#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t2a s ASN 24 N 0.00 3.78 -0.15 6.15 0.02 -1.26 -4.89 114.94 118.59 1t2a s ASN 24 Ca 0.00 -1.25 -0.01 0.00 -1.02 0.00 0.00 52.86 50.58 1t2a s ASN 24 Cb 0.00 -1.06 0.04 0.00 0.02 0.00 0.00 41.25 40.24 1t2a s ASN 24 CO 0.00 -0.28 -0.04 -0.69 0.02 0.00 0.00 177.10 176.10 1t2a s VAL 25 N 1.47 0.97 0.03 1.60 1.01 -1.26 -1.56 120.40 122.66 1t2a s VAL 25 Ca -0.02 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.51 1t2a s VAL 25 Cb -0.18 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 1t2a s VAL 25 CO -0.09 0.16 -0.01 0.00 0.00 0.00 0.00 175.10 175.16 1t2a s ALA 26 N 1.70 3.25 -0.16 5.51 0.00 -0.01 0.01 121.76 132.06 1t2a s ALA 26 Ca 0.02 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.97 1t2a s ALA 26 Cb -0.15 -1.26 0.01 0.00 0.00 0.00 0.00 23.12 21.73 1t2a s ALA 26 CO -0.08 0.66 -0.20 -1.17 0.00 0.00 0.00 175.76 174.98 1t2a s LEU 27 N -1.82 2.20 -0.24 0.00 2.96 0.02 0.12 118.68 121.92 1t2a s LEU 27 Ca 0.22 -0.60 -0.02 0.00 -0.22 0.00 0.00 54.13 53.51 1t2a s LEU 27 Cb -0.12 -1.49 0.02 0.00 0.50 0.00 0.00 46.19 45.11 1t2a s LEU 27 CO 0.13 0.05 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.51 1t2a s ILE 28 N 1.03 2.91 0.34 6.68 1.01 0.48 -0.94 121.20 132.71 1t2a s ILE 28 Ca -0.02 -0.94 -0.17 0.00 0.00 0.00 0.00 60.65 59.53 1t2a s ILE 28 Cb -0.14 -2.44 -0.09 0.00 0.01 0.00 0.00 42.46 39.79 1t2a s ILE 28 CO -0.06 0.25 0.79 0.42 0.00 0.00 0.00 174.94 176.34 1t2a s THR 29 N 1.35 4.61 -0.56 2.92 -4.23 -0.38 -1.71 115.64 117.63 1t2a s THR 29 Ca 0.01 1.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.61 1t2a s THR 29 Cb -0.16 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.06 1t2a s THR 29 CO -0.05 -0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 1t2a n GLY 30 N -0.39 0.13 0.24 3.99 0.00 -1.25 -1.85 105.19 106.05 1t2a n GLY 30 Ca 0.04 -0.62 0.10 0.00 0.00 0.00 0.00 46.02 45.54 1t2a n GLY 30 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1t2a h ILE 31 N 0.00 0.71 0.00 -0.61 2.10 -1.71 -2.63 117.51 115.37 1t2a h ILE 31 Ca -0.15 -0.82 0.00 0.00 1.08 0.00 0.00 64.86 64.97 1t2a h ILE 31 Cb 1.09 1.51 0.00 0.00 -1.09 0.00 0.00 36.82 38.33 1t2a h ILE 31 CO 0.18 0.19 0.00 0.35 -1.08 0.00 0.00 178.15 177.79 1t2a n THR 32 N -3.68 0.03 -2.09 2.19 -2.24 -1.26 -2.72 114.28 104.50 1t2a n THR 32 Ca -0.01 0.01 -0.29 0.00 -2.27 0.00 0.00 64.05 61.49 1t2a n THR 32 Cb 0.32 -0.51 0.19 0.00 -2.10 0.00 0.00 70.33 68.22 1t2a n THR 32 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1t2a s GLY 33 N -2.86 1.80 0.09 3.38 0.00 -0.99 -4.58 107.32 104.17 1t2a s GLY 33 Ca 0.18 -1.43 -0.33 0.00 0.00 0.00 0.00 44.72 43.14 1t2a s GLY 33 CO 0.50 -0.65 1.52 -1.61 0.00 0.00 0.00 173.10 172.86 1t2a h GLN 34 N -1.51 -0.73 -0.58 2.90 4.15 -1.86 -1.11 115.11 116.37 1t2a h GLN 34 Ca -0.42 0.05 -0.09 0.00 0.77 0.00 0.00 58.65 58.96 1t2a h GLN 34 Cb 1.22 0.17 -0.02 0.00 0.21 0.00 0.00 27.48 29.06 1t2a h GLN 34 CO 0.33 -0.49 0.01 -0.44 -1.93 0.00 0.00 178.83 176.32 1t2a h ASP 35 N -0.76 1.00 -0.45 -0.69 5.19 -1.94 -2.85 116.42 115.92 1t2a h ASP 35 Ca -0.02 -0.30 -0.02 0.00 -0.62 0.00 0.00 57.03 56.07 1t2a h ASP 35 Cb 0.74 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.96 1t2a h ASP 35 CO -0.23 1.06 0.22 1.23 -3.12 0.00 0.00 179.24 178.40 1t2a h GLY 36 N 0.92 0.73 1.02 2.75 0.00 -1.59 0.14 103.07 107.03 1t2a h GLY 36 Ca 0.17 -0.34 -0.10 0.00 0.00 0.00 0.00 47.33 47.06 1t2a h GLY 36 CO 0.03 0.32 -0.11 1.48 0.00 0.00 0.00 176.54 178.26 1t2a h SER 37 N 0.68 0.86 -0.15 0.19 4.64 -1.00 0.34 113.55 119.12 1t2a h SER 37 Ca 0.17 -0.36 -0.15 0.00 -0.47 0.00 0.00 61.79 60.97 1t2a h SER 37 Cb 0.09 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 1t2a h SER 37 CO -0.02 1.02 -0.45 1.88 -0.87 0.00 0.00 176.83 178.39 1t2a h TYR 38 N 0.69 0.86 -0.27 4.77 -1.99 -1.22 -2.93 116.97 116.87 1t2a h TYR 38 Ca 0.11 -0.27 -0.12 0.00 2.00 0.00 0.00 58.73 60.45 1t2a h TYR 38 Cb 0.65 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 39.19 1t2a h TYR 38 CO 0.05 1.03 -0.34 1.25 -0.00 0.00 0.00 178.16 180.14 1t2a h LEU 39 N 0.57 0.62 -0.73 3.88 5.85 -0.67 -1.23 115.31 123.60 1t2a h LEU 39 Ca 0.04 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1t2a h LEU 39 Cb 1.00 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 1t2a h LEU 39 CO 0.09 0.91 0.42 0.00 -0.34 0.00 0.00 178.44 179.53 1t2a h ALA 40 N 1.13 0.94 0.04 1.25 0.00 -0.86 -1.00 119.26 120.75 1t2a h ALA 40 Ca 0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1t2a h ALA 40 Cb 0.83 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1t2a h ALA 40 CO 0.07 0.42 -0.02 0.93 0.00 0.00 0.00 179.25 180.66 1t2a h GLU 41 N 1.00 -0.05 -0.41 0.00 5.08 -1.31 0.72 114.58 119.62 1t2a h GLU 41 Ca 0.26 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.69 1t2a h GLU 41 Cb -0.00 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.20 1t2a h GLU 41 CO -0.05 0.01 0.08 0.35 -1.00 0.00 0.00 179.01 178.41 1t2a h PHE 42 N -0.10 0.13 -0.34 4.33 3.57 -0.86 -1.26 116.94 122.41 1t2a h PHE 42 Ca -0.01 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.36 1t2a h PHE 42 Cb 0.09 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 1t2a h PHE 42 CO -0.06 0.01 -0.42 -0.07 -2.23 0.00 0.00 178.31 175.54 1t2a h LEU 43 N 0.21 0.90 -1.30 0.59 3.38 -1.07 -2.81 115.31 115.21 1t2a h LEU 43 Ca 0.20 -0.42 0.02 0.00 0.09 0.00 0.00 57.88 57.76 1t2a h LEU 43 Cb 0.24 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1t2a h LEU 43 CO -0.26 1.20 0.48 -0.07 0.09 0.00 0.00 178.44 179.88 1t2a h LEU 44 N 0.68 0.81 -1.58 1.67 3.38 -0.50 0.53 115.31 120.30 1t2a h LEU 44 Ca 0.05 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1t2a h LEU 44 Cb 1.00 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1t2a h LEU 44 CO 0.10 0.58 -0.18 -0.08 0.09 0.00 0.00 178.44 178.95 1t2a h GLU 45 N 0.95 0.00 -0.38 1.13 4.22 -1.12 -0.90 114.58 118.48 1t2a h GLU 45 Ca 0.28 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.72 1t2a h GLU 45 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1t2a h GLU 45 CO -0.07 0.18 0.00 1.63 -2.18 0.00 0.00 179.01 178.57 1t2a n LYS 46 N -3.56 2.02 -0.66 1.92 5.02 0.12 -4.91 118.16 118.11 1t2a n LYS 46 Ca -0.01 -1.58 0.00 0.00 -2.02 0.00 0.00 58.31 54.70 1t2a n LYS 46 Cb 0.32 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 1t2a n LYS 46 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1t2a n GLY 47 N 1.23 0.66 3.80 0.72 0.00 -0.34 -5.04 105.19 106.22 1t2a n GLY 47 Ca 0.16 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1t2a n GLY 47 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1t2a s TYR 48 N -2.00 2.98 -0.25 1.61 1.51 -0.82 -4.89 117.35 115.48 1t2a s TYR 48 Ca 0.00 1.49 -0.17 0.00 -1.01 0.00 0.00 57.07 57.39 1t2a s TYR 48 Cb 0.00 -2.99 -0.03 0.00 -0.11 0.00 0.00 41.96 38.83 1t2a s TYR 48 CO 0.00 -1.21 0.45 -2.00 -1.11 0.00 0.00 175.55 171.68 1t2a s GLU 49 N -4.37 4.07 -0.15 -0.62 2.12 -0.60 -4.61 118.70 114.54 1t2a s GLU 49 Ca 0.62 0.22 -0.01 0.00 0.36 0.00 0.00 54.97 56.16 1t2a s GLU 49 Cb -0.16 -3.63 -0.01 0.00 0.26 0.00 0.00 34.13 30.59 1t2a s GLU 49 CO 0.43 -0.28 -0.12 0.08 -0.54 0.00 0.00 175.26 174.83 1t2a s VAL 50 N 2.07 3.00 0.03 3.70 1.01 0.62 -0.83 120.40 129.99 1t2a s VAL 50 Ca 0.19 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.58 1t2a s VAL 50 Cb -0.16 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1t2a s VAL 50 CO 0.09 0.51 -0.23 -1.00 0.00 0.00 0.00 175.10 174.47 1t2a s HIS 51 N 0.62 2.43 0.04 5.22 3.76 0.12 -0.64 115.29 126.84 1t2a s HIS 51 Ca -0.07 -0.35 0.04 0.00 -0.15 0.00 0.00 55.06 54.53 1t2a s HIS 51 Cb -0.15 -1.44 -0.02 0.00 1.11 0.00 0.00 32.58 32.07 1t2a s HIS 51 CO 0.03 0.16 -0.11 0.20 -0.85 0.00 0.00 174.74 174.16 1t2a s GLY 52 N -1.20 0.67 -0.24 -2.22 0.00 -0.08 -0.38 107.32 103.86 1t2a s GLY 52 Ca 0.12 -0.79 -0.11 0.00 0.00 0.00 0.00 44.72 43.95 1t2a s GLY 52 CO 0.03 -0.79 0.18 -0.42 0.00 0.00 0.00 173.10 172.09 1t2a s ILE 53 N -1.02 5.34 -0.03 0.90 1.09 -0.69 -0.34 121.20 126.44 1t2a s ILE 53 Ca -0.03 0.22 0.06 0.00 -1.10 0.00 0.00 60.65 59.80 1t2a s ILE 53 Cb -0.08 -3.52 -0.02 0.00 -1.06 0.00 0.00 42.46 37.78 1t2a s ILE 53 CO 0.01 0.33 -0.22 -0.69 -0.10 0.00 0.00 174.94 174.27 1t2a s VAL 54 N 1.17 2.42 0.28 2.92 1.01 0.73 -3.91 120.40 125.02 1t2a s VAL 54 Ca 0.08 -0.97 -0.29 0.00 0.00 0.00 0.00 61.98 60.80 1t2a s VAL 54 Cb -0.14 -1.88 -0.09 0.00 0.00 0.00 0.00 36.38 34.26 1t2a s VAL 54 CO 0.06 0.58 1.04 -0.13 0.00 0.00 0.00 175.10 176.65 1t2a s ARG 55 N -0.62 4.67 0.29 2.72 0.52 -1.26 -0.58 118.95 124.69 1t2a s ARG 55 Ca 0.10 1.67 -0.29 0.00 -0.52 0.00 0.00 55.73 56.68 1t2a s ARG 55 Cb -0.10 -3.15 -0.10 0.00 0.52 0.00 0.00 34.95 32.11 1t2a s ARG 55 CO -0.00 0.28 1.44 0.50 0.02 0.00 0.00 175.30 177.54 1t2a s ARG 56 N -1.47 4.25 0.03 3.54 3.00 -1.26 -4.92 118.95 122.12 1t2a s ARG 56 Ca 0.45 2.35 0.00 0.00 -1.00 0.00 0.00 55.73 57.53 1t2a s ARG 56 Cb -0.29 -3.07 -0.02 0.00 0.00 0.00 0.00 34.95 31.56 1t2a s ARG 56 CO 0.37 -0.41 -0.04 0.45 0.00 0.00 0.00 175.30 175.67 1t2a s SER 57 N 0.14 0.42 0.17 -2.12 0.15 -1.26 -5.03 113.70 106.16 1t2a s SER 57 Ca 0.57 -0.61 0.23 0.00 0.70 0.00 0.00 55.95 56.83 1t2a s SER 57 Cb -0.43 0.11 0.89 0.00 -1.71 0.00 0.00 66.02 64.88 1t2a s SER 57 CO 0.48 -0.34 1.69 -1.54 1.20 0.00 0.00 173.24 174.73 1t2a n SER 58 N 1.27 0.49 -4.50 5.45 3.41 -1.26 -4.79 113.62 113.68 1t2a n SER 58 Ca -0.22 0.60 -0.24 0.00 -0.26 0.00 0.00 58.87 58.75 1t2a n SER 58 Cb 0.56 -0.71 -0.10 0.00 -0.26 0.00 0.00 64.21 63.70 1t2a n SER 58 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1t2a s SER 59 N -3.91 3.34 0.22 4.04 0.01 -1.26 -5.11 113.70 111.02 1t2a s SER 59 Ca 0.07 -1.21 -0.32 0.00 1.31 0.00 0.00 55.95 55.80 1t2a s SER 59 Cb 0.11 -0.28 -0.12 0.00 0.21 0.00 0.00 66.02 65.94 1t2a s SER 59 CO 0.42 -0.29 1.67 0.33 0.41 0.00 0.00 173.24 175.78 1t2a n PHE 60 N -0.73 2.68 -2.18 2.43 7.35 -1.26 -4.90 117.46 120.86 1t2a n PHE 60 Ca -0.05 0.12 0.01 0.00 -0.76 0.00 0.00 57.45 56.78 1t2a n PHE 60 Cb 0.64 -2.64 0.01 0.00 0.35 0.00 0.00 39.48 37.84 1t2a n PHE 60 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1t2a n ASN 61 N 3.52 0.34 -0.54 -2.13 6.94 -1.26 -4.82 115.26 117.31 1t2a n ASN 61 Ca 0.15 -1.98 0.06 0.00 -0.02 0.00 0.00 54.58 52.79 1t2a n ASN 61 Cb 0.34 -0.23 0.19 0.00 -2.36 0.00 0.00 39.78 37.73 1t2a n ASN 61 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1t2a n THR 62 N 0.18 2.16 -0.34 5.53 -2.24 -1.26 -4.79 114.28 113.52 1t2a n THR 62 Ca 0.02 -2.52 0.20 0.00 -2.27 0.00 0.00 64.05 59.48 1t2a n THR 62 Cb 0.86 -0.26 0.43 0.00 -2.10 0.00 0.00 70.33 69.26 1t2a n THR 62 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1t2a h GLY 63 N 0.75 1.91 2.00 3.38 0.00 -1.90 -0.01 103.07 109.20 1t2a h GLY 63 Ca 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1t2a h GLY 63 CO 0.11 -0.32 0.00 3.21 0.00 0.00 0.00 176.54 179.54 1t2a h ARG 64 N 0.48 0.00 0.00 4.80 3.08 -1.86 -3.32 114.38 117.55 1t2a h ARG 64 Ca 0.68 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.73 1t2a h ARG 64 Cb 1.