#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a3c s SER 40 N 0.00 -0.28 0.92 0.00 1.04 -0.13 -4.95 113.70 110.31 2a3c s SER 40 Ca 0.00 0.44 -0.11 0.00 0.48 0.00 0.00 55.95 56.76 2a3c s SER 40 Cb 0.00 0.41 0.15 0.00 0.10 0.00 0.00 66.02 66.67 2a3c s SER 40 CO 0.00 -0.17 1.10 -0.94 0.98 0.00 0.00 173.24 174.21 2a3c s SER 41 N -0.43 3.07 0.00 7.02 1.04 -1.26 -0.31 113.70 122.83 2a3c s SER 41 Ca 0.03 1.77 0.00 0.00 0.48 0.00 0.00 55.95 58.24 2a3c s SER 41 Cb -0.03 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.71 2a3c s SER 41 CO -0.06 -2.94 0.00 0.61 0.98 0.00 0.00 173.24 171.83 2a3c n GLY 42 N -0.41 -1.95 3.80 7.32 0.00 -1.26 -4.49 105.19 108.20 2a3c n GLY 42 Ca 0.08 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.56 2a3c n GLY 42 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2a3c s TYR 43 N -2.47 3.39 0.06 1.61 2.02 -0.16 -3.97 117.35 117.84 2a3c s TYR 43 Ca 0.00 1.67 0.00 0.00 -0.37 0.00 0.00 57.07 58.37 2a3c s TYR 43 Cb 0.00 -2.96 -0.04 0.00 -0.40 0.00 0.00 41.96 38.56 2a3c s TYR 43 CO 0.00 -0.19 0.20 1.03 -1.57 0.00 0.00 175.55 175.01 2a3c s ARG 44 N -2.66 3.38 -0.32 -0.62 0.52 -0.03 -0.37 118.95 118.85 2a3c s ARG 44 Ca 0.58 -0.47 0.00 0.00 -0.52 0.00 0.00 55.73 55.32 2a3c s ARG 44 Cb -0.16 -3.01 0.10 0.00 0.52 0.00 0.00 34.95 32.41 2a3c s ARG 44 CO 0.20 0.60 0.09 0.45 0.02 0.00 0.00 175.30 176.67 2a3c s SER 45 N -2.52 4.20 -0.09 0.23 0.15 -1.26 -0.76 113.70 113.66 2a3c s SER 45 Ca 0.34 -1.77 0.01 0.00 0.70 0.00 0.00 55.95 55.23 2a3c s SER 45 Cb -0.13 -1.04 -0.03 0.00 -1.71 0.00 0.00 66.02 63.11 2a3c s SER 45 CO 0.27 -0.41 -0.09 -0.69 1.20 0.00 0.00 173.24 173.53 2a3c s VAL 46 N 1.43 3.52 -0.04 4.45 1.01 0.58 -0.46 120.40 130.89 2a3c s VAL 46 Ca 0.10 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 2a3c s VAL 46 Cb -0.18 -2.45 0.01 0.00 0.00 0.00 0.00 36.38 33.77 2a3c s VAL 46 CO -0.21 0.57 0.12 0.54 0.00 0.00 0.00 175.10 176.12 2a3c s VAL 47 N -0.47 -0.00 0.09 2.92 0.11 -0.85 -0.83 120.40 121.37 2a3c s VAL 47 Ca 0.07 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.84 2a3c s VAL 47 Cb -0.12 -0.17 -0.06 0.00 -1.53 0.00 0.00 36.38 34.50 2a3c s VAL 47 CO 0.02 0.00 0.86 -0.31 -3.33 0.00 0.00 175.10 172.34 2a3c s TYR 48 N 0.07 3.79 -0.24 1.54 1.51 -0.73 -0.86 117.35 122.42 2a3c s TYR 48 Ca -0.00 1.64 0.00 0.00 -1.01 0.00 0.00 57.07 57.71 2a3c s TYR 48 Cb -0.01 -2.93 0.04 0.00 -0.11 0.00 0.00 41.96 38.95 2a3c s TYR 48 CO 0.00 0.27 -0.10 0.12 -1.11 0.00 0.00 175.55 174.72 2a3c s PHE 49 N -0.14 3.09 -0.07 2.71 2.19 0.08 -0.57 117.98 125.26 2a3c s PHE 49 Ca 0.42 -1.86 -0.18 0.00 0.33 0.00 0.00 56.93 55.64 2a3c s PHE 49 Cb -0.22 -1.99 -0.05 0.00 -1.31 0.00 0.00 43.02 39.45 2a3c s PHE 49 CO 0.27 -0.80 0.48 0.14 1.83 0.00 0.00 175.22 177.13 2a3c s VAL 50 N 1.24 5.09 -0.17 3.12 -7.23 -1.26 -1.64 120.40 119.54 2a3c s VAL 50 Ca -0.02 0.98 0.26 0.00 -1.81 0.00 0.00 61.98 61.39 2a3c s VAL 50 Cb -0.17 -3.81 0.27 0.00 0.56 0.00 0.00 36.38 33.23 2a3c s VAL 50 CO -0.06 0.40 1.79 -0.55 -0.31 0.00 0.00 175.10 176.38 2a3c h ASN 51 N 6.04 0.00 -0.03 4.85 7.08 -1.21 0.05 115.58 132.36 2a3c h ASN 51 Ca -0.44 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.78 2a3c h ASN 51 Cb 1.19 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.43 2a3c h ASN 51 CO 0.71 0.00 0.00 -2.67 -2.08 0.00 0.00 177.43 173.39 2a3c n TRP 52 N -2.43 0.03 0.33 4.14 2.14 -1.26 -3.65 117.44 116.74 2a3c n TRP 52 Ca -0.00 -0.02 0.15 0.00 2.07 0.00 0.00 57.50 59.70 2a3c n TRP 52 Cb 0.14 0.00 0.62 0.00 -0.81 0.00 0.00 31.31 31.25 2a3c n TRP 52 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2a3c h ALA 53 N 4.10 1.00 0.00 -1.67 0.00 -1.25 -2.73 119.26 118.71 2a3c h ALA 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2a3c h ALA 53 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2a3c h ALA 53 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.69 2a3c n ILE 54 N -2.61 0.41 0.00 0.00 -5.35 -1.19 -0.47 119.36 110.16 2a3c n ILE 54 Ca 0.01 0.10 0.00 0.00 -0.27 0.00 0.00 62.75 62.59 2a3c n ILE 54 Cb 0.23 -0.72 0.00 0.00 -1.74 0.00 0.00 39.64 37.41 2a3c n ILE 54 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2a3c n TYR 55 N -1.43 0.00 -0.19 4.28 4.01 -1.03 -4.31 117.16 118.49 2a3c n TYR 55 Ca 0.07 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.87 2a3c n TYR 55 Cb 0.23 0.00 0.34 0.00 -0.31 0.00 0.00 39.34 39.60 2a3c n TYR 55 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2a3c h GLY 56 N 0.00 0.99 2.00 2.72 0.00 -1.82 0.16 103.07 107.12 2a3c h GLY 56 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2a3c h GLY 56 CO 0.00 0.24 0.00 3.21 0.00 0.00 0.00 176.54 179.99 2a3c h ARG 57 N 0.79 0.00 -6.70 4.80 3.08 -1.83 -3.46 114.38 111.05 2a3c h ARG 57 Ca 0.31 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.82 2a3c h ARG 57 Cb 0.23 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.20 2a3c h ARG 57 CO -0.10 0.00 -0.93 -1.71 -1.07 0.00 0.00 179.97 176.15 2a3c n ASN 58 N -2.30 -0.89 -4.03 7.04 5.15 0.04 -4.95 115.26 115.33 2a3c n ASN 58 Ca 0.02 -1.13 -0.28 0.00 -0.60 0.00 0.00 54.58 52.59 2a3c n ASN 58 Cb 0.25 -2.47 -0.17 0.00 -0.53 0.00 0.00 39.78 36.86 2a3c n ASN 58 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 2a3c s HIS 59 N -3.99 1.89 0.28 1.20 2.46 0.38 -4.99 115.29 112.53 2a3c s HIS 59 Ca 0.11 -0.91 0.12 0.00 0.47 0.00 0.00 55.06 54.85 2a3c s HIS 59 Cb -0.05 -1.39 -0.05 0.00 -0.13 0.00 0.00 32.58 30.96 2a3c s HIS 59 CO 0.93 -0.49 -0.17 -0.80 -2.47 0.00 0.00 174.74 171.75 2a3c s ASN 60 N 1.11 3.74 0.36 9.88 -0.87 -1.26 -3.15 114.94 124.75 2a3c s ASN 60 Ca -0.04 -0.98 0.14 0.00 -1.57 0.00 0.00 52.86 50.41 2a3c s ASN 60 Cb -0.14 -0.38 1.00 0.00 -0.02 0.00 0.00 41.25 41.71 2a3c s ASN 60 CO -0.03 0.02 1.75 -0.65 -2.57 0.00 0.00 177.10 175.63 2a3c h PRO 61 N 2.20 0.47 -0.33 -0.60 0.11 -1.94 0.35 132.00 132.25 2a3c h PRO 61 Ca -0.41 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 65.77 2a3c h PRO 61 Cb 1.26 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2a3c h PRO 61 CO 0.60 0.31 0.38 1.96 -0.21 0.00 0.00 178.00 181.05 2a3c h GLN 62 N 0.48 0.00 -0.00 1.05 7.50 -1.96 -0.42 115.11 121.77 2a3c h GLN 62 Ca 0.62 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.77 2a3c h GLN 62 Cb 1.38 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.91 2a3c h GLN 62 CO -0.37 0.00 -0.13 -0.25 -1.50 0.00 0.00 178.83 176.58 2a3c n ASP 63 N -3.68 0.20 -4.77 1.46 8.00 0.12 -4.92 116.55 112.96 2a3c n ASP 63 Ca 0.05 0.04 -0.40 0.00 0.71 0.00 0.00 54.79 55.19 2a3c n ASP 63 Cb 0.54 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 2a3c n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2a3c s LEU 64 N -2.83 4.20 -1.48 0.64 1.43 -0.17 -4.89 118.68 115.59 2a3c s LEU 64 Ca 0.18 2.78 -0.12 0.00 -1.03 0.00 0.00 54.13 55.95 2a3c s LEU 64 Cb 0.19 -3.87 0.02 0.00 0.03 0.00 0.00 46.19 42.56 2a3c s LEU 64 CO 0.54 -0.94 2.41 -0.81 0.23 0.00 0.00 176.35 177.78 2a3c n PRO 65 N 0.10 3.31 -0.34 1.29 -0.04 -1.26 -4.80 135.00 133.26 2a3c n PRO 65 Ca 0.04 -2.66 0.27 0.00 -0.04 0.00 0.00 63.50 61.11 2a3c n PRO 65 Cb 0.42 -3.06 0.57 0.00 -0.04 0.00 0.00 33.50 31.40 2a3c n PRO 65 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2a3c h VAL 66 N 3.58 0.44 0.00 0.52 -1.51 -1.94 0.22 116.25 117.57 2a3c h VAL 66 Ca 0.65 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 66.02 2a3c h VAL 66 Cb 0.51 0.14 0.00 0.00 -2.13 0.00 0.00 31.29 29.81 2a3c h VAL 66 CO 1.80 0.05 0.00 -0.33 -1.23 0.00 0.00 177.57 177.86 2a3c h GLU 67 N 0.27 0.00 -0.48 5.19 5.08 -2.00 -2.96 114.58 119.68 2a3c h GLU 67 Ca 0.63 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.99 2a3c h GLU 67 Cb 1.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.07 2a3c h GLU 67 CO -0.27 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.28 2a3c n ARG 68 N -3.07 3.87 -4.21 2.33 1.74 0.06 -4.94 116.66 112.44 2a3c n ARG 68 Ca 0.01 -2.92 -0.16 0.00 -0.77 0.00 0.00 57.85 54.00 2a3c n ARG 68 Cb 0.32 -1.98 -0.11 0.00 -1.02 0.00 0.00 32.46 29.68 2a3c n ARG 68 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2a3c s LEU 69 N -2.43 2.40 -0.05 0.55 1.43 -1.12 -4.85 118.68 114.61 2a3c s LEU 69 Ca 0.48 -0.81 0.04 0.00 -1.03 0.00 0.00 54.13 52.81 2a3c s LEU 69 Cb 0.35 -0.45 -0.06 0.00 0.03 0.00 0.00 46.19 46.06 2a3c s LEU 69 CO 0.16 -0.19 0.01 0.35 0.23 0.00 0.00 176.35 176.91 2a3c n THR 70 N 0.56 0.34 -4.00 5.49 -2.24 0.39 -4.69 114.28 110.14 2a3c n THR 70 Ca -0.16 -0.21 -0.13 0.00 -2.27 0.00 0.00 64.05 61.29 2a3c n THR 70 Cb 0.57 -0.86 -0.13 0.00 -2.10 0.00 0.00 70.33 67.81 2a3c n THR 70 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2a3c s HIS 71 N -2.12 0.25 -0.09 4.78 3.76 -0.76 -0.96 115.29 120.16 2a3c s HIS 71 Ca -0.03 -0.16 0.04 0.00 -0.15 0.00 0.00 55.06 54.77 2a3c s HIS 71 Cb 0.02 -0.16 -0.00 0.00 1.11 0.00 0.00 32.58 33.54 2a3c s HIS 71 CO 0.20 -0.04 -0.24 0.08 -0.85 0.00 0.00 174.74 173.89 2a3c s VAL 72 N -0.41 2.00 -0.32 -0.90 1.01 0.18 -2.01 120.40 119.96 2a3c s VAL 72 Ca -0.03 -1.00 -0.09 0.00 0.00 0.00 0.00 61.98 60.86 2a3c s VAL 72 Cb -0.03 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.63 2a3c s VAL 72 CO -0.00 0.55 0.14 -0.76 0.00 0.00 0.00 175.10 175.03 2a3c s LEU 73 N 0.22 4.17 -0.40 3.92 1.43 -0.04 -0.82 118.68 127.14 2a3c s LEU 73 Ca -0.15 -0.70 -0.21 0.00 -1.03 0.00 0.00 54.13 52.04 2a3c s LEU 73 Cb -0.17 -1.97 0.02 0.00 0.03 0.00 0.00 46.19 44.10 2a3c s LEU 73 CO 0.07 -0.24 0.67 -0.47 0.23 0.00 0.00 176.35 176.62 2a3c s TYR 74 N 1.56 3.09 -0.09 0.29 5.04 0.17 -0.74 117.35 126.66 2a3c s TYR 74 Ca 0.03 0.17 -0.02 0.00 -2.44 0.00 0.00 57.07 54.81 2a3c s TYR 74 Cb -0.18 -3.33 -0.03 0.00 0.35 0.00 0.00 41.96 38.78 2a3c s TYR 74 CO 0.05 -0.79 -0.00 0.00 -1.34 0.00 0.00 175.55 173.47 2a3c s ALA 75 N 2.87 3.27 0.10 3.97 0.00 -0.65 -0.73 121.76 130.59 2a3c s ALA 75 Ca 0.25 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.42 2a3c s ALA 75 Cb -0.14 -1.47 -0.04 0.00 0.00 0.00 0.00 23.12 21.47 2a3c s ALA 75 CO 0.18 0.58 -0.07 -0.06 0.00 0.00 0.00 175.76 176.40 2a3c s PHE 76 N -0.87 0.88 0.14 0.00 0.08 -1.26 -0.55 117.98 116.39 2a3c s PHE 76 Ca 0.13 -0.90 0.04 0.00 0.12 0.00 0.00 56.93 56.32 2a3c s PHE 76 Cb -0.11 -0.51 -0.04 0.00 -0.57 0.00 0.00 43.02 41.79 2a3c s PHE 76 CO 0.02 -0.15 0.14 0.00 -0.10 0.00 0.00 175.22 175.13 2a3c s ALA 77 N -3.55 3.61 0.45 5.36 0.00 -0.35 -4.12 121.76 123.16 2a3c s ALA 77 Ca 0.11 -1.14 0.08 0.00 0.00 0.00 0.00 51.96 51.00 2a3c s ALA 77 Cb 0.05 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.74 2a3c s ALA 77 CO -0.05 0.57 0.44 1.21 0.00 0.00 0.00 175.76 177.93 2a3c s ASN 78 N -2.93 5.05 -0.05 0.00 2.47 0.02 -2.00 114.94 117.49 2a3c s ASN 78 Ca 0.31 -0.80 0.01 0.00 0.42 0.00 0.00 52.86 52.80 2a3c s ASN 78 Cb -0.11 -0.35 0.02 0.00 -1.45 0.00 0.00 41.25 39.36 2a3c s ASN 78 CO 0.24 -0.79 -0.05 0.54 -3.72 0.00 0.00 177.10 173.31 2a3c s VAL 79 N -2.52 0.62 -0.04 -5.21 0.11 -1.26 -1.39 120.40 110.71 2a3c s VAL 79 Ca 0.48 -0.14 -0.30 0.00 -2.93 0.00 0.00 61.98 59.09 2a3c s VAL 79 Cb -0.04 -0.64 -0.04 0.00 -1.53 0.00 0.00 36.38 34.13 2a3c s VAL 79 CO 0.28 0.25 1.32 -0.13 -3.33 0.00 0.00 175.10 173.50 2a3c s ARG 80 N 1.06 4.30 0.34 1.54 0.52 0.81 -4.79 118.95 122.73 2a3c s ARG 80 Ca -0.09 1.84 0.02 0.00 -0.52 0.00 0.00 55.73 56.98 2a3c s ARG 80 Cb -0.14 -3.61 0.60 0.00 0.52 0.00 0.00 34.95 32.32 2a3c s ARG 80 CO -0.01 -0.55 1.99 -1.00 0.02 0.00 0.00 175.30 175.75 2a3c h PRO 81 N 7.81 0.85 0.00 3.54 0.13 -1.91 0.25 132.00 142.67 2a3c h PRO 81 Ca -0.35 -0.06 -0.08 0.00 -0.87 0.00 0.00 66.00 64.64 2a3c h PRO 81 Cb 1.16 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 2a3c h PRO 81 CO 0.90 0.58 -0.37 1.05 -0.23 0.00 0.00 178.00 179.93 2a3c h GLU 82 N 0.87 0.00 0.00 0.86 9.09 -1.91 -2.89 114.58 120.60 2a3c h GLU 82 Ca 0.23 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.64 2a3c h GLU 82 Cb -0.