#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a4h n ALA 54 N 0.00 -2.60 -0.71 3.04 0.00 -1.26 -4.70 120.51 114.28 2a4h n ALA 54 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2a4h n ALA 54 Cb 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2a4h n ALA 54 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2a4h n SER 55 N -2.11 -3.66 0.00 0.00 7.64 -1.26 -4.77 113.62 109.47 2a4h n SER 55 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2a4h n SER 55 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2a4h n SER 55 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2a4h n HIS 56 N -1.01 0.00 -3.38 1.43 -0.00 -1.26 -4.65 115.22 106.35 2a4h n HIS 56 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.29 2a4h n HIS 56 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 29.98 2a4h n HIS 56 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2a4h n HIS 57 N 0.00 4.93 -3.27 1.57 -0.00 -1.26 -4.93 115.22 112.26 2a4h n HIS 57 Ca 0.00 -3.89 -0.04 0.00 0.46 0.00 0.00 57.72 54.24 2a4h n HIS 57 Cb 0.00 -1.57 -0.05 0.00 -0.12 0.00 0.00 29.99 28.25 2a4h n HIS 57 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2a4h s HIS 58 N -1.40 -1.18 -0.26 1.57 -3.43 -1.26 -4.99 115.29 104.33 2a4h s HIS 58 Ca 0.30 0.99 -0.05 0.00 -0.80 0.00 0.00 55.06 55.50 2a4h s HIS 58 Cb -0.08 0.16 0.01 0.00 -1.43 0.00 0.00 32.58 31.23 2a4h s HIS 58 CO -0.08 -0.86 0.14 0.72 -2.00 0.00 0.00 174.74 172.66 2a4h n HIS 59 N 5.39 -2.89 -3.42 0.38 -0.00 -1.26 -5.05 115.22 108.37 2a4h n HIS 59 Ca -0.01 1.25 -0.04 0.00 -0.00 0.00 0.00 57.72 58.93 2a4h n HIS 59 Cb 0.51 -3.15 0.01 0.00 -0.00 0.00 0.00 29.99 27.35 2a4h n HIS 59 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2a4h n HIS 60 N 0.64 -1.50 -1.17 4.41 -0.00 -1.26 -5.14 115.22 111.20 2a4h n HIS 60 Ca 0.01 -0.81 0.00 0.00 -0.00 0.00 0.00 57.72 56.92 2a4h n HIS 60 Cb 0.24 0.40 0.00 0.00 -0.00 0.00 0.00 29.99 30.63 2a4h n HIS 60 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2a4h n HIS 61 N -0.26 -2.62 -0.12 1.57 -0.00 -1.26 -5.01 115.22 107.52 2a4h n HIS 61 Ca -0.04 1.47 -0.23 0.00 -0.00 0.00 0.00 57.72 58.93 2a4h n HIS 61 Cb 0.27 -2.79 -0.08 0.00 -0.00 0.00 0.00 29.99 27.39 2a4h n HIS 61 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2a4h n LEU 62 N 0.54 1.93 0.00 2.41 4.32 -1.26 -4.92 117.00 120.03 2a4h n LEU 62 Ca 0.00 0.37 0.00 0.00 -0.02 0.00 0.00 56.01 56.36 2a4h n LEU 62 Cb 0.00 -0.83 0.00 0.00 -1.62 0.00 0.00 43.42 40.97 2a4h n LEU 62 CO 0.00 0.29 0.00 -0.67 -1.22 0.00 0.00 177.39 175.79 2a4h n ASP 63 N -4.35 0.00 -2.66 -1.43 -0.08 -1.26 -5.03 116.55 101.74 2a4h n ASP 63 Ca -0.40 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 52.85 2a4h n ASP 63 Cb 0.74 0.00 0.08 0.00 2.34 0.00 0.00 41.12 44.28 2a4h n ASP 63 CO 0.00 0.00 0.00 1.67 0.12 0.00 0.00 177.20 178.99 2a4h n GLN 64 N -0.88 0.13 -2.44 -0.67 7.27 -1.26 -5.15 117.38 114.36 2a4h n GLN 64 Ca 0.00 -0.66 -0.39 0.00 0.07 0.00 0.00 57.00 56.02 2a4h n GLN 64 Cb 0.00 -0.09 -0.04 0.00 2.41 0.00 0.00 30.24 32.53 2a4h n GLN 64 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2a4h s GLN 65 N 0.03 4.43 -0.34 3.69 0.74 -1.26 -4.91 119.66 122.04 2a4h s GLN 65 Ca 0.15 1.77 -0.33 0.00 0.05 0.00 0.00 55.36 57.00 2a4h s GLN 65 Cb 0.23 -2.96 -0.10 0.00 1.10 0.00 0.00 33.01 31.28 2a4h s GLN 65 CO -0.15 0.03 2.22 -2.30 -0.55 0.00 0.00 175.29 174.54 2a4h n PRO 66 N 0.72 1.24 0.00 1.67 -0.02 -1.26 -4.73 135.00 132.62 2a4h n PRO 66 Ca 0.01 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 2a4h n PRO 66 Cb 0.46 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 2a4h n PRO 66 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a4h n ALA 67 N 10.54 2.59 -0.01 3.55 0.00 -1.26 -4.96 120.51 130.95 2a4h n ALA 67 Ca 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.82 2a4h n ALA 67 Cb 0.29 0.37 -0.00 0.00 0.00 0.00 0.00 19.45 20.10 2a4h n ALA 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2a4h n ALA 68 N -2.61 0.08 -0.62 0.00 0.00 -1.26 -4.99 120.51 111.11 2a4h n ALA 68 Ca 0.00 -0.21 -0.31 0.00 0.00 0.00 0.00 53.44 52.92 2a4h n ALA 68 Cb 0.37 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.01 2a4h n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2a4h n GLN 69 N -2.63 -1.19 -4.55 0.00 