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.47 1t2a h ARG 64 CO -0.51 0.00 0.00 0.44 -1.07 0.00 0.00 179.97 178.83 1t2a n ILE 65 N -2.68 0.25 -0.20 2.04 -5.35 -0.50 -4.76 119.36 108.16 1t2a n ILE 65 Ca 0.03 -0.57 0.13 0.00 -0.27 0.00 0.00 62.75 62.07 1t2a n ILE 65 Cb 0.38 0.95 0.45 0.00 -1.74 0.00 0.00 39.64 39.68 1t2a n ILE 65 CO 0.00 0.00 0.00 1.05 -1.76 0.00 0.00 176.55 175.84 1t2a h GLU 66 N 0.00 0.53 0.00 6.28 4.11 -1.15 0.53 114.58 124.88 1t2a h GLU 66 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1t2a h GLU 66 Cb 0.20 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1t2a h GLU 66 CO 0.00 0.35 0.00 -2.39 0.07 0.00 0.00 179.01 177.04 1t2a n HIS 67 N -4.51 0.00 1.13 2.06 1.44 -1.26 -2.09 115.22 112.00 1t2a n HIS 67 Ca 0.15 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.98 1t2a n HIS 67 Cb 0.47 -0.26 0.27 0.00 0.12 0.00 0.00 29.99 30.59 1t2a n HIS 67 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1t2a n LEU 68 N -1.26 0.97 -4.55 2.39 4.32 0.18 -5.24 117.00 113.82 1t2a n LEU 68 Ca 0.07 -0.25 -0.33 0.00 -0.02 0.00 0.00 56.01 55.48 1t2a n LEU 68 Cb 0.11 -0.14 -0.04 0.00 -1.62 0.00 0.00 43.42 41.73 1t2a n LEU 68 CO 0.11 0.20 1.93 -1.22 -1.22 0.00 0.00 177.39 177.18 1t2a n TYR 69 N -0.89 1.38 0.00 -1.77 0.53 -0.89 -4.70 117.16 110.82 1t2a n TYR 69 Ca 0.09 0.11 0.00 0.00 -1.02 0.00 0.00 57.90 57.08 1t2a n TYR 69 Cb 0.36 -2.63 0.00 0.00 -1.03 0.00 0.00 39.34 36.03 1t2a n TYR 69 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 1t2a n ASN 79 N 16.28 0.00 -4.31 7.72 4.13 -1.26 -5.17 115.26 132.65 1t2a n ASN 79 Ca 0.39 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 56.32 1t2a n ASN 79 Cb 0.53 -0.13 -0.16 0.00 -1.54 0.00 0.00 39.78 38.48 1t2a n ASN 79 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 1t2a s MET 80 N 0.00 3.11 -0.04 3.52 1.75 -1.26 -0.28 119.30 126.10 1t2a s MET 80 Ca 0.00 -0.79 0.03 0.00 -1.25 0.00 0.00 55.69 53.68 1t2a s MET 80 Cb 0.00 -2.43 0.00 0.00 2.84 0.00 0.00 34.83 35.24 1t2a s MET 80 CO 0.00 0.24 -0.12 0.15 -0.65 0.00 0.00 175.02 174.64 1t2a s LYS 81 N 0.22 1.43 -0.00 4.11 -0.14 0.19 -4.99 119.74 120.56 1t2a s LYS 81 Ca -0.12 -0.42 0.02 0.00 -1.36 0.00 0.00 55.97 54.08 1t2a s LYS 81 Cb -0.16 -1.25 -0.04 0.00 -1.68 0.00 0.00 37.83 34.70 1t2a s LYS 81 CO 0.07 0.12 -0.00 -0.51 -0.76 0.00 0.00 175.35 174.26 1t2a s LEU 82 N 0.32 3.49 -0.05 3.17 1.43 -1.26 -0.90 118.68 124.87 1t2a s LEU 82 Ca -0.07 -0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.03 1t2a s LEU 82 Cb -0.12 -2.00 0.02 0.00 0.03 0.00 0.00 46.19 44.12 1t2a s LEU 82 CO 0.02 0.28 -0.08 -1.00 0.23 0.00 0.00 176.35 175.80 1t2a s HIS 83 N -1.08 1.08 0.16 0.29 3.76 0.54 -4.91 115.29 115.13 1t2a s HIS 83 Ca 0.19 -0.36 -0.31 0.00 -0.15 0.00 0.00 55.06 54.44 1t2a s HIS 83 Cb -0.11 -0.85 -0.09 0.00 1.11 0.00 0.00 32.58 32.64 1t2a s HIS 83 CO 0.10 -0.22 1.38 0.71 -0.85 0.00 0.00 174.74 175.86 1t2a s TYR 84 N 0.75 3.21 0.20 1.40 4.12 -1.26 -0.19 117.35 125.58 1t2a s TYR 84 Ca -0.13 1.03 -0.21 0.00 0.02 0.00 0.00 57.07 57.77 1t2a s TYR 84 Cb -0.15 -3.69 0.08 0.00 -1.52 0.00 0.00 41.96 36.68 1t2a s TYR 84 CO 0.02 -2.33 1.03 0.20 0.02 0.00 0.00 175.55 174.49 1t2a s GLY 85 N 0.76 0.16 -0.17 0.71 0.00 0.26 -4.82 107.32 104.21 1t2a s GLY 85 Ca 0.62 -0.40 -0.16 0.00 0.00 0.00 0.00 44.72 44.78 1t2a s GLY 85 CO 0.35 2.50 0.45 -0.35 0.00 0.00 0.00 173.10 176.04 1t2a s ASP 86 N -3.43 -0.47 0.00 1.64 -1.08 -1.26 -3.99 116.67 108.08 1t2a s ASP 86 Ca 0.22 0.91 0.15 0.00 -0.52 0.00 0.00 52.55 53.32 1t2a s ASP 86 Cb -0.03 0.92 0.72 0.00 -1.46 0.00 0.00 42.92 43.07 1t2a s ASP 86 CO 0.06 -0.16 1.44 0.18 0.52 0.00 0.00 175.17 177.21 1t2a n LEU 87 N 2.89 0.00 -1.03 -1.34 4.77 -1.26 -1.76 117.00 119.26 1t2a n LEU 87 Ca -0.14 0.35 0.12 0.00 -0.03 0.00 0.00 56.01 56.31 1t2a n LEU 87 Cb 0.57 -0.35 0.25 0.00 -2.33 0.00 0.00 43.42 41.55 1t2a n LEU 87 CO 0.11 -0.17 0.72 0.35 -1.33 0.00 0.00 177.39 177.07 1t2a n THR 88 N -1.35 0.44 -4.02 -5.08 -2.24 -1.26 -4.35 114.28 96.43 1t2a n THR 88 Ca 0.06 -0.66 -0.31 0.00 -2.27 0.00 0.00 64.05 60.87 1t2a n THR 88 Cb 0.14 0.86 -0.15 0.00 -2.10 0.00 0.00 70.33 69.07 1t2a n THR 88 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1t2a s ASP 89 N -1.50 4.72 0.13 3.42 3.68 -0.72 -5.01 116.67 121.38 1t2a s ASP 89 Ca 0.37 -2.07 -0.20 0.00 2.13 0.00 0.00 52.55 52.78 1t2a s ASP 89 Cb 0.22 -1.60 -0.01 0.00 -1.45 0.00 0.00 42.92 40.08 1t2a s ASP 89 CO 0.30 -0.36 1.69 0.28 0.13 0.00 0.00 175.17 177.21 1t2a h SER 90 N 7.64 -0.25 -0.96 -0.34 0.02 -1.87 -2.85 113.55 114.94 1t2a h SER 90 Ca -0.06 0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1t2a h SER 90 Cb 1.02 0.16 -0.05 0.00 0.14 0.00 0.00 62.40 63.67 1t2a h SER 90 CO 0.51 -0.09 0.64 0.74 -1.14 0.00 0.00 176.83 177.49 1t2a h THR 91 N -0.02 1.23 -0.89 -2.27 2.02 -1.96 -0.57 112.91 110.45 1t2a h THR 91 Ca 0.11 -0.44 0.03 0.00 0.77 0.00 0.00 66.41 66.88 1t2a h THR 91 Cb 0.19 -0.17 -0.05 0.00 -1.74 0.00 0.00 68.15 66.39 1t2a h THR 91 CO -0.24 0.23 0.59 0.00 0.37 0.00 0.00 175.52 176.47 1t2a h LEU 93 N 1.13 0.97 -0.35 0.00 3.38 -0.90 -1.88 115.31 117.66 1t2a h LEU 93 Ca 0.35 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.92 1t2a h LEU 93 Cb -0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1t2a h LEU 93 CO -0.10 1.19 0.22 0.58 0.09 0.00 0.00 178.44 180.42 1t2a h VAL 94 N 0.78 1.07 -0.43 1.22 2.07 -0.95 -0.49 116.25 119.53 1t2a h VAL 94 Ca 0.09 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.46 1t2a h VAL 94 Cb 0.87 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1t2a h VAL 94 CO 0.08 0.08 0.27 0.11 0.02 0.00 0.00 177.57 178.14 1t2a h LYS 95 N 0.45 0.54 -0.33 1.57 1.57 -0.91 -0.46 116.57 119.00 1t2a h LYS 95 Ca 0.13 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1t2a h LYS 95 Cb -0.04 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 1t2a h LYS 95 CO -0.04 0.36 0.01 0.82 -0.57 0.00 0.00 179.45 180.03 1t2a h ILE 96 N 0.56 1.25 -0.14 1.86 2.04 -1.12 -2.04 117.51 119.92 1t2a h ILE 96 Ca 0.16 -0.93 -0.07 0.00 1.00 0.00 0.00 64.86 65.02 1t2a h ILE 96 Cb -0.05 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1t2a h ILE 96 CO -0.05 0.31 -0.22 0.40 0.00 0.00 0.00 178.15 178.59 1t2a h ILE 97 N 0.39 1.22 -0.18 -0.67 2.04 -0.89 0.27 117.51 119.68 1t2a h ILE 97 Ca 0.10 -1.02 -0.16 0.00 1.00 0.00 0.00 64.86 64.77 1t2a h ILE 97 Cb 0.43 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 1t2a h ILE 97 CO 0.01 0.31 -0.56 0.78 0.00 0.00 0.00 178.15 178.70 1t2a h ASN 98 N 0.22 0.62 -0.21 1.72 2.35 -0.90 0.13 115.58 119.50 1t2a h ASN 98 Ca 0.04 -0.33 -0.19 0.00 -0.55 0.00 0.00 56.30 55.27 1t2a h ASN 98 Cb 0.52 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1t2a h ASN 98 CO 0.03 1.04 -0.60 -0.08 -1.65 0.00 0.00 177.43 176.18 1t2a h GLU 99 N 0.42 0.78 0.16 0.81 4.81 -0.93 -3.33 114.58 117.29 1t2a h GLU 99 Ca 0.01 -0.56 -0.30 0.00 -0.13 0.00 0.00 59.36 58.38 1t2a h GLU 99 Cb 1.10 0.09 0.01 0.00 0.63 0.00 0.00 28.75 30.58 1t2a h GLU 99 CO 0.10 1.18 -1.38 0.28 -0.73 0.00 0.00 179.01 178.46 1t2a h VAL 100 N 0.51 1.36 -6.29 0.32 2.07 -0.89 -3.48 116.25 109.84 1t2a h VAL 100 Ca -0.02 -2.90 -0.45 0.00 0.82 0.00 0.00 66.70 64.15 1t2a h VAL 100 Cb 1.22 2.92 0.07 0.00 -1.52 0.00 0.00 31.29 33.99 1t2a h VAL 100 CO 0.13 0.86 -0.94 0.29 0.02 0.00 0.00 177.57 177.92 1t2a n LYS 101 N -3.56 -1.28 -1.74 1.57 5.02 0.44 -4.91 118.16 113.70 1t2a n LYS 101 Ca -0.13 0.42 -0.34 0.00 -2.02 0.00 0.00 58.31 56.25 1t2a n LYS 101 Cb 1.05 -4.02 0.05 0.00 -0.02 0.00 0.00 35.03 32.09 1t2a n LYS 101 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1t2a s PRO 102 N -6.13 2.68 0.04 1.97 0.04 -1.26 -4.91 135.00 127.43 1t2a s PRO 102 Ca 0.45 1.55 0.21 0.00 0.04 0.00 0.00 61.00 63.25 1t2a s PRO 102 Cb -0.17 -1.92 -0.20 0.00 0.04 0.00 0.00 34.50 32.25 1t2a s PRO 102 CO 0.87 -1.37 0.66 0.25 0.04 0.00 0.00 177.00 177.45 1t2a n THR 103 N -2.33 0.44 -3.82 1.26 -2.24 0.10 -4.68 114.28 103.00 1t2a n THR 103 Ca 0.12 -0.57 -0.14 0.00 -2.27 0.00 0.00 64.05 61.19 1t2a n THR 103 Cb 0.51 -0.22 -0.15 0.00 -2.10 0.00 0.00 70.33 68.37 1t2a n THR 103 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1t2a s GLU 104 N -3.32 -0.01 -0.10 -0.78 2.02 -0.96 -1.40 118.70 114.16 1t2a s GLU 104 Ca -0.05 0.10 0.03 0.00 0.02 0.00 0.00 54.97 55.07 1t2a s GLU 104 Cb 0.11 -0.16 0.01 0.00 0.10 0.00 0.00 34.13 34.20 1t2a s GLU 104 CO 0.86 -0.09 -0.18 0.42 0.02 0.00 0.00 175.26 176.28 1t2a s ILE 105 N 0.61 1.66 -0.27 -1.63 1.01 0.18 -0.80 121.20 121.97 1t2a s ILE 105 Ca -0.05 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.82 1t2a s ILE 105 Cb -0.07 -1.48 0.04 0.00 0.01 0.00 0.00 42.46 40.96 1t2a s ILE 105 CO -0.02 0.47 -0.05 -0.31 0.00 0.00 0.00 174.94 175.04 1t2a s TYR 106 N 0.65 3.15 -1.04 3.97 2.02 -0.12 -0.07 117.35 125.91 1t2a s TYR 106 Ca -0.13 -1.74 -0.16 0.00 -0.37 0.00 0.00 57.07 54.67 1t2a s TYR 106 Cb -0.16 -2.06 0.15 0.00 -0.40 0.00 0.00 41.96 39.49 1t2a s TYR 106 CO 0.04 -0.77 1.24 1.21 -1.57 0.00 0.00 175.55 175.70 1t2a s ASN 107 N 1.28 6.82 0.00 2.29 2.47 0.15 -1.25 114.94 126.69 1t2a s ASN 107 Ca -0.03 -2.46 0.21 0.00 0.42 0.00 0.00 52.86 51.00 1t2a s ASN 107 Cb -0.18 -2.39 -0.18 0.00 -1.45 0.00 0.00 41.25 37.05 1t2a s ASN 107 CO -0.03 -0.91 0.92 0.18 -3.72 0.00 0.00 177.10 173.54 1t2a n LEU 108 N 6.07 1.19 -4.74 3.21 4.77 -0.77 -2.75 117.00 123.98 1t2a n LEU 108 Ca 0.29 -0.55 -0.41 0.00 -0.03 0.00 0.00 56.01 55.30 1t2a n LEU 108 Cb 0.46 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 1t2a n LEU 108 CO 0.55 0.27 1.14 -0.83 -1.33 0.00 0.00 177.39 177.19 1t2a s GLY 109 N -2.86 2.16 -0.28 -0.72 0.00 -0.97 -4.59 107.32 100.06 1t2a s GLY 109 Ca 0.10 1.36 -0.35 0.00 0.00 0.00 0.00 44.72 45.83 1t2a s GLY 109 CO 0.80 2.37 1.35 0.00 0.00 0.00 0.00 173.10 177.62 1t2a s ALA 110 N 0.21 -2.16 -0.57 3.20 0.00 -1.26 -4.82 121.76 116.36 1t2a s ALA 110 Ca 0.62 1.87 -0.26 0.00 0.00 0.00 0.00 51.96 54.19 1t2a s ALA 110 Cb -0.43 -0.75 0.04 0.00 0.00 0.00 0.00 23.12 21.98 1t2a s ALA 110 CO 0.41 -0.45 1.04 -1.14 0.00 0.00 0.00 175.76 175.63 1t2a s GLN 111 N -1.74 3.39 0.00 0.00 -0.44 -1.26 -4.89 119.66 114.73 1t2a s GLN 111 Ca 0.10 -0.08 0.24 0.00 -2.50 0.00 0.00 55.36 53.13 1t2a s GLN 111 Cb -0.01 -4.04 0.26 0.00 -1.64 0.00 0.00 33.01 27.58 1t2a s GLN 111 CO -0.04 -1.57 1.30 -1.13 0.50 0.00 0.00 175.29 174.35 1t2a n SER 112 N 7.85 2.87 -4.64 6.67 3.41 -1.26 -4.93 113.62 123.60 1t2a n SER 112 Ca 0.04 -1.96 -0.39 0.00 -0.26 0.00 0.00 58.87 56.31 1t2a n SER 112 Cb 0.48 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.35 1t2a n SER 112 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1t2a s HIS 113 N -2.00 3.31 0.09 7.33 5.04 -1.26 -4.99 115.29 122.81 1t2a s HIS 113 Ca 0.29 0.59 -0.20 0.00 -1.54 0.00 0.00 55.06 54.20 1t2a s HIS 113 Cb 0.20 -2.61 -0.09 0.00 0.04 0.00 0.00 32.58 30.12 1t2a s HIS 113 CO 0.30 -0.15 1.57 0.28 -2.34 0.00 0.00 174.74 174.41 1t2a h VAL 114 N 5.23 1.21 -0.64 0.89 2.07 -2.00 -2.24 116.25 120.78 1t2a h VAL 114 Ca -0.33 -0.69 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 1t2a h VAL 114 Cb 1.15 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 1t2a h VAL 114 CO 0.70 0.22 0.32 0.50 0.02 0.00 0.00 177.57 179.33 1t2a h LYS 115 N 0.17 0.90 0.00 1.57 1.63 -1.98 -1.73 116.57 117.13 1t2a h LYS 115 Ca 0.07 -0.12 -0.03 0.00 -0.85 0.00 0.00 60.65 59.71 1t2a h LYS 115 Cb 0.28 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 31.74 1t2a h LYS 115 CO 0.00 0.70 -0.16 0.82 -3.45 0.00 0.00 179.45 177.37 1t2a h ILE 116 N 0.87 0.84 0.00 2.00 2.04 -1.97 -2.02 117.51 119.27 1t2a h ILE 116 Ca 0.22 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1t2a h ILE 116 Cb 0.08 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.51 1t2a h ILE 116 CO -0.03 0.15 -0.06 0.77 0.00 0.00 0.00 178.15 178.98 1t2a h SER 117 N 0.00 0.00 -0.01 1.72 4.64 -0.68 -1.65 113.55 117.57 1t2a h SER 117 Ca -0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1t2a h SER 117 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1t2a h SER 117 CO 0.02 0.06 -0.24 -0.26 -0.87 0.00 0.00 176.83 175.53 1t2a h PHE 118 N 0.00 0.46 