#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 3.78 -0.07 -5.12 0.00 -1.26 -5.03 121.76 114.07 2a4h s ALA 54 Ca 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 51.96 51.38 2a4h s ALA 54 Cb 0.00 -2.13 -0.02 0.00 0.00 0.00 0.00 23.12 20.97 2a4h s ALA 54 CO 0.00 0.47 -0.10 -1.13 0.00 0.00 0.00 175.76 175.01 2a4h n SER 55 N 2.31 0.85 -2.59 0.00 3.41 -1.26 -4.84 113.62 111.50 2a4h n SER 55 Ca -0.17 0.39 -0.03 0.00 -0.26 0.00 0.00 58.87 58.79 2a4h n SER 55 Cb 0.54 -0.66 -0.03 0.00 -0.26 0.00 0.00 64.21 63.79 2a4h n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2a4h n HIS 56 N -3.36 -0.14 -4.49 7.33 -0.00 -1.26 -5.01 115.22 108.29 2a4h n HIS 56 Ca -0.04 -0.55 -0.21 0.00 -0.00 0.00 0.00 57.72 56.92 2a4h n HIS 56 Cb 0.14 1.10 -0.15 0.00 -0.00 0.00 0.00 29.99 31.07 2a4h n HIS 56 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2a4h s HIS 57 N 0.01 1.07 -0.15 -1.40 0.09 -1.26 -5.03 115.29 108.62 2a4h s HIS 57 Ca 0.01 -0.24 0.19 0.00 -0.00 0.00 0.00 55.06 55.02 2a4h s HIS 57 Cb 0.02 -0.72 -0.27 0.00 -0.00 0.00 0.00 32.58 31.61 2a4h s HIS 57 CO -0.01 -0.07 0.18 0.72 -0.00 0.00 0.00 174.74 175.57 2a4h n HIS 58 N 3.05 0.00 -1.59 1.40 -0.00 -1.26 -4.98 115.22 111.83 2a4h n HIS 58 Ca -0.16 0.00 -0.44 0.00 -0.00 0.00 0.00 57.72 57.12 2a4h n HIS 58 Cb 0.55 -0.84 -0.01 0.00 -0.00 0.00 0.00 29.99 29.69 2a4h n HIS 58 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2a4h n HIS 59 N -2.59 1.20 -2.51 4.41 8.25 -1.26 -4.18 115.22 118.54 2a4h n HIS 59 Ca -0.24 0.68 -0.04 0.00 -0.26 0.00 0.00 57.72 57.86 2a4h n HIS 59 Cb 0.98 -2.24 -0.04 0.00 1.12 0.00 0.00 29.99 29.81 2a4h n HIS 59 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2a4h n HIS 60 N 0.10 -4.04 -3.05 4.41 -0.00 -1.26 -4.96 115.22 106.41 2a4h n HIS 60 Ca 0.09 2.26 -0.39 0.00 -0.00 0.00 0.00 57.72 59.69 2a4h n HIS 60 Cb 0.33 -3.74 -0.05 0.00 -0.00 0.00 0.00 29.99 26.53 2a4h n HIS 60 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2a4h s HIS 61 N -0.76 3.78 0.67 1.57 -0.00 -1.26 -5.07 115.29 114.22 2a4h s HIS 61 Ca -0.22 1.44 -0.09 0.00 -0.00 0.00 0.00 55.06 56.19 2a4h s HIS 61 Cb 0.01 -2.74 0.02 0.00 -0.00 0.00 0.00 32.58 29.88 2a4h s HIS 61 CO 0.73 0.38 1.02 -0.51 -0.00 0.00 0.00 174.74 176.36 2a4h s LEU 62 N -0.46 3.00 -0.58 5.38 1.02 -1.26 -4.98 118.68 120.80 2a4h s LEU 62 Ca 0.35 0.91 -0.02 0.00 0.02 0.00 0.00 54.13 55.39 2a4h s LEU 62 Cb -0.21 -3.69 0.32 0.00 0.02 0.00 0.00 46.19 42.63 2a4h s LEU 62 CO 0.22 -1.28 2.13 0.47 0.02 0.00 0.00 176.35 177.92 2a4h n ASP 63 N -2.85 7.19 0.00 2.29 9.92 -1.26 -4.10 116.55 127.74 2a4h n ASP 63 Ca 0.06 -3.53 0.00 0.00 -0.53 0.00 0.00 54.79 50.79 2a4h n ASP 63 Cb 0.58 -1.05 0.00 0.00 -0.64 0.00 0.00 41.12 40.01 2a4h n ASP 63 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2a4h n GLN 64 N -0.28 4.07 -4.66 -1.24 10.64 -1.26 -5.04 117.38 119.62 2a4h n GLN 64 Ca 0.51 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 55.34 2a4h n GLN 64 Cb 0.55 -0.56 -0.12 0.00 -0.86 0.00 0.00 30.24 29.25 2a4h n GLN 64 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 2a4h s GLN 65 N -1.04 2.77 1.15 2.61 0.74 -1.26 -5.11 119.66 119.52 2a4h s GLN 65 Ca 0.00 -0.57 -0.16 0.00 0.05 0.00 0.00 55.36 54.68 2a4h s GLN 65 Cb 0.00 -2.58 0.19 0.00 1.10 0.00 0.00 33.01 31.72 2a4h s GLN 65 CO 0.00 0.63 0.46 -2.30 -0.55 0.00 0.00 175.29 173.53 2a4h n PRO 66 N 2.33 -1.99 -1.68 1.67 -0.02 -1.26 -4.85 135.00 129.21 2a4h n PRO 66 Ca -0.18 -0.56 -0.38 0.00 -2.02 0.00 0.00 63.50 60.36 2a4h n PRO 66 Cb 0.53 -1.91 -0.02 0.00 -0.02 0.00 0.00 33.50 32.08 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 -4.67 7.09 -1.30 3.55 0.00 -1.26 -4.95 120.51 118.98 2a4h n ALA 67 Ca 0.02 -3.77 -0.08 0.00 0.00 0.00 0.00 53.44 49.61 2a4h n ALA 67 Cb 0.58 -2.97 0.08 0.00 0.00 0.00 0.00 19.45 17.14 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 2.43 -0.68 -0.70 0.00 0.00 -1.26 -5.02 120.51 115.28 2a4h n ALA 68 Ca 0.68 -0.65 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 2a4h n ALA 68 Cb 0.27 -0.03 0.15 0.00 0.00 0.00 0.00 19.45 19.83 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 -2.17 -1.49 -2.61 0.00 0.00 -1.26 -4.94 117.38 