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.04 2a3c h GLU 82 CO -0.05 0.37 -0.23 0.25 0.05 0.00 0.00 179.01 179.40 2a3c n THR 83 N -3.24 0.00 -0.99 -1.06 -2.24 -1.15 -4.98 114.28 100.62 2a3c n THR 83 Ca 0.02 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2a3c n THR 83 Cb 0.64 0.82 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 2a3c n THR 83 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a3c n GLY 84 N 1.13 0.76 3.72 3.38 0.00 0.88 -4.50 105.19 110.56 2a3c n GLY 84 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2a3c n GLY 84 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2a3c s GLU 85 N -0.01 4.28 -0.19 1.61 2.12 -1.25 -2.72 118.70 122.54 2a3c s GLU 85 Ca 0.00 2.21 -0.10 0.00 0.36 0.00 0.00 54.97 57.44 2a3c s GLU 85 Cb 0.00 -3.19 -0.05 0.00 0.26 0.00 0.00 34.13 31.15 2a3c s GLU 85 CO 0.00 -0.49 0.15 0.08 -0.54 0.00 0.00 175.26 174.46 2a3c s VAL 86 N 0.92 5.41 0.02 3.70 1.01 -1.26 -0.13 120.40 130.07 2a3c s VAL 86 Ca 0.66 0.23 -0.08 0.00 0.00 0.00 0.00 61.98 62.79 2a3c s VAL 86 Cb -0.40 -3.48 -0.00 0.00 0.00 0.00 0.00 36.38 32.50 2a3c s VAL 86 CO 0.33 0.45 0.15 -0.72 0.00 0.00 0.00 175.10 175.30 2a3c s TYR 87 N 0.28 0.08 0.62 5.22 1.13 -0.48 -4.61 117.35 119.58 2a3c s TYR 87 Ca 0.09 -0.26 -0.17 0.00 -1.41 0.00 0.00 57.07 55.32 2a3c s TYR 87 Cb -0.11 -0.07 -0.02 0.00 -1.10 0.00 0.00 41.96 40.66 2a3c s TYR 87 CO -0.01 -0.35 1.13 -1.64 -2.51 0.00 0.00 175.55 172.17 2a3c s MET 88 N -2.05 2.97 0.00 -3.49 -1.94 -1.26 -0.80 119.30 112.73 2a3c s MET 88 Ca -0.09 1.53 0.10 0.00 -1.71 0.00 0.00 55.69 55.51 2a3c s MET 88 Cb -0.04 -1.96 -0.02 0.00 2.01 0.00 0.00 34.83 34.82 2a3c s MET 88 CO -0.02 -1.14 0.57 0.25 -0.01 0.00 0.00 175.02 174.67 2a3c n THR 89 N -1.97 0.00 -3.36 2.05 -2.24 -1.26 -4.82 114.28 102.68 2a3c n THR 89 Ca 0.11 -0.38 -0.15 0.00 -2.27 0.00 0.00 64.05 61.36 2a3c n THR 89 Cb 0.51 1.09 -0.08 0.00 -2.10 0.00 0.00 70.33 69.75 2a3c n THR 89 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2a3c s ASP 90 N -1.43 1.17 0.40 3.42 -1.08 -1.26 -5.01 116.67 112.87 2a3c s ASP 90 Ca 0.07 -1.02 0.08 0.00 -0.52 0.00 0.00 52.55 51.15 2a3c s ASP 90 Cb 0.08 0.67 0.85 0.00 -1.46 0.00 0.00 42.92 43.06 2a3c s ASP 90 CO 0.27 -0.33 2.03 0.77 0.52 0.00 0.00 175.17 178.43 2a3c h SER 91 N 7.73 0.50 0.31 -0.34 4.64 -1.97 0.61 113.55 125.03 2a3c h SER 91 Ca -0.05 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 2a3c h SER 91 Cb 1.08 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2a3c h SER 91 CO 0.26 0.35 -0.15 -0.25 -0.87 0.00 0.00 176.83 176.18 2a3c h TRP 92 N 0.59 -0.38 -0.23 4.77 2.91 -1.95 0.42 115.95 122.08 2a3c h TRP 92 Ca 0.21 -0.01 -0.17 0.00 1.13 0.00 0.00 58.89 60.05 2a3c h TRP 92 Cb 0.09 0.13 -0.00 0.00 -0.51 0.00 0.00 29.16 28.87 2a3c h TRP 92 CO -0.00 -0.06 -0.54 0.00 -1.03 0.00 0.00 178.44 176.82 2a3c h ALA 93 N -0.18 0.62 0.29 2.65 0.00 -1.81 0.25 119.26 121.08 2a3c h ALA 93 Ca -0.04 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.34 2a3c h ALA 93 Cb 0.50 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2a3c h ALA 93 CO 0.07 0.68 -0.14 -0.44 0.00 0.00 0.00 179.25 179.42 2a3c h ASP 94 N 0.52 -0.33 0.00 0.00 3.32 0.16 -0.31 116.42 119.78 2a3c h ASP 94 Ca 0.01 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.86 2a3c h ASP 94 Cb 1.10 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2a3c h ASP 94 CO 0.11 0.10 0.00 2.30 -1.72 0.00 0.00 179.24 180.03 2a3c n ILE 95 N -5.08 0.00 -0.12 0.35 -5.35 -0.64 -1.54 119.36 106.98 2a3c n ILE 95 Ca -0.09 -0.16 -0.17 0.00 -0.27 0.00 0.00 62.75 62.06 2a3c n ILE 95 Cb 0.27 1.08 -0.12 0.00 -1.74 0.00 0.00 39.64 39.12 2a3c n ILE 95 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2a3c n GLU 96 N -0.29 0.65 -1.56 6.28 1.02 0.04 -0.67 120.64 126.12 2a3c n GLU 96 Ca 0.00 0.13 -0.47 0.00 -0.02 0.00 0.00 57.16 56.80 2a3c n GLU 96 Cb 0.02 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 29.90 2a3c n GLU 96 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2a3c n LYS 97 N -3.18 1.07 -3.61 3.49 4.81 0.86 -4.47 118.16 117.13 2a3c n LYS 97 Ca -0.44 0.38 -0.36 0.00 -0.87 0.00 0.00 58.31 57.02 2a3c n LYS 97 Cb 1.01 -1.73 -0.08 0.00 0.02 0.00 0.00 35.03 34.25 2a3c n LYS 97 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 2a3c s HIS 98 N -0.77 3.43 0.28 5.64 3.76 -1.26 -0.57 115.29 125.80 2a3c s HIS 98 Ca 0.64 0.48 0.10 0.00 -0.15 0.00 0.00 55.06 56.13 2a3c s HIS 98 Cb -0.79 -2.28 -0.05 0.00 1.11 0.00 0.00 32.58 30.58 2a3c s HIS 98 CO 0.57 0.24 -0.02 0.71 -0.85 0.00 0.00 174.74 175.39 2a3c s TYR 99 N 0.48 2.62 0.29 1.40 2.02 -1.26 -5.01 117.35 117.88 2a3c s TYR 99 Ca 0.13 -0.27 -0.30 0.00 -0.37 0.00 0.00 57.07 56.26 2a3c s TYR 99 Cb -0.12 -1.22 -0.12 0.00 -0.40 0.00 0.00 41.96 40.10 2a3c s TYR 99 CO 0.02 0.61 1.47 -2.30 -1.57 0.00 0.00 175.55 173.78 2a3c n PRO 100 N -0.87 2.38 0.00 -1.71 -0.02 -1.26 -1.13 135.00 132.38 2a3c n PRO 100 Ca -0.06 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2a3c n PRO 100 Cb 0.60 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2a3c n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a3c n GLY 101 N 1.81 0.20 3.72 -1.23 0.00 -1.26 -5.06 105.19 103.37 2a3c n GLY 101 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2a3c n GLY 101 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a3c s ASP 102 N -2.33 6.58 -0.00 1.61 1.01 -0.29 -5.08 116.67 118.17 2a3c s ASP 102 Ca 0.00 0.68 0.02 0.00 0.71 0.00 0.00 52.55 53.97 2a3c s ASP 102 Cb 0.00 -2.25 -0.01 0.00 1.01 0.00 0.00 42.92 41.67 2a3c s ASP 102 CO 0.00 0.01 -0.07 -0.55 0.21 0.00 0.00 175.17 174.77 2a3c s SER 103 N 0.65 0.81 0.03 0.27 0.15 -1.26 -4.88 113.70 109.46 2a3c s SER 103 Ca 0.22 -0.14 0.15 0.00 0.70 0.00 0.00 55.95 56.88 2a3c s SER 103 Cb -0.14 -0.09 0.62 0.00 -1.71 0.00 0.00 66.02 64.70 2a3c s SER 103 CO 0.08 0.08 1.46 0.79 1.20 0.00 0.00 173.24 176.85 2a3c n TRP 104 N 2.86 0.09 0.29 3.44 5.03 -1.26 -2.63 117.44 125.27 2a3c n TRP 104 Ca -0.13 0.04 0.19 0.00 3.03 0.00 0.00 57.50 60.62 2a3c n TRP 104 Cb 0.58 -0.56 0.94 0.00 -1.03 0.00 0.00 31.31 31.24 2a3c n TRP 104 CO 0.00 0.00 0.00 0.66 -0.03 0.00 0.00 177.69 178.32 2a3c h SER 105 N 0.00 0.00 -2.62 -0.99 4.64 -2.03 -3.41 113.55 109.14 2a3c h SER 105 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2a3c h SER 105 Cb 0.24 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.37 2a3c h SER 105 CO 0.00 0.00 1.04 -1.81 -0.87 0.00 0.00 176.83 175.19 2a3c s ASP 106 N -4.90 6.52 0.74 4.97 1.01 -1.08 -4.96 116.67 118.96 2a3c s ASP 106 Ca -0.03 2.62 -0.07 0.00 0.71 0.00 0.00 52.55 55.79 2a3c s ASP 106 Cb 0.10 -2.57 0.09 0.00 1.01 0.00 0.00 42.92 41.56 2a3c s ASP 106 CO 0.38 -0.94 1.05 0.42 0.21 0.00 0.00 175.17 176.29 2a3c s THR 107 N 2.58 2.22 0.00 -1.27 -4.23 -1.26 -4.91 115.64 108.77 2a3c s THR 107 Ca 0.77 -0.28 0.00 0.00 -1.18 0.00 0.00 61.69 60.99 2a3c s THR 107 Cb -0.43 -2.94 0.00 0.00 1.34 0.00 0.00 72.50 70.47 2a3c s THR 107 CO 0.34 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.03 2a3c n GLY 108 N -3.02 -0.12 3.54 3.99 0.00 -1.26 -4.70 105.19 103.62 2a3c n GLY 108 Ca 0.10 -1.00 -0.37 0.00 0.00 0.00 0.00 46.02 44.75 2a3c n GLY 108 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2a3c s ASN 109 N -4.00 5.71 0.21 1.61 2.47 -1.26 -4.99 114.94 114.69 2a3c s ASN 109 Ca 0.00 -0.08 0.09 0.00 0.42 0.00 0.00 52.86 53.29 2a3c s ASN 109 Cb 0.00 -2.05 -0.05 0.00 -1.45 0.00 0.00 41.25 37.70 2a3c s ASN 109 CO 0.00 -0.04 -0.16 0.20 -3.72 0.00 0.00 177.10 173.38 2a3c s ASN 110 N 1.70 2.77 -0.10 -4.21 0.01 -1.26 0.04 114.94 113.89 2a3c s ASN 110 Ca 0.07 -0.99 0.02 0.00 -0.71 0.00 0.00 52.86 51.25 2a3c s ASN 110 Cb -0.16 -0.17 -0.01 0.00 0.41 0.00 0.00 41.25 41.32 2a3c s ASN 110 CO 0.08 -0.11 -0.17 0.54 -1.51 0.00 0.00 177.10 175.93 2a3c s VAL 111 N -2.72 2.70 0.00 1.60 0.11 -1.26 -5.01 120.40 115.81 2a3c s VAL 111 Ca 0.23 -0.81 0.00 0.00 -2.93 0.00 0.00 61.98 58.47 2a3c s VAL 111 Cb -0.02 -2.08 0.00 0.00 -1.53 0.00 0.00 36.38 32.75 2a3c s VAL 111 CO 0.08 0.55 0.00 -1.22 -3.33 0.00 0.00 175.10 171.18 2a3c n TYR 112 N 3.21 0.00 -3.99 1.54 4.02 0.16 -4.53 117.16 117.57 2a3c n TYR 112 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 2a3c n TYR 112 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.85 2a3c n TYR 112 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2a3c n GLY 113 N 3.86 0.91 0.24 2.72 0.00 0.26 -1.98 105.19 111.21 2a3c n GLY 113 Ca 0.00 -0.75 0.01 0.00 0.00 0.00 0.00 46.02 45.28 2a3c n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3c h ILE 115 N 0.30 1.03 -0.36 0.00 1.08 -1.23 0.12 117.51 118.45 2a3c h ILE 115 Ca 0.06 -0.14 -0.03 0.00 -0.39 0.00 0.00 64.86 64.36 2a3c h ILE 115 Cb 0.40 0.58 -0.02 0.00 -3.07 0.00 0.00 36.82 34.72 2a3c h ILE 115 CO 0.02 0.07 0.10 0.50 -0.69 0.00 0.00 178.15 178.16 2a3c h LYS 116 N 0.41 0.57 -0.93 2.37 3.64 -1.28 -1.92 116.57 119.44 2a3c h LYS 116 Ca 0.14 -0.13 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2a3c h LYS 116 Cb 0.01 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.70 2a3c h LYS 116 CO -0.07 0.60 0.60 1.96 -2.27 0.00 0.00 179.45 180.27 2a3c h GLN 117 N 0.44 1.23 -0.61 1.90 1.08 -1.27 -0.50 115.11 117.37 2a3c h GLN 117 Ca 0.12 -0.08 -0.08 0.00 -1.45 0.00 0.00 58.65 57.16 2a3c h GLN 117 Cb 0.27 -0.27 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 2a3c h GLN 117 CO -0.00 0.82 0.08 -0.07 -0.95 0.00 0.00 178.83 178.71 2a3c h LEU 118 N 1.26 0.99 -0.58 1.46 3.38 -0.60 -2.17 115.31 119.05 2a3c h LEU 118 Ca 0.34 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2a3c h LEU 118 Cb -0.13 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.33 2a3c h LEU 118 CO -0.07 1.01 0.34 0.22 0.09 0.00 0.00 178.44 180.03 2a3c h TYR 119 N 0.93 0.77 -0.93 1.13 3.20 -0.70 -1.94 116.97 119.42 2a3c h TYR 119 Ca 0.18 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.12 2a3c h TYR 119 Cb 0.46 -0.25 -0.06 0.00 1.54 0.00 0.00 36.73 38.42 2a3c h TYR 119 CO 0.03 0.54 0.60 -0.07 -1.64 0.00 0.00 178.16 177.62 2a3c h LEU 120 N 0.78 0.92 -0.75 2.82 3.38 -0.79 -1.19 115.31 120.49 2a3c h LEU 120 Ca 0.21 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 2a3c h LEU 120 Cb 0.00 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2a3c h LEU 120 CO -0.04 0.58 0.07 -0.07 0.09 0.00 0.00 178.44 179.07 2a3c h LEU 121 N 1.04 0.99 -1.23 1.67 3.38 -0.75 -1.92 115.31 118.48 2a3c h LEU 121 Ca 0.41 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2a3c h LEU 121 Cb 0.24 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2a3c h LEU 121 CO -0.16 1.00 0.30 0.11 0.09 0.00 0.00 178.44 179.78 2a3c h LYS 122 N 0.96 0.84 -0.32 1.13 1.57 -0.53 0.64 116.57 120.84 2a3c h LYS 122 Ca 0.19 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.76 2a3c h LYS 122 Cb 0.46 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2a3c h LYS 122 CO 0.02 0.64 -0.25 0.87 -0.57 0.00 0.00 179.45 180.15 2a3c h LYS 123 N 0.84 0.65 0.00 3.15 1.57 -0.77 -3.07 116.57 118.93 2a3c h LYS 123 Ca 0.21 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2a3c h LYS 123 Cb 0.06 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.34 2a3c h LYS 123 CO -0.03 0.84 -0.20 1.96 -0.57 0.00 0.00 179.45 181.45 2a3c h GLN 124 N 0.56 0.00 -2.61 3.15 4.20 -0.60 -3.40 115.11 116.41 2a3c h GLN 124 Ca 0.08 0.00 -0.55 0.00 0.06 0.00 0.00 58.65 58.24 2a3c h GLN 124 Cb 0.73 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 28.12 2a3c h GLN 124 CO 0.06 0.00 -0.82 -0.80 -0.67 0.00 0.00 178.83 176.60 2a3c s ASN 125 N -5.43 3.05 0.27 1.46 0.01 0.14 -5.00 114.94 109.43 2a3c s ASN 125 Ca 0.07 -1.85 0.20 0.00 -0.71 0.00 0.00 52.86 50.57 2a3c s ASN 125 Cb 0.08 -0.32 1.01 0.00 0.41 0.00 0.00 41.25 42.43 2a3c s ASN 125 CO 0.67 -0.35 1.61 0.54 -1.51 0.00 0.00 177.10 178.06 2a3c n ARG 126 N 4.46 0.14 -0.05 -0.60 5.12 -1.23 -1.39 116.66 123.11 2a3c n ARG 126 Ca 0.06 0.56 0.12 0.00 -1.93 0.00 0.00 57.85 56.67 2a3c n ARG 126 Cb 0.39 -1.88 0.29 0.00 -1.16 0.00 0.00 32.46 30.10 2a3c n ARG 126 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2a3c n ASN 127 N -2.16 2.42 -4.54 0.55 5.15 -1.26 0.05 115.26 115.46 2a3c n ASN 127 Ca -0.00 -1.80 -0.42 0.00 -0.60 0.00 0.00 54.58 51.76 2a3c n ASN 127 Cb 0.08 -0.06 -0.08 0.00 -0.53 0.00 0.00 39.78 39.19 2a3c n ASN 127 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2a3c s LEU 128 N -1.84 4.45 -0.04 1.20 2.96 -0.49 -4.69 118.68 120.23 2a3c s LEU 128 Ca 0.34 -0.18 -0.05 0.00 -0.22 0.00 0.00 54.13 54.02 2a3c s LEU 128 Cb 0.20 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 44.32 2a3c s LEU 128 CO 0.31 -0.50 0.19 -0.54 -1.32 0.00 0.00 176.35 174.48 2a3c s LYS 129 N 2.34 3.46 -0.19 1.98 3.01 -0.13 -4.71 119.74 125.50 2a3c s LYS 129 Ca 0.17 -0.23 0.01 0.00 -1.01 0.00 0.00 55.97 54.91 2a3c s LYS 129 Cb -0.16 -3.12 0.03 0.00 -1.01 0.00 0.00 37.83 33.57 2a3c s LYS 129 CO 0.14 0.70 -0.17 0.08 0.51 0.00 0.00 175.35 176.61 2a3c s VAL 130 N -1.24 1.94 0.09 3.17 1.01 -1.26 -0.65 120.40 123.46 2a3c s VAL 130 Ca 0.24 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.29 2a3c s VAL 130 Cb -0.13 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2a3c s VAL 130 CO 0.14 0.41 0.00 -0.76 0.00 0.00 0.00 175.10 174.90 2a3c s LEU 131 N 1.31 3.47 -0.15 3.92 1.02 -0.00 -0.19 118.68 128.06 2a3c s LEU 131 Ca 0.03 -0.17 -0.21 0.00 0.02 0.00 0.00 54.13 53.80 2a3c s LEU 131 Cb -0.14 -2.19 -0.03 0.00 0.02 0.00 0.00 46.19 43.84 2a3c s LEU 131 CO -0.11 0.18 0.61 -0.22 0.02 0.00 0.00 176.35 176.83 2a3c s LEU 132 N -2.28 4.21 -0.23 1.79 2.96 -0.65 -0.66 118.68 123.82 2a3c s LEU 132 Ca 0.26 0.90 -0.14 0.00 -0.22 0.00 0.00 54.13 54.93 2a3c s LEU 132 Cb -0.12 -2.88 -0.04 0.00 0.50 0.00 0.00 46.19 43.65 2a3c s LEU 132 CO 0.18 -0.17 0.32 -0.55 -1.32 0.00 0.00 176.35 174.80 2a3c s SER 133 N 0.98 6.28 -0.19 3.68 0.15 0.09 -0.45 113.70 124.23 2a3c s SER 133 Ca 0.30 0.32 -0.04 0.00 0.70 0.00 0.00 55.95 57.22 2a3c s SER 133 Cb -0.16 -2.19 -0.02 0.00 -1.71 0.00 0.00 66.02 61.94 2a3c s SER 133 CO 0.12 -0.07 -0.02 -0.63 1.20 0.00 0.00 173.24 173.84 2a3c s ILE 134 N 1.48 3.78 0.00 6.45 1.01 0.95 -1.22 121.20 133.65 2a3c s ILE 134 Ca 0.14 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.42 2a3c s ILE 134 Cb -0.15 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.63 2a3c s ILE 134 CO 0.08 0.44 0.00 0.61 0.00 0.00 0.00 174.94 176.07 2a3c n GLY 135 N 4.21 0.08 0.00 6.18 0.00 -0.85 -0.55 105.19 114.26 2a3c n GLY 135 Ca -0.17 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.27 2a3c n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3c n GLY 136 N 0.00 1.48 0.13 -0.02 0.00 -0.28 -4.32 105.19 102.19 2a3c n GLY 136 Ca 0.00 -2.03 -0.08 0.00 0.00 0.00 0.00 46.02 43.91 2a3c n GLY 136 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2a3c h TRP 137 N 0.00 0.16 -0.42 1.61 6.55 -1.91 -0.73 115.95 121.21 2a3c h TRP 137 Ca 0.00 0.01 0.01 0.00 0.95 0.00 0.00 58.89 59.87 2a3c h TRP 137 Cb 0.00 -0.03 -0.02 0.00 -0.86 0.00 0.00 29.16 28.25 2a3c h TRP 137 CO 0.00 0.07 0.26 1.15 -1.05 0.00 0.00 178.44 178.87 2a3c h THR 138 N 0.21 1.08 -0.00 1.49 2.02 -1.97 -3.08 112.91 112.65 2a3c h THR 138 Ca 0.12 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.12 2a3c h THR 138 Cb 0.10 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 2a3c h THR 138 CO -0.13 0.10 -0.35 -1.22 0.37 0.00 0.00 175.52 174.28 2a3c n TYR 139 N -4.82 0.00 -0.12 3.16 4.01 -1.16 -4.44 