0.00 4.77 -1.00 -1.39 -1.97 116.94 117.81 1t2a h PHE 118 Ca -0.00 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 60.69 1t2a h PHE 118 Cb 0.25 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 39.69 1t2a h PHE 118 CO 0.00 0.63 -0.90 -0.25 -1.61 0.00 0.00 178.31 176.18 1t2a n ASP 119 N -4.14 0.83 -2.62 2.17 9.92 -0.80 -4.23 116.55 117.68 1t2a n ASP 119 Ca -0.00 -0.75 -0.23 0.00 -0.53 0.00 0.00 54.79 53.27 1t2a n ASP 119 Cb 0.39 0.83 -0.00 0.00 -0.64 0.00 0.00 41.12 41.69 1t2a n ASP 119 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1t2a n LEU 120 N -1.54 3.87 -0.22 0.64 4.77 -0.69 -4.90 117.00 118.94 1t2a n LEU 120 Ca 0.04 -4.99 -0.08 0.00 -0.03 0.00 0.00 56.01 50.94 1t2a n LEU 120 Cb 0.34 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 41.22 1t2a n LEU 120 CO 0.41 2.13 0.85 0.00 -1.33 0.00 0.00 177.39 179.45 1t2a h ALA 121 N 2.74 0.87 -0.05 -1.18 0.00 -1.53 -1.25 119.26 118.87 1t2a h ALA 121 Ca 0.19 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1t2a h ALA 121 Cb 0.91 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1t2a h ALA 121 CO 0.76 0.67 -0.34 1.49 0.00 0.00 0.00 179.25 181.83 1t2a h GLU 122 N 0.99 0.32 -0.83 0.00 4.81 -1.90 -0.80 114.58 117.17 1t2a h GLU 122 Ca 0.18 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1t2a h GLU 122 Cb 0.52 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.92 1t2a h GLU 122 CO 0.03 0.93 0.54 -0.92 -0.73 0.00 0.00 179.01 178.86 1t2a h TYR 123 N -0.21 1.03 -0.80 0.92 3.20 -1.96 0.99 116.97 120.14 1t2a h TYR 123 Ca -0.03 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 1t2a h TYR 123 Cb 1.02 -0.35 -0.04 0.00 1.54 0.00 0.00 36.73 38.90 1t2a h TYR 123 CO 0.14 0.63 0.32 1.15 -1.64 0.00 0.00 178.16 178.77 1t2a h THR 124 N 1.10 1.26 -0.41 1.81 2.02 -1.16 -0.25 112.91 117.28 1t2a h THR 124 Ca 0.31 -0.82 -0.11 0.00 0.77 0.00 0.00 66.41 66.56 1t2a h THR 124 Cb -0.09 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 66.60 1t2a h THR 124 CO -0.08 0.34 -0.20 0.00 0.37 0.00 0.00 175.52 175.95 1t2a h ALA 125 N 1.19 0.88 -0.46 6.16 0.00 -0.23 0.31 119.26 127.11 1t2a h ALA 125 Ca 0.27 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 1t2a h ALA 125 Cb 0.21 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1t2a h ALA 125 CO -0.02 0.63 -0.12 0.22 0.00 0.00 0.00 179.25 179.96 1t2a h ASP 126 N 0.71 0.85 0.00 0.00 3.58 -0.38 0.73 116.42 121.91 1t2a h ASP 126 Ca 0.10 -0.27 -0.10 0.00 0.42 0.00 0.00 57.03 57.19 1t2a h ASP 126 Cb 0.71 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 1t2a h ASP 126 CO 0.05 0.98 -0.52 0.58 -2.88 0.00 0.00 179.24 177.45 1t2a h VAL 127 N 0.76 1.44 0.00 2.25 2.07 -0.94 0.23 116.25 122.06 1t2a h VAL 127 Ca 0.12 -2.28 -0.18 0.00 0.82 0.00 0.00 66.70 65.18 1t2a h VAL 127 Cb 0.63 2.92 -0.03 0.00 -1.52 0.00 0.00 31.29 33.30 1t2a h VAL 127 CO 0.04 0.49 -0.87 0.44 0.02 0.00 0.00 177.57 177.70 1t2a h ASP 128 N -0.98 0.00 0.00 0.57 5.19 -1.01 -2.97 116.42 117.22 1t2a h ASP 128 Ca -0.14 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.27 1t2a h ASP 128 Cb 1.14 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.65 1t2a h ASP 128 CO -0.08 0.87 -0.05 0.61 -3.12 0.00 0.00 179.24 177.46 1t2a n GLY 129 N 1.25 -0.49 0.22 2.75 0.00 0.08 -4.24 105.19 104.76 1t2a n GLY 129 Ca 0.00 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.03 1t2a n GLY 129 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1t2a h VAL 130 N -0.06 1.21 -0.24 1.61 2.07 -1.11 -2.01 116.25 117.71 1t2a h VAL 130 Ca 0.00 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.52 1t2a h VAL 130 Cb 0.05 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1t2a h VAL 130 CO 0.00 0.29 -0.01 1.23 0.02 0.00 0.00 177.57 179.09 1t2a h GLY 131 N 0.85 0.39 0.92 2.17 0.00 -0.77 0.73 103.07 107.36 1t2a h GLY 131 Ca 0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 1t2a h GLY 131 CO 0.03 0.20 0.12 -0.84 0.00 0.00 0.00 176.54 176.05 1t2a h THR 132 N 0.35 1.18 -0.82 4.70 2.02 -1.47 -1.06 112.91 117.81 1t2a h THR 132 Ca 0.08 -0.54 -0.01 0.00 0.77 0.00 0.00 66.41 66.71 1t2a h THR 132 Cb 0.26 0.98 -0.04 0.00 -1.74 0.00 0.00 68.15 67.61 1t2a h THR 132 CO 0.01 0.19 0.46 0.25 0.37 0.00 0.00 175.52 176.79 1t2a h LEU 133 N 0.34 1.01 -1.34 2.58 5.85 -1.17 -0.96 115.31 121.62 1t2a h LEU 133 Ca 0.10 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1t2a h LEU 133 Cb 0.18 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1t2a h LEU 133 CO -0.01 0.81 0.45 0.03 -0.34 0.00 0.00 178.44 179.38 1t2a h ARG 134 N 1.14 0.88 -0.05 1.25 3.08 -0.48 0.26 114.38 120.47 1t2a h ARG 134 Ca 0.29 -0.05 -0.23 0.00 0.07 0.00 0.00 59.98 60.06 1t2a h ARG 134 Cb 0.01 -0.20 0.01 0.00 0.08 0.00 0.00 29.97 29.87 1t2a h ARG 134 CO -0.05 0.59 -0.90 1.25 -1.07 0.00 0.00 179.97 179.78 1t2a h LEU 135 N 0.91 0.74 -0.34 3.04 5.85 -0.74 -0.27 115.31 124.51 1t2a h LEU 135 Ca 0.25 -0.55 -0.05 0.00 0.84 0.00 0.00 57.88 58.37 1t2a h LEU 135 Cb -0.09 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.70 1t2a h LEU 135 CO -0.06 1.34 0.01 -0.07 -0.34 0.00 0.00 178.44 179.33 1t2a h LEU 136 N 0.37 0.58 -1.29 2.25 3.38 -0.32 -1.76 115.31 118.51 1t2a h LEU 136 Ca -0.08 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.55 1t2a h LEU 136 Cb 1.53 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.11 1t2a h LEU 136 CO 0.17 0.73 0.06 0.44 0.09 0.00 0.00 178.44 179.93 1t2a h ASP 137 N 0.41 0.50 -0.53 -0.43 3.32 -0.46 -1.21 116.42 118.02 1t2a h ASP 137 Ca 0.10 -0.08 -0.09 0.00 0.02 0.00 0.00 57.03 56.98 1t2a h ASP 137 Cb 0.43 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 1t2a h ASP 137 CO 0.01 0.53 -0.02 0.00 -1.72 0.00 0.00 179.24 178.04 1t2a h ALA 138 N 1.54 0.72 -0.33 3.45 0.00 -0.64 0.14 119.26 124.14 1t2a h ALA 138 Ca 0.12 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.77 1t2a h ALA 138 Cb 0.25 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1t2a h ALA 138 CO 0.00 0.56 0.09 0.28 0.00 0.00 0.00 179.25 180.18 1t2a h VAL 139 N 0.83 0.87 -0.55 0.00 2.07 -0.60 0.15 116.25 119.02 1t2a h VAL 139 Ca 0.15 -0.08 -0.11 0.00 0.82 0.00 0.00 66.70 67.49 1t2a h VAL 139 Cb 0.56 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1t2a h VAL 139 CO 0.03 0.04 -0.08 0.50 0.02 0.00 0.00 177.57 178.08 1t2a h LYS 140 N 0.22 1.02 -0.79 1.57 3.64 -1.01 -2.08 116.57 119.14 1t2a h LYS 140 Ca 0.15 -0.36 -0.02 0.00 -1.27 0.00 0.00 60.65 59.15 1t2a h LYS 140 Cb 0.15 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 1t2a h LYS 140 CO -0.18 1.05 0.40 1.15 -2.27 0.00 0.00 179.45 179.60 1t2a h THR 141 N 0.90 1.24 0.00 1.00 2.02 -0.24 -2.71 112.91 115.12 1t2a h THR 141 Ca 0.15 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.68 1t2a h THR 141 Cb 0.64 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 1t2a h THR 141 CO 0.04 0.28 0.00 0.00 0.37 0.00 0.00 175.52 176.21 1t2a n GLY 143 N 0.56 1.08 1.40 0.00 0.00 -1.02 -4.94 105.19 102.27 1t2a n GLY 143 Ca 0.06 -0.59 0.10 0.00 0.00 0.00 0.00 46.02 45.59 1t2a n GLY 143 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1t2a n LEU 144 N -1.12 4.28 -0.00 0.99 4.77 -0.80 -4.63 117.00 120.48 1t2a n LEU 144 Ca -0.10 -2.25 0.11 0.00 -0.03 0.00 0.00 56.01 53.74 1t2a n LEU 144 Cb 0.33 -0.51 0.53 0.00 -2.33 0.00 0.00 43.42 41.44 1t2a n LEU 144 CO 0.15 0.87 1.16 -0.29 -1.33 0.00 0.00 177.39 177.96 1t2a h ILE 145 N 3.93 0.93 -0.07 -0.08 6.09 -1.87 -0.84 117.51 125.60 1t2a h ILE 145 Ca 0.00 -0.11 0.00 0.00 -1.37 0.00 0.00 64.86 63.38 1t2a h ILE 145 Cb 1.21 0.58 0.00 0.00 0.47 0.00 0.00 36.82 39.09 1t2a h ILE 145 CO 0.12 0.06 0.00 0.59 -3.07 0.00 0.00 178.15 175.85 1t2a n ASN 146 N -4.47 3.04 -0.03 2.19 3.02 -1.26 -4.24 115.26 113.51 1t2a n ASN 146 Ca 0.07 -1.99 -0.04 0.00 -0.03 0.00 0.00 54.58 52.58 1t2a n ASN 146 Cb 0.31 -0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.41 1t2a n ASN 146 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1t2a n SER 147 N 1.35 3.57 -4.82 6.41 3.41 -0.63 -4.99 113.62 117.93 1t2a n SER 147 Ca 0.15 -0.02 -0.33 0.00 -0.26 0.00 0.00 58.87 58.40 1t2a n SER 147 Cb 0.60 0.17 -0.05 0.00 -0.26 0.00 0.00 64.21 64.67 1t2a n SER 147 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1t2a s VAL 148 N -2.13 4.26 -0.12 -3.33 0.11 -0.42 -4.95 120.40 113.83 1t2a s VAL 148 Ca -0.07 1.30 -0.03 0.00 -2.93 0.00 0.00 61.98 60.26 1t2a s VAL 148 Cb 0.02 -3.58 -0.03 0.00 -1.53 0.00 0.00 36.38 31.26 1t2a s VAL 148 CO 0.18 -0.40 -0.02 -0.54 -3.33 0.00 0.00 175.10 170.98 1t2a s LYS 149 N -3.46 3.28 -0.13 1.54 -0.14 -0.49 -4.11 119.74 116.23 1t2a s LYS 149 Ca 0.62 -0.47 0.03 0.00 -1.36 0.00 0.00 55.97 54.79 1t2a s LYS 149 Cb -0.11 -2.84 0.01 0.00 -1.68 0.00 0.00 37.83 33.21 1t2a s LYS 149 CO 0.20 0.49 -0.22 0.12 -0.76 0.00 0.00 175.35 175.18 1t2a s PHE 150 N -0.30 2.64 -0.18 3.18 5.36 0.89 -0.65 117.98 128.92 1t2a s PHE 150 Ca 0.06 -1.21 -0.05 0.00 -0.96 0.00 0.00 56.93 54.77 1t2a s PHE 150 Cb -0.12 -1.79 -0.03 0.00 -0.34 0.00 0.00 43.02 40.74 1t2a s PHE 150 CO 0.02 -0.53 -0.01 -0.47 -1.46 0.00 0.00 175.22 172.78 1t2a s TYR 151 N 0.64 3.06 -0.14 10.12 5.04 0.90 -1.20 117.35 135.78 1t2a s TYR 151 Ca -0.11 -0.31 -0.05 0.00 -2.44 0.00 0.00 57.07 54.16 1t2a s TYR 151 Cb -0.16 -2.03 -0.03 0.00 0.35 0.00 0.00 41.96 40.08 1t2a s TYR 151 CO 0.02 -0.10 0.02 -1.14 -1.34 0.00 0.00 175.55 173.02 1t2a s GLN 152 N 0.64 3.53 -1.29 4.97 2.00 0.64 -0.68 119.66 129.47 1t2a s GLN 152 Ca -0.01 -0.39 -0.17 0.00 -2.00 0.00 0.00 55.36 52.79 1t2a s GLN 152 Cb -0.14 -3.00 0.09 0.00 0.80 0.00 0.00 33.01 30.76 1t2a s GLN 152 CO 0.02 0.45 1.71 0.00 -0.50 0.00 0.00 175.29 176.97 1t2a n ALA 153 N 2.94 3.72 -1.46 1.58 0.00 -1.11 -1.80 120.51 124.38 1t2a n ALA 153 Ca -0.18 -3.93 -0.13 0.00 0.00 0.00 0.00 53.44 49.20 1t2a n ALA 153 Cb 0.53 -3.50 0.13 0.00 0.00 0.00 0.00 19.45 16.61 1t2a n ALA 153 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1t2a n SER 154 N 7.74 -0.31 -3.54 0.00 7.64 -0.10 -4.98 113.62 120.06 1t2a n SER 154 Ca 0.47 -1.22 -0.15 0.00 1.01 0.00 0.00 58.87 58.98 1t2a n SER 154 Cb 0.45 -0.63 -0.06 0.00 -1.01 0.00 0.00 64.21 62.96 1t2a n SER 154 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1t2a s THR 155 N -2.69 0.00 0.63 0.44 -1.32 -1.25 -3.10 115.64 108.35 1t2a s THR 155 Ca 0.47 0.00 0.36 0.00 -1.21 0.00 0.00 61.69 61.30 1t2a s THR 155 Cb -0.02 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.36 1t2a s THR 155 CO 0.33 0.00 2.22 0.77 -2.21 0.00 0.00 174.62 175.73 1t2a h SER 156 N 2.90 0.00 -0.02 8.08 4.64 -1.39 -1.29 113.55 126.47 1t2a h SER 156 Ca -0.24 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.08 1t2a h SER 156 Cb 1.