#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 4.01 -0.17 6.15 0.02 -1.26 -4.92 114.94 118.76 1t2a s ASN 24 Ca 0.00 -1.52 -0.00 0.00 -1.02 0.00 0.00 52.86 50.31 1t2a s ASN 24 Cb 0.00 -1.08 0.04 0.00 0.02 0.00 0.00 41.25 40.23 1t2a s ASN 24 CO 0.00 -0.35 -0.06 -0.69 0.02 0.00 0.00 177.10 176.02 1t2a s VAL 25 N 1.44 1.22 -0.08 1.60 1.01 -1.26 -1.47 120.40 122.85 1t2a s VAL 25 Ca 0.04 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 1t2a s VAL 25 Cb -0.18 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1t2a s VAL 25 CO -0.15 0.13 0.01 0.00 0.00 0.00 0.00 175.10 175.10 1t2a s ALA 26 N 1.58 3.32 -0.19 5.51 0.00 -0.53 0.00 121.76 131.46 1t2a s ALA 26 Ca 0.00 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.15 1t2a s ALA 26 Cb -0.15 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.47 1t2a s ALA 26 CO -0.08 0.59 -0.13 -1.17 0.00 0.00 0.00 175.76 174.98 1t2a s LEU 27 N -0.91 2.53 -0.23 0.00 2.96 0.58 -0.94 118.68 122.67 1t2a s LEU 27 Ca 0.14 -0.49 -0.03 0.00 -0.22 0.00 0.00 54.13 53.52 1t2a s LEU 27 Cb -0.11 -1.60 0.01 0.00 0.50 0.00 0.00 46.19 44.98 1t2a s LEU 27 CO 0.03 0.02 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.40 1t2a s ILE 28 N 1.19 3.17 0.30 6.68 1.01 0.68 -0.70 121.20 133.53 1t2a s ILE 28 Ca 0.02 -0.70 -0.12 0.00 0.00 0.00 0.00 60.65 59.85 1t2a s ILE 28 Cb -0.14 -2.50 -0.08 0.00 0.01 0.00 0.00 42.46 39.75 1t2a s ILE 28 CO -0.05 0.34 0.67 0.42 0.00 0.00 0.00 174.94 176.32 1t2a s THR 29 N 1.42 4.79 -0.60 2.92 -4.23 -0.43 -1.64 115.64 117.86 1t2a s THR 29 Ca 0.04 0.72 0.00 0.00 -1.18 0.00 0.00 61.69 61.27 1t2a s THR 29 Cb -0.15 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.06 1t2a s THR 29 CO -0.04 -0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 1t2a n GLY 30 N -0.44 0.62 0.28 3.99 0.00 -1.25 -2.10 105.19 106.29 1t2a n GLY 30 Ca 0.02 -0.74 0.14 0.00 0.00 0.00 0.00 46.02 45.44 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 0.54 -0.00 -0.61 2.10 -1.72 -1.38 117.51 116.44 1t2a h ILE 31 Ca -0.13 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.53 1t2a h ILE 31 Cb 0.61 1.18 0.00 0.00 -1.09 0.00 0.00 36.82 37.53 1t2a h ILE 31 CO 0.18 0.06 -0.11 0.35 -1.08 0.00 0.00 178.15 177.55 1t2a n THR 32 N -3.72 0.00 -2.07 2.19 -2.24 -1.26 -2.64 114.28 104.54 1t2a n THR 32 Ca -0.02 -0.02 -0.21 0.00 -2.27 0.00 0.00 64.05 61.52 1t2a n THR 32 Cb 0.16 -0.25 0.13 0.00 -2.10 0.00 0.00 70.33 68.27 1t2a n THR 32 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t2a n GLY 33 N 1.37 -0.55 0.42 3.38 0.00 -0.52 -4.61 105.19 104.69 1t2a n GLY 33 Ca 0.11 -1.83 -0.15 0.00 0.00 0.00 0.00 46.02 44.15 1t2a n GLY 33 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1t2a h GLN 34 N 0.00 -0.67 -0.34 1.61 4.15 -1.85 -1.37 115.11 116.65 1t2a h GLN 34 Ca -0.31 0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.03 1t2a h GLN 34 Cb 0.95 0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.79 1t2a h GLN 34 CO 0.26 -0.44 -0.27 -0.44 -1.93 0.00 0.00 178.83 176.00 1t2a h ASP 35 N -0.69 0.82 -0.75 -0.69 5.19 -1.93 -2.37 116.42 115.99 1t2a h ASP 35 Ca 0.01 -0.45 0.06 0.00 -0.62 0.00 0.00 57.03 56.03 1t2a h ASP 35 Cb 0.70 -0.23 -0.05 0.00 0.18 0.00 0.00 39.33 39.94 1t2a h ASP 35 CO -0.23 1.10 0.49 1.23 -3.12 0.00 0.00 179.24 178.72 1t2a h GLY 36 N 0.55 1.02 0.92 2.75 0.00 -1.63 0.24 103.07 106.94 1t2a h GLY 36 Ca 0.06 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 46.99 1t2a h GLY 36 CO 0.07 0.25 -0.09 1.48 0.00 0.00 0.00 176.54 178.25 1t2a h SER 37 N 0.81 0.66 -0.20 0.19 4.64 -0.87 0.53 113.55 119.32 1t2a h SER 37 Ca 0.32 -0.37 -0.14 0.00 -0.47 0.00 0.00 61.79 61.13 1t2a h SER 37 Cb 0.22 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1t2a h SER 37 CO -0.11 0.87 -0.38 1.88 -0.87 0.00 0.00 176.83 178.22 1t2a h TYR 38 N 0.43 0.87 -0.54 4.77 -1.99 -0.88 -2.62 116.97 117.01 1t2a h TYR 38 Ca 0.08 -0.25 -0.09 0.00 2.00 0.00 0.00 58.73 60.47 1t2a h TYR 38 Cb 0.59 -0.19 -0.02 0.00 2.00 0.00 0.00 36.73 39.11 1t2a h TYR 38 CO 0.05 1.00 -0.03 1.25 -0.00 0.00 0.00 178.16 180.43 1t2a h LEU 39 N 0.60 0.96 -0.47 3.88 5.85 -0.45 -1.14 115.31 124.54 1t2a h LEU 39 Ca 0.05 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1t2a h LEU 39 Cb 0.93 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 1t2a h LEU 39 CO 0.08 1.05 0.31 0.00 -0.34 0.00 0.00 178.44 179.54 1t2a h ALA 40 N 0.94 0.59 -0.40 1.25 0.00 -0.84 -0.24 119.26 120.57 1t2a h ALA 40 Ca 0.15 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1t2a h ALA 40 Cb 0.58 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1t2a h ALA 40 CO 0.03 0.05 0.23 0.93 0.00 0.00 0.00 179.25 180.50 1t2a h GLU 41 N 0.63 0.46 -0.75 0.00 5.08 -1.21 0.18 114.58 118.98 1t2a h GLU 41 Ca 0.17 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.53 1t2a h GLU 41 Cb -0.07 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.03 1t2a h GLU 41 CO -0.04 0.31 0.47 0.35 -1.00 0.00 0.00 179.01 179.10 1t2a h PHE 42 N 0.48 0.89 -0.02 4.33 3.57 -0.77 -1.74 116.94 123.67 1t2a h PHE 42 Ca 0.16 0.02 -0.23 0.00 3.53 0.00 0.00 57.97 61.46 1t2a h PHE 42 Cb 0.01 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.46 1t2a h PHE 42 CO -0.07 0.51 -0.92 -0.07 -2.23 0.00 0.00 178.31 175.53 1t2a h LEU 43 N 0.92 0.61 -1.28 0.59 3.38 -0.87 -2.96 115.31 115.71 1t2a h LEU 43 Ca 0.30 -0.47 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1t2a h LEU 43 Cb 0.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1t2a h LEU 43 CO -0.11 1.26 0.04 -0.07 0.09 0.00 0.00 178.44 179.65 1t2a h LEU 44 N 0.28 0.49 -1.84 1.67 3.38 -0.77 -0.87 115.31 117.66 1t2a h LEU 44 Ca -0.08 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1t2a h LEU 44 Cb 1.55 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.17 1t2a h LEU 44 CO 0.16 0.53 -0.12 -0.08 0.09 0.00 0.00 178.44 179.03 1t2a h GLU 45 N 0.52 0.00 -0.55 1.13 4.57 -1.17 -1.59 114.58 117.49 1t2a h GLU 45 Ca 0.12 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 1t2a h GLU 45 Cb 0.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1t2a h GLU 45 CO 0.00 0.12 0.00 1.63 -1.18 0.00 0.00 179.01 179.58 1t2a n LYS 46 N -3.55 2.49 -1.18 1.92 5.02 -0.43 -4.92 118.16 117.52 1t2a n LYS 46 Ca -0.01 -1.86 -0.04 0.00 -2.02 0.00 0.00 58.31 54.37 1t2a n LYS 46 Cb 0.26 -1.53 -0.02 0.00 -0.02 0.00 0.00 35.03 33.72 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 1.09 0.70 3.82 0.72 0.00 -0.60 -5.03 105.19 105.90 1t2a n GLY 47 Ca 0.17 -0.86 -0.32 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.17 3.23 -0.29 1.61 1.51 -0.64 -4.87 117.35 115.72 1t2a s TYR 48 Ca 0.00 1.47 -0.20 0.00 -1.01 0.00 0.00 57.07 57.33 1t2a s TYR 48 Cb 0.00 -2.89 -0.01 0.00 -0.11 0.00 0.00 41.96 38.95 1t2a s TYR 48 CO 0.00 -0.79 0.63 -2.00 -1.11 0.00 0.00 175.55 172.28 1t2a s GLU 49 N -4.21 3.95 -0.17 -0.62 2.12 -0.54 -4.58 118.70 114.64 1t2a s GLU 49 Ca 0.61 0.35 -0.02 0.00 0.36 0.00 0.00 54.97 56.26 1t2a s GLU 49 Cb -0.13 -3.71 -0.02 0.00 0.26 0.00 0.00 34.13 30.53 1t2a s GLU 49 CO 0.37 -0.54 -0.08 0.08 -0.54 0.00 0.00 175.26 174.56 1t2a s VAL 50 N 2.58 3.37 -0.01 3.70 1.01 0.93 -1.45 120.40 130.53 1t2a s VAL 50 Ca 0.25 -0.53 0.07 0.00 0.00 0.00 0.00 61.98 61.77 1t2a s VAL 50 Cb -0.15 -2.47 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 1t2a s VAL 50 CO 0.11 0.48 -0.22 -1.00 0.00 0.00 0.00 175.10 174.47 1t2a s HIS 51 N 0.76 2.46 0.11 5.22 3.76 -0.12 -0.36 115.29 127.11 1t2a s HIS 51 Ca -0.03 -0.34 0.05 0.00 -0.15 0.00 0.00 55.06 54.60 1t2a s HIS 51 Cb -0.15 -1.51 -0.04 0.00 1.11 0.00 0.00 32.58 31.99 1t2a s HIS 51 CO 0.02 0.08 -0.14 0.20 -0.85 0.00 0.00 174.74 174.05 1t2a s GLY 52 N -0.83 1.00 -0.27 -2.22 0.00 -0.31 -0.23 107.32 104.46 1t2a s GLY 52 Ca 0.11 -1.21 -0.13 0.00 0.00 0.00 0.00 44.72 43.50 1t2a s GLY 52 CO 0.01 -1.26 0.26 -0.42 0.00 0.00 0.00 173.10 171.69 1t2a s ILE 53 N -1.94 5.26 -0.01 0.90 1.01 -0.66 -0.49 121.20 125.28 1t2a s ILE 53 Ca 0.06 0.34 0.06 0.00 0.00 0.00 0.00 60.65 61.11 1t2a s ILE 53 Cb -0.06 -3.60 -0.03 0.00 0.01 0.00 0.00 42.46 38.78 1t2a s ILE 53 CO 0.02 0.23 -0.18 -0.69 0.00 0.00 0.00 174.94 174.32 1t2a s VAL 54 N 1.78 2.78 0.33 2.92 1.01 0.94 -3.92 120.40 126.24 1t2a s VAL 54 Ca 0.11 -0.97 -0.24 0.00 0.00 0.00 0.00 61.98 60.88 1t2a s VAL 54 Cb -0.16 -2.10 -0.10 0.00 0.00 0.00 0.00 36.38 34.02 1t2a s VAL 54 CO 0.10 0.49 0.91 -0.13 0.00 0.00 0.00 175.10 176.46 1t2a s ARG 55 N -0.99 4.44 0.30 2.72 0.52 -1.26 -1.05 118.95 123.64 1t2a s ARG 55 Ca 0.12 1.19 -0.29 0.00 -0.52 0.00 0.00 55.73 56.24 1t2a s ARG 55 Cb -0.10 -2.67 -0.10 0.00 0.52 0.00 0.00 34.95 32.59 1t2a s ARG 55 CO 0.02 0.23 1.35 0.50 0.02 0.00 0.00 175.30 177.42 1t2a s ARG 56 N -2.31 4.32 0.02 3.54 3.00 -1.26 -4.94 118.95 121.32 1t2a s ARG 56 Ca 0.52 2.24 -0.01 0.00 -1.00 0.00 0.00 55.73 57.48 1t2a s ARG 56 Cb -0.16 -3.09 -0.02 0.00 0.00 0.00 0.00 34.95 31.68 1t2a s ARG 56 CO 0.21 -0.27 -0.01 0.45 0.00 0.00 0.00 175.30 175.67 1t2a s SER 57 N -0.17 0.23 0.28 -2.12 0.15 -1.26 -5.01 113.70 105.80 1t2a s SER 57 Ca 0.53 -0.50 0.25 0.00 0.70 0.00 0.00 55.95 56.92 1t2a s SER 57 Cb -0.40 0.11 1.00 0.00 -1.71 0.00 0.00 66.02 65.02 1t2a s SER 57 CO 0.50 -0.32 1.74 0.77 1.20 0.00 0.00 173.24 177.12 1t2a h SER 58 N 4.54 0.00 -3.10 5.45 4.64 -2.06 -3.44 113.55 119.57 1t2a h SER 58 Ca -0.32 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.53 1t2a h SER 58 Cb 1.21 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.15 1t2a h SER 58 CO 0.42 0.00 -0.68 -0.44 -0.87 0.00 0.00 176.83 175.26 1t2a s SER 59 N -4.38 2.61 0.20 4.97 0.01 -1.26 -5.11 113.70 110.75 1t2a s SER 59 Ca 0.04 -1.16 -0.32 0.00 1.31 0.00 0.00 55.95 55.82 1t2a s SER 59 Cb 0.09 -0.14 -0.14 0.00 0.21 0.00 0.00 66.02 66.04 1t2a s SER 59 CO 0.42 -0.33 1.34 0.33 0.41 0.00 0.00 173.24 175.40 1t2a n PHE 60 N -0.53 1.87 -2.04 2.43 7.35 -1.26 -4.88 117.46 120.40 1t2a n PHE 60 Ca -0.06 0.51 0.00 0.00 -0.76 0.00 0.00 57.45 57.14 1t2a n PHE 60 Cb 0.63 -2.40 0.00 0.00 0.35 0.00 0.00 39.48 38.06 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 2.23 0.07 -0.78 -2.13 6.94 -1.26 -4.83 115.26 115.50 1t2a n ASN 61 Ca 0.13 -1.89 0.04 0.00 -0.02 0.00 0.00 54.58 52.84 1t2a n ASN 61 Cb 0.28 -0.18 0.21 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 0.04 2.29 -0.30 5.53 -2.24 -1.26 -4.79 114.28 113.55 1t2a n THR 62 Ca 0.00 -2.41 0.14 0.00 -2.27 0.00 0.00 64.05 59.52 1t2a n THR 62 Cb 0.72 -0.27 0.32 0.00 -2.10 0.00 0.00 70.33 68.99 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 1.06 1.50 2.00 3.38 0.00 -1.90 0.26 103.07 109.37 1t2a h GLY 63 Ca 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 1t2a h GLY 63 CO 0.21 -0.35 -0.11 3.21 0.00 0.00 0.00 176.54 179.50 1t2a h ARG 64 N 0.28 0.00 0.00 4.80 3.08 -1.87 -3.29 114.38 117.38 1t2a h ARG 64 Ca 0.58 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.63 1t2a h ARG 64 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.22 1t2a h ARG 64 CO -0.61 0.11 0.00 0.44 -1.07 0.00 0.00 179.97 178.84 1t2a n ILE 65 N -3.24 0.46 -0.31 2.04 -5.35 -0.52 -4.78 119.36 107.67 1t2a n ILE 65 Ca 0.01 -0.70 -0.01 0.00 -0.27 0.00 0.00 62.75 61.78 1t2a n ILE 65 Cb 0.38 0.80 0.12 0.00 -1.74 0.00 0.00 39.64 39.20 1t2a n ILE 65 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1t2a h GLU 66 N 0.00 0.98 0.00 6.28 4.39 -1.07 0.53 114.58 125.70 1t2a h GLU 66 Ca 0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1t2a