#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 0.00 -2.59 3.04 0.00 -1.26 -5.10 120.51 114.59 2a4h n ALA 54 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 2a4h n ALA 54 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2a4h n ALA 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2a4h n SER 55 N -2.57 -7.23 -4.79 0.00 2.88 -1.26 -5.05 113.62 95.60 2a4h n SER 55 Ca 0.00 1.00 -0.23 0.00 -1.33 0.00 0.00 58.87 58.31 2a4h n SER 55 Cb 0.00 -4.80 -0.05 0.00 -0.75 0.00 0.00 64.21 58.61 2a4h n SER 55 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2a4h s HIS 56 N -1.74 3.05 -0.30 0.66 -0.00 -1.26 -5.12 115.29 110.59 2a4h s HIS 56 Ca 0.07 -0.12 -0.14 0.00 -0.00 0.00 0.00 55.06 54.88 2a4h s HIS 56 Cb -0.02 -1.39 0.18 0.00 -0.00 0.00 0.00 32.58 31.35 2a4h s HIS 56 CO 0.68 0.53 1.07 -3.38 -0.00 0.00 0.00 174.74 173.64 2a4h s HIS 57 N -2.10 -0.49 0.00 0.38 -3.43 -1.26 -4.94 115.29 103.45 2a4h s HIS 57 Ca 0.32 0.57 0.00 0.00 -0.80 0.00 0.00 55.06 55.15 2a4h s HIS 57 Cb -0.08 0.19 0.00 0.00 -1.43 0.00 0.00 32.58 31.26 2a4h s HIS 57 CO 0.24 -0.26 0.00 0.72 -2.00 0.00 0.00 174.74 173.43 2a4h n HIS 58 N 5.36 0.00 -2.94 0.38 8.25 -1.26 -4.39 115.22 120.62 2a4h n HIS 58 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 2a4h n HIS 58 Cb 0.54 -0.99 0.00 0.00 1.12 0.00 0.00 29.99 30.66 2a4h n HIS 58 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2a4h n HIS 59 N -2.26 0.00 -2.20 4.41 -0.00 -1.26 -4.94 115.22 108.96 2a4h n HIS 59 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.76 2a4h n HIS 59 Cb 0.16 -0.93 0.04 0.00 -0.00 0.00 0.00 29.99 29.27 2a4h n HIS 59 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2a4h n HIS 60 N 1.67 0.00 -0.00 4.41 -0.00 -1.26 -4.80 115.22 115.24 2a4h n HIS 60 Ca 0.00 -0.53 -0.00 0.00 -0.00 0.00 0.00 57.72 57.18 2a4h n HIS 60 Cb 0.29 -0.14 -0.00 0.00 -0.00 0.00 0.00 29.99 30.14 2a4h n HIS 60 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2a4h n HIS 61 N 0.09 0.00 -2.04 4.41 -0.00 -1.26 -4.96 115.22 111.45 2a4h n HIS 61 Ca 0.07 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.76 2a4h n HIS 61 Cb 0.96 -0.02 -0.03 0.00 -0.00 0.00 0.00 29.99 30.90 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 -2.60 -0.37 -2.25 0.27 7.94 -1.26 -4.99 117.00 113.74 2a4h n LEU 62 Ca -0.01 -1.53 -0.04 0.00 -1.11 0.00 0.00 56.01 53.32 2a4h n LEU 62 Cb 0.02 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 43.97 2a4h n LEU 62 CO 0.01 1.13 -0.05 -0.90 -1.11 0.00 0.00 177.39 176.47 2a4h n ASP 63 N 0.04 -1.90 -3.40 1.96 5.68 -1.26 -2.02 116.55 115.64 2a4h n ASP 63 Ca -0.12 0.34 -0.15 0.00 -0.50 0.00 0.00 54.79 54.36 2a4h n ASP 63 Cb 0.65 -1.77 0.01 0.00 -1.14 0.00 0.00 41.12 38.87 2a4h n ASP 63 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2a4h n GLN 64 N -2.39 -1.58 -1.60 0.11 6.02 -1.26 -4.81 117.38 111.87 2a4h n GLN 64 Ca -0.05 1.23 -0.48 0.00 -0.01 0.00 0.00 57.00 57.69 2a4h n GLN 64 Cb 0.47 -3.87 -0.04 0.00 1.02 0.00 0.00 30.24 27.83 