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1t2a h SER 156 CO 0.36 0.00 0.11 -0.08 -0.87 0.00 0.00 176.83 176.34 1t2a h GLU 157 N 0.00 0.00 -0.46 4.77 4.57 -1.95 -0.11 114.58 121.40 1t2a h GLU 157 Ca 0.02 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.22 1t2a h GLU 157 Cb 0.22 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 1t2a h GLU 157 CO -0.00 0.00 0.30 -0.07 -1.18 0.00 0.00 179.01 178.06 1t2a h LEU 158 N 0.00 0.48 -0.37 1.64 3.38 -1.54 -2.37 115.31 116.52 1t2a h LEU 158 Ca 0.01 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1t2a h LEU 158 Cb 0.22 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1t2a h LEU 158 CO -0.00 0.34 -0.37 1.88 0.09 0.00 0.00 178.44 180.38 1t2a h TYR 159 N 0.56 0.00 0.00 1.13 -1.99 -1.23 0.21 116.97 115.65 1t2a h TYR 159 Ca 0.18 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.91 1t2a h TYR 159 Cb 0.03 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.76 1t2a h TYR 159 CO -0.00 0.37 0.00 0.41 -0.00 0.00 0.00 178.16 178.94 1t2a n GLY 160 N 0.85 1.37 3.53 3.88 0.00 -0.89 -2.47 105.19 111.45 1t2a n GLY 160 Ca 0.02 0.69 -0.42 0.00 0.00 0.00 0.00 46.02 46.31 1t2a n GLY 160 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1t2a s LYS 161 N 0.00 3.66 0.07 1.61 2.20 -0.78 -4.65 119.74 121.84 1t2a s LYS 161 Ca 0.00 -1.48 -0.37 0.00 -0.36 0.00 0.00 55.97 53.76 1t2a s LYS 161 Cb 0.00 -5.24 -0.18 0.00 -1.51 0.00 0.00 37.83 30.90 1t2a s LYS 161 CO 0.00 -2.07 1.15 1.33 -0.36 0.00 0.00 175.35 175.40 1t2a n VAL 162 N 6.31 0.24 1.03 4.02 0.24 -1.03 -4.78 118.33 124.37 1t2a n VAL 162 Ca 0.32 -0.06 0.11 0.00 -2.04 0.00 0.00 64.34 62.67 1t2a n VAL 162 Cb 0.49 -0.41 0.07 0.00 -1.47 0.00 0.00 33.84 32.53 1t2a n VAL 162 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t2a n GLN 163 N 1.88 0.27 -3.61 7.34 1.13 -1.26 -4.92 117.38 118.20 1t2a n GLN 163 Ca 0.19 -0.20 -0.13 0.00 -1.94 0.00 0.00 57.00 54.92 1t2a n GLN 163 Cb 0.15 -1.50 -0.05 0.00 0.11 0.00 0.00 30.24 28.95 1t2a n GLN 163 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1t2a s GLU 164 N -2.87 1.02 -0.07 -1.09 2.02 -1.26 -4.92 118.70 111.53 1t2a s GLU 164 Ca 0.12 -0.39 -0.01 0.00 0.02 0.00 0.00 54.97 54.71 1t2a s GLU 164 Cb 0.17 0.46 0.03 0.00 0.10 0.00 0.00 34.13 34.89 1t2a s GLU 164 CO 0.73 -0.37 -0.01 0.42 0.02 0.00 0.00 175.26 176.05 1t2a s ILE 165 N -2.83 0.43 1.06 -1.63 1.01 -1.26 -3.89 121.20 114.09 1t2a s ILE 165 Ca -0.03 0.07 -0.17 0.00 0.00 0.00 0.00 60.65 60.52 1t2a s ILE 165 Cb -0.00 -0.57 0.24 0.00 0.01 0.00 0.00 42.46 42.13 1t2a s ILE 165 CO -0.05 0.26 1.24 -2.16 0.00 0.00 0.00 174.94 174.23 1t2a s PRO 166 N 1.87 -0.13 -0.13 2.79 0.04 -1.26 -5.12 135.00 133.06 1t2a s PRO 166 Ca 0.04 -0.28 -0.12 0.00 0.04 0.00 0.00 61.00 60.68 1t2a s PRO 166 Cb -0.12 -1.74 -0.05 0.00 0.04 0.00 0.00 34.50 32.62 1t2a s PRO 166 CO -0.05 -2.95 0.25 -0.65 0.04 0.00 0.00 177.00 173.64 1t2a s GLN 167 N -5.70 4.01 0.27 4.56 1.11 -0.15 -4.87 119.66 118.89 1t2a s GLN 167 Ca 0.73 0.03 0.01 0.00 0.01 0.00 0.00 55.36 56.14 1t2a s GLN 167 Cb -0.06 -3.34 -0.00 0.00 -1.01 0.00 0.00 33.01 28.59 1t2a s GLN 167 CO 0.54 0.44 0.03 0.36 0.01 0.00 0.00 175.29 176.68 1t2a n LYS 168 N 2.94 1.07 -0.07 2.91 2.85 -1.26 -1.10 118.16 125.50 1t2a n LYS 168 Ca -0.15 -2.06 0.12 0.00 -1.05 0.00 0.00 58.31 55.17 1t2a n LYS 168 Cb 0.53 0.78 0.50 0.00 -0.65 0.00 0.00 35.03 36.19 1t2a n LYS 168 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1t2a h GLU 169 N 0.00 0.39 -0.30 -1.58 3.07 -1.95 -2.17 114.58 112.04 1t2a h GLU 169 Ca -0.22 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.62 1t2a h GLU 169 Cb 0.72 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 1t2a h GLU 169 CO 0.35 0.26 0.00 0.25 -1.40 0.00 0.00 179.01 178.47 1t2a n THR 170 N -4.47 0.39 -2.41 1.13 -2.24 -1.26 -4.90 114.28 100.52 1t2a n THR 170 Ca 0.09 -0.53 -0.42 0.00 -2.27 0.00 0.00 64.05 60.92 1t2a n THR 170 Cb 0.35 0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 69.09 1t2a n THR 170 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1t2a s THR 171 N -1.61 3.90 0.31 4.28 2.01 -0.82 -4.96 115.64 118.74 1t2a s THR 171 Ca 0.34 1.42 -0.29 0.00 0.31 0.00 0.00 61.69 63.47 1t2a s THR 171 Cb 0.19 -3.91 -0.10 0.00 0.01 0.00 0.00 72.50 68.68 1t2a s THR 171 CO 0.27 0.15 1.36 -2.84 -0.69 0.00 0.00 174.62 172.86 1t2a s PRO 172 N 0.67 4.31 0.59 4.92 0.02 -1.26 -4.90 135.00 139.36 1t2a s PRO 172 Ca 0.57 2.26 -0.16 0.00 0.02 0.00 0.00 61.00 63.69 1t2a s PRO 172 Cb -0.30 -3.08 -0.03 0.00 0.02 0.00 0.00 34.50 31.10 1t2a s PRO 172 CO 0.31 -0.28 1.07 -0.06 -0.33 0.00 0.00 177.00 177.71 1t2a s PHE 173 N -0.79 2.88 -0.49 6.54 0.08 -1.26 -4.42 117.98 120.52 1t2a s PHE 173 Ca 0.52 1.53 0.06 0.00 0.12 0.00 0.00 56.93 59.17 1t2a s PHE 173 Cb -0.41 -3.07 0.22 0.00 -0.57 0.00 0.00 43.02 39.19 1t2a s PHE 173 CO 0.51 -1.26 0.78 0.98 -0.10 0.00 0.00 175.22 176.13 1t2a n TYR 174 N -1.96 -3.22 -1.39 0.36 -0.00 0.05 -4.97 117.16 106.03 1t2a n TYR 174 Ca 0.09 -1.80 -0.35 0.00 -0.00 0.00 0.00 57.90 55.84 1t2a n TYR 174 Cb 0.52 1.35 0.10 0.00 -0.00 0.00 0.00 39.34 41.31 1t2a n TYR 174 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.86 176.51 1t2a n PRO 175 N 2.18 0.59 -0.69 2.98 -0.04 -1.17 -1.87 135.00 136.97 1t2a n PRO 175 Ca 0.14 0.27 0.03 0.00 -0.04 0.00 0.00 63.50 63.90 1t2a n PRO 175 Cb 0.59 -2.40 0.05 0.00 -0.04 0.00 0.00 33.50 31.70 1t2a n PRO 175 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1t2a n ARG 176 N -2.36 0.37 -3.68 0.54 5.12 -1.26 -4.80 116.66 110.59 1t2a n ARG 176 Ca 0.14 -1.75 -0.06 0.00 -1.93 0.00 0.00 57.85 54.25 1t2a n ARG 176 Cb 0.49 -0.65 -0.02 0.00 -1.16 0.00 0.00 32.46 31.12 1t2a n ARG 176 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1t2a s SER 177 N -1.80 -0.29 0.44 0.55 1.04 -1.26 -4.61 113.70 107.78 1t2a s SER 177 Ca 0.18 -0.31 0.12 0.00 0.48 0.00 0.00 55.95 56.42 1t2a s SER 177 Cb 0.18 0.53 0.96 0.00 0.10 0.00 0.00 66.02 67.80 1t2a s SER 177 CO -0.05 -0.94 2.02 -0.65 0.98 0.00 0.00 173.24 174.60 1t2a h PRO 178 N 2.00 0.19 0.07 4.02 0.11 -1.90 -0.52 132.00 135.97 1t2a h PRO 178 Ca -0.24 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.84 1t2a h PRO 178 Cb 1.25 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1t2a h PRO 178 CO 0.28 0.24 -0.03 -0.92 -0.21 0.00 0.00 178.00 177.35 1t2a h TYR 179 N 0.19 -0.08 -0.54 0.65 3.20 -1.87 -1.04 116.97 117.47 1t2a h TYR 179 Ca 0.04 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.95 1t2a h TYR 179 Cb 0.18 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.44 1t2a h TYR 179 CO 0.00 0.09 0.30 0.78 -1.64 0.00 0.00 178.16 177.69 1t2a h GLY 180 N -0.24 0.76 0.97 1.82 0.00 -1.66 -0.08 103.07 104.64 1t2a h GLY 180 Ca -0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1t2a h GLY 180 CO 0.01 0.15 0.21 0.00 0.00 0.00 0.00 176.54 176.91 1t2a h ALA 181 N 1.27 0.47 -0.78 3.60 0.00 -1.09 -0.94 119.26 121.79 1t2a h ALA 181 Ca 0.23 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1t2a h ALA 181 Cb 0.10 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1t2a h ALA 181 CO -0.14 -0.00 0.40 0.00 0.00 0.00 0.00 179.25 179.51 1t2a h ALA 182 N 1.07 1.00 0.00 0.00 0.00 -0.80 -1.94 119.26 118.59 1t2a h ALA 182 Ca 0.13 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1t2a h ALA 182 Cb 0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1t2a h ALA 182 CO -0.02 0.53 -0.33 0.87 0.00 0.00 0.00 179.25 180.30 1t2a h LYS 183 N 1.09 0.00 -0.37 0.00 1.79 -0.84 -1.97 116.57 116.26 1t2a h LYS 183 Ca 0.27 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.59 1t2a h LYS 183 Cb 0.07 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 1t2a h LYS 183 CO -0.04 0.33 -0.36 1.25 -1.08 0.00 0.00 179.45 179.55 1t2a h LEU 184 N 0.00 0.90 -0.39 2.94 5.85 -0.45 0.18 115.31 124.34 1t2a h LEU 184 Ca -0.00 -0.40 -0.02 0.00 0.84 0.00 0.00 57.88 58.30 1t2a h LEU 184 Cb 0.60 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1t2a h LEU 184 CO 0.04 1.17 0.16 0.22 -0.34 0.00 0.00 178.44 179.69 1t2a h TYR 185 N 0.71 0.59 -0.65 1.25 3.20 -0.91 -2.43 116.97 118.73 1t2a h TYR 185 Ca 0.06 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1t2a h TYR 185 Cb 0.93 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.99 1t2a h TYR 185 CO 0.05 0.53 0.42 0.00 -1.64 0.00 0.00 178.16 177.52 1t2a h ALA 186 N 1.00 0.83 -0.17 1.82 0.00 -1.05 -0.42 119.26 121.26 1t2a h ALA 186 Ca 0.13 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1t2a h ALA 186 Cb 0.18 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 1t2a h ALA 186 CO -0.01 0.27 -0.20 -0.92 0.00 0.00 0.00 179.25 178.40 1t2a h TYR 187 N 0.88 -0.51 -0.06 0.00 3.20 -0.40 -2.19 116.97 117.90 1t2a h TYR 187 Ca 0.24 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 62.00 1t2a h TYR 187 Cb -0.08 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 1t2a h TYR 187 CO -0.02 -0.27 -0.56 -1.49 -1.64 0.00 0.00 178.16 174.17 1t2a h TRP 188 N -0.23 0.22 -0.11 -3.82 4.06 -1.02 -2.20 115.95 112.86 1t2a h TRP 188 Ca 0.11 -0.08 -0.11 0.00 2.06 0.00 0.00 58.89 60.87 1t2a h TRP 188 Cb 0.40 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.50 1t2a h TRP 188 CO -0.33 0.70 -0.44 0.97 -3.56 0.00 0.00 178.44 175.78 1t2a h ILE 189 N 0.14 1.32 -0.07 1.49 6.09 -0.93 0.22 117.51 125.77 1t2a h ILE 189 Ca -0.00 -1.61 -0.01 0.00 -1.37 0.00 0.00 64.86 61.87 1t2a h ILE 189 Cb 1.03 1.74 -0.00 0.00 0.47 0.00 0.00 36.82 40.05 1t2a h ILE 189 CO 0.08 0.48 -0.00 0.58 -3.07 0.00 0.00 178.15 176.22 1t2a h VAL 190 N 0.21 1.26 -0.77 2.19 2.07 -1.30 -0.96 116.25 118.95 1t2a h VAL 190 Ca 0.02 -0.82 0.08 0.00 0.82 0.00 0.00 66.70 66.80 1t2a h VAL 190 Cb 0.87 1.67 -0.07 0.00 -1.52 0.00 0.00 31.29 32.24 1t2a h VAL 190 CO 0.07 0.23 0.43 0.58 0.02 0.00 0.00 177.57 178.89 1t2a h VAL 191 N -0.17 0.92 -0.67 2.57 2.07 -1.09 -1.77 116.25 118.12 1t2a h VAL 191 Ca 0.02 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 1t2a h VAL 191 Cb 0.36 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 1t2a h VAL 191 CO 0.00 0.14 0.13 -1.13 0.02 0.00 0.00 177.57 176.73 1t2a h ASN 192 N 0.74 1.03 -0.11 0.57 -0.00 -0.23 -0.39 115.58 117.18 1t2a h ASN 192 Ca 0.36 -0.23 -0.08 0.00 -0.00 0.00 0.00 56.30 56.35 1t2a h ASN 192 Cb 0.31 -0.27 -0.02 0.00 -0.00 0.00 0.00 38.32 38.34 1t2a h ASN 192 CO -0.23 1.01 -0.17 -0.26 -0.00 0.00 0.00 177.43 177.78 1t2a h PHE 193 N 1.02 0.54 0.27 0.67 -1.00 -0.72 0.17 116.94 117.88 1t2a h PHE 193 Ca 0.21 -0.09 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 1t2a h PHE 193 Cb 0.40 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.83 1t2a h PHE 193 CO 0.03 0.65 -0.13 -0.09 -1.61 0.00 0.00 178.31 177.16 1t2a h ARG 194 N 0.45 -0.35 -0.33 1.51 2.43 -0.83 -1.43 114.38 115.84 1t2a h ARG 194 Ca 0.08 0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.12 1t2a h ARG 194 Cb 0.56 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 1t2a h ARG 194 CO 0.04 -0.16 -0.38 0.93 -1.51 0.00 0.00 179.97 178.88 1t2a h GLU 195 N -0.46 0.79 0.05 0.20 5.08 -0.95 -0.22 114.58 119.06 1t2a h GLU 195 Ca -0.04 -0.41 -0.28 0.00 -1.00 0.00 0.00 59.36 57.64 1t2a h GLU 195 Cb 0.34 0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.63 1t2a h GLU 195 CO 0.06 1.03 -1.11 0.00 -1.00 0.00 0.00 179.01 177.99 1t2a h ALA 196 N 0.92 0.07 0.00 3.43 0.00 -0.71 -3.38 119.26 119.58 1t2a h ALA 196 Ca 0.06 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1t2a h ALA 196 Cb 0.94 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1t2a h ALA 196 CO 0.09 0.67 0.00 0.66 0.00 0.00 0.00 179.25 180.67 1t2a n TYR 197 N -3.84 0.00 -2.96 0.00 4.02 -0.54 -5.01 117.16 108.82 1t2a n TYR 197 Ca -0.12 -0.44 -0.22 0.00 -0.01 0.00 0.00 57.90 57.11 1t2a n TYR 197 Cb 0.92 -0.04 0.03 0.00 -0.02 0.00 0.00 39.34 40.22 1t2a n TYR 197 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1t2a n ASN 198 N -0.44 -5.98 -4.74 7.72 3.02 -0.10 -4.86 115.26 109.89 1t2a n ASN 198 Ca 0.00 -0.26 -0.41 0.00 -0.03 0.00 0.00 54.58 53.89 1t2a n ASN 198 Cb 0.25 -4.85 -0.05 0.00 -0.61 0.00 0.00 39.78 34.52 1t2a n ASN 198 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1t2a s LEU 199 N -6.60 4.57 -0.72 3.41 2.96 -1.19 -4.79 118.68 116.32 1t2a s LEU 199 Ca 0.27 1.90 -0.27 0.00 -0.22 0.00 0.00 54.13 55.81 1t2a s LEU 199 Cb -0.12 -3.60 0.02 0.00 0.50 0.00 0.00 46.19 42.99 1t2a s LEU 199 CO 0.34 0.02 1.36 0.12 -1.32 0.00 0.00 176.35 176.86 1t2a s PHE 200 N -0.58 2.20 -0.01 5.38 2.19 -1.26 -4.33 117.98 121.58 1t2a s PHE 200 Ca 0.44 0.08 0.00 0.00 0.33 0.00 0.00 56.93 57.78 1t2a s PHE 200 Cb -0.25 -4.55 0.01 0.00 -1.31 0.00 0.00 43.02 36.92 1t2a s PHE 200 CO 0.32 -2.10 0.00 