h GLU 66 Cb 0.27 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1t2a h GLU 66 CO 0.00 0.65 0.09 1.12 -1.16 0.00 0.00 179.01 179.71 1t2a h HIS 67 N 1.01 0.00 0.00 4.33 2.07 -1.86 0.23 115.15 120.93 1t2a h HIS 67 Ca 0.36 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.85 1t2a h HIS 67 Cb 0.09 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.06 1t2a h HIS 67 CO -0.03 0.00 -0.63 -0.07 -3.07 0.00 0.00 177.93 174.14 1t2a h LEU 68 N 0.00 0.00 -8.41 6.12 4.07 -1.24 -3.55 115.31 112.30 1t2a h LEU 68 Ca 0.00 0.00 -0.66 0.00 0.08 0.00 0.00 57.88 57.30 1t2a h LEU 68 Cb 0.18 0.00 -0.16 0.00 1.08 0.00 0.00 40.66 41.75 1t2a h LEU 68 CO 0.00 0.12 0.21 -0.47 -1.08 0.00 0.00 178.44 177.22 1t2a s TYR 69 N -3.22 2.97 0.00 1.13 5.04 0.81 -4.82 117.35 119.25 1t2a s TYR 69 Ca 0.02 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.27 1t2a s TYR 69 Cb 0.08 -3.71 0.00 0.00 0.35 0.00 0.00 41.96 38.67 1t2a s TYR 69 CO 0.74 -1.14 0.00 0.09 -1.34 0.00 0.00 175.55 173.90 1t2a n ASN 79 N 6.58 0.00 -4.24 4.32 3.02 -1.26 -4.99 115.26 118.69 1t2a n ASN 79 Ca -0.04 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.19 1t2a n ASN 79 Cb 0.46 -0.10 -0.16 0.00 -0.61 0.00 0.00 39.78 39.36 1t2a n ASN 79 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1t2a s MET 80 N 0.00 3.13 -0.02 3.52 1.75 -1.26 -0.05 119.30 126.37 1t2a s MET 80 Ca 0.00 -0.82 0.05 0.00 -1.25 0.00 0.00 55.69 53.67 1t2a s MET 80 Cb 0.00 -2.45 -0.01 0.00 2.84 0.00 0.00 34.83 35.21 1t2a s MET 80 CO 0.00 0.11 -0.18 0.21 -0.65 0.00 0.00 175.02 174.51 1t2a s LYS 81 N 0.55 1.50 0.01 4.11 2.20 0.51 -4.99 119.74 123.62 1t2a s LYS 81 Ca -0.12 -0.64 0.05 0.00 -0.36 0.00 0.00 55.97 54.90 1t2a s LYS 81 Cb -0.17 -1.43 -0.03 0.00 -1.51 0.00 0.00 37.83 34.70 1t2a s LYS 81 CO 0.04 0.37 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.76 1t2a s LEU 82 N -0.36 2.86 -0.05 5.43 1.43 -1.26 -1.16 118.68 125.57 1t2a s LEU 82 Ca 0.06 -0.27 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 1t2a s LEU 82 Cb -0.07 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.50 1t2a s LEU 82 CO -0.00 0.28 -0.13 -1.00 0.23 0.00 0.00 176.35 175.73 1t2a s HIS 83 N -0.92 1.40 0.25 0.29 3.76 0.36 -4.94 115.29 115.49 1t2a s HIS 83 Ca 0.15 -0.43 -0.30 0.00 -0.15 0.00 0.00 55.06 54.33 1t2a s HIS 83 Cb -0.11 -0.99 -0.09 0.00 1.11 0.00 0.00 32.58 32.50 1t2a s HIS 83 CO 0.05 -0.18 1.20 0.71 -0.85 0.00 0.00 174.74 175.67 1t2a s TYR 84 N 0.30 3.38 0.15 1.40 1.51 -1.26 -0.04 117.35 122.79 1t2a s TYR 84 Ca -0.07 1.50 -0.24 0.00 -1.01 0.00 0.00 57.07 57.25 1t2a s TYR 84 Cb -0.12 -3.45 0.08 0.00 -0.11 0.00 0.00 41.96 38.36 1t2a s TYR 84 CO 0.02 -1.19 1.07 0.20 -1.11 0.00 0.00 175.55 174.55 1t2a s GLY 85 N -0.33 0.03 -0.18 0.71 0.00 -0.22 -4.84 107.32 102.49 1t2a s GLY 85 Ca 0.49 -0.20 -0.20 0.00 0.00 0.00 0.00 44.72 44.81 1t2a s GLY 85 CO 0.42 2.51 0.55 -0.35 0.00 0.00 0.00 173.10 176.22 1t2a s ASP 86 N -3.40 -0.56 0.00 1.64 -1.08 -1.26 -4.02 116.67 108.00 1t2a s ASP 86 Ca 0.22 1.01 0.15 0.00 -0.52 0.00 0.00 52.55 53.40 1t2a s ASP 86 Cb -0.02 1.02 0.79 0.00 -1.46 0.00 0.00 42.92 43.25 1t2a s ASP 86 CO 0.04 -0.25 1.39 0.18 0.52 0.00 0.00 175.17 177.05 1t2a n LEU 87 N 2.51 0.00 -1.15 -1.34 4.77 -1.26 -1.71 117.00 118.83 1t2a n LEU 87 Ca -0.15 0.21 0.12 0.00 -0.03 0.00 0.00 56.01 56.16 1t2a n LEU 87 Cb 0.56 -0.21 0.22 0.00 -2.33 0.00 0.00 43.42 41.66 1t2a n LEU 87 CO 0.11 -0.11 0.70 0.35 -1.33 0.00 0.00 177.39 177.11 1t2a n THR 88 N -1.21 0.54 -3.98 -5.08 -2.24 -1.26 -4.29 114.28 96.75 1t2a n THR 88 Ca 0.08 -0.77 -0.31 0.00 -2.27 0.00 0.00 64.05 60.79 1t2a n THR 88 Cb 0.10 0.96 -0.15 0.00 -2.10 0.00 0.00 70.33 69.14 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 -1.43 4.65 0.13 3.42 3.68 -0.69 -5.02 116.67 121.40 1t2a s ASP 89 Ca 0.39 -2.20 -0.23 0.00 2.13 0.00 0.00 52.55 52.64 1t2a s ASP 89 Cb 0.22 -1.56 -0.03 0.00 -1.45 0.00 0.00 42.92 40.11 1t2a s ASP 89 CO 0.31 -0.37 1.66 -1.28 0.13 0.00 0.00 175.17 175.62 1t2a h SER 90 N 7.54 -0.52 -0.82 -0.34 0.87 -1.87 -2.78 113.55 115.62 1t2a h SER 90 Ca -0.05 0.09 0.05 0.00 -1.23 0.00 0.00 61.79 60.64 1t2a h SER 90 Cb 1.01 0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 63.15 1t2a h SER 90 CO 0.53 -0.22 0.54 0.74 -0.53 0.00 0.00 176.83 177.89 1t2a h THR 91 N -0.24 1.10 -0.50 2.23 2.02 -1.96 -1.15 112.91 114.42 1t2a h THR 91 Ca 0.08 -0.33 -0.08 0.00 0.77 0.00 0.00 66.41 66.85 1t2a h THR 91 Cb 0.35 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 1t2a h THR 91 CO -0.23 0.18 0.00 0.00 0.37 0.00 0.00 175.52 175.84 1t2a h LEU 93 N 0.78 1.00 -0.44 0.00 3.38 -1.12 -1.19 115.31 117.71 1t2a h LEU 93 Ca 0.15 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1t2a h LEU 93 Cb 0.47 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1t2a h LEU 93 CO 0.02 0.96 0.05 0.58 0.09 0.00 0.00 178.44 180.14 1t2a h VAL 94 N 1.00 1.25 0.14 1.22 2.07 -0.84 -1.21 116.25 119.89 1t2a h VAL 94 Ca 0.21 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.78 1t2a h VAL 94 Cb 0.36 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1t2a h VAL 94 CO 0.00 0.33 -0.11 0.50 0.02 0.00 0.00 177.57 178.31 1t2a h LYS 95 N 0.61 -0.26 -0.42 1.57 3.64 -0.75 0.17 116.57 121.14 1t2a h LYS 95 Ca 0.13 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1t2a h LYS 95 Cb 0.42 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 1t2a h LYS 95 CO 0.01 -0.17 0.26 0.82 -2.27 0.00 0.00 179.45 178.10 1t2a h ILE 96 N -0.27 1.07 -0.29 2.00 2.04 -1.14 -1.64 117.51 119.29 1t2a h ILE 96 Ca -0.00 -0.18 -0.12 0.00 1.00 0.00 0.00 64.86 65.55 1t2a h ILE 96 Cb 0.24 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1t2a h ILE 96 CO -0.02 0.10 -0.32 0.40 0.00 0.00 0.00 178.15 178.31 1t2a h ILE 97 N 0.53 1.28 -0.45 -0.67 2.04 -0.94 0.04 117.51 119.34 1t2a h ILE 97 Ca 0.16 -1.44 -0.08 0.00 1.00 0.00 0.00 64.86 64.51 1t2a h ILE 97 Cb -0.02 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1t2a h ILE 97 CO -0.06 0.46 -0.03 -1.13 0.00 0.00 0.00 178.15 177.39 1t2a h ASN 98 N 0.52 0.74 -0.11 1.72 -1.24 -0.45 0.16 115.58 116.92 1t2a h ASN 98 Ca 0.06 -0.19 -0.23 0.00 0.71 0.00 0.00 56.30 56.65 1t2a h ASN 98 Cb 0.81 -0.20 0.01 0.00 0.73 0.00 0.00 38.32 39.67 1t2a h ASN 98 CO 0.07 0.83 -0.83 -0.08 -1.29 0.00 0.00 177.43 176.12 1t2a h GLU 99 N 0.71 0.77 0.08 6.67 4.81 -0.88 -3.35 114.58 123.39 1t2a h GLU 99 Ca 0.13 -0.66 -0.28 0.00 -0.13 0.00 0.00 59.36 58.42 1t2a h GLU 99 Cb 0.48 0.15 0.02 0.00 0.63 0.00 0.00 28.75 30.04 1t2a h GLU 99 CO 0.02 1.26 -1.17 0.28 -0.73 0.00 0.00 179.01 178.68 1t2a h VAL 100 N 0.51 1.31 -6.20 0.32 2.07 -0.82 -3.48 116.25 109.96 1t2a h VAL 100 Ca -0.07 -2.46 -0.43 0.00 0.82 0.00 0.00 66.70 64.56 1t2a h VAL 100 Cb 1.47 2.62 0.06 0.00 -1.52 0.00 0.00 31.29 33.91 1t2a h VAL 100 CO 0.17 0.75 -0.90 0.29 0.02 0.00 0.00 177.57 177.90 1t2a n LYS 101 N -3.78 -2.67 -1.93 1.57 4.76 0.03 -4.92 118.16 111.21 1t2a n LYS 101 Ca -0.12 0.51 -0.35 0.00 -2.87 0.00 0.00 58.31 55.48 1t2a n LYS 101 Cb 0.95 -4.59 0.04 0.00 -1.84 0.00 0.00 35.03 29.59 1t2a n LYS 101 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1t2a s PRO 102 N -6.00 2.89 0.10 1.97 0.04 -1.26 -4.91 135.00 127.83 1t2a s PRO 102 Ca 0.25 1.74 0.22 0.00 0.04 0.00 0.00 61.00 63.25 1t2a s PRO 102 Cb -0.08 -1.93 -0.14 0.00 0.04 0.00 0.00 34.50 32.39 1t2a s PRO 102 CO 0.85 -1.25 0.81 0.25 0.04 0.00 0.00 177.00 177.69 1t2a n THR 103 N -1.80 0.34 -3.83 1.26 -2.24 0.10 -4.66 114.28 103.43 1t2a n THR 103 Ca 0.13 -0.51 -0.13 0.00 -2.27 0.00 0.00 64.05 61.27 1t2a n THR 103 Cb 0.50 -0.17 -0.15 0.00 -2.10 0.00 0.00 70.33 68.42 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 -3.42 0.00 -0.07 -0.78 2.02 -0.70 -1.10 118.70 114.65 1t2a s GLU 104 Ca -0.03 0.08 0.03 0.00 0.02 0.00 0.00 54.97 55.06 1t2a s GLU 104 Cb 0.12 -0.07 0.01 0.00 0.10 0.00 0.00 34.13 34.28 1t2a s GLU 104 CO 0.84 -0.06 -0.14 0.42 0.02 0.00 0.00 175.26 176.35 1t2a s ILE 105 N 0.35 1.23 -0.26 -1.63 1.01 -0.06 -0.31 121.20 121.54 1t2a s ILE 105 Ca -0.03 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.08 1t2a s ILE 105 Cb -0.04 -1.11 0.05 0.00 0.01 0.00 0.00 42.46 41.36 1t2a s ILE 105 CO -0.01 0.38 -0.08 -0.31 0.00 0.00 0.00 174.94 174.92 1t2a s TYR 106 N 0.57 3.18 -0.93 3.97 2.02 0.12 -0.42 117.35 125.87 1t2a s TYR 106 Ca -0.14 -1.98 -0.19 0.00 -0.37 0.00 0.00 57.07 54.39 1t2a s TYR 106 Cb -0.15 -2.00 0.12 0.00 -0.40 0.00 0.00 41.96 39.52 1t2a s TYR 106 CO 0.04 -0.82 1.15 1.21 -1.57 0.00 0.00 175.55 175.56 1t2a s ASN 107 N 1.21 6.60 0.00 2.29 2.47 0.31 -1.32 114.94 126.50 1t2a s ASN 107 Ca -0.05 -1.96 0.17 0.00 0.42 0.00 0.00 52.86 51.44 1t2a s ASN 107 Cb -0.19 -2.42 -0.09 0.00 -1.45 0.00 0.00 41.25 37.11 1t2a s ASN 107 CO -0.05 -1.12 0.81 0.18 -3.72 0.00 0.00 177.10 173.20 1t2a n LEU 108 N 6.80 1.25 -4.73 3.21 4.77 -0.89 -2.63 117.00 124.77 1t2a n LEU 108 Ca 0.24 -0.63 -0.42 0.00 -0.03 0.00 0.00 56.01 55.17 1t2a n LEU 108 Cb 0.49 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1t2a n LEU 108 CO 0.52 0.26 1.11 -0.83 -1.33 0.00 0.00 177.39 177.12 1t2a s GLY 109 N -2.30 1.99 -0.23 -0.72 0.00 -1.02 -4.61 107.32 100.43 1t2a s GLY 109 Ca 0.10 1.24 -0.31 0.00 0.00 0.00 0.00 44.72 45.75 1t2a s GLY 109 CO 0.56 2.38 1.24 0.00 0.00 0.00 0.00 173.10 177.28 1t2a s ALA 110 N 0.72 -2.07 -0.56 3.20 0.00 -1.26 -4.84 121.76 116.96 1t2a s ALA 110 Ca 0.64 1.74 -0.28 0.00 0.00 0.00 0.00 51.96 54.06 1t2a s ALA 110 Cb -0.40 -0.90 0.03 0.00 0.00 0.00 0.00 23.12 21.85 1t2a s ALA 110 CO 0.35 -0.37 1.18 -1.14 0.00 0.00 0.00 175.76 175.78 1t2a s GLN 111 N -1.48 3.56 0.00 0.00 -0.44 -1.26 -4.88 119.66 115.16 1t2a s GLN 111 Ca 0.07 0.32 0.23 0.00 -2.50 0.00 0.00 55.36 53.48 1t2a s GLN 111 Cb -0.01 -3.99 0.47 0.00 -1.64 0.00 0.00 33.01 27.84 1t2a s GLN 111 CO -0.05 -1.62 1.43 -1.13 0.50 0.00 0.00 175.29 174.43 1t2a n SER 112 N 8.31 3.57 -4.69 6.67 3.41 -1.26 -4.92 113.62 124.71 1t2a n SER 112 Ca 0.09 -2.00 -0.35 0.00 -0.26 0.00 0.00 58.87 56.36 1t2a n SER 112 Cb 0.49 -0.30 -0.09 0.00 -0.26 0.00 0.00 64.21 64.06 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 -1.41 3.34 0.05 7.33 5.65 -1.26 -5.01 115.29 123.98 1t2a s HIS 113 Ca 0.41 0.22 -0.21 0.00 0.25 0.00 0.00 55.06 55.73 1t2a s HIS 113 Cb 0.23 -2.12 -0.13 0.00 -1.18 0.00 0.00 32.58 29.38 1t2a s HIS 113 CO 0.32 0.23 1.45 0.28 -0.65 0.00 0.00 174.74 176.38 1t2a h VAL 114 N 4.75 1.28 -0.37 0.89 2.07 -1.99 -2.57 116.25 120.30 1t2a h VAL 114 Ca -0.39 -0.92 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 1t2a h VAL 114 Cb 1.16 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 1t2a h VAL 114 CO 0.74 0.27 0.13 0.50 0.02 0.00 0.00 177.57 179.22 1t2a h LYS 115 N -0.02 0.56 -0.20 1.57 1.63 -1.97 -2.16 116.57 115.98 1t2a h LYS 115 Ca 0.04 -0.11 0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1t2a h LYS 115 Cb 0.42 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.96 1t2a h LYS 115 CO 0.01 0.56 0.14 0.82 -3.45 0.00 0.00 179.45 177.53 1t2a h ILE 116 N 0.44 0.98 0.00 2.00 2.04 -1.99 -2.05 117.51 118.93 1t2a h ILE 116 Ca 0.12 -0.