104.92 2a4h n GLN 69 Ca 0.06 -0.43 -0.27 0.00 0.00 0.00 0.00 57.00 56.37 2a4h n GLN 69 Cb 0.22 -1.55 -0.01 0.00 0.00 0.00 0.00 30.24 28.89 2a4h n GLN 69 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 2a4h n ARG 70 N -1.33 3.37 -1.04 2.61 1.85 -1.26 -5.09 116.66 115.76 2a4h n ARG 70 Ca 0.01 -4.60 -0.36 0.00 -1.00 0.00 0.00 57.85 51.90 2a4h n ARG 70 Cb 0.61 -2.24 0.06 0.00 -1.05 0.00 0.00 32.46 29.84 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 -0.41 0.36 -2.84 8.89 -2.24 -1.26 -5.00 114.28 111.78 2a4h n THR 71 Ca 0.37 -0.41 -0.14 0.00 -2.27 0.00 0.00 64.05 61.60 2a4h n THR 71 Cb 0.59 -0.30 0.06 0.00 -2.10 0.00 0.00 70.33 68.58 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 -2.59 -2.71 -0.05 4.78 4.02 0.44 -4.98 117.16 116.08 2a4h n TYR 72 Ca 0.04 -1.37 0.02 0.00 -0.01 0.00 0.00 57.90 56.58 2a4h n TYR 72 Cb 0.53 -0.42 -0.16 0.00 -0.02 0.00 0.00 39.34 39.27 2a4h n TYR 72 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2a4h n ALA 73 N -2.68 2.22 -3.39 -0.72 0.00 -1.25 -4.19 120.51 110.50 2a4h n ALA 73 Ca -0.10 -0.83 -0.13 0.00 0.00 0.00 0.00 53.44 52.38 2a4h n ALA 73 Cb 0.41 -0.46 -0.03 0.00 0.00 0.00 0.00 19.45 19.37 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 -3.00 1.22 0.03 0.00 2.20 -0.98 -4.86 119.74 114.35 2a4h s LYS 74 Ca -0.08 -0.39 -0.24 0.00 -0.36 0.00 0.00 55.97 54.90 2a4h s LYS 74 Cb 0.10 0.56 0.06 0.00 -1.51 0.00 0.00 37.83 37.04 2a4h s LYS 74 CO 0.82 -0.51 0.55 0.00 -0.36 0.00 0.00 175.35 175.85 2a4h s ALA 75 N -3.36 -1.41 -0.07 3.13 0.00 -0.56 0.10 121.76 119.59 2a4h s ALA 75 Ca -0.01 0.74 -0.03 0.00 0.00 0.00 0.00 51.96 52.66 2a4h s ALA 75 Cb -0.01 0.31 0.04 0.00 0.00 0.00 0.00 23.12 23.46 2a4h s ALA 75 CO -0.09 -0.47 0.14 0.42 0.00 0.00 0.00 175.76 175.75 2a4h s ILE 76 N -2.17 -0.12 -0.95 0.00 1.01 0.43 -0.51 121.20 118.89 2a4h s ILE 76 Ca -0.07 0.25 -0.13 0.00 0.00 0.00 0.00 60.65 60.71 2a4h s ILE 76 Cb -0.01 -0.24 0.23 0.00 0.01 0.00 0.00 42.46 42.45 2a4h s ILE 76 CO 0.01 0.11 0.94 -0.22 0.00 0.00 0.00 174.94 175.77 2a4h s LEU 77 N 1.58 6.43 -0.30 2.97 2.96 -1.26 -0.04 118.68 131.03 2a4h s LEU 77 Ca -0.04 -2.96 -0.27 0.00 -0.22 0.00 0.00 54.13 50.64 2a4h s LEU 77 Cb -0.12 -2.23 0.01 0.00 0.50 0.00 0.00 46.19 44.35 2a4h s LEU 77 CO -0.05 -0.52 0.95 -1.61 -1.32 0.00 0.00 176.35 173.79 2a4h s GLU 78 N -0.06 4.07 -0.00 1.98 2.02 -1.02 -1.81 118.70 123.87 2a4h s GLU 78 Ca 0.24 0.93 0.00 0.00 0.02 0.00 0.00 54.97 56.16 2a4h s GLU 78 Cb -0.09 -3.71 -0.00 0.00 0.10 0.00 0.00 34.13 30.42 2a4h s GLU 78 CO -0.08 -0.75 -0.01 0.14 0.02 0.00 0.00 175.26 174.58 2a4h s VAL 79 N 3.27 0.05 -1.35 2.63 -7.23 -0.57 -1.85 120.40 115.36 2a4h s VAL 79 Ca 0.40 -0.03 0.18 0.00 -1.81 0.00 0.00 61.98 60.72 2a4h s VAL 79 Cb -0.14 -0.06 0.68 0.00 0.56 0.00 0.00 36.38 37.43 2a4h s VAL 79 CO 0.12 0.02 1.58 0.00 -0.31 0.00 0.00 175.10 176.51 2a4h n THR 81 N 1.18 -0.13 0.13 0.00 -2.24 -1.26 -4.77 114.28 107.19 2a4h n THR 81 Ca 0.24 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 2a4h n THR 81 Cb 0.80 -1.33 0.06 0.00 -2.10 0.00 0.00 70.33 67.76 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 -3.37 1.43 -0.53 0.00 0.00 -1.26 -4.32 118.16 110.11 2a4h n LYS 83 Ca 0.01 -0.48 0.45 0.00 -0.00 0.00 0.00 58.31 58.29 2a4h n LYS 83 Cb 0.74 -1.30 0.78 0.00 -0.00 0.00 0.00 35.03 35.25 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 0.71 0.00 0.01 5.58 3.57 -1.83 0.36 116.94 125.33 2a4h h PHE 84 Ca 0.00 0.00 -0.41 0.00 3.53 0.00 0.00 57.97 61.09 2a4h h PHE 84 Cb 0.39 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.06 2a4h h PHE 84 CO 0.12 0.00 -2.43 -2.13 -2.23 0.00 0.00 178.31 171.64 2a4h n ARG 85 N -3.99 0.63 0.16 1.11 3.00 -1.26 -4.10 116.66 112.21 2a4h n ARG 85 Ca 0.36 0.22 -0.07 0.00 -0.00 0.00 0.00 57.85 58.36 2a4h n ARG 85 Cb 1.69 -1.53 -0.03 0.00 0.00 0.00 0.00 32.46 32.59 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 -0.40 -0.78 -1.98 5.13 0.00 -1.22 -3.37 119.26 116.63 2a4h h ALA 86 Ca -0.61 -0.09 -0.67 0.00 0.00 0.00 0.00 54.91 53.54 2a4h h ALA 86 Cb 1.77 0.17 -0.37 0.00 0.00 0.00 0.00 17.79 19.36 2a4h h ALA 86 CO -0.22 -0.75 -0.09 0.66 0.00 0.00 0.00 179.25 178.85 2a4h