0.00 -1.26 -5.01 117.38 102.75 2a4h n GLN 69 Ca -0.01 -0.30 -0.33 0.00 0.00 0.00 0.00 57.00 56.35 2a4h n GLN 69 Cb 0.05 -2.18 -0.14 0.00 0.00 0.00 0.00 30.24 27.97 2a4h n GLN 69 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 2a4h s ARG 70 N -4.33 3.48 0.39 2.61 1.70 -1.26 -4.94 118.95 116.60 2a4h s ARG 70 Ca 0.65 -0.62 -0.02 0.00 -0.47 0.00 0.00 55.73 55.27 2a4h s ARG 70 Cb -0.23 -2.77 -0.04 0.00 -0.57 0.00 0.00 34.95 31.35 2a4h s ARG 70 CO 0.62 0.17 0.63 0.95 -1.08 0.00 0.00 175.30 176.60 2a4h s THR 71 N 0.50 5.03 0.40 4.99 -4.23 -1.26 -4.78 115.64 116.29 2a4h s THR 71 Ca -0.07 -0.18 0.07 0.00 -1.18 0.00 0.00 61.69 60.33 2a4h s THR 71 Cb -0.15 -3.85 -0.05 0.00 1.34 0.00 0.00 72.50 69.78 2a4h s THR 71 CO 0.04 -0.64 0.16 -0.31 -0.54 0.00 0.00 174.62 173.33 2a4h s TYR 72 N -2.45 2.61 -0.17 3.99 1.51 0.27 -4.98 117.35 118.13 2a4h s TYR 72 Ca 0.43 -0.57 0.19 0.00 -1.01 0.00 0.00 57.07 56.11 2a4h s TYR 72 Cb -0.10 -1.91 -0.08 0.00 -0.11 0.00 0.00 41.96 39.77 2a4h s TYR 72 CO 0.39 0.22 0.93 0.00 -1.11 0.00 0.00 175.55 175.97 2a4h h ALA 73 N 1.46 0.60 -2.49 3.71 0.00 -1.87 -3.29 119.26 117.38 2a4h h ALA 73 Ca -0.43 -0.52 0.10 0.00 0.00 0.00 0.00 54.91 54.06 2a4h h ALA 73 Cb 1.25 0.17 -0.12 0.00 0.00 0.00 0.00 17.79 19.09 2a4h h ALA 73 CO 0.70 0.57 0.41 0.21 0.00 0.00 0.00 179.25 181.14 2a4h s LYS 74 N -3.09 1.07 0.07 0.00 2.20 -0.81 -4.88 119.74 114.31 2a4h s LYS 74 Ca -0.02 -0.47 -0.27 0.00 -0.36 0.00 0.00 55.97 54.85 2a4h s LYS 74 Cb 0.09 0.45 0.08 0.00 -1.51 0.00 0.00 37.83 36.94 2a4h s LYS 74 CO 0.80 -0.48 0.97 0.00 -0.36 0.00 0.00 175.35 176.28 2a4h s ALA 75 N -3.35 -1.78 -0.14 3.13 0.00 -0.93 0.10 121.76 118.80 2a4h s ALA 75 Ca 0.06 0.52 -0.12 0.00 0.00 0.00 0.00 51.96 52.42 2a4h s ALA 75 Cb -0.01 0.51 0.04 0.00 0.00 0.00 0.00 23.12 23.66 2a4h s ALA 75 CO -0.06 -0.91 0.38 0.42 0.00 0.00 0.00 175.76 175.59 2a4h s ILE 76 N -3.13 -0.01 -1.02 0.00 1.01 0.45 -2.33 121.20 116.18 2a4h s ILE 76 Ca 0.10 0.02 -0.10 0.00 0.00 0.00 0.00 60.65 60.67 2a4h s ILE 76 Cb -0.01 -0.54 0.26 0.00 0.01 0.00 0.00 42.46 42.18 2a4h s ILE 76 CO -0.02 0.01 0.99 -0.22 0.00 0.00 0.00 174.94 175.69 2a4h s LEU 77 N 0.41 6.37 -0.37 2.97 2.96 -1.26 -0.31 118.68 129.45 2a4h s LEU 77 Ca -0.02 -3.37 -0.29 0.00 -0.22 0.00 0.00 54.13 50.23 2a4h s LEU 77 Cb -0.04 -2.18 0.01 0.00 0.50 0.00 0.00 46.19 44.48 2a4h s LEU 77 CO -0.02 -0.35 1.27 -1.61 -1.32 0.00 0.00 176.35 174.32 2a4h s GLU 78 N -0.90 3.80 0.28 1.98 2.02 -0.95 -1.94 118.70 123.00 2a4h s GLU 78 Ca 0.27 1.00 0.02 0.00 0.02 0.00 0.00 54.97 56.29 2a4h s GLU 78 Cb -0.10 -3.91 -0.04 0.00 0.10 0.00 0.00 34.13 30.18 2a4h s GLU 78 CO -0.08 -1.27 0.15 0.14 0.02 0.00 0.00 175.26 174.22 2a4h s VAL 79 N 4.59 0.29 0.00 2.63 -7.23 -0.39 -1.97 120.40 118.32 2a4h s VAL 79 Ca 0.55 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.72 2a4h s VAL 79 Cb -0.13 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.28 2a4h s VAL 79 CO 0.26 0.00 0.64 0.00 -0.31 0.00 0.00 175.10 175.69 2a4h n THR 81 N -0.20 0.00 0.22 0.00 -2.24 -1.26 -4.79 114.28 106.01 2a4h n THR 81 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 2a4h n THR 81 Cb 0.27 -1.43 0.31 0.00 -2.10 0.00 0.00 70.33 67.37 2a4h n THR 81 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2a4h n LYS 83 N -3.18 2.02 0.23 0.00 -0.00 -1.26 -4.24 118.16 111.73 2a4h n LYS 83 Ca 0.02 -1.00 0.18 0.00 -0.00 0.00 0.00 58.31 57.51 2a4h n LYS 83 Cb 0.50 -1.53 0.83 0.00 -0.00 0.00 0.00 35.03 34.83 2a4h n LYS 83 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.40 177.75 2a4h h PHE 84 N 1.40 0.00 0.00 5.58 3.57 -1.79 0.41 116.94 126.11 2a4h h PHE 84 Ca 0.00 0.00 -0.34 0.00 3.53 0.00 0.00 57.97 61.16 2a4h h PHE 84 Cb 0.73 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.42 2a4h h PHE 84 CO 0.29 0.00 -1.94 -2.13 -2.23 0.00 0.00 178.31 172.29 2a4h n ARG 85 N -3.39 0.57 0.15 1.11 3.00 -1.26 -4.02 116.66 112.82 2a4h n ARG 85 Ca 0.02 0.37 -0.12 0.00 -0.00 0.00 0.00 57.85 58.12 2a4h n ARG 85 Cb 0.42 -1.58 -0.07 0.00 0.00 0.00 0.00 32.46 31.23 2a4h n ARG 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2a4h h ALA 86 N -0.84 -0.43 -1.90 5.13 0.00 -1.76 -3.36 119.26 116.09 2a4h h ALA 86 Ca -0.51 -0.19 -0.69 0.00 0.00 0.00 0.00 54.91 53.52 2a4h h ALA 86 