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 1t2a h ILE 116 Cb 0.23 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1t2a h ILE 116 CO -0.01 0.03 -0.02 0.77 0.00 0.00 0.00 178.15 178.92 1t2a h SER 117 N 0.14 0.00 0.48 1.72 4.64 -0.96 -1.33 113.55 118.24 1t2a h SER 117 Ca 0.09 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.29 1t2a h SER 117 Cb 0.17 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 1t2a h SER 117 CO -0.01 0.02 -0.53 -0.26 -0.87 0.00 0.00 176.83 175.18 1t2a h PHE 118 N 0.00 0.07 0.00 4.77 -1.00 -1.41 -2.16 116.94 117.21 1t2a h PHE 118 Ca -0.00 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.76 1t2a h PHE 118 Cb 0.35 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 39.90 1t2a h PHE 118 CO 0.00 0.58 -0.99 -0.25 -1.61 0.00 0.00 178.31 176.04 1t2a n ASP 119 N -3.91 0.96 -2.72 2.17 8.00 -0.83 -4.30 116.55 115.93 1t2a n ASP 119 Ca -0.02 -0.95 -0.20 0.00 0.71 0.00 0.00 54.79 54.33 1t2a n ASP 119 Cb 0.55 0.98 -0.00 0.00 -0.02 0.00 0.00 41.12 42.62 1t2a n ASP 119 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1t2a n LEU 120 N -1.51 3.09 -0.20 0.64 4.77 -0.57 -4.92 117.00 118.31 1t2a n LEU 120 Ca 0.04 -4.80 -0.09 0.00 -0.03 0.00 0.00 56.01 51.13 1t2a n LEU 120 Cb 0.33 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.42 1t2a n LEU 120 CO 0.43 2.06 0.79 0.00 -1.33 0.00 0.00 177.39 179.33 1t2a h ALA 121 N 2.84 0.81 -0.23 -1.18 0.00 -1.57 -0.95 119.26 118.98 1t2a h ALA 121 Ca 0.12 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1t2a h ALA 121 Cb 0.94 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1t2a h ALA 121 CO 0.68 0.67 -0.17 1.49 0.00 0.00 0.00 179.25 181.93 1t2a h GLU 122 N 0.95 0.52 -0.84 0.00 4.81 -1.91 0.52 114.58 118.62 1t2a h GLU 122 Ca 0.16 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1t2a h GLU 122 Cb 0.62 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.96 1t2a h GLU 122 CO 0.04 0.82 0.52 -0.92 -0.73 0.00 0.00 179.01 178.74 1t2a h TYR 123 N 0.22 1.09 -0.57 0.92 3.20 -1.96 0.59 116.97 120.47 1t2a h TYR 123 Ca 0.04 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.90 1t2a h TYR 123 Cb 0.70 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 1t2a h TYR 123 CO 0.07 0.72 0.27 1.15 -1.64 0.00 0.00 178.16 178.73 1t2a h THR 124 N 1.15 1.21 -0.52 1.81 2.02 -1.00 -0.01 112.91 117.57 1t2a h THR 124 Ca 0.30 -0.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 1t2a h THR 124 Cb -0.07 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 1t2a h THR 124 CO -0.06 0.23 0.28 0.00 0.37 0.00 0.00 175.52 176.34 1t2a h ALA 125 N 1.11 0.66 -0.38 6.16 0.00 -0.31 0.74 119.26 127.24 1t2a h ALA 125 Ca 0.19 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1t2a h ALA 125 Cb 0.12 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1t2a h ALA 125 CO -0.02 0.19 -0.09 0.22 0.00 0.00 0.00 179.25 179.54 1t2a h ASP 126 N 0.69 0.63 0.04 0.00 3.58 -0.40 -0.66 116.42 120.31 1t2a h ASP 126 Ca 0.18 -0.17 -0.18 0.00 0.42 0.00 0.00 57.03 57.28 1t2a h ASP 126 Cb 0.06 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 1t2a h ASP 126 CO -0.03 0.76 -0.93 0.58 -2.88 0.00 0.00 179.24 176.74 1t2a h VAL 127 N 0.60 1.23 0.05 2.25 2.07 -0.92 0.13 116.25 121.66 1t2a h VAL 127 Ca 0.11 -2.32 -0.26 0.00 0.82 0.00 0.00 66.70 65.05 1t2a h VAL 127 Cb 0.52 2.76 -0.02 0.00 -1.52 0.00 0.00 31.29 33.03 1t2a h VAL 127 CO 0.03 0.54 -1.31 0.44 0.02 0.00 0.00 177.57 177.29 1t2a h ASP 128 N -0.74 0.18 0.00 0.57 5.19 -0.92 -3.01 116.42 117.69 1t2a h ASP 128 Ca -0.23 -0.23 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 1t2a h ASP 128 Cb 1.39 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.84 1t2a h ASP 128 CO -0.04 1.19 0.00 0.61 -3.12 0.00 0.00 179.24 177.87 1t2a n GLY 129 N 1.51 -0.06 0.28 2.75 0.00 -0.44 -4.20 105.19 105.03 1t2a n GLY 129 Ca -0.09 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.98 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 0.00 1.07 -0.60 1.61 2.07 -1.23 -1.81 116.25 117.36 1t2a h VAL 130 Ca 0.00 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.37 1t2a h VAL 130 Cb 0.00 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1t2a h VAL 130 CO 0.00 0.08 0.40 1.23 0.02 0.00 0.00 177.57 179.30 1t2a h GLY 131 N 0.37 0.81 0.88 2.17 0.00 -0.59 0.15 103.07 106.86 1t2a h GLY 131 Ca 0.08 -0.28 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 1t2a h GLY 131 CO -0.01 0.25 -0.01 -0.84 0.00 0.00 0.00 176.54 175.93 1t2a h THR 132 N 0.73 1.26 -0.96 4.70 2.02 -1.45 -1.24 112.91 117.96 1t2a h THR 132 Ca 0.24 -0.97 0.03 0.00 0.77 0.00 0.00 66.41 66.47 1t2a h THR 132 Cb 0.06 1.30 -0.05 0.00 -1.74 0.00 0.00 68.15 67.72 1t2a h THR 132 CO -0.06 0.31 0.63 0.25 0.37 0.00 0.00 175.52 177.02 1t2a h LEU 133 N 0.32 1.07 -1.09 2.58 5.85 -1.12 -1.26 115.31 121.66 1t2a h LEU 133 Ca 0.08 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1t2a h LEU 133 Cb 0.46 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 1t2a h LEU 133 CO 0.02 0.75 0.55 0.03 -0.34 0.00 0.00 178.44 179.45 1t2a h ARG 134 N 1.25 1.17 -0.19 1.25 3.08 -0.35 0.70 114.38 121.29 1t2a h ARG 134 Ca 0.37 -0.09 -0.19 0.00 0.07 0.00 0.00 59.98 60.15 1t2a h ARG 134 Cb -0.06 -0.25 0.01 0.00 0.08 0.00 0.00 29.97 29.74 1t2a h ARG 134 CO -0.10 0.79 -0.61 1.25 -1.07 0.00 0.00 179.97 180.23 1t2a h LEU 135 N 1.20 0.86 -0.77 3.04 5.85 -0.62 -0.97 115.31 123.88 1t2a h LEU 135 Ca 0.32 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1t2a h LEU 135 Cb -0.10 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.64 1t2a h LEU 135 CO -0.06 1.31 0.49 -0.07 -0.34 0.00 0.00 178.44 179.76 1t2a h LEU 136 N 0.46 0.91 -1.00 2.25 3.38 -0.70 -1.54 115.31 119.08 1t2a h LEU 136 Ca -0.02 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 1t2a h LEU 136 Cb 1.24 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1t2a h LEU 136 CO 0.13 0.68 -0.37 0.44 0.09 0.00 0.00 178.44 179.41 1t2a h ASP 137 N 1.05 0.25 -0.78 -0.43 5.19 -0.77 -1.98 116.42 118.96 1t2a h ASP 137 Ca 0.28 -0.10 -0.04 0.00 -0.62 0.00 0.00 57.03 56.55 1t2a h ASP 137 Cb -0.08 -0.07 -0.03 0.00 0.18 0.00 0.00 39.33 39.33 1t2a h ASP 137 CO -0.06 0.61 0.32 0.00 -3.12 0.00 0.00 179.24 177.00 1t2a h ALA 138 N 1.41 1.01 -0.05 3.45 0.00 -0.67 0.37 119.26 124.77 1t2a h ALA 138 Ca 0.02 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1t2a h ALA 138 Cb 0.76 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1t2a h ALA 138 CO 0.06 0.62 -0.02 0.28 0.00 0.00 0.00 179.25 180.19 1t2a h VAL 139 N 1.12 0.92 -0.20 0.00 2.07 -0.94 -0.50 116.25 118.72 1t2a h VAL 139 Ca 0.26 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.78 1t2a h VAL 139 Cb 0.20 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1t2a h VAL 139 CO -0.02 0.00 0.11 0.50 0.02 0.00 0.00 177.57 178.17 1t2a h LYS 140 N -0.02 0.28 -0.79 1.57 3.64 -0.98 -2.17 116.57 118.10 1t2a h LYS 140 Ca 0.03 -0.03 0.11 0.00 -1.27 0.00 0.00 60.65 59.49 1t2a h LYS 140 Cb 0.06 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.77 1t2a h LYS 140 CO -0.06 0.27 0.52 1.15 -2.27 0.00 0.00 179.45 179.05 1t2a h THR 141 N 0.21 0.90 -0.03 1.00 2.02 0.05 -1.28 112.91 115.79 1t2a h THR 141 Ca 0.07 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1t2a h THR 141 Cb 0.08 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 1t2a h THR 141 CO -0.01 0.12 0.00 0.00 0.37 0.00 0.00 175.52 176.00 1t2a n GLY 143 N 0.86 0.77 1.17 0.00 0.00 -0.48 -4.95 105.19 102.56 1t2a n GLY 143 Ca 0.15 -0.79 0.09 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.67 3.99 -0.11 0.99 4.77 -0.85 -4.60 117.00 120.53 1t2a n LEU 144 Ca -0.06 -2.34 0.23 0.00 -0.03 0.00 0.00 56.01 53.81 1t2a n LEU 144 Cb 0.22 -0.46 0.67 0.00 -2.33 0.00 0.00 43.42 41.52 1t2a n LEU 144 CO 0.09 0.80 1.22 0.40 -1.33 0.00 0.00 177.39 178.56 1t2a h ILE 145 N 3.17 0.66 -0.02 -0.08 5.03 -1.85 -0.94 117.51 123.49 1t2a h ILE 145 Ca 0.00 -0.03 0.00 0.00 -0.12 0.00 0.00 64.86 64.71 1t2a h ILE 145 Cb 1.18 0.58 0.00 0.00 -3.03 0.00 0.00 36.82 35.55 1t2a h ILE 145 CO 0.13 0.01 -0.21 0.59 -0.68 0.00 0.00 178.15 177.99 1t2a n ASN 146 N -4.36 2.17 -0.04 1.72 3.02 -1.26 -4.18 115.26 112.32 1t2a n ASN 146 Ca 0.14 -1.58 0.00 0.00 -0.03 0.00 0.00 54.58 53.12 1t2a n ASN 146 Cb 0.74 0.26 0.01 0.00 -0.61 0.00 0.00 39.78 40.18 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 0.45 1.50 -4.33 6.41 3.41 -0.41 -4.99 113.62 115.66 1t2a n SER 147 Ca 0.09 -1.44 -0.26 0.00 -0.26 0.00 0.00 58.87 57.00 1t2a n SER 147 Cb 0.43 -0.01 -0.13 0.00 -0.26 0.00 0.00 64.21 64.25 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 -0.46 1.97 -0.14 -3.33 0.11 -0.90 -4.62 120.40 113.03 1t2a s VAL 148 Ca 0.01 -1.65 -0.03 0.00 -2.93 0.00 0.00 61.98 57.38 1t2a s VAL 148 Cb 0.01 -1.77 -0.03 0.00 -1.53 0.00 0.00 36.38 33.06 1t2a s VAL 148 CO 0.01 0.01 -0.02 -0.54 -3.33 0.00 0.00 175.10 171.23 1t2a s LYS 149 N -1.99 3.52 -0.10 1.54 1.02 -0.26 -4.10 119.74 119.37 1t2a s LYS 149 Ca 0.10 -0.48 0.03 0.00 0.02 0.00 0.00 55.97 55.64 1t2a s LYS 149 Cb -0.10 -2.90 -0.01 0.00 -0.52 0.00 0.00 37.83 34.30 1t2a s LYS 149 CO 0.05 0.36 -0.21 0.12 -0.92 0.00 0.00 175.35 174.75 1t2a s PHE 150 N 0.06 2.61 -0.16 3.18 5.36 0.73 -0.88 117.98 128.89 1t2a s PHE 150 Ca 0.01 -0.90 -0.01 0.00 -0.96 0.00 0.00 56.93 55.06 1t2a s PHE 150 Cb -0.13 -1.73 -0.01 0.00 -0.34 0.00 0.00 43.02 40.80 1t2a s PHE 150 CO 0.02 -0.34 -0.10 -0.47 -1.46 0.00 0.00 175.22 172.87 1t2a s TYR 151 N 0.28 2.87 -0.15 10.12 5.04 0.45 -0.98 117.35 134.97 1t2a s TYR 151 Ca -0.15 -0.74 -0.04 0.00 -2.44 0.00 0.00 57.07 53.70 1t2a s TYR 151 Cb -0.17 -1.93 -0.03 0.00 0.35 0.00 0.00 41.96 40.18 1t2a s TYR 151 CO 0.08 -0.31 -0.00 -1.14 -1.34 0.00 0.00 175.55 172.83 1t2a s GLN 152 N 0.69 3.59 -1.33 4.97 2.00 0.16 -0.53 119.66 129.22 1t2a s GLN 152 Ca -0.05 -0.45 -0.17 0.00 -2.00 0.00 0.00 55.36 52.69 1t2a s GLN 152 Cb -0.15 -2.96 0.03 0.00 0.80 0.00 0.00 33.01 30.73 1t2a s GLN 152 CO 0.02 0.36 1.96 0.00 -0.50 0.00 0.00 175.29 177.14 1t2a n ALA 153 N 3.19 4.23 -1.53 1.58 0.00 -1.08 -1.70 120.51 125.21 1t2a n ALA 153 Ca -0.17 -3.78 -0.20 0.00 0.00 0.00 0.00 53.44 49.29 1t2a n ALA 153 Cb 0.53 -3.57 0.22 0.00 0.00 0.00 0.00 19.45 16.62 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 7.80 -0.85 -3.49 0.00 7.64 -0.14 -4.99 113.62 119.59 1t2a n SER 154 Ca 0.50 -1.33 -0.16 0.00 1.01 0.00 0.00 58.87 58.89 1t2a n SER 154 Cb 0.43 -0.98 -0.05 0.00 -1.01 0.00 0.00 64.21 62.60 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 -3.43 0.00 0.57 0.44 -1.32 -1.25 -2.97 115.64 107.68 1t2a s THR 155 Ca 0.71 -0.00 0.41 0.00 -1.21 0.00 0.00 61.69 61.60 1t2a s THR 155 Cb -0.04 -1.00 0.43 0.00 -1.51 0.00 0.00 72.50 70.38 1t2a s THR 155 CO 0.52 -0.00 2.30 0.77 -2.21 0.00 0.00 174.62 176.00 1t2a h SER 156 N 2.70 0.00 0.08 8.08 4.64 -1.39 -1.98 113.55 125.69 1t2a h SER 156 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1t2a h SER 156 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1t2a h SER 156 CO 0.39 0.01 0.00 -0.33 -0.87 0.00 0.00 176.83 176.02 1t2a h GLU 157 N 0.00 0.00 -0.10 4.77 4.39 -1.95 -0.69 114.58 121.00 1t2a h GLU 157 Ca -0.00 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.72 1t2a h GLU 157 Cb 0.09 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1t2a h GLU 157 CO 0.00 0.00 0.07 -0.07 -1.16 0.00 0.00 179.01 177.85 1t2a h LEU 158 N 0.00 0.04 -0.20 1.33 3.38 -1.67 -1.81 115.31 116.39 1t2a h LEU 158 Ca 0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1t2a h LEU 158 Cb 0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1t2a h LEU 158 CO 0.00 0.03 -0.11 1.88 0.09 0.00 0.00 178.44 180.33 1t2a h TYR 159 N 0.05 0.00 0.00 1.13 -1.99 -1.34 