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 -1.84 1.39 -1.51 -1.09 7.27 -0.86 -4.64 117.38 116.10 2a4h n GLN 65 Ca -0.14 0.49 -0.31 0.00 0.07 0.00 0.00 57.00 57.12 2a4h n GLN 65 Cb 0.60 -2.03 -0.17 0.00 2.41 0.00 0.00 30.24 31.06 2a4h n GLN 65 CO 0.00 0.00 0.00 -2.30 0.07 0.00 0.00 177.06 174.83 2a4h n PRO 66 N 1.78 0.13 -3.21 3.69 -0.02 -1.26 -4.78 135.00 131.32 2a4h n PRO 66 Ca 0.14 -0.07 -0.24 0.00 -2.02 0.00 0.00 63.50 61.32 2a4h n PRO 66 Cb 0.27 -1.62 -0.06 0.00 -0.02 0.00 0.00 33.50 32.06 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 9.50 2.59 -0.07 3.55 0.00 -1.26 -4.86 120.51 129.95 2a4h n ALA 67 Ca 0.63 -3.57 -0.09 0.00 0.00 0.00 0.00 53.44 50.41 2a4h n ALA 67 Cb 0.15 -0.83 -0.09 0.00 0.00 0.00 0.00 19.45 18.67 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 1.16 1.66 0.00 0.00 0.00 -1.26 -4.68 120.51 117.39 2a4h n ALA 68 Ca 0.23 -0.78 0.06 0.00 0.00 0.00 0.00 53.44 52.95 2a4h n ALA 68 Cb 0.53 0.05 -0.10 0.00 0.00 0.00 0.00 19.45 19.94 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 -2.73 0.42 -4.17 0.00 0.00 -1.26 -5.02 117.38 104.62 2a4h n GLN 69 Ca -0.25 -0.11 -0.30 0.00 0.00 0.00 0.00 57.00 56.34 2a4h n GLN 69 Cb 0.86 -1.29 -0.06 0.00 0.00 0.00 0.00 30.24 29.75 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 -1.92 -1.68 -0.83 2.61 1.85 -1.26 -4.76 116.66 110.67 2a4h n ARG 70 Ca -0.02 0.20 -0.34 0.00 -1.00 0.00 0.00 57.85 56.69 2a4h n ARG 70 Cb 0.32 -3.84 0.11 0.00 -1.05 0.00 0.00 32.46 28.00 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 -4.55 0.00 -3.71 8.89 -2.24 -1.26 -4.97 114.28 106.44 2a4h n THR 71 Ca -0.31 -0.27 -0.24 0.00 -2.27 0.00 0.00 64.05 60.97 2a4h n THR 71 Cb 0.68 -0.44 -0.00 0.00 -2.10 0.00 0.00 70.33 68.47 2a4h n THR 71 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2a4h s TYR 72 N -2.26 1.87 -0.12 4.78 1.51 0.27 -4.95 117.35 118.44 2a4h s TYR 72 Ca 0.52 -0.74 0.17 0.00 -1.01 0.00 0.00 57.07 56.00 2a4h s TYR 72 Cb -0.17 -2.01 -0.16 0.00 -0.11 0.00 0.00 41.96 39.51 2a4h s TYR 72 CO 0.71 -0.47 0.75 0.00 -1.11 0.00 0.00 175.55 175.43 2a4h n ALA 73 N -1.76 1.93 -3.58 3.71 0.00 -1.26 -4.35 120.51 115.20 2a4h n ALA 73 Ca 0.02 -0.60 -0.08 0.00 0.00 0.00 0.00 53.44 52.77 2a4h n ALA 73 Cb 0.63 -0.89 -0.02 0.00 0.00 0.00 0.00 19.45 19.17 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 -2.91 1.18 0.04 0.00 2.20 -0.90 -4.89 119.74 114.44 2a4h s LYS 74 Ca -0.04 -0.53 -0.28 0.00 -0.36 0.00 0.00 55.97 54.77 2a4h s LYS 74 Cb 0.09 0.48 0.09 0.00 -1.51 0.00 0.00 37.83 36.98 2a4h s LYS 74 CO 0.82 -0.53 0.96 0.00 -0.36 0.00 0.00 175.35 176.24 2a4h s ALA 75 N -3.46 -1.81 -0.14 3.13 0.00 -0.18 0.11 121.76 119.41 2a4h s ALA 75 Ca 0.06 0.72 -0.10 0.00 0.00 0.00 0.00 51.96 52.64 2a4h s ALA 75 Cb -0.02 0.46 0.04 0.00 0.00 0.00 0.00 23.12 23.60 2a4h s ALA 75 CO -0.06 -0.83 0.35 0.42 0.00 0.00 0.00 175.76 175.65 2a4h s ILE 76 N -3.09 -0.01 -1.00 0.00 1.01 0.42 -1.88 121.20 116.64 2a4h s ILE 76 Ca 0.08 0.04 -0.11 0.00 0.00 0.00 0.00 60.65 60.67 2a4h s ILE 