 0.06 -0.08 1.67 -0.81 0.52 0.00 0.00 175.17 176.52 3khu n PRO 369 N 3.49 0.11 0.00 4.34 -0.04 -1.26 -4.13 135.00 137.51 3khu n PRO 369 Ca -0.18 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 3khu n PRO 369 Cb 0.56 -1.68 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.87 1.90 -2.10 0.54 3.00 -1.26 -5.05 118.16 113.31 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 0.25 -0.72 -0.03 0.00 0.00 0.00 0.00 35.03 34.53 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 -1.39 3.20 0.39 3.15 1.01 -1.26 -4.70 120.40 120.81 3khu s VAL 371 Ca 0.00 0.81 -0.26 0.00 0.00 0.00 0.00 61.98 62.54 3khu s VAL 371 Cb 0.00 -3.52 -0.09 0.00 0.00 0.00 0.00 36.38 32.77 3khu s VAL 371 CO 0.00 0.05 1.19 -2.84 0.00 0.00 0.00 175.10 173.49 3khu s PRO 372 N 1.48 4.08 0.44 2.72 0.02 -1.26 -4.84 135.00 137.64 3khu s PRO 372 Ca 0.67 1.89 0.10 0.00 0.02 0.00 0.00 61.00 63.68 3khu s PRO 372 Cb -0.38 -2.72 0.99 0.00 0.02 0.00 0.00 34.50 32.41 3khu s PRO 372 CO 0.30 -0.31 2.08 0.07 -0.33 0.00 0.00 177.00 178.81 3khu h ARG 373 N 2.72 0.34 0.00 5.54 0.11 -1.97 -1.61 114.38 119.51 3khu h ARG 373 Ca -0.49 -0.02 -0.09 0.00 0.10 0.00 0.00 59.98 59.48 3khu h ARG 373 Cb 1.23 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 32.23 3khu h ARG 373 CO 0.63 0.24 -0.43 0.93 0.10 0.00 0.00 179.97 181.44 3khu h GLU 374 N 0.34 0.00 -0.28 0.08 3.07 -2.00 -2.22 114.58 113.57 3khu h GLU 374 Ca 0.09 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.78 3khu h GLU 374 Cb -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3khu h GLU 374 CO -0.02 0.43 -0.51 0.37 -1.40 0.00 0.00 179.01 177.89 3khu h GLN 375 N 0.00 0.80 -0.70 2.33 5.75 -1.68 -2.08 115.11 119.53 3khu h GLN 375 Ca -0.00 -0.48 -0.01 0.00 -0.15 0.00 0.00 58.65 58.00 3khu h GLN 375 Cb 0.77 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.33 3khu h GLN 375 CO 0.06 1.11 0.38 0.82 -2.65 0.00 0.00 178.83 178.55 3khu h ILE 376 N 0.63 1.22 -0.48 2.39 2.04 -1.33 0.57 117.51 122.55 3khu h ILE 376 Ca 0.02 -0.55 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 3khu h ILE 376 Cb 1.09 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 3khu h ILE 376 CO 0.11 0.24 0.15 0.58 0.00 0.00 0.00 178.15 179.23 3khu h VAL 377 N 0.96 1.22 -0.44 1.67 2.07 -1.36 -2.09 116.25 118.29 3khu h VAL 377 Ca 0.25 -0.75 -0.06 0.00 0.82 0.00 0.00 66.70 66.96 3khu h VAL 377 Cb 0.05 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 3khu h VAL 377 CO -0.04 0.27 0.05 0.58 0.02 0.00 0.00 177.57 178.45 3khu h VAL 378 N 0.63 1.25 -0.54 2.57 2.07 -0.99 -2.66 116.25 118.58 3khu h VAL 378 Ca 0.15 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 3khu h VAL 378 Cb 0.26 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 3khu h VAL 378 CO -0.01 0.33 0.25 0.44 0.02 0.00 0.00 177.57 178.60 3khu h ASP 379 N 0.59 0.68 -0.06 0.57 3.32 -0.68 -2.32 116.42 118.53 3khu h ASP 379 Ca 0.13 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3khu h ASP 379 Cb 0.41 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.79 3khu h ASP 379 CO 0.01 0.59 0.00 0.18 -1.72 0.00 0.00 179.24 178.31 3khu n LEU 380 N -4.36 1.82 -4.91 1.55 4.77 -0.81 -4.94 117.00 110.12 3khu n LEU 380 Ca 0.05 -0.65 -0.28 0.00 -0.03 0.00 0.00 56.01 