#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ghs n ALA 1 N 0.00 -0.10 0.38 -5.12 0.00 -1.26 -4.92 120.51 109.49 3ghs n ALA 1 Ca 0.00 0.39 0.12 0.00 0.00 0.00 0.00 53.44 53.95 3ghs n ALA 1 Cb 0.00 -2.04 0.11 0.00 0.00 0.00 0.00 19.45 17.52 3ghs n ALA 1 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3ghs h SER 2 N 2.11 0.00 -4.15 0.00 4.64 -2.01 -3.47 113.55 110.68 3ghs h SER 2 Ca -0.40 -0.13 -0.44 0.00 -0.47 0.00 0.00 61.79 60.35 3ghs h SER 2 Cb 1.33 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.23 3ghs h SER 2 CO 0.61 0.06 -0.77 -0.13 -0.87 0.00 0.00 176.83 175.73 3ghs s ARG 3 N -3.24 1.00 -0.04 4.77 0.52 -1.26 -1.24 118.95 119.45 3ghs s ARG 3 Ca 0.04 -1.17 0.04 0.00 -0.52 0.00 0.00 55.73 54.12 3ghs s ARG 3 Cb 0.11 -0.97 -0.03 0.00 0.52 0.00 0.00 34.95 34.59 3ghs s ARG 3 CO 0.74 0.20 -0.14 -1.50 0.02 0.00 0.00 175.30 174.62 3ghs s ILE 4 N -1.79 3.06 -0.07 1.52 2.07 0.05 -4.87 121.20 121.18 3ghs s ILE 4 Ca 0.06 -0.74 -0.30 0.00 -1.41 0.00 0.00 60.65 58.26 3ghs s ILE 4 Cb -0.07 -2.20 -0.02 0.00 0.13 0.00 0.00 42.46 40.30 3ghs s ILE 4 CO 0.03 0.58 1.00 -0.22 -1.91 0.00 0.00 174.94 174.42 3ghs s LEU 5 N -0.77 4.29 0.48 8.50 2.96 -1.26 -0.72 118.68 132.16 3ghs s LEU 5 Ca 0.12 1.58 -0.02 0.00 -0.22 0.00 0.00 54.13 55.58 3ghs s LEU 5 Cb -0.11 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 3ghs s LEU 5 CO 0.01 -0.38 0.74 -0.76 -1.32 0.00 0.00 176.35 174.64 3ghs s LEU 6 N 1.65 3.58 0.00 -0.68 1.43 0.06 -4.98 118.68 119.74 3ghs s LEU 6 Ca 0.50 0.55 0.11 0.00 -1.03 0.00 0.00 54.13 54.26 3ghs s LEU 6 Cb -0.19 -3.43 0.67 0.00 0.03 0.00 0.00 46.19 43.27 3ghs s LEU 6 CO 0.22 -0.72 1.29 -0.46 0.23 0.00 0.00 176.35 176.91 3ghs n ASN 7 N -2.21 0.00 -1.23 2.29 0.23 -1.26 -1.23 115.26 111.85 3ghs n ASN 7 Ca 0.01 -1.30 0.12 0.00 -0.53 0.00 0.00 54.58 52.88 3ghs n ASN 7 Cb 0.57 0.00 0.25 0.00 -2.08 0.00 0.00 39.78 38.52 3ghs n ASN 7 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3ghs n ASN 8 N -0.71 3.65 0.00 0.53 6.94 -1.26 -4.98 115.26 119.43 3ghs n ASN 8 Ca 0.08 -2.00 0.00 0.00 -0.02 0.00 0.00 54.58 52.65 3ghs n ASN 8 Cb 0.04 -0.33 0.00 0.00 -2.36 0.00 0.00 39.78 37.13 3ghs n ASN 8 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3ghs n GLY 9 N 1.56 1.41 3.94 4.83 0.00 -0.37 -5.05 105.19 111.50 3ghs n GLY 9 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.99 3ghs n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ghs s ALA 10 N -2.95 3.66 -0.12 4.61 0.00 -1.26 -4.86 121.76 120.84 3ghs s ALA 10 Ca 0.00 -0.84 -0.04 0.00 0.00 0.00 0.00 51.96 51.08 3ghs s ALA 10 Cb 0.00 -2.18 -0.03 0.00 0.00 0.00 0.00 23.12 20.91 3ghs s ALA 10 CO 0.00 -0.04 0.03 0.15 0.00 0.00 0.00 175.76 175.90 3ghs s LYS 11 N -4.31 3.34 -0.16 0.00 1.02 -1.26 -0.76 119.74 117.61 3ghs s LYS 11 Ca 0.41 -0.37 0.00 0.00 0.02 0.00 0.00 55.97 56.03 3ghs s LYS 11 Cb -0.10 -2.95 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 3ghs s LYS 11 CO 0.37 0.56 -0.16 1.41 -0.92 0.00 0.00 175.35 176.61 3ghs s MET 12 N -0.47 3.17 0.25 1.68 -2.45 0.10 -4.90 119.30 116.69 3ghs s MET 12 Ca 0.09 -0.77 -0.31 0.00 -1.25 0.00 0.00 55.69 53.46 3ghs s MET 12 Cb -0.12 -2.62 -0.12 0.00 1.25 0.00 0.00 34.83 33.22 3ghs s MET 12 CO 0.02 -0.03 1.67 -2.14 1.05 0.00 0.00 175.02 175.58 3ghs s PRO 13 N 0.92 4.11 0.41 4.11 0.02 -1.26 -0.77 135.00 142.55 3ghs s PRO 13 Ca -0.03 2.61 0.22 0.00 0.02 0.00 0.00 61.00 63.82 3ghs s PRO 13 Cb -0.15 -3.04 0.73 0.00 0.02 0.00 0.00 34.50 32.05 3ghs s PRO 13 CO -0.02 -0.70 1.74 -0.84 -0.33 0.00 0.00 177.00 176.85 3ghs h ILE 14 N 3.58 0.59 -3.18 2.83 3.07 -1.51 -3.41 117.51 119.48 3ghs h ILE 14 Ca -0.45 -1.33 -0.61 0.00 1.55 0.00 0.00 64.86 64.03 3ghs h ILE 14 Cb 1.21 1.90 -0.10 0.00 -0.27 0.00 0.00 36.82 39.56 3ghs h ILE 14 CO 0.87 0.26 -0.43 -0.76 -1.05 0.00 0.00 178.15 177.05 3ghs s LEU 15 N -6.70 4.26 0.20 0.16 2.01 -1.26 -0.82 118.68 116.53 3ghs s LEU 15 Ca 0.02 0.38 0.00 0.00 0.01 0.00 0.00 54.13 54.53 3ghs s LEU 15 Cb 0.09 -2.19 -0.04 0.00 0.01 0.00 0.00 46.19 44.06 3ghs s LEU 15 CO 0.66 0.19 0.09 -0.83 1.01 0.00 0.00 176.35 177.47 3ghs s GLY 16 N 0.14 1.42 -0.24 -3.19 0.00 -0.40 -4.25 107.32 100.81 3ghs s GLY 16 Ca 0.12 -1.70 -0.13 0.00 0.00 0.00 0.00 44.72 43.01 3ghs s GLY 16 CO 0.01 -1.47 0.28 -2.27 0.00 0.00 0.00 173.10 169.65 3ghs s LEU 17 N -3.19 4.11 0.51 0.66 2.96 -0.24 -3.39 118.68 120.10 3ghs s LEU 17 Ca 0.34 0.27 -0.18 0.00 -0.22 0.00 0.00 54.13 54.34 3ghs s LEU 17 Cb 0.07 -2.30 -0.08 0.00 0.50 0.00 0.00 46.19 44.39 3ghs s LEU 17 CO 0.10 -0.03 1.00 -0.83 -1.32 0.00 0.00 176.35 175.27 3ghs s GLY 18 N 1.21 2.21 0.00 7.98 0.00 -0.49 -0.96 107.32 117.28 3ghs s GLY 18 Ca 0.13 0.34 0.00 0.00 0.00 0.00 0.00 44.72 45.18 3ghs s GLY 18 CO 0.07 0.63 0.29 -1.30 0.00 0.00 0.00 173.10 172.79 3ghs n THR 19 N -1.40 0.06 -2.11 0.90 -2.24 -1.16 -4.19 114.28 104.15 3ghs n THR 19 Ca 0.08 -0.26 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 3ghs n THR 19 Cb 0.54 1.44 -0.03 0.00 -2.10 0.00 0.00 70.33 70.18 3ghs n THR 19 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3ghs s TRP 20 N -0.06 3.09 0.00 4.78 -0.00 -1.26 -2.32 118.94 123.17 3ghs s TRP 20 Ca 0.00 0.82 0.00 0.00 -0.00 0.00 0.00 56.10 56.92 3ghs s TRP 20 Cb 0.00 -3.75 0.00 0.00 -0.00 0.00 0.00 33.47 29.72 3ghs s TRP 20 CO 0.00 -2.73 0.00 1.63 -0.00 0.00 0.00 176.95 175.85 3ghs n LYS 21 N 4.26 0.00 -2.16 5.86 5.02 -1.26 -5.01 118.16 124.87 3ghs n LYS 21 Ca 0.13 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 3ghs n LYS 21 Cb 0.42 -2.15 -0.02 0.00 -0.02 0.00 0.00 35.03 33.25 3ghs n LYS 21 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3ghs s SER 22 N -3.24 6.70 0.58 4.39 0.01 -0.98 -4.94 113.70 116.22 3ghs s SER 22 Ca 0.00 1.94 -0.20 0.00 1.31 0.00 0.00 55.95 59.00 3ghs s SER 22 Cb 0.00 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.66 3ghs s SER 22 CO 0.00 -0.94 1.26 -2.84 0.41 0.00 0.00 173.24 171.13 3ghs s PRO 23 N 3.99 2.99 0.49 12.44 0.02 -1.26 -4.69 135.00 148.98 3ghs s PRO 23 Ca 0.67 1.97 0.22 0.00 0.02 0.00 0.00 61.00 63.88 3ghs s PRO 23 Cb -0.28 -2.03 1.26 0.00 0.02 0.00 0.00 34.50 33.47 3ghs s PRO 23 CO 0.25 -1.23 2.03 -1.35 -0.33 0.00 0.00 177.00 176.38 3ghs h PRO 24 N 1.05 0.00 -0.00 5.54 0.11 -1.92 0.52 132.00 137.30 3ghs h PRO 24 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ghs h PRO 24 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3ghs h PRO 24 CO 0.56 0.15 -0.01 0.41 -0.21 0.00 0.00 178.00 178.90 3ghs n GLY 25 N -0.81 -0.76 0.00 -0.55 0.00 -1.26 -3.83 105.19 97.97 3ghs n GLY 25 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3ghs n GLY 25 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ghs n GLN 26 N -0.72 1.00 0.15 1.61 6.02 -0.19 -4.81 117.38 120.42 3ghs n GLN 26 Ca 0.21 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 57.22 3ghs n GLN 26 Cb 0.19 -0.98 0.15 0.00 1.02 0.00 0.00 30.24 30.62 3ghs n GLN 26 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.06 175.81 3ghs h VAL 27 N 0.00 1.11 -0.14 5.09 3.04 -1.08 -1.66 116.25 122.61 3ghs h VAL 27 Ca 0.00 -2.12 -0.01 0.00 -1.01 0.00 0.00 66.70 63.56 3ghs h VAL 27 Cb 0.21 2.25 -0.01 0.00 -2.01 0.00 0.00 31.29 31.73 3ghs h VAL 27 CO 0.00 0.54 0.06 0.74 -1.01 0.00 0.00 177.57 177.91 3ghs h THR 28 N 0.00 1.13 -0.81 3.17 2.02 -1.76 -0.95 112.91 115.71 3ghs h THR 28 Ca -0.01 -0.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.76 3ghs h THR 28 Cb 1.20 1.13 -0.04 0.00 -1.74 0.00 0.00 68.15 68.71 3ghs h THR 28 CO 0.07 0.12 0.38 -0.08 0.37 0.00 0.00 175.52 176.39 3ghs h GLU 29 N 0.09 1.17 -0.59 6.66 4.81 -1.87 -1.17 114.58 123.68 3ghs h GLU 29 Ca 0.05 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.12 3ghs h GLU 29 Cb 0.13 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 3ghs h GLU 29 CO -0.01 0.90 0.38 0.00 -0.73 0.00 0.00 179.01 179.56 3ghs h ALA 30 N 1.26 0.76 -0.31 2.92 0.00 -0.94 -0.14 119.26 122.80 3ghs h ALA 30 Ca 0.28 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.99 3ghs h ALA 30 Cb 0.13 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3ghs h ALA 30 CO -0.03 0.15 -0.47 0.28 0.00 0.00 0.00 179.25 179.17 3ghs h VAL 31 N 0.76 1.28 -0.26 0.00 2.07 -0.99 -0.15 116.25 118.97 3ghs h VAL 31 Ca 0.23 -1.65 0.02 0.00 0.82 0.00 0.00 66.70 66.11 3ghs h VAL 31 Cb -0.05 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 3ghs h VAL 31 CO -0.07 0.54 0.12 0.11 0.02 0.00 0.00 177.57 178.29 3ghs h LYS 32 N 0.66 0.25 -0.22 1.57 1.57 -0.90 -0.77 116.57 118.73 3ghs h LYS 32 Ca 0.04 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 3ghs h LYS 32 Cb 1.05 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 3ghs h LYS 32 CO 0.11 0.16 0.13 0.28 -0.57 0.00 0.00 179.45 179.56 3ghs h VAL 33 N 0.26 1.04 -0.26 0.50 2.07 -0.93 -0.91 116.25 118.01 3ghs h VAL 33 Ca 0.11 -0.10 0.05 0.00 0.82 0.00 0.00 66.70 67.59 3ghs h VAL 33 Cb 0.05 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.50 3ghs h VAL 33 CO -0.09 0.05 -0.08 0.00 0.02 0.00 0.00 177.57 177.48 3ghs h ALA 34 N 1.09 0.16 -0.68 1.67 0.00 -0.77 -0.42 119.26 120.31 3ghs h ALA 34 Ca 0.08 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3ghs h ALA 34 Cb -0.02 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3ghs h ALA 34 CO -0.03 -0.48 0.30 0.82 0.00 0.00 0.00 179.25 179.86 3ghs h ILE 35 N -0.02 1.24 -0.35 0.00 2.04 -0.96 0.18 117.51 119.63 3ghs h ILE 35 Ca 0.13 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 3ghs h ILE 35 Cb 0.21 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 3ghs h ILE 35 CO -0.28 0.29 0.20 0.44 0.00 0.00 0.00 178.15 178.80 3ghs h ASP 36 N 0.96 0.42 -0.07 1.72 3.32 -0.37 -2.62 116.42 119.77 3ghs h ASP 36 Ca 0.23 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.26 3ghs h ASP 36 Cb 0.17 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3ghs h ASP 36 CO -0.02 0.34 0.00 1.33 -1.72 0.00 0.00 179.24 179.16 3ghs n VAL 37 N -4.45 0.07 0.00 -1.35 0.24 -0.24 -4.95 118.33 107.65 3ghs n VAL 37 Ca 0.02 -0.39 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 3ghs n VAL 37 Cb 0.09 0.85 0.00 0.00 -1.47 0.00 0.00 33.84 33.31 3ghs n VAL 37 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ghs n GLY 38 N 1.25 1.23 3.77 7.63 0.00 -0.77 -5.04 105.19 113.26 3ghs n GLY 38 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 3ghs n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ghs s TYR 39 N -1.31 2.69 0.00 1.61 1.51 -0.02 -4.90 117.35 116.93 3ghs s TYR 39 Ca 0.00 1.36 0.00 0.00 -1.01 0.00 0.00 57.07 57.42 3ghs s TYR 39 Cb 0.00 -3.75 0.00 0.00 -0.11 0.00 0.00 41.96 38.10 3ghs s TYR 39 CO 0.00 -2.37 0.04 0.54 -1.11 0.00 0.00 175.55 172.64 3ghs n ARG 40 N -0.01 4.39 -4.68 -0.62 5.12 -1.26 -4.23 116.66 115.37 3ghs n ARG 40 Ca 0.04 -0.04 -0.33 0.00 -1.93 0.00 0.00 57.85 55.60 3ghs n ARG 40 Cb 0.43 -0.40 -0.16 0.00 -1.16 0.00 0.00 32.46 31.17 3ghs n ARG 40 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 3ghs s HIS 41 N -0.64 2.70 -0.09 -1.55 2.46 -1.26 -0.18 115.29 116.74 3ghs s HIS 41 Ca 0.00 -1.19 0.03 0.00 0.47 0.00 0.00 55.06 54.37 3ghs s HIS 41 Cb 0.00 -1.83 0.01 0.00 -0.13 0.00 0.00 32.58 30.62 3ghs s HIS 41 CO 0.00 -0.53 -0.19 0.42 -2.47 0.00 0.00 174.74 171.96 3ghs s ILE 42 N 0.76 1.71 -0.27 0.89 -1.09 -0.91 -1.08 121.20 121.21 3ghs s ILE 42 Ca -0.08 -0.81 -0.11 0.00 -2.23 0.00 0.00 60.65 57.43 3ghs s ILE 42 Cb -0.16 -1.50 -0.05 0.00 -1.58 0.00 0.00 42.46 39.17 3ghs s ILE 42 CO -0.00 0.48 0.17 -0.62 -1.23 0.00 0.00 174.94 173.74 3ghs s ASP 43 N 0.52 5.98 0.34 3.58 2.15 -0.13 -1.82 116.67 127.29 3ghs s ASP 43 Ca -0.16 0.01 0.04 0.00 0.43 0.00 0.00 52.55 52.87 3ghs s ASP 43 Cb -0.17 -2.10 -0.07 0.00 -0.30 0.00 0.00 42.92 40.28 3ghs s ASP 43 CO 0.06 -0.01 0.05 0.00 -0.17 0.00 0.00 175.17 175.09 3ghs s ALA 45 N -3.17 -1.82 0.25 0.00 0.00 -1.26 -3.77 121.76 111.99 3ghs s ALA 45 Ca 0.36 1.63 -0.04 0.00 0.00 0.00 0.00 51.96 53.91 3ghs s ALA 45 Cb 0.09 -0.62 0.36 0.00 0.00 0.00 0.00 23.12 22.95 3ghs s ALA 45 CO 0.16 -0.34 1.86 1.25 0.00 0.00 0.00 175.76 178.69 3ghs h HIS 46 N 3.64 1.05 0.00 0.00 -0.00 -1.98 -1.81 115.15 116.06 3ghs h HIS 46 Ca -0.26 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.14 3ghs h HIS 46 Cb 1.15 -0.34 0.00 0.00 -0.00 0.00 0.00 27.41 28.22 3ghs h HIS 46 CO 0.36 0.53 0.00 -0.24 -0.00 0.00 0.00 177.93 178.59 3ghs h VAL 47 N 1.03 0.00 0.00 5.26 3.04 -1.96 -1.95 116.25 121.67 3ghs h VAL 47 Ca 0.39 -0.25 0.00 0.00 -1.01 0.00 0.00 66.70 65.84 3ghs h VAL 47 Cb 0.17 1.20 0.00 0.00 -2.01 0.00 0.00 31.29 30.65 3ghs h VAL 47 CO -0.17 0.00 0.00 -1.22 -1.01 0.00 0.00 177.57 175.17 3ghs n TYR 48 N -2.99 0.71 -1.48 3.17 4.01 -0.68 -4.91 117.16 114.99 3ghs n TYR 48 Ca -0.01 0.25 -0.12 0.00 -0.16 0.00 0.00 57.90 57.86 3ghs n TYR 48 Cb 0.18 -0.91 -0.05 0.00 -0.31 0.00 0.00 39.34 38.26 3ghs n TYR 48 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3ghs n GLN 49 N -2.12 -0.88 -0.28 -0.72 6.02 -0.74 -4.80 117.38 113.87 3ghs n GLN 49 Ca 0.03 0.89 0.02 0.00 -0.01 0.00 0.00 57.00 57.93 3ghs n GLN 49 Cb 0.28 -4.93 0.03 0.00 1.02 0.00 0.00 30.24 26.64 3ghs n GLN 49 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3ghs n ASN 50 N -0.04 0.58 0.02 1.08 0.23 -1.26 -4.85 115.26 111.02 3ghs n ASN 50 Ca -0.13 -2.00 -0.01 0.00 -0.53 0.00 0.00 54.58 51.92 3ghs n ASN 50 Cb 0.43 -0.19 0.27 0.00 -2.08 0.00 0.00 39.78 38.21 3ghs n ASN 50 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3ghs h GLU 51 N 0.00 0.48 -0.54 -3.83 5.08 -1.89 -1.34 114.58 112.55 3ghs h GLU 51 Ca 0.00 -0.13 0.03 0.00 -1.00 0.00 0.00 59.36 58.26 3ghs h GLU 51 Cb 1.18 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 3ghs h GLU 51 CO 0.00 0.60 0.31 -0.97 -1.00 0.00 0.00 179.01 177.95 3ghs h ASN 52 N 0.45 0.48 -0.06 1.42 -1.24 -1.89 0.31 115.58 115.05 3ghs h ASN 52 Ca 0.08 0.01 -0.18 0.00 0.71 0.00 0.00 56.30 56.92 3ghs h ASN 52 Cb 0.47 -0.09 -0.00 0.00 0.73 0.00 0.00 38.32 39.43 3ghs h ASN 52 CO 0.03 0.34 -0.62 -0.33 -1.29 0.00 0.00 177.43 175.55 3ghs h GLU 53 N 0.61 0.67 -0.37 6.67 3.07 -1.75 -0.96 114.58 122.52 3ghs h GLU 53 Ca 0.23 -0.46 0.04 0.00 -0.50 0.00 0.00 59.36 58.66 3ghs h GLU 53 Cb 0.07 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.01 3ghs h GLU 53 CO -0.12 1.08 0.15 0.28 -1.40 0.00 0.00 179.01 179.00 3ghs h VAL 54 N 0.50 0.92 -0.68 3.13 2.07 -1.08 -2.85 116.25 118.27 3ghs h VAL 54 Ca -0.01 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.41 3ghs h VAL 54 Cb 1.20 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 3ghs h VAL 54 CO 0.12 0.06 0.44 1.23 0.02 0.00 0.00 177.57 179.44 3ghs h GLY 55 N 0.31 0.96 0.72 2.17 0.00 -0.45 -1.74 103.07 105.04 3ghs h GLY 55 Ca 0.17 -0.37 0.05 0.00 0.00 0.00 0.00 47.33 47.18 3ghs h GLY 55 CO -0.15 0.36 0.38 -2.08 0.00 0.00 0.00 176.54 175.05 3ghs h VAL 56 N 0.92 0.99 -0.13 4.60 2.07 -0.95 -0.09 116.25 123.67 3ghs h VAL 56 Ca 0.25 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3ghs h VAL 56 Cb -0.09 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 3ghs h VAL 56 CO -0.05 0.13 0.04 0.00 0.02 0.00 0.00 177.57 177.71 3ghs h ALA 57 N 1.34 0.17 -0.23 1.67 0.00 -1.27 -1.43 119.26 119.51 3ghs h ALA 57 Ca 0.30 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3ghs h ALA 57 Cb 0.15 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3ghs h ALA 57 CO -0.17 -0.22 0.03 0.82 0.00 0.00 0.00 179.25 179.71 3ghs h ILE 58 N 0.03 0.88 -0.81 0.00 2.04 -1.03 -1.69 117.51 116.92 3ghs h ILE 58 Ca 0.04 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 3ghs h ILE 58 Cb 0.21 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 3ghs h ILE 58 CO -0.00 0.02 0.36 1.56 0.00 0.00 0.00 178.15 180.09 3ghs h GLN 59 N 0.12 1.19 -0.57 2.37 1.08 -0.96 -0.95 115.11 117.38 3ghs h GLN 59 Ca 0.11 -0.19 -0.04 0.00 -1.45 0.00 0.00 58.65 57.07 3ghs h GLN 59 Cb 0.11 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.32 3ghs h GLN 59 CO -0.15 0.94 0.18 1.49 -0.95 0.00 0.00 178.83 180.34 3ghs h GLU 60 N 1.16 0.87 -0.09 1.46 4.57 -0.99 0.69 114.58 122.26 3ghs h GLU 60 Ca 0.27 -0.18 -0.11 0.00 -1.18 0.00 0.00 59.36 58.16 3ghs h GLU 60 Cb 0.16 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 3ghs h GLU 60 CO -0.03 0.79 -0.46 0.87 -1.18 0.00 0.00 179.01 179.00 3ghs h LYS 61 N 0.79 0.23 -0.32 1.92 1.79 -0.90 0.85 116.57 120.92 3ghs h LYS 61 Ca 0.18 -0.12 -0.05 0.00 -2.18 0.00 0.00 60.65 58.49 3ghs h LYS 61 Cb 0.27 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 3ghs h LYS 61 CO -0.01 0.64 0.01 -0.07 -1.08 0.00 0.00 179.45 178.95 3ghs h LEU 62 N 0.19 0.54 -0.71 2.94 3.38 -1.01 -1.43 115.31 119.22 3ghs h LEU 62 Ca 0.01 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 3ghs h LEU 62 Cb 0.88 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 3ghs h LEU 62 CO 0.07 0.71 0.24 -0.09 0.09 0.00 0.00 178.44 179.46 3ghs h ARG 63 N 0.37 1.09 -0.00 1.13 2.43 -0.55 -1.71 114.38 117.13 3ghs h ARG 63 Ca 0.09 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 3ghs h ARG 63 Cb 0.42 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3ghs h ARG 63 CO 0.01 0.92 -0.03 0.39 -1.51 0.00 0.00 179.97 179.75 3ghs n GLU 64 N -4.32 0.74 -2.65 0.20 1.02 0.26 -4.89 120.64 111.01 3ghs n GLU 64 Ca 0.05 -0.13 -0.10 0.00 -0.02 0.00 0.00 57.16 56.97 3ghs n GLU 64 Cb 0.21 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.15 3ghs n GLU 64 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3ghs n GLN 65 N -1.02 -2.33 0.02 3.49 6.02 -0.64 -4.92 117.38 117.99 3ghs n GLN 65 Ca 0.17 0.38 -0.06 0.00 -0.01 0.00 0.00 57.00 57.49 3ghs n GLN 65 Cb 0.22 -4.13 0.13 0.00 1.02 0.00 0.00 30.24 27.48 3ghs n GLN 65 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3ghs h VAL 66 N -0.70 1.31 -2.99 5.09 2.07 -1.52 -3.46 116.25 116.04 3ghs h VAL 66 Ca -0.23 -1.58 -0.12 0.00 0.82 0.00 0.00 66.70 65.59 3ghs h VAL 66 Cb 1.16 1.61 -0.20 0.00 -1.52 0.00 0.00 31.29 32.33 3ghs h VAL 66 CO 0.24 0.49 -0.26 0.54 0.02 0.00 0.00 177.57 178.61 3ghs s VAL 67 N -4.19 0.05 0.32 2.57 0.11 -1.24 -5.07 120.40 112.95 3ghs s VAL 67 Ca -0.07 -0.44 -0.11 0.00 -2.93 0.00 0.00 61.98 58.43 3ghs s VAL 67 Cb 0.12 -0.62 -0.07 0.00 -1.53 0.00 0.00 36.38 34.28 3ghs s VAL 67 CO 0.81 -0.24 0.68 -0.54 -3.33 0.00 0.00 175.10 172.48 3ghs s LYS 68 N -1.27 3.83 0.26 1.54 1.02 -1.26 -4.39 119.74 119.47 3ghs s LYS 68 Ca -0.13 0.41 -0.03 0.00 0.02 0.00 0.00 55.97 56.25 3ghs s LYS 68 Cb -0.05 -2.50 0.41 0.00 -0.52 0.00 0.00 37.83 35.18 3ghs s LYS 68 CO 0.04 0.14 1.85 -0.09 -0.92 0.00 0.00 175.35 176.38 3ghs h ARG 69 N 1.91 1.00 0.00 1.68 9.65 -1.95 -0.82 114.38 125.85 3ghs h ARG 69 Ca -0.47 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.34 3ghs h ARG 69 Cb 1.18 -0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 29.53 3ghs h ARG 69 CO 0.66 0.66 -0.03 1.05 2.80 0.00 0.00 179.97 185.11 3ghs h GLU 70 N 1.03 0.00 0.00 0.20 4.11 -2.03 -1.85 114.58 116.04 3ghs h GLU 70 Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.86 3ghs h GLU 70 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3ghs h GLU 70 CO -0.20 0.03 -0.32 0.39 0.07 0.00 0.00 179.01 178.98 3ghs n GLU 71 N -3.67 0.13 -3.54 1.06 1.02 -0.32 -4.87 120.64 110.45 3ghs n GLU 71 Ca -0.03 0.06 -0.30 0.00 -0.02 0.00 0.00 57.16 56.88 3ghs n GLU 71 Cb 0.12 -1.61 -0.04 0.00 -0.02 0.00 0.00 31.44 29.90 3ghs n GLU 71 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3ghs s LEU 72 N -3.62 4.18 -0.35 -4.62 1.43 -0.70 -4.83 118.68 110.18 3ghs s LEU 72 Ca 0.10 0.64 0.01 0.00 -1.03 0.00 0.00 54.13 53.85 3ghs s LEU 72 Cb 0.16 -3.40 0.11 0.00 0.03 0.00 0.00 46.19 43.08 3ghs s LEU 72 CO 0.64 -0.06 0.12 0.12 0.23 0.00 0.00 176.35 177.41 3ghs s PHE 73 N -1.85 2.20 -0.20 0.29 2.19 0.75 -4.94 117.98 116.42 3ghs s PHE 73 Ca 0.42 -2.15 -0.07 0.00 0.33 0.00 0.00 56.93 55.46 3ghs s PHE 73 Cb -0.11 -2.01 -0.03 0.00 -1.31 0.00 0.00 43.02 39.55 3ghs s PHE 73 CO 0.26 -0.87 0.05 0.42 1.83 0.00 0.00 175.22 176.91 3ghs s ILE 74 N 1.19 4.50 -0.08 3.12 -1.09 -1.26 -2.14 121.20 125.44 3ghs s ILE 74 Ca 0.12 -0.13 0.03 0.00 -2.23 0.00 0.00 60.65 58.44 3ghs s ILE 74 Cb -0.19 -3.05 -0.02 0.00 -1.58 0.00 0.00 42.46 37.62 3ghs s ILE 74 CO -0.16 0.42 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.12 3ghs s VAL 75 N 0.81 2.91 0.23 2.92 1.01 -0.76 -1.30 120.40 126.22 3ghs s VAL 75 Ca 0.03 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.30 3ghs s VAL 75 Cb -0.14 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3ghs s VAL 75 CO 0.02 0.56 0.16 -0.24 0.00 0.00 0.00 175.10 175.60 3ghs n SER 76 N 2.87 0.00 -3.83 3.32 2.88 -0.82 -0.82 113.62 117.23 3ghs n SER 76 Ca -0.18 -2.44 -0.12 0.00 -1.33 0.00 0.00 58.87 54.80 3ghs n SER 76 Cb 0.52 0.98 -0.13 0.00 -0.75 0.00 0.00 64.21 64.83 3ghs n SER 76 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 3ghs s LYS 77 N -2.93 0.15 -0.22 -1.46 1.02 -1.25 -1.16 119.74 113.89 3ghs s LYS 77 Ca 0.23 0.18 -0.29 0.00 0.02 0.00 0.00 55.97 56.10 3ghs s LYS 77 Cb 0.01 0.07 0.00 0.00 -0.52 0.00 0.00 37.83 37.40 3ghs s LYS 77 CO 0.16 -0.02 1.11 -1.17 -0.92 0.00 0.00 175.35 174.51 3ghs s LEU 78 N 0.07 4.11 0.67 3.17 2.96 0.48 -3.82 118.68 126.33 3ghs s LEU 78 Ca -0.00 1.45 -0.11 0.00 -0.22 0.00 0.00 54.13 55.25 3ghs s LEU 78 Cb -0.01 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.14 3ghs s LEU 78 CO 0.00 -0.71 1.05 0.86 -1.32 0.00 0.00 176.35 176.23 3ghs s TRP 79 N 3.32 3.29 0.50 5.38 -0.11 -1.26 -2.10 118.94 127.95 3ghs s TRP 79 Ca 0.47 1.35 0.19 0.00 1.22 0.00 0.00 56.10 59.34 3ghs s TRP 79 Cb -0.17 -2.84 1.30 0.00 -1.50 0.00 0.00 33.47 30.26 3ghs s TRP 79 CO 0.09 -1.07 2.11 0.00 -4.62 0.00 0.00 176.95 173.46 3ghs n THR 81 N -4.24 0.02 -1.33 0.00 -2.24 -1.26 -0.62 114.28 104.60 3ghs n THR 81 Ca -0.03 -0.02 0.08 0.00 -2.27 0.00 0.00 64.05 61.81 3ghs n THR 81 Cb 0.16 -0.18 0.14 0.00 -2.10 0.00 0.00 70.33 68.35 3ghs n THR 81 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3ghs n TYR 82 N -0.65 0.00 0.20 4.78 4.01 -0.60 -4.07 117.16 120.83 3ghs n TYR 82 Ca 0.10 -0.99 0.08 0.00 -0.16 0.00 0.00 57.90 56.93 3ghs n TYR 82 Cb 0.06 -0.16 0.35 0.00 -0.31 0.00 0.00 39.34 39.28 3ghs n TYR 82 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3ghs h HIS 83 N 0.25 0.00 -3.67 -0.72 3.86 -1.70 -3.33 115.15 109.85 3ghs h HIS 83 Ca -0.01 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.64 3ghs h HIS 83 Cb 1.07 0.00 0.17 0.00 1.06 0.00 0.00 27.41 29.72 3ghs h HIS 83 CO 0.18 0.29 0.06 0.39 0.86 0.00 0.00 177.93 179.72 3ghs n GLU 84 N -3.37 0.61 -0.27 2.45 4.71 -1.26 -4.55 120.64 118.95 3ghs n GLU 84 Ca 0.01 0.26 0.04 0.00 -0.01 0.00 0.00 57.16 57.45 3ghs n GLU 84 Cb 0.50 -2.17 0.13 0.00 -1.01 0.00 0.00 31.44 28.89 3ghs n GLU 84 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 3ghs h LYS 85 N -0.04 0.03 -0.00 3.49 3.64 -1.90 -2.57 116.57 119.22 3ghs h LYS 85 Ca -0.48 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 3ghs h LYS 85 Cb 1.35 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 3ghs h LYS 85 CO 0.48 0.02 -0.04 0.41 -2.27 0.00 0.00 179.45 178.05 3ghs n GLY 86 N -1.48 -0.83 0.00 5.01 0.00 -1.26 -3.79 105.19 102.84 3ghs n GLY 86 Ca 0.13 -0.26 0.05 0.00 0.00 0.00 0.00 46.02 45.94 3ghs n GLY 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ghs n LEU 87 N -0.81 0.20 -0.05 0.99 4.77 -0.98 -4.75 117.00 116.37 3ghs n LEU 87 Ca 0.19 -0.21 -0.11 0.00 -0.03 0.00 0.00 56.01 55.85 3ghs n LEU 87 Cb 0.23 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.27 3ghs n LEU 87 CO 0.20 0.05 0.85 0.58 -1.33 0.00 0.00 177.39 177.74 3ghs h VAL 88 N 0.00 1.16 -0.35 4.08 2.07 -1.64 -1.90 116.25 119.67 3ghs h VAL 88 Ca 0.00 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 3ghs h VAL 88 Cb 0.38 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3ghs h VAL 88 CO 0.00 0.16 0.20 0.50 0.02 0.00 0.00 177.57 178.45 3ghs h LYS 89 N 0.14 0.49 -0.41 1.57 3.64 -1.86 -1.45 116.57 118.69 3ghs h LYS 89 Ca 0.06 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 3ghs h LYS 89 Cb 0.18 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 3ghs h LYS 89 CO -0.00 0.39 0.02 0.78 -2.27 0.00 0.00 179.45 178.37 3ghs h GLY 90 N 0.45 0.69 0.95 5.01 0.00 -1.82 0.12 103.07 108.46 3ghs h GLY 90 Ca 0.13 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 3ghs h GLY 90 CO -0.02 0.39 0.17 0.00 0.00 0.00 0.00 176.54 177.08 3ghs h ALA 91 N 1.42 0.45 -0.39 3.60 0.00 -1.00 -0.31 119.26 123.02 3ghs h ALA 91 Ca 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3ghs h ALA 91 Cb 0.35 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3ghs h ALA 91 CO 0.01 -0.00 0.18 0.00 0.00 0.00 0.00 179.25 179.44 3ghs h GLN 93 N 0.49 0.48 -0.37 0.00 4.20 -0.55 0.47 115.11 119.82 3ghs h GLN 93 Ca 0.13 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 3ghs h GLN 93 Cb 0.12 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 3ghs h GLN 93 CO -0.02 0.56 0.15 -0.22 -0.67 0.00 0.00 178.83 178.62 3ghs h LYS 94 N 0.45 0.55 -0.40 1.46 1.63 -0.87 0.52 116.57 119.91 3ghs h LYS 94 Ca 0.09 -0.10 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 3ghs h LYS 94 Cb 0.40 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.92 3ghs h LYS 94 CO 0.02 0.54 0.27 1.15 -3.45 0.00 0.00 179.45 177.97 3ghs h THR 95 N 0.45 1.10 -0.65 1.00 2.02 -0.93 -0.18 112.91 115.73 3ghs h THR 95 Ca 0.12 -0.19 0.03 0.00 0.77 0.00 0.00 66.41 67.15 3ghs h THR 95 Cb 0.19 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 3ghs h THR 95 CO -0.01 0.10 0.40 -0.07 0.37 0.00 0.00 175.52 176.31 3ghs h LEU 96 N 0.55 0.64 -0.49 2.58 3.38 -0.66 0.94 115.31 122.24 3ghs h LEU 96 Ca 0.15 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 3ghs h LEU 96 Cb -0.06 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3ghs h LEU 96 CO -0.03 0.44 0.14 0.28 0.09 0.00 0.00 178.44 179.36 3ghs h SER 97 N 0.77 0.73 -0.44 -0.43 0.02 -0.57 0.57 113.55 114.19 3ghs h SER 97 Ca 0.26 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 3ghs h SER 97 Cb 0.04 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 3ghs h SER 97 CO -0.11 0.76 0.09 0.44 -1.14 0.00 0.00 176.83 176.86 3ghs h ASP 98 N 0.67 0.70 1.08 3.07 3.32 -0.77 -2.00 116.42 122.47 3ghs h ASP 98 Ca 0.16 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.96 3ghs h ASP 98 Cb 0.30 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3ghs h ASP 98 CO -0.00 0.77 0.00 0.18 -1.72 0.00 0.00 179.24 178.47 3ghs n LEU 99 N -4.49 0.70 -1.96 1.55 4.77 0.30 -4.02 117.00 113.85 3ghs n LEU 99 Ca 0.00 0.62 -0.16 0.00 -0.03 0.00 0.00 56.01 56.44 3ghs n LEU 99 Cb 0.23 -0.45 0.01 0.00 -2.33 0.00 0.00 43.42 40.88 3ghs n LEU 99 CO 0.39 -0.36 -0.10 0.29 -1.33 0.00 0.00 177.39 176.28 3ghs n LYS 100 N -2.21 -2.32 -4.07 3.23 5.02 0.19 -4.50 118.16 113.50 3ghs n LYS 100 Ca 0.04 0.69 -0.25 0.00 -2.02 0.00 0.00 58.31 56.77 3ghs n LYS 100 Cb 0.32 -5.03 -0.05 0.00 -0.02 0.00 0.00 35.03 30.26 3ghs n LYS 100 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ghs s LEU 101 N -4.61 3.87 0.04 -0.35 1.43 -0.54 -4.97 118.68 113.55 3ghs s LEU 101 Ca 0.10 -0.12 0.16 0.00 -1.03 0.00 0.00 54.13 53.25 3ghs s LEU 101 Cb -0.05 -2.46 -0.15 0.00 0.03 0.00 0.00 46.19 43.56 3ghs s LEU 101 CO 0.13 0.05 0.79 0.47 0.23 0.00 0.00 176.35 178.01 3ghs n ASP 102 N -0.52 0.84 -3.75 2.29 8.00 -1.26 -4.50 116.55 117.65 3ghs n ASP 102 Ca -0.08 0.37 -0.11 0.00 0.71 0.00 0.00 54.79 55.69 3ghs n ASP 102 Cb 0.55 0.16 -0.07 0.00 -0.02 0.00 0.00 41.12 41.74 3ghs n ASP 102 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3ghs s TYR 103 N -2.88 -0.06 -0.00 1.24 1.13 -1.26 -4.77 117.35 110.75 3ghs s TYR 103 Ca -0.03 -0.20 -0.02 0.00 -1.41 0.00 0.00 57.07 55.41 3ghs s TYR 103 Cb 0.09 0.09 -0.04 0.00 -1.10 0.00 0.00 41.96 41.00 3ghs s TYR 103 CO 0.81 -0.56 0.17 -0.51 -2.51 0.00 0.00 175.55 172.96 3ghs s LEU 104 N -2.45 4.32 0.25 -3.49 1.43 -0.43 -4.99 118.68 113.33 3ghs s LEU 104 Ca -0.00 0.32 0.07 0.00 -1.03 0.00 0.00 54.13 53.48 3ghs s LEU 104 Cb 0.01 -2.60 0.30 0.00 0.03 0.00 0.00 46.19 43.93 3ghs s LEU 104 CO -0.07 0.26 1.58 0.44 0.23 0.00 0.00 176.35 178.79 3ghs h ASP 105 N 3.79 0.17 -3.36 2.29 3.32 -1.54 0.14 116.42 121.23 3ghs h ASP 105 Ca -0.49 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 56.38 3ghs h ASP 105 Cb 1.18 -0.05 -0.25 0.00 0.22 0.00 0.00 39.33 40.44 3ghs h ASP 105 CO 0.69 0.73 -0.20 -0.22 -1.72 0.00 0.00 179.24 178.52 3ghs s LEU 106 N -7.82 -0.20 -0.10 1.55 2.96 -1.09 -2.18 118.68 111.80 3ghs s LEU 106 Ca -0.03 1.04 0.02 0.00 -0.22 0.00 0.00 54.13 54.94 3ghs s LEU 106 Cb 0.12 1.63 0.01 0.00 0.50 0.00 0.00 46.19 48.46 3ghs s LEU 106 CO 0.78 -0.20 -0.14 -0.47 -1.32 0.00 0.00 176.35 175.01 3ghs s TYR 107 N 1.15 1.82 0.02 5.38 5.04 -0.52 -1.94 117.35 128.31 3ghs s TYR 107 Ca -0.07 -0.81 0.04 0.00 -2.44 0.00 0.00 57.07 53.79 3ghs s TYR 107 Cb -0.06 -1.32 -0.03 0.00 0.35 0.00 0.00 41.96 40.89 3ghs s TYR 107 CO -0.11 -0.42 -0.08 -0.51 -1.34 0.00 0.00 175.55 173.09 3ghs s LEU 108 N 0.93 3.11 -0.25 6.97 1.43 -0.31 -1.36 118.68 129.20 3ghs s LEU 108 Ca -0.08 -0.20 -0.29 0.00 -1.03 0.00 0.00 54.13 52.53 3ghs s LEU 108 Cb -0.15 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 3ghs s LEU 108 CO -0.00 0.26 1.54 -0.63 0.23 0.00 0.00 176.35 177.76 3ghs s ILE 109 N -1.03 3.79 0.12 -0.59 1.01 -0.36 -0.39 121.20 123.76 3ghs s ILE 109 Ca 0.18 0.89 -0.17 0.00 0.00 0.00 0.00 60.65 61.55 3ghs s ILE 109 Cb -0.11 -3.83 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 3ghs s ILE 109 CO 0.08 -0.36 1.64 -0.74 0.00 0.00 0.00 174.94 175.57 3ghs h HIS 110 N 10.50 0.57 -4.03 3.97 2.76 -1.70 -1.26 115.15 125.96 3ghs h HIS 110 Ca -0.32 -0.06 -0.18 0.00 -2.20 0.00 0.00 60.37 57.61 3ghs h HIS 110 Cb 1.14 -0.17 -0.18 0.00 1.55 0.00 0.00 27.41 29.75 3ghs h HIS 110 CO 0.91 0.55 -0.70 -1.58 -1.30 0.00 0.00 177.93 175.81 3ghs s TRP 111 N -5.42 0.52 -2.00 5.26 0.52 -1.25 -4.32 118.94 112.26 3ghs s TRP 111 Ca -0.13 -0.76 0.18 0.00 0.02 0.00 0.00 56.10 55.41 3ghs s TRP 111 Cb 0.09 -0.35 1.09 0.00 -1.15 0.00 0.00 33.47 33.15 3ghs s TRP 111 CO 0.75 -0.22 1.67 -0.35 0.02 0.00 0.00 176.95 178.82 3ghs n PRO 112 N 0.83 0.96 -3.67 4.98 -0.04 -1.26 -4.72 135.00 132.08 3ghs n PRO 112 Ca -0.19 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 62.91 3ghs n PRO 112 Cb 0.58 -1.30 -0.10 0.00 -0.04 0.00 0.00 33.50 32.64 3ghs n PRO 112 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3ghs s THR 113 N -2.00 5.29 0.11 0.52 -4.23 -1.26 -4.81 115.64 109.25 3ghs s THR 113 Ca 0.27 0.15 -0.20 0.00 -1.18 0.00 0.00 61.69 60.73 3ghs s THR 113 Cb 0.13 -3.47 -0.07 0.00 1.34 0.00 0.00 72.50 70.43 3ghs s THR 113 CO 0.21 0.34 0.63 -0.83 -0.54 0.00 0.00 174.62 174.43 3ghs s GLY 114 N 1.12 2.71 0.26 3.99 0.00 -1.26 -4.61 107.32 109.54 3ghs s GLY 114 Ca 0.07 0.11 0.11 0.00 0.00 0.00 0.00 44.72 45.01 3ghs s GLY 114 CO 0.05 0.54 -0.11 -1.36 0.00 0.00 0.00 173.10 172.22 3ghs s PHE 115 N -1.18 2.48 0.11 1.90 0.08 0.20 -1.40 117.98 120.17 3ghs s PHE 115 Ca 0.32 -0.28 -0.35 0.00 0.12 0.00 0.00 56.93 56.74 3ghs s PHE 115 Cb -0.20 -1.10 -0.15 0.00 -0.57 0.00 0.00 43.02 41.00 3ghs s PHE 115 CO 0.21 0.65 1.49 1.17 -0.10 0.00 0.00 175.22 178.64 3ghs n LYS 116 N -0.63 1.70 -2.13 0.44 4.81 -0.16 -4.17 118.16 118.02 3ghs n LYS 116 Ca -0.06 0.61 -0.34 0.00 -0.87 0.00 0.00 58.31 57.64 3ghs n LYS 116 Cb 0.59 -2.33 0.01 0.00 0.02 0.00 0.00 35.03 33.32 3ghs n LYS 116 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3ghs s PRO 117 N 0.88 3.23 0.00 1.64 0.04 -1.26 -4.78 135.00 134.76 3ghs s PRO 117 Ca 0.82 1.52 0.00 0.00 0.04 0.00 0.00 61.00 63.38 3ghs s PRO 117 Cb -0.81 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 31.74 3ghs s PRO 117 CO 0.43 -0.93 0.00 0.41 0.04 0.00 0.00 177.00 176.95 3ghs n GLY 118 N -0.09 -1.30 0.21 0.56 0.00 -1.26 -4.98 105.19 98.33 3ghs n GLY 118 Ca 0.11 -1.35 -0.07 0.00 0.00 0.00 0.00 46.02 44.70 3ghs n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ghs h LYS 119 N 1.17 0.50 -6.55 1.61 1.57 -1.99 -3.44 116.57 109.44 3ghs h LYS 119 Ca 0.00 -0.28 -0.52 0.00 -1.87 0.00 0.00 60.65 57.97 3ghs h LYS 119 Cb 0.00 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 3ghs h LYS 119 CO 0.00 0.87 0.43 -1.21 -0.57 0.00 0.00 179.45 178.97 3ghs s GLU 120 N -4.09 4.60 0.38 3.15 2.02 -1.26 -4.94 118.70 118.55 3ghs s GLU 120 Ca -0.07 1.58 0.18 0.00 0.02 0.00 0.00 54.97 56.68 3ghs s GLU 120 Cb 0.12 -3.36 0.73 0.00 0.10 0.00 0.00 34.13 31.72 3ghs s GLU 120 CO 0.82 0.05 1.77 0.74 0.02 0.00 0.00 175.26 178.66 3ghs h PHE 121 N 5.86 0.00 -2.69 1.61 