76 Cb -0.01 -0.51 0.26 0.00 0.01 0.00 0.00 42.46 42.21 2a4h s ILE 76 CO -0.05 0.02 0.98 -0.22 0.00 0.00 0.00 174.94 175.67 2a4h s LEU 77 N 0.65 6.51 -0.33 2.97 2.96 -1.26 -1.07 118.68 129.12 2a4h s LEU 77 Ca -0.04 -3.25 -0.29 0.00 -0.22 0.00 0.00 54.13 50.34 2a4h s LEU 77 Cb -0.05 -2.21 0.02 0.00 0.50 0.00 0.00 46.19 44.45 2a4h s LEU 77 CO -0.04 -0.40 1.05 -1.61 -1.32 0.00 0.00 176.35 174.04 2a4h s GLU 78 N -0.71 4.04 -0.02 1.98 2.02 -0.97 -1.74 118.70 123.30 2a4h s GLU 78 Ca 0.26 1.01 0.01 0.00 0.02 0.00 0.00 54.97 56.26 2a4h s GLU 78 Cb -0.10 -3.74 0.01 0.00 0.10 0.00 0.00 34.13 30.40 2a4h s GLU 78 CO -0.08 -0.91 -0.02 0.14 0.02 0.00 0.00 175.26 174.41 2a4h s VAL 79 N 3.63 0.29 -2.02 2.63 -7.23 -0.53 -1.37 120.40 115.81 2a4h s VAL 79 Ca 0.44 -0.06 0.14 0.00 -1.81 0.00 0.00 61.98 60.69 2a4h s VAL 79 Cb -0.12 -0.31 0.40 0.00 0.56 0.00 0.00 36.38 36.90 2a4h s VAL 79 CO 0.16 0.13 1.34 0.00 -0.31 0.00 0.00 175.10 176.42 2a4h n THR 81 N 0.79 -0.05 0.15 0.00 -2.24 -1.26 -4.77 114.28 106.89 2a4h n THR 81 Ca 0.15 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.95 2a4h n THR 81 Cb 0.38 -1.34 0.19 0.00 -2.10 0.00 0.00 70.33 67.45 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 -3.49 2.43 -0.22 0.00 -0.00 -1.26 -4.41 118.16 111.21 2a4h n LYS 83 Ca 0.00 -1.36 0.31 0.00 -0.00 0.00 0.00 58.31 57.26 2a4h n LYS 83 Cb 0.63 -1.64 0.69 0.00 -0.00 0.00 0.00 35.03 34.71 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 1.89 0.00 0.01 5.58 3.57 -1.80 0.28 116.94 126.47 2a4h h PHE 84 Ca 0.00 0.00 -0.37 0.00 3.53 0.00 0.00 57.97 61.13 2a4h h PHE 84 Cb 0.92 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.60 2a4h h PHE 84 CO 0.40 0.00 -2.05 -2.13 -2.23 0.00 0.00 178.31 172.30 2a4h n ARG 85 N -3.83 0.60 0.17 1.11 3.00 -1.26 -4.02 116.66 112.43 2a4h n ARG 85 Ca 0.22 0.37 -0.11 0.00 -0.00 0.00 0.00 57.85 58.32 2a4h n ARG 85 Cb 1.20 -1.60 -0.06 0.00 0.00 0.00 0.00 32.46 32.00 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 -0.67 -0.48 -1.81 5.13 0.00 -1.64 -3.37 119.26 116.42 2a4h h ALA 86 Ca -0.55 -0.18 -0.70 0.00 0.00 0.00 0.00 54.91 53.48 2a4h h ALA 86 Cb 1.56 0.19 -0.35 0.00 0.00 0.00 0.00 17.79 19.18 2a4h h ALA 86 CO -0.29 -0.52 0.16 0.66 0.00 0.00 0.00 179.25 179.26 2a4h n TYR 87 N -5.12 3.41 0.30 0.00 4.01 0.92 -4.81 117.16 115.87 2a4h n TYR 87 Ca -0.08 -3.32 0.12 0.00 -0.16 0.00 0.00 57.90 54.46 2a4h n TYR 87 Cb 0.26 -0.84 0.54 0.00 -0.31 0.00 0.00 39.34 39.00 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 -0.06 0.18 0.04 -0.72 -0.04 -1.22 -2.26 135.00 130.91 2a4h n PRO 88 Ca 0.38 0.52 -0.16 0.00 -0.04 0.00 0.00 63.50 64.19 2a4h n PRO 88 Cb 0.33 -1.92 -0.06 0.00 -0.04 0.00 0.00 33.50 31.81 2a4h n PRO 88 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2a4h h GLN 89 N 0.00 0.59 0.00 0.54 4.20 -1.91 -2.98 115.11 115.56 2a4h h GLN 89 Ca 0.00 -0.57 0.00 0.00 0.06 0.00 0.00 58.65 58.14 2a4h h GLN 89 Cb 0.22 0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.15 2a4h h GLN 89 CO 0.00 