n TYR 87 N -3.59 3.52 0.31 0.00 4.01 0.10 -4.84 117.16 116.68 2a4h n TYR 87 Ca -0.05 -3.55 0.20 0.00 -0.16 0.00 0.00 57.90 54.34 2a4h n TYR 87 Cb 0.17 -0.74 1.05 0.00 -0.31 0.00 0.00 39.34 39.51 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 3.69 0.00 -0.13 -0.72 0.13 -1.69 -2.03 132.00 131.24 2a4h h PRO 88 Ca 0.25 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 65.18 2a4h h PRO 88 Cb 0.49 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.62 2a4h h PRO 88 CO 0.96 0.00 -0.74 -0.56 -0.23 0.00 0.00 178.00 177.43 2a4h h GLN 89 N 0.00 0.63 0.00 0.86 3.07 -1.90 -2.92 115.11 114.85 2a4h h GLN 89 Ca 0.00 -0.51 0.00 0.00 0.09 0.00 0.00 58.65 58.23 2a4h h GLN 89 Cb 0.07 0.10 0.00 0.00 0.08 0.00 0.00 27.48 27.73 2a4h h GLN 89 CO 0.00 1.13 0.00 -0.89 0.09 0.00 0.00 178.83 179.16 2a4h n ILE 90 N -3.90 0.00 -0.34 1.86 5.41 -0.76 -1.75 119.36 119.87 2a4h n ILE 90 Ca -0.06 1.18 0.37 0.00 1.00 0.00 0.00 62.75 65.24 2a4h n ILE 90 Cb 0.72 -2.02 0.72 0.00 -0.71 0.00 0.00 39.64 38.35 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 -0.13 0.38 4.15 -1.72 -0.56 115.11 117.24 2a4h h GLN 91 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.45 2a4h h GLN 91 Cb 0.00 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.63 2a4h h GLN 91 CO 0.00 0.00 -0.53 0.00 -1.93 0.00 0.00 178.83 176.37 2a4h h ALA 92 N 1.20 -0.86 0.00 3.38 0.00 -1.13 0.59 119.26 122.43 2a4h h ALA 92 Ca 0.59 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.42 2a4h h ALA 92 Cb 2.57 0.99 -0.00 0.00 0.00 0.00 0.00 17.79 21.34 2a4h h ALA 92 CO -0.01 -1.08 -0.15 0.27 0.00 0.00 0.00 179.25 178.29 2a4h h PHE 93 N -0.58 0.00 -0.45 0.00 -5.15 -0.86 0.87 116.94 110.77 2a4h h PHE 93 Ca 0.04 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.75 2a4h h PHE 93 Cb 0.68 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.83 2a4h h PHE 93 CO -0.57 0.15 0.07 0.82 -2.00 0.00 0.00 178.31 176.78 2a4h h ILE 94 N 0.00 1.25 0.00 0.88 2.04 -0.66 -2.81 117.51 118.20 2a4h h ILE 94 Ca -0.00 -0.90 -0.06 0.00 1.00 0.00 0.00 64.86 64.89 2a4h h ILE 94 Cb 0.28 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 2a4h h ILE 94 CO 0.02 0.32 -0.30 1.56 0.00 0.00 0.00 178.15 179.75 2a4h h GLN 95 N 0.61 0.00 -0.80 2.37 4.20 0.67 -3.30 115.11 118.86 2a4h h GLN 95 Ca 0.14 0.00 0.18 0.00 0.06 0.00 0.00 58.65 59.03 2a4h h GLN 95 Cb 0.39 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.05 2a4h h GLN 95 CO 0.01 0.30 0.25 1.03 -0.67 0.00 0.00 178.83 179.75 2a4h h SER 96 N 0.00 0.11 0.00 1.46 0.87 -0.57 -3.46 113.55 111.96 2a4h h SER 96 Ca -0.00 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2a4h h SER 96 Cb 1.17 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.32 2a4h h SER 96 CO 0.04 -0.03 0.00 0.61 -0.53 0.00 0.00 176.83 176.91 2a4h n GLY 97 N -1.35 1.10 0.23 5.77 0.00 -1.24 -5.00 105.19 104.70 2a4h n GLY 97 Ca 0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 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 1.04 0.74 0.00 1.61 -0.00 -1.85 -2.57 114.38 113.35 2a4h h ARG 98 Ca 0.00 -0.12 -0.04 0.00 -0.50 0.00 0.00 59.98 59.32 2a4h h ARG 98 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 29.97 29.84 2a4h h ARG 98 CO 0.00 0.64 -0.18 -1.35 0.00 0.00 0.00 179.97 179.08 2a4h h PRO 99 N 0.67 0.00 -0.46 0.04 0.11 -1.85 -2.34 132.00 128.17 2a4h h PRO 99 Ca 0.17 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.32 2a4h h PRO 99 Cb 0.16 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.24 2a4h h PRO 99 CO -0.02 0.18 0.31 0.00 -0.21 0.00 0.00 178.00 178.25 2a4h h ALA 100 N 1.82 1.83 0.00 -0.75 0.00 -1.77 0.15 119.26 120.54 2a4h h ALA 100 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2a4h h ALA 100 Cb 0.44 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2a4h h ALA 100 CO 0.02 0.12 0.00 0.87 0.00 0.00 0.00 179.25 180.26 2a4h h LYS 101 N 0.48 0.00 -4.84 0.00 1.57 -1.45 -3.40 116.57 108.93 2a4h h LYS 101 Ca 0.19 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.28 2a4h h LYS 101 Cb 0.15 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.27 2a4h h LYS 101 CO -0.05 0.00 0.21 -0.06 -0.57 0.00 0.00 179.45 178.99 2a4h s PHE 102 N -3.28 2.94 