0.04 -1.96 -3.34 116.94 116.46 3ghs h PHE 121 Ca -0.43 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.74 3ghs h PHE 121 Cb 1.21 0.00 -0.40 0.00 2.20 0.00 0.00 35.95 38.96 3ghs h PHE 121 CO 0.65 0.37 -0.76 1.19 -0.60 0.00 0.00 178.31 179.16 3ghs n PHE 122 N -3.64 1.38 -2.04 -0.55 3.01 -1.26 -4.70 117.46 109.66 3ghs n PHE 122 Ca -0.01 -3.85 -0.42 0.00 1.01 0.00 0.00 57.45 54.18 3ghs n PHE 122 Cb 0.48 -0.24 -0.03 0.00 -0.01 0.00 0.00 39.48 39.68 3ghs n PHE 122 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3ghs s PRO 123 N -0.88 4.26 0.11 -1.08 0.04 -1.26 -4.95 135.00 131.25 3ghs s PRO 123 Ca 0.29 2.23 0.09 0.00 0.04 0.00 0.00 61.00 63.65 3ghs s PRO 123 Cb 0.01 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.28 3ghs s PRO 123 CO -0.17 -0.54 -0.21 -0.51 0.04 0.00 0.00 177.00 175.61 3ghs s LEU 124 N 1.25 2.58 0.90 -3.56 1.43 -1.26 -0.79 118.68 119.23 3ghs s LEU 124 Ca 0.68 -0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 53.04 3ghs s LEU 124 Cb -0.40 -1.45 0.16 0.00 0.03 0.00 0.00 46.19 44.53 3ghs s LEU 124 CO 0.31 0.19 1.25 1.51 0.23 0.00 0.00 176.35 179.84 3ghs s ASP 125 N -2.03 3.57 0.12 2.29 1.47 0.02 -4.86 116.67 117.25 3ghs s ASP 125 Ca 0.16 0.33 0.18 0.00 1.18 0.00 0.00 52.55 54.40 3ghs s ASP 125 Cb -0.10 -0.52 0.76 0.00 -0.34 0.00 0.00 42.92 42.72 3ghs s ASP 125 CO 0.08 -2.45 1.55 -0.62 0.68 0.00 0.00 175.17 174.42 3ghs n GLU 126 N -3.57 0.09 -0.22 2.11 -0.58 -1.26 -1.63 120.64 115.58 3ghs n GLU 126 Ca 0.13 0.35 0.11 0.00 -0.42 0.00 0.00 57.16 57.33 3ghs n GLU 126 Cb 0.60 -1.68 0.22 0.00 -0.57 0.00 0.00 31.44 30.02 3ghs n GLU 126 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 3ghs n SER 127 N -1.84 3.46 0.00 1.62 3.41 -1.26 -4.98 113.62 114.03 3ghs n SER 127 Ca 0.03 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.67 3ghs n SER 127 Cb 0.18 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 3ghs n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ghs n GLY 128 N 1.40 0.69 3.78 5.00 0.00 -0.65 -5.06 105.19 110.35 3ghs n GLY 128 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 3ghs n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ghs s ASN 129 N -2.82 7.35 0.52 1.61 -0.87 -1.26 -4.71 114.94 114.76 3ghs s ASN 129 Ca 0.00 1.70 -0.22 0.00 -1.57 0.00 0.00 52.86 52.77 3ghs s ASN 129 Cb 0.00 -2.52 -0.05 0.00 -0.02 0.00 0.00 41.25 38.65 3ghs s ASN 129 CO 0.00 0.08 1.29 0.54 -2.57 0.00 0.00 177.10 176.44 3ghs s VAL 130 N -1.37 2.42 -0.39 1.60 0.11 -0.57 -0.80 120.40 121.40 3ghs s VAL 130 Ca 0.42 0.31 -0.20 0.00 -2.93 0.00 0.00 61.98 59.58 3ghs s VAL 130 Cb -0.21 -3.16 0.01 0.00 -1.53 0.00 0.00 36.38 31.50 3ghs s VAL 130 CO 0.25 -0.01 0.64 -0.69 -3.33 0.00 0.00 175.10 171.96 3ghs s VAL 131 N -1.39 4.87 0.69 2.04 1.01 0.03 -4.78 120.40 122.86 3ghs s VAL 131 Ca 0.70 0.41 -0.13 0.00 0.00 0.00 0.00 61.98 62.95 3ghs s VAL 131 Cb -0.36 -4.12 0.01 0.00 0.00 0.00 0.00 36.38 31.91 3ghs s VAL 131 CO 0.43 -0.42 1.09 -2.84 0.00 0.00 0.00 175.10 173.36 3ghs s PRO 132 N 2.75 2.72 0.15 2.72 0.02 -1.26 -0.98 135.00 141.11 3ghs s PRO 132 Ca 0.24 1.25 -0.02 0.00 0.02 0.00 0.00 61.00 62.49 3ghs s PRO 132 Cb -0.14 -1.95 -0.05 0.00 0.02 0.00 0.00 34.50 32.38 3ghs s PRO 132 CO 0.16 -1.29 0.35 -1.54 -0.33 0.00 0.00 177.00 174.35 3ghs s SER 133 N -2.98 6.43 -0.08 2.53 1.04 -0.50 -3.81 113.70 116.33 3ghs s SER 133 Ca 0.64 0.46 0.01 0.00 0.48 0.00 0.00 55.95 57.54 3ghs s SER 133 Cb -0.18 -2.04 0.12 0.00 0.10 0.00 0.00 66.02 64.02 3ghs s SER 133 CO 0.47 0.04 1.21 -0.90 0.98 0.00 0.00 173.24 175.03 3ghs n ASP 134 N -0.15 3.27 -4.73 7.02 5.68 -1.26 -4.70 116.55 121.68 3ghs n ASP 134 Ca -0.04 -2.31 -0.41 0.00 -0.50 0.00 0.00 54.79 51.53 3ghs n ASP 134 Cb 0.52 -0.59 -0.04 0.00 -1.14 0.00 0.00 41.12 39.88 3ghs n ASP 134 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3ghs s THR 135 N -0.60 4.07 0.08 2.12 -4.23 -1.26 -5.04 115.64 110.78 3ghs s THR 135 Ca 0.10 1.65 0.03 0.00 -1.18 0.00 0.00 61.69 62.30 3ghs s THR 135 Cb 0.09 -4.05 -0.04 0.00 1.34 0.00 0.00 72.50 69.83 3ghs s THR 135 CO 0.02 0.22 0.06 0.54 -0.54 0.00 0.00 174.62 174.91 3ghs s ASN 136 N 0.38 5.38 0.21 3.99 4.22 -1.26 -4.75 114.94 123.11 3ghs s ASN 136 Ca 0.52 -0.06 -0.19 0.00 -2.14 0.00 0.00 52.86 51.00 3ghs s ASN 136 Cb -0.28 -1.40 0.19 0.00 1.28 0.00 0.00 41.25 41.04 3ghs s ASN 136 CO 0.32 0.18 1.57 0.40 -2.04 0.00 0.00 177.10 177.53 3ghs h ILE 137 N 2.67 0.10 -0.76 0.54 2.04 -1.96 -0.71 117.51 119.43 3ghs h ILE 137 Ca -0.47 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.46 3ghs h ILE 137 Cb 1.16 0.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.28 3ghs h ILE 137 CO 0.64 0.00 0.45 -0.07 0.00 0.00 0.00 178.15 179.17 3ghs h LEU 138 N -0.08 0.67 -0.68 1.44 3.38 -1.96 0.24 115.31 118.32 3ghs h LEU 138 Ca 0.29 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 58.16 3ghs h LEU 138 Cb 0.58 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3ghs h LEU 138 CO -0.82 0.43 -0.38 0.44 0.09 0.00 0.00 178.44 178.20 3ghs h ASP 139 N 0.81 0.62 -0.71 -0.43 3.32 -1.58 -1.45 116.42 117.00 3ghs h ASP 139 Ca 0.34 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 3ghs h ASP 139 Cb 0.21 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 3ghs h ASP 139 CO -0.19 0.94 0.25 0.74 -1.72 0.00 0.00 179.24 179.26 3ghs h THR 140 N 0.49 1.25 -0.58 0.35 2.02 -0.26 -2.43 112.91 113.76 3ghs h THR 140 Ca 0.05 -0.85 0.00 0.00 0.77 0.00 0.00 66.41 66.38 3ghs h THR 140 Cb 0.88 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 3ghs h THR 140 CO 0.08 0.34 0.36 -0.25 0.37 0.00 0.00 175.52 176.42 3ghs h TRP 141 N 1.06 0.75 -0.98 3.16 2.91 -0.29 -1.14 115.95 121.42 3ghs h TRP 141 Ca 0.24 0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.34 3ghs h TRP 141 Cb 0.26 -0.25 -0.07 0.00 -0.51 0.00 0.00 29.16 28.60 3ghs h TRP 141 CO 0.02 0.49 0.63 0.00 -1.03 0.00 0.00 178.44 178.56 3ghs h ALA 142 N 1.19 1.45 -0.74 2.65 0.00 -0.92 -0.07 119.26 122.82 3ghs h ALA 142 Ca 0.21 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3ghs h ALA 142 Cb -0.05 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 3ghs h ALA 142 CO -0.04 0.40 0.32 0.00 0.00 0.00 0.00 179.25 179.92 3ghs h ALA 143 N 1.48 1.16 -0.65 0.00 0.00 -0.91 -2.37 119.26 117.97 3ghs h ALA 143 Ca 0.43 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3ghs h ALA 143 Cb 0.21 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3ghs h ALA 143 CO -0.17 0.62 0.31 0.52 0.00 0.00 0.00 179.25 180.52 3ghs h MET 144 N 1.07 0.94 -0.83 0.00 2.07 -0.11 -2.78 114.93 115.28 3ghs h MET 144 Ca 0.25 -0.14 0.04 0.00 -2.07 0.00 0.00 59.70 57.79 3ghs h MET 144 Cb 0.17 -0.17 -0.05 0.00 -1.87 0.00 0.00 31.60 29.68 3ghs h MET 144 CO -0.03 0.75 0.54 0.93 1.07 0.00 0.00 176.91 180.17 3ghs h GLU 145 N 0.90 0.96 -0.43 1.72 5.08 -0.71 -1.50 114.58 120.59 3ghs h GLU 145 Ca 0.22 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3ghs h GLU 145 Cb 0.12 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 3ghs h GLU 145 CO -0.03 0.63 0.26 0.93 -1.00 0.00 0.00 179.01 179.80 3ghs h GLU 146 N 0.99 0.57 -0.62 2.33 5.08 -1.15 -2.23 114.58 119.55 3ghs h GLU 146 Ca 0.34 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.62 3ghs h GLU 146 Cb 0.09 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 3ghs h GLU 146 CO -0.11 0.40 0.25 -0.07 -1.00 0.00 0.00 179.01 178.48 3ghs h LEU 147 N 0.59 0.82 -0.33 1.33 3.38 -1.19 -0.55 115.31 119.35 3ghs h LEU 147 Ca 0.16 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3ghs h LEU 147 Cb -0.02 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3ghs h LEU 147 CO -0.03 0.73 0.19 0.58 0.09 0.00 0.00 178.44 180.00 3ghs h VAL 148 N 0.88 1.12 0.00 1.22 2.07 -1.36 -1.90 116.25 118.28 3ghs h VAL 148 Ca 0.21 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.44 3ghs h VAL 148 Cb 0.17 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 3ghs h VAL 148 CO -0.02 0.12 0.00 0.47 0.02 0.00 0.00 177.57 178.16 3ghs n ASP 149 N -4.81 0.60 -0.70 0.57 8.00 -0.76 -1.84 116.55 117.61 3ghs n ASP 149 Ca -0.01 0.63 0.12 0.00 0.71 0.00 0.00 54.79 56.24 3ghs n ASP 149 Cb 0.06 -0.77 0.11 0.00 -0.02 0.00 0.00 41.12 40.51 3ghs n ASP 149 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3ghs n GLU 150 N -2.15 1.76 -0.84 -1.24 1.02 -0.29 -4.98 120.64 113.93 3ghs n GLU 150 Ca 0.03 -1.41 0.00 0.00 -0.02 0.00 0.00 57.16 55.76 3ghs n GLU 150 Cb 0.25 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 3ghs n GLU 150 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ghs n GLY 151 N 1.36 0.70 0.11 0.62 0.00 -0.76 -4.93 105.19 102.29 3ghs n GLY 151 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.12 3ghs n GLY 151 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ghs h LEU 152 N 0.00 0.00 -7.93 0.99 -0.00 -1.59 -3.44 115.31 103.33 3ghs h LEU 152 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 57.88 57.66 3ghs h LEU 152 Cb 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 40.66 40.42 3ghs h LEU 152 CO 0.00 0.74 -0.72 0.68 -0.00 0.00 0.00 178.44 179.14 3ghs s VAL 153 N -2.99 0.18 -0.08 1.22 -7.23 -1.19 -1.31 120.40 108.98 3ghs s VAL 153 Ca 0.01 -0.62 0.15 0.00 -1.81 0.00 0.00 61.98 59.71 3ghs s VAL 153 Cb 0.10 -0.25 -0.15 0.00 0.56 0.00 0.00 36.38 36.63 3ghs s VAL 153 CO 0.78 -0.28 0.87 0.11 -0.31 0.00 0.00 175.10 176.27 3ghs h LYS 154 N 5.18 0.00 -3.46 4.82 1.57 -1.09 -3.37 116.57 120.22 3ghs h LYS 154 Ca -0.30 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.35 3ghs h LYS 154 Cb 1.21 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.33 3ghs h LYS 154 CO 0.45 0.42 -0.41 0.00 -0.57 0.00 0.00 179.45 179.33 3ghs s ALA 155 N -2.82 -0.41 0.14 3.86 0.00 -0.92 -4.99 121.76 116.61 3ghs s ALA 155 Ca -0.02 -0.13 0.09 0.00 0.00 0.00 0.00 51.96 51.89 3ghs s ALA 155 Cb 0.08 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 3ghs s ALA 155 CO 0.81 -0.28 -0.20 0.96 0.00 0.00 0.00 175.76 177.05 3ghs s ILE 156 N -1.89 1.81 0.00 0.00 -4.36 -1.26 -1.43 121.20 114.06 3ghs s ILE 156 Ca -0.10 -1.77 0.00 0.00 -0.26 0.00 0.00 60.65 58.51 3ghs s ILE 156 Cb -0.04 -1.75 0.00 0.00 1.25 0.00 0.00 42.46 41.92 3ghs s ILE 156 CO -0.00 -0.20 0.00 0.61 0.24 0.00 0.00 174.94 175.59 3ghs n GLY 157 N 0.62 2.49 3.25 6.27 0.00 -0.46 -0.74 105.19 116.61 3ghs n GLY 157 Ca -0.16 -0.88 -0.14 0.00 0.00 0.00 0.00 46.02 44.84 3ghs n GLY 157 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3ghs s ILE 158 N -2.99 0.70 -0.13 -0.61 -4.36 -0.15 -1.22 121.20 112.43 3ghs s ILE 158 Ca 0.00 -1.99 -0.10 0.00 -0.26 0.00 0.00 60.65 58.31 3ghs s ILE 158 Cb 0.00 -2.17 0.04 0.00 1.25 0.00 0.00 42.46 41.58 3ghs s ILE 158 CO 0.00 -0.43 0.33 -0.55 0.24 0.00 0.00 174.94 174.53 3ghs s SER 159 N -3.19 -0.37 -1.58 4.36 0.15 -0.48 -1.31 113.70 111.28 3ghs s SER 159 Ca 0.25 0.69 0.00 0.00 0.70 0.00 0.00 