Cb 1.43 0.17 -0.35 0.00 0.00 0.00 0.00 17.79 19.03 2a4h h ALA 86 CO -0.31 -0.49 0.09 0.66 0.00 0.00 0.00 179.25 179.20 2a4h n TYR 87 N -5.09 3.31 0.29 0.00 4.01 0.14 -4.83 117.16 114.98 2a4h n TYR 87 Ca -0.09 -3.37 0.17 0.00 -0.16 0.00 0.00 57.90 54.45 2a4h n TYR 87 Cb 0.27 -0.84 0.82 0.00 -0.31 0.00 0.00 39.34 39.28 2a4h n TYR 87 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2a4h h PRO 88 N 3.97 0.00 0.02 -0.72 0.13 -1.68 -2.39 132.00 131.33 2a4h h PRO 88 Ca 0.27 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 65.15 2a4h h PRO 88 Cb 0.50 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.64 2a4h h PRO 88 CO 1.01 0.00 -1.03 1.96 -0.23 0.00 0.00 178.00 179.71 2a4h h GLN 89 N 0.00 0.57 0.00 0.86 4.20 -1.89 -2.94 115.11 115.91 2a4h h GLN 89 Ca 0.00 -0.64 0.00 0.00 0.06 0.00 0.00 58.65 58.07 2a4h h GLN 89 Cb 0.16 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.13 2a4h h GLN 89 CO 0.00 1.25 0.00 -0.89 -0.67 0.00 0.00 178.83 178.52 2a4h n ILE 90 N -3.80 0.00 -0.32 2.54 5.41 -0.90 -1.68 119.36 120.62 2a4h n ILE 90 Ca -0.10 1.31 0.35 0.00 1.00 0.00 0.00 62.75 65.31 2a4h n ILE 90 Cb 0.88 -2.16 0.74 0.00 -0.71 0.00 0.00 39.64 38.39 2a4h n ILE 90 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 2a4h h GLN 91 N 0.00 0.00 0.04 0.38 5.75 -1.72 -1.14 115.11 118.42 2a4h h GLN 91 Ca 0.00 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.51 2a4h h GLN 91 Cb 0.00 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.51 2a4h h GLN 91 CO 0.00 0.00 -0.45 0.00 -2.65 0.00 0.00 178.83 175.73 2a4h h ALA 92 N 1.30 -0.90 0.00 3.38 0.00 -1.13 0.44 119.26 122.35 2a4h h ALA 92 Ca 0.57 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.39 2a4h h ALA 92 Cb 2.38 0.86 -0.00 0.00 0.00 0.00 0.00 17.79 21.03 2a4h h ALA 92 CO -0.01 -1.02 -0.03 0.27 0.00 0.00 0.00 179.25 178.46 2a4h h PHE 93 N -0.59 0.00 -0.28 0.00 -5.15 -0.84 0.16 116.94 110.25 2a4h h PHE 93 Ca 0.00 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.72 2a4h h PHE 93 Cb 0.61 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.78 2a4h h PHE 93 CO -0.47 0.03 -0.03 0.82 -2.00 0.00 0.00 178.31 176.67 2a4h h ILE 94 N 0.00 1.27 0.00 0.88 2.04 -0.91 -2.85 117.51 117.94 2a4h h ILE 94 Ca -0.00 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.86 2a4h h ILE 94 Cb 0.06 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2a4h h ILE 94 CO 0.00 0.32 0.00 1.56 0.00 0.00 0.00 178.15 180.03 2a4h h GLN 95 N 0.28 0.00 -0.48 2.37 4.20 0.62 -3.31 115.11 118.78 2a4h h GLN 95 Ca 0.07 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.88 2a4h h GLN 95 Cb 0.48 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.16 2a4h h GLN 95 CO 0.02 0.00 -0.27 1.03 -0.67 0.00 0.00 178.83 178.94 2a4h h SER 96 N 0.00 -0.93 0.00 1.46 0.87 -0.45 -3.46 113.55 111.04 2a4h h SER 96 Ca 0.00 0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2a4h h SER 96 Cb 0.84 0.47 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 2a4h h SER 96 CO 0.00 -0.28 0.00 0.61 -0.53 0.00 0.00 176.83 176.63 2a4h n GLY 97 N -1.42 1.92 0.26 5.77 0.00 -1.25 -4.90 105.19 105.57 2a4h n GLY 97 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 2a4h n GLY 97 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2a4h h ARG 98 N 0.00 0.67 0.00 1.61 -0.00 -1.87 -1.30 114.38 113.49 2a4h h ARG 98 Ca 0.00 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.98 59.43 2a4h h ARG 98 Cb 0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 29.97 29.82 2a4h h ARG 98 CO 0.00 0.44 -0.03 -1.35 0.00 0.00 0.00 179.97 179.03 2a4h h PRO 99 N 0.69 0.00 -0.19 0.04 0.11 -1.86 -1.52 132.00 129.27 2a4h h PRO 99 Ca 0.29 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.36 2a4h h PRO 99 Cb 0.