0.13 116.97 114.95 1t2a h TYR 159 Ca 0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.77 1t2a h TYR 159 Cb 0.11 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.84 1t2a h TYR 159 CO -0.00 0.11 0.00 0.41 -0.00 0.00 0.00 178.16 178.68 1t2a n GLY 160 N 0.97 1.70 3.56 3.88 0.00 -0.68 -3.00 105.19 111.61 1t2a n GLY 160 Ca 0.03 0.54 -0.40 0.00 0.00 0.00 0.00 46.02 46.19 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 3.28 0.33 1.61 2.20 -0.96 -4.61 119.74 121.59 1t2a s LYS 161 Ca 0.00 -0.58 -0.29 0.00 -0.36 0.00 0.00 55.97 54.74 1t2a s LYS 161 Cb 0.00 -4.80 -0.12 0.00 -1.51 0.00 0.00 37.83 31.40 1t2a s LYS 161 CO 0.00 -2.32 1.44 1.33 -0.36 0.00 0.00 175.35 175.44 1t2a n VAL 162 N 6.79 1.61 0.60 4.02 0.24 -1.16 -4.76 118.33 125.67 1t2a n VAL 162 Ca 0.21 -0.40 0.11 0.00 -2.04 0.00 0.00 64.34 62.22 1t2a n VAL 162 Cb 0.50 -1.77 -0.04 0.00 -1.47 0.00 0.00 33.84 31.06 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 1.13 0.26 -3.88 7.34 1.13 -1.26 -4.92 117.38 117.18 1t2a n GLN 163 Ca 0.06 -0.03 -0.09 0.00 -1.94 0.00 0.00 57.00 54.99 1t2a n GLN 163 Cb 0.36 -1.55 -0.08 0.00 0.11 0.00 0.00 30.24 29.08 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 -3.19 0.78 -0.05 -1.09 2.02 -1.26 -4.98 118.70 110.92 1t2a s GLU 164 Ca 0.03 -0.90 -0.01 0.00 0.02 0.00 0.00 54.97 54.11 1t2a s GLU 164 Cb 0.15 0.31 0.03 0.00 0.10 0.00 0.00 34.13 34.72 1t2a s GLU 164 CO 0.83 -0.23 0.02 0.42 0.02 0.00 0.00 175.26 176.32 1t2a s ILE 165 N -3.51 0.17 1.04 -1.63 1.01 -1.26 -4.09 121.20 112.93 1t2a s ILE 165 Ca 0.02 0.23 -0.17 0.00 0.00 0.00 0.00 60.65 60.73 1t2a s ILE 165 Cb 0.04 -0.36 0.23 0.00 0.01 0.00 0.00 42.46 42.38 1t2a s ILE 165 CO -0.09 0.22 1.26 -2.16 0.00 0.00 0.00 174.94 174.16 1t2a s PRO 166 N 1.91 0.01 -0.16 2.79 0.04 -1.26 -5.13 135.00 133.20 1t2a s PRO 166 Ca 0.03 -0.32 -0.08 0.00 0.04 0.00 0.00 61.00 60.67 1t2a s PRO 166 Cb -0.12 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 1t2a s PRO 166 CO -0.04 -2.85 0.12 -0.65 0.04 0.00 0.00 177.00 173.62 1t2a s GLN 167 N -5.75 3.79 0.33 4.56 1.11 0.87 -4.87 119.66 119.70 1t2a s GLN 167 Ca 0.73 -0.20 0.03 0.00 0.01 0.00 0.00 55.36 55.93 1t2a s GLN 167 Cb -0.05 -3.27 -0.01 0.00 -1.01 0.00 0.00 33.01 28.66 1t2a s GLN 167 CO 0.54 0.52 0.10 0.36 0.01 0.00 0.00 175.29 176.82 1t2a n LYS 168 N 2.79 0.70 -0.15 2.91 2.85 -1.26 -1.10 118.16 124.90 1t2a n LYS 168 Ca -0.18 -2.74 0.25 0.00 -1.05 0.00 0.00 58.31 54.59 1t2a n LYS 168 Cb 0.53 1.39 0.68 0.00 -0.65 0.00 0.00 35.03 36.98 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 0.07 -0.03 -1.58 3.07 -1.95 -1.15 114.58 113.01 1t2a h GLU 169 Ca -0.26 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.60 1t2a h GLU 169 Cb 0.96 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 1t2a h GLU 169 CO 0.42 0.05 0.00 0.25 -1.40 0.00 0.00 179.01 178.32 1t2a n THR 170 N -4.33 0.00 -2.20 1.13 -2.24 -1.26 -4.92 114.28 100.47 1t2a n THR 170 Ca 0.17 -0.43 -0.41 0.00 -2.27 0.00 0.00 64.05 61.11 1t2a n THR 170 Cb 0.85 1.23 -0.03 0.00 -2.10 0.00 0.00 70.33 70.28 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 -2.00 3.10 0.41 4.28 2.01 -0.44 -4.95 115.64 118.06 1t2a s THR 171 Ca 0.31 0.94 -0.26 0.00 0.31 0.00 0.00 61.69 62.99 1t2a s THR 171 Cb 0.20 -3.60 -0.08 0.00 0.01 0.00 0.00 72.50 69.03 1t2a s THR 171 CO 0.31 0.16 1.28 -2.84 -0.69 0.00 0.00 174.62 172.84 1t2a s PRO 172 N -0.44 3.93 0.50 4.92 0.02 -1.26 -4.90 135.00 137.78 1t2a s PRO 172 Ca 0.55 2.10 -0.19 0.00 0.02 0.00 0.00 61.00 63.48 1t2a s PRO 172 Cb -0.37 -2.71 -0.08 0.00 0.02 0.00 0.00 34.50 31.36 1t2a s PRO 172 CO 0.41 -0.50 1.01 -0.06 -0.33 0.00 0.00 177.00 177.52 1t2a s PHE 173 N -1.30 3.17 -0.50 6.54 0.08 -1.26 -4.51 117.98 120.21 1t2a s PHE 173 Ca 0.58 1.55 0.07 0.00 0.12 0.00 0.00 56.93 59.24 1t2a s PHE 173 Cb -0.37 -2.94 0.20 0.00 -0.57 0.00 0.00 43.02 39.34 1t2a s PHE 173 CO 0.47 -0.62 0.72 0.98 -0.10 0.00 0.00 175.22 176.67 1t2a n TYR 174 N -1.26 -3.33 -1.68 0.36 -0.00 0.45 -4.98 117.16 106.72 1t2a n TYR 174 Ca 0.08 -1.72 -0.35 0.00 -0.00 0.00 0.00 57.90 55.91 1t2a n TYR 174 Cb 0.53 1.32 0.07 0.00 -0.00 0.00 0.00 39.34 41.26 1t2a n TYR 174 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 1t2a s PRO 175 N 0.68 2.49 -0.08 2.98 0.04 -1.18 -2.26 135.00 137.68 1t2a s PRO 175 Ca 0.31 1.83 0.11 0.00 0.04 0.00 0.00 61.00 63.29 1t2a s PRO 175 Cb 0.06 -1.87 0.19 0.00 0.04 0.00 0.00 34.50 32.92 1t2a s PRO 175 CO -0.11 -1.58 1.10 0.54 0.04 0.00 0.00 177.00 176.99 1t2a n ARG 176 N -2.20 0.71 -3.69 4.56 5.12 -1.26 -4.81 116.66 115.08 1t2a n ARG 176 Ca 0.14 -1.97 -0.07 0.00 -1.93 0.00 0.00 57.85 54.02 1t2a n ARG 176 Cb 0.50 -1.02 -0.02 0.00 -1.16 0.00 0.00 32.46 30.76 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 -2.10 -0.30 0.53 0.55 1.04 -1.26 -4.60 113.70 107.56 1t2a s SER 177 Ca 0.20 -0.34 0.20 0.00 0.48 0.00 0.00 55.95 56.49 1t2a s SER 177 Cb 0.18 0.57 1.38 0.00 0.10 0.00 0.00 66.02 68.25 1t2a s SER 177 CO -0.00 -1.02 2.15 -0.65 0.98 0.00 0.00 173.24 174.70 1t2a h PRO 178 N 2.00 0.00 -0.10 4.02 0.11 -1.89 -1.58 132.00 134.56 1t2a h PRO 178 Ca -0.24 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.86 1t2a h PRO 178 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1t2a h PRO 178 CO 0.28 0.03 0.01 -0.92 -0.21 0.00 0.00 178.00 177.19 1t2a h TYR 179 N 0.00 0.18 -0.63 0.65 3.20 -1.86 -1.31 116.97 117.20 1t2a h TYR 179 Ca -0.00 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1t2a h TYR 179 Cb 0.07 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 1t2a h TYR 179 CO 0.00 0.39 0.35 0.78 -1.64 0.00 0.00 178.16 178.04 1t2a h GLY 180 N -0.08 0.93 1.08 1.82 0.00 -1.72 -0.50 103.07 104.60 1t2a h GLY 180 Ca 0.03 -0.42 -0.09 0.00 0.00 0.00 0.00 47.33 46.86 1t2a h GLY 180 CO 0.00 0.40 0.07 0.00 0.00 0.00 0.00 176.54 177.02 1t2a h ALA 181 N 1.17 0.88 -0.49 3.60 0.00 -1.31 -0.19 119.26 122.92 1t2a h ALA 181 Ca 0.22 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1t2a h ALA 181 Cb 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1t2a h ALA 181 CO -0.04 0.67 -0.19 0.00 0.00 0.00 0.00 179.25 179.70 1t2a h ALA 182 N 1.03 0.74 0.00 0.00 0.00 -0.74 -2.04 119.26 118.25 1t2a h ALA 182 Ca 0.20 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1t2a h ALA 182 Cb 0.48 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1t2a h ALA 182 CO 0.02 0.67 -0.45 0.87 0.00 0.00 0.00 179.25 180.36 1t2a h LYS 183 N 0.85 0.00 -0.43 0.00 1.79 -0.88 -1.86 116.57 116.04 1t2a h LYS 183 Ca 0.12 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.48 1t2a h LYS 183 Cb 0.76 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.39 1t2a h LYS 183 CO 0.06 0.45 -0.13 1.25 -1.08 0.00 0.00 179.45 179.99 1t2a h LEU 184 N 0.00 0.87 -0.14 2.94 7.12 -0.51 -0.15 115.31 125.43 1t2a h LEU 184 Ca -0.00 -0.37 0.02 0.00 0.13 0.00 0.00 57.88 57.65 1t2a h LEU 184 Cb 0.84 -0.24 -0.02 0.00 -0.53 0.00 0.00 40.66 40.72 1t2a h LEU 184 CO 0.06 1.04 0.03 0.22 -0.13 0.00 0.00 178.44 179.66 1t2a h TYR 185 N 0.69 0.05 -0.69 1.25 3.20 -1.09 -2.15 116.97 118.22 1t2a h TYR 185 Ca 0.11 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.06 1t2a h TYR 185 Cb 0.68 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.89 1t2a h TYR 185 CO 0.05 0.02 0.37 0.00 -1.64 0.00 0.00 178.16 176.96 1t2a h ALA 186 N 1.10 0.94 -0.48 1.82 0.00 -1.08 0.80 119.26 122.37 1t2a h ALA 186 Ca 0.06 0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1t2a h ALA 186 Cb 0.06 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1t2a h ALA 186 CO -0.09 0.03 0.20 -0.92 0.00 0.00 0.00 179.25 178.48 1t2a h TYR 187 N 0.67 0.36 0.00 0.00 3.20 -0.57 -1.50 116.97 119.13 1t2a h TYR 187 Ca 0.32 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 62.03 1t2a h TYR 187 Cb 0.25 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 1t2a h TYR 187 CO -0.08 0.15 -0.87 -1.49 -1.64 0.00 0.00 178.16 174.23 1t2a h TRP 188 N 0.40 0.00 -0.03 -3.82 4.06 -0.73 -1.59 115.95 114.24 1t2a h TRP 188 Ca 0.22 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 61.04 1t2a h TRP 188 Cb 0.18 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.33 1t2a h TRP 188 CO -0.13 0.87 -0.59 0.97 -3.56 0.00 0.00 178.44 176.00 1t2a h ILE 189 N 0.00 1.40 -0.25 1.49 6.09 -0.70 0.17 117.51 125.72 1t2a h ILE 189 Ca -0.01 -1.99 -0.04 0.00 -1.37 0.00 0.00 64.86 61.45 1t2a h ILE 189 Cb 1.58 2.04 -0.01 0.00 0.47 0.00 0.00 36.82 40.90 1t2a h ILE 189 CO 0.11 0.58 -0.01 0.58 -3.07 0.00 0.00 178.15 176.34 1t2a h VAL 190 N 0.08 1.26 -0.69 2.19 2.07 -1.09 -0.41 116.25 119.66 1t2a h VAL 190 Ca -0.01 -0.95 0.04 0.00 0.82 0.00 0.00 66.70 66.61 1t2a h VAL 190 Cb 1.06 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 32.18 1t2a h VAL 190 CO 0.08 0.30 0.42 0.58 0.02 0.00 0.00 177.57 178.97 1t2a h VAL 191 N 0.22 1.05 -0.44 2.57 2.07 -0.95 -1.65 116.25 119.12 1t2a h VAL 191 Ca 0.07 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1t2a h VAL 191 Cb 0.44 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1t2a h VAL 191 CO 0.02 0.15 0.09 -1.13 0.02 0.00 0.00 177.57 176.71 1t2a h ASN 192 N 0.80 0.61 0.52 0.57 -0.00 -0.29 0.29 115.58 118.09 1t2a h ASN 192 Ca 0.29 -0.10 -0.14 0.00 -0.00 0.00 0.00 56.30 56.35 1t2a h ASN 192 Cb 0.08 -0.16 -0.02 0.00 -0.00 0.00 0.00 38.32 38.22 1t2a h ASN 192 CO -0.13 0.63 -0.61 -0.26 -0.00 0.00 0.00 177.43 177.05 1t2a h PHE 193 N 0.64 0.12 0.20 0.67 -1.00 -0.46 0.88 116.94 117.99 1t2a h PHE 193 Ca 0.14 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.87 1t2a h PHE 193 Cb 0.27 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 39.81 1t2a h PHE 193 CO 0.01 0.68 -0.10 -0.09 -1.61 0.00 0.00 178.31 177.20 1t2a h ARG 194 N 0.07 -0.26 -0.35 1.51 2.43 -0.77 -1.84 114.38 115.17 1t2a h ARG 194 Ca -0.01 0.02 -0.17 0.00 -0.81 0.00 0.00 59.98 59.01 1t2a h ARG 194 Cb 1.10 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1t2a h ARG 194 CO 0.09 -0.05 -0.45 0.93 -1.51 0.00 0.00 179.97 178.98 1t2a h GLU 195 N -0.44 0.91 0.06 0.20 5.08 -0.86 -1.37 114.58 118.15 1t2a h GLU 195 Ca -0.03 -0.52 -0.24 0.00 -1.00 0.00 0.00 59.36 57.58 1t2a h GLU 195 Cb 0.33 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1t2a h GLU 195 CO 0.05 1.16 -1.10 0.00 -1.00 0.00 0.00 179.01 178.12 1t2a h ALA 196 N 0.75 0.25 0.00 3.43 0.00 -0.90 -3.39 119.26 119.41 1t2a h ALA 196 Ca 0.04 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1t2a h ALA 196 Cb 1.05 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1t2a h ALA 196 CO 0.11 1.09 0.00 0.66 0.00 0.00 0.00 179.25 181.11 1t2a n TYR 197 N -3.46 0.00 -2.12 0.00 4.02 -0.70 -5.00 117.16 109.90 1t2a n TYR 197 Ca -0.04 -0.33 -0.20 0.00 -0.01 0.00 0.00 57.90 57.32 1t2a n TYR 197 Cb 0.97 -0.03 -0.04 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 -0.33 -5.64 -4.76 7.72 5.03 -0.52 -4.88 115.26 111.88 1t2a n ASN 198 Ca 0.00 0.15 -0.41 0.00 0.87 0.00 0.00 54.58 55.20 1t2a n ASN 198 Cb 0.30 -4.75 -0.03 0.00 -1.02 0.00 0.00 39.78 34.28 1t2a n ASN 198 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1t2a s LEU 199 N -5.39 4.48 -0.86 3.41 2.96 -1.16 -4.84 118.68 117.27 1t2a s LEU 199 Ca 0.00 2.47 -0.25 0.00 -0.22 0.00 0.00 54.13 56.14 1t2a s LEU 199 Cb 0.00 -3.64 0.05 0.00 0.50 0.00 0.00 46.19 43.10 1t2a s LEU 199 CO 0.00 -0.35 1.33 0.12 -1.32 0.00 0.00 176.35 176.13 1t2a s PHE 200 N -1.05 2.45 0.02 5.38 2.19 -1.26 -4.32 117.98 121.39 1t2a