55.10 3khu n LEU 380 Cb 0.13 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 3khu n LEU 380 CO 0.38 0.32 0.11 -0.44 -1.33 0.00 0.00 177.39 176.43 3khu s SER 381 N -1.90 6.43 0.14 -1.43 0.01 -0.88 -4.74 113.70 111.33 3khu s SER 381 Ca 0.36 0.57 -0.30 0.00 1.31 0.00 0.00 55.95 57.88 3khu s SER 381 Cb 0.20 -2.08 -0.07 0.00 0.21 0.00 0.00 66.02 64.28 3khu s SER 381 CO 0.32 -0.10 1.09 -1.00 0.41 0.00 0.00 173.24 173.96 3khu s HIS 382 N -1.94 3.60 0.22 2.43 3.76 -1.26 -4.94 115.29 117.16 3khu s HIS 382 Ca 0.41 1.59 -0.30 0.00 -0.15 0.00 0.00 55.06 56.61 3khu s HIS 382 Cb -0.11 -3.26 -0.15 0.00 1.11 0.00 0.00 32.58 30.17 3khu s HIS 382 CO 0.29 -0.57 0.97 -2.30 -0.85 0.00 0.00 174.74 172.27 3khu n PRO 383 N 2.73 0.96 0.00 8.40 -0.01 -1.26 -0.75 135.00 145.07 3khu n PRO 383 Ca 0.04 0.34 0.00 0.00 -0.01 0.00 0.00 63.50 63.87 3khu n PRO 383 Cb 0.47 -1.68 0.00 0.00 -0.01 0.00 0.00 33.50 32.27 3khu n PRO 383 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3khu n GLY 384 N 1.66 0.71 3.37 -1.23 0.00 -1.26 -4.92 105.19 103.51 3khu n GLY 384 Ca 0.14 -0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.58 3khu n GLY 384 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3khu n VAL 385 N 0.00 0.08 0.01 1.61 3.14 0.07 -4.85 118.33 118.39 3khu n VAL 385 Ca 0.00 -0.09 -0.16 0.00 -2.96 0.00 0.00 64.34 61.13 3khu n VAL 385 Cb 0.00 -0.91 -0.14 0.00 -1.06 0.00 0.00 33.84 31.73 3khu n VAL 385 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 3khu h SER 386 N 9.76 0.28 -1.04 6.55 0.02 -1.91 -3.36 113.55 123.85 3khu h SER 386 Ca -0.19 -0.56 -0.63 0.00 -0.84 0.00 0.00 61.79 59.57 3khu h SER 386 Cb 1.38 -0.09 -0.35 0.00 0.14 0.00 0.00 62.40 63.48 3khu h SER 386 CO 1.05 1.49 0.14 -1.84 -1.14 0.00 0.00 176.83 176.54 3khu n GLU 387 N -3.33 3.10 -1.50 3.45 -0.00 -1.26 -5.08 120.64 116.02 3khu n GLU 387 Ca -0.24 -3.73 -0.53 0.00 -0.00 0.00 0.00 57.16 52.67 3khu n GLU 387 Cb 1.05 -2.28 -0.05 0.00 -0.00 0.00 0.00 31.44 30.15 3khu n GLU 387 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3khu n ASP 388 N -0.77 0.09 -0.02 -1.84 2.03 -1.26 -4.89 116.55 109.89 3khu n ASP 388 Ca 0.53 1.15 -0.16 0.00 0.52 0.00 0.00 54.79 56.82 3khu n ASP 388 Cb 0.74 -1.02 -0.13 0.00 -0.72 0.00 0.00 41.12 39.98 3khu n ASP 388 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 3khu h ASP 389 N 2.58 0.23 -0.12 1.67 3.58 -1.98 -2.81 116.42 119.58 3khu h ASP 389 Ca -0.42 -0.92 0.04 0.00 0.42 0.00 0.00 57.03 56.16 3khu h ASP 389 Cb 1.40 -0.07 -0.05 0.00 1.72 0.00 0.00 39.33 42.33 3khu h ASP 389 CO 0.65 1.12 -0.21 1.56 -2.88 0.00 0.00 179.24 179.47 3khu h GLN 390 N -0.63 -0.27 -0.67 0.28 4.20 -1.97 -0.51 115.11 115.55 3khu h GLN 390 Ca -0.06 0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.72 3khu h GLN 390 Cb 1.22 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 29.01 3khu h GLN 390 CO 0.07 -0.18 0.38 0.28 -0.67 0.00 0.00 178.83 178.71 3khu h VAL 391 N -0.28 1.00 -0.18 -0.54 2.07 -1.85 0.12 116.25 116.60 3khu h VAL 391 Ca 0.10 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3khu h VAL 391 Cb 0.42 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3khu h VAL 391 CO -0.28 0.13 0.08 -1.28 0.02 0.00 0.00 177.57 176.24 3khu h SER 