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 2a4h h PRO 99 CO -0.17 0.03 -0.08 0.00 -0.21 0.00 0.00 178.00 177.56 2a4h h ALA 100 N 1.97 1.51 0.00 -0.75 0.00 -1.56 -1.00 119.26 119.43 2a4h h ALA 100 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2a4h h ALA 100 Cb 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2a4h h ALA 100 CO 0.00 0.35 0.00 1.63 0.00 0.00 0.00 179.25 181.23 2a4h n LYS 101 N -4.29 0.12 -3.15 0.00 5.02 -0.57 -4.49 118.16 110.79 2a4h n LYS 101 Ca -0.00 0.18 -0.45 0.00 -2.02 0.00 0.00 58.31 56.01 2a4h n LYS 101 Cb 0.25 -1.66 -0.03 0.00 -0.02 0.00 0.00 35.03 33.57 2a4h n LYS 101 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2a4h s PHE 102 N -3.08 3.34 0.14 2.13 0.08 -0.38 -4.91 117.98 115.30 2a4h s PHE 102 Ca 0.10 -1.50 -0.17 0.00 0.12 0.00 0.00 56.93 55.48 2a4h s PHE 102 Cb 0.14 -4.01 0.01 0.00 -0.57 0.00 0.00 43.02 38.59 2a4h s PHE 102 CO 0.48 -1.22 1.77 -1.00 -0.10 0.00 0.00 175.22 175.15 2a4h h PRO 103 N 8.54 0.31 -0.13 0.24 0.13 -1.81 -1.21 132.00 138.06 2a4h h PRO 103 Ca -0.01 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 65.14 2a4h h PRO 103 Cb 1.05 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 2a4h h PRO 103 CO 0.97 0.20 0.29 -0.91 -0.23 0.00 0.00 178.00 178.33 2a4h h ASN 104 N 0.32 0.00 -3.46 1.44 4.21 -1.90 -3.39 115.58 112.80 2a4h h ASN 104 Ca 0.13 0.00 -0.60 0.00 1.21 0.00 0.00 56.30 57.04 2a4h h ASN 104 Cb 0.05 0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 37.14 2a4h h ASN 104 CO -0.09 0.00 -0.11 -0.22 -1.29 0.00 0.00 177.43 175.71 2a4h s LEU 105 N -6.57 4.16 -0.16 1.61 2.96 -0.46 -2.18 118.68 118.05 2a4h s LEU 105 Ca -0.04 0.62 -0.27 0.00 -0.22 0.00 0.00 54.13 54.22 2a4h s LEU 105 Cb 0.12 -2.63 -0.24 0.00 0.50 0.00 0.00 46.19 43.94 2a4h s LEU 105 CO 0.41 -0.12 0.63 -0.61 -1.32 0.00 0.00 176.35 175.34 2a4h h GLN 106 N 7.36 0.00 -4.96 1.98 5.75 -1.66 -3.46 115.11 120.12 2a4h h GLN 106 Ca -0.35 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.13 2a4h h GLN 106 Cb 1.16 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.72 2a4h h GLN 106 CO 0.73 1.00 -0.04 -0.89 -2.65 0.00 0.00 178.83 176.98 2a4h n ILE 107 N -4.56 -8.54 -3.78 2.39 2.08 -1.26 -4.89 119.36 100.81 2a4h n ILE 107 Ca -0.16 -0.25 -0.30 0.00 0.56 0.00 0.00 62.75 62.61 2a4h n ILE 107 Cb 0.53 -6.31 -0.04 0.00 -0.75 0.00 0.00 39.64 33.07 2a4h n ILE 107 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 2a4h s LYS 108 N -3.07 3.52 -0.80 0.38 2.20 -0.82 -4.89 119.74 116.26 2a4h s LYS 108 Ca 0.02 -0.32 0.02 0.00 -0.36 0.00 0.00 55.97 55.34 2a4h s LYS 108 Cb -0.00 -2.91 0.29 0.00 -1.51 0.00 0.00 37.83 33.70 2a4h s LYS 108 CO 0.62 0.49 1.15 0.66 -0.36 0.00 0.00 175.35 177.91 2a4h n TYR 109 N -0.15 3.23 -0.82 4.03 4.01 -1.25 -1.26 117.16 124.94 2a4h n TYR 109 Ca -0.04 -3.46 -0.29 0.00 -0.16 0.00 0.00 57.90 53.95 2a4h n TYR 109 Cb 0.52 -0.82 0.03 0.00 -0.31 0.00 0.00 39.34 38.76 2a4h n TYR 109 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 2a4h n VAL 110 N 0.61 0.00 -0.26 -0.72 3.14 0.42 -4.76 118.33 116.76 2a4h n VAL 110 Ca 0.32 -0.40 0.01 0.00 -2.96 0.00 0.00 64.34 61.31 2a4h n VAL 110 Cb 0.36 0.00 0.08 0.00 -1.06 0.00 0.00 33.84 33.22 2a4h n VAL 110 CO 0.00 0.00 0.00 0.03 -6.46 0.00 0.00 176.83 170.40 2a4h h ARG 111 N -0.68 -0.01 0.00 1.45 2.47 -1.98 -3.40 114.38 112.24 2a4h h ARG 111 Ca -0.34 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 2a4h h ARG 111 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.37 2a4h h ARG 111 CO 0.20 -0.01 0.00 0.41 0.56 0.00 0.00 179.97 181.14 2a4h n GLY 112 N -1.49 -1.91 0.00 0.04 0.00 -1.26 -4.96 105.19 95.61 2a4h n GLY 112 Ca 0.10 0.90 0.00 0.00 0.00 0.00 0.00 46.02 47.02 2a4h n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2a4h n LEU 113 N 0.00 0.00 -4.88 0.99 4.77 -1.26 -5.01 117.00 111.62 2a4h n LEU 113 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 2a4h n LEU 113 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2a4h n LEU 113 CO 0.00 0.00 0.23 1.51 -1.33 0.00 0.00 177.39 177.80 2a4h s ASP 114 N -0.83 6.60 -0.04 -1.43 -4.77 -1.26 -3.82 116.67 111.12 2a4h s ASP 114 Ca 0.00 0.91 -0.30 0.00 -3.30 0.00 0.00 52.55 49.87 2a4h s ASP 114 Cb 0.00 -2.22 -0.07 0.00 -1.09 0.00 0.00 42.92 39.53 2a4h s ASP 114 CO 0.00 -0.11 1.96 -2.84 0.70 0.00 0.00 175.17 174.88 2a4h s PRO 115 N -2.97 3.93 0.05 2.11 0.02 -1.25 -4.60 135.00 132.29 2a4h s PRO 115 Ca 0.47 2.39 -0.00 0.00 0.02 0.00 0.00 61.00 63.88 2a4h s PRO 115 Cb -0.11 -4.18 -0.04 0.00 0.02 0.00 0.00 34.50 30.20 2a4h s PRO 115 CO 0.23 -1.19 -0.04 0.08 -0.33 0.00 0.00 177.00 175.75 2a4h s VAL 116 N 5.21 0.30 -0.47 3.83 1.01 -0.83 -1.11 120.40 128.35 2a4h s VAL 116 Ca 0.88 -1.59 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 2a4h s VAL 116 Cb -0.39 -1.22 0.12 0.00 0.00 0.00 0.00 36.38 34.90 