#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a4h s ALA 54 N 0.00 -2.08 -0.43 3.17 0.00 -1.26 -5.07 121.76 116.10 2a4h s ALA 54 Ca 0.00 1.75 -0.06 0.00 0.00 0.00 0.00 51.96 53.65 2a4h s ALA 54 Cb 0.00 -0.90 0.01 0.00 0.00 0.00 0.00 23.12 22.23 2a4h s ALA 54 CO 0.00 -0.37 0.48 0.43 0.00 0.00 0.00 175.76 176.30 2a4h n SER 55 N 0.35 -6.38 -3.66 0.00 7.64 -1.26 -5.07 113.62 105.25 2a4h n SER 55 Ca -0.02 0.19 -0.09 0.00 1.01 0.00 0.00 58.87 59.96 2a4h n SER 55 Cb 0.58 -4.24 -0.10 0.00 -1.01 0.00 0.00 64.21 59.44 2a4h n SER 55 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2a4h s HIS 56 N -2.57 -0.74 0.38 1.43 5.65 -1.26 -5.09 115.29 113.10 2a4h s HIS 56 Ca 0.10 1.43 0.00 0.00 0.25 0.00 0.00 55.06 56.84 2a4h s HIS 56 Cb -0.03 0.25 0.00 0.00 -1.18 0.00 0.00 32.58 31.62 2a4h s HIS 56 CO 0.56 -0.46 0.00 0.72 -0.65 0.00 0.00 174.74 174.92 2a4h n HIS 57 N 5.35 -3.06 0.00 3.88 -0.00 -1.26 -4.71 115.22 115.43 2a4h n HIS 57 Ca -0.09 1.59 0.00 0.00 -0.00 0.00 0.00 57.72 59.23 2a4h n HIS 57 Cb 0.50 -2.78 0.00 0.00 -0.00 0.00 0.00 29.99 27.71 2a4h n HIS 57 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2a4h n HIS 58 N -3.94 0.00 -2.48 4.41 -0.00 -1.26 -4.78 115.22 107.16 2a4h n HIS 58 Ca -0.03 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.65 2a4h n HIS 58 Cb 0.55 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.51 2a4h n HIS 58 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2a4h n HIS 59 N 0.00 -3.86 -3.21 1.57 -0.00 -1.26 -5.07 115.22 103.40 2a4h n HIS 59 Ca 0.00 2.12 -0.00 0.00 -0.00 0.00 0.00 57.72 59.84 2a4h n HIS 59 Cb 0.00 -3.66 -0.03 0.00 -0.00 0.00 0.00 29.99 26.30 2a4h n HIS 59 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2a4h s HIS 60 N -0.80 -1.48 0.00 1.57 2.46 -1.26 -5.02 115.29 110.76 2a4h s HIS 60 Ca -0.19 1.11 0.00 0.00 0.47 0.00 0.00 55.06 56.45 2a4h s HIS 60 Cb 0.01 0.27 0.00 0.00 -0.13 0.00 0.00 32.58 32.73 2a4h s HIS 60 CO 0.70 -0.95 0.00 1.58 -2.47 0.00 0.00 174.74 173.60 2a4h n HIS 61 N 5.40 -0.49 -2.68 3.88 -0.00 -1.26 -5.12 115.22 114.94 2a4h n HIS 61 Ca 0.01 0.02 -0.03 0.00 -0.00 0.00 0.00 57.72 57.72 2a4h n HIS 61 Cb 0.52 0.13 -0.03 0.00 -0.00 0.00 0.00 29.99 30.61 2a4h n HIS 61 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 2a4h n LEU 62 N -1.75 -5.38 -3.34 0.27 7.94 -1.26 -5.04 117.00 108.45 2a4h n LEU 62 Ca 0.00 1.90 -0.10 0.00 -1.11 0.00 0.00 56.01 56.70 2a4h n LEU 62 Cb 0.00 -2.65 -0.08 0.00 0.53 0.00 0.00 43.42 41.22 2a4h n LEU 62 CO 0.00 -3.43 -0.08 -0.62 -1.11 0.00 0.00 177.39 172.15 2a4h s ASP 63 N -0.41 0.50 0.22 1.96 2.15 -1.26 -5.01 116.67 114.81 2a4h s ASP 63 Ca -0.16 -0.13 0.00 0.00 0.43 0.00 0.00 52.55 52.70 2a4h s ASP 63 Cb 0.01 1.02 0.00 0.00 -0.30 0.00 0.00 42.92 43.65 2a4h s ASP 63 CO 0.42 -0.33 0.00 0.00 -0.17 0.00 0.00 175.17 175.09 2a4h n GLN 64 N 5.35 0.00 -1.44 4.34 6.02 -1.26 -5.17 117.38 125.22 2a4h n GLN 64 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 2a4h n GLN 64 Cb 0.49 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.75 2a4h n GLN 64 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2a4h n GLN 65 N -2.99 -4.05 -0.01 -1.09 7.27 -1.26 -5.03 117.38 110.22 2a4h n GLN 65 Ca 0.00 2.92 0.00 0.00 0.07 0.00 0.00 57.00 59.99 2a4h n GLN 65 Cb 0.00 -3.22 0.00 0.00 2.41 0.00 0.00 30.24 29.43 2a4h n GLN 65 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 2a4h n PRO 66 N 0.24 0.41 0.16 3.69 -0.04 -1.26 -5.00 135.00 133.21 2a4h n PRO 66 Ca 0.00 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.32 2a4h n PRO 66 Cb 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.38 2a4h n PRO 66 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a4h h ALA 67 N -1.96 -0.38 -3.00 0.55 0.00 -2.09 -3.44 119.26 108.93 2a4h h ALA 67 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2a4h h ALA 67 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2a4h h ALA 67 CO 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 179.25 178.62 2a4h n ALA 68 N -2.35 0.00 -2.59 0.00 0.00 -1.26 -5.08 120.51 109.24 2a4h n ALA 68 Ca -0.10 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.06 2a4h n ALA 68 Cb 0.22 