392 N 0.72 0.25 -0.60 0.57 0.87 -1.20 -0.48 113.55 113.68 3khu h SER 392 Ca 0.29 -0.15 -0.08 0.00 -1.23 0.00 0.00 61.79 60.62 3khu h SER 392 Cb 0.14 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 3khu h SER 392 CO -0.16 0.33 0.09 0.03 -0.53 0.00 0.00 176.83 176.59 3khu h ARG 393 N 0.15 1.03 0.00 2.24 3.08 -0.70 -3.39 114.38 116.79 3khu h ARG 393 Ca 0.06 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.84 3khu h ARG 393 Cb 0.16 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3khu h ARG 393 CO -0.01 0.95 -1.05 1.28 -1.07 0.00 0.00 179.97 180.07 3khu n LEU 394 N -4.22 0.09 -4.32 3.04 4.77 0.40 -4.99 117.00 111.76 3khu n LEU 394 Ca 0.04 -0.14 -0.34 0.00 -0.03 0.00 0.00 56.01 55.55 3khu n LEU 394 Cb 0.29 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.23 3khu n LEU 394 CO 0.42 0.02 -0.43 -0.69 -1.33 0.00 0.00 177.39 175.38 3khu s VAL 395 N -2.26 3.07 -0.08 4.08 1.01 -0.20 -0.59 120.40 125.43 3khu s VAL 395 Ca -0.01 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.38 3khu s VAL 395 Cb 0.05 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 3khu s VAL 395 CO 0.29 0.49 -0.21 -0.89 0.00 0.00 0.00 175.10 174.79 3khu s THR 396 N 0.86 2.43 -0.30 3.92 2.01 0.24 -4.77 115.64 120.04 3khu s THR 396 Ca -0.03 -0.91 -0.14 0.00 0.31 0.00 0.00 61.69 60.91 3khu s THR 396 Cb -0.15 -1.94 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 3khu s THR 396 CO 0.00 0.56 0.32 -0.63 -0.69 0.00 0.00 174.62 174.19 3khu s ILE 397 N -0.03 5.21 0.25 1.82 -1.09 -1.26 -0.99 121.20 125.10 3khu s ILE 397 Ca -0.06 0.24 -0.14 0.00 -2.23 0.00 0.00 60.65 58.46 3khu s ILE 397 Cb -0.15 -3.71 -0.08 0.00 -1.58 0.00 0.00 42.46 36.94 3khu s ILE 397 CO 0.05 0.07 0.64 -0.44 -1.23 0.00 0.00 174.94 174.02 3khu s SER 398 N 1.71 6.77 0.16 3.58 0.01 0.17 -4.90 113.70 121.20 3khu s SER 398 Ca 0.12 1.14 0.24 0.00 1.31 0.00 0.00 55.95 58.75 3khu s SER 398 Cb -0.16 -2.31 0.24 0.00 0.21 0.00 0.00 66.02 63.99 3khu s SER 398 CO 0.11 -0.07 1.25 0.07 0.41 0.00 0.00 173.24 175.01 3khu h LYS 399 N 2.75 0.00 -3.42 12.44 -0.00 -1.98 -3.42 116.57 122.94 3khu h LYS 399 Ca -0.48 0.00 -0.05 0.00 -0.00 0.00 0.00 60.65 60.12 3khu h LYS 399 Cb 1.18 0.00 -0.13 0.00 -0.00 0.00 0.00 32.23 33.28 3khu h LYS 399 CO 0.67 0.00 -0.08 0.16 -0.00 0.00 0.00 179.45 180.19 3khu s ASP 400 N -4.68 -0.21 0.45 7.07 1.47 -1.26 -5.05 116.67 114.45 3khu s ASP 400 Ca 0.04 -0.37 0.22 0.00 1.18 0.00 0.00 52.55 53.63 3khu s ASP 400 Cb 0.12 0.48 1.05 0.00 -0.34 0.00 0.00 42.92 44.22 3khu s ASP 400 CO 0.74 -0.87 1.91 -0.65 0.68 0.00 0.00 175.17 176.98 3khu h PRO 401 N 2.37 0.00 -0.15 2.11 0.11 -1.96 -2.77 132.00 131.71 3khu h PRO 401 Ca -0.33 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.57 3khu h PRO 401 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3khu h PRO 401 CO 0.46 0.24 -0.71 1.88 -0.21 0.00 0.00 178.00 179.66 3khu h TYR 402 N 0.00 0.88 -0.76 0.65 0.05 -1.98 -1.57 116.97 114.23 3khu h TYR 402 Ca -0.00 -0.37 0.05 0.00 0.05 0.00 0.00 58.73 58.46 3khu h TYR 402 Cb 0.60 -0.14 -0.06 0.00 1.01 0.00 0.00 36.73 38.14 3khu h TYR 402 CO 0.00 1.17 0.46 0.93 -1.05 0.00 0.00 178.16 179.67 3khu h GLU 403 N 0.46 0.83 -0.90 4.88 5.08 -1.90 -1.61 114.58 121.42 3khu h GLU 