2a4h s VAL 116 CO 0.38 -0.83 0.31 0.68 0.00 0.00 0.00 175.10 175.64 2a4h s VAL 117 N -3.17 3.87 -0.42 2.92 -7.23 -0.69 -2.23 120.40 113.44 2a4h s VAL 117 Ca 0.02 -1.99 -0.16 0.00 -1.81 0.00 0.00 61.98 58.04 2a4h s VAL 117 Cb 0.02 -3.58 0.03 0.00 0.56 0.00 0.00 36.38 33.41 2a4h s VAL 117 CO -0.06 -0.76 0.36 -0.54 -0.31 0.00 0.00 175.10 173.78 2a4h s LYS 118 N 1.14 3.01 0.16 4.82 1.02 0.58 -2.62 119.74 127.85 2a4h s LYS 118 Ca 0.08 -0.96 -0.24 0.00 0.02 0.00 0.00 55.97 54.87 2a4h s LYS 118 Cb -0.24 -3.99 -0.08 0.00 -0.52 0.00 0.00 37.83 33.00 2a4h s LYS 118 CO -0.02 -0.82 0.74 -0.51 -0.92 0.00 0.00 175.35 173.82 2a4h s LEU 119 N 1.84 4.57 0.00 3.17 1.02 0.33 0.17 118.68 129.78 2a4h s LEU 119 Ca 0.07 1.57 0.06 0.00 0.02 0.00 0.00 54.13 55.85 2a4h s LEU 119 Cb -0.19 -3.25 -0.02 0.00 0.02 0.00 0.00 46.19 42.75 2a4h s LEU 119 CO 0.11 0.21 0.21 0.18 0.02 0.00 0.00 176.35 177.07 2a4h n LEU 120 N 1.54 0.00 0.02 1.79 4.32 0.28 0.49 117.00 125.45 2a4h n LEU 120 Ca -0.06 -2.72 -0.01 0.00 -0.02 0.00 0.00 56.01 53.20 2a4h n LEU 120 Cb 0.49 1.26 -0.00 0.00 -1.62 0.00 0.00 43.42 43.55 2a4h n LEU 120 CO 0.45 -0.44 -0.26 0.47 -1.22 0.00 0.00 177.39 176.39 2a4h n ASP 121 N -1.78 0.66 0.00 -1.43 8.00 -1.26 -1.92 116.55 118.82 2a4h n ASP 121 Ca 0.03 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.62 2a4h n ASP 121 Cb 0.52 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 2a4h n ASP 121 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2a4h n ALA 122 N -3.31 0.00 0.25 2.24 0.00 -1.26 -4.52 120.51 113.91 2a4h n ALA 122 Ca -0.01 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.55 2a4h n ALA 122 Cb 0.24 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.85 2a4h n ALA 122 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2a4h h SER 123 N 0.00 0.00 0.00 0.00 0.02 -2.04 -3.47 113.55 108.06 2a4h h SER 123 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2a4h h SER 123 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2a4h h SER 123 CO 0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 2a4h n GLY 124 N 1.15 1.17 0.19 -3.77 0.00 -1.26 -5.00 105.19 97.66 2a4h n GLY 124 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 2a4h n GLY 124 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2a4h h LYS 125 N 1.83 0.33 -3.45 1.61 1.63 -1.93 -3.48 116.57 113.11 2a4h h LYS 125 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2a4h h LYS 125 Cb 0.00 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.56 2a4h h LYS 125 CO 0.00 0.22 -0.07 0.28 -3.45 0.00 0.00 179.45 176.43 2a4h n VAL 126 N -5.01 -3.49 -0.28 2.00 0.31 -1.25 -4.93 118.33 105.68 2a4h n VAL 126 Ca 0.04 0.11 0.10 0.00 -0.01 0.00 0.00 64.34 64.58 2a4h n VAL 126 Cb 0.18 -4.51 0.24 0.00 -0.91 0.00 0.00 33.84 28.85 2a4h n VAL 126 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2a4h h GLN 127 N 0.30 0.19 -3.74 5.55 1.08 -0.26 -3.43 115.11 114.80 2a4h h GLN 127 Ca 0.00 -0.01 -0.13 0.00 -1.45 0.00 0.00 58.65 57.06 2a4h h GLN 127 Cb 0.43 -0.04 -0.19 0.00 -0.05 0.00 0.00 27.48 27.63 2a4h h GLN 127 CO 0.04 0.13 -0.52 -1.21 -0.95 0.00 0.00 178.83 176.32 2a4h s GLU 128 N -5.99 0.55 -0.27 1.46 2.02 -1.16 -4.96 118.70 110.34 2a4h s GLU 128 Ca -0.12 -0.65 -0.02 0.00 0.02 0.00 0.00 54.97 54.19 2a4h s GLU 128 Cb 0.24 0.22 0.11 0.00 0.10 0.00 0.00 34.13 34.81 2a4h s GLU 128 CO 0.77 -0.13 0.22 0.99 0.02 0.00 0.00 175.26 177.12 2a4h s THR 129 N -2.24 -0.27 -0.19 3.63 2.01 -1.25 -0.51 115.64 116.82 2a4h s THR 129 Ca -0.08 -0.51 -0.01 0.00 0.31 0.00 0.00 61.69 61.40 2a4h s THR 129 Cb -0.03 -0.92 0.00 0.00 0.01 0.00 0.00 72.50 71.56 2a4h s THR 129 CO -0.03 -0.51 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.51 2a4h s LEU 130 N 2.26 2.52 0.07 4.42 1.43 -1.08 -4.92 118.68 123.38 2a4h s LEU 130 Ca 0.09 -0.51 -0.31 0.00 -1.03 0.00 0.00 54.13 52.37 2a4h s LEU 130 Cb -0.15 -1.60 -0.08 0.00 0.03 0.00 0.00 46.19 44.38 2a4h s LEU 130 CO -0.30 0.01 1.68 -0.55 0.23 0.00 0.00 176.35 177.42 2a4h s SER 131 N 1.27 6.58 -0.12 2.29 0.15 -1.26 -1.71 113.70 120.90 2a4h s SER 131 Ca 0.03 2.51 0.17 0.00 0.70 0.00 0.00 55.95 59.36 2a4h s SER 131 Cb -0.14 -2.56 0.67 0.00 -1.71 0.00 0.00 66.02 62.28 2a4h s SER 131 CO -0.06 -0.91 1.58 2.30 1.20 0.00 0.00 173.24 177.35 2a4h n ILE 