s PHE 200 Ca 0.47 -0.48 0.04 0.00 0.33 0.00 0.00 56.93 57.29 1t2a s PHE 200 Cb -0.36 -4.63 -0.02 0.00 -1.31 0.00 0.00 43.02 36.71 1t2a s PHE 200 CO 0.46 -1.97 -0.11 0.00 1.83 0.00 0.00 175.22 175.43 1t2a s ALA 201 N 5.19 0.91 0.03 11.12 0.00 -1.26 -0.19 121.76 137.55 1t2a s ALA 201 Ca 0.39 -0.63 0.02 0.00 0.00 0.00 0.00 51.96 51.74 1t2a s ALA 201 Cb -0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 1t2a s ALA 201 CO 0.03 0.17 -0.07 0.08 0.00 0.00 0.00 175.76 175.97 1t2a s VAL 202 N -0.64 0.49 -0.33 0.00 1.01 -0.15 -4.68 120.40 116.09 1t2a s VAL 202 Ca 0.01 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 61.06 1t2a s VAL 202 Cb -0.06 -0.52 -0.00 0.00 0.00 0.00 0.00 36.38 35.79 1t2a s VAL 202 CO 0.00 -0.24 0.19 0.20 0.00 0.00 0.00 175.10 175.25 1t2a s ASN 203 N -1.15 5.73 -0.28 3.32 0.01 -1.26 -0.66 114.94 120.64 1t2a s ASN 203 Ca -0.07 -0.60 -0.22 0.00 -0.71 0.00 0.00 52.86 51.27 1t2a s ASN 203 Cb -0.08 -2.04 -0.01 0.00 0.41 0.00 0.00 41.25 39.53 1t2a s ASN 203 CO 0.00 -0.25 0.70 -0.83 -1.51 0.00 0.00 177.10 175.21 1t2a s GLY 204 N 1.63 1.77 -1.02 0.66 0.00 -0.69 -2.18 107.32 107.49 1t2a s GLY 204 Ca 0.04 -0.46 -0.12 0.00 0.00 0.00 0.00 44.72 44.18 1t2a s GLY 204 CO 0.07 1.58 1.06 -0.42 0.00 0.00 0.00 173.10 175.39 1t2a s ILE 205 N 2.70 5.59 0.01 0.90 1.01 0.50 -0.97 121.20 130.94 1t2a s ILE 205 Ca 0.29 -2.80 -0.18 0.00 0.00 0.00 0.00 60.65 57.95 1t2a s ILE 205 Cb -0.15 -4.63 -0.06 0.00 0.01 0.00 0.00 42.46 37.63 1t2a s ILE 205 CO 0.10 -1.24 0.52 -0.76 0.00 0.00 0.00 174.94 173.56 1t2a s LEU 206 N 0.06 4.45 0.71 2.97 1.02 -1.16 -1.80 118.68 124.93 1t2a s LEU 206 Ca 0.29 1.09 -0.06 0.00 0.02 0.00 0.00 54.13 55.47 1t2a s LEU 206 Cb -0.08 -2.78 0.07 0.00 0.02 0.00 0.00 46.19 43.42 1t2a s LEU 206 CO -0.07 0.21 1.02 -0.36 0.02 0.00 0.00 176.35 177.17 1t2a s PHE 207 N -0.66 2.72 0.13 0.29 0.40 -0.14 -1.15 117.98 119.57 1t2a s PHE 207 Ca 0.27 0.34 -0.35 0.00 -0.60 0.00 0.00 56.93 56.60 1t2a s PHE 207 Cb -0.18 -3.21 -0.16 0.00 0.51 0.00 0.00 43.02 39.98 1t2a s PHE 207 CO 0.16 -1.48 1.20 0.09 0.70 0.00 0.00 175.22 175.89 1t2a n ASN 208 N -2.93 1.24 -3.88 1.36 4.13 -1.22 -4.83 115.26 109.13 1t2a n ASN 208 Ca 0.09 1.13 -0.12 0.00 1.68 0.00 0.00 54.58 57.36 1t2a n ASN 208 Cb 0.60 -1.17 -0.14 0.00 -1.54 0.00 0.00 39.78 37.53 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 0.04 0.05 0.25 3.10 -3.43 -1.26 -1.62 115.29 112.41 1t2a s HIS 209 Ca 0.78 -0.02 0.02 0.00 -0.80 0.00 0.00 55.06 55.05 1t2a s HIS 209 Cb -0.93 -0.03 -0.01 0.00 -1.43 0.00 0.00 32.58 30.18 1t2a s HIS 209 CO 0.51 -0.00 0.08 0.39 -2.00 0.00 0.00 174.74 173.71 1t2a n GLU 210 N 3.04 0.79 0.00 -0.38 -0.58 0.58 -4.62 120.64 119.48 1t2a n GLU 210 Ca -0.12 -2.06 0.00 0.00 -0.42 0.00 0.00 57.16 54.56 1t2a n GLU 210 Cb 0.60 1.05 0.00 0.00 -0.57 0.00 0.00 31.44 32.52 1t2a n GLU 210 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1t2a n SER 211 N -1.68 0.00 0.07 1.62 3.41 -1.26 -0.62 113.62 115.16 1t2a n SER 211 Ca -0.04 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.65 1t2a n SER 211 Cb 0.36 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.70 1t2a n SER 211 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1t2a n PRO 212 N -0.38 0.10 -0.04 4.33 -0.02 -1.26 -1.72 135.00 136.02 1t2a n PRO 212 Ca 0.00 0.38 0.12 0.00 -2.02 0.00 0.00 63.50 61.99 1t2a n PRO 212 Cb 0.00 -1.71 0.29 0.00 -0.02 0.00 0.00 33.50 32.07 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 -1.89 2.05 -1.81 -0.52 1.74 -1.26 -5.00 116.66 109.97 1t2a n ARG 213 Ca 0.02 -1.55 -0.39 0.00 -0.77 0.00 0.00 57.85 55.16 1t2a n ARG 213 Cb 0.17 -1.47 0.02 0.00 -1.02 0.00 0.00 32.46 30.16 1t2a n ARG 213 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1t2a s ARG 214 N -1.91 3.55 0.42 5.56 6.06 -0.70 -4.53 118.95 127.41 1t2a s ARG 214 Ca 0.33 2.35 -0.26 0.00 -2.50 0.00 0.00 55.73 55.66 1t2a s ARG 214 Cb 0.20 -2.55 -0.10 0.00 0.06 0.00 0.00 34.95 32.57 1t2a s ARG 214 CO 0.31 -0.91 1.33 0.41 -2.50 0.00 0.00 175.30 173.95 1t2a n GLY 215 N 0.62 0.73 0.31 8.12 0.00 -1.26 -4.86 105.19 108.85 1t2a n GLY 215 Ca 0.06 0.21 0.17 0.00 0.00 0.00 0.00 46.02 46.47 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 2.23 1.41 -0.16 4.61 0.00 -1.91 -2.32 119.26 123.10 1t2a h ALA 216 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1t2a h ALA 216 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1t2a h ALA 216 CO 0.61 -0.04 0.00 0.27 0.00 0.00 0.00 179.25 180.09 1t2a n ASN 217 N -3.61 2.40 -4.86 0.00 6.94 -1.26 -3.16 115.26 111.72 1t2a n ASN 217 Ca -0.03 -1.81 -0.31 0.00 -0.02 0.00 0.00 54.58 52.41 1t2a n ASN 217 Cb 0.11 -0.10 -0.01 0.00 -2.36 0.00 0.00 39.78 37.42 1t2a n ASN 217 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1t2a s PHE 218 N -1.80 3.56 0.28 -2.53 0.40 -0.87 -4.89 117.98 112.12 1t2a s PHE 218 Ca 0.34 1.35 0.00 0.00 -0.60 0.00 0.00 56.93 58.02 1t2a s PHE 218 Cb 0.20 -2.74 0.42 0.00 0.51 0.00 0.00 43.02 41.41 1t2a s PHE 218 CO 0.30 -0.55 1.79 -0.24 0.70 0.00 0.00 175.22 177.22 1t2a h VAL 219 N 0.20 1.23 -0.24 -0.44 3.04 -1.89 -0.20 116.25 117.94 1t2a h VAL 219 Ca -0.45 -0.96 -0.04 0.00 -1.01 0.00 0.00 66.70 64.24 1t2a h VAL 219 Cb 1.19 0.93 -0.01 0.00 -2.01 0.00 0.00 31.29 31.39 1t2a h VAL 219 CO 0.62 0.33 -0.02 0.71 -1.01 0.00 0.00 177.57 178.20 1t2a h THR 220 N 0.65 1.27 -0.05 3.17 1.35 -1.93 -1.27 112.91 116.10 1t2a h THR 220 Ca 0.13 -0.95 -0.16 0.00 -0.55 0.00 0.00 66.41 64.88 1t2a h THR 220 Cb 0.43 1.42 -0.01 0.00 -1.73 0.00 0.00 68.15 68.26 1t2a h THR 220 CO 0.02 0.30 -0.67 -0.09 -0.25 0.00 0.00 175.52 174.82 1t2a h ARG 221 N 0.19 0.23 -0.60 4.72 9.65 -1.77 0.12 114.38 126.91 1t2a h ARG 221 Ca 0.06 -0.18 0.01 0.00 -1.10 0.00 0.00 59.98 58.78 1t2a h ARG 221 Cb 0.44 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.03 1t2a h ARG 221 CO 0.02 0.82 0.39 -0.22 2.80 0.00 0.00 179.97 183.77 1t2a h LYS 222 N 0.16 0.77 -0.12 0.20 3.64 -0.91 -0.25 116.57 120.06 1t2a h LYS 222 Ca -0.02 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 1t2a h LYS 222 Cb 1.21 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1t2a h LYS 222 CO 0.10 0.51 -0.10 0.82 -2.27 0.00 0.00 179.45 178.52 1t2a h ILE 223 N 0.80 1.34 -0.53 2.00 2.04 -0.77 -1.37 117.51 121.02 1t2a h ILE 223 Ca 0.22 -1.22 -0.08 0.00 1.00 0.00 0.00 64.86 64.79 1t2a h ILE 223 Cb -0.07 1.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1t2a h ILE 223 CO -0.06 0.35 0.02 0.77 0.00 0.00 0.00 178.15 179.24 1t2a h SER 224 N -0.10 0.84 -0.40 1.72 4.64 -0.61 0.21 113.55 119.85 1t2a h SER 224 Ca 0.02 -0.20 -0.15 0.00 -0.47 0.00 0.00 61.79 60.98 1t2a h SER 224 Cb 0.60 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1t2a h SER 224 CO 0.03 0.89 -0.35 0.03 -0.87 0.00 0.00 176.83 176.56 1t2a h ARG 225 N 0.82 0.94 -0.35 4.77 3.08 -1.04 -0.59 114.38 122.01 1t2a h ARG 225 Ca 0.16 -0.48 -0.10 0.00 0.07 0.00 0.00 59.98 59.63 1t2a h ARG 225 Cb 0.45 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1t2a h ARG 225 CO 0.02 1.14 -0.16 0.77 -1.07 0.00 0.00 179.97 180.67 1t2a h SER 226 N 0.77 0.75 -0.54 7.04 0.02 -0.89 -0.16 113.55 120.53 1t2a h SER 226 Ca 0.07 -0.40 -0.03 0.00 -0.84 0.00 0.00 61.79 60.59 1t2a h SER 226 Cb 0.94 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.25 1t2a h SER 226 CO 0.09 0.98 0.21 0.58 -1.14 0.00 0.00 176.83 177.55 1t2a h VAL 227 N 0.51 1.22 -0.59 2.27 2.07 -0.58 -0.83 116.25 120.33 1t2a h VAL 227 Ca 0.08 -0.71 0.02 0.00 0.82 0.00 0.00 66.70 66.90 1t2a h VAL 227 Cb 0.69 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 1t2a h VAL 227 CO 0.05 0.27 0.38 0.00 0.02 0.00 0.00 177.57 178.29 1t2a h ALA 228 N 1.06 0.76 -0.33 1.67 0.00 -0.90 -0.88 119.26 120.64 1t2a h ALA 228 Ca 0.18 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1t2a h ALA 228 Cb 0.22 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1t2a h ALA 228 CO -0.01 0.14 -0.01 0.87 0.00 0.00 0.00 179.25 180.24 1t2a h LYS 229 N 0.76 0.51 -0.14 0.00 1.57 -0.63 -0.54 116.57 118.10 1t2a h LYS 229 Ca 0.23 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 1t2a h LYS 229 Cb -0.04 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 1t2a h LYS 229 CO -0.07 0.54 -0.02 0.82 -0.57 0.00 0.00 179.45 180.15 1t2a h ILE 230 N 0.49 1.27 -0.92 1.86 2.04 -0.67 0.45 117.51 122.03 1t2a h ILE 230 Ca 0.11 -0.91 0.07 0.00 1.00 0.00 0.00 64.86 65.12 1t2a h ILE 230 Cb 0.33 1.59 -0.06 0.00 -0.74 0.00 0.00 36.82 37.93 1t2a h ILE 230 CO 0.01 0.27 0.58 0.22 0.00 0.00 0.00 178.15 179.23 1t2a h TYR 231 N -0.02 1.08 0.00 1.37 3.20 -0.72 -1.82 116.97 120.06 1t2a h TYR 231 Ca 0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1t2a h TYR 231 Cb 0.41 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.33 1t2a h TYR 231 CO 0.04 0.55 0.00 1.28 -1.64 0.00 0.00 178.16 178.39 1t2a n LEU 232 N -4.57 0.00 -0.35 2.82 4.77 -0.25 -4.88 117.00 114.54 1t2a n LEU 232 Ca 0.14 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.07 1t2a n LEU 232 Cb 0.19 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1t2a n LEU 232 CO 0.31 0.00 -0.04 0.61 -1.33 0.00 0.00 177.39 176.94 1t2a n GLY 233 N 0.94 0.73 0.20 -0.72 0.00 -0.63 -4.89 105.19 100.81 1t2a n GLY 233 Ca 0.22 -0.65 0.12 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.66 0.60 -3.64 1.61 6.02 0.15 -4.93 117.38 114.53 1t2a n GLN 234 Ca -0.05 -0.41 -0.13 0.00 -0.01 0.00 0.00 57.00 56.41 1t2a n GLN 234 Cb 0.18 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 29.88 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 -2.68 0.24 -0.12 1.08 2.96 -1.06 -4.92 118.68 114.18 1t2a s LEU 235 Ca 0.18 0.08 0.07 0.00 -0.22 0.00 0.00 54.13 54.24 1t2a s LEU 235 Cb 0.18 1.86 -0.13 0.00 0.50 0.00 0.00 46.19 48.61 1t2a s LEU 235 CO 0.62 -0.67 -0.01 -0.62 -1.32 0.00 0.00 176.35 174.35 1t2a n GLU 236 N 0.53 1.64 -3.50 1.98 -0.58 -1.26 -4.04 120.64 115.41 1t2a n GLU 236 Ca -0.19 0.02 -0.14 0.00 -0.42 0.00 0.00 57.16 56.43 1t2a n GLU 236 Cb 0.60 -1.29 -0.04 0.00 -0.57 0.00 0.00 31.44 30.14 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 -2.66 0.30 -0.01 0.00 -0.12 -0.47 -5.00 117.98 110.02 1t2a s PHE 238 Ca -0.04 -0.75 0.03 0.00 -0.05 0.00 0.00 56.93 56.11 1t2a s PHE 238 Cb -0.01 -0.20 -0.03 0.00 -0.63 0.00 0.00 43.02 42.15 1t2a s PHE 238 CO -0.03 -0.45 -0.06 -1.54 -0.05 0.00 0.00 175.22 173.08 1t2a s SER 239 N -2.76 4.65 0.49 1.98 1.04 -1.26 -1.09 113.70 116.76 1t2a s SER 239 Ca 0.04 -0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.36 1t2a s SER 239 Cb 0.05 -1.10 -0.01 0.00 0.10 0.00 0.00 66.02 65.06 1t2a s SER 239 CO -0.10 0.29 0.03 -0.76 0.98 0.00 0.00 173.24 173.69 1t2a s LEU 240 N -1.34 2.20 0.00 2.42 1.43 0.04 -4.90 118.68 118.53 1t2a s LEU 240 Ca 0.16 -1.68 0.00 0.00 -1.03 0.00 0.00 54.13 51.58 1t2a s LEU 240 Cb -0.11 -0.58 0.00 0.00 0.03 0.00 0.00 46.19 45.53 1t2a s LEU 240 CO 0.07 -0.90 0.00 0.61 0.23 0.00 0.00 176.35 176.36 1t2a n GLY 241 N -1.21 0.45 3.57 -3.19 0.00 -1.26 -0.51 105.19 103.03 1t2a n GLY 241 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.61 6.33 0.27 1.61 2.47 -1.26 -4.69 114.94 119.06 1t2a s ASN 242 Ca 0.00 -0.13 0.24 0.00 0.42 0.00 0.00 52.86 53.40 1t2a s ASN 242 Cb 0.00 -2.55 0.99 0.00 -1.45 0.00 0.00 41.25 38.24 1t2a s ASN 242 CO 0.00 -1.62 1.73 0.18 -3.72 0.00 0.00 177.10 173.67 1t2a n LEU 243 N 8.79 0.72 -1.08 3.21 4.77 -1.26 -3.32 117.00 128.82 1t2a n LEU 243 Ca 0.06 0.67 