0.06 -1.35 0.08 0.53 -4.93 117.98 112.02 2a4h s PHE 102 Ca 0.06 -0.89 -0.26 0.00 0.12 0.00 0.00 56.93 55.96 2a4h s PHE 102 Cb 0.10 -4.08 -0.17 0.00 -0.57 0.00 0.00 43.02 38.30 2a4h s PHE 102 CO 0.51 -1.37 1.56 -1.00 -0.10 0.00 0.00 175.22 174.82 2a4h h PRO 103 N 9.25 -0.24 -1.09 0.24 0.13 -1.80 -2.59 132.00 135.90 2a4h h PRO 103 Ca -0.28 0.02 0.32 0.00 -0.87 0.00 0.00 66.00 65.18 2a4h h PRO 103 Cb 1.08 0.05 -0.04 0.00 0.13 0.00 0.00 31.00 32.22 2a4h h PRO 103 CO 1.12 -0.06 0.81 -0.91 -0.23 0.00 0.00 178.00 178.73 2a4h h ASN 104 N -0.38 0.00 -3.49 1.44 4.21 -1.89 -3.36 115.58 112.11 2a4h h ASN 104 Ca -0.03 0.00 -0.61 0.00 1.21 0.00 0.00 56.30 56.87 2a4h h ASN 104 Cb 0.29 0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 37.38 2a4h h ASN 104 CO 0.04 0.00 0.30 -0.22 -1.29 0.00 0.00 177.43 176.26 2a4h s LEU 105 N -8.29 4.13 -0.03 1.61 2.96 -0.98 -1.50 118.68 116.58 2a4h s LEU 105 Ca -0.05 0.50 -0.24 0.00 -0.22 0.00 0.00 54.13 54.12 2a4h s LEU 105 Cb 0.22 -2.97 -0.18 0.00 0.50 0.00 0.00 46.19 43.77 2a4h s LEU 105 CO 0.78 -0.59 1.09 -0.61 -1.32 0.00 0.00 176.35 175.70 2a4h h GLN 106 N 8.23 -0.18 -4.85 1.98 5.75 -0.96 -3.46 115.11 121.62 2a4h h GLN 106 Ca -0.25 0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.25 2a4h h GLN 106 Cb 1.10 0.04 0.01 0.00 1.07 0.00 0.00 27.48 29.70 2a4h h GLN 106 CO 0.86 0.25 -0.04 -0.89 -2.65 0.00 0.00 178.83 176.37 2a4h n ILE 107 N -4.94 -8.12 -3.59 2.39 2.08 -1.26 -4.88 119.36 101.04 2a4h n ILE 107 Ca -0.08 -0.23 -0.32 0.00 0.56 0.00 0.00 62.75 62.67 2a4h n ILE 107 Cb 0.26 -6.16 -0.05 0.00 -0.75 0.00 0.00 39.64 32.95 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 -3.06 3.69 -0.97 0.38 2.20 -0.75 -4.88 119.74 116.35 2a4h s LYS 108 Ca 0.02 0.04 -0.01 0.00 -0.36 0.00 0.00 55.97 55.66 2a4h s LYS 108 Cb -0.00 -2.81 0.30 0.00 -1.51 0.00 0.00 37.83 33.80 2a4h s LYS 108 CO 0.58 0.44 1.34 0.66 -0.36 0.00 0.00 175.35 178.01 2a4h n TYR 109 N 0.14 2.62 -0.99 4.03 4.01 -1.25 -1.52 117.16 124.20 2a4h n TYR 109 Ca -0.02 -2.95 -0.37 0.00 -0.16 0.00 0.00 57.90 54.39 2a4h n TYR 109 Cb 0.52 -1.07 0.04 0.00 -0.31 0.00 0.00 39.34 38.51 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 1.07 0.00 0.00 -0.72 3.14 0.82 -4.74 118.33 117.89 2a4h n VAL 110 Ca 0.28 -0.26 0.00 0.00 -2.96 0.00 0.00 64.34 61.41 2a4h n VAL 110 Cb 0.34 -0.03 0.00 0.00 -1.06 0.00 0.00 33.84 33.10 2a4h n VAL 110 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2a4h n ARG 111 N 2.32 5.95 0.00 1.45 1.74 -1.26 -3.84 116.66 123.02 2a4h n ARG 111 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2a4h n ARG 111 Cb 0.65 -0.45 0.00 0.00 -1.02 0.00 0.00 32.46 31.64 2a4h n ARG 111 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2a4h n GLY 112 N 0.92 -1.06 3.71 -0.13 0.00 -1.26 -5.03 105.19 102.34 2a4h n GLY 112 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2a4h n GLY 112 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a4h s LEU 113 N 0.00 2.65 0.44 0.99 1.43 -1.26 -5.12 118.68 117.81 2a4h s LEU 113 Ca 0.00 -1.45 0.08 0.00 -1.03 0.00 0.00 54.13 51.73 2a4h s LEU 113 Cb 0.00 -0.91 0.01 0.00 0.03 0.00 0.00 46.19 45.32 2a4h s LEU 113 CO 0.00 -0.68 0.56 1.51 0.23 0.00 0.00 176.35 177.97 2a4h s ASP 114 N -3.84 5.46 -0.36 2.29 1.47 -1.26 -3.81 116.67 116.61 2a4h s ASP 114 Ca 0.23 -0.55 -0.27 0.00 1.18 0.00 0.00 52.55 53.14 2a4h s ASP 114 Cb 0.05 -0.51 -0.05 0.00 -0.34 0.00 0.00 42.92 42.07 2a4h s ASP 114 CO 0.12 -0.82 2.18 -2.84 0.68 0.00 0.00 175.17 174.49 2a4h s PRO 115 N -4.35 2.78 0.08 2.11 0.02 -1.24 -4.46 135.00 129.95 2a4h s PRO 115 Ca 0.54 1.59 0.02 0.00 0.02 0.00 0.00 61.00 63.17 2a4h s PRO 115 Cb -0.08 -4.41 -0.04 0.00 0.02 0.00 0.00 34.50 29.99 2a4h s PRO 115 CO 0.33 -2.51 -0.07 0.08 -0.33 0.00 0.00 177.00 174.50 2a4h s VAL 116 N 9.41 0.67 -0.53 3.83 1.01 -0.77 -0.53 120.40 133.49 2a4h s VAL 116 Ca 0.93 -1.69 -0.10 0.00 0.00 0.00 0.00 61.98 61.12 2a4h s VAL 116 Cb -0.24 -1.37 0.13 0.00 0.00 0.00 0.00 36.38 34.90 2a4h s VAL 116 CO 0.30 -0.72 0.42 0.68 0.00 0.00 0.00 175.10 175.79 2a4h s VAL 117 N -2.94 4.47 -0.51 2.92 -7.23 -0.65 -2.44 120.40 114.02 2a4h s VAL 117 Ca 0.06 -1.91 -0.21 0.00 -1.81 0.00 0.00 