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.57 2a4h n ALA 68 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2a4h s GLN 69 N -1.91 2.14 -0.54 0.00 0.00 -1.26 -5.05 119.66 113.03 2a4h s GLN 69 Ca 0.00 -1.10 0.05 0.00 -0.00 0.00 0.00 55.36 54.31 2a4h s GLN 69 Cb 0.00 -2.27 0.37 0.00 0.00 0.00 0.00 33.01 31.11 2a4h s GLN 69 CO 0.00 0.48 1.04 2.89 0.00 0.00 0.00 175.29 179.70 2a4h n ARG 70 N 0.43 3.36 -0.82 9.60 1.85 -1.26 -5.09 116.66 124.73 2a4h n ARG 70 Ca -0.12 -4.72 -0.29 0.00 -1.00 0.00 0.00 57.85 51.72 2a4h n ARG 70 Cb 0.53 -2.25 0.03 0.00 -1.05 0.00 0.00 32.46 29.72 2a4h n ARG 70 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 2a4h n THR 71 N -0.33 0.00 -3.91 8.89 -2.24 -1.26 -5.01 114.28 110.41 2a4h n THR 71 Ca 0.35 -0.40 -0.08 0.00 -2.27 0.00 0.00 64.05 61.64 2a4h n THR 71 Cb 0.48 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.70 2a4h n THR 71 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2a4h n TYR 72 N -1.94 -0.45 -0.01 4.78 4.01 0.43 -4.97 117.16 119.01 2a4h n TYR 72 Ca -0.01 -0.68 0.00 0.00 -0.16 0.00 0.00 57.90 57.05 2a4h n TYR 72 Cb 0.44 -0.11 -0.02 0.00 -0.31 0.00 0.00 39.34 39.35 2a4h n TYR 72 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2a4h n ALA 73 N -2.61 2.02 -2.48 -0.72 0.00 -1.26 -4.16 120.51 111.30 2a4h n ALA 73 Ca -0.05 -0.09 -0.08 0.00 0.00 0.00 0.00 53.44 53.22 2a4h n ALA 73 Cb 0.18 0.07 -0.09 0.00 0.00 0.00 0.00 19.45 19.60 2a4h n ALA 73 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2a4h s LYS 74 N -2.09 0.60 -0.17 0.00 2.20 -1.06 -4.60 119.74 114.62 2a4h s LYS 74 Ca -0.01 -0.95 -0.33 0.00 -0.36 0.00 0.00 55.97 54.32 2a4h s LYS 74 Cb 0.01 0.23 0.14 0.00 -1.51 0.00 0.00 37.83 36.69 2a4h s LYS 74 CO 0.08 -0.14 1.15 0.00 -0.36 0.00 0.00 175.35 176.08 2a4h s ALA 75 N -3.18 -2.02 -0.10 3.13 0.00 0.30 -0.20 121.76 119.69 2a4h s ALA 75 Ca -0.00 1.53 -0.05 0.00 0.00 0.00 0.00 51.96 53.44 2a4h s ALA 75 Cb 0.02 -0.20 0.05 0.00 0.00 0.00 0.00 23.12 22.99 2a4h s ALA 75 CO -0.07 -0.55 0.23 0.42 0.00 0.00 0.00 175.76 175.78 2a4h s ILE 76 N -2.29 -0.09 -1.04 0.00 1.01 0.18 -1.04 121.20 117.93 2a4h s ILE 76 Ca 0.08 0.18 -0.12 0.00 0.00 0.00 0.00 60.65 60.78 2a4h s ILE 76 Cb -0.01 -0.36 0.24 0.00 0.01 0.00 0.00 42.46 42.34 2a4h s ILE 76 CO -0.05 0.07 1.07 -0.22 0.00 0.00 0.00 174.94 175.81 2a4h s LEU 77 N 1.40 6.18 -0.25 2.97 2.96 -1.26 -1.07 118.68 129.60 2a4h s LEU 77 Ca -0.08 -3.16 -0.29 0.00 -0.22 0.00 0.00 54.13 50.38 2a4h s LEU 77 Cb -0.11 -2.25 0.01 0.00 0.50 0.00 0.00 46.19 44.34 2a4h s LEU 77 CO -0.08 -0.48 1.08 -1.61 -1.32 0.00 0.00 176.35 173.94 2a4h s GLU 78 N -0.20 4.19 0.17 1.98 2.02 -1.04 -2.13 118.70 123.69 2a4h s GLU 78 Ca 0.29 1.30 -0.01 0.00 0.02 0.00 0.00 54.97 56.57 2a4h s GLU 78 Cb -0.09 -3.69 -0.04 0.00 0.10 0.00 0.00 34.13 30.42 2a4h s GLU 78 CO -0.07 -0.73 0.09 0.14 0.02 0.00 0.00 175.26 174.71 2a4h s VAL 79 N 3.39 0.05 0.00 2.63 -7.23 -0.60 -1.98 120.40 116.66 2a4h s VAL 79 Ca 0.46 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.67 2a4h s VAL 79 Cb -0.15 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.51 2a4h s VAL 79 CO 0.10 -0.23 0.63 0.00 -0.31 0.00 0.00 175.10 175.29 2a4h n THR 81 N -0.19 0.00 0.17 0.00 -2.24 -1.26 -4.81 114.28 105.95 2a4h n THR 81 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 2a4h n THR 81 Cb 0.18 -1.31 0.21 0.00 -2.10 0.00 0.00 70.33 67.32 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 -3.34 2.13 0.03 0.00 -0.00 -1.26 -4.28 118.16 111.45 2a4h n LYS 83 Ca 0.01 -1.09 0.22 0.00 -0.00 0.00 0.00 58.31 57.45 2a4h n LYS 83 Cb 0.60 -1.57 0.72 0.00 -0.00 0.00 0.00 35.03 34.78 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 1.51 0.00 0.00 5.58 3.04 -1.79 0.75 116.94 126.04 2a4h h PHE 84 Ca 0.00 0.00 -0.23 0.00 3.98 0.00 0.00 57.97 61.72 2a4h h PHE 84 Cb 0.79 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.26 2a4h h PHE 84 CO 0.32 0.00 -1.24 -0.09 -2.02 0.00 0.00 178.31 175.28 2a4h h ARG 85 N 0.00 0.00 0.29 1.11 9.65 -1.88 -3.28 114.38 120.27 2a4h h ARG 85 Ca 0.25 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.11 2a4h h ARG 85 Cb 1.29 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 2a4h h ARG 85 