403 Ca -0.03 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 3khu h GLU 403 Cb 1.32 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 30.34 3khu h GLU 403 CO 0.14 0.55 0.51 0.00 -1.00 0.00 0.00 179.01 179.21 3khu h ALA 404 N 1.36 1.20 0.00 3.43 0.00 -1.24 -2.95 119.26 121.06 3khu h ALA 404 Ca 0.33 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3khu h ALA 404 Cb 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3khu h ALA 404 CO -0.16 0.65 -0.50 0.00 0.00 0.00 0.00 179.25 179.25 3khu s ASP 406 N -3.34 6.28 -0.37 0.00 -1.08 -0.63 -1.40 116.67 116.14 3khu s ASP 406 Ca 0.10 1.78 0.00 0.00 -0.52 0.00 0.00 52.55 53.91 3khu s ASP 406 Cb 0.16 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 39.10 3khu s ASP 406 CO 0.69 -1.31 0.00 0.61 0.52 0.00 0.00 175.17 175.68 3khu n GLY 407 N 4.77 0.64 3.84 2.66 0.00 0.49 -5.01 105.19 112.59 3khu n GLY 407 Ca 0.20 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.04 3.23 0.05 4.61 0.00 -0.49 -4.45 121.76 122.67 3khu s ALA 408 Ca 0.00 0.14 0.04 0.00 0.00 0.00 0.00 51.96 52.14 3khu s ALA 408 Cb 0.00 -2.89 -0.24 0.00 0.00 0.00 0.00 23.12 19.99 3khu s ALA 408 CO 0.00 0.24 1.01 0.45 0.00 0.00 0.00 175.76 177.47 3khu h HIS 409 N 2.07 0.17 -3.37 0.00 3.86 -1.24 -1.92 115.15 114.73 3khu h HIS 409 Ca -0.48 -0.13 -0.14 0.00 -1.16 0.00 0.00 60.37 58.47 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 1.13 -0.43 0.00 0.86 0.00 0.00 177.93 180.12 3khu s ALA 410 N -2.65 -0.46 -0.19 2.45 0.00 -1.26 -2.15 121.76 117.50 3khu s ALA 410 Ca -0.04 0.01 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 3khu s ALA 410 Cb 0.08 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.30 3khu s ALA 410 CO 0.84 -0.22 -0.12 0.08 0.00 0.00 0.00 175.76 176.33 3khu s VAL 411 N -1.35 2.77 -0.31 0.00 1.01 0.39 -1.53 120.40 121.37 3khu s VAL 411 Ca -0.14 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.11 3khu s VAL 411 Cb -0.07 -2.21 0.06 0.00 0.00 0.00 0.00 36.38 34.16 3khu s VAL 411 CO 0.02 0.49 0.01 -0.69 0.00 0.00 0.00 175.10 174.93 3khu s VAL 412 N 1.21 2.94 -0.30 2.92 1.01 0.41 -0.19 120.40 128.40 3khu s VAL 412 Ca 0.02 -1.50 -0.18 0.00 0.00 0.00 0.00 61.98 60.33 3khu s VAL 412 Cb -0.14 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.48 3khu s VAL 412 CO -0.05 -0.17 0.52 -0.63 0.00 0.00 0.00 175.10 174.76 3khu s ILE 413 N 1.22 5.04 -0.08 2.22 1.01 0.02 -0.83 121.20 129.81 3khu s ILE 413 Ca -0.04 0.65 0.06 0.00 0.00 0.00 0.00 60.65 61.33 3khu s ILE 413 Cb -0.20 -3.89 -0.09 0.00 0.01 0.00 0.00 42.46 38.30 3khu s ILE 413 CO -0.02 -0.05 0.16 0.00 0.00 0.00 0.00 174.94 175.04 3khu s THR 415 N -2.22 1.09 -0.05 0.00 2.01 -1.22 -4.75 115.64 110.51 3khu s THR 415 Ca -0.01 -0.55 -0.00 0.00 0.31 0.00 0.00 61.69 61.44 3khu s THR 415 Cb 0.04 -0.93 0.04 0.00 0.01 0.00 0.00 72.50 71.66 3khu s THR 415 CO 0.25 0.32 1.80 -1.84 -0.69 0.00 0.00 174.62 174.46 3khu n GLU 416 N 3.04 1.13 -1.72 4.92 0.00 -1.26 -4.69 120.64 122.05 3khu n GLU 416 Ca -0.17 -0.26 -0.42 0.00 0.00 0.00 0.00 57.16 56.31 3khu n GLU 416 Cb 0.54 -1.10 -0.03 0.00 0.00 0.00 0.00 31.44 30.85 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 1.10 2.73 0.08 -1.84 7.02 -1.26 -4.81 117.44 120.46 3khu n TRP 417 Ca 