0.00 1.83 0.00 0.00 175.22 175.27 1t2a s ALA 201 N 6.17 0.09 0.07 11.12 0.00 -1.26 -0.08 121.76 137.88 1t2a s ALA 201 Ca 0.40 0.10 0.02 0.00 0.00 0.00 0.00 51.96 52.47 1t2a s ALA 201 Cb -0.09 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.88 1t2a s ALA 201 CO 0.16 -0.03 -0.08 0.14 0.00 0.00 0.00 175.76 175.95 1t2a s VAL 202 N 0.43 0.65 -0.26 0.00 -7.23 -0.34 -4.64 120.40 109.01 1t2a s VAL 202 Ca -0.04 -1.47 -0.08 0.00 -1.81 0.00 0.00 61.98 58.59 1t2a s VAL 202 Cb -0.06 -1.11 -0.02 0.00 0.56 0.00 0.00 36.38 35.75 1t2a s VAL 202 CO -0.01 -0.58 0.09 0.20 -0.31 0.00 0.00 175.10 174.48 1t2a s ASN 203 N -2.23 5.21 -0.37 4.85 0.01 -1.26 -0.26 114.94 120.89 1t2a s ASN 203 Ca 0.00 -0.28 -0.21 0.00 -0.71 0.00 0.00 52.86 51.66 1t2a s ASN 203 Cb -0.03 -1.94 0.01 0.00 0.41 0.00 0.00 41.25 39.70 1t2a s ASN 203 CO -0.02 -0.07 0.68 -0.83 -1.51 0.00 0.00 177.10 175.36 1t2a s GLY 204 N 1.61 1.71 -1.07 0.66 0.00 -0.75 -1.77 107.32 107.73 1t2a s GLY 204 Ca 0.06 -0.82 -0.13 0.00 0.00 0.00 0.00 44.72 43.83 1t2a s GLY 204 CO 0.04 1.58 1.15 -0.42 0.00 0.00 0.00 173.10 175.45 1t2a s ILE 205 N 2.85 5.46 0.07 0.90 1.01 0.17 -0.93 121.20 130.73 1t2a s ILE 205 Ca 0.26 -2.75 -0.21 0.00 0.00 0.00 0.00 60.65 57.95 1t2a s ILE 205 Cb -0.14 -4.70 -0.06 0.00 0.01 0.00 0.00 42.46 37.57 1t2a s ILE 205 CO 0.16 -1.34 0.63 -0.76 0.00 0.00 0.00 174.94 173.64 1t2a s LEU 206 N 0.42 4.50 0.68 2.97 1.02 -1.18 -1.73 118.68 125.36 1t2a s LEU 206 Ca 0.32 1.32 -0.07 0.00 0.02 0.00 0.00 54.13 55.73 1t2a s LEU 206 Cb -0.07 -3.01 0.05 0.00 0.02 0.00 0.00 46.19 43.18 1t2a s LEU 206 CO -0.06 0.19 0.99 -0.36 0.02 0.00 0.00 176.35 177.13 1t2a s PHE 207 N -0.75 3.00 0.09 0.29 0.40 -0.50 -1.13 117.98 119.39 1t2a s PHE 207 Ca 0.32 0.51 -0.36 0.00 -0.60 0.00 0.00 56.93 56.79 1t2a s PHE 207 Cb -0.20 -3.09 -0.17 0.00 0.51 0.00 0.00 43.02 40.07 1t2a s PHE 207 CO 0.20 -1.27 1.24 0.09 0.70 0.00 0.00 175.22 176.18 1t2a n ASN 208 N -2.85 1.26 -3.84 1.36 4.13 -1.20 -4.83 115.26 109.28 1t2a n ASN 208 Ca 0.07 1.13 -0.13 0.00 1.68 0.00 0.00 54.58 57.34 1t2a n ASN 208 Cb 0.60 -1.15 -0.14 0.00 -1.54 0.00 0.00 39.78 37.55 1t2a n ASN 208 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 1t2a s HIS 209 N 0.24 -0.01 0.43 3.10 -3.43 -1.26 -1.58 115.29 112.78 1t2a s HIS 209 Ca 0.83 0.06 0.03 0.00 -0.80 0.00 0.00 55.06 55.18 1t2a s HIS 209 Cb -0.98 -0.05 -0.02 0.00 -1.43 0.00 0.00 32.58 30.10 1t2a s HIS 209 CO 0.50 -0.03 0.11 -1.21 -2.00 0.00 0.00 174.74 172.11 1t2a s GLU 210 N 0.26 1.99 -0.10 -0.38 0.41 0.17 -4.66 118.70 116.38 1t2a s GLU 210 Ca -0.02 -2.22 -0.31 0.00 -0.41 0.00 0.00 54.97 52.00 1t2a s GLU 210 Cb -0.03 -0.78 0.10 0.00 -1.78 0.00 0.00 34.13 31.65 1t2a s GLU 210 CO -0.01 -0.46 1.38 -1.54 -0.49 0.00 0.00 175.26 174.14 1t2a s SER 211 N -3.66 0.00 0.03 -0.19 1.04 -1.26 -0.63 113.70 109.03 1t2a s SER 211 Ca 0.20 -0.01 0.13 0.00 0.48 0.00 0.00 55.95 56.76 1t2a s SER 211 Cb 0.02 0.00 0.55 0.00 0.10 0.00 0.00 66.02 66.69 1t2a s SER 211 CO 0.13 -0.01 1.40 -2.65 0.98 0.00 0.00 173.24 173.09 1t2a n PRO 212 N -0.95 0.02 0.00 4.02 -0.02 -1.26 -1.79 135.00 135.02 1t2a n PRO 212 Ca 0.05 0.33 0.12 0.00 -2.02 0.00 0.00 63.50 61.98 1t2a n PRO 212 Cb 0.59 -1.55 0.09 0.00 -0.02 0.00 0.00 33.50 32.60 1t2a n PRO 212 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1t2a n ARG 213 N -1.59 2.14 -1.74 -0.52 1.74 -1.26 -5.00 116.66 110.42 1t2a n ARG 213 Ca 0.03 -1.80 -0.41 0.00 -0.77 0.00 0.00 57.85 54.90 1t2a n ARG 213 Cb 0.14 -1.45 0.01 0.00 -1.02 0.00 0.00 32.46 30.13 1t2a n ARG 213 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1t2a n ARG 214 N 1.18 2.32 -1.67 5.56 3.00 -0.74 -4.54 116.66 121.76 1t2a n ARG 214 Ca 0.13 0.82 -0.43 0.00 -0.00 0.00 0.00 57.85 58.37 1t2a n ARG 214 Cb 0.57 -2.53 -0.01 0.00 0.00 0.00 0.00 32.46 30.49 1t2a n ARG 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1t2a n GLY 215 N 0.62 0.37 0.24 5.14 0.00 -1.26 -4.83 105.19 105.46 1t2a n GLY 215 Ca 0.04 0.30 0.17 0.00 0.00 0.00 0.00 46.02 46.53 1t2a n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t2a h ALA 216 N 2.36 1.00 0.00 4.61 0.00 -1.92 -2.35 119.26 122.96 1t2a h ALA 216 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1t2a h ALA 216 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1t2a h ALA 216 CO 0.62 0.00 -0.16 -1.71 0.00 0.00 0.00 179.25 178.00 1t2a n ASN 217 N -2.75 0.20 -4.86 0.00 5.15 -1.26 -3.36 115.26 108.38 1t2a n ASN 217 Ca -0.00 0.29 -0.31 0.00 -0.60 0.00 0.00 54.58 53.95 1t2a n ASN 217 Cb 0.18 -0.29 -0.02 0.00 -0.53 0.00 0.00 39.78 39.11 1t2a n ASN 217 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1t2a s PHE 218 N -3.01 3.49 0.30 1.20 0.40 -0.89 -4.89 117.98 114.59 1t2a s PHE 218 Ca 0.13 1.22 0.00 0.00 -0.60 0.00 0.00 56.93 57.68 1t2a s PHE 218 Cb 0.18 -2.60 0.47 0.00 0.51 0.00 0.00 43.02 41.58 1t2a s PHE 218 CO 0.59 -0.30 1.87 -0.24 0.70 0.00 0.00 175.22 177.83 1t2a h VAL 219 N 0.76 1.21 -0.08 -0.44 3.04 -1.90 -1.23 116.25 117.62 1t2a h VAL 219 Ca -0.47 -0.71 -0.01 0.00 -1.01 0.00 0.00 66.70 64.50 1t2a h VAL 219 Cb 1.19 0.62 -0.00 0.00 -2.01 0.00 0.00 31.29 31.08 1t2a h VAL 219 CO 0.62 0.27 0.00 0.71 -1.01 0.00 0.00 177.57 178.17 1t2a h THR 220 N 0.78 1.24 -0.09 3.17 1.35 -1.93 -1.19 112.91 116.23 1t2a h THR 220 Ca 0.18 -0.76 -0.15 0.00 -0.55 0.00 0.00 66.41 65.13 1t2a h THR 220 Cb 0.22 1.59 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 1t2a h THR 220 CO -0.01 0.21 -0.61 -0.09 -0.25 0.00 0.00 175.52 174.78 1t2a h ARG 221 N -0.13 0.32 -0.70 4.72 9.65 -1.79 0.14 114.38 126.58 1t2a h ARG 221 Ca 0.02 -0.22 -0.02 0.00 -1.10 0.00 0.00 59.98 58.67 1t2a h ARG 221 Cb 0.33 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.91 1t2a h ARG 221 CO 0.00 0.83 0.36 -0.22 2.80 0.00 0.00 179.97 183.74 1t2a h LYS 222 N 0.23 0.99 0.07 0.20 3.64 -1.14 -0.08 116.57 120.48 1t2a h LYS 222 Ca -0.01 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1t2a h LYS 222 Cb 1.12 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1t2a h LYS 222 CO 0.10 0.76 -0.03 0.82 -2.27 0.00 0.00 179.45 178.83 1t2a h ILE 223 N 0.97 1.17 -0.69 2.00 2.04 -0.83 -1.77 117.51 120.40 1t2a h ILE 223 Ca 0.24 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 65.29 1t2a h ILE 223 Cb 0.07 1.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.82 1t2a h ILE 223 CO -0.04 0.21 0.45 0.77 0.00 0.00 0.00 178.15 179.54 1t2a h SER 224 N -0.47 0.76 -0.56 1.72 4.64 -0.90 0.18 113.55 118.93 1t2a h SER 224 Ca -0.01 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.26 1t2a h SER 224 Cb 0.41 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.29 1t2a h SER 224 CO 0.01 0.55 0.19 0.03 -0.87 0.00 0.00 176.83 176.75 1t2a h ARG 225 N 0.90 0.85 -0.36 4.77 3.08 -1.05 -0.82 114.38 121.75 1t2a h ARG 225 Ca 0.26 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 1t2a h ARG 225 Cb -0.07 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.84 1t2a h ARG 225 CO -0.07 0.76 0.01 0.77 -1.07 0.00 0.00 179.97 180.37 1t2a h SER 226 N 0.77 0.62 -0.41 7.04 0.02 -0.83 -1.69 113.55 119.07 1t2a h SER 226 Ca 0.18 -0.30 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 1t2a h SER 226 Cb 0.25 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 1t2a h SER 226 CO -0.01 0.77 0.12 0.58 -1.14 0.00 0.00 176.83 177.14 1t2a h VAL 227 N 0.45 1.21 -0.58 2.27 2.07 -0.59 -1.81 116.25 119.28 1t2a h VAL 227 Ca 0.10 -0.74 -0.10 0.00 0.82 0.00 0.00 66.70 66.78 1t2a h VAL 227 Cb 0.44 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1t2a h VAL 227 CO 0.02 0.27 -0.03 0.00 0.02 0.00 0.00 177.57 177.85 1t2a h ALA 228 N 1.43 0.78 -0.24 1.67 0.00 -0.83 -1.46 119.26 120.61 1t2a h ALA 228 Ca 0.16 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 1t2a h ALA 228 Cb 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1t2a h ALA 228 CO -0.00 0.64 -0.37 0.87 0.00 0.00 0.00 179.25 180.39 1t2a h LYS 229 N 0.93 0.54 -0.27 0.00 1.57 -0.93 -0.99 116.57 117.42 1t2a h LYS 229 Ca 0.16 -0.26 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 1t2a h LYS 229 Cb 0.59 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 1t2a h LYS 229 CO 0.04 0.83 0.02 0.82 -0.57 0.00 0.00 179.45 180.59 1t2a h ILE 230 N 0.45 1.25 -0.86 1.86 2.04 -1.16 1.47 117.51 122.56 1t2a h ILE 230 Ca 0.05 -0.86 0.03 0.00 1.00 0.00 0.00 64.86 65.08 1t2a h ILE 230 Cb 0.85 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 38.17 1t2a h ILE 230 CO 0.07 0.27 0.55 0.22 0.00 0.00 0.00 178.15 179.27 1t2a h TYR 231 N 0.25 1.04 -0.00 1.37 3.20 -1.07 0.37 116.97 122.13 1t2a h TYR 231 Ca 0.08 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.97 1t2a h TYR 231 Cb 0.38 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.31 1t2a h TYR 231 CO 0.03 0.60 0.00 1.28 -1.64 0.00 0.00 178.16 178.43 1t2a n LEU 232 N -4.54 0.07 -0.75 2.82 4.77 -0.39 -4.87 117.00 114.10 1t2a n LEU 232 Ca 0.11 -0.02 -0.09 0.00 -0.03 0.00 0.00 56.01 55.97 1t2a n LEU 232 Cb 0.09 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 1t2a n LEU 232 CO 0.34 0.01 -0.09 0.61 -1.33 0.00 0.00 177.39 176.93 1t2a n GLY 233 N 0.93 0.86 0.76 -0.72 0.00 0.12 -4.89 105.19 102.25 1t2a n GLY 233 Ca 0.20 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.73 1t2a n GLY 233 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1t2a n GLN 234 N -2.57 1.90 -3.54 1.61 6.02 0.49 -4.94 117.38 116.34 1t2a n GLN 234 Ca -0.09 -1.54 -0.17 0.00 -0.01 0.00 0.00 57.00 55.19 1t2a n GLN 234 Cb 0.35 -1.47 -0.06 0.00 1.02 0.00 0.00 30.24 30.08 1t2a n GLN 234 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1t2a s LEU 235 N -2.16 -0.65 -0.19 1.08 2.96 -1.00 -4.89 118.68 113.82 1t2a s LEU 235 Ca 0.26 0.81 0.02 0.00 -0.22 0.00 0.00 54.13 54.99 1t2a s LEU 235 Cb 0.19 2.48 -0.13 0.00 0.50 0.00 0.00 46.19 49.24 1t2a s LEU 235 CO 0.39 -0.53 -0.17 -0.62 -1.32 0.00 0.00 176.35 174.10 1t2a n GLU 236 N 1.17 0.49 -3.74 1.98 -0.58 -1.26 -3.72 120.64 114.98 1t2a n GLU 236 Ca -0.18 0.11 -0.13 0.00 -0.42 0.00 0.00 57.16 56.54 1t2a n GLU 236 Cb 0.57 -1.38 -0.08 0.00 -0.57 0.00 0.00 31.44 29.98 1t2a n GLU 236 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1t2a s PHE 238 N -1.83 0.47 0.05 0.00 -0.12 -0.83 -5.02 117.98 110.70 1t2a s PHE 238 Ca -0.10 -0.99 0.07 0.00 -0.05 0.00 0.00 56.93 55.87 1t2a s PHE 238 Cb -0.03 -0.35 -0.03 0.00 -0.63 0.00 0.00 43.02 41.98 1t2a s PHE 238 CO 0.01 -0.38 -0.19 -1.54 -0.05 0.00 0.00 175.22 173.07 1t2a s SER 239 N -2.82 3.76 0.53 1.98 1.04 -1.26 -1.44 113.70 115.49 1t2a s SER 239 Ca 0.05 -0.45 0.02 0.00 0.48 0.00 0.00 55.95 56.05 1t2a s SER 239 Cb 0.07 -0.58 0.02 0.00 0.10 0.00 0.00 66.02 65.63 1t2a s SER 239 CO -0.09 0.25 0.19 0.18 0.98 0.00 0.00 173.24 174.74 1t2a n LEU 240 N 1.49 0.00 0.00 2.42 4.77 0.54 -4.91 117.00 121.31 1t2a n LEU 240 Ca -0.16 -3.08 0.00 0.00 -0.03 0.00 0.00 56.01 52.74 1t2a n LEU 240 Cb 0.52 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 1t2a n LEU 240 CO 0.26 -0.52 0.00 0.61 -1.33 0.00 0.00 177.39 176.42 1t2a n GLY 241 N -1.40 0.68 3.59 -0.72 0.00 -1.26 -1.35 105.19 104.74 1t2a n GLY 241 Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 1t2a n GLY 241 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1t2a s ASN 242 N -0.32 6.47 0.43 1.61 2.47 -1.26 -4.72 114.94 119.62 1t2a s ASN 242 Ca 0.00 0.42 0.24 0.00 0.42 0.00 0.00 52.86 53.94 1t2a s ASN 242 Cb 0.00 -2.55 0.79 0.00 -1.45 0.00 0.00 41.25 38.04 1t2a s ASN 242 CO 0.00 -1.40 1.77 -0.07 -3.72 0.00 0.00 177.10 173.68 1t2a h LEU 243 N 11.81 0.00 -0.01 3.21 3.38 -1.96 -3.27 115.31 128.47 1t2a h LEU 243 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1t2a h LEU 243 