117.16 113.78 2a3c n TYR 139 Ca 0.01 0.00 0.24 0.00 -0.16 0.00 0.00 57.90 58.00 2a3c n TYR 139 Cb 0.04 -0.27 0.69 0.00 -0.31 0.00 0.00 39.34 39.49 2a3c n TYR 139 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2a3c h SER 140 N 0.19 0.05 0.26 7.72 0.02 -1.04 -1.47 113.55 119.27 2a3c h SER 140 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2a3c h SER 140 Cb 0.49 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.02 2a3c h SER 140 CO 0.00 0.02 0.00 -0.65 -1.14 0.00 0.00 176.83 175.06 2a3c h PRO 141 N 0.05 0.00 0.00 3.45 0.11 -1.81 -2.20 132.00 131.60 2a3c h PRO 141 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.48 2a3c h PRO 141 Cb 1.39 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.50 2a3c h PRO 141 CO -0.02 0.00 -0.16 -0.91 -0.21 0.00 0.00 178.00 176.70 2a3c h ASN 142 N 0.00 0.00 0.05 -2.05 2.35 -1.57 -3.37 115.58 111.00 2a3c h ASN 142 Ca 0.00 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2a3c h ASN 142 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2a3c h ASN 142 CO 0.00 0.01 -0.03 -0.26 -1.65 0.00 0.00 177.43 175.51 2a3c h PHE 143 N 0.00 -0.06 0.01 1.19 0.04 -1.57 -2.48 116.94 114.07 2a3c h PHE 143 Ca 0.00 -0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.79 2a3c h PHE 143 Cb 0.85 0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.96 2a3c h PHE 143 CO 0.00 0.14 -0.50 0.00 -0.60 0.00 0.00 178.31 177.35 2a3c h ALA 144 N 0.67 -0.88 -0.47 2.45 0.00 -1.77 -0.11 119.26 119.17 2a3c h ALA 144 Ca -0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2a3c h ALA 144 Cb 0.23 0.89 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 2a3c h ALA 144 CO 0.01 -1.07 0.27 -1.00 0.00 0.00 0.00 179.25 177.46 2a3c h PRO 145 N -0.66 0.64 -0.40 0.00 0.13 -1.79 -1.87 132.00 128.04 2a3c h PRO 145 Ca 0.02 -0.06 0.01 0.00 -0.87 0.00 0.00 66.00 65.10 2a3c h PRO 145 Cb 0.71 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.69 2a3c h PRO 145 CO -0.34 0.48 0.27 0.00 -0.23 0.00 0.00 178.00 178.18 2a3c h ALA 146 N 1.12 1.74 -0.09 -0.56 0.00 -1.11 -2.25 119.26 118.12 2a3c h ALA 146 Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2a3c h ALA 146 Cb 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2a3c h ALA 146 CO -0.03 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.46 2a3c n ALA 147 N -2.48 2.49 0.37 0.00 0.00 -0.08 -3.41 120.51 117.40 2a3c n ALA 147 Ca 0.03 -0.64 0.14 0.00 0.00 0.00 0.00 53.44 52.97 2a3c n ALA 147 Cb 0.08 -0.95 0.53 0.00 0.00 0.00 0.00 19.45 19.10 2a3c n ALA 147 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2a3c h SER 148 N 3.76 0.00 -3.79 0.00 4.64 -0.70 -3.44 113.55 114.01 2a3c h SER 148 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 2a3c h SER 148 Cb 0.80 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.70 2a3c h SER 148 CO 0.00 0.00 -0.79 0.42 -0.87 0.00 0.00 176.83 175.59 2a3c s THR 149 N -3.40 1.72 0.26 2.95 -4.23 -1.26 -5.04 115.64 106.64 2a3c s THR 149 Ca 0.04 -1.79 -0.04 0.00 -1.18 0.00 0.00 61.69 58.72 2a3c s THR 149 Cb 0.09 -1.72 0.18 0.00 1.34 0.00 0.00 72.50 72.39 2a3c s THR 149 CO 0.48 -0.26 1.84 -0.78 -0.54 0.00 0.00 174.62 175.36 2a3c h ASP 150 N 3.50 0.93 -0.50 3.99 3.58 -1.93 -0.97 116.42 125.03 2a3c h ASP 150 Ca -0.43 -0.13 -0.07 0.00 0.42 0.00 0.00 57.03 56.83 2a3c h ASP 150 Cb 1.20 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.99 2a3c h ASP 150 CO 0.48 0.82 0.05 0.00 -2.88 0.00 0.00 179.24 177.71 2a3c h ALA 151 N 1.31 0.67 0.17 -0.78 0.00 -1.96 -1.32 119.26 117.35 2a3c h ALA 151 Ca 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2a3c h ALA 151 Cb 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2a3c h ALA 151 CO -0.02 0.43 -0.08 0.78 0.00 0.00 0.00 179.25 180.36 2a3c h GLY 152 N 0.72 -0.24 0.81 0.00 0.00 -1.62 -1.16 103.07 101.58 2a3c h GLY 152 Ca 0.15 0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.60 2a3c h GLY 152 CO 0.02 -0.09 0.22 3.21 0.00 0.00 0.00 176.54 179.90 2a3c h ARG 153 N -0.27 0.43 -0.47 4.80 3.08 -1.15 0.14 114.38 120.95 2a3c h ARG 153 Ca -0.02 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 2a3c h ARG 153 Cb 0.21 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2a3c h ARG 153 CO 0.04 0.28 0.02 0.87 -1.07 0.00 0.00 179.97 180.11 2a3c h LYS 154 N 0.44 0.77 -0.05 0.04 1.57 -1.17 -1.52 116.57 116.66 2a3c h LYS 154 Ca 0.18 -0.19 -0.16 0.00 -1.87 0.00 0.00 60.65 58.60 2a3c h LYS 154 Cb 0.07 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 2a3c h LYS 154 CO -0.11 0.77 -0.69 -0.97 -0.57 0.00 0.00 179.45 177.87 2a3c h ASN 155 N 0.72 0.26 0.03 0.86 -1.24 -0.73 -0.56 115.58 114.93 2a3c h ASN 155 Ca 0.15 -0.17 -0.00 0.00 0.71 0.00 0.00 56.30 56.98 2a3c h ASN 155 Cb 0.42 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.39 2a3c h ASN 155 CO 0.02 0.87 -0.01 0.15 -1.29 0.00 0.00 177.43 177.16 2a3c h PHE 156 N 0.15 -0.04 -0.41 0.67 3.04 -0.30 0.62 116.94 120.68 2a3c h PHE 156 Ca -0.02 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.92 2a3c h PHE 156 Cb 1.23 0.01 -0.02 0.00 2.56 0.00 0.00 35.95 39.74 2a3c h PHE 156 CO 0.02 -0.02 0.21 0.00 -2.02 0.00 0.00 178.31 176.51 2a3c h ALA 157 N 0.92 0.53 -0.02 2.41 0.00 -1.12 -0.68 119.26 121.31 2a3c h ALA 157 Ca -0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2a3c h ALA 157 Cb 0.04 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2a3c h ALA 157 CO 0.01 0.07 0.01 -0.22 0.00 0.00 0.00 179.25 179.12 2a3c h LYS 158 N 0.53 0.02 -0.66 0.00 3.64 -0.87 -1.18 116.57 118.06 2a3c h LYS 158 Ca 0.14 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 2a3c h LYS 158 Cb 0.08 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 2a3c h LYS 158 CO -0.02 0.12 0.13 1.79 -2.27 0.00 0.00 179.45 179.20 2a3c h THR 159 N -0.08 1.26 -0.50 1.00 1.35 -0.80 -1.09 112.91 114.05 2a3c h THR 159 Ca 0.01 -0.98 -0.10 0.00 -0.55 0.00 0.00 66.41 64.78 2a3c h THR 159 Cb 0.10 0.61 -0.02 0.00 -1.73 0.00 0.00 68.15 67.12 2a3c h THR 159 CO -0.00 0.37 -0.07 0.00 -0.25 0.00 0.00 175.52 175.58 2a3c h ALA 160 N 1.13 0.69 -0.09 6.62 0.00 -1.02 -1.96 119.26 124.63 2a3c h ALA 160 Ca 0.20 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 2a3c h ALA 160 Cb 0.40 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2a3c h ALA 160 CO 0.01 0.56 -0.35 0.28 0.00 0.00 0.00 179.25 179.74 2a3c h VAL 161 N 0.79 1.28 -0.67 0.00 2.07 -1.05 -1.30 116.25 117.36 2a3c h VAL 161 Ca 0.13 -1.34 -0.05 0.00 0.82 0.00 0.00 66.70 66.27 2a3c h VAL 161 Cb 0.61 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 2a3c h VAL 161 CO 0.04 0.40 0.22 0.50 0.02 0.00 0.00 177.57 178.75 2a3c h LYS 162 N 0.16 1.02 -0.60 1.57 1.63 -0.86 0.13 116.57 119.62 2a3c h LYS 162 Ca 0.02 -0.20 -0.09 0.00 -0.85 0.00 0.00 60.65 59.53 2a3c h LYS 162 Cb 0.70 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 32.15 2a3c h LYS 162 CO 0.05 0.86 0.03 -0.07 -3.45 0.00 0.00 179.45 176.87 2a3c h LEU 163 N 0.99 1.00 -0.47 5.20 3.38 -0.58 -1.88 115.31 122.94 2a3c h LEU 163 Ca 0.22 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2a3c h LEU 163 Cb 0.26 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2a3c h LEU 163 CO -0.01 1.03 0.10 0.25 0.09 0.00 0.00 178.44 179.91 2a3c h LEU 164 N 0.95 0.72 -1.23 1.67 6.46 -0.71 0.24 115.31 123.40 2a3c h LEU 164 Ca 0.18 -0.24 -0.08 0.00 -0.12 0.00 0.00 57.88 57.62 2a3c h LEU 164 Cb 0.51 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.24 2a3c h LEU 164 CO 0.02 0.77 -0.37 0.06 -0.62 0.00 0.00 178.44 178.31 2a3c h GLN 165 N 0.63 0.00 0.14 1.25 3.07 -0.78 -2.37 115.11 117.05 2a3c h GLN 165 Ca 0.15 0.00 -0.28 0.00 0.09 0.00 0.00 58.65 58.61 2a3c h GLN 165 Cb 0.34 0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.91 2a3c h GLN 165 CO 0.00 0.37 -1.38 -0.44 0.09 0.00 0.00 178.83 177.47 2a3c h ASP 166 N 0.00 0.47 -0.35 0.06 3.32 -1.11 -3.32 116.42 115.50 2a3c h ASP 166 Ca -0.00 -0.89 0.00 0.00 0.02 0.00 0.00 57.03 56.16 2a3c h ASP 166 Cb 0.70 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2a3c h ASP 166 CO 0.05 1.62 0.00 0.18 -1.72 0.00 0.00 179.24 179.37 2a3c n LEU 167 N -3.88 3.13 -1.10 1.55 4.77 0.81 -4.65 117.00 117.62 2a3c n LEU 167 Ca -0.22 -1.34 -0.06 0.00 -0.03 0.00 0.00 56.01 54.35 2a3c n LEU 167 Cb 0.93 -0.23 0.01 0.00 -2.33 0.00 0.00 43.42 41.81 2a3c n LEU 167 CO 0.46 0.67 0.03 0.61 -1.33 0.00 0.00 177.39 177.83 2a3c n GLY 168 N 1.44 0.49 3.88 -0.72 0.00 -0.90 -4.90 105.19 104.47 2a3c n GLY 168 Ca 0.19 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 2a3c n GLY 168 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2a3c s PHE 169 N -2.89 3.45 -2.37 1.61 0.08 -1.15 -4.90 117.98 111.82 2a3c s PHE 169 Ca 0.11 0.93 0.25 0.00 0.12 0.00 0.00 56.93 58.34 2a3c s PHE 169 Cb -0.05 -2.33 0.47 0.00 -0.57 0.00 0.00 43.02 40.55 2a3c s PHE 169 CO 0.14 0.07 1.40 -0.25 -0.10 0.00 0.00 175.22 176.48 2a3c n ASP 170 N -0.83 1.96 0.00 1.36 8.00 0.74 -4.89 116.55 122.88 2a3c n ASP 170 Ca 0.01 -1.52 0.00 0.00 0.71 0.00 0.00 54.79 53.99 2a3c n ASP 170 Cb 0.54 0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.79 2a3c n ASP 170 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a3c n GLY 171 N 1.32 -1.83 3.16 0.44 0.00 -1.25 -1.40 105.19 105.63 2a3c n GLY 171 Ca 0.14 -1.15 -0.22 0.00 0.00 0.00 0.00 46.02 44.78 2a3c n GLY 171 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a3c s LEU 172 N 0.00 2.10 -0.10 0.99 1.43 -0.30 -1.64 118.68 121.16 2a3c s LEU 172 Ca 0.00 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.75 2a3c s LEU 172 Cb 0.00 -0.76 0.00 0.00 0.03 0.00 0.00 46.19 45.47 2a3c s LEU 172 CO 0.00 0.13 -0.21 -0.62 0.23 0.00 0.00 176.35 175.88 2a3c s ASP 173 N -0.78 2.83 -0.20 2.29 2.15 0.41 -1.41 116.67 121.96 2a3c s ASP 173 Ca 0.05 -0.51 -0.04 0.00 0.43 0.00 0.00 52.55 52.48 2a3c s ASP 173 Cb -0.07 -1.30 -0.01 0.00 -0.30 0.00 0.00 42.92 41.24 2a3c s ASP 173 CO 0.00 0.12 -0.04 -0.63 -0.17 0.00 0.00 175.17 174.45 2a3c s ILE 174 N 0.50 3.50 -0.55 4.11 1.01 0.02 -0.04 121.20 129.76 2a3c s ILE 174 Ca -0.16 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.04 2a3c s ILE 174 Cb -0.17 -2.58 0.14 0.00 0.01 0.00 0.00 42.46 39.86 2a3c s ILE 174 CO 0.06 0.44 0.32 -1.81 0.00 0.00 0.00 174.94 173.95 2a3c s ASP 175 N 1.20 4.73 -0.39 3.58 -0.00 0.28 -2.18 116.67 123.88 2a3c s ASP 175 Ca 0.02 -2.89 -0.09 0.00 -0.00 0.00 0.00 52.55 49.60 2a3c s ASP 175 Cb -0.14 -1.73 0.06 0.00 -0.00 0.00 0.00 42.92 41.10 2a3c s ASP 175 CO -0.01 -0.30 0.22 0.86 -0.00 0.00 0.00 175.17 175.94 2a3c s TRP 176 N -0.12 3.30 -0.55 4.23 -0.11 -1.26 -1.13 118.94 123.31 2a3c s TRP 176 Ca 0.16 -1.40 -0.03 0.00 1.22 0.00 0.00 56.10 56.06 2a3c s TRP 176 Cb -0.23 -2.71 0.14 0.00 -1.50 0.00 0.00 33.47 29.17 2a3c s TRP 176 CO -0.02 -0.78 0.37 -1.21 -4.62 0.00 0.00 176.95 170.69 2a3c s GLU 177 N 1.44 2.40 0.04 5.86 8.01 -1.26 -4.20 118.70 130.99 2a3c s GLU 177 Ca 0.02 -2.27 -0.17 0.00 0.01 0.00 0.00 54.97 52.56 2a3c s GLU 177 Cb -0.21 -3.71 0.03 0.00 -4.31 0.00 0.00 34.13 25.93 2a3c s GLU 177 CO 0.03 -1.15 0.39 0.71 0.01 0.00 0.00 175.26 175.26 2a3c s TYR 178 N 0.39 -0.24 0.22 1.61 1.51 -1.26 -4.80 117.35 114.78 2a3c s TYR 178 Ca 0.14 0.20 -0.32 0.00 -1.01 0.00 0.00 57.07 56.08 2a3c s TYR 178 Cb -0.21 0.19 -0.12 0.00 -0.11 0.00 0.00 41.96 41.71 2a3c s TYR 178 CO -0.04 -0.55 1.63 -2.30 -1.11 0.00 0.00 175.55 173.18 2a3c n PRO 179 N 0.56 2.55 0.01 -1.71 -0.02 -1.26 -4.88 135.00 130.25 2a3c n PRO 179 Ca -0.19 0.92 0.11 0.00 -2.02 0.00 0.00 63.50 62.32 2a3c n PRO 179 Cb 0.59 -2.71 -0.09 0.00 -0.02 0.00 0.00 33.50 31.27 2a3c n PRO 179 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2a3c n GLU 180 N 3.18 0.34 -3.97 -0.52 1.02 -1.26 -4.89 120.64 114.54 2a3c n GLU 180 Ca 0.14 -0.07 -0.11 0.00 -0.02 0.00 0.00 57.16 57.10 2a3c n GLU 180 Cb 0.34 -1.54 -0.03 0.00 -0.02 0.00 0.00 31.44 30.18 2a3c n GLU 180 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2a3c s ASN 181 N -3.89 0.24 0.25 1.62 2.20 -1.26 -5.04 114.94 109.05 2a3c s ASN 181 Ca 0.01 -1.13 -0.04 0.00 -0.94 0.00 0.00 52.86 50.76 2a3c s ASN 181 Cb 0.15 0.69 0.43 0.00 -2.00 0.00 0.00 41.25 40.52 2a3c s ASN 181 CO 0.86 -1.34 1.78 -0.78 -2.94 0.00 0.00 177.10 174.68 2a3c h ASP 182 N 2.12 0.52 -0.33 3.54 3.58 -1.95 0.14 116.42 124.05 2a3c h ASP 182 Ca -0.28 0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.25 2a3c h ASP 182 Cb 1.25 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 42.27 2a3c h ASP 182 CO 0.37 0.27 0.20 -0.61 -2.88 0.00 0.00 179.24 176.58 2a3c h GLN 183 N 0.64 0.45 -0.66 0.28 5.75 -1.97 0.34 115.11 119.95 2a3c h GLN 183 Ca 0.41 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.83 2a3c h GLN 183 Cb 0.49 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.92 2a3c h GLN 183 CO -0.31 0.34 0.25 1.96 -2.65 0.00 0.00 178.83 178.42 2a3c h GLN 184 N 0.43 0.99 -0.69 1.69 4.20 -1.76 0.11 115.11 120.08 2a3c h GLN 184 Ca 0.12 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 2a3c h GLN 184 Cb 0.00 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 2a3c h GLN 184 CO -0.02 0.83 0.43 0.00 -0.67 0.00 0.00 178.83 179.40 2a3c h ALA 185 N 1.11 0.88 -0.35 3.87 0.00 -0.30 0.99 119.26 125.45 2a3c h ALA 185 Ca 0.22 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2a3c h ALA 185 Cb 0.22 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2a3c h ALA 185 CO -0.02 0.34 0.09 -0.91 0.00 0.00 0.00 179.25 178.75 2a3c h ASN 186 N 0.94 0.53 -0.74 0.00 2.35 -0.53 -2.59 115.58 115.54 2a3c h ASN 186 Ca 0.25 -0.23 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2a3c h ASN 186 Cb -0.05 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.14 2a3c h ASN 186 CO -0.05 0.62 0.46 0.44 -1.65 0.00 0.00 177.43 177.25 2a3c h ASP 187 N 