0.05 0.13 0.13 0.00 -1.02 0.00 0.00 57.50 56.79 3khu n TRP 417 Cb 0.53 -2.64 0.63 0.00 -2.42 0.00 0.00 31.31 27.41 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 6.09 0.09 0.20 -0.99 3.32 -2.01 -2.14 116.42 120.97 3khu h ASP 418 Ca -0.44 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 3khu h ASP 418 Cb 1.21 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 3khu h ASP 418 CO 0.90 0.05 -0.06 0.00 -1.72 0.00 0.00 179.24 178.42 3khu h MET 419 N 0.10 0.00 0.00 3.56 -0.00 -1.99 -2.86 114.93 113.74 3khu h MET 419 Ca 0.16 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.81 3khu h MET 419 Cb 0.49 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.09 3khu h MET 419 CO -0.02 0.06 -0.22 0.74 -0.00 0.00 0.00 176.91 177.47 3khu h PHE 420 N 0.00 0.00 0.00 -0.10 0.04 -1.76 -2.08 116.94 113.05 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 0.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.32 3khu h PHE 420 CO 0.00 0.22 0.00 0.36 -0.60 0.00 0.00 178.31 178.29 3khu n LYS 421 N -3.72 0.22 0.00 1.51 2.85 -1.08 -3.53 118.16 114.42 3khu n LYS 421 Ca -0.01 0.24 0.12 0.00 -1.05 0.00 0.00 58.31 57.61 3khu n LYS 421 Cb 0.33 -1.79 0.19 0.00 -0.65 0.00 0.00 35.03 33.11 3khu n LYS 421 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3khu n GLU 422 N -2.19 1.42 -1.48 -1.58 -0.58 -0.79 -4.98 120.64 110.46 3khu n GLU 422 Ca 0.05 -1.07 -0.34 0.00 -0.42 0.00 0.00 57.16 55.38 3khu n GLU 422 Cb 0.38 -1.48 0.09 0.00 -0.57 0.00 0.00 31.44 29.86 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 -2.31 3.32 -0.97 -4.62 1.43 -1.19 -4.91 118.68 109.42 3khu s LEU 423 Ca 0.25 2.28 -0.22 0.00 -1.03 0.00 0.00 54.13 55.40 3khu s LEU 423 Cb 0.19 -4.58 0.07 0.00 0.03 0.00 0.00 46.19 41.90 3khu s LEU 423 CO 0.47 -2.15 1.34 -0.62 0.23 0.00 0.00 176.35 175.62 3khu s ASP 424 N -2.16 6.51 0.36 2.29 2.15 -1.26 -4.84 116.67 119.72 3khu s ASP 424 Ca 0.73 -1.57 0.18 0.00 0.43 0.00 0.00 52.55 52.32 3khu s ASP 424 Cb -0.27 -2.52 0.62 0.00 -0.30 0.00 0.00 42.92 40.45 3khu s ASP 424 CO 0.45 -1.40 1.71 1.88 -0.17 0.00 0.00 175.17 177.64 3khu h TYR 425 N 9.53 0.00 -0.41 -5.34 -1.99 -1.97 -2.36 116.97 114.43 3khu h TYR 425 Ca 0.16 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.86 3khu h TYR 425 Cb 1.02 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.73 3khu h TYR 425 CO 1.23 0.41 0.17 1.49 -0.00 0.00 0.00 178.16 181.46 3khu h GLU 426 N 0.00 0.62 -0.39 4.88 4.81 -1.99 0.32 114.58 122.82 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 0.94 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 3khu h GLU 426 CO 0.05 0.57 0.21 -0.09 -0.73 0.00 0.00 179.01 179.02 3khu h ARG 427 N 0.52 0.55 -0.38 1.92 2.43 -1.93 -2.68 114.38 114.81 3khu h ARG 427 Ca 0.14 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3khu h ARG 427 Cb 0.18 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 3khu h ARG 427 CO -0.01 0.46 0.25 0.82 -1.51 0.00 0.00 179.97 179.98 3khu h ILE 428 N 0.50 1.10 -0.38 1.20 2.04 -1.14 -2.92 117.51 117.91 3khu h ILE 428 Ca 0.14 -0.18 0.07 0.00 1.00 0.00 0.00 64.86 65.88 3khu h ILE 428 Cb 0.08 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 36.63 3khu h ILE 428 CO -0.02 0.09 0.03 -0.74 0.00 0.00 