61.98 58.11 2a4h s VAL 117 Cb 0.01 -3.91 0.05 0.00 0.56 0.00 0.00 36.38 33.09 2a4h s VAL 117 CO -0.03 -0.83 0.75 -0.54 -0.31 0.00 0.00 175.10 174.14 2a4h s LYS 118 N 1.16 3.23 0.11 4.82 -0.14 0.95 -2.97 119.74 126.90 2a4h s LYS 118 Ca 0.07 -0.57 -0.21 0.00 -1.36 0.00 0.00 55.97 53.90 2a4h s LYS 118 Cb -0.25 -4.06 -0.07 0.00 -1.68 0.00 0.00 37.83 31.77 2a4h s LYS 118 CO -0.01 -1.28 0.65 -0.51 -0.76 0.00 0.00 175.35 173.43 2a4h s LEU 119 N 3.15 4.55 0.34 3.17 1.02 0.47 0.16 118.68 131.53 2a4h s LEU 119 Ca 0.22 1.40 0.07 0.00 0.02 0.00 0.00 54.13 55.85 2a4h s LEU 119 Cb -0.16 -3.05 -0.03 0.00 0.02 0.00 0.00 46.19 42.97 2a4h s LEU 119 CO 0.16 0.25 0.27 -0.76 0.02 0.00 0.00 176.35 176.29 2a4h s LEU 120 N -1.14 1.77 0.00 1.79 1.02 0.11 -0.55 118.68 121.69 2a4h s LEU 120 Ca 0.32 -1.76 0.06 0.00 0.02 0.00 0.00 54.13 52.76 2a4h s LEU 120 Cb -0.21 0.53 -0.02 0.00 0.02 0.00 0.00 46.19 46.51 2a4h s LEU 120 CO 0.22 -1.06 0.22 0.47 0.02 0.00 0.00 176.35 176.22 2a4h n ASP 121 N -1.56 0.12 -0.22 2.29 9.92 -1.04 -2.33 116.55 123.73 2a4h n ASP 121 Ca 0.07 -3.18 -0.03 0.00 -0.53 0.00 0.00 54.79 51.12 2a4h n ASP 121 Cb 0.62 1.40 0.04 0.00 -0.64 0.00 0.00 41.12 42.54 2a4h n ASP 121 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2a4h h ALA 122 N 1.90 0.18 0.00 2.24 0.00 -1.92 0.73 119.26 122.39 2a4h h ALA 122 Ca -0.27 0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2a4h h ALA 122 Cb 1.20 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.66 2a4h h ALA 122 CO 0.41 -0.56 0.00 1.03 0.00 0.00 0.00 179.25 180.13 2a4h h SER 123 N -0.09 0.00 0.00 0.00 0.87 -2.02 -3.45 113.55 108.86 2a4h h SER 123 Ca 0.28 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 2a4h h SER 123 Cb 0.53 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.49 2a4h h SER 123 CO -0.69 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.22 2a4h n GLY 124 N -0.82 0.83 3.75 5.77 0.00 0.25 -5.06 105.19 109.92 2a4h n GLY 124 Ca -0.02 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2a4h n GLY 124 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2a4h s LYS 125 N -0.67 4.67 -1.09 1.61 2.20 -1.26 -4.73 119.74 120.48 2a4h s LYS 125 Ca 0.00 1.68 -0.20 0.00 -0.36 0.00 0.00 55.97 57.10 2a4h s LYS 125 Cb 0.00 -3.25 0.09 0.00 -1.51 0.00 0.00 37.83 33.16 2a4h s LYS 125 CO 0.00 0.23 1.45 0.08 -0.36 0.00 0.00 175.35 176.75 2a4h s VAL 126 N -0.75 4.30 0.24 4.02 1.01 -1.26 -2.51 120.40 125.46 2a4h s VAL 126 Ca 0.46 -1.48 -0.04 0.00 0.00 0.00 0.00 61.98 60.91 2a4h s VAL 126 Cb -0.29 -5.01 0.21 0.00 0.00 0.00 0.00 36.38 31.29 2a4h s VAL 126 CO 0.36 -1.82 1.77 1.56 0.00 0.00 0.00 175.10 176.96 2a4h h GLN 127 N 8.67 0.58 -3.94 2.72 1.08 -1.15 -3.43 115.11 119.65 2a4h h GLN 127 Ca 0.27 -0.04 -0.18 0.00 -1.45 0.00 0.00 58.65 57.25 2a4h h GLN 127 Cb 0.96 -0.13 -0.22 0.00 -0.05 0.00 0.00 27.48 28.04 2a4h h GLN 127 CO 1.34 0.39 -0.70 -1.21 -0.95 0.00 0.00 178.83 177.69 2a4h s GLU 128 N -6.02 0.25 -0.29 1.46 2.02 -1.18 -4.98 118.70 109.96 2a4h s GLU 128 Ca -0.12 -0.50 -0.03 0.00 0.02 0.00 0.00 54.97 54.34 2a4h s GLU 128 Cb 0.20 0.09 0.11 0.00 0.10 0.00 0.00 34.13 34.63 2a4h s GLU 128 CO 0.77 -0.04 0.19 0.99 0.02 0.00 0.00 175.26 177.19 2a4h s THR 129 N -1.20 -0.20 -0.18 3.63 2.01 -1.25 -0.40 115.64 118.05 2a4h s THR 129 Ca -0.13 -0.63 -0.00 0.00 0.31 0.00 0.00 61.69 61.23 2a4h s THR 129 Cb -0.08 -0.97 0.01 0.00 0.01 0.00 0.00 72.50 71.47 2a4h s THR 129 CO -0.01 -0.61 -0.15 -0.76 -0.69 0.00 0.00 174.62 172.40 2a4h s LEU 130 N 2.20 2.41 0.05 4.42 1.43 -1.16 -4.92 118.68 123.12 2a4h s LEU 130 Ca 0.09 -0.54 -0.30 0.00 -1.03 0.00 0.00 54.13 52.35 2a4h s LEU 130 Cb -0.15 -1.57 -0.08 0.00 0.03 0.00 0.00 46.19 44.42 2a4h s LEU 130 CO -0.34 0.02 1.71 -0.55 0.23 0.00 0.00 176.35 177.41 2a4h s SER 131 N 1.22 6.58 -0.40 2.29 0.15 -1.26 -1.63 113.70 120.64 2a4h s SER 131 Ca 0.02 2.50 0.05 0.00 0.70 0.00 0.00 55.95 59.22 2a4h s SER 131 Cb -0.14 -2.56 0.51 0.00 -1.71 0.00 0.00 66.02 62.12 2a4h s SER 131 CO -0.07 -0.92 1.60 2.30 1.20 0.00 0.00 173.24 177.35 2a4h n ILE 132 N 4.92 2.89 -0.03 6.45 -5.35 0.31 -4.71 119.36 123.84 2a4h n ILE 132 Ca 0.17 -3.00 0.24 0.00 -0.27 0.00 0.00 62.75 59.89 2a4h n ILE 132 Cb 0.41 -0.71 0.69 0.00 -1.74 0.00 0.00 39.64 38.29 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 1.25 0.32 0.00 7.28 1.35 -1.91 -3.42 112.91 117.78 2a4h h THR 133 Ca 0.40 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.26 2a4h h THR 133 Cb 1.61 0.