0.42 0.89 -0.35 5.81 3.32 -0.33 -0.99 116.42 125.18 2a3c h ASP 187 Ca 0.11 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 2a3c h ASP 187 Cb 0.29 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2a3c h ASP 187 CO 0.00 0.67 0.21 0.15 -1.72 0.00 0.00 179.24 178.55 2a3c h PHE 188 N 1.03 0.46 -0.17 4.55 3.57 -0.59 0.53 116.94 126.31 2a3c h PHE 188 Ca 0.27 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.78 2a3c h PHE 188 Cb -0.06 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 2a3c h PHE 188 CO 0.00 0.34 0.09 0.28 -2.23 0.00 0.00 178.31 176.78 2a3c h VAL 189 N 0.46 1.00 -0.87 1.41 2.07 -1.00 0.70 116.25 120.03 2a3c h VAL 189 Ca 0.13 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.62 2a3c h VAL 189 Cb 0.01 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.52 2a3c h VAL 189 CO -0.02 0.03 0.56 -0.07 0.02 0.00 0.00 177.57 178.09 2a3c h LEU 190 N 0.18 0.92 -0.23 2.57 3.38 -0.74 0.07 115.31 121.47 2a3c h LEU 190 Ca 0.07 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.04 2a3c h LEU 190 Cb 0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2a3c h LEU 190 CO -0.05 0.63 0.13 0.25 0.09 0.00 0.00 178.44 179.50 2a3c h LEU 191 N 1.08 0.22 -0.41 1.67 5.85 0.80 -0.81 115.31 123.72 2a3c h LEU 191 Ca 0.35 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2a3c h LEU 191 Cb 0.01 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2a3c h LEU 191 CO -0.12 0.16 0.27 -0.07 -0.34 0.00 0.00 178.44 178.34 2a3c h LEU 192 N 0.28 0.47 -0.57 2.25 3.38 -0.10 -1.25 115.31 119.76 2a3c h LEU 192 Ca 0.09 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.12 2a3c h LEU 192 Cb -0.01 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 2a3c h LEU 192 CO -0.04 0.34 0.24 0.50 0.09 0.00 0.00 178.44 179.57 2a3c h LYS 193 N 0.55 0.42 -0.69 1.13 1.63 -0.71 0.99 116.57 119.90 2a3c h LYS 193 Ca 0.15 -0.03 0.01 0.00 -0.85 0.00 0.00 60.65 59.94 2a3c h LYS 193 Cb -0.06 -0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 31.43 2a3c h LYS 193 CO -0.03 0.28 0.45 1.49 -3.45 0.00 0.00 179.45 178.19 2a3c h GLU 194 N 0.44 0.88 -0.34 1.90 4.57 -0.53 -1.27 114.58 120.23 2a3c h GLU 194 Ca 0.28 -0.05 -0.10 0.00 -1.18 0.00 0.00 59.36 58.31 2a3c h GLU 194 Cb 0.29 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.68 2a3c h GLU 194 CO -0.26 0.58 -0.18 0.28 -1.18 0.00 0.00 179.01 178.26 2a3c h VAL 195 N 0.90 1.29 -0.24 0.32 2.07 -0.44 -1.77 116.25 118.39 2a3c h VAL 195 Ca 0.26 -1.30 0.03 0.00 0.82 0.00 0.00 66.70 66.51 2a3c h VAL 195 Cb -0.07 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 2a3c h VAL 195 CO -0.07 0.42 0.08 -0.09 0.02 0.00 0.00 177.57 177.93 2a3c h ARG 196 N 0.50 0.18 -0.29 1.57 9.65 -0.54 0.19 114.38 125.63 2a3c h ARG 196 Ca 0.07 -0.01 0.01 0.00 -1.10 0.00 0.00 59.98 58.95 2a3c h ARG 196 Cb 0.72 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.24 2a3c h ARG 196 CO 0.05 0.12 0.18 1.15 2.80 0.00 0.00 179.97 184.27 2a3c h THR 197 N 0.18 1.06 -0.96 0.20 2.02 -1.20 -1.24 112.91 112.97 2a3c h THR 197 Ca 0.10 -0.13 0.02 0.00 0.77 0.00 0.00 66.41 67.17 2a3c h THR 197 Cb 0.08 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.09 2a3c h THR 197 CO -0.11 0.07 0.64 0.00 0.37 0.00 0.00 175.52 176.48 2a3c h ALA 198 N 1.11 1.24 -0.60 6.16 0.00 -0.85 -1.68 119.26 124.64 2a3c h ALA 198 Ca 0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2a3c h ALA 198 Cb -0.03 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.36 2a3c h ALA 198 CO -0.03 0.58 0.21 -0.07 0.00 0.00 0.00 179.25 179.94 2a3c h LEU 199 N 1.28 0.85 -0.29 0.00 3.38 0.02 -2.15 115.31 118.40 2a3c h LEU 199 Ca 0.36 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 2a3c h LEU 199 Cb -0.10 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 2a3c h LEU 199 CO -0.09 0.81 0.04 0.44 0.09 0.00 0.00 178.44 179.73 2a3c h ASP 200 N 0.84 0.47 0.11 -0.43 3.32 -0.85 -1.63 116.42 118.26 2a3c h ASP 200 Ca 0.20 -0.26 0.02 0.00 0.02 0.00 0.00 57.03 57.00 2a3c h ASP 200 Cb 0.25 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 2a3c h ASP 200 CO -0.01 0.61 -0.22 0.28 -1.72 0.00 0.00 179.24 178.18 2a3c h SER 201 N 0.30 -0.62 -0.76 6.45 0.02 -1.22 0.45 113.55 118.17 2a3c h SER 201 Ca 0.09 0.07 0.11 0.00 -0.84 0.00 0.00 61.79 61.22 2a3c h SER 201 Cb 0.35 0.24 -0.08 0.00 0.14 0.00 0.00 62.40 63.04 2a3c h SER 201 CO 0.01 -0.31 0.38 0.22 -1.14 0.00 0.00 176.83 175.99 2a3c h TYR 202 N -0.41 0.67 -0.33 3.45 3.20 -1.37 -2.00 116.97 120.18 2a3c h TYR 202 Ca 0.03 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 2a3c h TYR 202 Cb 0.44 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2a3c h TYR 202 CO -0.21 0.22 0.14 1.03 -1.64 0.00 0.00 178.16 177.70 2a3c h SER 203 N 0.61 0.45 -0.82 -2.11 0.87 -0.42 0.27 113.55 112.40 2a3c h SER 203 Ca 0.38 -0.16 0.06 0.00 -1.23 0.00 0.00 61.79 60.85 2a3c h SER 203 Cb 0.45 -0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 62.23 2a3c h SER 203 CO -0.30 0.49 0.50 0.00 -0.53 0.00 0.00 176.83 176.99 2a3c h ALA 204 N 0.99 1.13 0.11 6.23 0.00 -0.47 0.62 119.26 127.86 2a3c h ALA 204 Ca 0.11 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.74 2a3c h ALA 204 Cb 0.17 -0.21 0.02 0.00 0.00 0.00 0.00 17.79 17.76 2a3c h ALA 204 CO -0.01 0.23 -1.19 0.00 0.00 0.00 0.00 179.25 178.28 2a3c h ALA 205 N 1.39 0.10 0.00 0.00 0.00 -1.16 -3.40 119.26 116.20 2a3c h ALA 205 Ca 0.36 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2a3c h ALA 205 Cb 0.18 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2a3c h ALA 205 CO -0.17 0.80 0.00 0.09 0.00 0.00 0.00 179.25 179.97 2a3c n ASN 206 N -3.70 0.97 -0.78 0.00 3.02 0.92 -4.82 115.26 110.87 2a3c n ASN 206 Ca -0.11 -1.41 0.01 0.00 -0.03 0.00 0.00 54.58 53.05 2a3c n ASN 206 Cb 0.97 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 40.15 2a3c n ASN 206 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2a3c n ALA 207 N -0.20 2.10 -3.76 5.41 0.00 0.21 -4.67 120.51 119.60 2a3c n ALA 207 Ca 0.00 -1.37 -0.29 0.00 0.00 0.00 0.00 53.44 51.78 2a3c n ALA 207 Cb 0.29 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.18 2a3c n ALA 207 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a3c n GLY 208 N 0.14 -0.48 2.79 0.00 0.00 -0.85 -0.66 105.19 106.12 2a3c n GLY 208 Ca 0.02 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2a3c n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3c n GLY 209 N -1.44 0.73 3.49 -0.02 0.00 -0.89 -4.96 105.19 102.10 2a3c n GLY 209 Ca 0.03 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.52 2a3c n GLY 209 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2a3c n GLN 210 N -2.17 0.36 -2.84 1.61 -0.06 0.16 -4.84 117.38 109.60 2a3c n GLN 210 Ca 0.00 0.13 -0.43 0.00 -2.00 0.00 0.00 57.00 54.70 2a3c n GLN 210 Cb 0.02 -1.46 -0.04 0.00 -4.06 0.00 0.00 30.24 24.69 2a3c n GLN 210 CO 0.00 0.00 0.00 -1.58 -0.20 0.00 0.00 177.06 175.28 2a3c s HIS 211 N -0.40 2.82 0.27 3.69 5.65 -1.26 -4.84 115.29 121.23 2a3c s HIS 211 Ca 0.77 0.05 -0.22 0.00 0.25 0.00 0.00 55.06 55.91 2a3c s HIS 211 Cb -1.03 -4.03 -0.09 0.00 -1.18 0.00 0.00 32.58 26.25 2a3c s HIS 211 CO 0.55 -1.29 0.82 -0.06 -0.65 0.00 0.00 174.74 174.10 2a3c s PHE 212 N 3.88 3.63 0.38 3.88 0.08 -1.26 -5.03 117.98 123.53 2a3c s PHE 212 Ca 0.31 1.53 -0.15 0.00 0.12 0.00 0.00 56.93 58.75 2a3c s PHE 212 Cb -0.12 -2.73 -0.08 0.00 -0.57 0.00 0.00 43.02 39.51 2a3c s PHE 212 CO 0.20 0.25 0.79 -0.51 -0.10 0.00 0.00 175.22 175.86 2a3c s LEU 213 N -2.12 3.94 -0.10 -0.37 1.43 -0.49 -4.96 118.68 116.02 2a3c s LEU 213 Ca 0.47 1.32 -0.03 0.00 -1.03 0.00 0.00 54.13 54.86 2a3c s LEU 213 Cb -0.17 -4.16 0.04 0.00 0.03 0.00 0.00 46.19 41.94 2a3c s LEU 213 CO 0.21 -0.31 0.07 -0.22 0.23 0.00 0.00 176.35 176.33 2a3c s LEU 214 N -3.34 0.26 0.29 1.79 2.96 -1.26 -1.16 118.68 118.22 2a3c s LEU 214 Ca 0.55 -0.22 0.02 0.00 -0.22 0.00 0.00 54.13 54.26 2a3c s LEU 214 Cb -0.10 -0.20 -0.06 0.00 0.50 0.00 0.00 46.19 46.33 2a3c s LEU 214 CO 0.22 -0.29 0.08 0.42 -1.32 0.00 0.00 176.35 175.46 2a3c s THR 215 N 2.14 0.80 0.03 3.68 -4.23 -0.50 -0.91 115.64 116.65 2a3c s THR 215 Ca 0.04 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.54 2a3c s THR 215 Cb -0.14 -2.70 -0.03 0.00 1.34 0.00 0.00 72.50 70.98 2a3c s THR 215 CO -0.06 0.00 -0.03 0.68 -0.54 0.00 0.00 174.62 174.68 2a3c s VAL 216 N -3.57 0.15 -0.03 2.29 -7.23 -1.19 -0.80 120.40 110.02 2a3c s VAL 216 Ca 0.37 -1.23 -0.21 0.00 -1.81 0.00 0.00 61.98 59.11 2a3c s VAL 216 Cb 0.08 -0.71 -0.05 0.00 0.56 0.00 0.00 36.38 36.26 2a3c s VAL 216 CO 0.14 -0.68 0.60 0.00 -0.31 0.00 0.00 175.10 174.85 2a3c s ALA 217 N -2.34 3.46 0.06 1.32 0.00 -0.93 -1.05 121.76 122.29 2a3c s ALA 217 Ca -0.08 0.02 0.08 0.00 0.00 0.00 0.00 51.96 51.97 2a3c s ALA 217 Cb -0.04 -2.76 -0.03 0.00 0.00 0.00 0.00 23.12 20.30 2a3c s ALA 217 CO -0.04 0.10 -0.21 -1.54 0.00 0.00 0.00 175.76 174.07 2a3c s SER 218 N 0.06 2.51 0.53 0.00 1.04 0.74 -4.63 113.70 113.96 2a3c s SER 218 Ca 0.31 -0.57 -0.20 0.00 0.48 0.00 0.00 55.95 55.96 2a3c s SER 218 Cb -0.18 -0.19 -0.06 0.00 0.10 0.00 0.00 66.02 65.70 2a3c s SER 218 CO 0.16 0.13 1.18 -2.16 0.98 0.00 0.00 173.24 173.54 2a3c s PRO 219 N -1.40 3.34 -0.00 4.02 0.04 -1.26 -0.62 135.00 139.11 2a3c s PRO 219 Ca 0.07 1.77 0.17 0.00 0.04 0.00 0.00 61.00 63.06 2a3c s PRO 219 Cb -0.09 -2.12 -0.20 0.00 0.04 0.00 0.00 34.50 32.13 2a3c s PRO 219 CO 0.03 -0.90 0.71 0.00 0.04 0.00 0.00 177.00 176.88 2a3c n ALA 220 N -1.13 4.14 -2.59 8.56 0.00 -1.26 -4.78 120.51 123.45 2a3c n ALA 220 Ca 0.11 -0.49 -0.43 0.00 0.00 0.00 0.00 53.44 52.63 2a3c n ALA 220 Cb 0.49 -0.64 -0.02 0.00 0.00 0.00 0.00 19.45 19.28 2a3c n ALA 220 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2a3c s GLY 221 N -2.79 2.04 0.25 0.00 0.00 -1.26 -4.51 107.32 101.05 2a3c s GLY 221 Ca 0.05 0.40 -0.03 0.00 0.00 0.00 0.00 44.72 45.14 2a3c s GLY 221 CO 0.72 2.14 1.78 -2.55 0.00 0.00 0.00 173.10 175.19 2a3c h PRO 222 N 7.42 0.65 -0.98 2.90 0.11 -1.96 0.65 132.00 140.78 2a3c h PRO 222 Ca -0.28 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.85 2a3c h PRO 222 Cb 1.12 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 32.02 2a3c h PRO 222 CO 0.91 0.43 0.63 -0.44 -0.21 0.00 0.00 178.00 179.32 2a3c h ASP 223 N 0.67 1.01 -0.13 -2.05 3.32 -2.00 -0.20 116.42 117.04 2a3c h ASP 223 Ca 0.42 0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.32 2a3c h ASP 223 Cb 0.51 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.86 2a3c h ASP 223 CO -0.31 0.65 -0.54 0.11 -1.72 0.00 0.00 179.24 177.43 2a3c h LYS 224 N 1.15 0.59 -0.82 3.56 6.56 -1.62 -3.23 116.57 122.76 2a3c h LYS 224 Ca 0.42 -0.46 0.02 0.00 -1.06 0.00 0.00 60.65 59.57 2a3c h LYS 224 Cb 0.16 0.09 -0.04 0.00 -0.57 0.00 0.00 32.23 31.87 2a3c h LYS 224 CO -0.17 1.08 0.54 0.82 -2.06 0.00 0.00 179.45 179.66 2a3c h ILE 225 N 0.22 1.18 -0.69 1.86 2.04 -0.47 -2.53 117.51 119.12 2a3c h ILE 225 Ca -0.03 -0.37 0.14 0.00 1.00 0.00 0.00 64.86 65.60 2a3c h ILE 225 Cb 1.17 0.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 2a3c h ILE 225 CO 0.11 0.20 0.47 0.11 0.00 0.00 0.00 178.15 179.04 2a3c h LYS 226 N 1.07 0.37 -0.19 2.37 1.79 -1.06 -2.03 116.57 118.89 2a3c h LYS 226 Ca 0.31 -0.02 -0.14 0.00 -2.18 0.00 0.00 60.65 58.62 2a3c h LYS 226 Cb -0.07 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.49 2a3c h LYS 226 CO -0.09 0.24 -0.48 0.28 -1.08 0.00 0.00 179.45 178.32 2a3c h VAL 227 N 0.38 1.32 -4.11 0.50 2.07 -1.51 -3.46 116.25 111.44 2a3c h VAL 227 Ca 0.33 -1.70 -0.53 0.00 0.82 0.00 0.00 66.70 65.62 2a3c h VAL 227 Cb 0.78 1.70 0.12 0.00 -1.52 0.00 0.00 31.29 32.37 2a3c h VAL 227 CO -0.10 0.53 0.47 -0.76 0.02 0.00 0.00 177.57 177.73 2a3c s LEU 228 N -8.37 3.60 -0.99 2.57 1.43 -0.76 -4.75 118.68 111.40 2a3c s LEU 228 Ca -0.07 2.41 -0.09 0.00 -1.03 0.00 0.00 54.13 55.36 2a3c s LEU 228 Cb 0.12 -4.60 0.25 0.00 0.03 0.00 0.00 46.19 41.99 2a3c s LEU 228 CO 0.82 -1.74 0.95 -1.00 0.23 0.00 0.00 176.35 175.62 2a3c s HIS 229 N -1.62 4.06 0.14 0.29 3.76 -1.26 -4.94 115.29 115.72 2a3c s HIS 229 Ca 0.78 -2.59 -0.25 0.00 -0.15 0.00 0.00 55.06 52.85 2a3c s HIS 229 Cb -0.31 -3.71 -0.01 0.00 1.11 0.00 0.00 32.58 29.66 2a3c s HIS 229 CO 0.36 -0.92 1.62 -0.07 -0.85 0.00 0.00 174.74 174.87 2a3c h LEU 230 N 6.84 -0.93 -0.42 0.89 3.38 -1.91 -1.32 115.31 121.85 2a3c h LEU 230 Ca 0.15 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 2a3c h LEU 230 Cb 0.91 0.40 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 2a3c h LEU 230 CO 0.91 -0.34 0.21 0.11 0.09 0.00 0.00 178.44 179.43 2a3c h LYS 231 N -0.36 0.60 -0.78 1.13 1.57 -1.93 0.98 116.57 117.78 2a3c h LYS 231 Ca 0.11 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2a3c h LYS 231 Cb 0.52 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.68 2a3c h LYS 231 CO -0.36 0.51 0.51 -0.44 -0.57 0.00 0.00 179.45 179.10 2a3c h ASP 232 N 0.54 0.87 -0.12 0.86 3.32 -1.92 -2.44 116.42 117.52 2a3c h ASP 232 Ca 0.14 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 2a3c h ASP 232 Cb 0.10 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.44 2a3c h ASP 232 CO -0.02 0.62 0.02 0.24 -1.72 0.00 0.00 179.24 178.38 2a3c h MET 233 N 1.03 0.19 -0.55 3.56 2.86 -0.93 -2.99 114.93 118.10 2a3c h MET 233 Ca 0.29 -0.05 0.16 0.00 -2.06 0.00 0.00 59.70 58.04 2a3c h MET 233 Cb -0.08 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 2a3c h MET 233 CO -0.08 0.40 0.41 0.22 1.06 0.00 0.00 176.91 178.92 2a3c h ASP 234 N -0.04 0.00 0.20 1.22 3.58 -0.45 0.94 116.42 121.87 2a3c h ASP 234 Ca 0.04 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.46 2a3c h ASP 234 Cb 0.30 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.34 2a3c h ASP 234 CO 0.00 0.00 -0.12 -0.61 -2.88 0.00 0.00 179.24 175.63 2a3c h GLN 235 N 0.00 0.00 -0.01 0.28 5.75 -1.29 -2.55 115.11 117.29 2a3c h GLN 235 Ca 0.26 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.76 2a3c h GLN 235 Cb 1.08 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.63 2a3c h GLN 235 CO -0.00 0.12 -0.63 1.04 -2.65 0.00 0.00 178.83 176.71 2a3c n GLN 236 N -4.05 0.77 -4.08 1.69 1.13 0.31 -5.00 117.38 108.16 2a3c n GLN 236 Ca -0.02 -0.62 -0.31 0.00 -1.94 0.00 0.00 57.00 54.10 2a3c n GLN 236 Cb 0.20 -1.49 -0.07 0.00 0.11 0.00 0.00 30.24 29.00 2a3c n GLN 236 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2a3c s LEU 237 N -2.66 3.83 -0.00 1.08 1.43 -0.96 -4.78 118.68 116.61 2a3c s LEU 237 Ca 0.15 0.04 -0.00 0.00 -1.03 0.00 0.00 54.13 53.29 2a3c s LEU 237 Cb 0.17 -2.41 -0.26 0.00 0.03 0.00 0.00 46.19 43.72 2a3c s LEU 237 CO 0.67 0.21 0.83 0.44 0.23 0.00 0.00 176.35 178.72 2a3c h ASP 238 N 3.58 0.30 -5.01 2.29 3.32 -1.33 -3.48 116.42 116.10 2a3c h ASP 238 Ca -0.47 -0.45 0.24 0.00 0.02 0.00 0.00 57.03 56.37 2a3c h ASP 238 Cb 1.17 -0.10 -0.14 0.00 0.22 0.00 0.00 39.33 40.48 2a3c h ASP 238 CO 0.65 1.38 0.71 0.72 -1.72 0.00 0.00 179.24 180.97 2a3c s PHE 239 N -2.62 -0.14 -0.11 4.55 -0.12 -1.26 -4.91 117.98 113.39 2a3c s PHE 239 Ca -0.09 0.01 0.03 0.00 -0.05 0.00 0.00 56.93 56.84 2a3c s PHE 239 Cb 0.07 0.55 -0.00 0.00 -0.63 0.00 0.00 43.02 43.01 2a3c s PHE 239 CO 0.84 -0.39 -0.22 -1.58 -0.05 0.00 0.00 175.22 173.82 2a3c s TRP 240 N -2.69 2.61 -0.45 3.49 0.52 0.12 -3.18 118.94 119.35 2a3c s TRP 240 Ca 0.11 -0.97 -0.15 0.00 0.02 0.00 0.00 56.10 55.11 2a3c s TRP 240 Cb 0.01 -1.74 0.06 0.00 -1.15 0.00 0.00 33.47 30.65 2a3c s TRP 240 CO -0.04 -0.38 0.37 -0.80 0.02 0.00 0.00 176.95 176.12 2a3c s ASN 241 N 0.34 6.14 -0.17 2.95 0.01 -0.21 0.02 114.94 124.02 2a3c s ASN 241 Ca -0.17 -1.20 -0.29 0.00 -0.71 0.00 0.00 52.86 50.49 2a3c s ASN 241 Cb -0.18 -2.18 -0.01 0.00 0.41 0.00 0.00 41.25 39.30 2a3c s ASN 241 CO 0.08 -0.59 1.14 -0.22 -1.51 0.00 0.00 177.10 176.00 2a3c s LEU 242 N 1.65 4.17 -1.32 0.60 2.96 0.04 -0.19 118.68 126.60 2a3c s LEU 242 Ca 0.04 1.57 -0.14 0.00 -0.22 0.00 0.00 54.13 55.38 2a3c s LEU 242 Cb -0.23 -3.54 0.11 0.00 0.50 0.00 0.00 46.19 43.03 2a3c s LEU 242 CO 0.08 -0.67 1.83 0.23 -1.32 0.00 0.00 176.35 176.50 2a3c n MET 243 N 6.14 3.25 -1.48 1.98 2.81 0.21 -0.18 117.12 129.85 2a3c n MET 243 Ca 0.12 -3.29 -0.40 0.00 -1.81 0.00 0.00 57.70 52.32 2a3c n MET 243 Cb 0.46 -3.20 -0.02 0.00 -0.71 0.00 0.00 33.22 29.75 2a3c n MET 243 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2a3c n ALA 244 N 6.07 7.17 -3.84 3.04 0.00 -1.25 -4.29 120.51 127.40 2a3c n ALA 244 Ca 0.45 -3.67 -0.06 0.00 0.00 0.00 0.00 53.44 50.16 2a3c n ALA 244 Cb 0.41 -3.31 0.02 0.00 0.00 0.00 0.00 19.45 16.57 2a3c n ALA 244 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2a3c s TYR 245 N 1.82 0.10 -1.52 0.00 -0.85 -1.26 -4.61 117.35 111.04 2a3c s TYR 245 Ca 0.64 -0.66 -0.04 0.00 -0.52 0.00 0.00 57.07 56.48 2a3c s TYR 245 Cb 0.17 0.78 0.00 0.00 0.38 0.00 0.00 41.96 43.30 2a3c s TYR 245 CO -0.07 -1.29 0.58 -0.25 -1.52 0.00 0.00 175.55 173.00 2a3c n ASP 246 N -1.34 -6.02 0.22 -0.18 8.00 -0.19 -4.89 116.55 112.15 2a3c n ASP 246 Ca -0.06 -0.27 0.11 0.00 0.71 0.00 0.00 54.79 55.27 2a3c n ASP 246 Cb 0.60 -4.84 0.39 0.00 -0.02 0.00 0.00 41.12 37.25 2a3c n ASP 246 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2a3c h TYR 247 N -1.33 0.00 -3.54 1.24 0.05 -0.85 -3.45 116.97 109.09 2a3c h TYR 247 Ca -0.52 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.10 2a3c h TYR 247 Cb 1.36 0.00 -0.23 0.00 1.01 0.00 0.00 36.73 38.87 2a3c h TYR 247 CO 0.51 0.17 -0.54 0.00 -1.05 0.00 0.00 178.16 177.25 2a3c s ALA 248 N -3.46 -0.27 0.00 3.88 0.00 -1.25 -4.73 121.76 115.93 2a3c s ALA 248 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.95 2a3c s ALA 248 Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.22 2a3c s ALA 248 CO 0.64 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.65 2a3c n GLY 249 N 1.97 1.07 0.16 0.00 0.00 -1.26 -4.67 105.19 102.45 2a3c n GLY 249 Ca -0.20 -0.61 0.09 0.00 0.00 0.00 0.00 46.02 45.31 2a3c n GLY 249 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2a3c n SER 250 N 0.00 0.46 -0.14 1.61 3.41 -1.26 -0.11 113.62 117.59 2a3c n SER 250 Ca 0.00 0.67 0.12 0.00 -0.26 0.00 0.00 58.87 59.40 2a3c n SER 250 Cb 0.00 -0.69 0.16 0.00 -0.26 0.00 0.00 64.21 63.42 2a3c n SER 250 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2a3c n PHE 251 N -2.15 0.00 -2.83 7.33 3.01 -1.26 -4.95 117.46 116.60 2a3c n PHE 251 Ca -0.01 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.10 2a3c n PHE 251 Cb 0.15 -0.12 -0.07 0.00 -0.01 0.00 0.00 39.48 39.43 2a3c n PHE 251 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2a3c s SER 252 N -2.79 7.14 0.19 4.37 0.01 0.84 -4.98 113.70 118.49 2a3c s SER 252 Ca 0.15 1.72 -0.09 0.00 1.31 0.00 0.00 55.95 59.05 2a3c s SER 252 Cb 0.18 -2.54 0.11 0.00 0.21 0.00 0.00 66.02 63.98 2a3c s SER 252 CO 0.67 -0.18 1.72 0.28 0.41 0.00 0.00 173.24 176.14 2a3c h SER 253 N 2.66 1.05 -3.44 2.44 0.02 -1.93 -3.45 113.55 110.89 2a3c h SER 253 Ca -0.48 -0.22 -0.43 0.00 -0.84 0.00 0.00 61.79 59.82 2a3c h SER 253 Cb 1.19 -0.27 -0.14 0.00 0.14 0.00 0.00 62.40 63.31 2a3c h SER 253 CO 0.63 0.99 -0.65 -0.76 -1.14 0.00 0.00 176.83 175.90 2a3c s LEU 254 N -9.58 2.29 0.79 5.07 1.43 -1.26 -4.72 118.68 112.69 2a3c s LEU 254 Ca -0.12 -1.24 -0.12 0.00 -1.03 0.00 0.00 54.13 51.62 2a3c s LEU 254 Cb 0.14 -0.41 0.07 0.00 0.03 0.00 0.00 46.19 46.02 2a3c s LEU 254 CO 0.84 -0.47 1.13 -0.94 0.23 0.00 0.00 176.35 177.13 2a3c s SER 255 N -3.38 4.09 0.03 2.29 1.04 0.03 -4.83 113.70 112.96 2a3c s SER 255 Ca 0.30 2.04 -0.28 0.00 0.48 0.00 0.00 55.95 58.49 2a3c s SER 255 Cb 0.06 -2.55 0.10 0.00 0.10 0.00 0.00 66.02 63.73 2a3c s SER 255 CO 0.11 -2.32 1.23 -0.83 0.98 0.00 0.00 173.24 172.40 2a3c s GLY 256 N -2.85 -0.22 0.13 7.32 0.00 -1.26 -0.89 107.32 109.56 2a3c s GLY 256 Ca 0.66 0.26 -0.27 0.00 0.00 0.00 0.00 44.72 45.36 2a3c s GLY 256 CO 0.53 2.45 0.85 0.30 0.00 0.00 0.00 173.10 177.23 2a3c s HIS 257 N -2.30 3.85 -1.37 1.90 3.76 -0.32 -4.77 115.29 116.04 2a3c s HIS 257 Ca 0.21 1.69 0.24 0.00 -0.15 0.00 0.00 55.06 57.04 2a3c s HIS 257 Cb 0.01 -2.90 0.22 0.00 1.11 0.00 0.00 32.58 31.03 2a3c s HIS 257 CO -0.01 0.36 1.22 0.00 -0.85 0.00 0.00 174.74 175.46 2a3c n GLN 258 N 2.22 0.42 -1.13 1.40 10.64 -1.26 -3.86 117.38 125.80 2a3c n GLN 258 Ca -0.02 -0.31 -0.02 0.00 -1.83 0.00 0.00 57.00 54.82 2a3c n GLN 258 Cb 0.49 -1.49 -0.03 0.00 -0.86 0.00 0.00 30.24 28.34 2a3c n GLN 258 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2a3c n ALA 259 N -1.02 3.10 -1.77 2.61 0.00 -1.26 -0.24 120.51 121.93 2a3c n ALA 259 Ca 0.07 -1.26 -0.38 0.00 0.00 0.00 0.00 53.44 51.87 2a3c n ALA 259 Cb 0.36 -0.47 -0.00 0.00 0.00 0.00 0.00 19.45 19.34 2a3c n ALA 259 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2a3c s ASN 260 N -1.30 6.16 -0.01 0.00 4.22 -1.26 -4.89 114.94 117.85 2a3c s ASN 260 Ca 0.12 2.44 -0.17 0.00 -2.14 0.00 0.00 52.86 53.11 2a3c s ASN 260 Cb 0.14 -2.62 -0.33 0.00 1.28 0.00 0.00 41.25 39.72 2a3c s ASN 260 CO -0.06 -0.93 0.90 0.58 -2.04 0.00 0.00 177.10 175.55 2a3c h VAL 261 N 2.03 1.30 -2.59 3.54 2.07 -1.04 -2.18 116.25 119.37 2a3c h VAL 261 Ca -0.49 -2.61 -0.61 0.00 0.82 0.00 0.00 66.70 63.80 2a3c h VAL 261 Cb 1.25 3.05 -0.14 0.00 -1.52 0.00 0.00 31.29 33.92 2a3c h VAL 261 CO 0.61 0.78 -0.75 -0.31 0.02 0.00 0.00 177.57 177.92 2a3c s TYR 262 N -2.54 2.43 0.34 1.57 2.02 -1.19 -0.97 117.35 119.01 2a3c s TYR 262 Ca -0.12 -0.30 -0.27 0.00 -0.37 0.00 0.00 57.07 56.01 2a3c s TYR 262 Cb 0.03 -1.12 -0.09 0.00 -0.40 0.00 0.00 41.96 40.38 2a3c s TYR 262 CO 0.89 0.61 1.17 1.21 -1.57 0.00 0.00 175.55 177.86 2a3c s ASN 263 N -3.21 6.87 -0.74 2.29 2.47 -1.26 -4.69 114.94 116.66 2a3c s ASN 263 Ca 0.27 2.38 -0.19 0.00 0.42 0.00 0.00 52.86 55.74 2a3c s ASN 263 Cb -0.07 -2.63 0.12 0.00 -1.45 0.00 0.00 41.25 37.23 2a3c s ASN 263 CO 0.15 -0.44 0.90 -0.62 -3.72 0.00 0.00 177.10 173.37 2a3c s ASP 264 N -0.91 6.38 0.30 -4.21 -1.08 -1.26 -4.89 116.67 110.99 2a3c s ASP 264 Ca 0.51 -1.67 0.01 0.00 -0.52 0.00 0.00 52.55 50.87 2a3c s ASP 264 Cb -0.33 -2.35 0.52 0.00 -1.46 0.00 0.00 42.92 39.31 2a3c s ASP 264 CO 0.42 -1.11 1.90 0.71 0.52 0.00 0.00 175.17 177.61 2a3c h THR 265 N 5.78 1.05 0.00 1.71 1.35 -1.97 0.26 112.91 121.09 2a3c h THR 265 Ca -0.11 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 2a3c h THR 265 Cb 1.06 -0.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 2a3c h THR 265 CO 1.08 0.19 0.00 -1.54 -0.25 0.00 0.00 175.52 175.00 2a3c n SER 266 N -4.50 0.00 -2.73 5.36 3.41 -1.26 -4.11 113.62 109.78 2a3c n SER 266 Ca 0.15 0.14 -0.09 0.00 -0.26 0.00 0.00 58.87 58.81 2a3c n SER 266 Cb 0.22 -0.37 0.08 0.00 -0.26 0.00 0.00 64.21 63.88 2a3c n SER 266 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2a3c n ASN 267 N -1.37 -2.44 0.15 4.04 5.15 -0.44 -5.01 115.26 115.35 2a3c n ASN 267 Ca 0.10 -3.59 0.18 0.00 -0.60 0.00 0.00 54.58 50.67 2a3c n ASN 267 Cb 0.24 1.90 0.79 0.00 -0.53 0.00 0.00 39.78 42.18 2a3c n ASN 267 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2a3c h PRO 268 N 3.18 0.00 0.00 1.20 0.13 -0.70 -1.63 132.00 134.18 2a3c h PRO 268 Ca -0.11 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.98 2a3c h PRO 268 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 2a3c h PRO 268 CO 0.17 0.00 -0.15 -0.07 -0.23 0.00 0.00 178.00 177.72 2a3c h LEU 269 N 0.00 0.00 0.00 1.56 3.38 -1.89 -1.98 115.31 116.38 2a3c h LEU 269 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2a3c h LEU 269 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2a3c h LEU 269 CO -0.00 0.15 -0.10 -1.54 0.09 0.00 0.00 178.44 177.03 2a3c n SER 270 N -3.81 0.34 -3.53 -0.43 3.41 -0.61 -4.34 113.62 104.65 2a3c n SER 270 Ca -0.02 0.41 -0.27 0.00 -0.26 0.00 0.00 58.87 58.73 2a3c n SER 270 Cb 0.25 -0.45 -0.09 0.00 -0.26 0.00 0.00 64.21 63.66 2a3c n SER 270 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2a3c n THR 271 N -1.76 1.07 0.31 6.66 -2.24 -0.74 -1.18 114.28 116.40 2a3c n THR 271 Ca 0.06 -4.63 0.20 0.00 -2.27 0.00 0.00 64.05 57.41 2a3c n THR 271 Cb 0.37 -2.04 1.02 0.00 -2.10 0.00 0.00 70.33 67.58 2a3c n THR 271 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2a3c h PRO 272 N 4.74 0.00 -4.35 -0.78 0.13 -1.76 -3.44 132.00 126.55 2a3c h PRO 272 Ca 0.17 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.12 2a3c h PRO 272 Cb 0.76 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.75 2a3c h PRO 272 CO 0.67 0.00 -0.53 -0.06 -0.23 0.00 0.00 178.00 177.85 2a3c s PHE 273 N -3.95 0.89 -0.16 1.56 0.40 -1.26 -5.13 117.98 110.32 2a3c s PHE 273 Ca -0.03 -1.19 -0.26 0.00 -0.60 0.00 0.00 56.93 54.85 2a3c s PHE 273 Cb 0.11 -0.38 0.06 0.00 0.51 0.00 0.00 43.02 43.32 2a3c s PHE 273 CO 0.41 -0.66 0.66 0.54 0.70 0.00 0.00 175.22 176.86 2a3c s ASN 274 N -3.09 -0.66 0.28 1.36 2.20 -1.26 -4.79 114.94 108.98 2a3c s ASN 274 Ca 0.30 1.04 -0.00 0.00 -0.94 0.00 0.00 52.86 53.26 2a3c s ASN 274 Cb 0.06 0.99 0.41 0.00 -2.00 0.00 0.00 41.25 40.71 2a3c s ASN 274 CO 0.08 -0.39 1.80 0.74 -2.94 0.00 0.00 177.10 176.38 2a3c h THR 275 N 3.65 1.23 -0.44 0.54 2.02 -0.97 -3.13 112.91 115.81 2a3c h THR 275 Ca -0.28 -0.92 0.05 0.00 0.77 0.00 0.00 66.41 66.03 2a3c h THR 275 Cb 1.15 0.86 -0.05 0.00 -1.74 0.00 0.00 68.15 68.38 2a3c h THR 275 CO 0.22 0.32 0.17 -0.61 0.37 0.00 0.00 175.52 175.99 2a3c h GLN 276 N 0.69 0.34 -0.36 6.66 5.75 -1.35 -0.09 115.11 126.75 2a3c h GLN 276 Ca 0.14 -0.02 0.06 0.00 -0.15 0.00 0.00 58.65 58.68 2a3c h GLN 276 Cb 0.39 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 28.81 2a3c h GLN 276 CO 0.01 0.23 0.05 1.15 -2.65 0.00 0.00 178.83 177.62 2a3c h THR 277 N 0.35 0.79 -0.32 2.39 2.02 -1.81 0.06 112.91 116.40 2a3c h THR 277 Ca 0.20 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.33 2a3c h THR 277 Cb 0.17 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 2a3c h THR 277 CO -0.19 0.03 0.21 0.00 0.37 0.00 0.00 175.52 175.94 2a3c h ALA 278 N 1.29 0.41 -0.62 6.16 0.00 -1.34 -2.00 119.26 123.15 2a3c h ALA 278 Ca 0.18 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 2a3c h ALA 278 Cb 0.22 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2a3c h ALA 278 CO -0.25 -0.12 0.24 -0.07 0.00 0.00 0.00 179.25 179.06 2a3c h LEU 279 N 0.43 0.83 -0.98 0.00 3.38 -0.47 -1.50 115.31 117.01 2a3c h LEU 279 Ca 0.12 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2a3c h LEU 279 Cb -0.03 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2a3c h LEU 279 CO -0.02 0.75 0.03 0.44 0.09 0.00 0.00 178.44 179.73 2a3c h ASP 280 N 0.90 0.73 -0.48 -0.43 3.32 -0.67 -0.21 116.42 119.58 2a3c h ASP 280 Ca 0.21 -0.16 -0.08 0.00 0.02 0.00 0.00 57.03 57.02 2a3c h ASP 280 Cb 0.18 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 2a3c h ASP 280 CO -0.02 0.78 -0.02 -0.07 -1.72 0.00 0.00 179.24 178.20 2a3c h LEU 281 N 0.73 0.85 -0.50 1.55 3.38 -0.72 -0.20 115.31 120.40 2a3c h LEU 281 Ca 0.15 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.72 2a3c h LEU 281 Cb 0.40 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2a3c h LEU 281 CO 0.01 0.96 0.01 1.88 0.09 0.00 0.00 178.44 181.39 2a3c h TYR 282 N 0.72 0.95 -0.35 1.13 -1.99 -0.94 -0.30 116.97 116.19 2a3c h TYR 282 Ca 0.13 -0.16 -0.07 0.00 2.00 0.00 0.00 58.73 60.63 2a3c h TYR 282 Cb 0.54 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 39.01 2a3c h TYR 282 CO 0.04 0.89 -0.05 0.00 -0.00 0.00 0.00 178.16 179.05 2a3c h ARG 283 N 0.74 0.65 0.00 4.88 3.08 -0.95 -1.13 114.38 121.65 2a3c h ARG 283 Ca 0.14 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 2a3c h ARG 283 Cb 0.51 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 2a3c h ARG 283 CO 0.02 0.79 -0.19 0.00 -1.07 0.00 0.00 179.97 179.53 2a3c h ALA 284 N 0.83 1.32 0.00 0.04 0.00 -0.95 -0.67 119.26 119.82 2a3c h ALA 284 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2a3c h ALA 284 Cb 0.