0.00 178.15 177.51 3khu h HIS 429 N 0.52 0.03 -0.93 1.37 2.76 -0.82 -2.48 115.15 115.61 3khu h HIS 429 Ca 0.14 0.03 0.20 0.00 -2.20 0.00 0.00 60.37 58.53 3khu h HIS 429 Cb -0.06 0.04 -0.11 0.00 1.55 0.00 0.00 27.41 28.83 3khu h HIS 429 CO -0.05 -0.04 0.49 0.87 -1.30 0.00 0.00 177.93 177.90 3khu h LYS 430 N 0.14 0.57 -0.42 5.26 1.57 -1.28 -2.18 116.57 120.23 3khu h LYS 430 Ca 0.19 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3khu h LYS 430 Cb 0.25 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.43 3khu h LYS 430 CO -0.29 0.37 0.00 1.63 -0.57 0.00 0.00 179.45 180.60 3khu n LYS 431 N -4.90 2.50 -2.83 3.15 5.02 -0.98 -4.92 118.16 115.19 3khu n LYS 431 Ca 0.22 -2.31 -0.32 0.00 -2.02 0.00 0.00 58.31 53.88 3khu n LYS 431 Cb 0.59 -1.51 -0.05 0.00 -0.02 0.00 0.00 35.03 34.04 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 -1.40 3.98 0.60 1.97 -1.94 -0.82 -0.38 119.30 121.32 3khu s MET 432 Ca 0.39 0.78 -0.17 0.00 -1.71 0.00 0.00 55.69 54.98 3khu s MET 432 Cb 0.22 -2.30 -0.03 0.00 2.01 0.00 0.00 34.83 34.73 3khu s MET 432 CO 0.31 -0.03 1.10 -0.51 -0.01 0.00 0.00 175.02 175.88 3khu s LEU 433 N -3.48 3.55 -0.01 -0.03 1.43 -0.72 -4.90 118.68 114.51 3khu s LEU 433 Ca 0.56 2.02 0.07 0.00 -1.03 0.00 0.00 54.13 55.75 3khu s LEU 433 Cb -0.10 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.54 3khu s LEU 433 CO 0.23 -1.36 -0.24 -0.54 0.23 0.00 0.00 176.35 174.67 3khu s LYS 434 N -3.79 2.12 0.39 1.70 -0.14 -1.26 -3.28 119.74 115.48 3khu s LYS 434 Ca 0.68 -0.93 -0.26 0.00 -1.36 0.00 0.00 55.97 54.10 3khu s LYS 434 Cb -0.20 -2.09 -0.09 0.00 -1.68 0.00 0.00 37.83 33.77 3khu s LYS 434 CO 0.35 0.56 1.23 -1.25 -0.76 0.00 0.00 175.35 175.47 3khu s PRO 435 N -0.78 4.08 -0.21 -1.68 0.04 -1.26 -5.16 135.00 130.02 3khu s PRO 435 Ca 0.11 1.98 -0.10 0.00 0.04 0.00 0.00 61.00 63.04 3khu s PRO 435 Cb -0.10 -2.77 -0.05 0.00 0.04 0.00 0.00 34.50 31.63 3khu s PRO 435 CO 0.00 -0.35 0.13 0.00 0.04 0.00 0.00 177.00 176.82 3khu s ALA 436 N -1.32 3.59 0.01 8.56 0.00 -1.21 -4.87 121.76 126.53 3khu s ALA 436 Ca 0.56 -0.79 0.06 0.00 0.00 0.00 0.00 51.96 51.79 3khu s ALA 436 Cb -0.34 -2.18 -0.03 0.00 0.00 0.00 0.00 23.12 20.57 3khu s ALA 436 CO 0.44 0.01 -0.17 -0.06 0.00 0.00 0.00 175.76 175.98 3khu s PHE 437 N 0.66 2.60 -0.13 0.00 0.40 -0.91 -1.55 117.98 119.04 3khu s PHE 437 Ca 0.07 -0.23 0.03 0.00 -0.60 0.00 0.00 56.93 56.19 3khu s PHE 437 Cb -0.12 -1.51 0.01 0.00 0.51 0.00 0.00 43.02 41.90 3khu s PHE 437 CO 0.01 0.22 -0.22 0.42 0.70 0.00 0.00 175.22 176.35 3khu s ILE 438 N -0.86 2.04 -0.28 0.64 1.01 -0.24 -0.46 121.20 123.05 3khu s ILE 438 Ca 0.14 -0.98 -0.02 0.00 0.00 0.00 0.00 60.65 59.78 3khu s ILE 438 Cb -0.11 -1.79 0.04 0.00 0.01 0.00 0.00 42.46 40.61 3khu s ILE 438 CO 0.04 0.55 -0.01 -0.36 0.00 0.00 0.00 174.94 175.16 3khu s PHE 439 N 0.68 3.18 -0.52 3.97 0.08 0.73 -1.13 117.98 124.98 3khu s PHE 439 Ca -0.11 -1.65 -0.17 0.00 0.12 0.00 0.00 56.93 55.13 3khu s PHE 439 Cb -0.16 -2.11 0.09 0.00 -0.57 0.00 0.00 43.02 40.26 3khu s PHE 439 CO 0.01 -0.75 0.51 0.34 -0.10 0.00 0.00 175.22 175.23 3khu s ASP 440 N 1.31 6.18 0.00 1.36 2.15 0.20 -0.80 116.67 127.07 3khu s ASP 440 Ca -0.02 -1.40 0.12 0.00 0.43 0.00 0.00 52.55 51.67 3khu