CO -0.00 1.00 -0.14 0.00 2.80 0.00 0.00 179.97 183.62 2a4h h ALA 86 N -0.49 -0.39 -1.86 2.80 0.00 -1.64 -3.37 119.26 114.30 2a4h h ALA 86 Ca -0.34 -0.16 -0.68 0.00 0.00 0.00 0.00 54.91 53.72 2a4h h ALA 86 Cb 1.30 0.15 -0.36 0.00 0.00 0.00 0.00 17.79 18.88 2a4h h ALA 86 CO -0.21 -0.41 0.06 0.66 0.00 0.00 0.00 179.25 179.35 2a4h n TYR 87 N -5.04 3.53 0.21 0.00 4.01 0.26 -4.82 117.16 115.30 2a4h n TYR 87 Ca -0.07 -3.40 0.09 0.00 -0.16 0.00 0.00 57.90 54.36 2a4h n TYR 87 Cb 0.23 -0.78 0.46 0.00 -0.31 0.00 0.00 39.34 38.94 2a4h n TYR 87 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2a4h n PRO 88 N -0.16 0.12 0.11 -0.72 -0.04 -1.18 -2.10 135.00 131.04 2a4h n PRO 88 Ca 0.38 0.54 -0.23 0.00 -0.04 0.00 0.00 63.50 64.15 2a4h n PRO 88 Cb 0.34 -1.84 -0.14 0.00 -0.04 0.00 0.00 33.50 31.81 2a4h n PRO 88 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2a4h h GLN 89 N 0.00 0.58 0.00 0.54 3.07 -1.89 -3.08 115.11 114.33 2a4h h GLN 89 Ca 0.00 -0.85 0.00 0.00 0.09 0.00 0.00 58.65 57.89 2a4h h GLN 89 Cb 0.10 0.30 0.00 0.00 0.08 0.00 0.00 27.48 27.96 2a4h h GLN 89 CO 0.00 1.40 0.00 -0.89 0.09 0.00 0.00 178.83 179.43 2a4h n ILE 90 N -3.79 0.00 -0.06 1.86 5.41 -0.89 -1.59 119.36 120.30 2a4h n ILE 90 Ca -0.15 0.96 0.25 0.00 1.00 0.00 0.00 62.75 64.81 2a4h n ILE 90 Cb 1.02 -1.73 0.62 0.00 -0.71 0.00 0.00 39.64 38.84 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 -0.25 0.38 4.15 -1.77 0.31 115.11 117.93 2a4h h GLN 91 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.48 2a4h h GLN 91 Cb 0.00 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.62 2a4h h GLN 91 CO 0.00 0.00 -0.29 0.00 -1.93 0.00 0.00 178.83 176.61 2a4h h ALA 92 N 1.08 -0.23 -0.06 3.38 0.00 -1.20 0.53 119.26 122.76 2a4h h ALA 92 Ca 0.34 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.22 2a4h h ALA 92 Cb 1.94 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 20.32 2a4h h ALA 92 CO -0.00 -0.73 -0.44 0.27 0.00 0.00 0.00 179.25 178.35 2a4h h PHE 93 N -0.30 0.16 -0.45 0.00 -5.15 -0.57 0.19 116.94 110.82 2a4h h PHE 93 Ca 0.13 -0.04 -0.03 0.00 -0.20 0.00 0.00 57.97 57.83 2a4h h PHE 93 Cb 0.51 -0.03 -0.02 0.00 0.22 0.00 0.00 35.95 36.63 2a4h h PHE 93 CO -0.44 0.55 0.15 0.82 -2.00 0.00 0.00 178.31 177.39 2a4h h ILE 94 N 0.11 1.18 0.00 0.88 2.04 -0.80 -2.29 117.51 118.63 2a4h h ILE 94 Ca 0.01 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.26 2a4h h ILE 94 Cb 0.82 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 2a4h h ILE 94 CO 0.06 0.23 -1.10 0.00 0.00 0.00 0.00 178.15 177.34 2a4h n GLN 95 N -4.34 0.51 0.01 2.37 6.02 0.17 -4.46 117.38 117.67 2a4h n GLN 95 Ca 0.03 0.05 -0.02 0.00 -0.01 0.00 0.00 57.00 57.05 2a4h n GLN 95 Cb 0.17 -1.72 -0.01 0.00 1.02 0.00 0.00 30.24 29.70 2a4h n GLN 95 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2a4h h SER 96 N 0.00 -0.20 0.00 1.08 0.87 -0.01 -3.47 113.55 111.81 2a4h h SER 96 Ca 0.00 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2a4h h SER 96 Cb 0.92 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 2a4h h SER 96 CO 0.00 -0.07 0.00 0.61 -0.53 0.00 0.00 176.83 176.84 2a4h n GLY 97 N -1.06 0.64 0.20 5.77 0.00 -1.24 -5.02 105.19 104.49 2a4h n GLY 97 Ca -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 0.62 0.00 1.61 -0.00 -1.92 -2.37 114.38 112.33 2a4h h ARG 98 Ca 0.00 -0.09 0.00 0.00 -0.50 0.00 0.00 59.98 59.39 2a4h h ARG 98 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 29.97 29.86 2a4h h ARG 98 CO 0.00 0.52 0.00 -1.35 0.00 0.00 0.00 179.97 179.14 2a4h h PRO 99 N 0.56 0.00 -0.01 0.04 0.11 -1.88 -2.44 132.00 128.39 2a4h h PRO 99 Ca 0.15 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.16 2a4h h PRO 99 Cb 0.