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 2a4h h THR 133 CO 0.85 0.00 0.00 2.29 -0.25 0.00 0.00 175.52 178.41 2a4h n LYS 134 N -3.71 0.00 0.00 4.72 2.85 -1.26 -4.70 118.16 116.06 2a4h n LYS 134 Ca 0.13 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.39 2a4h n LYS 134 Cb 0.89 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.27 2a4h n LYS 134 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 2a4h n TRP 135 N -0.09 0.00 0.00 5.58 7.02 -1.26 -2.92 117.44 125.77 2a4h n TRP 135 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2a4h n TRP 135 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 2a4h n TRP 135 CO 0.00 0.00 0.00 0.27 -2.02 0.00 0.00 177.69 175.94 2a4h n ASN 136 N 0.67 0.00 -0.34 -0.99 6.94 -1.26 -5.16 115.26 115.12 2a4h n ASN 136 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 2a4h n ASN 136 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2a4h n ASN 136 CO 0.00 0.00 0.00 1.07 -1.03 0.00 0.00 177.26 177.30 2a4h n THR 137 N 0.00 0.00 0.00 5.53 5.66 -1.15 -4.61 114.28 119.72 2a4h n THR 137 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2a4h n THR 137 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 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 -3.44 0.00 -0.05 1.09 8.00 -1.26 -3.12 116.55 117.78 2a4h n ASP 138 Ca 0.00 0.00 0.25 0.00 0.71 0.00 0.00 54.79 55.75 2a4h n ASP 138 Cb 0.00 0.00 0.70 0.00 -0.02 0.00 0.00 41.12 41.80 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 0.34 -0.51 -3.53 2.02 -2.00 0.47 112.91 109.70 2a4h h THR 139 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2a4h h THR 139 Cb 0.00 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 2a4h h THR 139 CO 0.00 0.00 0.29 1.62 0.37 0.00 0.00 175.52 177.80 2a4h h VAL 140 N 0.00 1.16 -1.01 3.16 3.04 -1.89 0.18 116.25 120.90 2a4h h VAL 140 Ca 0.32 -0.39 0.15 0.00 -1.01 0.00 0.00 66.70 65.76 2a4h h VAL 140 Cb 1.60 0.50 -0.09 0.00 -2.01 0.00 0.00 31.29 31.29 2a4h h VAL 140 CO -0.00 0.17 0.63 -0.08 -1.01 0.00 0.00 177.57 177.28 2a4h h GLU 141 N 0.68 0.89 -0.01 4.17 4.81 -0.37 0.43 114.58 125.19 2a4h h GLU 141 Ca 0.18 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.22 2a4h h GLU 141 Cb 0.02 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 2a4h h GLU 141 CO -0.03 0.59 -0.62 1.49 -0.73 0.00 0.00 179.01 179.71 2a4h h GLU 142 N 0.92 0.03 -0.71 1.92 4.81 -1.24 -3.06 114.58 117.24 2a4h h GLU 142 Ca 0.53 -0.02 0.16 0.00 -0.13 0.00 0.00 59.36 59.90 2a4h h GLU 142 Cb 0.63 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 29.89 2a4h h GLU 142 CO -0.31 0.64 -0.03 0.35 -0.73 0.00 0.00 179.01 178.93 2a4h h PHE 143 N 0.02 -0.10 0.17 0.92 3.57 0.29 0.11 116.94 121.91 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 1.10 0.16 0.00 0.00 2.79 0.00 0.00 35.95 40.00 2a4h h PHE 143 CO 0.00 -0.23 -0.08 0.74 -2.23 0.00 0.00 178.31 176.51 2a4h h PHE 144 N 0.09 -0.22 -0.99 0.41 0.04 -1.51 0.84 116.94 115.60 2a4h h PHE 144 Ca 0.38 -0.01 0.29 0.00 2.80 0.00 0.00 57.97 61.43 2a4h h PHE 144 Cb 0.64 0.07 -0.04 0.00 2.20 0.00 0.00 35.95 38.82 2a4h h PHE 144 CO -0.43 -0.07 0.89 1.05 -0.60 0.00 0.00 178.31 179.15 2a4h h GLU 145 N -1.05 0.00 0.05 1.51 -0.00 -1.41 1.42 114.58 115.10 2a4h h GLU 145 Ca -0.02 0.00 -0.38 0.00 -0.00 0.00 0.00 59.36 58.96 2a4h h GLU 145 Cb 0.25 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 28.95 2a4h h GLU 145 CO 0.04 0.00 -2.25 0.25 -0.00 0.00 0.00 179.01 177.05 2a4h n THR 146 N -3.76 1.62 0.45 -1.06 -2.24 0.35 -4.31 114.28 105.32 2a4h n THR 146 Ca 0.21 -0.58 0.13 0.00 -2.27 0.00 0.00 64.05 61.54 2a4h n THR 146 Cb 1.21 -1.59 0.35 0.00 -2.10 0.00 0.00 70.33 68.21 2a4h n THR 146 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2a4h h HIS 147 N -0.04 0.00 -1.50 4.78 2.76 0.14 -3.45 115.15 117.84 2a4h h HIS 147 Ca -0.51 0.00 -0.45 0.00 -2.20 0.00 0.00 60.37 57.21 2a4h h HIS 147 Cb 1.93 0.00 