s ASP 440 Cb -0.18 -2.23 0.35 0.00 -0.30 0.00 0.00 42.92 40.55 3khu s ASP 440 CO -0.02 -0.82 1.28 0.61 -0.17 0.00 0.00 175.17 176.06 3khu n GLY 441 N 5.22 0.70 0.00 2.66 0.00 0.20 -2.91 105.19 111.07 3khu n GLY 441 Ca -0.11 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 0.56 0.08 -2.13 1.61 5.12 -1.26 -1.25 116.66 119.40 3khu n ARG 442 Ca 0.12 -0.32 -0.20 0.00 -1.93 0.00 0.00 57.85 55.53 3khu n ARG 442 Cb 0.31 -0.61 -0.03 0.00 -1.16 0.00 0.00 32.46 30.96 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 -0.04 -1.51 0.19 5.56 5.12 -1.26 -4.89 116.66 119.83 3khu n ARG 443 Ca 0.00 1.03 0.08 0.00 -1.93 0.00 0.00 57.85 57.03 3khu n ARG 443 Cb 0.28 -5.54 0.22 0.00 -1.16 0.00 0.00 32.46 26.25 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 0.52 -0.41 1.55 -1.51 -1.95 -3.17 116.25 111.27 3khu h VAL 444 Ca -0.45 -1.52 0.00 0.00 -1.23 0.00 0.00 66.70 63.50 3khu h VAL 444 Cb 1.33 2.09 0.00 0.00 -2.13 0.00 0.00 31.29 32.57 3khu h VAL 444 CO 0.56 0.27 0.00 0.18 -1.23 0.00 0.00 177.57 177.35 3khu n LEU 445 N -3.23 2.48 -4.58 4.19 4.77 -1.26 -4.77 117.00 114.59 3khu n LEU 445 Ca 0.02 -1.24 -0.45 0.00 -0.03 0.00 0.00 56.01 54.31 3khu n LEU 445 Cb 0.58 -0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 41.32 3khu n LEU 445 CO 0.36 0.56 0.53 0.47 -1.33 0.00 0.00 177.39 177.98 3khu n ASP 446 N 0.69 1.12 0.00 -1.43 9.92 -1.20 -1.46 116.55 124.20 3khu n ASP 446 Ca 0.14 1.17 0.00 0.00 -0.53 0.00 0.00 54.79 55.57 3khu n ASP 446 Cb 0.42 -1.27 0.00 0.00 -0.64 0.00 0.00 41.12 39.63 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 1.27 2.59 1.08 0.44 0.00 -1.26 -4.83 105.19 104.47 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 -0.02 0.99 4.77 -0.53 -4.70 117.00 120.98 3khu n LEU 448 Ca 0.00 -1.81 -0.12 0.00 -0.03 0.00 0.00 56.01 54.04 3khu n LEU 448 Cb 0.00 -0.34 -0.07 0.00 -2.33 0.00 0.00 43.42 40.68 3khu n LEU 448 CO 0.00 0.83 0.74 0.45 -1.33 0.00 0.00 177.39 178.07 3khu h HIS 449 N 3.68 0.14 -0.54 -1.77 3.86 -1.88 -1.42 115.15 117.21 3khu h HIS 449 Ca 0.00 -0.02 0.06 0.00 -1.16 0.00 0.00 60.37 59.25 3khu h HIS 449 Cb 0.90 -0.04 -0.05 0.00 1.06 0.00 0.00 27.41 29.28 3khu h HIS 449 CO 0.34 0.39 0.25 -0.91 0.86 0.00 0.00 177.93 178.86 3khu h ASN 450 N -0.15 0.33 -0.40 2.45 2.35 -1.97 0.13 115.58 118.32 3khu h ASN 450 Ca 0.02 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.85 3khu h ASN 450 Cb 0.34 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.66 3khu h ASN 450 CO 0.00 0.22 0.18 -0.08 -1.65 0.00 0.00 177.43 176.11 3khu h GLU 451 N 0.48 0.37 -0.34 0.81 4.81 -1.86 -0.36 114.58 118.48 3khu h GLU 451 Ca 0.25 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.33 3khu h GLU 451 Cb 0.21 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 3khu h GLU 451 CO -0.20 0.24 -0.30 -0.07 -0.73 0.00 0.00 179.01 177.95 3khu h LEU 452 N 0.38 0.76 -0.52 1.64 3.38 -0.47 -1.55 115.31 118.93 3khu h LEU 452 Ca 0.18 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 3khu h LEU 452 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3khu h LEU 452 CO -0.14 1.01 0.15 1.56 0.09 0.00 0.00 178.44 181.11 3khu h GLN 453 N 0.62 0.82 -0.72 1.13 4.20 -0.57 -1.46 115.11 119.14 3khu h GLN 453 Ca 0.07 -0.18 0.01 0.00 