0.12 0.00 -0.03 0.00 0.00 56.01 56.83 1t2a n LEU 243 Cb 0.49 -0.57 0.22 0.00 -2.33 0.00 0.00 43.42 41.23 1t2a n LEU 243 CO 0.71 -0.56 0.70 0.47 -1.33 0.00 0.00 177.39 177.38 1t2a n ASP 244 N -2.28 3.26 -4.75 -1.43 8.00 -1.26 -0.97 116.55 117.12 1t2a n ASP 244 Ca 0.02 -1.97 -0.39 0.00 0.71 0.00 0.00 54.79 53.16 1t2a n ASP 244 Cb 0.24 -0.21 0.03 0.00 -0.02 0.00 0.00 41.12 41.17 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 -1.59 2.94 -0.08 2.24 0.00 -1.21 -4.78 121.76 119.28 1t2a s ALA 245 Ca 0.37 1.35 0.05 0.00 0.00 0.00 0.00 51.96 53.73 1t2a s ALA 245 Cb 0.22 -3.57 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 1t2a s ALA 245 CO 0.31 -1.30 -0.24 0.15 0.00 0.00 0.00 175.76 174.69 1t2a s LYS 246 N -2.77 2.83 0.10 0.00 1.02 -0.40 -1.56 119.74 118.96 1t2a s LYS 246 Ca 0.68 -0.88 0.01 0.00 0.02 0.00 0.00 55.97 55.81 1t2a s LYS 246 Cb -0.41 -2.26 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 1t2a s LYS 246 CO 0.50 0.28 -0.04 1.03 -0.92 0.00 0.00 175.35 176.20 1t2a s ARG 247 N 0.08 0.84 -0.40 1.68 1.81 0.28 -2.23 118.95 121.02 1t2a s ARG 247 Ca -0.11 -1.35 -0.07 0.00 -1.72 0.00 0.00 55.73 52.48 1t2a s ARG 247 Cb -0.16 -0.11 0.08 0.00 -0.45 0.00 0.00 34.95 34.31 1t2a s ARG 247 CO 0.06 -0.07 0.21 0.34 -0.68 0.00 0.00 175.30 175.17 1t2a s ASP 248 N -3.04 5.46 -0.25 0.23 3.68 -1.20 -1.17 116.67 120.38 1t2a s ASP 248 Ca 0.14 -1.58 -0.07 0.00 2.13 0.00 0.00 52.55 53.17 1t2a s ASP 248 Cb 0.06 -1.92 -0.02 0.00 -1.45 0.00 0.00 42.92 39.59 1t2a s ASP 248 CO -0.04 -0.50 0.06 0.26 0.13 0.00 0.00 175.17 175.08 1t2a s TRP 249 N 1.34 3.08 0.33 -5.34 0.51 -1.26 -3.40 118.94 114.20 1t2a s TRP 249 Ca 0.03 -0.55 0.01 0.00 -2.12 0.00 0.00 56.10 53.47 1t2a s TRP 249 Cb -0.22 -2.23 0.01 0.00 -0.81 0.00 0.00 33.47 30.22 1t2a s TRP 249 CO 0.00 -0.41 0.12 0.41 -0.51 0.00 0.00 176.95 176.56 1t2a n GLY 250 N 4.90 3.35 3.55 0.98 0.00 -0.64 -4.54 105.19 112.80 1t2a n GLY 250 Ca -0.16 -2.28 -0.35 0.00 0.00 0.00 0.00 46.02 43.23 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 -1.92 3.16 0.39 1.61 2.46 -1.26 -0.30 115.29 119.41 1t2a s HIS 251 Ca 0.09 -0.14 0.16 0.00 0.47 0.00 0.00 55.06 55.65 1t2a s HIS 251 Cb -0.01 -2.11 1.05 0.00 -0.13 0.00 0.00 32.58 31.38 1t2a s HIS 251 CO 0.06 -0.04 1.78 0.00 -2.47 0.00 0.00 174.74 174.07 1t2a h ALA 252 N 7.17 2.14 -0.63 1.58 0.00 -1.13 -0.52 119.26 127.88 1t2a h ALA 252 Ca -0.36 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1t2a h ALA 252 Cb 1.17 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1t2a h ALA 252 CO 0.65 -0.53 0.26 -0.22 0.00 0.00 0.00 179.25 179.40 1t2a h LYS 253 N 0.45 0.91 -0.30 0.00 3.64 -1.95 -1.87 116.57 117.45 1t2a h LYS 253 Ca 0.58 -0.14 -0.12 0.00 -1.27 0.00 0.00 60.65 59.70 1t2a h LYS 253 Cb 1.38 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 1t2a h LYS 253 CO -0.30 0.74 -0.31 -0.44 -2.27 0.00 0.00 179.45 176.87 1t2a h ASP 254 N 0.90 0.66 0.81 4.20 3.45 -1.51 -3.31 116.42 121.62 1t2a h ASP 254 Ca 0.21 -0.26 -0.14 0.00 0.43 0.00 0.00 57.03 57.27 1t2a h ASP 254 Cb 0.17 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 38.73 1t2a h ASP 254 CO -0.02 0.93 -0.67 1.88 -1.57 0.00 0.00 179.24 179.78 1t2a h TYR 255 N 0.55 0.00 0.00 4.55 -1.99 -0.85 -3.06 116.97 116.17 1t2a h TYR 255 Ca 0.06 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.75 1t2a h TYR 255 Cb 0.80 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.52 1t2a h TYR 255 CO 0.04 0.67 -0.23 -0.39 -0.00 0.00 0.00 178.16 178.25 1t2a h VAL 256 N 0.00 0.68 -0.78 -2.88 -1.51 -1.50 -1.72 116.25 108.55 1t2a h VAL 256 Ca -0.01 -1.00 -0.05 0.00 -1.23 0.00 0.00 66.70 64.42 1t2a h VAL 256 Cb 1.26 1.64 -0.03 0.00 -2.13 0.00 0.00 31.29 32.02 1t2a h VAL 256 CO 0.09 0.22 0.29 -0.08 -1.23 0.00 0.00 177.57 176.87 1t2a h GLU 257 N 0.00 1.17 -0.87 5.19 4.81 -1.67 -1.97 114.58 121.24 1t2a h GLU 257 Ca -0.00 -0.22 0.02 0.00 -0.13 0.00 0.00 59.36 59.02 1t2a h GLU 257 Cb 0.62 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.77 1t2a h GLU 257 CO 0.03 0.96 0.57 0.00 -0.73 0.00 0.00 179.01 179.85 1t2a h ALA 258 N 1.15 1.41 -0.52 2.92 0.00 -1.39 -1.15 119.26 121.69 1t2a h ALA 258 Ca 0.26 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.14 1t2a h ALA 258 Cb 0.24 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1t2a h ALA 258 CO -0.02 0.53 0.30 0.52 0.00 0.00 0.00 179.25 180.58 1t2a h MET 259 N 1.14 0.58 -0.55 0.00 2.86 -1.06 -0.96 114.93 116.93 1t2a h MET 259 Ca 0.33 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.83 1t2a h MET 259 Cb -0.07 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.44 1t2a h MET 259 CO -0.08 0.38 -0.06 2.35 1.06 0.00 0.00 176.91 180.55 1t2a h TRP 260 N 0.59 1.11 -0.88 -0.22 7.01 -1.11 -2.49 115.95 119.97 1t2a h TRP 260 Ca 0.21 -0.21 0.03 0.00 2.11 0.00 0.00 58.89 61.04 1t2a h TRP 260 Cb 0.05 -0.28 -0.05 0.00 -2.10 0.00 0.00 29.16 26.78 1t2a h TRP 260 CO -0.07 1.01 0.58 -0.07 -2.79 0.00 0.00 178.44 177.10 1t2a h LEU 261 N 0.91 0.95 -1.75 0.65 3.38 -0.93 -0.96 115.31 117.55 1t2a h LEU 261 Ca 0.15 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1t2a h LEU 261 Cb 0.62 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1t2a h LEU 261 CO 0.04 0.65 -0.09 0.24 0.09 0.00 0.00 178.44 179.37 1t2a h MET 262 N 1.10 0.04 -0.00 1.13 2.86 -0.72 -0.86 114.93 118.47 1t2a h MET 262 Ca 0.35 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.98 1t2a h MET 262 Cb 0.02 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.68 1t2a h MET 262 CO -0.10 0.13 -0.28 1.28 1.06 0.00 0.00 176.91 179.00 1t2a n LEU 263 N -4.41 0.59 0.02 1.22 4.32 -0.43 -3.37 117.00 114.94 1t2a n LEU 263 Ca -0.02 -0.02 0.11 0.00 -0.02 0.00 0.00 56.01 56.06 1t2a n LEU 263 Cb 0.18 -0.23 0.04 0.00 -1.62 0.00 0.00 43.42 41.80 1t2a n LEU 263 CO 0.36 0.12 0.05 0.00 -1.22 0.00 0.00 177.39 176.70 1t2a n GLN 264 N -1.12 0.24 -1.73 3.23 1.13 -0.37 -4.94 117.38 113.82 1t2a n GLN 264 Ca 0.10 -0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 54.78 1t2a n GLN 264 Cb 0.33 -1.58 0.07 0.00 0.11 0.00 0.00 30.24 29.16 1t2a n GLN 264 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1t2a n ASN 265 N -1.90 2.21 -0.26 1.08 5.15 -0.93 -4.93 115.26 115.68 1t2a n ASN 265 Ca 0.02 0.86 -0.07 0.00 -0.60 0.00 0.00 54.58 54.79 1t2a n ASN 265 Cb 0.42 -1.56 0.05 0.00 -0.53 0.00 0.00 39.78 38.16 1t2a n ASN 265 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 1t2a h ASP 266 N 0.69 1.02 -3.34 1.20 5.19 -1.92 -3.43 116.42 115.83 1t2a h ASP 266 Ca -0.51 -0.19 -0.66 0.00 -0.62 0.00 0.00 57.03 55.05 1t2a h ASP 266 Cb 1.33 -0.27 -0.19 0.00 0.18 0.00 0.00 39.33 40.39 1t2a h ASP 266 CO 0.54 0.94 -0.83 -1.83 -3.12 0.00 0.00 179.24 174.94 1t2a s GLU 267 N -5.48 1.54 -0.54 3.56 1.03 -1.26 -5.08 118.70 112.47 1t2a s GLU 267 Ca -0.12 -1.46 -0.28 0.00 0.03 0.00 0.00 54.97 53.13 1t2a s GLU 267 Cb 0.15 -1.89 0.02 0.00 -0.80 0.00 0.00 34.13 31.61 1t2a s GLU 267 CO 0.83 0.41 1.36 -1.25 -1.33 0.00 0.00 175.26 175.29 1t2a s PRO 268 N -2.54 3.40 0.24 -4.83 0.04 -1.26 -5.00 135.00 125.06 1t2a s PRO 268 Ca 0.20 0.50 0.08 0.00 0.04 0.00 0.00 61.00 61.82 1t2a s PRO 268 Cb -0.08 -4.08 -0.05 0.00 0.04 0.00 0.00 34.50 30.33 1t2a s PRO 268 CO 0.09 -1.81 -0.12 -1.21 0.04 0.00 0.00 177.00 174.00 1t2a s GLU 269 N 5.27 1.46 -0.01 4.56 2.02 -1.26 -4.93 118.70 125.81 1t2a s GLU 269 Ca 0.52 -1.69 -0.11 0.00 0.02 0.00 0.00 54.97 53.71 1t2a s GLU 269 Cb -0.10 -1.22 -0.05 0.00 0.10 0.00 0.00 34.13 32.86 1t2a s GLU 269 CO 0.27 0.14 0.32 -0.51 0.02 0.00 0.00 175.26 175.50 1t2a s ASP 270 N -3.39 6.63 -0.00 -0.19 1.01 -1.26 -4.43 116.67 115.03 1t2a s ASP 270 Ca 0.26 0.75 0.00 0.00 0.71 0.00 0.00 52.55 54.27 1t2a s ASP 270 Cb 0.01 -2.17 0.00 0.00 1.01 0.00 0.00 42.92 41.77 1t2a s ASP 270 CO 0.10 0.30 -0.00 -0.36 0.21 0.00 0.00 175.17 175.42 1t2a s PHE 271 N -1.17 0.04 0.15 4.23 0.40 -0.93 -4.99 117.98 115.71 1t2a s PHE 271 Ca 0.24 -0.00 -0.27 0.00 -0.60 0.00 0.00 56.93 56.30 1t2a s PHE 271 Cb -0.15 -0.04 -0.07 0.00 0.51 0.00 0.00 43.02 43.27 1t2a s PHE 271 CO 0.13 -0.01 0.84 0.08 0.70 0.00 0.00 175.22 176.96 1t2a s VAL 272 N 0.05 4.40 -0.10 -0.44 1.01 -1.26 -0.37 120.40 123.68 1t2a s VAL 272 Ca -0.00 1.82 0.01 0.00 0.00 0.00 0.00 61.98 63.81 1t2a s VAL 272 Cb -0.01 -4.20 0.02 0.00 0.00 0.00 0.00 36.38 32.19 1t2a s VAL 272 CO -0.00 0.45 -0.10 -0.63 0.00 0.00 0.00 175.10 174.82 1t2a s ILE 273 N -0.75 1.17 0.26 2.22 -1.09 -0.75 -4.52 121.20 117.73 1t2a s ILE 273 Ca 0.39 -0.42 -0.20 0.00 -2.23 0.00 0.00 60.65 58.20 1t2a s ILE 273 Cb -0.23 -1.13 0.07 0.00 -1.58 0.00 0.00 42.46 39.59 1t2a s ILE 273 CO 0.27 0.38 0.95 0.00 -1.23 0.00 0.00 174.94 175.31 1t2a s ALA 274 N 1.33 -1.30 -0.06 9.38 0.00 -1.26 -0.96 121.76 128.90 1t2a s ALA 274 Ca -0.01 -0.47 0.20 0.00 0.00 0.00 0.00 51.96 51.67 1t2a s ALA 274 Cb -0.14 0.73 -0.30 0.00 0.00 0.00 0.00 23.12 23.41 1t2a s ALA 274 CO -0.05 -1.04 0.38 0.25 0.00 0.00 0.00 175.76 175.31 1t2a n THR 275 N -0.63 0.22 -0.60 0.00 -2.24 -1.26 -4.78 114.28 104.99 1t2a n THR 275 Ca -0.05 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1t2a n THR 275 Cb 0.60 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 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 1.43 1.71 3.65 3.38 0.00 -1.21 -5.02 105.19 109.13 1t2a n GLY 276 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.03 3.06 -0.02 1.61 0.41 -1.26 -4.83 118.70 117.63 1t2a s GLU 277 Ca 0.00 -0.44 0.03 0.00 -0.41 0.00 0.00 54.97 54.15 1t2a s GLU 277 Cb 0.00 -2.79 -0.03 0.00 -1.78 0.00 0.00 34.13 29.53 1t2a s GLU 277 CO 0.00 0.63 -0.10 0.08 -0.49 0.00 0.00 175.26 175.38 1t2a s VAL 278 N -0.69 3.41 0.04 2.63 1.01 -1.26 -4.12 120.40 121.42 1t2a s VAL 278 Ca 0.11 -0.74 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 1t2a s VAL 278 Cb -0.12 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 1t2a s VAL 278 CO 0.02 0.49 0.06 -1.00 0.00 0.00 0.00 175.10 174.66 1t2a s HIS 279 N -0.88 0.29 0.48 5.22 3.76 -0.31 -4.94 115.29 118.90 1t2a s HIS 279 Ca 0.14 -0.67 0.02 0.00 -0.15 0.00 0.00 55.06 54.41 1t2a s HIS 279 Cb -0.11 -0.21 0.01 0.00 1.11 0.00 0.00 32.58 33.39 1t2a s HIS 279 CO 0.04 -0.37 0.68 -1.54 -0.85 0.00 0.00 174.74 172.70 1t2a s SER 280 N -2.34 5.57 0.13 1.40 1.04 -1.26 -0.56 113.70 117.69 1t2a s SER 280 Ca -0.02 0.00 -0.15 0.00 0.48 0.00 0.00 55.95 56.26 1t2a s SER 280 Cb 0.01 -1.08 0.00 0.00 0.10 0.00 0.00 66.02 65.05 1t2a s SER 280 CO -0.06 -0.88 1.65 0.58 0.98 0.00 0.00 173.24 175.51 1t2a h VAL 281 N 0.34 1.22 -0.87 5.02 2.07 -1.28 -1.74 116.25 121.02 1t2a h VAL 281 Ca -0.43 -0.75 0.16 0.00 0.82 0.00 0.00 66.70 66.50 1t2a h VAL 281 Cb 1.28 0.91 -0.10 0.00 -1.52 0.00 0.00 31.29 31.85 1t2a h VAL 281 CO 0.53 0.27 0.44 -0.09 0.02 0.00 0.00 177.57 178.74 1t2a h ARG 282 N 0.55 0.58 -0.32 1.57 2.43 -1.33 0.28 114.38 118.14 1t2a h ARG 282 Ca 0.14 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.14 1t2a h ARG 282 Cb 0.28 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1t2a h ARG 282 CO -0.00 0.38 -0.33 0.93 -1.51 0.00 0.00 179.97 179.44 1t2a h GLU 283 N 0.60 0.69 -0.66 0.20 5.08 -1.66 -0.08 114.58 118.75 1t2a h GLU 283 Ca 0.49 -0.32 -0.07 0.00 -1.00 0.00 0.00 59.36 58.46 1t2a h GLU 283 Cb 0.74 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 1t2a h GLU 283 CO -0.39 0.93 0.15 0.35 -1.00 0.00 0.00 179.01 179.04 1t2a h PHE 284 N 0.58 1.09 -0.05 4.33 3.57 -0.50 0.30 116.94 