#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 -3.42 -0.10 3.04 0.00 -1.26 -5.01 120.51 113.75 2a4h n ALA 54 Ca 0.00 0.46 -0.19 0.00 0.00 0.00 0.00 53.44 53.71 2a4h n ALA 54 Cb 0.00 -0.97 -0.08 0.00 0.00 0.00 0.00 19.45 18.40 2a4h n ALA 54 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2a4h n SER 55 N 0.59 1.88 -4.11 0.00 3.41 -1.26 -4.73 113.62 109.40 2a4h n SER 55 Ca 0.00 0.43 -0.37 0.00 -0.26 0.00 0.00 58.87 58.68 2a4h n SER 55 Cb 0.01 -0.88 -0.07 0.00 -0.26 0.00 0.00 64.21 63.01 2a4h n SER 55 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2a4h s HIS 56 N -2.45 3.78 -0.09 7.33 2.46 -1.26 -4.67 115.29 120.39 2a4h s HIS 56 Ca -0.29 -2.92 0.03 0.00 0.47 0.00 0.00 55.06 52.36 2a4h s HIS 56 Cb 0.07 -3.25 0.11 0.00 -0.13 0.00 0.00 32.58 29.38 2a4h s HIS 56 CO 0.47 -0.77 0.73 1.58 -2.47 0.00 0.00 174.74 174.28 2a4h n HIS 57 N 2.65 -0.53 -2.23 3.88 -0.00 -1.26 -5.05 115.22 112.68 2a4h n HIS 57 Ca 0.18 -0.47 -0.42 0.00 -0.00 0.00 0.00 57.72 57.01 2a4h n HIS 57 Cb 0.38 0.77 0.00 0.00 -0.00 0.00 0.00 29.99 31.13 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 -0.40 2.77 0.08 1.57 -0.00 -1.26 -4.38 115.22 113.61 2a4h n HIS 58 Ca -0.06 -2.79 0.00 0.00 0.46 0.00 0.00 57.72 55.33 2a4h n HIS 58 Cb 0.58 -1.88 0.00 0.00 -0.12 0.00 0.00 29.99 28.57 2a4h n HIS 58 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2a4h n HIS 59 N 3.00 -0.98 -3.14 1.57 8.25 -1.26 -5.10 115.22 117.57 2a4h n HIS 59 Ca 0.47 0.17 -0.26 0.00 -0.26 0.00 0.00 57.72 57.85 2a4h n HIS 59 Cb 0.32 0.23 -0.01 0.00 1.12 0.00 0.00 29.99 31.65 2a4h n HIS 59 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2a4h s HIS 60 N -1.93 3.52 -0.31 4.41 0.09 -1.26 -4.73 115.29 115.08 2a4h s HIS 60 Ca 0.00 0.55 -0.08 0.00 -0.00 0.00 0.00 55.06 55.53 2a4h s HIS 60 Cb 0.00 -2.06 0.01 0.00 -0.00 0.00 0.00 32.58 30.53 2a4h s HIS 60 CO 0.00 0.00 0.31 1.58 -0.00 0.00 0.00 174.74 176.63 2a4h n HIS 61 N -1.79 -2.91 0.04 1.40 -0.00 -1.26 -5.00 115.22 105.70 2a4h n HIS 61 Ca -0.03 1.22 -0.02 0.00 -0.00 0.00 0.00 57.72 58.89 2a4h n HIS 61 Cb 0.55 -3.53 -0.01 0.00 -0.00 0.00 0.00 29.99 27.00 2a4h n HIS 61 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2a4h h LEU 62 N 1.87 -0.10 -9.55 0.27 6.46 -2.01 -3.45 115.31 108.81 2a4h h LEU 62 Ca 0.00 0.00 -0.60 0.00 -0.12 0.00 0.00 57.88 57.17 2a4h h LEU 62 Cb 0.51 0.02 0.10 0.00 -0.73 0.00 0.00 40.66 40.56 2a4h h LEU 62 CO 0.13 -0.01 0.38 -0.67 -0.62 0.00 0.00 178.44 177.64 2a4h n ASP 63 N -2.61 2.06 -2.98 1.25 2.03 -1.26 -4.97 116.55 110.08 2a4h n ASP 63 Ca -0.01 1.17 -0.08 0.00 0.52 0.00 0.00 54.79 56.39 2a4h n ASP 63 Cb 0.04 -1.36 -0.02 0.00 -0.72 0.00 0.00 41.12 39.07 2a4h n ASP 63 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2a4h s GLN 64 N -1.12 0.98 -0.07 -0.67 0.74 -1.26 -5.13 119.66 113.12 2a4h s GLN 64 Ca 0.63 -1.09 0.01 0.00 0.05 0.00 0.00 55.36 54.96 2a4h s GLN 64 Cb -0.68 -0.29 0.02 0.00 1.10 0.00 0.00 33.01 33.16 2a4h s GLN 64 CO 0.56 -1.31 -0.08 -1.14 -0.55 0.00 0.00 175.29 172.78 2a4h s GLN 65 N 0.94 1.29 1.21 1.67 0.74 -1.26 -5.15 119.66 119.11 2a4h s GLN 65 Ca 0.27 -0.24 -0.20 0.00 0.05 0.00 0.00 55.36 55.24 2a4h s GLN 65 Cb -0.01 -1.21 0.30 0.00 1.10 0.00 0.00 33.01 33.19 2a4h s GLN 65 CO -0.07 -0.08 0.98 -0.35 -0.55 0.00 0.00 175.29 175.21 2a4h n PRO 66 N 4.18 -3.42 0.00 1.67 -0.04 -1.26 -5.05 135.00 131.08 2a4h n PRO 66 Ca -0.21 -1.59 0.00 0.00 -0.04 0.00 0.00 63.50 61.67 2a4h n PRO 66 Cb 0.51 -1.60 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 2a4h n PRO 66 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a4h n ALA 67 N -4.98 0.00 -1.31 0.55 0.00 -1.26 -5.00 120.51 108.51 2a4h n ALA 67 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.15 2a4h n ALA 67 Cb 0.56 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.11 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 -1.78 -1.05 -2.55 0.00 0.00 -1.26 -5.09 120.51 108.78 2a4h n ALA 68 Ca 0.00 -0.83 -0.23 0.00 0.00 0.00 0.00 53.44 52.38 2a4h n ALA 68 Cb 0.00 -0.05 -0.15 0.00 0.00 0.00 0.00 19.45 19.25 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 -4.35 1.19 -0.49 0.00 -2.07 -1.26 -5.04 119.66 107.64 2a4h s GLN 69 Ca 0.36 -0.54 -0.05 0.00 -1.82 0.00 0.00 55.36 53.31 2a4h s GLN 69 Cb -0.02 -1.15 -0.05 0.00 -1.09 0.00 0.00 33.01 30.70 2a4h s GLN 69 CO 0.26 0.32 3.03 2.89 -1.32 0.00 0.00 175.29 180.46 2a4h n ARG 70 N 2.68 2.62 -0.46 9.60 1.85 -1.26 -4.96 116.66 126.73 2a4h n ARG 70 Ca -0.14 -2.02 -0.28 0.00 -1.00 0.00 0.00 57.85 54.40 2a4h n ARG 70 Cb 0.55 -2.20 0.27 0.00 -1.05 0.00 0.00 32.46 30.03 2a4h n ARG 70 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2a4h s THR 71 N -0.72 1.85 0.29 8.89 -4.23 -1.26 -4.96 115.64 115.50 2a4h s THR 71 Ca 0.62 0.00 0.11 0.00 -1.18 0.00 0.00 61.69 61.23 2a4h s THR 71 Cb 0.32 -2.03 -0.05 0.00 1.34 0.00 0.00 72.50 72.09 2a4h s THR 71 CO -0.12 0.00 -0.09 -0.31 -0.54 0.00 0.00 174.62 173.56 2a4h s TYR 72 N -2.38 2.48 -0.11 3.99 1.51 0.41 -4.94 117.35 118.31 2a4h s TYR 72 Ca 0.69 -0.31 0.16 0.00 -1.01 0.00 0.00 57.07 56.60 2a4h s TYR 72 Cb -0.23 -1.16 -0.17 0.00 -0.11 0.00 0.00 41.96 40.29 2a4h s TYR 72 CO 0.64 0.64 0.72 0.00 -1.11 0.00 0.00 175.55 176.44 2a4h n ALA 73 N -0.78 1.85 -2.98 3.71 0.00 -1.25 -3.74 120.51 117.32 2a4h n ALA 73 Ca -0.05 -0.65 -0.11 0.00 0.00 0.00 0.00 53.44 52.63 2a4h n ALA 73 Cb 0.60 -0.87 -0.08 0.00 0.00 0.00 0.00 19.45 19.10 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 -2.85 0.72 -0.10 0.00 2.20 -0.40 -4.83 119.74 114.48 2a4h s LYS 74 Ca -0.04 -0.51 -0.26 0.00 -0.36 0.00 0.00 55.97 54.80 2a4h s LYS 74 Cb 0.09 0.31 0.06 0.00 -1.51 0.00 0.00 37.83 36.77 2a4h s LYS 74 CO 0.82 -0.22 0.61 0.00 -0.36 0.00 0.00 175.35 176.21 2a4h s ALA 75 N -2.32 -1.57 -0.09 3.13 0.00 -0.43 0.44 121.76 120.92 2a4h s ALA 75 Ca -0.07 1.32 -0.04 0.00 0.00 0.00 0.00 51.96 53.18 2a4h s ALA 75 Cb -0.02 -0.30 0.05 0.00 0.00 0.00 0.00 23.12 22.84 2a4h s ALA 75 CO -0.02 -0.33 0.19 0.42 0.00 0.00 0.00 175.76 176.01 2a4h s ILE 76 N -0.75 -0.18 -1.03 0.00 1.01 0.35 -0.94 121.20 119.65 2a4h s ILE 76 Ca -0.08 0.25 -0.12 0.00 0.00 0.00 0.00 60.65 60.70 2a4h s ILE 76 Cb -0.02 -0.32 0.23 0.00 0.01 0.00 0.00 42.46 42.36 2a4h s ILE 76 CO 0.06 0.11 1.07 -0.22 0.00 0.00 0.00 174.94 175.96 2a4h s LEU 77 N 1.79 6.14 -0.27 2.97 2.96 -1.26 -0.83 118.68 130.18 2a4h s LEU 77 Ca -0.03 -3.11 -0.29 0.00 -0.22 0.00 0.00 54.13 50.48 2a4h s LEU 77 Cb -0.12 -2.26 0.01 0.00 0.50 0.00 0.00 46.19 44.32 2a4h s LEU 77 CO -0.07 -0.51 1.17 -1.61 -1.32 0.00 0.00 176.35 174.01 2a4h s GLU 78 N -0.05 4.09 0.06 1.98 2.02 -1.03 -2.03 118.70 123.75 2a4h s GLU 78 Ca 0.29 1.29 0.01 0.00 0.02 0.00 0.00 54.97 56.59 2a4h s GLU 78 Cb -0.08 -3.77 -0.03 0.00 0.10 0.00 0.00 34.13 30.35 2a4h s GLU 78 CO -0.07 -0.88 -0.06 0.14 0.02 0.00 0.00 175.26 174.41 2a4h s VAL 79 N 3.75 0.50 -0.44 2.63 -7.23 -0.52 -2.29 120.40 116.79 2a4h s VAL 79 Ca 0.50 -1.43 0.23 0.00 -1.81 0.00 0.00 61.98 59.48 2a4h s VAL 79 Cb -0.16 -1.03 0.09 0.00 0.56 0.00 0.00 36.38 35.85 2a4h s VAL 79 CO 0.16 -0.63 1.28 0.00 -0.31 0.00 0.00 175.10 175.60 2a4h n THR 81 N -2.53 0.00 1.03 0.00 -2.24 -1.26 -4.79 114.28 104.49 2a4h n THR 81 Ca 0.02 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.91 2a4h n THR 81 Cb 0.50 -0.81 0.05 0.00 -2.10 0.00 0.00 70.33 67.97 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 -1.10 1.85 0.07 0.00 0.00 -1.26 -4.30 118.16 113.41 2a4h n LYS 83 Ca 0.06 -0.89 0.21 0.00 -0.00 0.00 0.00 58.31 57.69 2a4h n LYS 83 Cb 0.36 -1.45 0.66 0.00 -0.00 0.00 0.00 35.03 34.61 2a4h n LYS 83 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2a4h h PHE 84 N 1.28 0.00 0.00 5.58 -0.00 -1.79 0.72 116.94 122.73 2a4h h PHE 84 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 2a4h h PHE 84 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.57 2a4h h PHE 84 CO 0.24 0.00 -0.28 -0.09 -0.00 0.00 0.00 178.31 178.19 2a4h h ARG 85 N 0.00 0.00 0.43 6.09 2.43 -1.94 -3.31 114.38 118.07 2a4h h ARG 85 Ca 0.23 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 2a4h h ARG 85 Cb 1.46 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.99 2a4h h ARG 85 CO -0.00 0.00 -0.46 0.00 -1.51 0.00 0.00 179.97 178.00 2a4h h ALA 86 N -1.15 -1.10 -2.98 2.80 0.00 -1.74 -3.34 119.26 111.76 2a4h h ALA 86 Ca 0.00 -0.17 -0.68 0.00 0.00 0.00 0.00 54.91 54.06 2a4h h ALA 86 Cb 0.28 0.70 -0.37 0.00 0.00 0.00 0.00 17.79 18.39 2a4h h ALA 86 CO 0.00 -1.14 -0.26 0.71 0.00 0.00 0.00 179.25 178.56 2a4h s TYR 87 N -5.52 3.71 -0.24 0.00 2.02 0.20 -4.89 117.35 112.63 2a4h s TYR 87 Ca -0.16 -3.04 0.26 0.00 -0.37 0.00 0.00 57.07 53.76 2a4h s TYR 87 Cb 0.04 -3.11 0.70 0.00 -0.40 0.00 0.00 41.96 39.19 2a4h s TYR 87 CO 0.53 -0.72 1.74 -1.00 -1.57 0.00 0.00 175.55 174.54 2a4h h PRO 88 N 6.08 0.00 0.03 -1.71 0.13 -1.69 -3.25 132.00 131.59 2a4h h PRO 88 Ca 0.12 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.99 2a4h h PRO 88 Cb 0.83 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.98 2a4h h PRO 88 CO 0.79 0.02 -1.02 1.96 -0.23 0.00 0.00 178.00 179.52 2a4h h GLN 89 N 0.00 0.63 0.00 0.86 4.20 -1.90 -2.98 115.11 115.93 2a4h h GLN 89 Ca -0.00 -0.72 0.00 0.00 0.06 0.00 0.00 58.65 57.99 2a4h h GLN 89 Cb 0.84 0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.83 2a4h h GLN 89 CO 0.00 1.31 0.00 -0.89 -0.67 0.00 0.00 178.83 178.58 2a4h n ILE 90 N -3.91 0.00 -0.15 2.54 5.41 -1.23 -1.63 119.36 120.40 2a4h n ILE 90 Ca -0.12 1.02 0.28 0.00 1.00 0.00 0.00 62.75 64.94 2a4h n ILE 90 Cb 0.87 -1.82 0.64 0.00 -0.71 0.00 0.00 39.64 38.63 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 -0.21 0.38 4.15 -1.75 0.74 115.11 118.42 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 -0.30 0.00 -1.93 0.00 0.00 178.83 176.60 2a4h h ALA 92 N 1.10 -0.27 -0.11 3.38 0.00 -1.14 0.24 119.26 122.46 2a4h h ALA 92 Ca 0.42 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.31 2a4h h ALA 92 Cb 2.16 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 20.53 2a4h h ALA 92 CO -0.00 -0.75 -0.26 0.27 0.00 0.00 0.00 179.25 178.50 2a4h h PHE 93 N -0.33 0.21 -0.79 0.00 -5.15 -0.46 0.16 116.94 110.58 2a4h h PHE 93 Ca 0.12 -0.04 -0.03 0.00 -0.20 0.00 0.00 57.97 57.82 2a4h h PHE 93 Cb 0.52 -0.05 -0.04 0.00 0.22 0.00 0.00 35.95 36.60 2a4h h PHE 93 CO -0.42 0.44 0.37 0.82 -2.00 0.00 0.00 178.31 177.52 2a4h h ILE 94 N 0.17 1.25 0.00 0.88 2.04 -0.89 -2.45 117.51 118.51 2a4h h ILE 94 Ca 0.03 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 2a4h h ILE 94 Cb 0.56 0.24 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2a4h h ILE 94 CO 0.04 0.30 -0.70 1.56 0.00 0.00 0.00 178.15 179.35 2a4h h GLN 95 N 1.12 0.00 -0.77 2.37 4.20 -0.15 -3.34 115.11 118.53 2a4h h GLN 95 Ca 0.27 0.00 0.14 0.00 0.06 0.00 0.00 58.65 59.12 2a4h h GLN 95 Cb 0.12 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.81 2a4h h GLN 95 CO -0.03 0.03 0.34 0.77 -0.67 0.00 0.00 178.83 179.27 2a4h h SER 96 N 0.00 0.36 0.00 1.46 0.02 -0.20 -3.46 113.55 111.74 2a4h h SER 96 Ca -0.01 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2a4h h SER 96 Cb 1.04 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.64 2a4h h SER 96 CO 0.00 0.15 0.00 0.61 -1.14 0.00 0.00 176.83 176.45 2a4h n GLY 97 N -1.32 1.96 0.21 -3.77 0.00 -1.23 -4.99 105.19 96.06 2a4h n GLY 97 Ca 0.15 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 0.94 0.67 0.00 1.61 -0.00 -1.88 -1.89 114.38 113.83 2a4h h ARG 98 Ca 0.00 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.42 2a4h h ARG 98 Cb 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 29.97 29.83 2a4h h ARG 98 CO 0.00 0.48 -0.02 -1.35 0.00 0.00 0.00 179.97 179.08 2a4h h PRO 99 N 0.67 0.00 -0.35 0.04 0.11 -1.87 -1.79 132.00 128.81 2a4h h PRO 99 Ca 0.18 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.22 2a4h h PRO 99 Cb -0.03 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 2a4h h PRO 99 CO -0.04 0.02 -0.07 0.00 -0.21 0.00 0.00 178.00 177.70 2a4h h ALA 100 N 1.98 1.23 0.00 -0.75 0.00 -1.66 -1.66 119.26 118.39 2a4h h ALA 100 Ca -0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2a4h h ALA 100 Cb 0.24 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2a4h h ALA 100 CO 0.00 0.51 -0.04 0.87 0.00 0.00 0.00 179.25 180.59 2a4h h LYS 101 N 0.54 0.00 -6.18 0.00 1.57 -1.32 -3.40 116.57 107.79 2a4h h LYS 101 Ca 0.11 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.30 