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2a3c h ALA 284 CO 0.03 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.92 2a3c n GLY 285 N -0.58 -1.17 0.00 0.00 0.00 -0.13 -4.90 105.19 98.41 2a3c n GLY 285 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2a3c n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3c n GLY 286 N 1.15 0.52 3.70 -0.02 0.00 -0.26 -4.18 105.19 106.11 2a3c n GLY 286 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2a3c n GLY 286 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a3c s VAL 287 N -2.00 4.91 0.30 1.61 1.01 -0.48 -4.95 120.40 120.80 2a3c s VAL 287 Ca 0.00 1.80 -0.30 0.00 0.00 0.00 0.00 61.98 63.49 2a3c s VAL 287 Cb 0.00 -4.20 -0.11 0.00 0.00 0.00 0.00 36.38 32.07 2a3c s VAL 287 CO 0.00 0.14 1.50 -2.84 0.00 0.00 0.00 175.10 173.90 2a3c s PRO 288 N 1.28 4.19 0.21 2.72 0.02 -1.26 -4.22 135.00 137.94 2a3c s PRO 288 Ca 0.45 2.46 -0.10 0.00 0.02 0.00 0.00 61.00 63.82 2a3c s PRO 288 Cb -0.19 -3.05 0.27 0.00 0.02 0.00 0.00 34.50 31.56 2a3c s PRO 288 CO 0.21 -0.51 1.73 0.00 -0.33 0.00 0.00 177.00 178.10 2a3c h ALA 289 N 4.47 0.73 0.00 -1.55 0.00 -1.90 -1.20 119.26 119.81 2a3c h ALA 289 Ca -0.47 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2a3c h ALA 289 Cb 1.22 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2a3c h ALA 289 CO 0.75 -0.24 0.00 0.27 0.00 0.00 0.00 179.25 180.03 2a3c n ASN 290 N -5.05 0.00 -0.58 0.00 0.23 -1.02 -1.21 115.26 107.63 2a3c n ASN 290 Ca 0.08 -0.67 0.07 0.00 -0.53 0.00 0.00 54.58 53.53 2a3c n ASN 290 Cb 0.28 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 38.06 2a3c n ASN 290 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2a3c n LYS 291 N -0.75 1.12 -3.75 -3.83 5.02 -0.45 -3.85 118.16 111.67 2a3c n LYS 291 Ca 0.05 -1.41 -0.37 0.00 -2.02 0.00 0.00 58.31 54.56 2a3c n LYS 291 Cb 0.02 -1.27 -0.12 0.00 -0.02 0.00 0.00 35.03 33.64 2a3c n LYS 291 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2a3c s ILE 292 N -1.13 4.09 -0.17 -0.18 1.01 -0.35 0.12 121.20 124.59 2a3c s ILE 292 Ca 0.17 -0.60 -0.15 0.00 0.00 0.00 0.00 60.65 60.07 2a3c s ILE 292 Cb 0.12 -3.08 -0.04 0.00 0.01 0.00 0.00 42.46 39.46 2a3c s ILE 292 CO 0.17 0.10 0.34 -0.69 0.00 0.00 0.00 174.94 174.87 2a3c s VAL 293 N 1.53 5.26 -0.46 2.92 1.01 0.10 0.21 120.40 130.98 2a3c s VAL 293 Ca 0.03 0.62 -0.29 0.00 0.00 0.00 0.00 61.98 62.35 2a3c s VAL 293 Cb -0.17 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.55 2a3c s VAL 293 CO 0.03 0.34 1.35 -0.22 0.00 0.00 0.00 175.10 176.60 2a3c s LEU 294 N 0.77 3.56 0.30 3.92 2.96 0.05 -0.78 118.68 129.46 2a3c s LEU 294 Ca 0.18 0.64 -0.29 0.00 -0.22 0.00 0.00 54.13 54.45 2a3c s LEU 294 Cb -0.14 -3.46 -0.10 0.00 0.50 0.00 0.00 46.19 43.00 2a3c s LEU 294 CO 0.06 -1.45 1.12 -0.83 -1.32 0.00 0.00 176.35 173.93 2a3c s GLY 295 N 3.70 3.02 0.01 7.98 0.00 0.75 -1.08 107.32 121.70 2a3c s GLY 295 Ca 0.57 0.92 0.01 0.00 0.00 0.00 0.00 44.72 46.22 2a3c s GLY 295 CO 0.31 1.51 -0.04 1.06 0.00 0.00 0.00 173.10 175.94 2a3c s MET 296 N -1.64 0.34 0.13 2.90 -1.94 0.26 -3.86 119.30 115.49 2a3c s MET 296 Ca 0.47 -0.33 -0.26 0.00 -1.71 0.00 0.00 55.69 53.85 2a3c s MET 296 Cb -0.32 -0.23 -0.07 0.00 2.01 0.00 0.00 34.83 36.22 2a3c s MET 296 CO 0.41 0.05 0.82 -1.25 -0.01 0.00 0.00 175.02 175.04 2a3c s PRO 297 N -0.61 4.60 -0.49 2.03 0.04 -1.26 -2.74 135.00 136.57 2a3c s PRO 297 Ca -0.03 1.21 0.03 0.00 0.04 0.00 0.00 61.00 62.24 2a3c s PRO 297 Cb -0.04 -3.31 0.47 0.00 0.04 0.00 0.00 34.50 31.65 2a3c s PRO 297 CO -0.00 0.42 1.67 1.28 0.04 0.00 0.00 177.00 180.41 2a3c n LEU 298 N 2.15 6.33 -3.88 -3.56 4.77 -0.66 -4.60 117.00 117.55 2a3c n LEU 298 Ca -0.03 -4.37 -0.08 0.00 -0.03 0.00 0.00 56.01 51.50 2a3c n LEU 298 Cb 0.49 -0.71 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 2a3c n LEU 298 CO 0.48 1.66 0.39 -0.72 -1.33 0.00 0.00 177.39 177.86 2a3c s TYR 299 N -3.67 -0.05 0.11 -1.77 1.13 -1.26 -1.45 117.35 110.40 2a3c s TYR 299 Ca 0.58 -0.37 0.07 0.00 -1.41 0.00 0.00 57.07 55.94 2a3c s TYR 299 Cb 0.46 0.56 -0.04 0.00 -1.10 0.00 0.00 41.96 41.85 2a3c s TYR 299 CO 0.01 -1.16 -0.18 0.20 -2.51 0.00 0.00 175.55 171.92 2a3c s GLY 300 N -2.94 1.18 -0.16 5.49 0.00 0.15 -4.56 107.32 106.47 2a3c s GLY 300 Ca 0.14 -1.27 -0.04 0.00 0.00 0.00 0.00 44.72 43.55 2a3c s GLY 300 CO 0.07 -1.30 -0.04 0.50 0.00 0.00 0.00 173.10 172.33 2a3c s ARG 301 N -2.23 3.63 0.25 2.90 0.52 -0.67 -0.50 118.95 122.86 2a3c s ARG 301 Ca 0.08 -0.54 0.07 0.00 -0.52 0.00 0.00 55.73 54.82 2a3c s ARG 301 Cb -0.08 -2.92 -0.04 0.00 0.52 0.00 0.00 34.95 32.43 2a3c s ARG 301 CO 0.04 0.19 0.20 -1.54 0.02 0.00 0.00 175.30 174.21 2a3c s SER 302 N 0.49 5.53 -0.02 0.23 1.04 -0.34 -0.83 113.70 119.80 2a3c s SER 302 Ca -0.03 -0.25 0.01 0.00 0.48 0.00 0.00 55.95 56.15 2a3c s SER 302 Cb -0.14 -1.40 0.02 0.00 0.10 0.00 0.00 66.02 64.60 2a3c s SER 302 CO 0.03 -0.05 -0.01 -0.36 0.98 0.00 0.00 173.24 173.84 2a3c s PHE 303 N -2.14 0.30 0.26 5.02 0.40 0.76 -4.62 117.98 117.96 2a3c s PHE 303 Ca 0.33 -0.01 0.06 0.00 -0.60 0.00 0.00 56.93 56.71 2a3c s PHE 303 Cb -0.08 -0.35 -0.03 0.00 0.51 0.00 0.00 43.02 43.07 2a3c s PHE 303 CO 0.25 -0.10 0.30 0.00 0.70 0.00 0.00 175.22 176.37 2a3c s ALA 304 N 0.76 3.81 -1.27 5.36 0.00 0.10 -1.47 121.76 129.05 2a3c s ALA 304 Ca -0.08 -1.35 -0.14 0.00 0.00 0.00 0.00 51.96 50.39 2a3c s ALA 304 Cb -0.11 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.50 2a3c s ALA 304 CO -0.01 0.21 0.60 0.09 0.00 0.00 0.00 175.76 176.64 2a3c n ASN 305 N -1.33 -2.92 -4.10 0.00 3.02 -0.97 -0.69 115.26 108.26 2a3c n ASN 305 Ca -0.07 -1.06 -0.17 0.00 -0.03 0.00 0.00 54.58 53.25 2a3c n ASN 305 Cb 0.58 -2.95 -0.12 0.00 -0.61 0.00 0.00 39.78 36.67 2a3c n ASN 305 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2a3c s THR 306 N -3.71 0.82 0.15 3.41 -1.32 -0.88 -3.67 115.64 110.44 2a3c s THR 306 Ca 0.27 -1.01 0.10 0.00 -1.21 0.00 0.00 61.69 59.85 2a3c s THR 306 Cb -0.11 -0.80 -0.08 0.00 -1.51 0.00 0.00 72.50 70.01 2a3c s THR 306 CO 0.89 -0.18 1.47 0.44 -2.21 0.00 0.00 174.62 175.03 2a3c h ASP 307 N 4.75 0.00 0.00 8.08 3.32 -1.86 -3.43 116.42 127.28 2a3c h ASP 307 Ca -0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2a3c h ASP 307 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2a3c h ASP 307 CO 0.43 0.74 0.00 0.61 -1.72 0.00 0.00 179.24 179.29 2a3c n GLY 308 N 0.83 -1.12 3.76 2.75 0.00 -1.26 -5.09 105.19 105.05 2a3c n GLY 308 Ca -0.00 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 2a3c n GLY 308 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2a3c s PRO 309 N -0.99 4.13 -0.92 1.61 0.02 -1.26 -2.94 135.00 134.65 2a3c s PRO 309 Ca 0.00 2.55 -0.01 0.00 0.02 0.00 0.00 61.00 63.56 2a3c s PRO 309 Cb 0.00 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.51 2a3c s PRO 309 CO 0.00 -0.58 0.17 0.41 -0.33 0.00 0.00 177.00 176.67 2a3c n GLY 310 N 1.65 -0.04 3.36 0.52 0.00 -0.07 -4.70 105.19 105.91 2a3c n GLY 310 Ca 0.06 -0.34 -0.19 0.00 0.00 0.00 0.00 46.02 45.55 2a3c n GLY 310 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a3c s LYS 311 N -4.87 1.41 0.67 1.61 -0.14 -1.15 -4.64 119.74 112.62 2a3c s LYS 311 Ca 0.08 -1.71 -0.17 0.00 -1.36 0.00 0.00 55.97 52.82 2a3c s LYS 311 Cb -0.04 -0.82 0.00 0.00 -1.68 0.00 0.00 37.83 35.30 2a3c s LYS 311 CO 0.10 -0.04 1.25 -2.14 -0.76 0.00 0.00 175.35 173.76 2a3c s PRO 312 N -3.81 2.48 0.22 -1.68 0.02 -1.26 -0.79 135.00 130.18 2a3c s PRO 312 Ca 0.28 1.91 -0.10 0.00 0.02 0.00 0.00 61.00 63.11 2a3c s PRO 312 Cb 0.05 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.70 2a3c s PRO 312 CO 0.09 -1.61 0.37 1.52 -0.33 0.00 0.00 177.00 177.04 2a3c s TYR 313 N -1.65 0.51 -0.22 6.54 1.13 -1.26 -4.19 117.35 118.21 2a3c s TYR 313 Ca 0.79 -0.85 -0.04 0.00 -1.41 0.00 0.00 57.07 55.56 2a3c s TYR 313 Cb -0.33 0.00 0.09 0.00 -1.10 0.00 0.00 41.96 40.62 2a3c s TYR 313 CO 0.40 -0.87 0.16 1.21 -2.51 0.00 0.00 175.55 173.95 2a3c s ASN 314 N -3.03 2.25 0.00 -0.18 2.47 0.13 -4.99 114.94 111.59 2a3c s ASN 314 Ca 0.24 -0.67 0.00 0.00 0.42 0.00 0.00 52.86 52.85 2a3c s ASN 314 Cb 0.02 0.01 0.00 0.00 -1.45 0.00 0.00 41.25 39.83 2a3c s ASN 314 CO 0.08 -0.37 0.00 0.61 -3.72 0.00 0.00 177.10 173.70 2a3c n GLY 315 N 5.29 -1.20 0.00 1.21 0.00 -1.26 -4.33 105.19 104.90 2a3c n GLY 315 Ca -0.06 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.35 2a3c n GLY 315 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2a3c n VAL 316 N -1.32 0.57 -4.48 1.61 0.24 -1.26 -0.72 118.33 112.96 2a3c n VAL 316 Ca 0.00 -0.66 0.00 0.00 -2.04 0.00 0.00 64.34 61.64 2a3c n VAL 316 Cb 0.00 0.77 0.00 0.00 -1.47 0.00 0.00 33.84 33.14 2a3c n VAL 316 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2a3c n GLY 317 N -0.29 -0.39 0.00 7.63 0.00 -1.26 -3.86 105.19 107.02 2a3c n GLY 317 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2a3c n GLY 317 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2a3c n GLN 318 N -0.06 3.57 -2.73 1.61 6.02 -1.26 -3.46 117.38 121.07 2a3c n GLN 318 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 57.00 2a3c n GLN 318 Cb 0.00 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.27 2a3c n GLN 318 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2a3c n GLY 319 N 5.00 0.49 0.07 1.08 0.00 -1.26 -0.30 105.19 110.28 2a3c n GLY 319 Ca 0.00 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 2a3c n GLY 319 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2a3c h SER 320 N 0.84 -0.00 0.00 1.61 0.02 -1.41 -3.42 113.55 111.19 2a3c h SER 320 Ca -0.09 -0.92 0.00 0.00 -0.84 0.00 0.00 61.79 59.94 2a3c h SER 320 Cb 0.50 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.04 2a3c h SER 320 CO 0.13 0.94 0.00 0.79 -1.14 0.00 0.00 176.83 177.56 2a3c n TRP 321 N -4.63 0.00 -3.60 3.45 7.02 -1.26 -5.05 117.44 113.36 2a3c n TRP 321 Ca -0.09 0.00 -0.14 0.00 -1.02 0.00 0.00 57.50 56.24 2a3c n TRP 321 Cb 0.44 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.27 2a3c n TRP 321 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2a3c s GLU 322 N -0.46 0.84 0.28 -0.99 2.12 -1.26 -5.13 118.70 114.10 2a3c s GLU 322 Ca 0.00 0.76 -0.30 0.00 0.36 0.00 0.00 54.97 55.79 2a3c s GLU 322 Cb 0.00 0.40 -0.11 0.00 0.26 0.00 0.00 34.13 34.69 2a3c s GLU 322 CO 0.00 -0.15 1.51 -0.80 -0.54 0.00 0.00 175.26 175.28 2a3c s ASN 323 N -0.04 6.51 0.00 -1.70 0.01 -1.26 -2.63 114.94 115.83 2a3c s ASN 323 Ca -0.02 2.83 0.00 0.00 -0.71 0.00 0.00 52.86 54.96 2a3c s ASN 323 Cb -0.04 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 38.99 2a3c s ASN 323 CO 0.02 -0.80 0.00 0.61 -1.51 0.00 0.00 177.10 175.42 2a3c n GLY 324 N 1.95 1.03 3.01 0.66 0.00 0.59 -4.88 105.19 107.55 2a3c n GLY 324 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2a3c n GLY 324 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a3c s VAL 325 N -2.72 1.06 -0.02 1.61 1.01 -1.08 -1.19 120.40 119.07 2a3c s VAL 325 Ca 0.00 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.58 2a3c s VAL 325 Cb 0.00 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 2a3c s VAL 325 CO 0.00 0.33 -0.15 0.26 0.00 0.00 0.00 175.10 175.54 2a3c s TRP 326 N 0.61 1.43 0.33 5.22 0.52 0.35 -0.95 118.94 126.45 2a3c s TRP 326 Ca -0.13 -0.31 -0.29 0.00 0.02 0.00 0.00 56.10 55.39 2a3c s TRP 326 Cb -0.15 -0.94 -0.11 0.00 -1.15 0.00 0.00 33.47 31.13 2a3c s TRP 326 CO 0.03 -0.06 1.43 -0.51 0.02 0.00 0.00 176.95 177.86 2a3c s ASP 327 N -0.23 6.54 0.28 2.95 1.01 -1.26 0.30 116.67 126.25 2a3c s ASP 327 Ca 0.03 2.86 -0.01 0.00 0.71 0.00 0.00 52.55 56.13 2a3c s ASP 327 Cb -0.07 -2.65 0.44 0.00 1.01 0.00 0.00 42.92 41.65 2a3c s ASP 327 CO 0.00 -0.74 1.89 0.22 0.21 0.00 0.00 175.17 176.75 2a3c h TYR 328 N 3.71 1.16 0.00 4.23 3.20 -1.15 -0.38 116.97 127.75 2a3c h TYR 328 Ca -0.49 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.41 2a3c h TYR 328 Cb 1.23 -0.38 0.00 0.00 1.54 0.00 0.00 36.73 39.12 2a3c h TYR 328 CO 0.56 0.60 0.00 0.36 -1.64 0.00 0.00 178.16 178.04 2a3c n LYS 329 N -4.50 0.03 -0.33 1.82 2.85 -0.55 -0.55 118.16 116.93 2a3c n LYS 329 Ca 0.15 0.35 0.11 0.00 -1.05 0.00 0.00 58.31 57.87 2a3c n LYS 329 Cb 0.19 -1.50 0.29 0.00 -0.65 0.00 0.00 35.03 33.36 2a3c n LYS 329 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2a3c n ALA 330 N -1.41 2.34 -2.44 0.58 0.00 -0.15 -4.96 120.51 114.47 2a3c n ALA 330 Ca 0.01 -1.27 -0.26 0.00 0.00 0.00 0.00 53.44 51.93 2a3c n ALA 330 Cb 0.04 -0.84 -0.12 0.00 0.00 0.00 0.00 19.45 18.53 2a3c n ALA 330 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2a3c s LEU 331 N -1.01 2.38 0.61 0.00 1.43 0.29 -3.96 118.68 118.41 2a3c s LEU 331 Ca 0.44 -0.80 -0.13 0.00 -1.03 0.00 0.00 54.13 52.62 2a3c s LEU 331 Cb 0.23 -1.06 -0.04 0.00 0.03 0.00 0.00 46.19 45.35 2a3c s LEU 331 CO 0.30 0.10 1.03 -2.16 0.23 0.00 0.00 176.35 175.85 2a3c s PRO 332 N -2.37 3.46 0.42 1.29 0.04 -1.26 -5.02 135.00 131.56 2a3c s PRO 332 Ca 0.15 0.92 -0.18 0.00 0.04 0.00 0.00 61.00 61.93 2a3c s PRO 332 Cb -0.08 -2.06 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 2a3c s PRO 332 CO 0.07 -0.68 0.89 -0.65 0.04 0.00 0.00 177.00 176.67 2a3c s GLN 333 N -4.73 4.07 0.24 4.56 -0.21 -1.25 -4.98 119.66 117.35 2a3c s GLN 333 Ca 0.58 0.92 -0.29 0.00 0.02 0.00 0.00 55.36 56.59 2a3c s GLN 333 Cb -0.12 -2.25 -0.15 0.00 1.00 0.00 0.00 33.01 31.49 2a3c s GLN 333 CO 0.47 -0.04 0.89 0.00 -2.12 0.00 0.00 