0.03 0.00 1.55 0.00 0.00 27.41 30.92 2a4h h HIS 147 CO 0.05 0.00 -0.14 -0.51 -1.30 0.00 0.00 177.93 176.03 2a4h s LEU 148 N -5.21 3.37 0.14 0.26 1.43 0.47 -0.42 118.68 118.71 2a4h s LEU 148 Ca 0.08 -0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 52.60 2a4h s LEU 148 Cb 0.09 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.99 2a4h s LEU 148 CO 0.60 -1.10 0.30 0.00 0.23 0.00 0.00 176.35 176.37 2a4h s ALA 149 N -2.59 -0.30 -0.03 4.21 0.00 -1.26 -4.81 121.76 116.99 2a4h s ALA 149 Ca 0.59 -0.62 -0.25 0.00 0.00 0.00 0.00 51.96 51.67 2a4h s ALA 149 Cb -0.08 0.72 -0.20 0.00 0.00 0.00 0.00 23.12 23.56 2a4h s ALA 149 CO 0.37 -0.62 1.19 0.87 0.00 0.00 0.00 175.76 177.56 2a4h h LYS 150 N 2.54 -0.06 -4.55 0.00 1.79 -1.98 -3.43 116.57 110.89 2a4h h LYS 150 Ca -0.32 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.15 2a4h h LYS 150 Cb 1.23 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 2a4h h LYS 150 CO 0.49 0.43 -0.48 -0.25 -1.08 0.00 0.00 179.45 178.56 2a4h n ASP 151 N -4.88 -6.19 0.00 0.86 9.92 -1.26 -4.98 116.55 110.03 2a4h n ASP 151 Ca -0.09 0.62 0.00 0.00 -0.53 0.00 0.00 54.79 54.80 2a4h n ASP 151 Cb 0.26 -4.06 0.00 0.00 -0.64 0.00 0.00 41.12 36.68 2a4h n ASP 151 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2a4h n GLY 152 N -0.03 1.59 3.15 0.44 0.00 -1.26 -5.15 105.19 103.92 2a4h n GLY 152 Ca 0.05 0.45 0.04 0.00 0.00 0.00 0.00 46.02 46.56 2a4h n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a4h s ALA 153 N 0.00 -2.68 -1.19 4.61 0.00 -1.26 -4.98 121.76 116.26 2a4h s ALA 153 Ca 0.00 1.32 -0.15 0.00 0.00 0.00 0.00 51.96 53.12 2a4h s ALA 153 Cb 0.00 -2.49 -0.01 0.00 0.00 0.00 0.00 23.12 20.62 2a4h s ALA 153 CO 0.00 -1.72 0.74 0.41 0.00 0.00 0.00 175.76 175.18 2a4h n GLY 154 N 5.38 -0.82 0.03 0.00 0.00 -1.26 -4.91 105.19 103.61 2a4h n GLY 154 Ca 0.03 0.38 -0.02 0.00 0.00 0.00 0.00 46.02 46.42 2a4h n GLY 154 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2a4h n LYS 155 N -4.18 2.05 -2.47 1.61 2.85 -1.26 -4.83 118.16 111.93 2a4h n LYS 155 Ca -0.14 -0.02 -0.41 0.00 -1.05 0.00 0.00 58.31 56.68 2a4h n LYS 155 Cb 0.61 -1.20 -0.01 0.00 -0.65 0.00 0.00 35.03 33.79 2a4h n LYS 155 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2a4h n ASN 156 N -2.14 4.61 -0.49 -5.58 5.03 -1.26 -4.89 115.26 110.54 2a4h n ASN 156 Ca -0.09 -2.88 0.00 0.00 0.87 0.00 0.00 54.58 52.47 2a4h n ASN 156 Cb 0.60 -1.74 0.00 0.00 -1.02 0.00 0.00 39.78 37.62 2a4h n ASN 156 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2a4h n SER 157 N 9.22 -4.42 -4.07 6.41 2.88 -1.26 -4.84 113.62 117.54 2a4h n SER 157 Ca 0.48 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.73 2a4h n SER 157 Cb 0.46 0.00 0.19 0.00 -0.75 0.00 0.00 64.21 64.11 2a4h n SER 157 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2a4h s TYR 158 N 0.00 1.31 0.00 0.66 -0.85 -1.26 -4.98 117.35 112.23 2a4h s TYR 158 Ca 0.00 0.13 0.00 0.00 -0.52 0.00 0.00 57.07 56.68 2a4h s TYR 158 Cb 0.00 -4.06 0.00 0.00 0.38 0.00 0.00 41.96 38.28 2a4h s TYR 158 CO 0.00 -2.69 0.00 0.43 -1.52 0.00 0.00 175.55 171.77 2a4h n SER 159 N -3.71 1.09 -3.79 -0.18 7.64 -1.26 -5.08 113.62 108.33 2a4h n SER 159 Ca 0.17 -0.60 -0.22 0.00 1.01 0.00 0.00 58.87 59.23 2a4h n SER 159 Cb 0.59 0.00 0.14 0.00 -1.01 0.00 0.00 64.21 63.93 2a4h n SER 159 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2a4h n VAL 160 N -0.27 0.00 -3.96 0.44 0.24 -1.26 -5.00 118.33 108.52 2a4h n VAL 160 Ca 0.00 -0.09 -0.28 0.00 -2.04 0.00 0.00 64.34 61.93 2a4h n VAL 160 Cb 0.00 -0.45 -0.17 0.00 -1.47 0.00 0.00 33.84 31.76 2a4h n VAL 160 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2a4h s VAL 161 N -2.10 1.28 0.48 3.34 1.01 -1.26 -5.13 120.40 118.02 2a4h s VAL 161 Ca 0.39 -0.45 -0.21 0.00 0.00 0.00 0.00 61.98 61.71 2a4h s VAL 161 Cb -0.05 -1.24 -0.08 0.00 0.00 0.00 0.00 36.38 35.01 2a4h s VAL 161 CO 0.42 0.41 1.09 -1.83 0.00 0.00 0.00 175.10 175.19 2a4h s GLU 162 N 1.60 3.76 -0.50 2.72 -1.05 -1.26 -4.92 118.70 119.05 2a4h s GLU 162 Ca 0.05 1.55 -0.27 0.00 -0.15 0.00 0.00 54.97 56.15 2a4h s GLU 162 Cb -0.13 -2.23 -0.04 0.00 -0.44 0.00 0.00 34.13 31.29 2a4h s GLU 162 CO -0.09 -0.50 2.10 0.34 0.95 