2a4h h LYS 101 Cb 0.45 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.66 2a4h h LYS 101 CO 0.02 0.04 0.77 -0.06 -0.57 0.00 0.00 179.45 179.65 2a4h s PHE 102 N -3.90 2.68 0.21 -1.35 0.08 -0.63 -4.90 117.98 110.18 2a4h s PHE 102 Ca -0.01 0.15 -0.07 0.00 0.12 0.00 0.00 56.93 57.12 2a4h s PHE 102 Cb 0.11 -4.30 0.15 0.00 -0.57 0.00 0.00 43.02 38.41 2a4h s PHE 102 CO 0.52 -1.50 1.70 -1.00 -0.10 0.00 0.00 175.22 174.84 2a4h h PRO 103 N 9.46 1.03 0.00 0.24 0.13 -1.83 -2.46 132.00 138.56 2a4h h PRO 103 Ca -0.26 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2a4h h PRO 103 Cb 1.06 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2a4h h PRO 103 CO 1.14 0.97 0.00 -0.91 -0.23 0.00 0.00 178.00 178.98 2a4h h ASN 104 N 0.96 0.00 -3.34 1.44 4.21 -1.89 -3.42 115.58 113.53 2a4h h ASN 104 Ca 0.18 0.00 -0.58 0.00 1.21 0.00 0.00 56.30 57.11 2a4h h ASN 104 Cb 0.48 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 37.60 2a4h h ASN 104 CO 0.02 0.00 0.27 -0.22 -1.29 0.00 0.00 177.43 176.21 2a4h s LEU 105 N -5.87 4.19 -0.16 1.61 2.96 -0.93 -1.32 118.68 119.16 2a4h s LEU 105 Ca 0.00 1.09 -0.23 0.00 -0.22 0.00 0.00 54.13 54.78 2a4h s LEU 105 Cb 0.10 -3.13 -0.20 0.00 0.50 0.00 0.00 46.19 43.46 2a4h s LEU 105 CO 0.49 -0.32 0.43 -0.61 -1.32 0.00 0.00 176.35 175.02 2a4h h GLN 106 N 7.28 0.00 -4.90 1.98 5.75 -1.30 -3.47 115.11 120.45 2a4h h GLN 106 Ca -0.32 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.18 2a4h h GLN 106 Cb 1.15 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.70 2a4h h GLN 106 CO 0.81 0.86 -0.19 -0.89 -2.65 0.00 0.00 178.83 176.77 2a4h n ILE 107 N -4.55 -8.92 -3.77 2.39 2.08 -1.26 -4.88 119.36 100.44 2a4h n ILE 107 Ca -0.18 0.23 -0.26 0.00 0.56 0.00 0.00 62.75 63.10 2a4h n ILE 107 Cb 0.51 -6.49 -0.03 0.00 -0.75 0.00 0.00 39.64 32.88 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 -2.68 3.49 -0.82 0.38 2.20 -0.86 -4.90 119.74 116.54 2a4h s LYS 108 Ca 0.09 -0.45 0.02 0.00 -0.36 0.00 0.00 55.97 55.27 2a4h s LYS 108 Cb -0.03 -2.87 0.32 0.00 -1.51 0.00 0.00 37.83 33.74 2a4h s LYS 108 CO 0.62 0.42 1.33 0.66 -0.36 0.00 0.00 175.35 178.02 2a4h n TYR 109 N -0.76 3.33 -0.73 4.03 4.01 -1.25 -1.43 117.16 124.35 2a4h n TYR 109 Ca -0.06 -3.30 -0.24 0.00 -0.16 0.00 0.00 57.90 54.14 2a4h n TYR 109 Cb 0.54 -0.86 0.01 0.00 -0.31 0.00 0.00 39.34 38.73 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 0.09 0.00 -0.28 -0.72 3.14 0.17 -4.77 118.33 115.96 2a4h n VAL 110 Ca 0.37 -0.32 0.03 0.00 -2.96 0.00 0.00 64.34 61.46 2a4h n VAL 110 Cb 0.33 0.00 0.10 0.00 -1.06 0.00 0.00 33.84 33.22 2a4h n VAL 110 CO 0.00 0.00 0.00 0.08 -6.46 0.00 0.00 176.83 170.45 2a4h h ARG 111 N -0.24 0.00 0.00 1.45 0.11 -1.94 -3.39 114.38 110.38 2a4h h ARG 111 Ca -0.27 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.81 2a4h h ARG 111 Cb 0.88 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.96 2a4h h ARG 111 CO 0.22 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.70 2a4h n GLY 112 N -1.52 -1.90 0.00 0.08 0.00 -1.26 -4.95 105.19 95.65 2a4h n GLY 112 Ca 0.12 0.87 0.00 0.00 0.00 0.00 0.00 46.02 47.01 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 -4.89 0.99 4.77 -1.26 -4.97 117.00 111.64 2a4h n LEU 113 Ca 0.00 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.68 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 0.28 1.51 -1.33 0.00 0.00 177.39 177.85 2a4h s ASP 114 N -0.58 6.51 -0.06 -1.43 -4.77 -1.26 -3.39 116.67 111.69 2a4h s ASP 114 Ca 0.00 0.89 -0.30 0.00 -3.30 0.00 0.00 52.55 49.84 2a4h s ASP 114 Cb 0.00 -2.22 -0.06 0.00 -1.09 0.00 0.00 42.92 39.56 2a4h s ASP 114 CO 0.00 -0.23 1.72 -2.84 0.70 0.00 0.00 175.17 174.52 2a4h s PRO 115 N -3.47 4.11 0.05 2.11 0.02 -1.26 -4.62 135.00 131.95 2a4h s PRO 115 Ca 0.47 2.21 0.01 0.00 0.02 0.00 0.00 61.00 63.71 2a4h s PRO 115 Cb -0.11 -4.03 -0.03 0.00 0.02 0.00 0.00 34.50 30.35 2a4h s PRO 115 CO 0.28 -0.94 -0.05 0.08 -0.33 0.00 0.00 177.00 176.05 2a4h s VAL 116 N 4.33 0.34 -0.36 3.83 1.01 -0.97 -1.83 120.40 126.75 2a4h s VAL 116 Ca 0.77 -1.37 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 2a4h s VAL 116 Cb -0.34 -0.93 0.06 0.00 0.00 0.00 0.00 36.38 35.16 2a4h s VAL 116 CO 0.32 -0.68 0.14 0.68 0.00 0.00 0.00 175.10 175.56 2a4h s VAL 117 N -2.50 3.77 -0.42 2.92 -7.23 -0.29 -2.46 120.40 114.20 2a4h s VAL 117 Ca -0.03 -1.31 -0.11 0.00 -1.81 0.00 0.00 61.98 58.72 2a4h s VAL 117 Cb -0.02 -3.22 0.07 0.00 0.56 0.00 0.00 36.38 33.76 2a4h s VAL 117 CO -0.04 -0.30 0.27 -0.54 -0.31 0.00 0.00 175.10 174.18 2a4h s LYS 118 N 1.37 2.72 -1.02 4.82 1.02 -0.01 -2.26 119.74 126.38 2a4h s LYS 118 Ca 0.00 -1.37 -0.14 0.00 0.02 0.00 0.00 55.97 54.49 2a4h s LYS 118 Cb -0.21 -3.84 0.20 0.00 -0.52 0.00 0.00 37.83 33.47 2a4h s LYS 118 CO 0.02 -0.92 1.10 -0.51 -0.92 0.00 0.00 175.35 174.12 2a4h s LEU 119 N 1.49 5.85 0.00 3.17 1.02 -0.04 0.13 118.68 130.30 2a4h s LEU 119 Ca 0.03 -2.85 0.00 0.00 0.02 0.00 0.00 54.13 51.32 2a4h s LEU 119 Cb -0.23 -2.30 0.00 0.00 0.02 0.00 0.00 46.19 43.69 2a4h s LEU 119 CO 0.04 -0.65 0.00 0.18 0.02 0.00 0.00 176.35 175.94 2a4h n LEU 120 N 4.64 0.00 0.02 1.79 4.32 0.17 -1.79 117.00 126.14 2a4h n LEU 120 Ca 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.23 2a4h n LEU 120 Cb 0.44 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.24 2a4h n LEU 120 CO 0.48 -0.46 -0.32 0.47 -1.22 0.00 0.00 177.39 176.34 2a4h n ASP 121 N -2.70 0.38 0.00 -1.43 8.00 -1.26 -1.27 116.55 118.26 2a4h n ASP 121 Ca 0.00 0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.55 2a4h n ASP 121 Cb 0.00 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 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 -3.16 0.00 0.29 2.24 0.00 -1.26 -3.19 120.51 115.43 2a4h n ALA 122 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 2a4h n ALA 122 Cb 0.32 0.00 0.56 0.00 0.00 0.00 0.00 19.45 20.33 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 -0.04 0.00 0.87 -2.01 -3.46 113.55 108.90 2a4h h SER 123 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 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 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.91 2a4h n GLY 124 N 0.27 1.53 0.08 5.77 0.00 -1.26 -5.03 105.19 106.55 2a4h n GLY 124 Ca 0.02 -0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 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 0.08 -2.20 1.61 3.64 -1.96 -3.50 116.57 114.23 2a4h h LYS 125 Ca 0.00 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 2a4h h LYS 125 Cb 0.10 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2a4h h LYS 125 CO 0.00 0.93 0.00 0.28 -2.27 0.00 0.00 179.45 178.39 2a4h n VAL 126 N -4.57 -1.11 -0.21 2.00 0.31 -1.26 -4.97 118.33 108.51 2a4h n VAL 126 Ca -0.10 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.25 2a4h n VAL 126 Cb 0.48 -2.76 0.13 0.00 -0.91 0.00 0.00 33.84 30.78 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 0.00 0.26 -4.05 5.55 1.08 -1.64 -3.43 115.11 112.88 2a4h h GLN 127 Ca 0.00 -0.02 -0.22 0.00 -1.45 0.00 0.00 58.65 56.96 2a4h h GLN 127 Cb 0.36 -0.06 -0.24 0.00 -0.05 0.00 0.00 27.48 27.50 2a4h h GLN 127 CO 0.00 0.17 -0.72 -1.21 -0.95 0.00 0.00 178.83 176.12 2a4h s GLU 128 N -6.09 0.28 -0.27 1.46 2.02 -1.18 -4.99 118.70 109.93 2a4h s GLU 128 Ca -0.13 -0.42 -0.03 0.00 0.02 0.00 0.00 54.97 54.40 2a4h s GLU 128 Cb 0.19 -0.05 0.10 0.00 0.10 0.00 0.00 34.13 34.47 2a4h s GLU 128 CO 0.74 -0.00 0.16 0.99 0.02 0.00 0.00 175.26 177.18 2a4h s THR 129 N -0.90 -0.16 -0.08 3.63 2.01 -1.24 -0.86 115.64 118.04 2a4h s THR 129 Ca -0.09 -0.58 0.03 0.00 0.31 0.00 0.00 61.69 61.36 2a4h s THR 129 Cb -0.06 -0.91 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 2a4h s THR 129 CO -0.00 -0.58 -0.16 -0.76 -0.69 0.00 0.00 174.62 172.42 2a4h s LEU 130 N 2.17 2.56 0.06 4.42 1.43 -0.96 -4.91 118.68 123.47 2a4h s LEU 130 Ca 0.08 -0.32 -0.30 0.00 -1.03 0.00 0.00 54.13 52.56 2a4h s LEU 130 Cb -0.16 -1.53 -0.05 0.00 0.03 0.00 0.00 46.19 44.49 2a4h s LEU 130 CO -0.31 0.25 0.97 -0.55 0.23 0.00 0.00 176.35 176.95 2a4h s SER 131 N -0.19 7.43 -0.56 2.29 0.15 -1.26 -1.14 113.70 120.42 2a4h s SER 131 Ca -0.01 1.74 0.04 0.00 0.70 0.00 0.00 55.95 58.43 2a4h s SER 131 Cb -0.13 -2.58 0.38 0.00 -1.71 0.00 0.00 66.02 61.97 2a4h s SER 131 CO 0.03 -0.16 1.17 2.30 1.20 0.00 0.00 173.24 177.79 2a4h n ILE 132 N 3.27 2.99 -1.17 6.45 -5.35 -0.76 -4.61 119.36 120.17 2a4h n ILE 132 Ca 0.04 -5.20 -0.07 0.00 -0.27 0.00 0.00 62.75 57.25 2a4h n ILE 132 Cb 0.50 -1.33 0.25 0.00 -1.74 0.00 0.00 39.64 37.31 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 -0.37 2.82 0.00 7.28 -2.24 -1.26 -4.67 114.28 115.84 2a4h n THR 133 Ca 0.38 -1.99 0.00 0.00 -2.27 0.00 0.00 64.05 60.17 2a4h n THR 133 Cb 0.50 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 2a4h n THR 133 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2a4h n LYS 134 N -0.64 0.00 -0.30 -0.78 2.85 -1.26 -5.05 118.16 112.98 2a4h n LYS 134 Ca 0.41 0.00 -0.08 0.00 -1.05 0.00 0.00 58.31 57.59 2a4h n LYS 134 Cb 1.30 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 35.61 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 0.00 -0.31 0.00 5.58 7.02 -1.26 -4.72 117.44 123.74 2a4h n TRP 135 Ca 0.00 0.89 0.00 0.00 -1.02 0.00 0.00 57.50 57.37 2a4h n TRP 135 Cb 0.00 -0.56 0.00 0.00 -2.42 0.00 0.00 31.31 28.33 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 -4.88 0.00 -0.49 -0.99 0.23 -1.26 -5.16 115.26 102.70 2a4h n ASN 136 Ca 0.01 0.00 0.02 0.00 -0.53 0.00 0.00 54.58 54.08 2a4h n ASN 136 Cb 0.19 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 37.88 2a4h n ASN 136 CO 0.00 0.00 0.00 1.07 -0.93 0.00 0.00 177.26 177.40 2a4h n THR 137 N 0.00 0.00 0.00 5.53 5.66 -1.26 -4.52 114.28 119.69 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 -0.05 0.00 0.00 -1.55 0.00 0.00 70.33 68.73 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 -3.74 0.00 -0.13 1.09 8.00 -1.26 -3.16 116.55 117.35 2a4h n ASP 138 Ca 0.00 0.00 0.28 0.00 0.71 0.00 0.00 54.79 55.78 2a4h n ASP 138 Cb 0.07 0.00 0.69 0.00 -0.02 0.00 0.00 41.12 41.86 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 0.32 -0.62 -3.53 2.02 -2.00 0.66 112.91 109.76 2a4h h THR 139 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.25 2a4h h THR 139 Cb 0.00 0.43 -0.06 0.00 -1.74 0.00 0.00 68.15 66.78 2a4h h THR 139 CO 0.00 0.00 0.31 1.62 0.37 0.00 0.00 175.52 177.82 2a4h h VAL 140 N 0.00 0.91 -0.56 3.16 3.04 -1.88 0.65 116.25 121.57 2a4h h VAL 140 Ca 0.40 -0.19 0.08 0.00 -1.01 0.00 0.00 66.70 65.97 2a4h h VAL 140 Cb 1.91 0.29 -0.06 0.00 -2.01 0.00 0.00 31.29 31.41 2a4h h VAL 140 CO -0.00 0.10 0.21 -0.08 -1.01 0.00 0.00 177.57 176.79 2a4h h GLU 141 N 0.57 0.39 0.00 4.17 4.81 0.02 0.25 114.58 124.79 2a4h h GLU 141 Ca 0.29 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.44 2a4h h GLU 141 Cb 0.24 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2a4h h GLU 141 CO -0.21 0.26 -0.25 1.49 -0.73 0.00 0.00 179.01 179.57 2a4h h GLU 142 N 0.40 0.00 -0.50 1.92 4.81 -0.98 -2.98 114.58 117.25 2a4h h GLU 142 Ca 0.27 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.60 2a4h h GLU 142 Cb 0.30 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.58 2a4h h GLU 142 CO -0.27 0.25 -0.23 0.35 -0.73 0.00 0.00 179.01 178.38 2a4h h PHE 143 N 0.00 -0.58 0.00 0.92 3.57 0.38 -1.18 116.94 120.06 2a4h h PHE 143 Ca -0.00 0.05 -0.18 0.00 3.53 0.00 0.00 57.97 61.37 2a4h h PHE 143 Cb 0.54 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.59 2a4h h PHE 143 CO 0.00 -0.31 -0.86 0.74 -2.23 0.00 0.00 178.31 175.65 2a4h h PHE 144 N -0.11 0.10 -0.39 0.41 0.04 -1.45 -1.51 116.94 114.03 2a4h h PHE 144 Ca 0.23 -0.06 0.11 0.00 2.80 0.00 0.00 57.97 61.06 2a4h h PHE 144 Cb 0.48 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.60 2a4h h PHE 144 CO -0.51 0.89 0.32 1.05 -0.60 0.00 0.00 178.31 179.46 2a4h h GLU 145 N 0.04 0.00 0.00 1.51 -0.00 -1.08 -2.27 114.58 112.77 2a4h h GLU 145 Ca -0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 59.36 59.22 2a4h h GLU 145 Cb 1.50 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 30.23 2a4h h GLU 145 CO 0.12 0.00 -1.42 -2.37 -0.00 0.00 0.00 179.01 175.34 2a4h n THR 146 N -4.16 0.42 0.19 -1.06 5.66 -1.03 -4.60 114.28 109.70 2a4h n THR 146 Ca 0.07 -0.15 0.09 0.00 -3.05 0.00 0.00 64.05 61.01 2a4h n THR 146 Cb 0.50 -0.93 0.48 0.00 -1.55 0.00 0.00 70.33 68.84 2a4h n THR 146 