175.29 174.48 2a3c n ALA 334 N -0.85 -1.17 0.00 6.09 0.00 -1.26 -1.78 120.51 121.54 2a3c n ALA 334 Ca 0.06 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2a3c n ALA 334 Cb 0.54 -1.89 0.00 0.00 0.00 0.00 0.00 19.45 18.09 2a3c n ALA 334 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a3c n GLY 335 N 1.57 3.19 3.93 0.00 0.00 -1.26 -5.04 105.19 107.58 2a3c n GLY 335 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 2a3c n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3c s ALA 336 N -1.98 3.68 -0.08 4.61 0.00 -0.74 -4.70 121.76 122.56 2a3c s ALA 336 Ca 0.00 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.21 2a3c s ALA 336 Cb 0.00 -2.17 -0.00 0.00 0.00 0.00 0.00 23.12 20.94 2a3c s ALA 336 CO 0.00 0.07 -0.23 0.99 0.00 0.00 0.00 175.76 176.60 2a3c s THR 337 N -2.24 1.91 0.51 0.00 2.01 -0.07 -4.86 115.64 112.89 2a3c s THR 337 Ca 0.41 -0.96 -0.18 0.00 0.31 0.00 0.00 61.69 61.28 2a3c s THR 337 Cb -0.10 -1.64 -0.08 0.00 0.01 0.00 0.00 72.50 70.69 2a3c s THR 337 CO 0.34 0.53 1.00 -1.61 -0.69 0.00 0.00 174.62 174.20 2a3c s GLU 338 N 0.16 3.83 -0.03 4.92 2.02 -1.26 -1.29 118.70 127.04 2a3c s GLU 338 Ca -0.12 1.12 -0.01 0.00 0.02 0.00 0.00 54.97 55.98 2a3c s GLU 338 Cb -0.16 -2.11 0.02 0.00 0.10 0.00 0.00 34.13 31.98 2a3c s GLU 338 CO 0.06 -0.38 0.07 -1.01 0.02 0.00 0.00 175.26 174.02 2a3c s HIS 339 N -2.38 -0.06 -0.08 1.61 3.76 0.81 -4.95 115.29 114.01 2a3c s HIS 339 Ca 0.62 0.23 0.02 0.00 -0.15 0.00 0.00 55.06 55.79 2a3c s HIS 339 Cb -0.12 -0.10 -0.02 0.00 1.11 0.00 0.00 32.58 33.45 2a3c s HIS 339 CO 0.27 -0.09 -0.14 0.08 -0.85 0.00 0.00 174.74 174.01 2a3c s VAL 340 N 0.70 3.06 -0.68 -0.90 1.01 -1.26 -1.00 120.40 121.33 2a3c s VAL 340 Ca -0.06 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.27 2a3c s VAL 340 Cb -0.08 -2.23 0.16 0.00 0.00 0.00 0.00 36.38 34.24 2a3c s VAL 340 CO -0.03 0.57 0.46 -0.76 0.00 0.00 0.00 175.10 175.34 2a3c s LEU 341 N -0.35 4.74 0.27 3.92 1.43 0.42 -4.99 118.68 124.11 2a3c s LEU 341 Ca 0.03 -3.74 -0.01 0.00 -1.03 0.00 0.00 54.13 49.39 2a3c s LEU 341 Cb -0.13 -1.63 0.59 0.00 0.03 0.00 0.00 46.19 45.06 2a3c s LEU 341 CO 0.02 -0.10 1.68 1.55 0.23 0.00 0.00 176.35 179.73 2a3c h PRO 342 N 5.55 0.28 0.00 1.29 0.13 -1.96 -1.94 132.00 135.35 2a3c h PRO 342 Ca 0.11 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2a3c h PRO 342 Cb 0.77 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2a3c h PRO 342 CO 0.71 0.19 0.00 -0.25 -0.23 0.00 0.00 178.00 178.42 2a3c n ASP 343 N -5.15 0.00 0.00 1.44 8.00 -1.26 -1.20 116.55 118.38 2a3c n ASP 343 Ca 0.18 0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.76 2a3c n ASP 343 Cb 0.56 -0.28 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 2a3c n ASP 343 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2a3c n ILE 344 N -1.28 0.40 -3.75 0.53 -5.35 -0.82 -4.60 119.36 104.49 2a3c n ILE 344 Ca 0.07 -0.60 -0.33 0.00 -0.27 0.00 0.00 62.75 61.62 2a3c n ILE 344 Cb 0.11 0.90 0.03 0.00 -1.74 0.00 0.00 39.64 38.94 2a3c n ILE 344 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 2a3c n MET 345 N -0.20 -1.01 -3.97 6.28 2.81 -0.34 -0.66 117.12 120.03 2a3c n MET 345 Ca 0.00 0.44 -0.09 0.00 -1.81 0.00 0.00 57.70 56.24 2a3c n MET 345 Cb 0.18 -3.68 -0.10 0.00 -0.71 0.00 0.00 33.22 28.91 2a3c n MET 345 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2a3c s ALA 346 N -3.42 0.08 0.07 3.04 0.00 -1.08 -4.11 121.76 116.35 2a3c s ALA 346 Ca 0.42 -0.67 -0.01 0.00 0.00 0.00 0.00 51.96 51.70 2a3c s ALA 346 Cb -0.17 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 2a3c s ALA 346 CO 0.88 -0.28 0.00 -1.54 0.00 0.00 0.00 175.76 174.82 2a3c s SER 347 N -2.08 0.43 0.08 0.00 1.04 -1.26 -0.44 113.70 111.48 2a3c s SER 347 Ca -0.06 -1.02 -0.26 0.00 0.48 0.00 0.00 55.95 55.09 2a3c s SER 347 Cb -0.02 0.23 0.08 0.00 0.10 0.00 0.00 66.02 66.41 2a3c s SER 347 CO -0.04 -0.64 0.68 -0.72 0.98 0.00 0.00 173.24 173.50 2a3c s TYR 348 N -3.94 -0.51 0.14 5.02 1.13 -0.17 -3.39 117.35 115.63 2a3c s TYR 348 Ca 0.11 0.44 0.06 0.00 -1.41 0.00 0.00 57.07 56.26 2a3c s TYR 348 Cb 0.08 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.43 2a3c s TYR 348 CO -0.08 -0.73 0.02 -1.54 -2.51 0.00 0.00 175.55 170.71 2a3c s SER 349 N -2.40 4.99 -0.12 -0.18 1.04 -0.31 -0.13 113.70 116.59 2a3c s SER 349 Ca -0.00 -0.27 -0.10 0.00 0.48 0.00 0.00 55.95 56.05 2a3c s SER 349 Cb -0.01 -1.15 0.03 0.00 0.10 0.00 0.00 66.02 64.99 2a3c s SER 349 CO -0.08 0.12 0.31 -0.47 0.98 0.00 0.00 173.24 174.09 2a3c s TYR 350 N -1.59 -0.35 -0.27 5.02 5.04 -0.41 -1.62 117.35 123.17 2a3c s TYR 350 Ca 0.27 0.84 0.03 0.00 -2.44 0.00 0.00 57.07 55.78 2a3c s TYR 350 Cb -0.10 0.12 0.07 0.00 0.35 0.00 0.00 41.96 42.39 2a3c s TYR 350 CO 0.19 -0.18 -0.08 0.34 -1.34 0.00 0.00 175.55 174.48 2a3c s ASP 351 N 0.29 4.48 0.40 4.32 -1.08 -0.49 -0.90 116.67 123.70 2a3c s ASP 351 Ca -0.01 -1.51 0.17 0.00 -0.52 0.00 0.00 52.55 50.68 2a3c s ASP 351 Cb -0.03 -1.55 0.84 0.00 -1.46 0.00 0.00 42.92 40.72 2a3c s ASP 351 CO -0.01 -0.22 1.84 0.00 0.52 0.00 0.00 175.17 177.31 2a3c h ALA 352 N 7.75 1.25 -0.20 3.66 0.00 -1.88 0.52 119.26 130.37 2a3c h ALA 352 Ca -0.17 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2a3c h ALA 352 Cb 1.04 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2a3c h ALA 352 CO 0.47 0.41 0.11 1.79 0.00 0.00 0.00 179.25 182.03 2a3c h THR 353 N 0.00 1.11 -0.19 0.00 1.35 -1.94 -3.19 112.91 110.06 2a3c h THR 353 Ca -0.00 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 2a3c h THR 353 Cb 0.67 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 2a3c h THR 353 CO 0.04 0.11 0.00 -0.46 -0.25 0.00 0.00 175.52 174.96 2a3c n ASN 354 N -4.89 2.67 -3.50 5.36 0.23 -1.19 -5.00 115.26 108.95 2a3c n ASN 354 Ca -0.04 -1.78 -0.25 0.00 -0.53 0.00 0.00 54.58 51.99 2a3c n ASN 354 Cb 0.08 -0.12 0.05 0.00 -2.08 0.00 0.00 39.78 37.71 2a3c n ASN 354 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2a3c n LYS 355 N 0.91 -6.36 -3.68 -3.83 5.02 0.18 -4.31 118.16 106.08 2a3c n LYS 355 Ca 0.12 0.78 -0.36 0.00 -2.02 0.00 0.00 58.31 56.82 2a3c n LYS 355 Cb 0.43 -5.73 -0.10 0.00 -0.02 0.00 0.00 35.03 29.61 2a3c n LYS 355 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2a3c s PHE 356 N -3.25 3.29 -0.05 2.13 5.36 -1.00 -2.07 117.98 122.39 2a3c s PHE 356 Ca 0.52 0.18 0.06 0.00 -0.96 0.00 0.00 56.93 56.73 2a3c s PHE 356 Cb -0.24 -2.26 -0.01 0.00 -0.34 0.00 0.00 43.02 40.16 2a3c s PHE 356 CO 0.64 0.03 -0.24 -1.17 -1.46 0.00 0.00 175.22 173.03 2a3c s LEU 357 N 1.09 2.14 -0.07 6.12 0.20 -0.54 -1.40 118.68 126.23 2a3c s LEU 357 Ca 0.07 -0.47 0.01 0.00 0.69 0.00 0.00 54.13 54.43 2a3c s LEU 357 Cb -0.14 -1.39 0.02 0.00 -0.43 0.00 0.00 46.19 44.25 2a3c s LEU 357 CO 0.05 0.27 -0.08 -0.63 -0.29 0.00 0.00 176.35 175.66 2a3c s ILE 358 N -0.29 0.89 -0.43 6.68 1.01 -0.64 -0.17 121.20 128.25 2a3c s ILE 358 Ca 0.00 -0.29 -0.17 0.00 0.00 0.00 0.00 60.65 60.19 2a3c s ILE 358 Cb -0.13 -0.87 0.03 0.00 0.01 0.00 0.00 42.46 41.49 2a3c s ILE 358 CO 0.02 0.32 0.44 -0.55 0.00 0.00 0.00 174.94 175.17 2a3c s SER 359 N 1.09 6.19 0.18 3.58 0.15 -0.01 -1.16 113.70 123.72 2a3c s SER 359 Ca -0.07 -0.73 -0.13 0.00 0.70 0.00 0.00 55.95 55.72 2a3c s SER 359 Cb -0.14 -2.22 0.01 0.00 -1.71 0.00 0.00 66.02 61.95 2a3c s SER 359 CO -0.01 -0.60 0.39 -0.72 1.20 0.00 0.00 173.24 173.51 2a3c s TYR 360 N 2.12 0.17 -0.08 3.44 1.13 -1.22 -1.68 117.35 121.23 2a3c s TYR 360 Ca 0.11 -0.53 -0.16 0.00 -1.41 0.00 0.00 57.07 55.09 2a3c s TYR 360 Cb -0.18 0.15 -0.05 0.00 -1.10 0.00 0.00 41.96 40.78 2a3c s TYR 360 CO 0.13 -0.82 0.41 -0.51 -2.51 0.00 0.00 175.55 172.25 2a3c s ASP 361 N -2.93 6.67 0.55 -0.18 1.01 -1.26 -4.06 116.67 116.47 2a3c s ASP 361 Ca 0.14 0.80 0.09 0.00 0.71 0.00 0.00 52.55 54.28 2a3c s ASP 361 Cb 0.01 -2.25 0.07 0.00 1.01 0.00 0.00 42.92 41.76 2a3c s ASP 361 CO -0.01 0.15 0.70 0.54 0.21 0.00 0.00 175.17 176.76 2a3c s ASN 362 N -0.08 5.08 0.45 0.27 2.20 -1.26 -4.92 114.94 116.68 2a3c s ASN 362 Ca 0.23 -0.86 0.14 0.00 -0.94 0.00 0.00 52.86 51.42 2a3c s ASN 362 Cb -0.15 0.20 1.05 0.00 -2.00 0.00 0.00 41.25 40.35 2a3c s ASN 362 CO 0.10 -1.23 2.02 -0.65 -2.94 0.00 0.00 177.10 174.40 2a3c h PRO 363 N 0.34 0.35 -0.55 3.55 0.11 -1.96 -1.29 132.00 132.55 2a3c h PRO 363 Ca -0.32 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.73 2a3c h PRO 363 Cb 1.29 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2a3c h PRO 363 CO 0.44 0.23 0.19 0.37 -0.21 0.00 0.00 178.00 179.03 2a3c h GLN 364 N 0.36 0.83 -0.30 1.05 4.15 -1.99 -0.10 115.11 119.11 2a3c h GLN 364 Ca 0.22 -0.16 -0.09 0.00 0.77 0.00 0.00 58.65 59.38 2a3c h GLN 364 Cb 0.40 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 2a3c h GLN 364 CO -0.05 0.74 -0.19 0.28 -1.93 0.00 0.00 178.83 177.68 2a3c h VAL 365 N 0.75 1.25 -0.66 2.39 2.07 -1.69 -1.71 116.25 118.65 2a3c h VAL 365 Ca 0.18 -1.19 -0.03 0.00 0.82 0.00 0.00 66.70 66.49 2a3c h VAL 365 Cb 0.24 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 2a3c h VAL 365 CO -0.01 0.38 0.31 0.00 0.02 0.00 0.00 177.57 178.27 2a3c h ALA 366 N 1.31 0.85 -0.32 1.67 0.00 -0.76 0.41 119.26 122.43 2a3c h ALA 366 Ca 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2a3c h ALA 366 Cb 0.61 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2a3c h ALA 366 CO 0.04 0.43 0.14 -0.91 0.00 0.00 0.00 179.25 178.95 2a3c h ASN 367 N 0.92 0.43 -0.53 0.00 -0.26 -0.63 -1.71 115.58 113.80 2a3c h ASN 367 Ca 0.23 -0.14 0.03 0.00 -0.56 0.00 0.00 56.30 55.85 2a3c h ASN 367 Cb 0.13 -0.11 -0.04 0.00 -1.06 0.00 0.00 38.32 37.25 2a3c h ASN 367 CO -0.03 0.45 0.31 -0.07 -1.06 0.00 0.00 177.43 177.03 2a3c h LEU 368 N 0.37 0.48 -1.56 1.61 3.38 -0.88 -1.91 115.31 116.80 2a3c h LEU 368 Ca 0.11 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2a3c h LEU 368 Cb 0.15 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2a3c h LEU 368 CO -0.01 0.34 -0.23 0.11 0.09 0.00 0.00 178.44 178.73 2a3c h LYS 369 N 0.60 0.00 -0.29 1.13 1.57 -0.75 -0.60 116.57 118.23 2a3c h LYS 369 Ca 0.22 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.84 2a3c h LYS 369 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 2a3c h LYS 369 CO -0.11 0.23 -0.45 0.77 -0.57 0.00 0.00 179.45 179.33 2a3c h SER 370 N 0.00 0.90 -0.13 0.86 0.02 -0.70 -0.38 113.55 114.12 2a3c h SER 370 Ca -0.00 -0.51 -0.06 0.00 -0.84 0.00 0.00 61.79 60.37 2a3c h SER 370 Cb 0.47 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 2a3c h SER 370 CO 0.03 1.24 -0.10 1.23 -1.14 0.00 0.00 176.83 178.08 2a3c h GLY 371 N 0.59 0.49 0.84 -3.77 0.00 -0.78 -1.57 103.07 98.87 2a3c h GLY 371 Ca 0.03 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 2a3c h GLY 371 CO 0.10 0.30 0.03 -1.82 0.00 0.00 0.00 176.54 175.16 2a3c h TYR 372 N 0.43 0.35 -0.64 5.60 3.20 -0.83 0.42 116.97 125.50 2a3c h TYR 372 Ca 0.08 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 61.95 2a3c h TYR 372 Cb 0.45 -0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.57 2a3c h TYR 372 CO 0.01 0.47 0.36 0.82 -1.64 0.00 0.00 178.16 178.19 2a3c h ILE 373 N 0.12 1.00 -0.46 1.81 2.04 -0.70 -1.63 117.51 119.69 2a3c h ILE 373 Ca 0.06 -0.24 -0.10 0.00 1.00 0.00 0.00 64.86 65.59 2a3c h ILE 373 Cb 0.31 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 2a3c h ILE 373 CO 0.00 0.13 -0.09 0.11 0.00 0.00 0.00 178.15 178.30 2a3c h LYS 374 N 0.69 0.88 -0.26 2.37 1.57 -1.11 -1.30 116.57 119.40 2a3c h LYS 374 Ca 0.27 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 2a3c h LYS 374 Cb 0.12 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2a3c h LYS 374 CO -0.15 0.97 0.02 0.66 -0.57 0.00 0.00 179.45 180.38 2a3c h SER 375 N 0.72 0.35 0.08 0.86 4.64 -0.50 -2.66 113.55 117.04 2a3c h SER 375 Ca 0.12 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2a3c h SER 375 Cb 0.64 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2a3c h SER 375 CO 0.04 0.40 -0.51 0.18 -0.87 0.00 0.00 176.83 176.07 2a3c n LEU 376 N -4.35 1.54 -2.36 5.97 4.32 -0.65 -4.96 117.00 116.52 2a3c n LEU 376 Ca 0.01 -0.56 -0.16 0.00 -0.02 0.00 0.00 56.01 55.28 2a3c n LEU 376 Cb 0.19 -0.04 0.04 0.00 -1.62 0.00 0.00 43.42 41.99 2a3c n LEU 376 CO 0.37 0.30 0.09 0.61 -1.22 0.00 0.00 177.39 177.54 2a3c n GLY 377 N 1.42 -0.09 3.69 -0.72 0.00 -0.59 -4.80 105.19 104.10 2a3c n GLY 377 Ca 0.09 -0.11 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2a3c n GLY 377 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a3c s LEU 378 N -4.97 1.95 0.00 0.99 1.43 -0.62 -2.43 118.68 115.03 2a3c s LEU 378 Ca 0.30 1.39 0.22 0.00 -1.03 0.00 0.00 54.13 55.01 2a3c s LEU 378 Cb -0.13 -3.69 1.03 0.00 0.03 0.00 0.00 46.19 43.42 2a3c s LEU 378 CO 0.38 -2.92 1.70 0.61 0.23 0.00 0.00 176.35 176.35 2a3c n GLY 379 N -0.99 -1.10 0.00 -3.19 0.00 0.13 -4.68 105.19 95.36 2a3c n GLY 379 Ca 0.06 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2a3c n GLY 379 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3c n GLY 380 N 0.63 0.77 3.25 -0.02 0.00 -1.26 -0.85 105.19 107.71 2a3c n GLY 380 Ca 0.08 -1.79 -0.23 0.00 0.00 0.00 0.00 46.02 44.09 2a3c n GLY 380 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3c s ALA 381 N -1.16 1.64 0.04 4.61 0.00 0.06 -0.77 121.76 126.18 2a3c s ALA 381 Ca 0.00 -1.14 0.02 0.00 0.00 0.00 0.00 51.96 50.84 2a3c s ALA 381 Cb 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 2a3c s ALA 381 CO 0.00 0.32 -0.08 1.41 0.00 0.00 0.00 175.76 177.42 2a3c s MET 382 N -1.71 0.52 0.03 0.00 0.00 -0.24 -0.30 119.30 117.60 2a3c s MET 382 Ca 0.05 -0.73 0.01 0.00 0.00 0.00 0.00 55.69 55.02 2a3c s MET 382 Cb -0.10 -0.29 -0.02 0.00 0.00 0.00 0.00 34.83 34.42 2a3c s MET 382 CO 0.03 0.05 -0.06 -1.58 0.00 0.00 0.00 175.02 