0.00 0.00 175.26 178.05 2a4h s ASP 163 N -1.70 5.04 0.00 0.83 -1.08 -1.26 -4.86 116.67 113.63 2a4h s ASP 163 Ca 0.66 0.88 0.00 0.00 -0.52 0.00 0.00 52.55 53.57 2a4h s ASP 163 Cb -0.22 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 2a4h s ASP 163 CO 0.26 -2.46 0.00 0.00 0.52 0.00 0.00 175.17 173.50 2a4h n ALA 164 N 13.58 0.00 -1.17 3.66 0.00 -1.26 -5.05 120.51 130.27 2a4h n ALA 164 Ca 0.28 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 53.19 2a4h n ALA 164 Cb 0.52 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.87 2a4h n ALA 164 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2a4h n ASP 165 N 0.00 0.74 -3.55 0.00 9.92 -1.26 -4.89 116.55 117.51 2a4h n ASP 165 Ca 0.00 0.69 -0.01 0.00 -0.53 0.00 0.00 54.79 54.94 2a4h n ASP 165 Cb 0.00 -0.76 -0.05 0.00 -0.64 0.00 0.00 41.12 39.67 2a4h n ASP 165 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2a4h s GLY 166 N 4.42 -0.24 -0.15 0.44 0.00 -1.26 -5.08 107.32 105.45 2a4h s GLY 166 Ca 0.98 2.92 -0.16 0.00 0.00 0.00 0.00 44.72 48.47 2a4h s GLY 166 CO 0.60 2.91 -0.30 1.34 0.00 0.00 0.00 173.10 177.64 2a4h n ASP 167 N 4.53 1.79 0.01 1.64 2.03 -1.26 -4.85 116.55 120.43 2a4h n ASP 167 Ca -0.14 0.30 -0.01 0.00 0.52 0.00 0.00 54.79 55.46 2a4h n ASP 167 Cb 0.54 -0.69 -0.00 0.00 -0.72 0.00 0.00 41.12 40.25 2a4h n ASP 167 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2a4h h ASP 168 N -0.87 -0.03 -4.01 1.67 1.82 -2.02 -3.51 116.42 109.47 2a4h h ASP 168 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2a4h h ASP 168 Cb 0.87 0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.89 2a4h h ASP 168 CO 0.00 0.01 -0.81 0.47 -1.61 0.00 0.00 179.24 177.30 2a4h n ASP 169 N -2.29 -7.57 -4.53 2.28 8.00 -1.26 -4.49 116.55 106.68 2a4h n ASP 169 Ca -0.00 1.24 -0.23 0.00 0.71 0.00 0.00 54.79 56.51 2a4h n ASP 169 Cb 0.01 -4.14 -0.12 0.00 -0.02 0.00 0.00 41.12 36.86 2a4h n ASP 169 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2a4h n GLU 170 N -1.34 0.43 0.00 -1.24 1.02 -1.26 -4.09 120.64 114.15 2a4h n GLU 170 Ca 0.00 -0.37 0.00 0.00 -0.02 0.00 0.00 57.16 56.77 2a4h n GLU 170 Cb 0.12 -2.66 0.00 0.00 -0.02 0.00 0.00 31.44 28.88 2a4h n GLU 170 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2a4h n ASP 171 N 13.67 0.00 0.00 1.62 2.03 -1.26 -5.16 116.55 127.45 2a4h n ASP 171 Ca 0.53 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.84 2a4h n ASP 171 Cb 0.32 0.24 0.00 0.00 -0.72 0.00 0.00 41.12 40.97 2a4h n ASP 171 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2a4h n TYR 172 N -1.87 -0.46 -4.46 -0.67 9.36 -1.26 -4.74 117.16 113.07 2a4h n TYR 172 Ca 0.00 0.00 -0.23 0.00 3.32 0.00 0.00 57.90 60.99 2a4h n TYR 172 Cb 0.00 0.11 -0.16 0.00 -0.63 0.00 0.00 39.34 38.65 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 1.61 -0.04 2.98 1.43 -1.26 -5.03 118.68 118.38 2a4h s LEU 173 Ca 0.00 -0.24 -0.06 0.00 -1.03 0.00 0.00 54.13 52.81 2a4h s LEU 173 Cb 0.00 -0.69 -0.28 0.00 0.03 0.00 0.00 46.19 45.25 2a4h s LEU 173 CO 0.00 0.03 0.71 0.03 0.23 0.00 0.00 176.35 177.34 2a4h h ARG 174 N 6.86 0.29 -6.07 1.70 -0.00 -2.07 -3.46 114.38 111.63 2a4h h ARG 174 Ca -0.33 -0.50 -0.60 0.00 -0.50 0.00 0.00 59.98 58.05 2a4h h ARG 174 Cb 1.18 0.19 -0.05 0.00 0.00 0.00 0.00 29.97 31.29 2a4h h ARG 174 CO 0.48 1.17 -0.27 0.95 0.00 0.00 0.00 179.97 182.29 2a4h s THR 175 N -2.59 5.13 -0.14 2.04 -4.23 -1.26 -5.09 115.64 109.50 2a4h s THR 175 Ca -0.13 0.39 0.01 0.00 -1.18 0.00 0.00 61.69 60.78 2a4h s THR 175 Cb 0.06 -3.63 0.02 0.00 1.34 0.00 0.00 72.50 70.29 2a4h s THR 175 CO 0.84 0.30 -0.17 0.54 -0.54 0.00 0.00 174.62 175.58 2a4h s ASN 176 N -1.77 2.79 0.00 3.99 4.22 -1.26 -4.90 114.94 118.01 2a4h s ASN 176 Ca 0.32 -0.52 0.00 0.00 -2.14 0.00 0.00 52.86 50.52 2a4h s ASN 176 Cb -0.14 -1.27 0.00 0.00 1.28 0.00 0.00 41.25 41.13 2a4h s ASN 176 CO 0.18 0.01 0.00 0.54 -2.04 0.00 0.00 177.10 175.79 2a4h n ARG 177 N 4.38 0.00 0.00 3.55 1.74 -1.26 -5.30 116.66 119.78 2a4h n ARG 177 Ca -0.19 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 2a4h n ARG 177 Cb 0.51 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.95 2a4h n ARG 177 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62