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2a4h n HIS 147 N -2.84 0.62 -3.80 1.09 8.25 -0.57 -4.66 115.22 113.31 2a4h n HIS 147 Ca -0.13 0.31 -0.24 0.00 -0.26 0.00 0.00 57.72 57.40 2a4h n HIS 147 Cb 0.63 -0.99 -0.03 0.00 1.12 0.00 0.00 29.99 30.72 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 -4.25 3.05 0.16 2.41 1.43 -0.86 0.15 118.68 120.78 2a4h s LEU 148 Ca -0.01 -1.02 -0.03 0.00 -1.03 0.00 0.00 54.13 52.04 2a4h s LEU 148 Cb 0.06 -1.57 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 2a4h s LEU 148 CO 0.20 -0.83 0.14 0.00 0.23 0.00 0.00 176.35 176.09 2a4h s ALA 149 N -2.62 0.68 -0.06 4.21 0.00 -1.25 -4.73 121.76 117.99 2a4h s ALA 149 Ca 0.41 -1.36 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 2a4h s ALA 149 Cb -0.01 0.98 -0.01 0.00 0.00 0.00 0.00 23.12 24.08 2a4h s ALA 149 CO 0.24 -0.56 0.06 0.87 0.00 0.00 0.00 175.76 176.38 2a4h h LYS 150 N 2.72 -0.04 -1.14 0.00 1.79 -1.99 -3.41 116.57 114.50 2a4h h LYS 150 Ca -0.34 0.00 -0.40 0.00 -2.18 0.00 0.00 60.65 57.74 2a4h h LYS 150 Cb 1.22 0.01 -0.40 0.00 -1.58 0.00 0.00 32.23 31.47 2a4h h LYS 150 CO 0.54 -0.03 -1.15 -0.25 -1.08 0.00 0.00 179.45 177.49 2a4h n ASP 151 N -3.81 1.76 0.00 0.86 9.92 -1.26 -4.94 116.55 119.08 2a4h n ASP 151 Ca -0.01 -2.85 0.00 0.00 -0.53 0.00 0.00 54.79 51.41 2a4h n ASP 151 Cb 0.02 -0.53 0.00 0.00 -0.64 0.00 0.00 41.12 39.97 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 -0.08 0.39 2.70 0.44 0.00 -1.26 -4.85 105.19 102.53 2a4h n GLY 152 Ca 0.14 -2.02 -0.05 0.00 0.00 0.00 0.00 46.02 44.08 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 0.93 3.08 -0.01 4.61 0.00 -1.26 -4.91 120.51 122.94 2a4h n ALA 153 Ca 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 53.44 50.46 2a4h n ALA 153 Cb 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.53 0.81 2.52 0.00 0.00 -1.26 -4.76 105.19 101.97 2a4h n GLY 154 Ca 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 0.00 -2.96 -3.30 1.61 4.76 -1.26 -4.93 118.16 112.09 2a4h n LYS 155 Ca 0.00 2.44 -0.46 0.00 -2.87 0.00 0.00 58.31 57.42 2a4h n LYS 155 Cb 0.00 -4.69 -0.01 0.00 -1.84 0.00 0.00 35.03 28.49 2a4h n LYS 155 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2a4h s ASN 156 N -1.36 7.08 0.00 4.39 3.84 -1.26 -4.91 114.94 122.72 2a4h s ASN 156 Ca -0.00 -3.18 0.00 0.00 0.21 0.00 0.00 52.86 49.89 2a4h s ASN 156 Cb 0.00 -2.23 0.00 0.00 -0.55 0.00 0.00 41.25 38.47 2a4h s ASN 156 CO 0.66 -0.45 0.00 -0.24 -2.79 0.00 0.00 177.10 174.28 2a4h n SER 157 N 3.49 0.00 -0.51 -4.21 2.88 -1.26 -0.66 113.62 113.36 2a4h n SER 157 Ca 0.21 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.75 2a4h n SER 157 Cb 0.43 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.89 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 0.00 0.00 0.00 0.66 4.02 -1.26 -5.06 117.16 115.52 2a4h n TYR 158 Ca 0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2a4h n TYR 158 Cb 0.00 0.12 0.00 0.00 -0.02 0.00 0.00 39.34 39.44 2a4h n TYR 158 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2a4h n SER 159 N 0.00 0.00 -3.50 7.72 7.64 0.17 -4.60 113.62 121.05 2a4h n SER 159 Ca -0.00 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.70 2a4h n SER 159 Cb 0.59 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.71 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 0.00 0.00 -0.07 0.44 -7.23 -1.26 -5.08 120.40 107.20 2a4h s VAL 160 Ca 0.00 -1.97 -0.01 0.00 -1.81 0.00 0.00 61.98 58.19 2a4h s VAL 160 Cb 0.00 -2.51 0.03 0.00 0.56 0.00 0.00 36.38 34.46 2a4h s VAL 160 CO 0.00 0.00 0.00 -0.69 -0.31 0.00 0.00 175.10 174.10 2a4h s VAL 161 N -3.55 0.34 1.03 1.32 1.01 -1.26 -5.14 120.40 114.16 2a4h s VAL 161 Ca 0.40 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.39 2a4h s VAL 161 Cb 0.03 -0.49 0.21 0.00 0.00 0.00 0.00 36.38 36.13 2a4h s VAL 161 CO 0.24 0.25 1.08 -0.70 0.00 0.00 0.00 175.10 175.97 2a4h s GLU 162 N 1.86 0.11 -0.93 2.72 2.12 -1.26 -4.91 118.70 118.41 2a4h s GLU 162 Ca 0.03 1.05 -0.21 0.00 0.36 0.00 0.00 54.97 56.21 2a4h s GLU 162 Cb -0.12 -1.66 0.09 0.00 0.26 0.00 0.00 34.13 32.70 2a4h s GLU 162 CO -0.05 -3.09 1.24 0.34 -0.54 0.00 