132 N 4.79 1.92 0.01 6.45 -5.35 -0.27 -4.47 119.36 122.44 2a4h n ILE 132 Ca 0.16 -1.30 0.21 0.00 -0.27 0.00 0.00 62.75 61.56 2a4h n ILE 132 Cb 0.40 0.07 0.72 0.00 -1.74 0.00 0.00 39.64 39.09 2a4h n ILE 132 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 2a4h h THR 133 N 3.59 0.61 -1.72 7.28 1.35 -1.90 -3.41 112.91 118.70 2a4h h THR 133 Ca 0.00 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 65.93 2a4h h THR 133 Cb 1.44 0.70 -0.25 0.00 -1.73 0.00 0.00 68.15 68.32 2a4h h THR 133 CO 0.24 0.00 0.24 -0.54 -0.25 0.00 0.00 175.52 175.21 2a4h s LYS 134 N -4.90 0.52 0.00 4.72 1.02 -1.26 -4.98 119.74 114.86 2a4h s LYS 134 Ca -0.05 0.88 0.00 0.00 0.02 0.00 0.00 55.97 56.82 2a4h s LYS 134 Cb 0.19 0.11 0.00 0.00 -0.52 0.00 0.00 37.83 37.61 2a4h s LYS 134 CO 0.68 -0.11 0.00 0.91 -0.92 0.00 0.00 175.35 175.92 2a4h n TRP 135 N 3.85 0.00 0.00 3.18 7.02 -1.26 -5.02 117.44 125.21 2a4h n TRP 135 Ca -0.19 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.29 2a4h n TRP 135 Cb 0.58 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.47 2a4h n TRP 135 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2a4h n ASN 136 N 0.00 0.00 -1.01 -0.99 2.85 -1.26 -5.14 115.26 109.70 2a4h n ASN 136 Ca 0.00 0.00 0.11 0.00 -0.11 0.00 0.00 54.58 54.58 2a4h n ASN 136 Cb 0.00 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 40.98 2a4h n ASN 136 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 2a4h n THR 137 N -0.38 0.00 0.00 -0.44 5.66 -1.26 -4.49 114.28 113.38 2a4h n THR 137 Ca 0.00 0.21 0.00 0.00 -3.05 0.00 0.00 64.05 61.21 2a4h n THR 137 Cb 0.00 -0.50 0.00 0.00 -1.55 0.00 0.00 70.33 68.28 2a4h n THR 137 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2a4h n ASP 138 N -4.26 0.00 -0.12 1.09 8.00 -1.26 -3.13 116.55 116.87 2a4h n ASP 138 Ca -0.01 0.00 0.27 0.00 0.71 0.00 0.00 54.79 55.76 2a4h n ASP 138 Cb 0.61 0.00 0.67 0.00 -0.02 0.00 0.00 41.12 42.38 2a4h n ASP 138 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2a4h h THR 139 N 0.00 0.27 -0.62 -3.53 2.02 -2.01 1.05 112.91 110.10 2a4h h THR 139 Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.22 2a4h h THR 139 Cb 0.00 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 66.77 2a4h h THR 139 CO 0.00 0.00 0.36 1.62 0.37 0.00 0.00 175.52 177.87 2a4h h VAL 140 N 0.00 1.03 -1.00 3.16 3.04 -1.86 0.83 116.25 121.45 2a4h h VAL 140 Ca 0.39 -0.24 0.18 0.00 -1.01 0.00 0.00 66.70 66.02 2a4h h VAL 140 Cb 1.95 0.27 -0.10 0.00 -2.01 0.00 0.00 31.29 31.40 2a4h h VAL 140 CO -0.00 0.13 0.62 -0.08 -1.01 0.00 0.00 177.57 177.22 2a4h h GLU 141 N 0.69 0.76 -0.06 4.17 4.81 0.85 0.72 114.58 126.53 2a4h h GLU 141 Ca 0.26 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.34 2a4h h GLU 141 Cb 0.09 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 2a4h h GLU 141 CO -0.13 0.50 -0.46 1.49 -0.73 0.00 0.00 179.01 179.68 2a4h h GLU 142 N 0.79 0.13 -0.78 1.92 4.81 -0.95 -3.04 114.58 117.45 2a4h h GLU 142 Ca 0.55 -0.07 0.18 0.00 -0.13 0.00 0.00 59.36 59.90 2a4h h GLU 142 Cb 0.83 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 30.09 2a4h h GLU 142 CO -0.34 0.57 0.13 0.35 -0.73 0.00 0.00 179.01 178.99 2a4h h PHE 143 N 0.11 0.17 0.21 0.92 3.57 0.27 0.19 116.94 122.38 2a4h h PHE 143 Ca 0.01 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2a4h h PHE 143 Cb 0.86 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.65 2a4h h PHE 143 CO 0.01 -0.18 -0.10 0.74 -2.23 0.00 0.00 178.31 176.55 2a4h h PHE 144 N 0.19 -0.26 -1.04 0.41 0.04 -1.41 0.17 116.94 115.04 2a4h h PHE 144 Ca 0.45 -0.01 0.30 0.00 2.80 0.00 0.00 57.97 61.52 2a4h h PHE 144 Cb 0.82 0.09 -0.04 0.00 2.20 0.00 0.00 35.95 39.02 2a4h h PHE 144 CO -0.32 -0.16 0.95 1.05 -0.60 0.00 0.00 178.31 179.22 2a4h h GLU 145 N -0.58 0.00 0.06 1.51 -0.00 -1.43 1.41 114.58 115.55 2a4h h GLU 145 Ca -0.03 0.00 -0.32 0.00 -0.00 0.00 0.00 59.36 59.01 2a4h h GLU 145 Cb 0.21 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 28.93 2a4h h GLU 145 CO 0.05 0.00 -1.78 0.25 -0.00 0.00 0.00 179.01 177.53 2a4h n THR 146 N -3.70 1.64 0.82 -1.06 -2.24 0.66 -4.25 114.28 106.15 2a4h n THR 146 Ca 0.23 -0.37 0.13 0.00 -2.27 0.00 0.00 64.05 61.77 2a4h n THR 146 Cb 1.28 -1.85 0.50 0.00 -2.10 0.00 0.00 70.33 68.17 2a4h n THR 146 