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1t2a h LEU 243 CO 1.14 0.21 -0.11 0.47 0.09 0.00 0.00 178.44 180.25 1t2a n ASP 244 N -3.30 0.12 -4.77 -0.43 8.00 -1.26 -1.78 116.55 113.13 1t2a n ASP 244 Ca 0.01 0.26 -0.40 0.00 0.71 0.00 0.00 54.79 55.36 1t2a n ASP 244 Cb 0.47 -0.32 0.00 0.00 -0.02 0.00 0.00 41.12 41.26 1t2a n ASP 244 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1t2a s ALA 245 N -2.95 3.44 -0.08 2.24 0.00 -1.23 -4.75 121.76 118.42 1t2a s ALA 245 Ca 0.15 1.50 0.02 0.00 0.00 0.00 0.00 51.96 53.63 1t2a s ALA 245 Cb 0.19 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 1t2a s ALA 245 CO 0.56 -1.07 -0.15 0.15 0.00 0.00 0.00 175.76 175.25 1t2a s LYS 246 N -2.21 2.86 0.10 0.00 1.02 -0.49 -1.07 119.74 119.96 1t2a s LYS 246 Ca 0.56 -0.71 0.04 0.00 0.02 0.00 0.00 55.97 55.87 1t2a s LYS 246 Cb -0.45 -2.46 -0.04 0.00 -0.52 0.00 0.00 37.83 34.36 1t2a s LYS 246 CO 0.59 0.44 -0.10 1.03 -0.92 0.00 0.00 175.35 176.39 1t2a s ARG 247 N -0.25 0.88 -0.42 1.68 1.81 0.12 -2.14 118.95 120.63 1t2a s ARG 247 Ca 0.01 -1.21 -0.15 0.00 -1.72 0.00 0.00 55.73 52.67 1t2a s ARG 247 Cb -0.13 -0.54 0.03 0.00 -0.45 0.00 0.00 34.95 33.86 1t2a s ARG 247 CO 0.03 0.08 0.31 0.34 -0.68 0.00 0.00 175.30 175.38 1t2a s ASP 248 N -2.56 6.07 -0.18 0.23 3.68 -1.15 -1.76 116.67 120.99 1t2a s ASP 248 Ca 0.07 -1.01 -0.03 0.00 2.13 0.00 0.00 52.55 53.72 1t2a s ASP 248 Cb -0.02 -2.15 -0.01 0.00 -1.45 0.00 0.00 42.92 39.29 1t2a s ASP 248 CO -0.00 -0.49 -0.06 0.26 0.13 0.00 0.00 175.17 175.01 1t2a s TRP 249 N 1.66 2.94 0.25 -5.34 0.51 -1.26 -3.21 118.94 114.48 1t2a s TRP 249 Ca 0.04 -0.70 0.01 0.00 -2.12 0.00 0.00 56.10 53.33 1t2a s TRP 249 Cb -0.20 -2.00 -0.00 0.00 -0.81 0.00 0.00 33.47 30.45 1t2a s TRP 249 CO 0.09 -0.33 0.03 0.41 -0.51 0.00 0.00 176.95 176.64 1t2a n GLY 250 N 4.16 3.77 3.60 0.98 0.00 -0.61 -4.62 105.19 112.46 1t2a n GLY 250 Ca -0.18 -2.18 -0.35 0.00 0.00 0.00 0.00 46.02 43.32 1t2a n GLY 250 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1t2a s HIS 251 N -2.14 3.20 0.47 1.61 2.46 -1.26 -0.66 115.29 118.97 1t2a s HIS 251 Ca 0.05 -0.02 0.19 0.00 0.47 0.00 0.00 55.06 55.74 1t2a s HIS 251 Cb 0.00 -2.07 1.19 0.00 -0.13 0.00 0.00 32.58 31.56 1t2a s HIS 251 CO 0.03 0.08 1.96 0.00 -2.47 0.00 0.00 174.74 174.35 1t2a h ALA 252 N 6.82 2.25 -0.37 1.58 0.00 -1.14 -1.65 119.26 126.75 1t2a h ALA 252 Ca -0.36 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.44 1t2a h ALA 252 Cb 1.17 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1t2a h ALA 252 CO 0.68 -0.41 -0.18 -0.22 0.00 0.00 0.00 179.25 179.12 1t2a h LYS 253 N 0.25 0.69 -0.39 0.00 3.64 -1.94 -2.13 116.57 116.68 1t2a h LYS 253 Ca 0.30 -0.25 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 1t2a h LYS 253 Cb 0.84 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.61 1t2a h LYS 253 CO -0.06 0.82 -0.24 -0.44 -2.27 0.00 0.00 179.45 177.26 1t2a h ASP 254 N 0.61 0.88 0.30 4.20 3.45 -1.72 -3.31 116.42 120.84 1t2a h ASP 254 Ca 0.10 -0.42 -0.07 0.00 0.43 0.00 0.00 57.03 57.06 1t2a h ASP 254 Cb 0.65 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 39.16 1t2a h ASP 254 CO 0.05 1.12 -0.33 1.88 -1.57 0.00 0.00 179.24 180.38 1t2a h TYR 255 N 0.66 0.06 0.00 4.55 -1.99 -1.08 -2.66 116.97 116.50 1t2a h TYR 255 Ca 0.08 -0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.74 1t2a h TYR 255 Cb 0.80 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.51 1t2a h TYR 255 CO 0.06 0.37 -0.28 -0.39 -0.00 0.00 0.00 178.16 177.93 1t2a h VAL 256 N 0.05 1.03 -0.83 -2.88 -1.51 -1.48 -1.47 116.25 109.16 1t2a h VAL 256 Ca 0.00 -1.00 -0.03 0.00 -1.23 0.00 0.00 66.70 64.44 1t2a h VAL 256 Cb 0.60 1.57 -0.04 0.00 -2.13 0.00 0.00 31.29 31.29 1t2a h VAL 256 CO 0.04 0.27 0.39 -0.08 -1.23 0.00 0.00 177.57 176.96 1t2a h GLU 257 N 0.00 1.20 -0.21 5.19 4.81 -1.59 -1.93 114.58 122.04 1t2a h GLU 257 Ca -0.00 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 58.99 1t2a h GLU 257 Cb 0.55 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1t2a h GLU 257 CO 0.04 0.92 -0.12 0.00 -0.73 0.00 0.00 179.01 179.12 1t2a h ALA 258 N 1.24 1.42 -0.21 2.92 0.00 -1.28 -1.27 119.26 122.09 1t2a h ALA 258 Ca 0.28 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1t2a h ALA 258 Cb 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1t2a h ALA 258 CO -0.03 0.40 0.08 0.52 0.00 0.00 0.00 179.25 180.22 1t2a h MET 259 N 0.32 0.18 -0.67 0.00 2.86 -1.05 -1.16 114.93 115.41 1t2a h MET 259 Ca 0.06 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.67 1t2a h MET 259 Cb 0.40 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.99 1t2a h MET 259 CO 0.02 0.12 0.33 2.35 1.06 0.00 0.00 176.91 180.80 1t2a h TRP 260 N 0.19 0.95 -0.95 -0.22 7.01 -1.17 -2.66 115.95 119.10 1t2a h TRP 260 Ca 0.09 -0.04 0.01 0.00 2.11 0.00 0.00 58.89 61.06 1t2a h TRP 260 Cb 0.04 -0.30 -0.05 0.00 -2.10 0.00 0.00 29.16 26.76 1t2a h TRP 260 CO -0.11 0.70 0.63 -0.07 -2.79 0.00 0.00 178.44 176.80 1t2a h LEU 261 N 0.92 1.08 -1.23 0.65 3.38 -0.86 -1.09 115.31 118.16 1t2a h LEU 261 Ca 0.23 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1t2a h LEU 261 Cb 0.10 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1t2a h LEU 261 CO -0.03 0.78 0.37 0.24 0.09 0.00 0.00 178.44 179.89 1t2a h MET 262 N 1.28 0.90 0.00 1.13 2.86 -0.89 -0.73 114.93 119.48 1t2a h MET 262 Ca 0.35 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.90 1t2a h MET 262 Cb -0.13 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.34 1t2a h MET 262 CO -0.08 0.65 0.00 1.28 1.06 0.00 0.00 176.91 179.82 1t2a n LEU 263 N -4.38 0.00 0.00 1.22 4.32 -0.47 -2.81 117.00 114.88 1t2a n LEU 263 Ca 0.06 0.33 0.11 0.00 -0.02 0.00 0.00 56.01 56.50 1t2a n LEU 263 Cb 0.09 -0.33 -0.08 0.00 -1.62 0.00 0.00 43.42 41.48 1t2a n LEU 263 CO 0.37 -0.07 -0.16 0.00 -1.22 0.00 0.00 177.39 176.30 1t2a n GLN 264 N -1.33 0.21 -1.93 3.23 1.13 -0.35 -4.97 117.38 113.36 1t2a n GLN 264 Ca 0.10 -0.04 -0.36 0.00 -1.94 0.00 0.00 57.00 54.75 1t2a n GLN 264 Cb 0.21 -1.52 0.04 0.00 0.11 0.00 0.00 30.24 29.07 1t2a n GLN 264 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1t2a s ASN 265 N -3.53 5.03 0.24 1.08 3.04 -0.80 -4.92 114.94 115.08 1t2a s ASN 265 Ca 0.04 2.42 -0.06 0.00 0.04 0.00 0.00 52.86 55.29 1t2a s ASN 265 Cb 0.15 -2.60 0.25 0.00 -1.54 0.00 0.00 41.25 37.51 1t2a s ASN 265 CO 0.85 -1.70 1.85 0.44 -3.04 0.00 0.00 177.10 175.50 1t2a h ASP 266 N 0.74 1.07 -3.63 -4.21 3.32 -1.93 -3.43 116.42 108.36 1t2a h ASP 266 Ca -0.50 -0.11 -0.67 0.00 0.02 0.00 0.00 57.03 55.76 1t2a h ASP 266 Cb 1.30 -0.27 -0.19 0.00 0.22 0.00 0.00 39.33 40.39 1t2a h ASP 266 CO 0.54 0.89 -0.82 -1.61 -1.72 0.00 0.00 179.24 176.52 1t2a s GLU 267 N -5.71 1.64 -0.40 3.56 0.41 -1.26 -5.09 118.70 111.84 1t2a s GLU 267 Ca -0.12 -1.30 -0.29 0.00 -0.41 0.00 0.00 54.97 52.85 1t2a s GLU 267 Cb 0.17 -2.00 0.02 0.00 -1.78 0.00 0.00 34.13 30.54 1t2a s GLU 267 CO 0.83 0.45 1.09 -1.25 -0.49 0.00 0.00 175.26 175.89 1t2a s PRO 268 N -2.27 3.88 0.17 0.39 0.04 -1.26 -5.01 135.00 130.94 1t2a s PRO 268 Ca 0.18 0.78 0.06 0.00 0.04 0.00 0.00 61.00 62.06 1t2a s PRO 268 Cb -0.10 -3.83 -0.05 0.00 0.04 0.00 0.00 34.50 30.57 1t2a s PRO 268 CO 0.09 -1.14 -0.12 -1.21 0.04 0.00 0.00 177.00 174.66 1t2a s GLU 269 N 4.03 1.17 0.10 4.56 2.02 -1.26 -4.91 118.70 124.41 1t2a s GLU 269 Ca 0.46 -1.50 -0.11 0.00 0.02 0.00 0.00 54.97 53.84 1t2a s GLU 269 Cb -0.10 -0.83 -0.06 0.00 0.10 0.00 0.00 34.13 33.24 1t2a s GLU 269 CO 0.24 0.12 0.45 -0.51 0.02 0.00 0.00 175.26 175.57 1t2a s ASP 270 N -3.21 6.69 -0.06 -0.19 1.01 -1.26 -4.36 116.67 115.29 1t2a s ASP 270 Ca 0.19 0.87 -0.04 0.00 0.71 0.00 0.00 52.55 54.27 1t2a s ASP 270 Cb 0.01 -2.21 0.02 0.00 1.01 0.00 0.00 42.92 41.75 1t2a s ASP 270 CO 0.03 0.14 0.14 -0.36 0.21 0.00 0.00 175.17 175.34 1t2a s PHE 271 N -1.43 -0.16 0.20 4.23 0.40 -0.73 -4.97 117.98 115.52 1t2a s PHE 271 Ca 0.35 0.41 -0.28 0.00 -0.60 0.00 0.00 56.93 56.80 1t2a s PHE 271 Cb -0.14 0.02 -0.08 0.00 0.51 0.00 0.00 43.02 43.32 1t2a s PHE 271 CO 0.19 -0.10 0.88 0.08 0.70 0.00 0.00 175.22 176.97 1t2a s VAL 272 N 0.38 4.22 -0.09 -0.44 1.01 -1.26 0.46 120.40 124.68 1t2a s VAL 272 Ca -0.03 1.95 0.00 0.00 0.00 0.00 0.00 61.98 63.90 1t2a s VAL 272 Cb -0.04 -4.26 0.02 0.00 0.00 0.00 0.00 36.38 32.10 1t2a s VAL 272 CO -0.02 0.49 -0.08 -0.63 0.00 0.00 0.00 175.10 174.87 1t2a s ILE 273 N -1.05 0.95 0.16 2.22 -1.09 -0.71 -4.51 121.20 117.17 1t2a s ILE 273 Ca 0.40 -0.28 -0.25 0.00 -2.23 0.00 0.00 60.65 58.29 1t2a s ILE 273 Cb -0.25 -0.96 0.07 0.00 -1.58 0.00 0.00 42.46 39.74 1t2a s ILE 273 CO 0.30 0.34 0.98 0.00 -1.23 0.00 0.00 174.94 175.33 1t2a s ALA 274 N 1.44 -1.65 -0.11 9.38 0.00 -1.26 -1.41 121.76 128.15 1t2a s ALA 274 Ca -0.01 0.05 0.15 0.00 0.00 0.00 0.00 51.96 52.15 1t2a s ALA 274 Cb -0.13 0.65 -0.24 0.00 0.00 0.00 0.00 23.12 23.40 1t2a s ALA 274 CO -0.05 -1.05 0.43 0.25 0.00 0.00 0.00 175.76 175.34 1t2a n THR 275 N -0.51 1.51 -0.39 0.00 -2.24 -1.26 -4.69 114.28 106.70 1t2a n THR 275 Ca -0.06 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.90 1t2a n THR 275 Cb 0.61 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1t2a n THR 275 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t2a n GLY 276 N 1.63 1.00 3.55 3.38 0.00 -1.22 -5.00 105.19 108.53 1t2a n GLY 276 Ca -0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1t2a n GLY 276 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1t2a s GLU 277 N -0.46 2.65 -0.00 1.61 0.41 -1.26 -4.82 118.70 116.83 1t2a s GLU 277 Ca 0.00 -0.61 0.06 0.00 -0.41 0.00 0.00 54.97 54.01 1t2a s GLU 277 Cb 0.00 -2.52 -0.03 0.00 -1.78 0.00 0.00 34.13 29.81 1t2a s GLU 277 CO 0.00 0.65 -0.19 0.08 -0.49 0.00 0.00 175.26 175.31 1t2a s VAL 278 N -0.81 2.70 0.04 2.63 1.01 -1.26 -4.05 120.40 120.65 1t2a s VAL 278 Ca 0.13 -1.01 -0.05 0.00 0.00 0.00 0.00 61.98 61.04 1t2a s VAL 278 Cb -0.11 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 1t2a s VAL 278 CO 0.02 0.48 0.09 -1.00 0.00 0.00 0.00 175.10 174.68 1t2a s HIS 279 N -0.78 0.21 0.50 5.22 3.76 -0.72 -4.96 115.29 118.51 1t2a s HIS 279 Ca 0.12 -0.52 0.01 0.00 -0.15 0.00 0.00 55.06 54.53 1t2a s HIS 279 Cb -0.10 -0.15 0.02 0.00 1.11 0.00 0.00 32.58 33.45 1t2a s HIS 279 CO 0.02 -0.35 0.72 -1.54 -0.85 0.00 0.00 174.74 172.74 1t2a s SER 280 N -2.10 5.51 0.21 1.40 1.04 -1.26 -0.70 113.70 117.80 1t2a s SER 280 Ca -0.05 0.06 -0.09 0.00 0.48 0.00 0.00 55.95 56.34 1t2a s SER 280 Cb -0.01 -1.10 0.17 0.00 0.10 0.00 0.00 66.02 65.18 1t2a s SER 280 CO -0.04 -0.95 1.87 0.58 0.98 0.00 0.00 173.24 175.68 1t2a h VAL 281 N 0.24 1.22 -0.28 5.02 2.07 -1.04 -1.66 116.25 121.82 1t2a h VAL 281 Ca -0.43 -0.44 0.06 0.00 0.82 0.00 0.00 66.70 66.70 1t2a h VAL 281 Cb 1.28 0.09 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 1t2a h VAL 281 CO 0.54 0.22 -0.11 -0.09 0.02 0.00 0.00 177.57 178.15 1t2a h ARG 282 N 1.08 -0.06 -0.06 1.57 2.43 -1.62 0.34 114.38 118.06 1t2a h ARG 282 Ca 0.29 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.43 1t2a h ARG 282 Cb -0.07 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1t2a h ARG 282 CO -0.06 -0.04 -0.10 0.93 -1.51 0.00 0.00 179.97 179.20 1t2a h GLU 283 N -0.06 0.09 -0.46 0.20 5.08 -1.75 0.11 114.58 117.80 1t2a h GLU 283 Ca 0.14 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.35 1t2a h GLU 283 Cb 0.27 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1t2a h GLU 283 CO -0.32 0.20 -0.25 0.35 -1.00 0.00 0.00 179.01 177.99 1t2a h PHE 284 N 0.09 1.12 -0.49 4.33 3.57 -0.09 -0.49 116.94 124.98 1t2a h PHE 284 Ca 0.02 -0.28 -0.01 0.00 3.53 0.00 0.00 57.97 61.23 1t2a h PHE 284 Cb 0.23 