55.95 57.60 3ghs s SER 159 Cb 0.06 0.65 0.00 0.00 -1.71 0.00 0.00 66.02 65.02 3ghs s SER 159 CO 0.05 -0.14 0.00 0.59 1.20 0.00 0.00 173.24 174.94 3ghs n ASN 160 N 3.49 -5.18 -4.73 5.45 3.02 -0.34 -3.96 115.26 113.01 3ghs n ASN 160 Ca -0.18 0.06 -0.39 0.00 -0.03 0.00 0.00 54.58 54.04 3ghs n ASN 160 Cb 0.56 -4.26 -0.05 0.00 -0.61 0.00 0.00 39.78 35.42 3ghs n ASN 160 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3ghs s PHE 161 N -2.85 3.58 0.93 3.10 0.40 -1.26 -4.54 117.98 117.33 3ghs s PHE 161 Ca 0.00 1.13 -0.15 0.00 -0.60 0.00 0.00 56.93 57.31 3ghs s PHE 161 Cb 0.00 -2.69 0.17 0.00 0.51 0.00 0.00 43.02 41.02 3ghs s PHE 161 CO 0.00 0.16 1.29 0.54 0.70 0.00 0.00 175.22 177.91 3ghs s ASN 162 N 0.56 3.41 0.19 1.36 2.20 -1.26 -4.74 114.94 116.65 3ghs s ASN 162 Ca 0.33 0.36 -0.13 0.00 -0.94 0.00 0.00 52.86 52.47 3ghs s ASN 162 Cb -0.17 -0.49 0.19 0.00 -2.00 0.00 0.00 41.25 38.77 3ghs s ASN 162 CO 0.15 -2.55 1.73 -0.74 -2.94 0.00 0.00 177.10 172.75 3ghs h HIS 163 N -1.51 0.21 0.00 1.54 -0.00 -1.27 0.16 115.15 114.29 3ghs h HIS 163 Ca -0.45 0.03 -0.11 0.00 -0.00 0.00 0.00 60.37 59.84 3ghs h HIS 163 Cb 1.25 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 28.63 3ghs h HIS 163 CO -0.85 0.03 -0.53 -0.07 -0.00 0.00 0.00 177.93 176.51 3ghs h LEU 164 N 0.27 0.00 -0.16 0.26 3.38 -1.94 -1.20 115.31 115.93 3ghs h LEU 164 Ca 0.25 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.99 3ghs h LEU 164 Cb 0.31 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.07 3ghs h LEU 164 CO -0.30 0.53 -0.78 1.56 0.09 0.00 0.00 178.44 179.54 3ghs h GLN 165 N 0.00 0.80 -0.27 1.13 4.20 -1.70 -0.73 115.11 118.55 3ghs h GLN 165 Ca -0.01 -0.66 0.01 0.00 0.06 0.00 0.00 58.65 58.05 3ghs h GLN 165 Cb 1.01 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.91 3ghs h GLN 165 CO 0.07 1.26 0.17 0.28 -0.67 0.00 0.00 178.83 179.94 3ghs h VAL 166 N 0.55 1.05 -0.81 -0.54 2.07 -0.88 -2.63 116.25 115.06 3ghs h VAL 166 Ca -0.05 -0.12 0.07 0.00 0.82 0.00 0.00 66.70 67.41 3ghs h VAL 166 Cb 1.41 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 3ghs h VAL 166 CO 0.16 0.06 0.49 -0.08 0.02 0.00 0.00 177.57 178.22 3ghs h GLU 167 N 0.35 0.86 -0.59 1.57 4.81 -1.19 -0.34 114.58 120.05 3ghs h GLU 167 Ca 0.10 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.35 3ghs h GLU 167 Cb -0.03 -0.19 -0.06 0.00 0.63 0.00 0.00 28.75 29.10 3ghs h GLU 167 CO -0.03 0.57 0.29 1.98 -0.73 0.00 0.00 179.01 181.08 3ghs h MET 168 N 0.88 0.52 -0.27 1.92 4.05 -0.77 0.63 114.93 121.89 3ghs h MET 168 Ca 0.36 -0.03 -0.16 0.00 -0.28 0.00 0.00 59.70 59.59 3ghs h MET 168 Cb 0.20 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 30.89 3ghs h MET 168 CO -0.19 0.34 -0.48 0.82 0.23 0.00 0.00 176.91 177.64 3ghs h ILE 169 N 0.53 1.29 -0.29 1.77 2.04 -1.14 -1.62 117.51 120.10 3ghs h ILE 169 Ca 0.28 -1.67 0.07 0.00 1.00 0.00 0.00 64.86 64.54 3ghs h ILE 169 Cb 0.23 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 3ghs h ILE 169 CO -0.21 0.54 0.21 -0.07 0.00 0.00 0.00 178.15 178.61 3ghs h LEU 170 N 0.55 0.07 -1.92 1.44 3.38 -0.60 -0.38 115.31 117.84 3ghs h LEU 170 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3ghs h LEU 170 Cb 1.08 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3ghs h LEU 170 CO 0.11 0.04 0.00 0.59 0.09 0.00 0.00 178.44 179.27 3ghs n ASN 171 N -4.47 2.79 -4.73 -0.43 3.02 0.17 -4.97 115.26 106.65 3ghs n ASN 171 Ca 0.04 -2.00 -0.42 0.00 -0.03 0.00 0.00 54.58 52.17 3ghs n ASN 171 Cb 0.32 -0.35 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 3ghs n ASN 171 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3ghs n LYS 172 N 1.03 2.77 -1.72 3.52 4.81 -0.15 -4.90 118.16 123.52 3ghs n LYS 172 Ca 0.17 1.00 -0.42 0.00 -0.87 0.00 0.00 58.31 58.19 3ghs n LYS 172 Cb 0.44 -2.83 -0.03 0.00 0.02 0.00 0.00 35.03 32.63 3ghs n LYS 172 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 3ghs n PRO 173 N 3.57 2.73 -1.07 1.64 -0.02 -1.26 -1.89 135.00 138.71 3ghs n PRO 173 Ca 0.14 0.99 -0.02 0.00 -2.02 0.00 0.00 63.50 62.59 3ghs n PRO 173 Cb 0.35 -2.83 -0.01 0.00 -0.02 0.00 0.00 33.50 31.00 3ghs n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ghs n GLY 174 N 3.91 0.56 3.59 -1.23 0.00 -1.26 -4.94 105.19 105.82 3ghs n GLY 174 Ca 0.16 -0.45 -0.52 0.00 0.00 0.00 0.00 46.02 45.21 3ghs n GLY 174 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3ghs n LEU 175 N -0.26 1.69 -0.13 0.99 7.94 -0.79 -4.90 117.00 121.54 3ghs n LEU 175 Ca -0.02 1.12 -0.24 0.00 -1.11 0.00 0.00 56.01 55.76 3ghs n LEU 175 Cb 0.13 -1.20 -0.10 0.00 0.53 0.00 0.00 43.42 42.78 3ghs n LEU 175 CO 0.03 -1.02 -1.36 1.17 -1.11 0.00 0.00 177.39 175.11 3ghs n LYS 176 N 2.56 0.57 -4.44 1.96 4.81 -1.26 -4.95 118.16 117.41 3ghs n LYS 176 Ca 0.18 0.21 -0.26 0.00 -0.87 0.00 0.00 58.31 57.57 3ghs n LYS 176 Cb 0.19 -1.44 -0.17 0.00 0.02 0.00 0.00 35.03 33.63 3ghs n LYS 176 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 3ghs s TYR 177 N -2.48 1.54 0.59 5.64 2.02 -1.26 -5.13 117.35 118.27 3ghs s TYR 177 Ca -0.35 -0.63 -0.18 0.00 -0.37 0.00 0.00 57.07 55.54 3ghs s TYR 177 Cb 0.12 -1.15 -0.03 0.00 -0.40 0.00 0.00 41.96 40.49 3ghs s TYR 177 CO 0.49 -0.35 1.17 0.15 -1.57 0.00 0.00 175.55 175.44 3ghs s LYS 178 N 0.90 3.03 0.33 -0.62 1.02 -1.26 -4.98 119.74 118.16 3ghs s LYS 178 Ca -0.10 1.69 -0.29 0.00 0.02 0.00 0.00 55.97 57.29 3ghs s LYS 178 Cb -0.15 -1.95 -0.11 0.00 -0.52 0.00 0.00 37.83 35.09 3ghs s LYS 178 CO 0.01 -1.13 1.54 -2.30 -0.92 0.00 0.00 175.35 172.55 3ghs n PRO 179 N -1.67 2.66 0.04 -1.68 -0.02 -1.26 -4.84 135.00 128.23 3ghs n PRO 179 Ca 0.12 0.94 -0.10 0.00 -2.02 0.00 0.00 63.50 62.45 3ghs n PRO 179 Cb 0.50 -2.69 -0.13 0.00 -0.02 0.00 0.00 33.50 31.16 3ghs n PRO 179 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ghs h ALA 180 N 3.93 0.43 -3.08 3.55 0.00 -1.30 -3.43 119.26 119.36 3ghs h ALA 180 Ca -0.48 -1.09 -0.17 0.00 0.00 0.00 0.00 54.91 53.16 3ghs h ALA 180 Cb 1.24 0.10 -0.24 0.00 0.00 0.00 0.00 17.79 18.89 3ghs h ALA 180 CO 0.72 1.30 -0.53 0.08 0.00 0.00 0.00 179.25 180.82 3ghs s VAL 181 N -2.66 0.04 -0.21 0.00 1.01 -1.26 -1.64 120.40 115.68 3ghs s VAL 181 Ca -0.03 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.61 3ghs s VAL 181 Cb 0.09 -0.31 0.03 0.00 0.00 0.00 0.00 36.38 36.19 3ghs s VAL 181 CO 0.83 -0.20 -0.17 0.21 0.00 0.00 0.00 175.10 175.77 3ghs s ASN 182 N -0.66 3.60 -0.30 3.32 2.47 -0.44 -0.98 114.94 121.95 3ghs s ASN 182 Ca -0.07 -0.91 -0.14 0.00 0.42 0.00 0.00 52.86 52.15 3ghs s ASN 182 Cb -0.04 -1.51 -0.03 0.00 -1.45 0.00 0.00 41.25 38.22 3ghs s ASN 182 CO 0.01 -0.07 0.34 -1.58 -3.72 0.00 0.00 177.10 172.08 3ghs s GLN 183 N 1.22 3.84 0.09 0.43 0.74 -0.43 -1.96 119.66 123.60 3ghs s GLN 183 Ca 0.00 -0.19 0.02 0.00 0.05 0.00 0.00 55.36 55.24 3ghs s GLN 183 Cb -0.15 -3.71 -0.04 0.00 1.10 0.00 0.00 33.01 30.21 3ghs s GLN 183 CO -0.10 -0.35 -0.07 0.96 -0.55 0.00 0.00 175.29 175.18 3ghs s ILE 184 N 2.00 0.65 0.22 -2.34 -4.36 -0.11 -1.20 121.20 116.05 3ghs s ILE 184 Ca 0.12 -1.82 -0.30 0.00 -0.26 0.00 0.00 60.65 58.39 3ghs s ILE 184 Cb -0.16 -1.54 -0.09 0.00 1.25 0.00 0.00 42.46 41.92 3ghs s ILE 184 CO 0.11 -0.82 1.40 -0.70 0.24 0.00 0.00 174.94 175.17 3ghs s GLU 185 N -3.55 4.31 -0.28 0.37 2.12 -1.26 -0.89 118.70 119.52 3ghs s GLU 185 Ca 0.09 2.21 -0.16 0.00 0.36 0.00 0.00 54.97 57.46 3ghs s GLU 185 Cb 0.03 -3.15 0.08 0.00 0.26 0.00 0.00 34.13 31.36 3ghs s GLU 185 CO -0.04 -0.37 0.69 0.00 -0.54 0.00 0.00 175.26 174.99 3ghs s HIS 187 N 1.67 0.02 0.15 0.00 -3.43 -0.94 -4.21 115.29 108.55 3ghs s HIS 187 Ca -0.10 -0.38 0.32 0.00 -0.80 0.00 0.00 55.06 54.10 3ghs s HIS 187 Cb -0.05 0.68 1.69 0.00 -1.43 0.00 0.00 32.58 33.46 3ghs s HIS 187 CO -0.20 -0.86 1.97 -1.35 -2.00 0.00 0.00 174.74 172.31 3ghs h PRO 188 N 2.00 0.00 -0.01 -0.38 0.11 -1.87 0.08 132.00 131.94 3ghs h PRO 188 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3ghs h PRO 188 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3ghs h PRO 188 CO 0.33 0.00 -0.21 0.66 -0.21 0.00 0.00 178.00 178.57 3ghs n TYR 189 N -2.63 0.00 -3.02 0.65 4.01 -1.26 -1.34 117.16 113.57 3ghs n TYR 189 Ca -0.02 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.59 3ghs n TYR 189 Cb 0.08 -0.08 -0.03 0.00 -0.31 0.00 0.00 39.34 38.99 3ghs n TYR 189 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 3ghs s LEU 190 N -2.37 -0.32 0.25 7.72 2.96 0.01 -1.44 118.68 125.49 3ghs s LEU 190 Ca 0.27 -2.25 0.21 0.00 -0.22 0.00 0.00 54.13 52.13 3ghs s LEU 190 Cb 0.20 0.97 0.07 0.00 0.50 0.00 0.00 46.19 47.92 3ghs s LEU 190 CO 0.48 -0.10 1.19 0.71 -1.32 0.00 0.00 176.35 177.31 3ghs h THR 191 N 4.85 0.18 -2.28 3.68 1.35 -1.80 -2.50 112.91 116.39 3ghs h THR 191 Ca 0.14 -1.31 -0.28 0.00 -0.55 0.00 0.00 66.41 64.41 3ghs h THR 191 Cb 1.03 1.82 -0.00 0.00 -1.73 0.00 0.00 68.15 69.27 3ghs h THR 191 CO 0.15 0.10 -0.38 0.00 -0.25 0.00 0.00 175.52 175.15 3ghs n GLN 192 N -2.88 -1.61 -0.23 4.72 1.13 -1.26 -4.87 117.38 112.38 3ghs n GLN 192 Ca -0.00 0.68 -0.03 0.00 -1.94 0.00 0.00 57.00 55.70 3ghs n GLN 192 Cb 0.62 -4.97 0.08 0.00 0.11 0.00 0.00 30.24 26.08 3ghs n GLN 192 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 3ghs h GLU 193 N -0.20 0.73 0.02 -1.09 5.08 -1.99 -1.11 114.58 116.02 3ghs h GLU 193 Ca -0.34 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 57.97 3ghs h GLU 193 Cb 1.25 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.34 3ghs h GLU 193 CO 0.40 0.48 -0.01 -0.22 -1.00 0.00 0.00 179.01 178.66 3ghs h LYS 194 N 0.75 -0.03 -0.31 2.33 3.64 -1.99 -2.20 116.57 118.75 3ghs h LYS 194 Ca 0.28 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.48 3ghs h LYS 194 Cb 0.09 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3ghs h LYS 194 CO -0.14 0.22 -0.50 1.25 -2.27 0.00 0.00 179.45 178.01 3ghs h LEU 195 N -0.28 0.97 -0.13 5.20 5.85 -1.82 -1.96 115.31 123.14 3ghs h LEU 195 Ca -0.00 -0.50 -0.00 0.00 0.84 0.00 0.00 57.88 58.22 3ghs h LEU 195 Cb 0.26 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 3ghs h LEU 195 CO 0.01 1.29 0.07 0.40 -0.34 0.00 0.00 178.44 179.87 3ghs h ILE 196 N 0.69 1.10 -0.62 4.05 2.04 -1.24 -1.00 117.51 122.53 3ghs h ILE 196 Ca 0.03 -0.28 -0.06 0.00 1.00 0.00 0.00 64.86 65.56 3ghs h ILE 196 Cb 1.10 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 3ghs h ILE 196 CO 0.11 0.09 0.17 -0.61 0.00 0.00 0.00 178.15 177.91 3ghs h GLN 197 N 0.11 0.97 0.33 2.37 -0.00 -1.28 0.61 115.11 118.22 3ghs h GLN 197 Ca 0.05 -0.20 -0.02 0.00 -0.00 0.00 0.00 58.65 58.48 3ghs h GLN 197 Cb 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 27.48 27.42 3ghs h GLN 197 CO -0.01 0.85 -0.16 -0.92 0.00 0.00 0.00 178.83 178.60 3ghs h TYR 198 N 0.93 -0.41 -0.29 3.99 3.20 -1.21 0.47 116.97 123.66 3ghs h TYR 198 Ca 0.20 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.08 3ghs h