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 2a4h h PRO 99 CO -0.02 0.00 -0.45 0.00 -0.21 0.00 0.00 178.00 177.32 2a4h h ALA 100 N 2.06 1.24 0.00 -0.75 0.00 -1.72 -2.43 119.26 117.66 2a4h h ALA 100 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2a4h h ALA 100 Cb 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2a4h h ALA 100 CO 0.00 0.57 0.00 0.87 0.00 0.00 0.00 179.25 180.69 2a4h h LYS 101 N 0.02 0.00 -6.03 0.00 1.57 -1.42 -3.42 116.57 107.30 2a4h h LYS 101 Ca -0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 2a4h h LYS 101 Cb 0.80 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.00 2a4h h LYS 101 CO 0.06 0.00 0.67 -0.06 -0.57 0.00 0.00 179.45 179.55 2a4h s PHE 102 N -3.36 2.73 0.03 -1.35 0.08 -0.91 -4.93 117.98 110.27 2a4h s PHE 102 Ca 0.05 0.07 -0.27 0.00 0.12 0.00 0.00 56.93 56.90 2a4h s PHE 102 Cb 0.09 -4.20 -0.17 0.00 -0.57 0.00 0.00 43.02 38.17 2a4h s PHE 102 CO 0.54 -1.43 1.41 -1.00 -0.10 0.00 0.00 175.22 174.63 2a4h h PRO 103 N 9.39 -0.44 -0.05 0.24 0.13 -1.81 -2.79 132.00 136.67 2a4h h PRO 103 Ca -0.26 0.03 0.02 0.00 -0.87 0.00 0.00 66.00 64.92 2a4h h PRO 103 Cb 1.07 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2a4h h PRO 103 CO 1.12 -0.17 0.23 -0.91 -0.23 0.00 0.00 178.00 178.04 2a4h h ASN 104 N -0.67 0.00 -2.96 1.44 2.35 -1.81 -3.36 115.58 110.57 2a4h h ASN 104 Ca -0.05 0.00 -0.65 0.00 -0.55 0.00 0.00 56.30 55.06 2a4h h ASN 104 Cb 0.47 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 38.69 2a4h h ASN 104 CO 0.08 0.00 0.38 -0.22 -1.65 0.00 0.00 177.43 176.02 2a4h s LEU 105 N -6.26 4.58 0.09 1.61 2.96 -1.05 -0.54 118.68 120.07 2a4h s LEU 105 Ca -0.04 -0.87 -0.24 0.00 -0.22 0.00 0.00 54.13 52.76 2a4h s LEU 105 Cb 0.11 -2.52 -0.14 0.00 0.50 0.00 0.00 46.19 44.14 2a4h s LEU 105 CO 0.37 -1.22 1.73 -0.61 -1.32 0.00 0.00 176.35 175.30 2a4h h GLN 106 N 9.32 -0.08 -4.88 1.98 5.75 -1.24 -3.46 115.11 122.50 2a4h h GLN 106 Ca -0.28 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.23 2a4h h GLN 106 Cb 1.08 0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.65 2a4h h GLN 106 CO 1.10 -0.05 -0.02 -0.89 -2.65 0.00 0.00 178.83 176.32 2a4h n ILE 107 N -5.13 -8.35 -3.77 2.39 2.08 -1.26 -4.88 119.36 100.43 2a4h n ILE 107 Ca -0.07 -0.14 -0.27 0.00 0.56 0.00 0.00 62.75 62.82 2a4h n ILE 107 Cb 0.07 -6.25 -0.03 0.00 -0.75 0.00 0.00 39.64 32.67 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 -2.96 3.49 -0.79 0.38 2.20 -0.90 -4.90 119.74 116.25 2a4h s LYS 108 Ca 0.01 -0.42 0.02 0.00 -0.36 0.00 0.00 55.97 55.22 2a4h s LYS 108 Cb -0.00 -2.88 0.32 0.00 -1.51 0.00 0.00 37.83 33.76 2a4h s LYS 108 CO 0.60 0.44 1.29 0.66 -0.36 0.00 0.00 175.35 177.97 2a4h n TYR 109 N -0.62 3.38 -0.63 4.03 4.01 -1.25 -1.56 117.16 124.52 2a4h n TYR 109 Ca -0.05 -3.37 -0.21 0.00 -0.16 0.00 0.00 57.90 54.11 2a4h n TYR 109 Cb 0.54 -0.82 0.01 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 0.11 0.00 -0.23 -0.72 3.14 0.43 -4.72 118.33 116.35 2a4h n VAL 110 Ca 0.36 -0.28 -0.01 0.00 -2.96 0.00 0.00 64.34 61.46 2a4h n VAL 110 Cb 0.34 0.00 0.06 0.00 -1.06 0.00 0.00 33.84 33.18 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 -0.24 -0.04 0.00 1.45 2.47 -1.97 -3.38 114.38 112.67 2a4h h ARG 111 Ca -0.23 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.49 2a4h h ARG 111 Cb 0.76 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.09 2a4h h ARG 111 CO 0.19 -0.03 0.00 0.41 0.56 0.00 0.00 179.97 181.10 2a4h n GLY 112 N -1.46 -1.90 0.00 0.04 0.00 -1.26 -4.94 105.19 95.67 2a4h n GLY 112 Ca 0.08 0.90 0.00 0.00 0.00 0.00 0.00 46.02 47.00 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 -4.92 0.99 4.77 -1.26 -5.02 117.00 111.56 2a4h n LEU 113 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.69 2a4h n LEU 113 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 2a4h n LEU 113 CO 0.00 0.00 0.04 1.51 -1.33 0.00 0.00 177.39 177.61 2a4h s ASP 114 N 0.14 6.42 -0.13 -1.43 -4.77 -1.26 -4.09 116.67 111.55 2a4h s ASP 114 Ca 0.00 0.49 -0.29 0.00 -3.30 0.00 0.00 52.55 49.45 2a4h s ASP 114 Cb 0.00 -2.05 -0.05 0.00 -1.09 0.00 0.00 42.92 39.73 2a4h s ASP 114 CO 0.00 -0.03 1.86 -2.84 0.70 0.00 0.00 175.17 174.87 2a4h s PRO 115 N -3.13 3.78 0.07 2.11 0.02 -1.25 -4.59 135.00 132.00 2a4h s PRO 115 Ca 0.40 2.07 0.04 0.00 0.02 0.00 0.00 61.00 63.53 2a4h s PRO 115 Cb -0.11 -4.15 -0.03 0.00 0.02 0.00 0.00 34.50 30.23 2a4h s PRO 115 CO 0.28 -1.34 -0.11 0.08 -0.33 0.00 0.00 177.00 175.57 2a4h s VAL 116 N 5.60 0.86 -0.43 3.83 1.01 -0.84 -1.57 120.40 128.86 2a4h s VAL 116 Ca 0.83 -1.29 -0.10 0.00 0.00 0.00 0.00 61.98 61.42 2a4h s VAL 116 Cb -0.33 -0.96 0.08 0.00 0.00 0.00 0.00 36.38 35.18 