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2a4h n HIS 147 N -3.92 0.43 -2.98 4.78 8.25 0.60 -4.75 115.22 117.63 2a4h n HIS 147 Ca -0.35 0.12 -0.18 0.00 -0.26 0.00 0.00 57.72 57.06 2a4h n HIS 147 Cb 0.88 -0.69 0.02 0.00 1.12 0.00 0.00 29.99 31.32 2a4h n HIS 147 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2a4h s LEU 148 N -3.71 3.53 -0.04 2.41 1.43 0.46 0.93 118.68 123.70 2a4h s LEU 148 Ca 0.12 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 2a4h s LEU 148 Cb 0.16 -2.50 0.01 0.00 0.03 0.00 0.00 46.19 43.88 2a4h s LEU 148 CO 0.57 -0.90 -0.11 0.00 0.23 0.00 0.00 176.35 176.15 2a4h s ALA 149 N -2.44 1.05 -1.39 4.21 0.00 -1.24 -4.70 121.76 117.24 2a4h s ALA 149 Ca 0.56 -0.37 -0.13 0.00 0.00 0.00 0.00 51.96 52.02 2a4h s ALA 149 Cb -0.09 -0.43 -0.02 0.00 0.00 0.00 0.00 23.12 22.57 2a4h s ALA 149 CO 0.35 0.13 2.38 1.63 0.00 0.00 0.00 175.76 180.25 2a4h n LYS 150 N 3.52 2.88 -2.20 0.00 4.76 -1.26 -4.45 118.16 121.41 2a4h n LYS 150 Ca -0.21 -2.34 -0.32 0.00 -2.87 0.00 0.00 58.31 52.57 2a4h n LYS 150 Cb 0.53 -3.07 -0.04 0.00 -1.84 0.00 0.00 35.03 30.61 2a4h n LYS 150 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2a4h s ASP 151 N 3.15 5.54 0.00 4.39 1.01 -1.26 -4.72 116.67 124.78 2a4h s ASP 151 Ca 0.54 -0.77 0.00 0.00 0.71 0.00 0.00 52.55 53.02 2a4h s ASP 151 Cb 0.15 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2a4h s ASP 151 CO -0.05 -2.36 0.00 0.61 0.21 0.00 0.00 175.17 173.58 2a4h n GLY 152 N 6.70 3.71 2.52 0.21 0.00 -1.26 -5.00 105.19 112.07 2a4h n GLY 152 Ca 0.35 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 2a4h n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a4h n ALA 153 N -1.16 4.27 0.00 4.61 0.00 -1.26 -5.03 120.51 121.94 2a4h n ALA 153 Ca 0.00 -4.78 0.00 0.00 0.00 0.00 0.00 53.44 48.66 2a4h n ALA 153 Cb 0.00 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.30 2a4h n ALA 153 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a4h n GLY 154 N 0.92 1.28 1.85 0.00 0.00 -1.26 -5.05 105.19 102.92 2a4h n GLY 154 Ca 0.29 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2a4h n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2a4h n LYS 155 N 3.82 -4.95 -3.82 1.61 5.02 -1.26 -5.09 118.16 113.49 2a4h n LYS 155 Ca 0.00 3.56 -0.09 0.00 -2.02 0.00 0.00 58.31 59.75 2a4h n LYS 155 Cb 0.00 -3.80 -0.05 0.00 -0.02 0.00 0.00 35.03 31.16 2a4h n LYS 155 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2a4h s ASN 156 N -0.80 -0.16 0.00 4.39 3.84 -1.26 -5.10 114.94 115.85 2a4h s ASN 156 Ca 0.00 -0.61 0.00 0.00 0.21 0.00 0.00 52.86 52.46 2a4h s ASN 156 Cb 0.00 0.54 0.00 0.00 -0.55 0.00 0.00 41.25 41.24 2a4h s ASN 156 CO 0.00 -1.01 0.71 -0.24 -2.79 0.00 0.00 177.10 173.77 2a4h n SER 157 N -0.31 0.00 -3.23 -4.21 2.88 -1.26 -4.83 113.62 102.66 2a4h n SER 157 Ca -0.09 0.79 -0.31 0.00 -1.33 0.00 0.00 58.87 57.93 2a4h n SER 157 Cb 0.62 -0.38 0.29 0.00 -0.75 0.00 0.00 64.21 64.00 2a4h n SER 157 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2a4h n TYR 158 N -1.65 -3.82 0.00 0.66 4.01 -1.26 -4.97 117.16 110.13 2a4h n TYR 158 Ca 0.00 -0.83 0.00 0.00 -0.16 0.00 0.00 57.90 56.91 2a4h n TYR 158 Cb 0.00 -1.25 0.00 0.00 -0.31 0.00 0.00 39.34 37.78 2a4h n TYR 158 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2a4h n SER 159 N -5.82 0.00 -3.47 7.72 7.64 -1.26 -4.96 113.62 113.47 2a4h n SER 159 Ca 0.14 0.55 -0.18 0.00 1.01 0.00 0.00 58.87 60.39 2a4h n SER 159 Cb 0.60 -0.05 -0.08 0.00 -1.01 0.00 0.00 64.21 63.67 2a4h n SER 159 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2a4h s VAL 160 N -1.19 0.00 -0.10 0.44 -7.23 -1.26 -4.88 120.40 106.18 2a4h s VAL 160 Ca 0.00 -1.95 -0.04 0.00 -1.81 0.00 0.00 61.98 58.18 2a4h s VAL 160 Cb 0.00 -2.51 0.05 0.00 0.56 0.00 0.00 36.38 34.48 2a4h s VAL 160 CO 0.00 0.00 0.19 -0.69 -0.31 0.00 0.00 175.10 174.29 2a4h s VAL 161 N -3.51 -0.26 0.11 1.32 1.01 -1.26 -5.14 120.40 112.68 2a4h s VAL 161 Ca 0.39 0.30 -0.29 0.00 0.00 0.00 0.00 61.98 62.38 2a4h s VAL 161 Cb 0.03 -0.33 -0.06 0.00 0.00 0.00 0.00 36.38 36.01 2a4h s VAL 161 CO 0.25 0.12 0.92 -1.83 0.00 0.00 0.00 175.10 174.56 2a4h s GLU 162 N 2.10 4.68 -0.09 2.72 -1.05 -1.26 -5.03 118.70 120.77 2a4h s GLU 162 Ca 0.00 1.38 -0.24 0.00 -0.15 0.00 0.00 54.97 55.96 2a4h s GLU 162 Cb -0.12 -3.36 -0.03 0.00 -0.44 0.00 