126.27 1t2a h PHE 284 Ca 0.06 -0.13 -0.00 0.00 3.53 0.00 0.00 57.97 61.44 1t2a h PHE 284 Cb 0.85 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.27 1t2a h PHE 284 CO 0.04 0.90 0.02 0.28 -2.23 0.00 0.00 178.31 177.32 1t2a h VAL 285 N 0.99 1.14 -0.28 1.41 2.07 -0.58 -1.07 116.25 119.93 1t2a h VAL 285 Ca 0.21 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 67.34 1t2a h VAL 285 Cb 0.36 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 1t2a h VAL 285 CO 0.00 0.11 0.15 -0.33 0.02 0.00 0.00 177.57 177.52 1t2a h GLU 286 N -0.08 0.29 -0.47 1.57 5.08 -0.68 -1.66 114.58 118.64 1t2a h GLU 286 Ca 0.02 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1t2a h GLU 286 Cb 0.16 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1t2a h GLU 286 CO -0.00 0.20 -0.11 0.87 -1.00 0.00 0.00 179.01 178.97 1t2a h LYS 287 N 0.30 0.86 -0.35 2.33 1.57 -0.89 -1.32 116.57 119.06 1t2a h LYS 287 Ca 0.11 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 1t2a h LYS 287 Cb 0.03 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1t2a h LYS 287 CO -0.07 0.92 0.18 0.77 -0.57 0.00 0.00 179.45 180.68 1t2a h SER 288 N 0.77 0.45 -0.39 0.86 0.02 -0.83 -2.20 113.55 112.22 1t2a h SER 288 Ca 0.13 -0.10 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1t2a h SER 288 Cb 0.61 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 1t2a h SER 288 CO 0.04 0.42 0.11 -0.26 -1.14 0.00 0.00 176.83 176.00 1t2a h PHE 289 N 0.44 0.71 -0.25 3.45 -1.00 -1.15 -1.69 116.94 117.45 1t2a h PHE 289 Ca 0.12 -0.06 -0.01 0.00 2.81 0.00 0.00 57.97 60.83 1t2a h PHE 289 Cb 0.08 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.42 1t2a h PHE 289 CO -0.02 0.61 0.10 -0.07 -1.61 0.00 0.00 178.31 177.32 1t2a h LEU 290 N 0.68 0.31 0.00 1.54 3.38 -0.74 -0.25 115.31 120.22 1t2a h LEU 290 Ca 0.15 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1t2a h LEU 290 Cb 0.26 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1t2a h LEU 290 CO -0.00 0.29 0.00 1.41 0.09 0.00 0.00 178.44 180.22 1t2a n HIS 291 N -4.43 0.00 -0.58 1.13 8.25 -0.64 -1.52 115.22 117.43 1t2a n HIS 291 Ca 0.01 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.53 1t2a n HIS 291 Cb 0.13 -0.43 0.17 0.00 1.12 0.00 0.00 29.99 30.98 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 -1.43 1.61 -0.88 1.59 -5.35 -0.22 -4.99 119.36 109.70 1t2a n ILE 292 Ca 0.06 -1.49 0.00 0.00 -0.27 0.00 0.00 62.75 61.04 1t2a n ILE 292 Cb 0.20 0.12 0.00 0.00 -1.74 0.00 0.00 39.64 38.21 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 -0.24 0.64 3.24 3.28 0.00 -0.58 -5.01 105.19 106.52 1t2a n GLY 293 Ca 0.15 -0.73 -0.24 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.83 1.28 -0.24 1.61 1.02 -0.54 -5.00 119.74 116.03 1t2a s LYS 294 Ca 0.00 -0.93 -0.04 0.00 0.02 0.00 0.00 55.97 55.02 1t2a s LYS 294 Cb 0.00 -1.39 0.00 0.00 -0.52 0.00 0.00 37.83 35.92 1t2a s LYS 294 CO 0.00 0.35 -0.01 0.99 -0.92 0.00 0.00 175.35 175.76 1t2a s THR 295 N -0.85 3.49 0.05 2.17 2.01 -1.26 -2.18 115.64 119.07 1t2a s THR 295 Ca 0.06 -0.61 -0.22 0.00 0.31 0.00 0.00 61.69 61.24 1t2a s THR 295 Cb -0.09 -2.67 -0.06 0.00 0.01 0.00 0.00 72.50 69.69 1t2a s THR 295 CO 0.02 0.30 0.66 -0.63 -0.69 0.00 0.00 174.62 174.28 1t2a s ILE 296 N 1.47 4.73 -0.11 1.82 -1.09 -1.26 -0.12 121.20 126.63 1t2a s ILE 296 Ca 0.04 1.40 0.00 0.00 -2.23 0.00 0.00 60.65 59.86 1t2a s ILE 296 Cb -0.15 -4.00 0.02 0.00 -1.58 0.00 0.00 42.46 36.75 1t2a s ILE 296 CO -0.02 0.46 -0.10 -0.69 -1.23 0.00 0.00 174.94 173.36 1t2a s VAL 297 N -0.55 1.19 0.27 2.92 1.01 -0.14 -4.91 120.40 120.19 1t2a s VAL 297 Ca 0.33 -0.42 -0.19 0.00 0.00 0.00 0.00 61.98 61.71 1t2a s VAL 297 Cb -0.20 -1.16 -0.09 0.00 0.00 0.00 0.00 36.38 34.93 1t2a s VAL 297 CO 0.20 0.39 0.76 0.26 0.00 0.00 0.00 175.10 176.71 1t2a s TRP 298 N 1.46 3.55 -0.01 5.22 0.52 -1.26 -1.62 118.94 126.79 1t2a s TRP 298 Ca 0.01 1.38 -0.11 0.00 0.02 0.00 0.00 56.10 57.41 1t2a s TRP 298 Cb -0.13 -2.63 0.01 0.00 -1.15 0.00 0.00 33.47 29.57 1t2a s TRP 298 CO -0.07 0.22 0.22 -1.83 0.02 0.00 0.00 176.95 175.52 1t2a s GLU 299 N -2.37 0.55 0.00 4.98 -1.05 -0.79 -4.99 118.70 115.03 1t2a s GLU 299 Ca 0.48 -0.26 0.00 0.00 -0.15 0.00 0.00 54.97 55.05 1t2a s GLU 299 Cb -0.14 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 33.78 1t2a s GLU 299 CO 0.20 -0.14 0.00 0.41 0.95 0.00 0.00 175.26 176.68 1t2a n GLY 300 N 1.49 -0.55 3.05 -3.83 0.00 -1.26 -0.62 105.19 103.47 1t2a n GLY 300 Ca -0.21 -1.78 -0.09 0.00 0.00 0.00 0.00 46.02 43.94 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 -1.06 0.45 3.74 1.61 1.02 -1.26 -4.56 119.74 119.68 1t2a s LYS 301 Ca 0.00 -0.76 0.00 0.00 0.02 0.00 0.00 55.97 55.23 1t2a s LYS 301 Cb 0.00 0.17 0.00 0.00 -0.52 0.00 0.00 37.83 37.48 1t2a s LYS 301 CO 0.00 -0.09 0.00 0.09 -0.92 0.00 0.00 175.35 174.43 1t2a n ASN 302 N 1.07 0.00 0.00 2.83 3.02 -1.26 -1.62 115.26 119.29 1t2a n ASN 302 Ca -0.21 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.39 1t2a n ASN 302 Cb 0.57 0.00 0.21 0.00 -0.61 0.00 0.00 39.78 39.95 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 0.02 -0.02 3.52 0.00 -1.26 -1.46 120.64 135.43 1t2a n GLU 303 Ca 0.00 0.32 0.12 0.00 0.00 0.00 0.00 57.16 57.59 1t2a n GLU 303 Cb 0.00 -1.50 0.11 0.00 0.00 0.00 0.00 31.44 30.05 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 -1.47 3.01 -4.77 -1.84 3.02 -0.64 -4.39 115.26 108.18 1t2a n ASN 304 Ca 0.03 -1.98 -0.38 0.00 -0.03 0.00 0.00 54.58 52.21 1t2a n ASN 304 Cb 0.11 -0.03 -0.00 0.00 -0.61 0.00 0.00 39.78 39.25 1t2a n ASN 304 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1t2a s GLU 305 N -1.91 3.85 0.04 3.52 2.12 -0.54 -4.34 118.70 121.44 1t2a s GLU 305 Ca 0.29 1.99 -0.00 0.00 0.36 0.00 0.00 54.97 57.61 1t2a s GLU 305 Cb 0.20 -2.60 -0.03 0.00 0.26 0.00 0.00 34.13 31.96 1t2a s GLU 305 CO 0.30 -0.54 -0.04 0.14 -0.54 0.00 0.00 175.26 174.58 1t2a s VAL 306 N -1.37 0.22 -0.20 3.70 -7.23 0.21 -3.59 120.40 112.14 1t2a s VAL 306 Ca 0.60 -1.33 -0.04 0.00 -1.81 0.00 0.00 61.98 59.41 1t2a s VAL 306 Cb -0.34 -0.85 -0.01 0.00 0.56 0.00 0.00 36.38 35.73 1t2a s VAL 306 CO 0.43 -0.70 -0.04 -0.83 -0.31 0.00 0.00 175.10 173.64 1t2a s GLY 307 N -2.12 1.63 0.01 2.32 0.00 0.38 -1.88 107.32 107.67 1t2a s GLY 307 Ca -0.05 -1.06 0.08 0.00 0.00 0.00 0.00 44.72 43.69 1t2a s GLY 307 CO -0.05 0.25 -0.24 -1.60 0.00 0.00 0.00 173.10 171.47 1t2a s ARG 308 N 1.11 2.03 0.03 2.90 3.52 -0.64 -0.53 118.95 127.38 1t2a s ARG 308 Ca 0.02 -0.98 -0.30 0.00 -0.13 0.00 0.00 55.73 54.33 1t2a s ARG 308 Cb -0.15 -2.08 -0.07 0.00 -1.56 0.00 0.00 34.95 31.10 1t2a s ARG 308 CO -0.00 0.55 1.64 0.00 -0.81 0.00 0.00 175.30 176.67 1t2a h LYS 310 N 8.66 0.39 0.08 0.00 3.64 -0.87 0.29 116.57 128.77 1t2a h LYS 310 Ca -0.42 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 58.94 1t2a h LYS 310 Cb 1.19 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1t2a h LYS 310 CO 0.93 0.26 -0.04 1.49 -2.27 0.00 0.00 179.45 179.82 1t2a h GLU 311 N 0.40 -0.11 0.00 1.90 4.81 -1.92 -3.36 114.58 116.30 1t2a h GLU 311 Ca 0.16 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1t2a h GLU 311 Cb 0.05 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1t2a h GLU 311 CO -0.10 0.42 -0.58 1.79 -0.73 0.00 0.00 179.01 179.82 1t2a h THR 312 N -0.77 0.00 0.00 0.32 1.35 -1.97 -3.48 112.91 108.37 1t2a h THR 312 Ca -0.01 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 1t2a h THR 312 Cb 0.58 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 1t2a h THR 312 CO 0.02 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 1t2a n GLY 313 N 1.29 0.51 3.81 5.82 0.00 0.09 -5.02 105.19 111.69 1t2a n GLY 313 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.43 4.32 -0.19 1.61 1.02 -1.25 -4.68 119.74 120.13 1t2a s LYS 314 Ca 0.00 0.99 -0.26 0.00 0.02 0.00 0.00 55.97 56.72 1t2a s LYS 314 Cb 0.00 -2.78 -0.01 0.00 -0.52 0.00 0.00 37.83 34.52 1t2a s LYS 314 CO 0.00 0.32 0.87 0.08 -0.92 0.00 0.00 175.35 175.70 1t2a s VAL 315 N -1.63 4.83 -0.10 3.17 1.01 -1.26 -0.15 120.40 126.27 1t2a s VAL 315 Ca 0.47 1.70 0.05 0.00 0.00 0.00 0.00 61.98 64.21 1t2a s VAL 315 Cb -0.16 -4.17 -0.07 0.00 0.00 0.00 0.00 36.38 31.98 1t2a s VAL 315 CO 0.21 -0.03 0.15 1.41 0.00 0.00 0.00 175.10 176.84 1t2a n HIS 316 N 5.56 0.00 -4.27 5.22 8.25 0.31 -4.56 115.22 125.73 1t2a n HIS 316 Ca 0.06 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.33 1t2a n HIS 316 Cb 0.48 -0.07 -0.15 0.00 1.12 0.00 0.00 29.99 31.37 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 -1.99 0.62 0.39 1.59 1.01 -0.79 -1.37 120.40 119.85 1t2a s VAL 317 Ca -0.00 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.76 1t2a s VAL 317 Cb 0.03 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.81 1t2a s VAL 317 CO 0.21 0.21 0.10 0.42 0.00 0.00 0.00 175.10 176.04 1t2a s THR 318 N 0.34 0.82 -0.03 3.92 -4.23 -0.25 -0.47 115.64 115.75 1t2a s THR 318 Ca -0.05 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.54 1t2a s THR 318 Cb -0.09 -2.48 -0.02 0.00 1.34 0.00 0.00 72.50 71.25 1t2a s THR 318 CO 0.00 0.00 -0.25 -0.69 -0.54 0.00 0.00 174.62 173.14 1t2a s VAL 319 N -3.23 2.00 -0.05 2.29 1.01 -1.24 -0.78 120.40 120.40 1t2a s VAL 319 Ca 0.27 -1.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 1t2a s VAL 319 Cb 0.05 -1.67 0.03 0.00 0.00 0.00 0.00 36.38 34.78 1t2a s VAL 319 CO 0.14 0.56 0.02 -0.62 0.00 0.00 0.00 175.10 175.20 1t2a s ASP 320 N -0.45 1.18 0.57 3.32 3.68 0.33 -4.79 116.67 120.51 1t2a s ASP 320 Ca 0.05 -0.02 0.37 0.00 2.13 0.00 0.00 52.55 55.08 1t2a s ASP 320 Cb -0.11 -0.30 2.02 0.00 -1.45 0.00 0.00 42.92 43.08 1t2a s ASP 320 CO 0.01 -0.19 2.13 -0.07 0.13 0.00 0.00 175.17 177.18 1t2a h LEU 321 N 8.09 0.00 -1.12 -1.34 3.38 -1.93 -1.08 115.31 121.31 1t2a h LEU 321 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 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 0.00 0.07 0.09 0.00 0.00 178.44 178.88 1t2a h LYS 322 N 0.00 0.00 -0.01 1.13 2.10 -1.95 -1.92 116.57 115.92 1t2a h LYS 322 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1t2a h LYS 322 Cb 0.