2a4h s VAL 116 CO 0.34 -0.36 0.28 0.68 0.00 0.00 0.00 175.10 176.05 2a4h s VAL 117 N -1.56 4.33 -0.43 2.92 -7.23 -0.52 -2.51 120.40 115.39 2a4h s VAL 117 Ca -0.03 -1.40 -0.17 0.00 -1.81 0.00 0.00 61.98 58.56 2a4h s VAL 117 Cb -0.08 -3.67 0.03 0.00 0.56 0.00 0.00 36.38 33.22 2a4h s VAL 117 CO 0.01 -0.54 0.44 -0.54 -0.31 0.00 0.00 175.10 174.16 2a4h s LYS 118 N 1.44 3.08 -1.14 4.82 -0.14 -0.23 -2.61 119.74 124.95 2a4h s LYS 118 Ca 0.03 -0.85 -0.10 0.00 -1.36 0.00 0.00 55.97 53.69 2a4h s LYS 118 Cb -0.23 -4.00 0.25 0.00 -1.68 0.00 0.00 37.83 32.17 2a4h s LYS 118 CO 0.02 -0.90 1.20 -0.51 -0.76 0.00 0.00 175.35 174.40 2a4h s LEU 119 N 2.10 6.02 0.00 3.17 1.02 0.23 0.48 118.68 131.70 2a4h s LEU 119 Ca 0.11 -3.46 -0.03 0.00 0.02 0.00 0.00 54.13 50.77 2a4h s LEU 119 Cb -0.18 -2.26 0.05 0.00 0.02 0.00 0.00 46.19 43.82 2a4h s LEU 119 CO 0.12 -0.40 0.30 0.18 0.02 0.00 0.00 176.35 176.58 2a4h n LEU 120 N 3.42 0.00 0.03 1.79 4.32 0.72 0.18 117.00 127.46 2a4h n LEU 120 Ca 0.27 -0.39 -0.00 0.00 -0.02 0.00 0.00 56.01 55.87 2a4h n LEU 120 Cb 0.40 -0.22 -0.00 0.00 -1.62 0.00 0.00 43.42 41.97 2a4h n LEU 120 CO 0.51 -0.70 -0.22 -0.67 -1.22 0.00 0.00 177.39 175.09 2a4h n ASP 121 N -3.15 0.66 0.00 -1.43 2.03 -1.26 -2.56 116.55 110.85 2a4h n ASP 121 Ca 0.04 0.08 0.00 0.00 0.52 0.00 0.00 54.79 55.43 2a4h n ASP 121 Cb 0.14 -0.20 0.00 0.00 -0.72 0.00 0.00 41.12 40.34 2a4h n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2a4h n ALA 122 N -3.30 0.00 0.26 -1.67 0.00 -1.26 -2.63 120.51 111.90 2a4h n ALA 122 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 2a4h n ALA 122 Cb 0.21 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.76 2a4h n ALA 122 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2a4h h SER 123 N 0.00 0.00 0.00 0.00 0.87 -2.02 -3.47 113.55 108.92 2a4h h SER 123 Ca 0.00 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 2a4h h SER 123 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2a4h h SER 123 CO 0.00 0.02 0.00 0.61 -0.53 0.00 0.00 176.83 176.93 2a4h n GLY 124 N 1.20 1.93 0.10 5.77 0.00 -1.26 -5.04 105.19 107.89 2a4h n GLY 124 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 0.00 0.21 -4.43 1.61 1.63 -1.94 -3.49 116.57 110.16 2a4h h LYS 125 Ca 0.00 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 2a4h h LYS 125 Cb 0.00 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.61 2a4h h LYS 125 CO 0.00 0.45 -0.11 0.28 -3.45 0.00 0.00 179.45 176.63 2a4h n VAL 126 N -4.79 -6.95 0.02 2.00 0.31 -1.26 -4.95 118.33 102.70 2a4h n VAL 126 Ca -0.06 0.09 -0.10 0.00 -0.01 0.00 0.00 64.34 64.26 2a4h n VAL 126 Cb 0.20 -5.75 -0.04 0.00 -0.91 0.00 0.00 33.84 27.35 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 0.61 -0.32 -5.06 5.55 1.08 0.16 -3.43 115.11 113.69 2a4h h GLN 127 Ca 0.00 0.02 -0.46 0.00 -1.45 0.00 0.00 58.65 56.77 2a4h h GLN 127 Cb 0.87 0.07 -0.29 0.00 -0.05 0.00 0.00 27.48 28.08 2a4h h GLN 127 CO 0.16 -0.22 -0.80 -1.21 -0.95 0.00 0.00 178.83 175.81 2a4h s GLU 128 N -6.07 1.04 -0.34 1.46 2.02 -1.14 -4.92 118.70 110.75 2a4h s GLU 128 Ca -0.15 -0.44 -0.01 0.00 0.02 0.00 0.00 54.97 54.39 2a4h s GLU 128 Cb 0.10 -0.99 0.12 0.00 0.10 0.00 0.00 34.13 33.46 2a4h s GLU 128 CO 0.67 0.25 0.17 0.99 0.02 0.00 0.00 175.26 177.35 2a4h s THR 129 N -0.23 0.42 -0.17 3.63 2.01 -1.19 0.76 115.64 120.87 2a4h s THR 129 Ca 0.04 -1.48 -0.01 0.00 0.31 0.00 0.00 61.69 60.54 2a4h s THR 129 Cb -0.05 -1.32 -0.00 0.00 0.01 0.00 0.00 72.50 71.13 2a4h s THR 129 CO -0.00 -0.83 -0.12 -0.76 -0.69 0.00 0.00 174.62 172.22 2a4h s LEU 130 N 1.39 2.63 -1.07 4.42 1.43 -1.07 -4.87 118.68 121.54 2a4h s LEU 130 Ca 0.14 -0.43 -0.23 0.00 -1.03 0.00 0.00 54.13 52.58 2a4h s LEU 130 Cb -0.20 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2a4h s LEU 130 CO -0.16 0.06 1.86 -0.55 0.23 0.00 0.00 176.35 177.79 2a4h s SER 131 N 0.95 5.46 0.00 2.29 0.15 -1.26 -1.44 113.70 119.83 2a4h s SER 131 Ca -0.02 -1.35 0.00 0.00 0.70 0.00 0.00 55.95 55.28 2a4h s SER 131 Cb -0.15 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.59 2a4h s SER 131 CO -0.01 -2.55 0.80 2.30 1.20 0.00 0.00 173.24 174.98 2a4h n ILE 132 N 7.56 0.00 0.00 6.45 -5.35 -0.61 -4.68 119.36 122.74 2a4h n ILE 132 Ca 0.42 1.30 0.00 0.00 -0.27 0.00 0.00 62.75 64.20 2a4h n ILE 132 Cb 0.47 -2.10 0.00 0.00 -1.74 0.00 0.00 39.64 36.28 2a4h n ILE 132 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 2a4h n THR 133 N -1.74 0.00 0.01 7.28 -2.24 -1.24 -2.28 114.28 114.08 2a4h n THR 133 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 2a4h n THR 133 Cb 0.00 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2a4h n THR 133 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2a4h n LYS 134 N 0.00 0.06 0.00 -0.78 5.02 -1.26 -4.80 118.16 116.40 2a4h n LYS 134 Ca 0.00 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 2a4h n LYS 134 Cb 0.00 -0.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.55 2a4h n LYS 134 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2a4h n TRP 135 N -3.25 0.00 0.00 2.13 7.02 -0.96 -2.77 117.44 119.61 2a4h n TRP 135 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 2a4h n TRP 135 Cb 0.06 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.95 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 0.29 0.02 -0.94 -0.99 5.15 -1.26 -5.16 115.26 112.37 2a4h n ASN 136 Ca 0.00 0.00 0.12 0.00 -0.60 0.00 0.00 54.58 54.10 2a4h n ASN 136 Cb 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.22 2a4h n ASN 136 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 2a4h n THR 137 N -1.10 0.00 0.00 -0.44 5.66 -1.11 -4.52 114.28 112.77 2a4h n THR 137 Ca 0.00 0.10 0.00 0.00 -3.05 0.00 0.00 64.05 61.10 2a4h n THR 137 Cb 0.00 -0.40 0.00 0.00 -1.55 0.00 0.00 70.33 68.39 2a4h n THR 137 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2a4h n ASP 138 N -4.33 0.00 -0.10 1.09 -0.08 -1.26 -3.13 116.55 108.74 2a4h n ASP 138 Ca -0.00 0.00 0.26 0.00 -1.51 0.00 0.00 54.79 53.54 2a4h n ASP 138 Cb 0.61 0.00 0.72 0.00 2.34 0.00 0.00 41.12 44.78 2a4h n ASP 138 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 2a4h h THR 139 N 0.00 0.47 -0.60 5.18 2.02 -2.01 0.64 112.91 118.62 2a4h h THR 139 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 2a4h h THR 139 Cb 0.00 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 66.90 2a4h h THR 139 CO 0.00 0.00 0.30 1.62 0.37 0.00 0.00 175.52 177.81 2a4h h VAL 140 N 0.00 0.93 -0.88 3.16 3.04 -1.86 0.28 116.25 120.92 2a4h h VAL 140 Ca 0.36 -0.19 0.17 0.00 -1.01 0.00 0.00 66.70 66.03 2a4h h VAL 140 Cb 1.60 0.31 -0.10 0.00 -2.01 0.00 0.00 31.29 31.09 2a4h h VAL 140 CO -0.00 0.10 0.45 -0.08 -1.01 0.00 0.00 177.57 177.03 2a4h h GLU 141 N 0.56 0.58 -0.05 4.17 4.81 0.00 0.63 114.58 125.29 2a4h h GLU 141 Ca 0.27 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.34 2a4h h GLU 141 Cb 0.20 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2a4h h GLU 141 CO -0.20 0.38 -0.53 1.49 -0.73 0.00 0.00 179.01 179.43 2a4h h GLU 142 N 0.60 0.14 -0.83 1.92 4.81 -1.00 -3.07 114.58 117.16 2a4h h GLU 142 Ca 0.50 -0.09 0.20 0.00 -0.13 0.00 0.00 59.36 59.85 2a4h h GLU 142 Cb 0.77 0.01 -0.13 0.00 0.63 0.00 0.00 28.75 30.02 2a4h h GLU 142 CO -0.40 0.64 0.18 0.35 -0.73 0.00 0.00 179.01 179.05 2a4h h PHE 143 N 0.11 0.27 0.15 0.92 3.57 0.37 0.16 116.94 122.50 2a4h h PHE 143 Ca 0.00 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2a4h h PHE 143 Cb 0.97 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.73 2a4h h PHE 143 CO 0.01 -0.18 -0.07 0.74 -2.23 0.00 0.00 178.31 176.58 2a4h h PHE 144 N 0.21 -0.19 -1.15 0.41 0.04 -1.44 -1.83 116.94 113.00 2a4h h PHE 144 Ca 0.50 -0.00 0.33 0.00 2.80 0.00 0.00 57.97 61.59 2a4h h PHE 144 Cb 0.94 0.06 -0.05 0.00 2.20 0.00 0.00 35.95 39.11 2a4h h PHE 144 CO -0.29 -0.12 0.97 1.05 -0.60 0.00 0.00 178.31 179.32 2a4h h GLU 145 N -0.72 0.00 0.04 1.51 -0.00 -1.41 1.63 114.58 115.63 2a4h h GLU 145 Ca -0.02 0.00 -0.31 0.00 -0.00 0.00 0.00 59.36 59.03 2a4h h GLU 145 Cb 0.16 0.00 -0.04 0.00 -0.00 0.00 0.00 28.75 28.87 2a4h h GLU 145 CO 0.03 0.00 -1.74 1.79 -0.00 0.00 0.00 179.01 179.09 2a4h h THR 146 N 0.00 0.84 0.00 -1.06 1.35 -0.76 -3.35 112.91 109.93 2a4h h THR 146 Ca 0.54 -2.65 0.00 0.00 -0.55 0.00 0.00 66.41 63.76 2a4h h THR 146 Cb 2.48 2.47 0.00 0.00 -1.73 0.00 0.00 68.15 71.38 2a4h h THR 146 CO -0.01 0.62 -0.60 1.41 -0.25 0.00 