173.47 2a3c s TRP 383 N -1.33 0.49 -0.11 4.11 0.51 -0.01 0.91 118.94 123.50 2a3c s TRP 383 Ca -0.10 -0.47 0.00 0.00 -2.12 0.00 0.00 56.10 53.42 2a3c s TRP 383 Cb -0.10 -0.31 0.02 0.00 -0.81 0.00 0.00 33.47 32.28 2a3c s TRP 383 CO 0.00 -0.11 -0.10 -0.46 -0.51 0.00 0.00 176.95 175.77 2a3c s TRP 384 N -1.28 1.66 0.28 -1.98 -0.11 -1.11 -1.78 118.94 114.62 2a3c s TRP 384 Ca -0.11 -0.83 0.04 0.00 1.22 0.00 0.00 56.10 56.43 2a3c s TRP 384 Cb -0.09 -1.30 -0.06 0.00 -1.50 0.00 0.00 33.47 30.52 2a3c s TRP 384 CO -0.00 -0.51 0.01 0.16 -4.62 0.00 0.00 176.95 171.98 2a3c s ASP 385 N 1.47 2.31 0.60 5.86 1.47 -1.26 -1.65 116.67 125.47 2a3c s ASP 385 Ca 0.02 -1.28 0.29 0.00 1.18 0.00 0.00 52.55 52.76 2a3c s ASP 385 Cb -0.13 -0.08 1.64 0.00 -0.34 0.00 0.00 42.92 44.01 2a3c s ASP 385 CO -0.07 -0.50 2.06 0.77 0.68 0.00 0.00 175.17 178.11 2a3c h SER 386 N 2.27 0.00 1.26 2.11 4.64 -1.10 -3.15 113.55 119.59 2a3c h SER 386 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2a3c h SER 386 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2a3c h SER 386 CO 0.67 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.40 2a3c h SER 387 N 0.00 0.00 -0.34 4.97 4.64 -1.98 -3.34 113.55 117.50 2a3c h SER 387 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2a3c h SER 387 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2a3c h SER 387 CO -0.00 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.42 2a3c n SER 388 N -2.86 3.98 -4.90 4.97 3.41 -1.19 -5.00 113.62 112.02 2a3c n SER 388 Ca 0.02 -2.78 -0.28 0.00 -0.26 0.00 0.00 58.87 55.57 2a3c n SER 388 Cb 0.36 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 2a3c n SER 388 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2a3c s ASP 389 N -1.57 6.24 0.66 4.04 2.15 -1.26 -1.48 116.67 125.46 2a3c s ASP 389 Ca 0.41 1.00 -0.07 0.00 0.43 0.00 0.00 52.55 54.32 2a3c s ASP 389 Cb 0.31 -2.27 0.04 0.00 -0.30 0.00 0.00 42.92 40.70 2a3c s ASP 389 CO 0.12 -0.63 0.98 -0.54 -0.17 0.00 0.00 175.17 174.92 2a3c s LYS 390 N -4.82 2.53 0.41 4.34 1.02 -1.26 -4.61 119.74 117.36 2a3c s LYS 390 Ca 0.49 -0.10 0.08 0.00 0.02 0.00 0.00 55.97 56.45 2a3c s LYS 390 Cb -0.10 -2.20 -0.01 0.00 -0.52 0.00 0.00 37.83 35.00 2a3c s LYS 390 CO 0.46 -1.01 0.47 0.95 -0.92 0.00 0.00 175.35 175.30 2a3c s THR 391 N -3.16 2.87 0.00 2.17 -4.23 -1.26 -4.00 115.64 108.04 2a3c s THR 391 Ca 0.57 -1.17 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 2a3c s THR 391 Cb -0.11 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.72 2a3c s THR 391 CO 0.45 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 175.14 2a3c n GLY 392 N -1.69 -0.66 0.26 3.99 0.00 -1.26 -3.83 105.19 102.01 2a3c n GLY 392 Ca 0.05 -1.13 0.14 0.00 0.00 0.00 0.00 46.02 45.08 2a3c n GLY 392 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2a3c h SER 393 N 2.07 0.00 0.06 1.61 4.64 -2.01 -2.69 113.55 117.23 2a3c h SER 393 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a3c h SER 393 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2a3c h SER 393 CO 0.00 0.10 -0.00 0.47 -0.87 0.00 0.00 176.83 176.53 2a3c n ASP 394 N -3.33 0.01 -4.70 4.97 8.00 -1.25 -4.53 116.55 115.72 2a3c n ASP 394 Ca -0.01 -0.91 -0.42 0.00 0.71 0.00 0.00 54.79 54.16 2a3c n ASP 394 Cb 0.31 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.35 2a3c n ASP 394 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2a3c s SER 395 N -2.06 6.62 0.29 -2.24 0.15 -1.02 -4.58 113.70 110.86 2a3c s SER 395 Ca 0.46 2.51 0.06 0.00 0.70 0.00 0.00 55.95 59.69 2a3c s SER 395 Cb 0.22 -2.58 0.44 0.00 -1.71 0.00 0.00 66.02 62.39 2a3c s SER 395 CO 0.38 -0.84 1.69 -0.07 1.20 0.00 0.00 173.24 175.60 2a3c h LEU 396 N 7.72 0.26 -0.27 3.45 3.38 -1.87 -0.69 115.31 127.30 2a3c h LEU 396 Ca -0.42 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 2a3c h LEU 396 Cb 1.20 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2a3c h LEU 396 CO 0.92 0.66 0.06 0.40 0.09 0.00 0.00 178.44 180.56 2a3c h ILE 397 N 0.20 1.22 -0.48 1.22 2.04 -1.92 -0.38 117.51 119.41 2a3c h ILE 397 Ca 0.02 -0.74 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 2a3c h ILE 397 Cb 0.84 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 2a3c h ILE 397 CO 0.07 0.24 0.18 0.74 0.00 0.00 0.00 178.15 179.38 2a3c h THR 398 N 0.27 1.21 -0.39 -0.27 2.02 -1.87 -0.25 112.91 113.63 2a3c h THR 398 Ca 0.08 -0.68 0.04 0.00 0.77 0.00 0.00 66.41 66.62 2a3c h THR 398 Cb 0.31 0.76 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 2a3c h THR 398 CO 0.00 0.25 0.17 0.74 0.37 0.00 0.00 175.52 177.06 2a3c h THR 399 N 0.64 0.93 -0.15 3.16 2.02 -0.89 -0.48 112.91 118.15 2a3c h THR 399 Ca 0.16 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.18 2a3c h THR 399 Cb 0.22 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 67.17 2a3c h THR 399 CO -0.01 0.06 -0.04 0.58 0.37 0.00 0.00 175.52 176.49 2a3c h VAL 400 N 0.35 1.29 -0.62 3.16 2.07 -0.85 -1.11 116.25 120.54 2a3c h VAL 400 Ca 0.17 -0.99 0.06 0.00 0.82 0.00 0.00 66.70 66.76 2a3c h VAL 400 Cb 0.12 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 2a3c h VAL 400 CO -0.15 0.29 0.32 0.58 0.02 0.00 0.00 177.57 178.64 2a3c h VAL 401 N -0.01 0.94 -0.10 2.57 2.07 -0.83 0.18 116.25 121.08 2a3c h VAL 401 Ca 0.04 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2a3c h VAL 401 Cb 0.47 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2a3c h VAL 401 CO 0.02 0.11 0.04 0.78 0.02 0.00 0.00 177.57 178.54 2a3c h ASN 402 N 0.60 0.14 -0.25 0.57 -0.26 -1.04 0.38 115.58 115.72 2a3c h ASN 402 Ca 0.28 -0.15 0.01 0.00 -0.56 0.00 0.00 56.30 55.88 2a3c h ASN 402 Cb 0.20 -0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 2a3c h ASN 402 CO -0.19 0.25 0.17 0.00 -1.06 0.00 0.00 177.43 176.60 2a3c h ALA 403 N 0.89 1.84 0.00 -0.83 0.00 -0.37 -1.08 119.26 119.72 2a3c h ALA 403 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2a3c h ALA 403 Cb 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2a3c h ALA 403 CO -0.00 0.14 0.00 1.28 0.00 0.00 0.00 179.25 180.67 2a3c n LEU 404 N -4.50 0.72 0.00 0.00 4.77 0.57 -4.85 117.00 113.71 2a3c n LEU 404 Ca 0.01 0.63 0.00 0.00 -0.03 0.00 0.00 56.01 56.62 2a3c n LEU 404 Cb 0.09 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 2a3c n LEU 404 CO 0.35 -0.41 0.00 0.61 -1.33 0.00 0.00 177.39 176.60 2a3c n GLY 405 N 0.50 0.94 0.00 -0.72 0.00 -0.41 -4.89 105.19 100.60 2a3c n GLY 405 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2a3c n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3c n GLY 406 N 0.00 0.20 0.24 -0.02 0.00 0.10 -4.46 105.19 101.25 2a3c n GLY 406 Ca 0.00 -1.83 0.16 0.00 0.00 0.00 0.00 46.02 44.35 2a3c n GLY 406 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2a3c h THR 407 N 0.00 0.00 0.00 2.61 1.35 -1.92 -1.57 112.91 113.38 2a3c h THR 407 Ca 0.00 -0.01 -0.04 0.00 -0.55 0.00 0.00 66.41 65.81 2a3c h THR 407 Cb 0.00 0.72 -0.01 0.00 -1.73 0.00 0.00 68.15 67.14 2a3c h THR 407 CO 0.00 0.00 -0.19 1.23 -0.25 0.00 0.00 175.52 176.31 2a3c h GLY 408 N 0.08 0.00 -0.63 5.82 0.00 -1.96 -2.38 103.07 103.99 2a3c h GLY 408 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2a3c h GLY 408 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.87 2a3c n VAL 409 N -3.93 0.21 -2.27 4.60 0.24 -0.59 -4.93 118.33 111.67 2a3c n VAL 409 Ca -0.02 -0.30 -0.37 0.00 -2.04 0.00 0.00 64.34 61.61 2a3c n VAL 409 Cb 0.27 0.23 -0.01 0.00 -1.47 0.00 0.00 33.84 32.87 2a3c n VAL 409 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2a3c s PHE 410 N -1.79 2.92 0.34 6.34 0.08 -0.90 -0.99 117.98 123.98 2a3c s PHE 410 Ca 0.29 1.54 -0.29 0.00 0.12 0.00 0.00 56.93 58.59 2a3c s PHE 410 Cb 0.15 -3.38 -0.11 0.00 -0.57 0.00 0.00 43.02 39.12 2a3c s PHE 410 CO 0.23 -1.45 1.42 -2.00 -0.10 0.00 0.00 175.22 173.32 2a3c s GLU 411 N -2.61 4.22 -0.19 0.44 2.12 0.50 -4.56 118.70 118.62 2a3c s GLU 411 Ca 0.62 2.40 -0.02 0.00 0.36 0.00 0.00 54.97 58.33 2a3c s GLU 411 Cb -0.29 -3.03 -0.01 0.00 0.26 0.00 0.00 34.13 31.07 2a3c s GLU 411 CO 0.35 -0.40 -0.09 -0.65 -0.54 0.00 0.00 175.26 173.94 2a3c s GLN 412 N -1.62 3.33 -0.30 4.30 -1.52 0.57 -4.90 119.66 119.52 2a3c s GLN 412 Ca 0.53 -0.67 -0.12 0.00 -1.95 0.00 0.00 55.36 53.16 2a3c s GLN 412 Cb -0.43 -2.85 0.14 0.00 -0.22 0.00 0.00 33.01 29.64 2a3c s GLN 412 CO 0.55 -0.09 0.75 -1.54 -0.25 0.00 0.00 175.29 174.71 2a3c s SER 413 N 1.15 -0.98 0.36 5.90 1.04 -1.26 -0.95 113.70 118.95 2a3c s SER 413 Ca 0.01 1.36 -0.29 0.00 0.48 0.00 0.00 55.95 57.52 2a3c s SER 413 Cb -0.14 2.08 -0.11 0.00 0.10 0.00 0.00 66.02 67.94 2a3c s SER 413 CO -0.02 -0.19 1.53 -1.10 0.98 0.00 0.00 173.24 174.43 2a3c s GLN 414 N 2.70 4.10 0.90 4.02 -1.52 -1.26 -4.58 119.66 124.00 2a3c s GLN 414 Ca -0.05 2.60 -0.14 0.00 -1.95 0.00 0.00 55.36 55.81 2a3c s GLN 414 Cb -0.10 -2.98 0.20 0.00 -0.22 0.00 0.00 33.01 29.92 2a3c s GLN 414 CO -0.19 -0.58 1.22 0.27 -0.25 0.00 0.00 175.29 175.76 2a3c n ASN 415 N 0.90 0.23 -4.57 5.90 0.23 0.11 -5.00 115.26 113.05 2a3c n ASN 415 Ca 0.03 -1.52 -0.34 0.00 -0.53 0.00 0.00 54.58 52.21 2a3c n ASN 415 Cb 0.39 -0.92 -0.11 0.00 -2.08 0.00 0.00 39.78 37.06 2a3c n ASN 415 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 2a3c s GLU 416 N -5.65 3.85 -0.00 -3.83 2.56 -1.26 -4.98 118.70 109.39 2a3c s GLU 416 Ca 0.70 -0.41 0.10 0.00 0.00 0.00 0.00 54.97 55.36 2a3c s GLU 416 Cb -0.02 -3.13 -0.12 0.00 2.00 0.00 0.00 34.13 32.85 2a3c s GLU 416 CO 0.49 0.22 0.34 1.28 -0.56 0.00 0.00 175.26 177.02 2a3c n LEU 417 N 3.67 0.29 -4.63 2.70 4.77 -1.26 -4.93 117.00 117.62 2a3c n LEU 417 Ca -0.17 -0.32 -0.37 0.00 -0.03 0.00 0.00 56.01 55.12 2a3c n LEU 417 Cb 0.52 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.51 2a3c n LEU 417 CO 0.34 0.07 -0.16 -0.62 -1.33 0.00 0.00 177.39 175.69 2a3c s ASP 418 N -2.33 6.08 -0.52 -1.43 2.15 -1.26 -4.77 116.67 114.59 2a3c s ASP 418 Ca 0.01 0.07 0.05 0.00 0.43 0.00 0.00 52.55 53.11 2a3c s ASP 418 Cb 0.07 -2.12 0.18 0.00 -0.30 0.00 0.00 42.92 40.75 2a3c s ASP 418 CO 0.40 0.01 0.43 -1.22 -0.17 0.00 0.00 175.17 174.61 2a3c n TYR 419 N 4.63 0.75 0.25 -5.34 4.02 -1.26 -4.92 117.16 115.30 2a3c n TYR 419 Ca -0.14 -3.71 0.11 0.00 -0.01 0.00 0.00 57.90 54.15 2a3c n TYR 419 Cb 0.52 -0.12 0.73 0.00 -0.02 0.00 0.00 39.34 40.45 2a3c n TYR 419 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2a3c h PRO 420 N 5.36 0.00 -0.38 -0.72 0.13 -1.83 -2.98 132.00 131.58 2a3c h PRO 420 Ca 0.21 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.23 2a3c h PRO 420 Cb 0.84 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.91 2a3c h PRO 420 CO 0.52 0.00 0.03 1.33 -0.23 0.00 0.00 178.00 179.65 2a3c n VAL 421 N -4.32 2.49 -2.31 1.56 0.24 -1.26 -5.00 118.33 109.73 2a3c n VAL 421 Ca -0.02 -2.16 -0.41 0.00 -2.04 0.00 0.00 64.34 59.71 2a3c n VAL 421 Cb 0.12 -0.30 -0.03 0.00 -1.47 0.00 0.00 33.84 32.16 2a3c n VAL 421 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2a3c s SER 422 N -2.02 7.01 0.28 -1.34 0.15 -1.13 -4.81 113.70 111.85 2a3c s SER 422 Ca 0.45 2.30 0.24 0.00 0.70 0.00 0.00 55.95 59.63 2a3c s SER 422 Cb 0.38 -2.61 1.03 0.00 -1.71 0.00 0.00 66.02 63.12 2a3c s SER 422 CO 0.06 -0.43 1.72 0.00 1.20 0.00 0.00 173.24 175.79 2a3c n GLN 423 N 2.56 0.19 -3.27 5.44 10.64 -1.26 -4.57 117.38 127.11 2a3c n GLN 423 Ca 0.05 0.47 -0.41 0.00 -1.83 0.00 0.00 57.00 55.28 2a3c n GLN 423 Cb 0.44 -1.90 -0.08 0.00 -0.86 0.00 0.00 30.24 27.84 2a3c n GLN 423 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2a3c s TYR 424 N -3.37 3.21 0.15 2.61 2.02 -1.26 -4.70 117.35 116.00 2a3c s TYR 424 Ca 0.03 0.33 -0.18 0.00 -0.37 0.00 0.00 57.07 56.88 2a3c s TYR 424 Cb 0.09 -2.80 0.03 0.00 -0.40 0.00 0.00 41.96 38.88 2a3c s TYR 424 CO 0.37 -0.42 1.72 -0.44 -1.57 0.00 0.00 175.55 175.20 2a3c h ASP 425 N 8.30 -0.09 -0.50 2.29 3.32 -0.63 0.02 116.42 129.13 2a3c h ASP 425 Ca -0.29 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.79 2a3c h ASP 425 Cb 1.14 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.77 2a3c h ASP 425 CO 0.73 -0.01 0.21 -0.55 -1.72 0.00 0.00 179.24 177.90 2a3c h ASN 426 N 0.10 0.71 0.19 6.45 -1.07 -1.86 -2.21 115.58 117.90 2a3c h ASN 426 Ca 0.14 -0.09 -0.31 0.00 0.07 0.00 0.00 56.30 56.11 2a3c h ASN 426 Cb 0.18 -0.18 0.03 0.00 -2.07 0.00 0.00 38.32 36.28 2a3c h ASN 426 CO -0.23 0.65 -1.32 0.25 0.07 0.00 0.00 177.43 176.85 2a3c h LEU 427 N 0.77 0.83 -2.04 6.14 6.46 -1.84 0.26 115.31 125.90 2a3c h LEU 427 Ca 0.18 -0.88 0.03 0.00 -0.12 0.00 0.00 57.88 57.09 2a3c h LEU 427 Cb 0.17 -0.27 -0.00 0.00 -0.73 0.00 0.00 40.66 39.83 2a3c h LEU 427 CO -0.02 1.65 0.08 -0.09 -0.62 0.00 0.00 178.44 179.44 2a3c h ARG 428 N 0.15 0.00 -0.68 1.25 2.43 -0.91 -1.11 114.38 115.52 2a3c h ARG 428 Ca -0.22 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.94 2a3c h ARG 428 Cb 2.02 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.56 2a3c h ARG 428 CO 0.25 0.00 0.02 0.09 -1.51 0.00 0.00 179.97 178.82 2a3c n ASN 429 N -4.44 4.77 -0.06 -3.80 5.03 -0.84 -4.64 115.26 111.28 2a3c n ASN 429 Ca -0.00 -2.76 -0.01 0.00 0.87 0.00 0.00 54.58 52.68 2a3c n ASN 429 Cb 0.20 -0.65 -0.00 0.00 -1.02 0.00 0.00 39.78 38.30 2a3c n ASN 429 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2a3c n GLY 430 N 0.46 0.49 3.36 7.41 0.00 -0.42 -4.28 105.19 112.21 2a3c n GLY 430 Ca 0.23 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.71 2a3c n GLY 430 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2a3c n MET 431 N -2.74 -1.50 0.00 1.61 1.56 0.90 -5.01 117.12 111.95 2a3c n MET 431 Ca -0.01 1.02 0.15 0.00 -0.27 0.00 0.00 57.70 58.59 2a3c n MET 431 Cb 0.06 -4.80 0.87 0.00 2.15 0.00 0.00 33.22 31.49 2a3c n MET 431 CO 0.00 0.00 0.00 1.04 -0.73 0.00 0.00 175.97 176.28