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.40 1t2a h LYS 322 CO 0.00 0.00 -0.31 0.66 -2.00 0.00 0.00 179.45 177.80 1t2a n TYR 323 N -2.34 0.00 -1.38 0.07 4.02 -0.41 -4.95 117.16 112.18 1t2a n TYR 323 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.59 1t2a n TYR 323 Cb 0.15 -0.06 0.08 0.00 -0.02 0.00 0.00 39.34 39.50 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 -2.42 2.76 -0.00 -0.72 1.51 -0.72 -4.65 117.35 113.11 1t2a s TYR 324 Ca 0.23 1.47 0.02 0.00 -1.01 0.00 0.00 57.07 57.78 1t2a s TYR 324 Cb 0.19 -3.00 -0.03 0.00 -0.11 0.00 0.00 41.96 39.01 1t2a s TYR 324 CO 0.51 -1.64 -0.03 1.03 -1.11 0.00 0.00 175.55 174.32 1t2a s ARG 325 N -4.97 2.70 0.28 -0.62 3.00 -1.26 -5.02 118.95 113.05 1t2a s ARG 325 Ca 0.60 -0.65 0.01 0.00 0.00 0.00 0.00 55.73 55.70 1t2a s ARG 325 Cb -0.16 -2.60 0.59 0.00 0.00 0.00 0.00 34.95 32.77 1t2a s ARG 325 CO 0.56 0.62 1.79 -1.35 0.00 0.00 0.00 175.30 176.91 1t2a h PRO 326 N 4.46 0.74 -3.49 3.54 0.11 -1.97 -3.28 132.00 132.12 1t2a h PRO 326 Ca -0.49 -0.04 -0.61 0.00 0.11 0.00 0.00 66.00 64.97 1t2a h PRO 326 Cb 1.17 -0.17 -0.40 0.00 0.11 0.00 0.00 31.00 31.72 1t2a h PRO 326 CO 0.56 0.49 -0.73 0.95 -0.21 0.00 0.00 178.00 179.05 1t2a s THR 327 N -5.94 1.47 0.70 -1.15 -4.23 -1.26 -5.13 115.64 100.10 1t2a s THR 327 Ca -0.12 -2.19 -0.12 0.00 -1.18 0.00 0.00 61.69 58.08 1t2a s THR 327 Cb 0.23 -2.06 0.02 0.00 1.34 0.00 0.00 72.50 72.02 1t2a s THR 327 CO 0.79 -0.76 1.08 -0.70 -0.54 0.00 0.00 174.62 174.49 1t2a s GLU 328 N 0.82 2.76 -0.41 3.99 2.56 -1.24 -4.78 118.70 122.40 1t2a s GLU 328 Ca 0.14 1.13 -0.07 0.00 0.00 0.00 0.00 54.97 56.17 1t2a s GLU 328 Cb -0.21 -1.96 0.09 0.00 2.00 0.00 0.00 34.13 34.05 1t2a s GLU 328 CO -0.10 -1.25 0.23 0.08 -0.56 0.00 0.00 175.26 173.66 1t2a s VAL 329 N -2.80 3.87 0.21 3.70 1.01 -1.26 -4.79 120.40 120.34 1t2a s VAL 329 Ca 0.61 -1.61 0.07 0.00 0.00 0.00 0.00 61.98 61.05 1t2a s VAL 329 Cb -0.16 -3.45 -0.09 0.00 0.00 0.00 0.00 36.38 32.68 1t2a s VAL 329 CO 0.50 -0.55 1.49 0.44 0.00 0.00 0.00 175.10 176.99 1t2a h ASP 330 N 8.28 0.12 -3.66 3.32 3.45 -1.91 -3.43 116.42 122.59 1t2a h ASP 330 Ca -0.20 -0.09 -0.10 0.00 0.43 0.00 0.00 57.03 57.07 1t2a h ASP 330 Cb 1.07 -0.04 -0.24 0.00 -0.56 0.00 0.00 39.33 39.56 1t2a h ASP 330 CO 0.73 0.82 -0.20 0.12 -1.57 0.00 0.00 179.24 179.14 1t2a s PHE 331 N -3.40 -0.56 -0.07 4.55 5.36 -1.25 -1.27 117.98 121.33 1t2a s PHE 331 Ca -0.02 1.30 -0.05 0.00 -0.96 0.00 0.00 56.93 57.20 1t2a s PHE 331 Cb 0.11 0.22 0.03 0.00 -0.34 0.00 0.00 43.02 43.05 1t2a s PHE 331 CO 0.80 -0.29 0.17 -0.51 -1.46 0.00 0.00 175.22 173.93 1t2a s LEU 332 N 0.65 0.98 -0.24 6.12 1.43 -0.95 -4.67 118.68 122.00 1t2a s LEU 332 Ca -0.03 0.35 -0.04 0.00 -1.03 0.00 0.00 54.13 53.37 1t2a s LEU 332 Cb -0.05 0.51 0.12 0.00 0.03 0.00 0.00 46.19 46.81 1t2a s LEU 332 CO -0.04 -0.11 0.43 -1.58 0.23 0.00 0.00 176.35 175.28 1t2a s GLN 333 N 0.68 0.38 0.16 1.70 0.74 -1.26 -3.25 119.66 118.81 1t2a s GLN 333 Ca -0.05 0.83 -0.11 0.00 0.05 0.00 0.00 55.36 56.08 1t2a s GLN 333 Cb -0.06 0.02 -0.07 0.00 1.10 0.00 0.00 33.01 34.00 1t2a s GLN 333 CO -0.03 -0.47 0.50 0.20 -0.55 0.00 0.00 175.29 174.94 1t2a s GLY 334 N 2.63 2.35 -0.34 2.59 0.00 -1.26 -0.09 107.32 113.20 1t2a s GLY 334 Ca 0.07 -0.27 -0.04 0.00 0.00 0.00 0.00 44.72 44.48 1t2a s GLY 334 CO -0.15 -0.07 0.09 -0.35 0.00 0.00 0.00 173.10 172.61 1t2a s ASP 335 N -2.02 5.17 -0.46 1.64 3.68 -0.26 -3.32 116.67 121.10 1t2a s ASP 335 Ca 0.41 -1.33 0.04 0.00 2.13 0.00 0.00 52.55 53.79 1t2a s ASP 335 Cb -0.13 -1.81 0.49 0.00 -1.45 0.00 0.00 42.92 40.02 1t2a s ASP 335 CO 0.20 -0.34 1.66 0.00 0.13 0.00 0.00 175.17 176.82 1t2a h THR 337 N 1.33 0.66 -0.00 0.00 2.02 -1.94 -1.38 112.91 113.60 1t2a h THR 337 Ca 0.46 -0.09 0.02 0.00 0.77 0.00 0.00 66.41 67.58 1t2a h THR 337 Cb 1.44 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 1t2a h THR 337 CO 1.05 0.05 -0.13 0.50 0.37 0.00 0.00 175.52 177.35 1t2a h LYS 338 N 0.26 -0.21 -0.79 6.66 3.64 -1.92 0.51 116.57 124.72 1t2a h LYS 338 Ca 0.30 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.69 1t2a h LYS 338 Cb 0.44 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.27 1t2a h LYS 338 CO -0.39 -0.14 0.48 0.00 -2.27 0.00 0.00 179.45 177.13 1t2a h ALA 339 N 0.74 1.35 -0.48 5.00 0.00 -1.60 0.16 119.26 124.43 1t2a h ALA 339 Ca 0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1t2a h ALA 339 Cb 0.28 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1t2a h ALA 339 CO -0.13 0.56 0.19 0.87 0.00 0.00 0.00 179.25 180.73 1t2a h LYS 340 N 1.09 0.71 0.14 0.00 1.57 -0.72 0.19 116.57 119.55 1t2a h LYS 340 Ca 0.28 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1t2a h LYS 340 Cb -0.05 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.15 1t2a h LYS 340 CO -0.05 0.64 -0.07 0.37 -0.57 0.00 0.00 179.45 179.77 1t2a h GLN 341 N 0.63 -0.18 0.02 3.15 4.15 -0.45 -1.44 115.11 120.99 1t2a h GLN 341 Ca 0.16 0.01 -0.25 0.00 0.77 0.00 0.00 58.65 59.34 1t2a h GLN 341 Cb 0.20 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.89 1t2a h GLN 341 CO -0.01 0.20 -1.32 0.87 -1.93 0.00 0.00 178.83 176.63 1t2a h LYS 342 N -0.59 0.05 0.00 1.69 1.57 -0.68 -3.36 116.57 115.25 1t2a h LYS 342 Ca -0.02 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1t2a h LYS 342 Cb 0.45 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1t2a h LYS 342 CO 0.03 0.87 -1.22 1.28 -0.57 0.00 0.00 179.45 179.84 1t2a n LEU 343 N -3.28 0.44 -2.99 2.94 4.77 0.60 -4.99 117.00 114.50 1t2a n LEU 343 Ca -0.08 -0.28 -0.21 0.00 -0.03 0.00 0.00 56.01 55.40 1t2a n LEU 343 Cb 1.00 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.13 1t2a n LEU 343 CO 0.47 0.11 0.07 -3.20 -1.33 0.00 0.00 177.39 173.51 1t2a n ASN 344 N -1.70 -5.92 -4.90 -1.43 4.05 -0.54 -4.98 115.26 99.84 1t2a n ASN 344 Ca 0.00 -0.34 -0.33 0.00 0.45 0.00 0.00 54.58 54.37 1t2a n ASN 344 Cb 0.34 -4.68 -0.05 0.00 1.23 0.00 0.00 39.78 36.62 1t2a n ASN 344 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 177.26 175.07 1t2a s TRP 345 N -3.19 3.54 -0.16 1.20 -0.00 -1.21 -4.99 118.94 114.13 1t2a s TRP 345 Ca 0.36 0.48 -0.13 0.00 -0.00 0.00 0.00 56.10 56.81 1t2a s TRP 345 Cb -0.16 -1.93 0.05 0.00 -0.00 0.00 0.00 33.47 31.43 1t2a s TRP 345 CO 0.45 0.57 0.42 0.21 -0.00 0.00 0.00 176.95 178.60 1t2a s LYS 346 N -2.14 0.46 0.52 5.86 2.47 -1.26 -4.17 119.74 121.48 1t2a s LYS 346 Ca 0.32 0.65 -0.21 0.00 -1.56 0.00 0.00 55.97 55.16 1t2a s LYS 346 Cb -0.13 0.16 -0.06 0.00 -1.46 0.00 0.00 37.83 36.34 1t2a s LYS 346 CO 0.21 -0.09 1.22 -1.25 0.16 0.00 0.00 175.35 175.59 1t2a s PRO 347 N 0.59 3.41 -0.23 4.03 0.04 -1.26 -4.96 135.00 136.61 1t2a s PRO 347 Ca -0.03 1.88 0.01 0.00 0.04 0.00 0.00 61.00 62.89 1t2a s PRO 347 Cb -0.05 -2.23 -0.15 0.00 0.04 0.00 0.00 34.50 32.12 1t2a s PRO 347 CO -0.04 -0.87 -0.22 0.54 0.04 0.00 0.00 177.00 176.46 1t2a n ARG 348 N -0.93 0.58 -3.29 4.56 5.12 -1.26 -4.94 116.66 116.49 1t2a n ARG 348 Ca 0.10 0.14 -0.38 0.00 -1.93 0.00 0.00 57.85 55.78 1t2a n ARG 348 Cb 0.48 -1.46 -0.06 0.00 -1.16 0.00 0.00 32.46 30.26 1t2a n ARG 348 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1t2a s VAL 349 N -2.46 5.17 0.38 1.55 1.01 -1.26 -5.07 120.40 119.71 1t2a s VAL 349 Ca -0.32 0.97 0.04 0.00 0.00 0.00 0.00 61.98 62.67 1t2a s VAL 349 Cb 0.09 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.63 1t2a s VAL 349 CO 0.53 0.30 0.55 0.00 0.00 0.00 0.00 175.10 176.48 1t2a s ALA 350 N 0.82 3.99 0.21 5.51 0.00 -1.26 -4.57 121.76 126.46 1t2a s ALA 350 Ca 0.26 -1.25 -0.18 0.00 0.00 0.00 0.00 51.96 50.78 1t2a s ALA 350 Cb -0.15 -1.90 0.20 0.00 0.00 0.00 0.00 23.12 21.27 1t2a s ALA 350 CO 0.10 -0.17 1.58 0.35 0.00 0.00 0.00 175.76 177.62 1t2a h PHE 351 N 0.69 -0.91 -0.99 0.00 3.04 -1.98 -1.08 116.94 115.71 1t2a h PHE 351 Ca -0.46 0.08 0.04 0.00 3.98 0.00 0.00 57.97 61.61 1t2a h PHE 351 Cb 1.25 0.51 -0.06 0.00 2.56 0.00 0.00 35.95 40.21 1t2a h PHE 351 CO 0.44 -0.39 0.65 -0.44 -2.02 0.00 0.00 178.31 176.55 1t2a h ASP 352 N -0.09 1.07 0.39 0.41 3.32 -1.97 -0.41 116.42 119.15 1t2a h ASP 352 Ca 0.29 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.22 1t2a h ASP 352 Cb 0.57 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1t2a h ASP 352 CO -0.81 0.72 -0.52 -0.08 -1.72 0.00 0.00 179.24 176.84 1t2a h GLU 353 N 1.23 0.14 -0.44 3.56 4.57 -1.71 -1.94 114.58 119.99 1t2a h GLU 353 Ca 0.40 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.42 1t2a h GLU 353 Cb 0.04 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 1t2a h GLU 353 CO -0.13 0.63 -0.03 1.25 -1.18 0.00 0.00 179.01 179.55 1t2a h LEU 354 N 0.11 0.79 -0.39 1.64 5.85 0.09 -0.79 115.31 122.61 1t2a h LEU 354 Ca 0.00 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.36 1t2a h LEU 354 Cb 0.95 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1t2a h LEU 354 CO 0.07 0.92 0.08 0.58 -0.34 0.00 0.00 178.44 179.76 1t2a h VAL 355 N 0.64 1.24 -0.45 1.05 2.07 -1.07 -0.97 116.25 118.75 1t2a h VAL 355 Ca 0.12 -0.83 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 1t2a h VAL 355 Cb 0.53 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1t2a h VAL 355 CO 0.03 0.28 0.22 -0.09 0.02 0.00 0.00 177.57 178.03 1t2a h ARG 356 N 0.49 0.65 -0.47 1.57 2.43 -1.19 -0.94 114.38 116.92 1t2a h ARG 356 Ca 0.12 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1t2a h ARG 356 Cb 0.34 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1t2a h ARG 356 CO 0.00 0.56 0.29 1.49 -1.51 0.00 0.00 179.97 180.80 1t2a h GLU 357 N 0.59 0.64 -0.46 0.20 4.81 -0.96 -0.58 114.58 118.82 1t2a h GLU 357 Ca 0.16 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1t2a h GLU 357 Cb 0.12 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 1t2a h GLU 357 CO -0.02 0.46 0.07 0.52 -0.73 0.00 0.00 179.01 179.31 1t2a h MET 358 N 0.63 0.77 -0.25 1.92 2.86 -0.83 -0.14 114.93 119.89 1t2a h MET 358 Ca 0.17 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 1t2a h MET 358 Cb -0.01 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 1t2a h MET 358 CO -0.03 0.79 -0.05 0.28 1.06 0.00 0.00 176.91 178.96 1t2a h VAL 359 N 0.63 1.28 -0.77 -2.22 2.07 -1.01 -1.17 116.25 115.06 1t2a h VAL 359 Ca 0.14 -1.03 -0.06 0.00 0.82 0.00 0.00 66.70 66.57 1t2a h VAL 359 Cb 0.40 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 1t2a h VAL 359 CO 0.01 0.32 0.26 0.45 0.02 0.00 0.00 177.57 178.64 1t2a h HIS 360 N 0.22 1.21 -0.68 1.57 -0.00 -1.04 -0.73 115.15 115.71 1t2a h HIS 360 Ca 0.07 -0.11 -0.08 0.00 -0.00 0.00 0.00 60.37 60.24 1t2a h HIS 360 Cb 0.50 -0.35 -0.03 0.00 -0.00 0.00 0.00 27.41 27.53 1t2a h HIS 360 CO 0.05 0.94 0.11 0.00 -0.00 0.00 0.00 177.93 179.03 1t2a h ALA 361 N 1.14 0.91 0.00 2.45 0.00 -0.91 -2.30 119.26 120.55 1t2a h ALA 361 Ca 0.25 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1t2a h ALA 361 Cb 0.28 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1t2a h ALA 361 CO -0.01 0.67 -0.53 -0.44 0.00 0.00 0.00 179.25 178.94 1t2a h ASP 362 N 1.05 0.00 -0.42 0.00 3.45 -0.95 0.27 116.42 119.81 1t2a h ASP 362 Ca 0.21 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.63 1t2a h ASP 362 Cb 0.45 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.20 1t2a h ASP 362 CO 0.01 0.53 0.10 0.58 -1.57 0.00 0.00 179.24 178.89 1t2a h VAL 363 N 0.00 1.23 -0.49 -1.35 2.07 -0.88 -0.81 116.25 116.02 1t2a h VAL 363 Ca -0.01 -0.79 -0.12 0.00 0.82 0.00 0.00 66.70 66.61 1t2a h VAL 363 Cb 1.06 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1t2a h VAL 363 CO 0.07 0.28 -0.15 -0.33 0.02 0.00 0.00 177.57 177.46 1t2a h GLU 364 N 0.54 0.97 -0.34 1.57 4.39 -1.14 -2.03 114.58 118.54 1t2a h GLU 364 Ca 0.13 -0.38 -0.00 0.00 0.34 0.00 0.00 59.36 59.44 1t2a h GLU 364 Cb 0.31 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 1t2a h GLU 364 CO 0.00 1.06 0.20 1.25 -1.16 0.00 0.00 179.01 180.35 1t2a h LEU 365 N 0.83 0.41 -0.78 1.33 6.46 -0.80 -2.65 115.31 120.11 1t2a h LEU 365 Ca 0.12 -0.07 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 1t2a h LEU 365 Cb 0.71 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.54 1t2a h LEU 365 CO 0.05 0.36 0.00 0.24 -0.62 0.00 0.00 178.44 178.48 1t2a h MET 366 N 0.43 0.00 0.00 1.25 2.86 -1.08 -2.53 114.93 115.85 1t2a h MET 366 Ca 0.12 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1t2a h MET 366 Cb 0.03 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 1t2a h MET 366 CO -0.02 0.00 -0.01 0.00 1.06 0.00 0.00 176.91 177.94 1t2a h ARG 367 N 0.00 0.00 -0.03 1.72 3.08 -0.99 -3.51 114.38 114.65 1t2a h ARG 367 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1t2a h ARG 367 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 1t2a h ARG 367 CO 0.00 0.01 0.00 2.41 -1.07 0.00 0.00 179.97 181.32