0.00 175.52 176.70 2a4h n HIS 147 N -3.18 0.11 -3.80 4.73 8.25 0.25 -4.65 115.22 116.93 2a4h n HIS 147 Ca -0.20 0.03 -0.25 0.00 -0.26 0.00 0.00 57.72 57.04 2a4h n HIS 147 Cb 1.05 -0.32 0.01 0.00 1.12 0.00 0.00 29.99 31.85 2a4h n HIS 147 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2a4h n LEU 148 N -1.64 0.00 -4.10 2.41 4.77 0.49 0.16 117.00 119.09 2a4h n LEU 148 Ca 0.05 -2.79 -0.27 0.00 -0.03 0.00 0.00 56.01 52.96 2a4h n LEU 148 Cb 0.36 -0.08 -0.17 0.00 -2.33 0.00 0.00 43.42 41.21 2a4h n LEU 148 CO 0.36 -0.60 -0.50 0.00 -1.33 0.00 0.00 177.39 175.32 2a4h s ALA 149 N -2.77 1.56 -1.09 -1.18 0.00 -1.26 -4.73 121.76 112.29 2a4h s ALA 149 Ca 0.34 -0.62 0.12 0.00 0.00 0.00 0.00 51.96 51.80 2a4h s ALA 149 Cb -0.03 -0.61 0.55 0.00 0.00 0.00 0.00 23.12 23.03 2a4h s ALA 149 CO 0.21 0.20 1.38 1.63 0.00 0.00 0.00 175.76 179.18 2a4h n LYS 150 N 3.57 0.04 -2.25 0.00 4.76 -1.26 -4.52 118.16 118.51 2a4h n LYS 150 Ca -0.21 0.26 -0.03 0.00 -2.87 0.00 0.00 58.31 55.47 2a4h n LYS 150 Cb 0.52 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.22 2a4h n LYS 150 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2a4h n ASP 151 N -1.45 -5.07 -3.60 4.39 2.03 -1.26 -4.88 116.55 106.70 2a4h n ASP 151 Ca 0.04 0.15 -0.13 0.00 0.52 0.00 0.00 54.79 55.38 2a4h n ASP 151 Cb 0.14 -3.27 -0.06 0.00 -0.72 0.00 0.00 41.12 37.20 2a4h n ASP 151 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2a4h s GLY 152 N -2.11 -0.37 0.23 0.27 0.00 -1.26 -5.08 107.32 99.00 2a4h s GLY 152 Ca 0.08 2.10 0.00 0.00 0.00 0.00 0.00 44.72 46.90 2a4h s GLY 152 CO 0.40 1.48 0.00 0.00 0.00 0.00 0.00 173.10 174.98 2a4h n ALA 153 N 1.81 3.00 -1.57 3.20 0.00 -1.26 -5.07 120.51 120.62 2a4h n ALA 153 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2a4h n ALA 153 Cb 0.56 0.04 0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 1.84 0.32 1.70 0.00 0.00 -1.26 -5.11 105.19 102.69 2a4h n GLY 154 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.25 -4.79 -2.69 1.61 5.02 -1.26 -4.86 118.16 110.94 2a4h n LYS 155 Ca 0.00 3.48 -0.42 0.00 -2.02 0.00 0.00 58.31 59.35 2a4h n LYS 155 Cb 0.00 -3.85 -0.03 0.00 -0.02 0.00 0.00 35.03 31.13 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 -2.28 7.32 -0.16 4.39 3.84 -1.26 -4.93 114.94 121.87 2a4h s ASN 156 Ca 0.00 1.65 0.05 0.00 0.21 0.00 0.00 52.86 54.77 2a4h s ASN 156 Cb 0.00 -2.57 -0.13 0.00 -0.55 0.00 0.00 41.25 38.00 2a4h s ASN 156 CO 0.00 -0.32 -0.08 -0.24 -2.79 0.00 0.00 177.10 173.68 2a4h n SER 157 N 4.19 2.27 -4.78 -4.21 2.88 -1.26 -5.00 113.62 107.70 2a4h n SER 157 Ca 0.07 -0.06 -0.36 0.00 -1.33 0.00 0.00 58.87 57.19 2a4h n SER 157 Cb 0.50 0.15 -0.03 0.00 -0.75 0.00 0.00 64.21 64.09 2a4h n SER 157 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2a4h s TYR 158 N -2.34 3.06 0.00 0.66 1.51 -1.26 -5.02 117.35 113.96 2a4h s TYR 158 Ca -0.17 1.59 0.00 0.00 -1.01 0.00 0.00 57.07 57.48 2a4h s TYR 158 Cb 0.05 -3.22 0.00 0.00 -0.11 0.00 0.00 41.96 38.69 2a4h s TYR 158 CO 0.46 -1.02 0.24 0.43 -1.11 0.00 0.00 175.55 174.55 2a4h n SER 159 N -0.41 0.00 -4.10 2.29 7.64 -1.26 -5.02 113.62 112.76 2a4h n SER 159 Ca 0.07 0.30 -0.23 0.00 1.01 0.00 0.00 58.87 60.02 2a4h n SER 159 Cb 0.49 -0.11 -0.09 0.00 -1.01 0.00 0.00 64.21 63.50 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 -0.69 0.59 -0.08 0.44 -7.23 -1.26 -5.16 120.40 107.02 2a4h s VAL 160 Ca 0.00 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 2a4h s VAL 160 Cb 0.00 -2.45 0.02 0.00 0.56 0.00 0.00 36.38 34.51 2a4h s VAL 160 CO 0.00 0.00 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.00 2a4h s VAL 161 N -3.32 1.01 0.28 1.32 1.01 -1.26 -5.14 120.40 114.29 2a4h s VAL 161 Ca 0.29 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.86 2a4h s VAL 161 Cb 0.04 -0.97 0.07 0.00 0.00 0.00 0.00 36.38 35.51 2a4h s VAL 161 CO 0.16 0.34 0.29 -1.84 0.00 0.00 0.00 175.10 174.05 2a4h n GLU 162 N 4.23 -1.07 -1.54 2.72 0.28 -1.26 -4.80 120.64 119.21 2a4h n GLU 162 Ca -0.20 -0.45 -0.29 0.00 -0.16 0.00 0.00 57.16 56.06 2a4h n GLU 162 Cb 0.51 -0.37 -0.09 0.00 1.43 0.00 0.00 31.44 32.92 2a4h n GLU 162 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2a4h n ASP 163 