TYR 198 Cb 0.31 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 3ghs h TYR 198 CO 0.02 -0.23 0.14 0.00 -1.64 0.00 0.00 178.16 176.45 3ghs h GLN 200 N 0.30 1.03 0.00 0.00 4.20 -0.78 -0.91 115.11 118.95 3ghs h GLN 200 Ca 0.12 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 3ghs h GLN 200 Cb 0.03 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.62 3ghs h GLN 200 CO -0.08 0.79 -0.02 0.66 -0.67 0.00 0.00 178.83 179.51 3ghs h SER 201 N 1.02 0.00 -0.39 1.46 4.64 -0.47 -1.32 113.55 118.50 3ghs h SER 201 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3ghs h SER 201 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 3ghs h SER 201 CO -0.03 0.02 0.00 0.29 -0.87 0.00 0.00 176.83 176.24 3ghs n LYS 202 N -3.17 2.47 -1.01 4.77 4.76 -0.67 -4.96 118.16 120.35 3ghs n LYS 202 Ca -0.01 -2.22 -0.00 0.00 -2.87 0.00 0.00 58.31 53.21 3ghs n LYS 202 Cb 0.21 -1.51 -0.00 0.00 -1.84 0.00 0.00 35.03 31.89 3ghs n LYS 202 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ghs n GLY 203 N 1.49 0.44 3.54 0.72 0.00 -0.50 -5.03 105.19 105.85 3ghs n GLY 203 Ca 0.19 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 3ghs n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ghs s ILE 204 N -2.00 5.04 0.19 -0.61 1.01 -0.44 -4.33 121.20 120.06 3ghs s ILE 204 Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 60.65 60.49 3ghs s ILE 204 Cb 0.00 -3.98 -0.08 0.00 0.01 0.00 0.00 42.46 38.41 3ghs s ILE 204 CO 0.00 -0.27 1.15 -0.69 0.00 0.00 0.00 174.94 175.13 3ghs s VAL 205 N 2.32 3.68 -0.19 2.92 1.01 -0.65 -3.20 120.40 126.30 3ghs s VAL 205 Ca 0.17 1.45 -0.09 0.00 0.00 0.00 0.00 61.98 63.50 3ghs s VAL 205 Cb -0.16 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 3ghs s VAL 205 CO 0.14 0.25 0.12 -0.69 0.00 0.00 0.00 175.10 174.92 3ghs s VAL 206 N -0.21 5.35 -0.19 2.92 1.01 -1.26 -1.33 120.40 126.68 3ghs s VAL 206 Ca 0.51 0.16 -0.08 0.00 0.00 0.00 0.00 61.98 62.58 3ghs s VAL 206 Cb -0.31 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 3ghs s VAL 206 CO 0.36 0.47 0.07 -0.89 0.00 0.00 0.00 175.10 175.11 3ghs s THR 207 N 0.15 4.76 -0.30 3.92 2.01 -0.83 -1.44 115.64 123.91 3ghs s THR 207 Ca 0.08 -0.04 -0.21 0.00 0.31 0.00 0.00 61.69 61.84 3ghs s THR 207 Cb -0.11 -3.16 -0.01 0.00 0.01 0.00 0.00 72.50 69.23 3ghs s THR 207 CO -0.01 0.44 0.64 0.00 -0.69 0.00 0.00 174.62 175.00 3ghs s ALA 208 N 0.56 3.55 0.32 7.40 0.00 0.79 -0.94 121.76 133.44 3ghs s ALA 208 Ca 0.03 -0.59 0.07 0.00 0.00 0.00 0.00 51.96 51.47 3ghs s ALA 208 Cb -0.13 -3.10 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 3ghs s ALA 208 CO 0.01 -1.04 0.43 1.52 0.00 0.00 0.00 175.76 176.68 3ghs s TYR 209 N 2.62 3.12 -1.43 0.00 -0.85 -0.06 -2.95 117.35 117.78 3ghs s TYR 209 Ca 0.26 -0.21 -0.02 0.00 -0.52 0.00 0.00 57.07 56.58 3ghs s TYR 209 Cb -0.15 -1.91 0.02 0.00 0.38 0.00 0.00 41.96 40.30 3ghs s TYR 209 CO 0.11 0.08 0.47 0.43 -1.52 0.00 0.00 175.55 175.12 3ghs n SER 210 N -1.57 -0.68 0.25 -0.18 7.64 -1.26 -2.14 113.62 115.68 3ghs n SER 210 Ca -0.01 -1.00 0.16 0.00 1.01 0.00 0.00 58.87 59.03 3ghs n SER 210 Cb 0.58 -3.06 0.67 0.00 -1.01 0.00 0.00 64.21 61.39 3ghs n SER 210 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3ghs h PRO 211 N -1.81 0.00 -0.25 1.43 0.13 -1.80 -1.09 132.00 128.60 3ghs h PRO 211 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 3ghs h PRO 211 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 3ghs h PRO 211 CO 0.64 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.69 3ghs n LEU 212 N -2.89 2.69 0.00 1.56 4.77 -1.26 -4.80 117.00 117.08 3ghs n LEU 212 Ca 0.01 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 54.88 3ghs n LEU 212 Cb 0.27 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 3ghs n LEU 212 CO 0.25 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 3ghs n GLY 213 N 1.34 0.48 3.89 -0.72 0.00 -0.41 -4.43 105.19 105.34 3ghs n GLY 213 Ca 0.18 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 3ghs n GLY 213 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ghs n SER 214 N 1.11 -4.61 0.30 1.61 2.88 -1.26 -4.82 113.62 108.83 3ghs n SER 214 Ca 0.00 -1.16 0.20 0.00 -1.33 0.00 0.00 58.87 56.58 3ghs n SER 214 Cb 0.00 -2.52 1.01 0.00 -0.75 0.00 0.00 64.21 61.96 3ghs n SER 214 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3ghs h PRO 215 N -2.27 0.00 -0.34 -1.46 0.13 -1.98 -1.26 132.00 124.82 3ghs h PRO 215 Ca -0.69 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 3ghs h PRO 215 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 3ghs h PRO 215 CO 0.50 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.87 3ghs n ASP 216 N -2.94 2.52 -4.77 1.44 5.75 -1.26 -4.91 116.55 112.37 3ghs n ASP 216 Ca -0.02 -1.89 -0.41 0.00 -0.01 0.00 0.00 54.79 52.46 3ghs n ASP 216 Cb 0.12 -0.22 -0.01 0.00 -1.03 0.00 0.00 41.12 39.98 3ghs n ASP 216 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ghs s ARG 217 N -1.56 4.16 0.61 0.11 1.70 -0.48 -4.84 118.95 118.65 3ghs s ARG 217 Ca 0.34 2.50 0.39 0.00 -0.47 0.00 0.00 55.73 58.49 3ghs s ARG 217 Cb 0.19 -3.00 1.87 0.00 -0.57 0.00 0.00 34.95 33.45 3ghs s ARG 217 CO 0.27 -0.47 2.17 -1.35 -1.08 0.00 0.00 175.30 174.84 3ghs h PRO 218 N 3.24 0.00 -0.64 3.89 0.10 -1.93 -1.72 132.00 134.95 3ghs h PRO 218 Ca -0.50 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.60 3ghs h PRO 218 Cb 1.23 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.33 3ghs h PRO 218 CO 0.66 0.00 0.00 -2.67 0.10 0.00 0.00 178.00 176.09 3ghs n TRP 219 N -3.10 1.55 -1.71 0.65 2.14 -1.26 -4.99 117.44 110.72 3ghs n TRP 219 Ca -0.01 -0.63 -0.38 0.00 2.07 0.00 0.00 57.50 58.54 3ghs n TRP 219 Cb 0.19 -0.28 0.04 0.00 -0.81 0.00 0.00 31.31 30.46 3ghs n TRP 219 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 3ghs n ALA 220 N 1.04 1.18 -2.63 -1.67 0.00 -0.65 -5.03 120.51 112.75 3ghs n ALA 220 Ca 0.26 0.10 -0.24 0.00 0.00 0.00 0.00 53.44 53.56 3ghs n ALA 220 Cb 0.93 -2.29 -0.08 0.00 0.00 0.00 0.00 19.45 18.02 3ghs n ALA 220 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3ghs s LYS 221 N -2.84 2.25 0.64 0.00 3.01 -1.26 -5.01 119.74 116.53 3ghs s LYS 221 Ca 0.73 -1.37 0.40 0.00 -1.01 0.00 0.00 55.97 54.72 3ghs s LYS 221 Cb -0.43 -2.17 2.17 0.00 -1.01 0.00 0.00 37.83 36.40 3ghs s LYS 221 CO 0.49 0.38 2.30 -1.00 0.51 0.00 0.00 175.35 178.03 3ghs h PRO 222 N 2.13 0.00 0.00 -1.68 0.13 -2.03 -3.23 132.00 127.33 3ghs h PRO 222 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3ghs h PRO 222 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3ghs h PRO 222 CO 0.59 0.01 -1.13 -0.85 -0.23 0.00 0.00 178.00 176.39 3ghs n GLU 223 N -3.23 0.45 -1.06 0.86 -0.00 -1.26 -5.01 120.64 111.40 3ghs n GLU 223 Ca -0.03 0.02 -0.34 0.00 -0.00 0.00 0.00 57.16 56.81 3ghs n GLU 223 Cb 0.11 -1.67 0.02 0.00 -0.00 0.00 0.00 31.44 29.90 3ghs n GLU 223 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3ghs n ASP 224 N -2.26 -3.83 -4.74 -1.84 8.00 -1.22 -4.94 116.55 105.71 3ghs n ASP 224 Ca 0.00 0.48 -0.36 0.00 0.71 0.00 0.00 54.79 55.62 3ghs n ASP 224 Cb 0.50 -0.74 0.06 0.00 -0.02 0.00 0.00 41.12 40.91 3ghs n ASP 224 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3ghs s PRO 225 N -1.13 2.67 -0.24 -0.24 0.05 -1.26 -5.01 135.00 129.84 3ghs s PRO 225 Ca 0.47 1.87 -0.01 0.00 0.05 0.00 0.00 61.00 63.38 3ghs s PRO 225 Cb -0.37 -1.89 0.07 0.00 0.05 0.00 0.00 34.50 32.36 3ghs s PRO 225 CO 0.63 -1.45 0.01 0.45 0.05 0.00 0.00 177.00 176.69 3ghs s SER 226 N -1.66 3.57 0.17 6.66 0.15 -1.26 -5.01 113.70 116.32 3ghs s SER 226 Ca 0.78 -1.17 -0.15 0.00 0.70 0.00 0.00 55.95 56.11 3ghs s SER 226 Cb -0.32 -0.92 0.11 0.00 -1.71 0.00 0.00 66.02 63.19 3ghs s SER 226 CO 0.38 -0.30 1.74 -0.07 1.20 0.00 0.00 173.24 176.18 3ghs h LEU 227 N 8.07 0.09 -1.98 3.45 3.38 -1.94 -1.86 115.31 124.53 3ghs h LEU 227 Ca -0.16 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3ghs h LEU 227 Cb 1.08 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 3ghs h LEU 227 CO 0.40 0.09 -0.10 -0.07 0.09 0.00 0.00 178.44 178.85 3ghs h LEU 228 N 0.27 0.00 -2.31 1.67 3.38 -1.95 -2.44 115.31 113.92 3ghs h LEU 228 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3ghs h LEU 228 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3ghs h LEU 228 CO -0.23 0.10 0.00 -0.62 0.09 0.00 0.00 178.44 177.78 3ghs n GLU 229 N -3.57 2.31 -2.18 1.13 -0.58 -0.97 -4.86 120.64 111.91 3ghs n GLU 229 Ca -0.02 -2.12 -0.42 0.00 -0.42 0.00 0.00 57.16 54.18 3ghs n GLU 229 Cb 0.22 -1.44 -0.03 0.00 -0.57 0.00 0.00 31.44 29.63 3ghs n GLU 229 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3ghs s ASP 230 N -1.32 6.82 0.40 1.62 -1.08 -0.74 -4.87 116.67 117.50 3ghs s ASP 230 Ca 0.33 2.17 0.06 0.00 -0.52 0.00 0.00 52.55 54.60 3ghs s ASP 230 Cb 0.19 -2.56 0.82 0.00 -1.46 0.00 0.00 42.92 39.91 3ghs s ASP 230 CO 0.27 -0.73 2.04 -0.65 0.52 0.00 0.00 175.17 176.62 3ghs h PRO 231 N 7.83 0.60 -0.12 4.34 0.11 -1.91 -1.03 132.00 141.81 3ghs h PRO 231 Ca -0.39 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 65.51 3ghs h PRO 231 Cb 1.18 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 3ghs h PRO 231 CO 0.90 0.39 -0.65 0.00 -0.21 0.00 0.00 178.00 178.43 3ghs h ARG 232 N 0.61 0.48 0.01 1.05 3.08 -1.97 -1.73 114.38 115.92 3ghs h ARG 232 Ca 0.18 -0.35 -0.24 0.00 0.07 0.00 0.00 59.98 59.64 3ghs h ARG 232 Cb -0.03 0.06 0.02 0.00 0.08 0.00 0.00 29.97 30.10 3ghs h ARG 232 CO -0.04 0.97 -0.95 0.82 -1.07 0.00 0.00 179.97 179.70 3ghs h ILE 233 N 0.35 1.32 -0.95 2.04 2.04 -1.68 -2.95 117.51 117.67 3ghs h ILE 233 Ca -0.02 -2.23 0.12 0.00 1.00 0.00 0.00 64.86 63.74 3ghs h ILE 233 Cb 1.22 2.47 -0.08 0.00 -0.74 0.00 0.00 36.82 39.69 3ghs h ILE 233 CO 0.12 0.68 0.60 0.11 0.00 0.00 0.00 178.15 179.66 3ghs h LYS 234 N 0.26 0.87 -0.51 2.37 1.57 -1.12 -1.06 116.57 118.95 3ghs h LYS 234 Ca -0.12 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 3ghs h LYS 234 Cb 1.63 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 33.72 3ghs h LYS 234 CO 0.19 0.58 -0.06 0.00 -0.57 0.00 0.00 179.45 179.59 3ghs h ALA 235 N 1.56 0.69 -0.56 3.86 0.00 -1.25 0.22 119.26 123.77 3ghs h ALA 235 Ca 0.46 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3ghs h ALA 235 Cb 0.51 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3ghs h ALA 235 CO -0.22 0.56 0.30 0.82 0.00 0.00 0.00 179.25 180.71 3ghs h ILE 236 N 0.80 1.19 -0.41 0.00 2.04 -1.25 -1.76 117.51 118.12 3ghs h ILE 236 Ca 0.14 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.52 3ghs h ILE 236 Cb 0.60 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 3ghs h ILE 236 CO 0.04 0.20 0.27 0.00 0.00 0.00 0.00 178.15 178.66 3ghs h ALA 237 N 1.13 0.52 -0.87 1.87 0.00 -0.90 -2.59 119.26 118.41 3ghs h ALA 237 Ca 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3ghs h ALA 237 Cb 0.05 