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 1t2a h PHE 284 CO 0.00 1.10 0.28 0.28 -2.23 0.00 0.00 178.31 177.74 1t2a h VAL 285 N 0.83 1.17 0.21 1.41 2.07 0.07 -0.87 116.25 121.13 1t2a h VAL 285 Ca 0.10 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 1t2a h VAL 285 Cb 0.83 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1t2a h VAL 285 CO 0.07 0.17 -0.10 -0.33 0.02 0.00 0.00 177.57 177.41 1t2a h GLU 286 N 0.65 -0.27 -0.89 1.57 5.08 -0.63 -1.95 114.58 118.14 1t2a h GLU 286 Ca 0.17 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.58 1t2a h GLU 286 Cb 0.04 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 1t2a h GLU 286 CO -0.03 -0.05 0.59 0.87 -1.00 0.00 0.00 179.01 179.39 1t2a h LYS 287 N -0.45 1.10 -0.31 2.33 1.57 -1.04 -1.47 116.57 118.30 1t2a h LYS 287 Ca -0.03 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1t2a h LYS 287 Cb 0.34 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1t2a h LYS 287 CO 0.05 0.73 0.16 0.77 -0.57 0.00 0.00 179.45 180.59 1t2a h SER 288 N 1.13 0.40 0.02 0.86 0.02 -0.75 -2.36 113.55 112.88 1t2a h SER 288 Ca 0.35 -0.10 -0.10 0.00 -0.84 0.00 0.00 61.79 61.09 1t2a h SER 288 Cb -0.02 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1t2a h SER 288 CO -0.10 0.39 -0.30 -0.26 -1.14 0.00 0.00 176.83 175.42 1t2a h PHE 289 N 0.38 0.47 -0.74 3.45 -1.00 -1.14 -2.27 116.94 116.09 1t2a h PHE 289 Ca 0.11 -0.11 0.08 0.00 2.81 0.00 0.00 57.97 60.86 1t2a h PHE 289 Cb 0.09 -0.11 -0.05 0.00 3.61 0.00 0.00 35.95 39.49 1t2a h PHE 289 CO -0.02 0.68 0.49 1.25 -1.61 0.00 0.00 178.31 179.09 1t2a h LEU 290 N 0.36 0.65 -0.48 1.54 5.85 -0.85 0.67 115.31 123.05 1t2a h LEU 290 Ca 0.05 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1t2a h LEU 290 Cb 0.71 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1t2a h LEU 290 CO 0.05 0.41 0.00 1.41 -0.34 0.00 0.00 178.44 179.98 1t2a n HIS 291 N -4.49 0.66 -1.27 1.25 8.25 -0.86 -1.50 115.22 117.27 1t2a n HIS 291 Ca 0.11 0.25 -0.01 0.00 -0.26 0.00 0.00 57.72 57.82 1t2a n HIS 291 Cb 0.26 -0.90 0.22 0.00 1.12 0.00 0.00 29.99 30.69 1t2a n HIS 291 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1t2a n ILE 292 N -2.10 2.50 -3.37 1.59 -5.35 0.04 -4.96 119.36 107.71 1t2a n ILE 292 Ca 0.03 -2.38 -0.19 0.00 -0.27 0.00 0.00 62.75 59.94 1t2a n ILE 292 Cb 0.25 -0.31 0.06 0.00 -1.74 0.00 0.00 39.64 37.90 1t2a n ILE 292 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1t2a n GLY 293 N -0.91 -0.24 3.00 3.28 0.00 -0.56 -5.03 105.19 104.74 1t2a n GLY 293 Ca 0.31 0.06 -0.15 0.00 0.00 0.00 0.00 46.02 46.24 1t2a n GLY 293 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t2a s LYS 294 N -6.02 0.50 -0.21 1.61 1.02 -0.12 -4.99 119.74 111.53 1t2a s LYS 294 Ca 0.46 -0.40 -0.03 0.00 0.02 0.00 0.00 55.97 56.01 1t2a s LYS 294 Cb -0.20 -0.42 -0.01 0.00 -0.52 0.00 0.00 37.83 36.68 1t2a s LYS 294 CO 0.58 0.10 -0.05 0.99 -0.92 0.00 0.00 175.35 176.05 1t2a s THR 295 N -0.56 3.33 0.01 2.17 2.01 -1.26 -2.33 115.64 119.02 1t2a s THR 295 Ca -0.02 -0.51 -0.16 0.00 0.31 0.00 0.00 61.69 61.31 1t2a s THR 295 Cb -0.05 -2.50 -0.06 0.00 0.01 0.00 0.00 72.50 69.90 1t2a s THR 295 CO 0.00 0.44 0.44 -0.63 -0.69 0.00 0.00 174.62 174.18 1t2a s ILE 296 N 1.32 4.98 -0.07 1.82 1.09 -1.26 -0.53 121.20 128.54 1t2a s ILE 296 Ca 0.04 0.91 0.04 0.00 -1.10 0.00 0.00 60.65 60.54 1t2a s ILE 296 Cb -0.14 -3.75 0.00 0.00 -1.06 0.00 0.00 42.46 37.51 1t2a s ILE 296 CO -0.02 0.56 -0.19 -0.69 -0.10 0.00 0.00 174.94 174.50 1t2a s VAL 297 N -0.99 1.65 0.07 2.92 1.01 -0.71 -4.90 120.40 119.45 1t2a s VAL 297 Ca 0.25 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.36 1t2a s VAL 297 Cb -0.17 -1.44 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 1t2a s VAL 297 CO 0.14 0.47 0.35 0.26 0.00 0.00 0.00 175.10 176.32 1t2a s TRP 298 N 0.34 3.56 0.00 5.22 0.52 -1.26 -2.33 118.94 125.00 1t2a s TRP 298 Ca -0.13 0.67 -0.05 0.00 0.02 0.00 0.00 56.10 56.60 1t2a s TRP 298 Cb -0.16 -2.07 -0.00 0.00 -1.15 0.00 0.00 33.47 30.09 1t2a s TRP 298 CO 0.06 0.53 0.09 -1.21 0.02 0.00 0.00 176.95 176.44 1t2a s GLU 299 N -2.03 0.40 0.00 4.98 2.02 -0.76 -4.97 118.70 118.34 1t2a s GLU 299 Ca 0.33 -0.39 0.00 0.00 0.02 0.00 0.00 54.97 54.93 1t2a s GLU 299 Cb -0.13 0.16 0.00 0.00 0.10 0.00 0.00 34.13 34.26 1t2a s GLU 299 CO 0.19 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 175.79 1t2a n GLY 300 N 1.67 -0.73 3.16 -1.39 0.00 -1.26 0.33 105.19 106.97 1t2a n GLY 300 Ca -0.22 -1.72 -0.09 0.00 0.00 0.00 0.00 46.02 43.99 1t2a n GLY 300 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t2a s LYS 301 N -1.27 0.92 3.90 1.61 -0.14 -1.26 -4.40 119.74 119.10 1t2a s LYS 301 Ca 0.00 -1.39 0.00 0.00 -1.36 0.00 0.00 55.97 53.22 1t2a s LYS 301 Cb 0.00 0.25 0.00 0.00 -1.68 0.00 0.00 37.83 36.40 1t2a s LYS 301 CO 0.00 -0.26 0.00 0.09 -0.76 0.00 0.00 175.35 174.42 1t2a n ASN 302 N -0.09 0.00 0.00 2.83 3.02 -1.26 0.31 115.26 120.08 1t2a n ASN 302 Ca -0.06 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 54.64 1t2a n ASN 302 Cb 0.63 0.00 0.93 0.00 -0.61 0.00 0.00 39.78 40.73 1t2a n ASN 302 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1t2a n GLU 303 N 14.00 0.99 -0.00 3.52 0.00 -1.26 -2.48 120.64 135.40 1t2a n GLU 303 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.27 1t2a n GLU 303 Cb 0.00 -1.49 -0.14 0.00 0.00 0.00 0.00 31.44 29.80 1t2a n GLU 303 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1t2a n ASN 304 N -0.99 0.24 -4.75 -1.84 5.03 0.15 -4.41 115.26 108.68 1t2a n ASN 304 Ca 0.23 -0.16 -0.40 0.00 0.87 0.00 0.00 54.58 55.12 1t2a n ASN 304 Cb 0.11 1.70 0.02 0.00 -1.02 0.00 0.00 39.78 40.59 1t2a n ASN 304 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 1t2a n GLU 305 N -2.14 2.18 -4.12 3.52 2.13 -0.57 -4.45 120.64 117.19 1t2a n GLU 305 Ca -0.02 0.77 -0.12 0.00 0.66 0.00 0.00 57.16 58.45 1t2a n GLU 305 Cb 0.52 -2.56 -0.11 0.00 0.27 0.00 0.00 31.44 29.56 1t2a n GLU 305 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1t2a s VAL 306 N -1.19 0.65 -0.18 6.31 -7.23 0.15 -3.77 120.40 115.13 1t2a s VAL 306 Ca 0.61 -1.47 0.00 0.00 -1.81 0.00 0.00 61.98 59.31 1t2a s VAL 306 Cb -0.47 -1.11 0.01 0.00 0.56 0.00 0.00 36.38 35.38 1t2a s VAL 306 CO 0.58 -0.59 -0.17 -0.83 -0.31 0.00 0.00 175.10 173.78 1t2a s GLY 307 N -2.23 1.43 0.10 2.32 0.00 0.33 -1.83 107.32 107.44 1t2a s GLY 307 Ca 0.00 -1.19 0.06 0.00 0.00 0.00 0.00 44.72 43.59 1t2a s GLY 307 CO -0.02 0.27 -0.15 1.09 0.00 0.00 0.00 173.10 174.29 1t2a s ARG 308 N 1.25 0.94 -0.03 2.90 1.70 -0.98 0.15 118.95 124.88 1t2a s ARG 308 Ca 0.04 -1.10 -0.30 0.00 -0.47 0.00 0.00 55.73 53.90 1t2a s ARG 308 Cb -0.14 -0.93 -0.07 0.00 -0.57 0.00 0.00 34.95 33.25 1t2a s ARG 308 CO -0.10 0.20 1.83 0.00 -1.08 0.00 0.00 175.30 176.15 1t2a h LYS 310 N 10.47 0.00 0.05 0.00 3.64 -1.16 1.43 116.57 131.01 1t2a h LYS 310 Ca -0.44 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 58.59 1t2a h LYS 310 Cb 1.21 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.99 1t2a h LYS 310 CO 0.95 0.00 -2.03 -1.91 -2.27 0.00 0.00 179.45 174.19 1t2a n GLU 311 N -3.03 0.67 -0.00 1.90 0.00 -1.26 -4.55 120.64 114.37 1t2a n GLU 311 Ca -0.03 0.30 0.08 0.00 0.00 0.00 0.00 57.16 57.52 1t2a n GLU 311 Cb 0.09 -1.64 -0.10 0.00 0.00 0.00 0.00 31.44 29.78 1t2a n GLU 311 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1t2a n THR 312 N -3.73 0.00 -1.08 6.31 -2.24 -1.12 -4.99 114.28 107.44 1t2a n THR 312 Ca -0.38 -0.10 -0.03 0.00 -2.27 0.00 0.00 64.05 61.27 1t2a n THR 312 Cb 0.94 0.95 -0.01 0.00 -2.10 0.00 0.00 70.33 70.10 1t2a n THR 312 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t2a n GLY 313 N 1.42 0.46 3.76 3.38 0.00 0.49 -4.96 105.19 109.73 1t2a n GLY 313 Ca 0.03 -0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 1t2a n GLY 313 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t2a s LYS 314 N -1.57 4.75 -0.16 1.61 1.02 -1.24 -4.62 119.74 119.52 1t2a s LYS 314 Ca 0.00 1.36 -0.29 0.00 0.02 0.00 0.00 55.97 57.06 1t2a s LYS 314 Cb 0.00 -3.27 -0.01 0.00 -0.52 0.00 0.00 37.83 34.03 1t2a s LYS 314 CO 0.00 0.54 1.24 0.08 -0.92 0.00 0.00 175.35 176.29 1t2a s VAL 315 N -1.17 4.30 -0.01 3.17 1.01 -1.26 -0.00 120.40 126.44 1t2a s VAL 315 Ca 0.39 1.58 0.05 0.00 0.00 0.00 0.00 61.98 63.99 1t2a s VAL 315 Cb -0.25 -4.02 -0.07 0.00 0.00 0.00 0.00 36.38 32.04 1t2a s VAL 315 CO 0.30 -0.12 0.10 1.41 0.00 0.00 0.00 175.10 176.78 1t2a n HIS 316 N 6.44 0.00 -3.94 5.22 8.25 0.40 -4.55 115.22 127.03 1t2a n HIS 316 Ca 0.13 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.38 1t2a n HIS 316 Cb 0.45 -0.10 -0.17 0.00 1.12 0.00 0.00 29.99 31.29 1t2a n HIS 316 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1t2a s VAL 317 N -2.31 0.49 0.40 1.59 1.01 -0.35 -1.97 120.40 119.27 1t2a s VAL 317 Ca -0.02 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.00 1t2a s VAL 317 Cb 0.03 -0.58 -0.06 0.00 0.00 0.00 0.00 36.38 35.77 1t2a s VAL 317 CO 0.19 0.25 0.04 0.42 0.00 0.00 0.00 175.10 176.00 1t2a s THR 318 N 1.51 1.46 0.09 3.92 -4.23 -0.52 0.12 115.64 117.99 1t2a s THR 318 Ca -0.02 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.59 1t2a s THR 318 Cb -0.13 -2.72 -0.04 0.00 1.34 0.00 0.00 72.50 70.96 1t2a s THR 318 CO -0.03 0.00 -0.23 -0.69 -0.54 0.00 0.00 174.62 173.13 1t2a s VAL 319 N -2.97 2.47 -0.08 2.29 1.01 -1.25 -0.34 120.40 121.53 1t2a s VAL 319 Ca 0.29 -1.52 -0.03 0.00 0.00 0.00 0.00 61.98 60.72 1t2a s VAL 319 Cb 0.07 -2.07 0.04 0.00 0.00 0.00 0.00 36.38 34.43 1t2a s VAL 319 CO 0.14 0.20 0.16 -0.62 0.00 0.00 0.00 175.10 174.97 1t2a s ASP 320 N -1.79 0.32 0.53 3.32 3.68 -0.46 -4.86 116.67 117.42 1t2a s ASP 320 Ca 0.15 0.32 0.23 0.00 2.13 0.00 0.00 52.55 55.38 1t2a s ASP 320 Cb -0.10 0.24 1.38 0.00 -1.45 0.00 0.00 42.92 42.99 1t2a s ASP 320 CO 0.06 -0.20 2.06 -0.07 0.13 0.00 0.00 175.17 177.15 1t2a h LEU 321 N 7.81 0.00 -1.90 -1.34 3.38 -1.93 -2.00 115.31 119.34 1t2a h LEU 321 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1t2a h LEU 321 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1t2a h LEU 321 CO 0.28 0.00 0.30 0.07 0.09 0.00 0.00 178.44 179.18 1t2a h LYS 322 N 0.00 0.00 -0.01 1.13 2.10 -1.96 0.17 116.57 118.01 1t2a h LYS 322 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 1t2a h LYS 322 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 1t2a h LYS 322 CO -0.00 0.00 -0.42 0.66 -2.00 0.00 0.00 179.45 177.69 1t2a n TYR 323 N -2.78 0.00 -1.54 0.07 4.02 -0.75 -4.93 117.16 111.25 1t2a n TYR 323 Ca -0.02 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.57 1t2a n TYR 323 Cb 0.35 -0.14 0.09 0.00 -0.02 0.00 0.00 39.34 39.62 1t2a n TYR 323 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1t2a s TYR 324 N -2.69 2.84 -0.02 -0.72 1.51 0.61 -4.62 117.35 114.26 1t2a s TYR 324 Ca 0.18 1.19 0.04 0.00 -1.01 0.00 0.00 57.07 57.47 1t2a s TYR 324 Cb 0.18 -3.10 -0.03 0.00 -0.11 0.00 0.00 41.96 38.91 1t2a s TYR 324 CO 0.61 -1.73 -0.12 1.03 -1.11 0.00 0.00 175.55 174.23 1t2a s ARG 325 N -5.14 2.47 0.33 -0.62 3.00 -1.26 -5.02 118.95 112.71 1t2a s ARG 325 Ca 0.61 -0.74 0.08 0.00 0.00 0.00 0.00 55.73 55.68 1t2a s ARG 325 Cb -0.14 -2.41 0.80 0.00 0.00 0.00 0.00 34.95 33.19 1t2a s ARG 325 CO 0.54 0.61 1.81 -1.35 0.00 0.00 0.00 175.30 176.91 1t2a h PRO 326 N 4.91 0.69 -3.39 3.54 0.11 -1.97 -3.27 132.00 132.62 1t2a h PRO 326 Ca -0.48 -0.04 -0.59 0.00 0.11 0.00 0.00 66.00 65.00 1t2a h PRO 326 Cb 1.16 -0.16 -0.40 0.00 0.11 0.00 0.00 31.00 31.71 1t2a h PRO 326 CO 0.51 0.46 -0.75 -0.08 -0.21 0.00 0.00 178.00 177.93 1t2a s THR 327 N -5.75 1.02 0.59 -1.15 -1.32 -1.26 -5.11 115.64 102.65 1t2a s THR 327 Ca -0.10 -1.74 -0.14 0.00 -1.21 0.00 0.00 61.69 