0.00 175.26 173.16 2a4h s ASP 163 N -2.76 6.53 0.05 -1.70 2.15 -1.26 -4.97 116.67 114.71 2a4h s ASP 163 Ca 0.67 -1.68 0.01 0.00 0.43 0.00 0.00 52.55 51.97 2a4h s ASP 163 Cb -0.23 -2.47 -0.03 0.00 -0.30 0.00 0.00 42.92 39.89 2a4h s ASP 163 CO 0.61 -1.28 -0.05 0.00 -0.17 0.00 0.00 175.17 174.27 2a4h s ALA 164 N 3.74 0.47 0.00 3.66 0.00 -1.26 -5.12 121.76 123.26 2a4h s ALA 164 Ca 0.37 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.43 2a4h s ALA 164 Cb -0.04 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.23 2a4h s ALA 164 CO -0.07 -0.18 0.00 -0.25 0.00 0.00 0.00 175.76 175.26 2a4h n ASP 165 N 0.97 -0.49 -4.76 0.00 9.92 -1.26 -4.66 116.55 116.27 2a4h n ASP 165 Ca -0.20 0.00 -0.32 0.00 -0.53 0.00 0.00 54.79 53.74 2a4h n ASP 165 Cb 0.57 0.00 0.08 0.00 -0.64 0.00 0.00 41.12 41.13 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 -0.52 1.91 -0.38 0.44 0.00 -1.26 -5.00 107.32 102.51 2a4h s GLY 166 Ca 0.00 0.44 0.12 0.00 0.00 0.00 0.00 44.72 45.28 2a4h s GLY 166 CO 0.00 0.80 1.12 1.34 0.00 0.00 0.00 173.10 176.36 2a4h n ASP 167 N -3.09 -0.54 0.03 1.64 2.03 -1.26 -4.95 116.55 110.42 2a4h n ASP 167 Ca 0.10 -2.77 0.00 0.00 0.52 0.00 0.00 54.79 52.64 2a4h n ASP 167 Cb 0.52 0.44 0.00 0.00 -0.72 0.00 0.00 41.12 41.36 2a4h n ASP 167 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2a4h n ASP 168 N -0.20 0.05 -4.63 1.67 -0.08 -1.26 -5.09 116.55 107.02 2a4h n ASP 168 Ca 0.05 0.12 -0.42 0.00 -1.51 0.00 0.00 54.79 53.03 2a4h n ASP 168 Cb 0.80 0.06 0.01 0.00 2.34 0.00 0.00 41.12 44.33 2a4h n ASP 168 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2a4h n ASP 169 N -2.89 1.52 -4.70 1.67 8.00 -1.26 -5.01 116.55 113.88 2a4h n ASP 169 Ca 0.00 1.06 -0.25 0.00 0.71 0.00 0.00 54.79 56.31 2a4h n ASP 169 Cb 0.10 -1.38 -0.08 0.00 -0.02 0.00 0.00 41.12 39.74 2a4h n ASP 169 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2a4h s GLU 170 N -2.00 2.16 0.02 -1.24 0.41 -1.26 -5.05 118.70 111.74 2a4h s GLU 170 Ca 0.62 -1.89 0.22 0.00 -0.41 0.00 0.00 54.97 53.52 2a4h s GLU 170 Cb -0.56 -1.91 -0.09 0.00 -1.78 0.00 0.00 34.13 29.80 2a4h s GLU 170 CO 0.57 -0.08 0.90 -3.47 -0.49 0.00 0.00 175.26 172.70 2a4h n ASP 171 N -1.15 0.60 -4.26 -0.19 -0.08 -1.26 -4.98 116.55 105.22 2a4h n ASP 171 Ca -0.02 -0.38 -0.31 0.00 -1.51 0.00 0.00 54.79 52.57 2a4h n ASP 171 Cb 0.65 1.06 0.19 0.00 2.34 0.00 0.00 41.12 45.36 2a4h n ASP 171 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2a4h n TYR 172 N -1.89 -1.50 0.00 -0.67 0.18 -1.26 -5.02 117.16 107.01 2a4h n TYR 172 Ca 0.01 0.05 0.00 0.00 1.88 0.00 0.00 57.90 59.85 2a4h n TYR 172 Cb 0.43 -1.57 0.00 0.00 -0.38 0.00 0.00 39.34 37.83 2a4h n TYR 172 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 2a4h n LEU 173 N -2.34 1.81 -0.00 -3.48 4.77 -1.26 -4.98 117.00 111.52 2a4h n LEU 173 Ca 0.01 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2a4h n LEU 173 Cb 0.60 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.69 2a4h n LEU 173 CO 0.52 0.00 -0.50 -2.11 -1.33 0.00 0.00 177.39 173.97 2a4h n ARG 174 N -0.77 0.00 0.00 3.23 1.85 -1.26 -5.10 116.66 114.60 2a4h n ARG 174 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2a4h n ARG 174 Cb 0.00 -0.52 0.00 0.00 -1.05 0.00 0.00 32.46 30.89 2a4h n ARG 174 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 2a4h n THR 175 N -2.98 0.00 -3.69 8.89 -2.24 -1.26 -5.16 114.28 107.84 2a4h n THR 175 Ca -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2a4h n THR 175 Cb 0.50 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 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 0.00 1.35 0.02 3.42 3.02 -1.26 -5.00 115.26 116.81 2a4h n ASN 176 Ca 0.00 -0.69 0.22 0.00 -0.03 0.00 0.00 54.58 54.08 2a4h n ASN 176 Cb 0.00 0.00 0.73 0.00 -0.61 0.00 0.00 39.78 39.90 2a4h n ASN 176 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2a4h h ARG 177 N 0.00 0.00 0.00 3.52 3.08 -2.07 -3.51 114.38 115.40 2a4h h ARG 177 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2a4h h ARG 177 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2a4h h ARG 177 CO 0.00 0.00 0.00 1.51 -1.07 0.00 0.00 179.97 180.41