0.00 34.13 30.18 2a4h s GLU 162 CO -0.07 0.27 0.73 0.34 0.95 0.00 0.00 175.26 177.48 2a4h s ASP 163 N -0.18 6.97 0.11 0.83 2.15 -1.26 -5.06 116.67 120.23 2a4h s ASP 163 Ca 0.44 1.17 -0.06 0.00 0.43 0.00 0.00 52.55 54.54 2a4h s ASP 163 Cb -0.23 -2.42 -0.05 0.00 -0.30 0.00 0.00 42.92 39.92 2a4h s ASP 163 CO 0.29 -0.18 0.36 0.00 -0.17 0.00 0.00 175.17 175.47 2a4h s ALA 164 N 1.12 3.79 0.16 3.66 0.00 -1.26 -5.10 121.76 124.13 2a4h s ALA 164 Ca 0.37 -0.53 -0.19 0.00 0.00 0.00 0.00 51.96 51.61 2a4h s ALA 164 Cb -0.17 -2.14 0.04 0.00 0.00 0.00 0.00 23.12 20.85 2a4h s ALA 164 CO 0.17 0.65 0.51 0.34 0.00 0.00 0.00 175.76 177.43 2a4h s ASP 165 N -2.20 -0.34 0.00 0.00 2.15 -1.26 -4.99 116.67 110.02 2a4h s ASP 165 Ca 0.37 -0.28 0.00 0.00 0.43 0.00 0.00 52.55 53.07 2a4h s ASP 165 Cb -0.13 0.55 0.00 0.00 -0.30 0.00 0.00 42.92 43.04 2a4h s ASP 165 CO 0.22 -0.96 0.00 0.61 -0.17 0.00 0.00 175.17 174.87 2a4h n GLY 166 N -0.31 1.53 2.81 2.66 0.00 -1.26 -5.15 105.19 105.46 2a4h n GLY 166 Ca -0.14 -0.87 -0.15 0.00 0.00 0.00 0.00 46.02 44.86 2a4h n GLY 166 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2a4h s ASP 167 N -0.31 1.09 -0.31 1.61 2.15 -1.26 -4.99 116.67 114.65 2a4h s ASP 167 Ca 0.00 -0.24 -0.10 0.00 0.43 0.00 0.00 52.55 52.64 2a4h s ASP 167 Cb 0.00 0.66 0.01 0.00 -0.30 0.00 0.00 42.92 43.29 2a4h s ASP 167 CO 0.00 -0.34 0.38 0.47 -0.17 0.00 0.00 175.17 175.52 2a4h n ASP 168 N 5.33 -6.45 0.00 -0.34 8.00 -1.26 -5.07 116.55 116.77 2a4h n ASP 168 Ca -0.04 0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.96 2a4h n ASP 168 Cb 0.49 -4.28 0.00 0.00 -0.02 0.00 0.00 41.12 37.31 2a4h n ASP 168 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2a4h n ASP 169 N -0.23 0.00 -3.98 -2.24 -0.08 -1.26 -5.07 116.55 103.69 2a4h n ASP 169 Ca 0.08 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.93 2a4h n ASP 169 Cb 0.30 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.76 2a4h n ASP 169 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2a4h n GLU 170 N 0.00 4.40 -1.81 -0.67 1.02 -1.26 -4.63 120.64 117.69 2a4h n GLU 170 Ca 0.00 -4.43 -0.17 0.00 -0.02 0.00 0.00 57.16 52.55 2a4h n GLU 170 Cb 0.00 -2.56 -0.05 0.00 -0.02 0.00 0.00 31.44 28.81 2a4h n GLU 170 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2a4h n ASP 171 N 1.62 -5.01 0.00 1.62 8.00 -1.26 -4.56 116.55 116.95 2a4h n ASP 171 Ca 0.28 0.25 0.00 0.00 0.71 0.00 0.00 54.79 56.03 2a4h n ASP 171 Cb 0.33 -4.04 0.00 0.00 -0.02 0.00 0.00 41.12 37.39 2a4h n ASP 171 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2a4h n TYR 172 N -3.10 0.00 -3.96 1.24 9.36 -1.26 -4.21 117.16 115.23 2a4h n TYR 172 Ca -0.18 0.00 -0.18 0.00 3.32 0.00 0.00 57.90 60.85 2a4h n TYR 172 Cb 0.59 0.00 -0.16 0.00 -0.63 0.00 0.00 39.34 39.14 2a4h n TYR 172 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 2a4h s LEU 173 N 0.00 1.11 0.24 2.98 1.43 -1.26 -5.02 118.68 118.15 2a4h s LEU 173 Ca 0.00 -0.05 0.06 0.00 -1.03 0.00 0.00 54.13 53.11 2a4h s LEU 173 Cb 0.00 -0.30 0.24 0.00 0.03 0.00 0.00 46.19 46.16 2a4h s LEU 173 CO 0.00 -0.10 1.54 0.03 0.23 0.00 0.00 176.35 178.05 2a4h h ARG 174 N 7.39 0.15 0.00 1.70 3.08 -1.89 -3.46 114.38 121.34 2a4h h ARG 174 Ca -0.38 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2a4h h ARG 174 Cb 1.14 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.21 2a4h h ARG 174 CO 0.44 0.75 0.00 2.41 -1.07 0.00 0.00 179.97 182.50 2a4h n THR 175 N -3.81 0.00 -2.70 2.04 -1.04 -1.26 -3.25 114.28 104.27 2a4h n THR 175 Ca -0.02 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.94 2a4h n THR 175 Cb 0.65 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 69.22 2a4h n THR 175 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2a4h n ASN 176 N 1.01 -1.91 -4.79 8.00 2.85 -1.26 -5.16 115.26 114.01 2a4h n ASN 176 Ca 0.00 -2.10 -0.35 0.00 -0.11 0.00 0.00 54.58 52.02 2a4h n ASN 176 Cb 0.00 1.08 -0.04 0.00 1.24 0.00 0.00 39.78 42.07 2a4h n ASN 176 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2a4h s ARG 177 N 0.48 3.94 0.00 1.20 1.81 -1.20 -5.32 118.95 119.86 2a4h s ARG 177 Ca 0.27 1.43 0.00 0.00 -1.72 0.00 0.00 55.73 55.72 2a4h s ARG 177 Cb 0.18 -2.27 0.00 0.00 -0.45 0.00 0.00 34.95 32.41 2a4h s ARG 177 CO -0.13 -0.33 0.46 0.44 -0.68 0.00 0.00 175.30 175.07