58.49 1t2a s THR 327 Cb 0.24 -1.75 -0.04 0.00 -1.51 0.00 0.00 72.50 69.43 1t2a s THR 327 CO 0.80 -0.75 1.03 -0.70 -2.21 0.00 0.00 174.62 172.79 1t2a s GLU 328 N 1.24 3.51 -0.64 7.08 2.56 -1.24 -4.78 118.70 126.44 1t2a s GLU 328 Ca 0.12 1.00 -0.06 0.00 0.00 0.00 0.00 54.97 56.04 1t2a s GLU 328 Cb -0.19 -2.07 0.17 0.00 2.00 0.00 0.00 34.13 34.03 1t2a s GLU 328 CO -0.17 -0.64 0.48 0.08 -0.56 0.00 0.00 175.26 174.46 1t2a s VAL 329 N -2.73 4.10 0.46 3.70 1.01 -1.26 -4.83 120.40 120.84 1t2a s VAL 329 Ca 0.60 -2.72 0.11 0.00 0.00 0.00 0.00 61.98 59.98 1t2a s VAL 329 Cb -0.13 -3.65 0.25 0.00 0.00 0.00 0.00 36.38 32.86 1t2a s VAL 329 CO 0.41 -0.89 2.08 0.44 0.00 0.00 0.00 175.10 177.14 1t2a h ASP 330 N 7.35 0.22 -3.40 3.32 3.45 -1.92 -3.44 116.42 122.00 1t2a h ASP 330 Ca -0.02 -0.01 -0.05 0.00 0.43 0.00 0.00 57.03 57.38 1t2a h ASP 330 Cb 0.98 -0.06 -0.23 0.00 -0.56 0.00 0.00 39.33 39.47 1t2a h ASP 330 CO 0.73 0.19 -0.09 0.12 -1.57 0.00 0.00 179.24 178.63 1t2a s PHE 331 N -5.19 -0.79 -0.01 4.55 5.36 -1.26 -1.39 117.98 119.25 1t2a s PHE 331 Ca -0.06 1.70 0.00 0.00 -0.96 0.00 0.00 56.93 57.61 1t2a s PHE 331 Cb 0.17 0.38 0.01 0.00 -0.34 0.00 0.00 43.02 43.25 1t2a s PHE 331 CO 0.70 -0.40 0.01 -0.51 -1.46 0.00 0.00 175.22 173.56 1t2a s LEU 332 N 1.09 1.55 -0.18 6.12 1.43 -0.91 -4.64 118.68 123.14 1t2a s LEU 332 Ca -0.06 0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 52.99 1t2a s LEU 332 Cb -0.06 -0.07 0.09 0.00 0.03 0.00 0.00 46.19 46.19 1t2a s LEU 332 CO -0.10 -0.06 0.34 -1.58 0.23 0.00 0.00 176.35 175.17 1t2a s GLN 333 N 0.53 0.25 0.10 1.70 0.74 -1.26 -2.94 119.66 118.77 1t2a s GLN 333 Ca -0.05 0.77 -0.00 0.00 0.05 0.00 0.00 55.36 56.14 1t2a s GLN 333 Cb -0.07 -0.07 -0.04 0.00 1.10 0.00 0.00 33.01 33.93 1t2a s GLN 333 CO -0.01 -0.36 0.26 0.20 -0.55 0.00 0.00 175.29 174.82 1t2a s GLY 334 N 2.51 2.09 -0.40 2.59 0.00 -1.26 -0.97 107.32 111.87 1t2a s GLY 334 Ca 0.03 -0.83 -0.03 0.00 0.00 0.00 0.00 44.72 43.88 1t2a s GLY 334 CO -0.12 -0.81 0.18 -0.35 0.00 0.00 0.00 173.10 172.01 1t2a s ASP 335 N -2.67 5.24 -0.36 1.64 3.68 -0.26 -3.42 116.67 120.52 1t2a s ASP 335 Ca 0.36 -1.89 0.01 0.00 2.13 0.00 0.00 52.55 53.16 1t2a s ASP 335 Cb -0.12 -1.83 0.41 0.00 -1.45 0.00 0.00 42.92 39.93 1t2a s ASP 335 CO 0.28 -0.51 1.77 0.00 0.13 0.00 0.00 175.17 176.83 1t2a h THR 337 N 0.79 0.92 -0.51 0.00 2.02 -1.94 -1.43 112.91 112.76 1t2a h THR 337 Ca 0.44 -0.31 -0.04 0.00 0.77 0.00 0.00 66.41 67.27 1t2a h THR 337 Cb 1.83 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 68.14 1t2a h THR 337 CO 0.88 0.17 0.18 0.50 0.37 0.00 0.00 175.52 177.61 1t2a h LYS 338 N 0.91 0.78 -0.68 6.66 3.64 -1.91 -0.82 116.57 125.16 1t2a h LYS 338 Ca 0.46 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.63 1t2a h LYS 338 Cb 0.43 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1t2a h LYS 338 CO -0.26 0.71 0.25 0.00 -2.27 0.00 0.00 179.45 177.88 1t2a h ALA 339 N 1.03 1.16 -0.53 5.00 0.00 -1.61 -0.44 119.26 123.86 1t2a h ALA 339 Ca 0.17 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1t2a h ALA 339 Cb 0.24 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1t2a h ALA 339 CO -0.01 0.60 0.25 0.87 0.00 0.00 0.00 179.25 180.96 1t2a h LYS 340 N 0.99 0.78 -0.31 0.00 1.57 -0.92 0.38 116.57 119.06 1t2a h LYS 340 Ca 0.23 -0.12 -0.15 0.00 -1.87 0.00 0.00 60.65 58.73 1t2a h LYS 340 Cb 0.23 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1t2a h LYS 340 CO -0.02 0.65 -0.41 1.96 -0.57 0.00 0.00 179.45 181.06 1t2a h GLN 341 N 0.72 0.76 0.00 3.15 4.20 -0.59 -1.62 115.11 121.73 1t2a h GLN 341 Ca 0.18 -0.41 -0.16 0.00 0.06 0.00 0.00 58.65 58.32 1t2a h GLN 341 Cb 0.14 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.90 1t2a h GLN 341 CO -0.02 1.03 -2.03 1.63 -0.67 0.00 0.00 178.83 178.77 1t2a n LYS 342 N -4.03 0.87 -0.01 1.46 5.02 -0.23 -4.51 118.16 116.73 1t2a n LYS 342 Ca -0.02 -0.09 0.09 0.00 -2.02 0.00 0.00 58.31 56.27 1t2a n LYS 342 Cb 0.54 -1.45 -0.14 0.00 -0.02 0.00 0.00 35.03 33.97 1t2a n LYS 342 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1t2a n LEU 343 N -2.41 0.16 -3.14 -0.35 4.77 0.13 -4.97 117.00 111.19 1t2a n LEU 343 Ca -0.16 -0.09 -0.23 0.00 -0.03 0.00 0.00 56.01 55.50 1t2a n LEU 343 Cb 0.79 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.92 1t2a n LEU 343 CO 0.38 0.04 0.04 -3.20 -1.33 0.00 0.00 177.39 173.33 1t2a n ASN 344 N -2.03 -6.17 -4.95 -1.43 5.15 -0.61 -4.98 115.26 100.24 1t2a n ASN 344 Ca -0.02 -0.34 -0.24 0.00 -0.60 0.00 0.00 54.58 53.37 1t2a n ASN 344 Cb 0.46 -4.96 -0.03 0.00 -0.53 0.00 0.00 39.78 34.73 1t2a n ASN 344 CO 0.00 0.00 0.00 0.86 1.40 0.00 0.00 177.26 179.52 1t2a s TRP 345 N -3.21 3.47 -0.28 1.20 -0.00 -1.20 -4.99 118.94 113.94 1t2a s TRP 345 Ca 0.36 0.07 -0.24 0.00 -0.00 0.00 0.00 56.10 56.29 1t2a s TRP 345 Cb -0.16 -1.63 0.10 0.00 -0.00 0.00 0.00 33.47 31.77 1t2a s TRP 345 CO 0.45 0.49 0.89 -1.59 -0.00 0.00 0.00 176.95 177.18 1t2a s LYS 346 N -3.49 0.65 0.49 5.86 -2.85 -1.26 -4.12 119.74 115.01 1t2a s LYS 346 Ca 0.34 0.79 -0.24 0.00 -1.00 0.00 0.00 55.97 55.87 1t2a s LYS 346 Cb -0.10 0.31 -0.07 0.00 -2.06 0.00 0.00 37.83 35.90 1t2a s LYS 346 CO 0.29 -0.08 1.39 -1.25 0.10 0.00 0.00 175.35 175.79 1t2a s PRO 347 N 0.37 3.49 -0.24 1.78 0.04 -1.26 -4.96 135.00 134.23 1t2a s PRO 347 Ca 0.01 2.32 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1t2a s PRO 347 Cb -0.05 -2.50 -0.15 0.00 0.04 0.00 0.00 34.50 31.84 1t2a s PRO 347 CO -0.04 -0.94 -0.22 0.54 0.04 0.00 0.00 177.00 176.38 1t2a n ARG 348 N -0.50 0.59 -3.38 4.56 1.74 -1.26 -4.94 116.66 113.47 1t2a n ARG 348 Ca 0.07 0.15 -0.38 0.00 -0.77 0.00 0.00 57.85 56.92 1t2a n ARG 348 Cb 0.43 -1.47 -0.06 0.00 -1.02 0.00 0.00 32.46 30.34 1t2a n ARG 348 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1t2a s VAL 349 N -2.47 5.09 0.41 1.55 1.01 -1.26 -5.08 120.40 119.65 1t2a s VAL 349 Ca -0.32 0.93 0.08 0.00 0.00 0.00 0.00 61.98 62.67 1t2a s VAL 349 Cb 0.09 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 1t2a s VAL 349 CO 0.54 0.43 0.44 0.00 0.00 0.00 0.00 175.10 176.50 1t2a s ALA 350 N -0.09 4.20 0.20 5.51 0.00 -1.26 -4.62 121.76 125.70 1t2a s ALA 350 Ca 0.25 -1.81 -0.12 0.00 0.00 0.00 0.00 51.96 50.28 1t2a s ALA 350 Cb -0.16 -1.21 0.25 0.00 0.00 0.00 0.00 23.12 21.99 1t2a s ALA 350 CO 0.12 -0.23 1.67 0.35 0.00 0.00 0.00 175.76 177.67 1t2a h PHE 351 N 0.91 -0.04 -0.46 0.00 3.04 -1.99 -1.14 116.94 117.27 1t2a h PHE 351 Ca -0.41 0.04 0.03 0.00 3.98 0.00 0.00 57.97 61.61 1t2a h PHE 351 Cb 1.27 0.11 -0.04 0.00 2.56 0.00 0.00 35.95 39.85 1t2a h PHE 351 CO 0.48 -0.14 0.24 -0.44 -2.02 0.00 0.00 178.31 176.43 1t2a h ASP 352 N 0.11 0.37 0.14 0.41 3.32 -1.97 -1.87 116.42 116.93 1t2a h ASP 352 Ca 0.29 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.27 1t2a h ASP 352 Cb 0.45 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1t2a h ASP 352 CO -0.48 0.26 -0.30 -0.08 -1.72 0.00 0.00 179.24 176.92 1t2a h GLU 353 N 0.49 0.26 -0.20 3.56 4.81 -1.79 -2.51 114.58 119.19 1t2a h GLU 353 Ca 0.19 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1t2a h GLU 353 Cb 0.07 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1t2a h GLU 353 CO -0.12 0.54 0.04 1.25 -0.73 0.00 0.00 179.01 180.00 1t2a h LEU 354 N 0.23 0.31 -0.16 1.64 5.85 -0.62 -1.32 115.31 121.25 1t2a h LEU 354 Ca 0.03 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1t2a h LEU 354 Cb 0.66 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1t2a h LEU 354 CO 0.05 0.48 0.06 0.58 -0.34 0.00 0.00 178.44 179.27 1t2a h VAL 355 N 0.13 1.16 -0.45 1.05 2.07 -1.23 -2.15 116.25 116.83 1t2a h VAL 355 Ca 0.06 -0.48 0.06 0.00 0.82 0.00 0.00 66.70 67.16 1t2a h VAL 355 Cb 0.29 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 1t2a h VAL 355 CO 0.00 0.15 0.16 -0.09 0.02 0.00 0.00 177.57 177.82 1t2a h ARG 356 N 0.10 0.33 -0.96 1.57 2.43 -1.41 -1.19 114.38 115.24 1t2a h ARG 356 Ca 0.05 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1t2a h ARG 356 Cb 0.18 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.61 1t2a h ARG 356 CO -0.00 0.22 0.59 1.49 -1.51 0.00 0.00 179.97 180.75 1t2a h GLU 357 N 0.34 1.30 -0.15 0.20 4.81 -1.01 0.80 114.58 120.87 1t2a h GLU 357 Ca 0.21 -0.11 -0.15 0.00 -0.13 0.00 0.00 59.36 59.19 1t2a h GLU 357 Cb 0.21 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1t2a h GLU 357 CO -0.22 0.90 -0.47 0.52 -0.73 0.00 0.00 179.01 179.01 1t2a h MET 358 N 1.32 0.58 -0.49 1.92 2.86 -0.74 -0.09 114.93 120.29 1t2a h MET 358 Ca 0.35 -0.43 -0.06 0.00 -2.06 0.00 0.00 59.70 57.50 1t2a h MET 358 Cb -0.08 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1t2a h MET 358 CO -0.07 1.05 0.08 0.28 1.06 0.00 0.00 176.91 179.32 1t2a h VAL 359 N 0.23 1.25 -0.51 -2.22 2.07 -1.08 -0.70 116.25 115.28 1t2a h VAL 359 Ca -0.02 -0.92 -0.09 0.00 0.82 0.00 0.00 66.70 66.49 1t2a h VAL 359 Cb 1.10 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 1t2a h VAL 359 CO 0.10 0.33 -0.03 0.45 0.02 0.00 0.00 177.57 178.43 1t2a h HIS 360 N 0.68 1.02 -0.70 1.57 -0.00 -0.82 -0.28 115.15 116.63 1t2a h HIS 360 Ca 0.15 -0.19 0.03 0.00 -0.00 0.00 0.00 60.37 60.36 1t2a h HIS 360 Cb 0.39 -0.26 -0.04 0.00 -0.00 0.00 0.00 27.41 27.49 1t2a h HIS 360 CO 0.03 0.96 0.44 0.00 -0.00 0.00 0.00 177.93 179.35 1t2a h ALA 361 N 0.93 0.92 0.00 2.45 0.00 -0.74 -1.77 119.26 121.05 1t2a h ALA 361 Ca 0.14 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 1t2a h ALA 361 Cb 0.57 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1t2a h ALA 361 CO 0.03 0.21 -0.64 -0.44 0.00 0.00 0.00 179.25 178.41 1t2a h ASP 362 N 0.85 0.00 -0.45 0.00 3.45 -0.87 -0.70 116.42 118.71 1t2a h ASP 362 Ca 0.28 0.00 -0.05 0.00 0.43 0.00 0.00 57.03 57.69 1t2a h ASP 362 Cb 0.03 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.78 1t2a h ASP 362 CO -0.11 0.64 0.08 0.58 -1.57 0.00 0.00 179.24 178.86 1t2a h VAL 363 N 0.00 1.24 -0.38 -1.35 2.07 -0.57 0.55 116.25 117.82 1t2a h VAL 363 Ca -0.01 -0.87 -0.07 0.00 0.82 0.00 0.00 66.70 66.57 1t2a h VAL 363 Cb 1.17 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1t2a h VAL 363 CO 0.08 0.31 -0.04 -0.08 0.02 0.00 0.00 177.57 177.86 1t2a h GLU 364 N 0.60 0.62 -0.16 1.57 4.57 -1.09 -1.01 114.58 119.67 1t2a h GLU 364 Ca 0.14 -0.16 -0.14 0.00 -1.18 0.00 0.00 59.36 58.01 1t2a h GLU 364 Cb 0.36 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1t2a h GLU 364 CO 0.01 0.67 -0.46 1.25 -1.18 0.00 0.00 179.01 179.29 1t2a h LEU 365 N 0.58 0.68 -0.91 1.64 5.85 -0.94 -2.91 115.31 119.30 1t2a h LEU 365 Ca 0.12 -0.59 -0.08 0.00 0.84 0.00 0.00 57.88 58.16 1t2a h LEU 365 Cb 0.43 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1t2a h LEU 365 CO 0.02 1.15 -0.38 0.24 -0.34 0.00 0.00 178.44 179.13 1t2a h MET 366 N 0.24 0.00 -0.45 1.25 2.86 -0.79 -2.88 114.93 115.17 1t2a h MET 366 Ca -0.01 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.49 1t2a h MET 366 Cb 1.08 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.73 1t2a h MET 366 CO 0.10 0.38 -0.27 -0.09 1.06 0.00 0.00 176.91 178.09 1t2a h ARG 367 N 0.00 0.98 0.00 1.72 2.43 -1.17 -2.01 114.38 116.32 1t2a h ARG 367 Ca -0.00 -0.45 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1t2a h ARG 367 Cb 0.91 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1t2a h ARG 367 CO 0.05 1.12 0.00 1.79 -1.51 0.00 0.00 179.97 181.42 1t2a h THR 368 N 0.83 0.00 0.00 0.20 1.35 -1.30 -3.51 112.91 110.47 1t2a h THR 368 Ca 0.09 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 1t2a h THR 368 Cb 0.85 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1t2a h THR 368 CO 0.08 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 174.89