0.06 0.00 0.00 58.65 58.61 3khu h GLN 453 Cb 0.82 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.45 3khu h GLN 453 CO 0.07 0.77 0.47 1.15 -0.67 0.00 0.00 178.83 180.62 3khu h THR 454 N 0.72 1.17 -0.49 -0.54 2.02 -0.81 -0.75 112.91 114.23 3khu h THR 454 Ca 0.17 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 67.03 3khu h THR 454 Cb 0.30 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 3khu h THR 454 CO -0.00 0.17 0.32 0.40 0.37 0.00 0.00 175.52 176.79 3khu h ILE 455 N 0.96 1.11 0.00 3.11 2.04 -1.18 -3.46 117.51 120.08 3khu h ILE 455 Ca 0.27 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3khu h ILE 455 Cb -0.09 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 3khu h ILE 455 CO -0.07 0.12 0.00 0.61 0.00 0.00 0.00 178.15 178.81 3khu n GLY 456 N -1.47 0.62 3.80 5.37 0.00 -0.29 -5.05 105.19 108.18 3khu n GLY 456 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.37 2.98 -0.42 1.61 0.40 -0.61 -4.68 117.98 115.88 3khu s PHE 457 Ca 0.00 1.57 -0.22 0.00 -0.60 0.00 0.00 56.93 57.68 3khu s PHE 457 Cb 0.00 -3.08 0.02 0.00 0.51 0.00 0.00 43.02 40.47 3khu s PHE 457 CO 0.00 -0.88 0.74 -0.65 0.70 0.00 0.00 175.22 175.14 3khu s GLN 458 N -3.24 3.47 -0.19 0.44 1.11 -0.60 -4.28 119.66 116.37 3khu s GLN 458 Ca 0.68 -0.06 -0.06 0.00 0.01 0.00 0.00 55.36 55.92 3khu s GLN 458 Cb -0.17 -3.90 -0.03 0.00 -1.01 0.00 0.00 33.01 27.89 3khu s GLN 458 CO 0.20 -1.01 0.04 -1.50 0.01 0.00 0.00 175.29 173.03 3khu s ILE 459 N 3.12 4.43 0.03 1.08 1.10 -1.26 -1.07 121.20 128.62 3khu s ILE 459 Ca 0.28 -0.15 0.05 0.00 -0.51 0.00 0.00 60.65 60.31 3khu s ILE 459 Cb -0.13 -3.00 -0.02 0.00 0.15 0.00 0.00 42.46 39.46 3khu s ILE 459 CO 0.20 0.44 -0.14 -1.61 -2.11 0.00 0.00 174.94 171.72 3khu s GLU 460 N 0.71 0.93 0.06 3.50 2.02 -0.28 -4.98 118.70 120.66 3khu s GLU 460 Ca 0.02 -0.72 -0.03 0.00 0.02 0.00 0.00 54.97 54.26 3khu s GLU 460 Cb -0.14 -0.93 -0.03 0.00 0.10 0.00 0.00 34.13 33.13 3khu s GLU 460 CO 0.02 0.23 0.03 -0.08 0.02 0.00 0.00 175.26 175.48 3khu s THR 461 N -0.79 0.20 0.41 3.63 -1.32 -1.26 -0.63 115.64 115.88 3khu s THR 461 Ca 0.02 -1.65 -0.26 0.00 -1.21 0.00 0.00 61.69 58.59 3khu s THR 461 Cb -0.07 -1.49 -0.08 0.00 -1.51 0.00 0.00 72.50 69.34 3khu s THR 461 CO 0.01 -0.90 1.28 0.27 -2.21 0.00 0.00 174.62 173.07 3khu s ILE 462 N -3.91 2.70 -0.09 5.08 -4.36 -1.14 -3.09 121.20 116.38 3khu s ILE 462 Ca 0.07 0.61 0.00 0.00 -0.26 0.00 0.00 60.65 61.07 3khu s ILE 462 Cb 0.07 -3.35 0.00 0.00 1.25 0.00 0.00 42.46 40.43 3khu s ILE 462 CO -0.10 0.08 0.00 0.61 0.24 0.00 0.00 174.94 175.77 3khu n GLY 463 N 0.66 0.47 2.75 6.27 0.00 -1.23 -4.86 105.19 109.25 3khu n GLY 463 Ca 0.04 -0.76 -0.18 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.57 0.08 0.32 1.61 2.20 -1.18 -1.63 119.74 119.58 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 -0.45 -0.10 0.00 -1.51 0.00 0.00 37.83 35.77 3khu s LYS 464 CO 0.00 -0.23 1.34 0.21 -0.36 0.00 0.00 175.35 176.32 3khu s LYS 465 N 1.50 4.32 0.00 4.03 2.20 -1.26 -4.64 119.74 125.89 3khu s LYS 465 Ca -0.03 2.26 0.25 0.00 -0.36 0.00 0.00 55.97 58.08 3khu s LYS 465 Cb -0.13 -3.07 1.47 0.00 -1.51 0.00 0.00 37.83 34.60 3khu s LYS 465 CO -0.03 -0.25 1.84 0.28 -0.36 0.00 0.00 175.35 176.82