N -3.36 1.30 -3.63 -1.84 -0.08 -1.26 -4.85 116.55 102.83 2a4h n ASP 163 Ca 0.04 -0.63 -0.23 0.00 -1.51 0.00 0.00 54.79 52.45 2a4h n ASP 163 Cb 0.14 -1.34 -0.07 0.00 2.34 0.00 0.00 41.12 42.19 2a4h n ASP 163 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2a4h n ALA 164 N 14.29 0.61 -2.46 -1.67 0.00 -1.26 -5.18 120.51 124.83 2a4h n ALA 164 Ca 0.49 -2.00 -0.09 0.00 0.00 0.00 0.00 53.44 51.84 2a4h n ALA 164 Cb 0.36 1.43 -0.08 0.00 0.00 0.00 0.00 19.45 21.16 2a4h n ALA 164 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2a4h s ASP 165 N -3.41 0.17 0.62 0.00 -1.08 -1.26 -5.17 116.67 106.54 2a4h s ASP 165 Ca 0.26 -0.95 0.00 0.00 -0.52 0.00 0.00 52.55 51.34 2a4h s ASP 165 Cb 0.01 0.36 0.00 0.00 -1.46 0.00 0.00 42.92 41.83 2a4h s ASP 165 CO 0.19 -0.79 0.00 0.61 0.52 0.00 0.00 175.17 175.69 2a4h n GLY 166 N -0.13 -2.74 3.60 2.66 0.00 -1.26 -4.90 105.19 102.42 2a4h n GLY 166 Ca -0.08 -0.91 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 2a4h n GLY 166 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2a4h n ASP 167 N -1.86 -0.01 -4.67 1.61 -0.08 -1.26 -4.95 116.55 105.33 2a4h n ASP 167 Ca 0.00 0.53 -0.40 0.00 -1.51 0.00 0.00 54.79 53.40 2a4h n ASP 167 Cb 0.00 -1.40 -0.05 0.00 2.34 0.00 0.00 41.12 42.01 2a4h n ASP 167 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 2a4h s ASP 168 N -2.02 6.82 0.00 1.67 1.01 -1.26 -4.58 116.67 118.31 2a4h s ASP 168 Ca 0.68 1.00 0.00 0.00 0.71 0.00 0.00 52.55 54.94 2a4h s ASP 168 Cb -0.28 -2.39 0.00 0.00 1.01 0.00 0.00 42.92 41.26 2a4h s ASP 168 CO 0.56 -0.28 0.00 -0.67 0.21 0.00 0.00 175.17 174.98 2a4h n ASP 169 N 4.88 0.00 -4.55 0.27 2.03 -1.26 -5.10 116.55 112.82 2a4h n ASP 169 Ca 0.00 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.89 2a4h n ASP 169 Cb 0.50 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.86 2a4h n ASP 169 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2a4h s GLU 170 N 0.00 3.44 0.29 -0.67 2.02 -1.26 -4.88 118.70 117.63 2a4h s GLU 170 Ca 0.00 0.02 0.21 0.00 0.02 0.00 0.00 54.97 55.22 2a4h s GLU 170 Cb 0.00 -4.02 1.07 0.00 0.10 0.00 0.00 34.13 31.27 2a4h s GLU 170 CO 0.00 -1.55 1.65 -0.25 0.02 0.00 0.00 175.26 175.13 2a4h n ASP 171 N 7.89 0.57 0.00 -0.19 9.92 -1.26 -4.82 116.55 128.66 2a4h n ASP 171 Ca 0.05 0.72 0.00 0.00 -0.53 0.00 0.00 54.79 55.03 2a4h n ASP 171 Cb 0.48 -0.81 0.00 0.00 -0.64 0.00 0.00 41.12 40.15 2a4h n ASP 171 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2a4h n TYR 172 N -2.22 0.00 0.00 1.24 9.36 -1.26 -3.17 117.16 121.11 2a4h n TYR 172 Ca -0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2a4h n TYR 172 Cb 0.10 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.81 2a4h n TYR 172 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2a4h n LEU 173 N 0.00 0.00 -4.62 2.98 4.77 -1.26 -5.13 117.00 113.74 2a4h n LEU 173 Ca 0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.74 2a4h n LEU 173 Cb 0.00 0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.05 2a4h n LEU 173 CO 0.00 -0.39 -0.33 -0.13 -1.33 0.00 0.00 177.39 175.22 2a4h s ARG 174 N -1.78 2.13 -0.44 3.23 0.52 -1.19 -5.09 118.95 116.33 2a4h s ARG 174 Ca 0.00 -1.61 0.07 0.00 -0.52 0.00 0.00 55.73 53.67 2a4h s ARG 174 Cb 0.00 -2.01 0.27 0.00 0.52 0.00 0.00 34.95 33.73 2a4h s ARG 174 CO 0.00 0.24 0.78 0.25 0.02 0.00 0.00 175.30 176.60 2a4h n THR 175 N -0.90 -0.25 0.02 0.02 -2.24 -1.26 -4.91 114.28 104.75 2a4h n THR 175 Ca -0.05 -2.70 0.00 0.00 -2.27 0.00 0.00 64.05 59.03 2a4h n THR 175 Cb 0.61 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 2a4h n THR 175 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2a4h n ASN 176 N 1.21 0.08 -3.24 3.42 4.13 -1.26 -5.10 115.26 114.50 2a4h n ASN 176 Ca 0.14 0.05 -0.16 0.00 1.68 0.00 0.00 54.58 56.29 2a4h n ASN 176 Cb 0.61 0.01 0.02 0.00 -1.54 0.00 0.00 39.78 38.87 2a4h n ASN 176 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 2a4h n ARG 177 N -2.66 -1.43 -0.28 3.52 1.85 -1.26 -5.34 116.66 111.07 2a4h n ARG 177 Ca 0.00 1.35 0.00 0.00 -1.00 0.00 0.00 57.85 58.20 2a4h n ARG 177 Cb 0.00 -2.24 0.00 0.00 -1.05 0.00 0.00 32.46 29.17 2a4h n ARG 177 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73