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3ghs h ALA 237 CO -0.03 -0.03 0.51 0.00 0.00 0.00 0.00 179.25 179.70 3ghs h ALA 238 N 1.15 1.25 -0.63 0.00 0.00 -0.72 -0.82 119.26 119.50 3ghs h ALA 238 Ca 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3ghs h ALA 238 Cb -0.06 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.35 3ghs h ALA 238 CO -0.04 0.63 0.40 -0.22 0.00 0.00 0.00 179.25 180.02 3ghs h LYS 239 N 1.21 0.83 -0.17 0.00 3.64 -0.98 -1.65 116.57 119.45 3ghs h LYS 239 Ca 0.31 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 3ghs h LYS 239 Cb -0.02 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 3ghs h LYS 239 CO -0.06 0.56 0.00 0.72 -2.27 0.00 0.00 179.45 178.41 3ghs n HIS 240 N -4.43 0.21 -3.80 1.91 8.25 -0.72 -4.95 115.22 111.69 3ghs n HIS 240 Ca 0.06 -0.11 -0.26 0.00 -0.26 0.00 0.00 57.72 57.16 3ghs n HIS 240 Cb 0.05 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.19 3ghs n HIS 240 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3ghs n ASN 241 N 0.68 -3.47 -4.41 0.41 3.02 -0.43 -5.00 115.26 106.07 3ghs n ASN 241 Ca 0.17 -0.77 -0.20 0.00 -0.03 0.00 0.00 54.58 53.75 3ghs n ASN 241 Cb 0.43 -4.06 -0.10 0.00 -0.61 0.00 0.00 39.78 35.43 3ghs n ASN 241 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3ghs s LYS 242 N -6.33 1.57 0.63 3.52 -0.14 -0.52 -5.03 119.74 113.43 3ghs s LYS 242 Ca 0.39 -1.85 -0.08 0.00 -1.36 0.00 0.00 55.97 53.06 3ghs s LYS 242 Cb -0.19 -0.72 0.00 0.00 -1.68 0.00 0.00 37.83 35.24 3ghs s LYS 242 CO 0.81 -0.19 0.98 0.95 -0.76 0.00 0.00 175.35 177.14 3ghs s THR 243 N -3.40 3.84 0.23 2.17 -4.23 -1.26 -4.11 115.64 108.88 3ghs s THR 243 Ca 0.36 0.30 -0.07 0.00 -1.18 0.00 0.00 61.69 61.10 3ghs s THR 243 Cb 0.08 -3.55 0.21 0.00 1.34 0.00 0.00 72.50 70.58 3ghs s THR 243 CO 0.14 -0.64 1.86 0.00 -0.54 0.00 0.00 174.62 175.44 3ghs h THR 244 N -0.33 1.26 -0.71 3.99 1.03 -1.91 -1.60 112.91 114.64 3ghs h THR 244 Ca -0.45 -0.64 0.01 0.00 -0.01 0.00 0.00 66.41 65.32 3ghs h THR 244 Cb 1.24 0.02 -0.04 0.00 -1.07 0.00 0.00 68.15 68.30 3ghs h THR 244 CO 0.62 0.29 0.47 0.00 -0.01 0.00 0.00 175.52 176.89 3ghs h ALA 245 N 1.28 0.91 -0.89 0.00 0.00 -1.93 -0.73 119.26 117.89 3ghs h ALA 245 Ca 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3ghs h ALA 245 Cb 0.02 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 3ghs h ALA 245 CO -0.05 0.30 0.51 1.96 0.00 0.00 0.00 179.25 181.96 3ghs h GLN 246 N 0.94 1.23 -0.49 0.00 4.20 -1.72 -0.53 115.11 118.74 3ghs h GLN 246 Ca 0.27 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.83 3ghs h GLN 246 Cb -0.08 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.43 3ghs h GLN 246 CO -0.07 0.89 0.24 0.28 -0.67 0.00 0.00 178.83 179.50 3ghs h VAL 247 N 1.24 1.18 0.00 -0.54 2.07 -0.73 -0.61 116.25 118.86 3ghs h VAL 247 Ca 0.32 -0.51 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 3ghs h VAL 247 Cb -0.00 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3ghs h VAL 247 CO -0.05 0.20 -0.16 -0.07 0.02 0.00 0.00 177.57 177.51 3ghs h LEU 248 N 0.64 0.00 0.19 2.57 3.38 -0.54 -0.87 115.31 120.68 3ghs h LEU 248 Ca 0.17 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.86 3ghs h LEU 248 Cb 0.10 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.87 3ghs h LEU 248 CO -0.02 0.16 -1.29 0.40 0.09 0.00 0.00 178.44 177.78 3ghs h ILE 249 N 0.00 1.27 -0.27 1.22 2.04 -0.93 -3.35 117.51 117.50 3ghs h ILE 249 Ca -0.00 -2.58 -0.06 0.00 1.00 0.00 0.00 64.86 63.22 3ghs h ILE 249 Cb 0.34 3.01 -0.02 0.00 -0.74 0.00 0.00 36.82 39.41 3ghs h ILE 249 CO 0.02 0.77 -0.10 -0.09 0.00 0.00 0.00 178.15 178.75 3ghs h ARG 250 N -0.10 0.44 0.04 2.37 9.65 -0.87 -3.22 114.38 122.69 3ghs h ARG 250 Ca -0.24 -0.11 0.02 0.00 -1.10 0.00 0.00 59.98 58.55 3ghs h ARG 250 Cb 1.93 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 30.40 3ghs h ARG 250 CO 0.19 0.55 -0.51 0.35 2.80 0.00 0.00 179.97 183.34 3ghs h PHE 251 N 0.41 -1.49 -0.19 2.20 3.57 -1.29 -1.87 116.94 118.28 3ghs h PHE 251 Ca 0.08 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 3ghs h PHE 251 Cb 0.43 0.64 -0.01 0.00 2.79 0.00 0.00 35.95 39.81 3ghs h PHE 251 CO 0.01 -0.57 -0.13 -1.00 -2.23 0.00 0.00 178.31 174.39 3ghs h PRO 252 N -0.69 0.30 -0.93 6.41 0.13 -1.74 -2.47 132.00 133.02 3ghs h PRO 252 Ca 0.01 -0.07 0.09 0.00 -0.87 0.00 0.00 66.00 65.16 3ghs h PRO 252 Cb 0.73 -0.04 -0.07 0.00 0.13 0.00 0.00 31.00 31.75 3ghs h PRO 252 CO -0.33 0.44 0.58 0.52 -0.23 0.00 0.00 178.00 178.98 3ghs h MET 253 N 0.28 0.95 0.00 0.86 2.86 -1.39 -0.87 114.93 117.63 3ghs h MET 253 Ca 0.06 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3ghs h MET 253 Cb 0.41 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.85 3ghs h MET 253 CO 0.02 0.63 0.00 1.04 1.06 0.00 0.00 176.91 179.66 3ghs n GLN 254 N -4.62 0.62 -0.28 1.72 6.02 -0.77 -2.11 117.38 117.95 3ghs n GLN 254 Ca 0.15 0.01 0.10 0.00 -0.01 0.00 0.00 57.00 57.25 3ghs n GLN 254 Cb 0.26 -1.50 0.26 0.00 1.02 0.00 0.00 30.24 30.28 3ghs n GLN 254 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3ghs n ARG 255 N -1.18 2.34 -1.85 -1.09 1.74 -0.40 -4.93 116.66 111.30 3ghs n ARG 255 Ca 0.17 -2.08 -0.13 0.00 -0.77 0.00 0.00 57.85 55.04 3ghs n ARG 255 Cb 0.18 -1.46 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 3ghs n ARG 255 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3ghs n ASN 256 N 1.20 -4.23 -4.92 0.55 5.15 -0.90 -5.03 115.26 107.09 3ghs n ASN 256 Ca 0.19 0.13 -0.26 0.00 -0.60 0.00 0.00 54.58 54.05 3ghs n ASN 256 Cb 0.50 -3.16 -0.02 0.00 -0.53 0.00 0.00 39.78 36.57 3ghs n ASN 256 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3ghs s LEU 257 N -3.29 3.99 0.25 1.20 1.43 -0.77 -4.73 118.68 116.76 3ghs s LEU 257 Ca 0.00 0.62 -0.12 0.00 -1.03 0.00 0.00 54.13 53.60 3ghs s LEU 257 Cb 0.00 -3.47 -0.08 0.00 0.03 0.00 0.00 46.19 42.67 3ghs s LEU 257 CO 0.00 -0.28 0.60 -0.69 0.23 0.00 0.00 176.35 176.21 3ghs s VAL 258 N -2.26 4.85 0.00 -1.59 1.01 -0.52 -4.14 120.40 117.74 3ghs s VAL 258 Ca 0.42 0.65 0.00 0.00 0.00 0.00 0.00 61.98 63.05 3ghs s VAL 258 Cb -0.10 -3.63 -0.00 0.00 0.00 0.00 0.00 36.38 32.64 3ghs s VAL 258 CO 0.34 -0.06 -0.01 0.54 0.00 0.00 0.00 175.10 175.91 3ghs s VAL 259 N -1.82 0.03 -0.46 2.92 0.11 0.00 -0.15 120.40 121.04 3ghs s VAL 259 Ca 0.48 -0.15 0.09 0.00 -2.93 0.00 0.00 61.98 59.47 3ghs s VAL 259 Cb -0.11 -0.06 0.33 0.00 -1.53 0.00 0.00 36.38 35.01 3ghs s VAL 259 CO 0.20 -0.07 0.78 2.30 -3.33 0.00 0.00 175.10 174.98 3ghs n ILE 260 N 2.85 1.02 -1.76 7.04 -5.35 -1.15 -1.27 119.36 120.72 3ghs n ILE 260 Ca -0.14 -4.90 -0.41 0.00 -0.27 0.00 0.00 62.75 57.03 3ghs n ILE 260 Cb 0.59 -0.94 0.01 0.00 -1.74 0.00 0.00 39.64 37.56 3ghs n ILE 260 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 3ghs n PRO 261 N 0.26 2.47 -3.77 6.28 -0.04 -1.22 -3.28 135.00 135.71 3ghs n PRO 261 Ca 0.27 0.87 -0.36 0.00 -0.04 0.00 0.00 63.50 64.24 3ghs n PRO 261 Cb 0.54 -2.63 -0.07 0.00 -0.04 0.00 0.00 33.50 31.30 3ghs n PRO 261 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3ghs s LYS 262 N -2.23 3.82 -0.03 0.54 2.36 -1.26 -1.39 119.74 121.55 3ghs s LYS 262 Ca 0.56 -0.11 -0.20 0.00 -2.55 0.00 0.00 55.97 53.68 3ghs s LYS 262 Cb -0.47 -3.30 0.04 0.00 -1.05 0.00 0.00 37.83 33.05 3ghs s LYS 262 CO 0.61 0.55 0.43 0.45 1.55 0.00 0.00 175.35 178.94 3ghs s SER 263 N -0.39 -0.34 0.00 1.43 0.15 -1.26 -4.94 113.70 108.35 3ghs s SER 263 Ca 0.13 0.31 0.12 0.00 0.70 0.00 0.00 55.95 57.21 3ghs s SER 263 Cb -0.12 0.41 0.29 0.00 -1.71 0.00 0.00 66.02 64.89 3ghs s SER 263 CO 0.02 -0.48 1.20 1.33 1.20 0.00 0.00 173.24 176.52 3ghs n VAL 264 N 1.24 0.82 -3.38 4.45 0.24 -1.26 -4.89 118.33 115.55 3ghs n VAL 264 Ca -0.20 -0.91 -0.40 0.00 -2.04 0.00 0.00 64.34 60.78 3ghs n VAL 264 Cb 0.56 0.64 -0.09 0.00 -1.47 0.00 0.00 33.84 33.48 3ghs n VAL 264 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3ghs s THR 265 N -1.00 5.15 0.27 3.34 2.01 -1.26 -4.79 115.64 119.36 3ghs s THR 265 Ca 0.23 0.18 -0.00 0.00 0.31 0.00 0.00 61.69 62.41 3ghs s THR 265 Cb 0.13 -3.81 0.26 0.00 0.01 0.00 0.00 72.50 69.08 3ghs s THR 265 CO 0.17 -0.06 1.81 -0.65 -0.69 0.00 0.00 174.62 175.20 3ghs h PRO 266 N 8.41 0.83 -0.47 4.92 0.11 -1.97 -0.14 132.00 143.70 3ghs h PRO 266 Ca -0.30 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.69 3ghs h PRO 266 Cb 1.15 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 3ghs h PRO 266 CO 0.69 0.55 0.00 0.93 -0.21 0.00 0.00 178.00 179.97 3ghs h GLU 267 N 0.86 0.77 -0.14 1.05 3.07 -2.00 -1.99 114.58 116.20 3ghs h GLU 267 Ca 0.47 -0.20 -0.21 0.00 -0.50 0.00 0.00 59.36 58.92 3ghs h GLU 267 Cb 0.51 -0.09 0.01 0.00 -0.84 0.00 0.00 28.75 28.33 3ghs h GLU 267 CO -0.28 0.78 -0.75 0.00 -1.40 0.00 0.00 179.01 177.35 3ghs h ARG 268 N 0.72 0.68 -0.36 2.33 3.08 -1.62 -1.60 114.38 117.61 3ghs h ARG 268 Ca 0.14 -0.55 0.07 0.00 0.07 0.00 0.00 59.98 59.71 3ghs h ARG 268 Cb 0.44 0.11 -0.07 0.00 0.08 0.00 0.00 29.97 30.53 3ghs h ARG 268 CO 0.02 1.16 -0.07 0.82 -1.07 0.00 0.00 179.97 180.83 3ghs h ILE 269 N 0.47 0.66 -0.19 2.04 2.04 -0.85 1.00 117.51 122.68 3ghs h ILE 269 Ca -0.04 -0.01 -0.12 0.00 1.00 0.00 0.00 64.86 65.69 3ghs h ILE 269 Cb 1.36 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 3ghs h ILE 269 CO 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 178.15 177.95 3ghs h ALA 270 N 1.35 0.29 -0.70 1.87 0.00 -1.33 -3.04 119.26 117.70 3ghs h ALA 270 Ca 0.17 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 3ghs h ALA 270 Cb 0.26 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3ghs h ALA 270 CO -0.35 0.36 0.17 1.49 0.00 0.00 0.00 179.25 180.92 3ghs h GLU 271 N 0.23 1.13 -0.06 0.00 4.81 -1.21 -2.97 114.58 116.51 3ghs h GLU 271 Ca 0.01 -0.27 -0.00 0.00 -0.13 0.00 0.00 59.36 58.97 3ghs h GLU 271 Cb 0.95 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.18 3ghs h GLU 271 CO 0.08 0.99 0.03 -0.91 -0.73 0.00 0.00 179.01 178.47 3ghs h ASN 272 N 1.07 0.07 1.34 1.04 2.35 -0.69 -0.84 115.58 119.92 3ghs h ASN 272 Ca 0.22 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 3ghs h ASN 272 Cb 0.37 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.72 3ghs h ASN 272 CO 0.00 0.06 0.00 0.15 -1.65 0.00 0.00 177.43 175.99 3ghs h PHE 273 N 0.08 0.00 -1.13 1.19 3.57 -1.41 -3.39 116.94 115.85 3ghs h PHE 273 Ca 0.02 0.00 -0.74 0.00 3.53 0.00 0.00 57.97 60.78 3ghs h PHE 273 Cb 0.01 0.00 -0.12 0.00 2.79 0.00 0.00 35.95 38.62 3ghs h PHE 273 CO 0.00 0.00 2.38 1.63 -2.23 0.00 0.00 178.31 180.09 3ghs n LYS 274 N -2.40 4.10 0.00 1.11 5.02 -0.32 -4.36 118.16 121.31 3ghs n LYS 274 Ca 0.04 -3.38 0.00 0.00 -2.02 0.00 0.00 58.31 52.96 3ghs n LYS 274 Cb 0.39 -2.78 0.00 0.00 -0.02 0.00 0.00 35.03 32.62 3ghs n LYS 274 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 3ghs n VAL 275 N 2.57 0.26 0.78 -0.18 0.24 -1.26 -4.82 118.33 115.93 3ghs n VAL 275 Ca 0.54 -0.39 0.12 0.00 -2.04 0.00 0.00 64.34 62.58 3ghs n VAL 275 Cb 0.29 1.11 0.21 0.00 -1.47 0.00 0.00 33.84 33.98 3ghs n VAL 275 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3ghs n PHE 276 N -0.13 0.22 -1.49 6.34 3.72 -1.26 -4.46 117.46 120.40 3ghs n PHE 276 Ca 0.00 -0.11 0.07 0.00 -0.05 0.00 0.00 57.45 57.35 3ghs n PHE 276 Cb 0.25 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 38.91 3ghs n PHE 276 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3ghs n ASP 277 N 1.22 1.65 -4.05 4.37 5.75 -1.26 -1.64 116.55 122.58 3ghs n ASP 277 Ca 0.17 -2.98 -0.11 0.00 -0.01 0.00 0.00 54.79 51.86 3ghs n ASP 277 Cb 0.56 -0.40 -0.08 0.00 -1.03 0.00 0.00 41.12 40.17 3ghs n ASP 277 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3ghs s PHE 278 N -2.17 0.85 -0.02 2.11 -0.71 -1.26 -5.08 117.98 111.69 3ghs s PHE 278 Ca 0.28 -1.12 -0.00 0.00 -1.04 0.00 0.00 56.93 55.04 3ghs s PHE 278 Cb 0.26 -0.24 0.03 0.00 -1.21 0.00 0.00 43.02 41.86 3ghs s PHE 278 CO -0.02 -0.81 0.04 -1.21 -1.34 0.00 0.00 175.22 171.88 3ghs s GLU 279 N -4.03 -0.03 0.27 1.99 2.02 -1.26 -4.90 118.70 112.76 3ghs s GLU 279 Ca 0.32 0.21 -0.29 0.00 0.02 0.00 0.00 54.97 55.23 3ghs s GLU 279 Cb 0.03 -0.26 -0.09 0.00 0.10 0.00 0.00 34.13 33.91 3ghs s GLU 279 CO 0.12 -0.18 1.09 -0.51 0.02 0.00 0.00 175.26 175.80 3ghs s LEU 280 N 1.14 4.56 0.91 1.80 1.43 -1.26 -5.05 118.68 122.20 3ghs s LEU 280 Ca -0.08 2.24 -0.12 0.00 -1.03 0.00 0.00 54.13 55.14 3ghs s LEU 280 Cb -0.13 -3.62 0.13 0.00 0.03 0.00 0.00 46.19 42.60 3ghs s LEU 280 CO -0.03 -0.13 1.10 -0.94 0.23 0.00 0.00 176.35 176.58 3ghs s SER 281 N -0.86 3.47 0.30 2.29 1.04 -1.26 -4.83 113.70 113.86 3ghs s SER 281 Ca 0.44 1.26 -0.02 0.00 0.48 0.00 0.00 55.95 58.12 3ghs s SER 281 Cb -0.31 -1.93 0.45 0.00 0.10 0.00 0.00 66.02 64.33 3ghs s SER 281 CO 0.40 -2.61 1.97 0.77 0.98 0.00 0.00 173.24 174.75 3ghs h SER 282 N -1.53 0.95 -0.64 7.02 4.64 -1.99 -0.08 113.55 121.92 3ghs h SER 282 Ca -0.50 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 60.75 3ghs h SER 282 Cb 1.30 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 63.13 3ghs h SER 282 CO 0.58 0.68 0.23 -0.61 -0.87 0.00 0.00 176.83 176.84 3ghs h GLN 283 N 1.11 0.97 -0.47 4.77 4.15 -1.99 0.07 115.11 123.73 3ghs h GLN 283 Ca 0.31 -0.19 0.03 0.00 0.77 0.00 0.00 58.65 59.56 3ghs h GLN 283 Cb -0.11 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.40 3ghs h GLN 283 CO -0.07 0.83 0.26 -0.44 -1.93 0.00 0.00 178.83 177.49 3ghs h ASP 284 N 0.90 0.41 -0.23 -0.69 3.32 -1.72 0.30 116.42 118.71 3ghs h ASP 284 Ca 0.21 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 3ghs h ASP 284 Cb 0.25 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3ghs h ASP 284 CO -0.01 0.29 0.14 0.24 -1.72 0.00 0.00 179.24 178.18 3ghs h MET 285 N 0.53 0.32 -0.52 3.56 2.86 -0.60 0.25 114.93 121.32 3ghs h MET 285 Ca 0.19 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.72 3ghs h MET 285 Cb 0.05 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 3ghs h MET 285 CO -0.11 0.28 0.02 1.15 1.06 0.00 0.00 176.91 179.31 3ghs h THR 286 N 0.28 1.25 -0.31 2.22 2.02 -0.85 -0.68 112.91 116.84 3ghs h THR 286 Ca 0.08 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.23 3ghs h THR 286 Cb 0.04 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 3ghs h THR 286 CO -0.01 0.37 0.14 0.74 0.37 0.00 0.00 175.52 177.12 3ghs h THR 287 N 0.81 1.16 -0.90 3.16 2.02 -0.71 -1.24 112.91 117.22 3ghs h THR 287 Ca 0.16 -0.48 -0.02 0.00 0.77 0.00 0.00 66.41 66.84 3ghs h THR 287 Cb 0.46 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.74 3ghs h THR 287 CO 0.02 0.17 0.50 -0.07 0.37 0.00 0.00 175.52 176.51 3ghs h LEU 288 N 0.35 1.12 -1.79 2.58 3.38 -0.66 -1.60 115.31 118.69 3ghs h LEU 288 Ca 0.10 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3ghs h LEU 288 Cb 0.14 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3ghs h LEU 288 CO -0.01 0.89 -0.07 -0.07 0.09 0.00 0.00 178.44 179.27 3ghs h LEU 289 N 1.25 0.03 -0.92 1.67 3.38 -0.86 -2.29 115.31 117.58 3ghs h LEU 289 Ca 0.32 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 3ghs h LEU 289 Cb 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3ghs h LEU 289 CO -0.05 0.11 0.00 -1.54 0.09 0.00 0.00 178.44 177.05 3ghs n SER 290 N -4.43 0.64 -0.11 -0.43 3.41 -0.49 -2.43 113.62 109.78 3ghs n SER 290 Ca -0.02 0.69 0.14 0.00 -0.26 0.00 0.00 58.87 59.42 3ghs n SER 290 Cb 0.16 -0.82 0.77 0.00 -0.26 0.00 0.00 64.21 64.07 3ghs n SER 290 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3ghs n TYR 291 N -2.24 0.01 -1.69 7.33 4.01 -0.86 -4.91 117.16 118.81 3ghs n TYR 291 Ca 0.01 -0.01 -0.44 0.00 -0.16 0.00 0.00 57.90 57.31 3ghs n TYR 291 Cb 0.17 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.18 3ghs n TYR 291 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3ghs n ASN 292 N -0.69 2.90 -0.07 7.72 5.15 -0.45 -4.36 115.26 125.46 3ghs n ASN 292 Ca 0.21 1.16 0.00 0.00 -0.60 0.00 0.00 54.58 55.36 3ghs n ASN 292 Cb 0.16 -1.47 0.01 0.00 -0.53 0.00 0.00 39.78 37.94 3ghs n ASN 292 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3ghs n ARG 293 N 1.58 0.61 -3.25 1.20 1.74 -0.66 -4.98 116.66 112.91 3ghs n ARG 293 Ca 0.09 -0.84 -0.23 0.00 -0.77 0.00 0.00 57.85 56.10 3ghs n ARG 293 Cb 0.34 -0.64 0.01 0.00 -1.02 0.00 0.00 32.46 31.15 3ghs n ARG 293 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3ghs n ASN 294 N -0.15 -4.61 -4.41 0.55 3.02 -0.52 -4.88 115.26 104.25 3ghs n ASN 294 Ca 0.01 -0.36 -0.44 0.00 -0.03 0.00 0.00 54.58 53.76 3ghs n ASN 294 Cb 0.49 -3.77 -0.04 0.00 -0.61 0.00 0.00 39.78 35.85 3ghs n ASN 294 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3ghs s TRP 295 N -3.02 2.85 -0.31 3.10 -0.00 -0.63 -5.00 118.94 115.92 3ghs s TRP 295 Ca 0.37 -0.79 -0.17 0.00 -0.00 0.00 0.00 56.10 55.52 3ghs s TRP 295 Cb -0.18 -4.16 -0.02 0.00 -0.00 0.00 0.00 33.47 29.10 3ghs s TRP 295 CO 0.45 -1.48 0.45 0.50 -0.00 0.00 0.00 176.95 176.88 3ghs s ARG 296 N 3.34 3.83 0.08 5.86 3.52 -1.26 -4.50 118.95 129.83 3ghs s ARG 296 Ca 0.17 -0.03 0.11 0.00 -0.13 0.00 0.00 55.73 55.86 3ghs s ARG 296 Cb -0.20 -3.73 -0.17 0.00 -1.56 0.00 0.00 34.95 29.30 3ghs s ARG 296 CO 0.07 -0.45 1.04 -0.39 -0.81 0.00 0.00 175.30 174.76 3ghs h VAL 297 N 5.49 1.14 -3.47 7.11 -1.51 -1.95 -3.43 116.25 119.63 3ghs h VAL 297 Ca -0.29 -2.82 -0.73 0.00 -1.23 0.00 0.00 66.70 61.63 3ghs h VAL 297 Cb 1.14 2.53 -0.30 0.00 -2.13 0.00 0.00 31.29 32.53 3ghs h VAL 297 CO 0.71 0.65 -0.29 0.00 -1.23 0.00 0.00 177.57 177.41 3ghs s ALA 299 N 0.75 -0.62 -0.27 0.00 0.00 -1.26 -5.06 121.76 115.29 3ghs s ALA 299 Ca 0.11 -0.40 -0.04 0.00 0.00 0.00 0.00 51.96 51.63 3ghs s ALA 299 Cb -0.21 0.80 0.15 0.00 0.00 0.00 0.00 23.12 23.86 3ghs s ALA 299 CO -0.03 -0.71 0.52 -1.17 0.00 0.00 0.00 175.76 174.37 3ghs s LEU 300 N -2.89 -1.04 0.27 0.00 2.96 -1.26 -5.04 118.68 111.68 3ghs s LEU 300 Ca 0.10 0.81 -0.02 0.00 -0.22 0.00 0.00 54.13 54.80 3ghs s LEU 300 Cb 0.01 1.78 0.41 0.00 0.50 0.00 0.00 46.19 48.89 3ghs s LEU 300 CO -0.04 -0.26 1.90 0.25 -1.32 0.00 0.00 176.35 176.87 3ghs h LEU 301 N 8.08 1.03 -2.89 -0.68 5.85 -2.01 -1.91 115.31 122.79 3ghs h LEU 301 Ca -0.20 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 3ghs h LEU 301 Cb 1.14 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 3ghs h LEU 301 CO 0.22 0.68 -0.00 0.77 -0.34 0.00 0.00 178.44 179.77 3ghs h SER 302 N 1.18 0.00 -0.01 1.25 4.64 -1.97 -2.02 113.55 116.62 3ghs h SER 302 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 3ghs h SER 302 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3ghs h SER 302 CO -0.15 0.00 -0.42 0.00 -0.87 0.00 0.00 176.83 175.39 3ghs n THR 304 N -0.20 1.15 0.73 0.00 -2.24 -0.76 -1.55 114.28 111.42 3ghs n THR 304 Ca 0.07 0.37 0.12 0.00 -2.27 0.00 0.00 64.05 62.35 3ghs n THR 304 Cb 0.38 -1.26 0.49 0.00 -2.10 0.00 0.00 70.33 67.83 3ghs n THR 304 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3ghs n SER 305 N -1.84 0.31 -4.76 3.42 3.41 -1.26 -4.90 113.62 108.00 3ghs n SER 305 Ca 0.02 0.54 -0.39 0.00 -0.26 0.00 0.00 58.87 58.78 3ghs n SER 305 Cb 0.13 -0.62 -0.06 0.00 -0.26 0.00 0.00 64.21 63.40 3ghs n SER 305 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3ghs s HIS 306 N -3.07 3.92 0.50 7.33 5.04 -0.60 -4.95 115.29 123.46 3ghs s HIS 306 Ca 0.11 1.83 0.35 0.00 -1.54 0.00 0.00 55.06 55.81 3ghs s HIS 306 Cb 0.14 -2.92 1.88 0.00 0.04 0.00 0.00 32.58 31.72 3ghs s HIS 306 CO 0.48 0.43 2.21 1.57 -2.34 0.00 0.00 174.74 177.09 3ghs h LYS 307 N 4.00 0.00 -0.47 2.88 2.10 -1.90 -1.59 116.57 121.59 3ghs h LYS 307 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 3ghs h LYS 307 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3ghs h LYS 307 CO 0.67 0.04 0.00 -0.25 -2.00 0.00 0.00 179.45 177.91 3ghs n ASP 308 N -3.40 4.08 -4.73 7.07 8.00 -1.26 -4.99 116.55 121.32 3ghs n ASP 308 Ca -0.02 -2.49 -0.42 0.00 0.71 0.00 0.00 54.79 52.57 3ghs n ASP 308 Cb 0.15 -0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 40.75 3ghs n ASP 308 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ghs n TYR 309 N 0.53 2.80 0.28 1.24 9.36 -0.60 -4.42 117.16 126.35 3ghs n TYR 309 Ca 0.21 0.10 0.12 0.00 3.32 0.00 0.00 57.90 61.65 3ghs n TYR 309 Cb 0.78 -2.66 0.11 0.00 -0.63 0.00 0.00 39.34 36.95 3ghs n TYR 309 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 3ghs h PRO 310 N 6.20 0.00 -6.09 2.98 0.13 -1.91 -3.46 132.00 129.84 3ghs h PRO 310 Ca -0.44 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.01 3ghs h PRO 310 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.19 3ghs h PRO 310 CO 0.91 0.00 -0.65 -0.06 -0.23 0.00 0.00 178.00 177.97 3ghs s PHE 311 N -3.26 3.07 0.00 1.56 0.08 -1.26 -3.99 117.98 114.18 3ghs s PHE 311 Ca 0.04 0.11 0.00 0.00 0.12 0.00 0.00 56.93 57.20 3ghs s PHE 311 Cb 0.09 -1.72 0.00 0.00 -0.57 0.00 0.00 43.02 40.83 3ghs s PHE 311 CO 0.73 0.44 0.00 0.72 -0.10 0.00 0.00 175.22 177.01 3ghs n HIS 312 N 1.81 0.00 -0.25 0.36 8.25 -1.26 -5.09 115.22 119.04 3ghs n HIS 312 Ca -0.17 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.22 3ghs n HIS 312 Cb 0.53 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.64 3ghs n HIS 312 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3ghs n GLU 313 N -2.44 0.00 -0.32 -0.41 4.71 -1.26 -5.11 120.64 115.82 3ghs n GLU 313 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 57.16 57.11 3ghs n GLU 313 Cb 0.00 -0.20 0.08 0.00 -1.01 0.00 0.00 31.44 30.32 3ghs n GLU 313 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 3ghs h GLU 314 N 0.01 1.14 0.00 3.49 4.22 -1.98 -3.50 114.58 117.96 3ghs h GLU 314 Ca -0.08 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 59.28 3ghs h GLU 314 Cb 0.28 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3ghs h GLU 314 CO 0.08 0.77 0.00 1.97 -2.18 0.00 0.00 179.01 179.65