1.19 0.00 -0.89 -0.67 0.00 0.00 178.83 178.46 2a4h n ILE 90 N -3.84 0.00 -0.14 2.54 5.41 -0.96 -1.56 119.36 120.81 2a4h n ILE 90 Ca -0.08 1.01 0.28 0.00 1.00 0.00 0.00 62.75 64.96 2a4h n ILE 90 Cb 0.81 -1.78 0.66 0.00 -0.71 0.00 0.00 39.64 38.62 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 -0.30 0.38 4.15 -1.73 -0.16 115.11 117.45 2a4h h GLN 91 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.49 2a4h h GLN 91 Cb 0.00 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 27.61 2a4h h GLN 91 CO 0.00 0.00 -0.28 0.00 -1.93 0.00 0.00 178.83 176.62 2a4h h ALA 92 N 1.16 -0.16 -0.16 3.38 0.00 -1.12 0.33 119.26 122.70 2a4h h ALA 92 Ca 0.41 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.34 2a4h h ALA 92 Cb 2.05 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 20.42 2a4h h ALA 92 CO -0.00 -0.70 -0.21 0.27 0.00 0.00 0.00 179.25 178.61 2a4h h PHE 93 N -0.26 0.30 -0.96 0.00 -5.15 -0.66 0.70 116.94 110.90 2a4h h PHE 93 Ca 0.15 -0.05 -0.00 0.00 -0.20 0.00 0.00 57.97 57.87 2a4h h PHE 93 Cb 0.50 -0.08 -0.05 0.00 0.22 0.00 0.00 35.95 36.55 2a4h h PHE 93 CO -0.46 0.47 0.60 0.82 -2.00 0.00 0.00 178.31 177.75 2a4h h ILE 94 N 0.25 1.26 0.00 0.88 2.04 -0.74 -1.68 117.51 119.52 2a4h h ILE 94 Ca 0.04 -0.53 -0.06 0.00 1.00 0.00 0.00 64.86 65.32 2a4h h ILE 94 Cb 0.51 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 2a4h h ILE 94 CO 0.03 0.26 -0.33 1.56 0.00 0.00 0.00 178.15 179.68 2a4h h GLN 95 N 1.32 0.00 -0.72 2.37 4.20 0.14 -3.33 115.11 119.09 2a4h h GLN 95 Ca 0.35 0.00 0.15 0.00 0.06 0.00 0.00 58.65 59.20 2a4h h GLN 95 Cb -0.09 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.55 2a4h h GLN 95 CO -0.07 0.25 -0.16 1.03 -0.67 0.00 0.00 178.83 179.21 2a4h h SER 96 N 0.00 -0.63 0.00 1.46 0.87 0.11 -3.46 113.55 111.90 2a4h h SER 96 Ca -0.01 0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 2a4h h SER 96 Cb 1.21 0.43 0.00 0.00 -0.44 0.00 0.00 62.40 63.60 2a4h h SER 96 CO 0.03 -0.23 0.00 0.61 -0.53 0.00 0.00 176.83 176.71 2a4h n GLY 97 N -1.47 2.18 0.22 5.77 0.00 -1.24 -4.99 105.19 105.66 2a4h n GLY 97 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 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 0.69 0.00 1.61 -0.00 -1.88 -2.21 114.38 112.59 2a4h h ARG 98 Ca 0.00 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.98 59.39 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 0.54 -0.03 -1.35 0.00 0.00 0.00 179.97 179.13 2a4h h PRO 99 N 0.66 0.00 -0.26 0.04 0.11 -1.86 -1.45 132.00 129.24 2a4h h PRO 99 Ca 0.17 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.27 2a4h h PRO 99 Cb 0.05 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 2a4h h PRO 99 CO -0.03 0.03 0.09 0.00 -0.21 0.00 0.00 178.00 177.89 2a4h h ALA 100 N 1.97 1.68 0.00 -0.75 0.00 -1.71 0.32 119.26 120.76 2a4h h ALA 100 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2a4h h ALA 100 Cb 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2a4h h ALA 100 CO 0.00 0.25 0.00 1.63 0.00 0.00 0.00 179.25 181.14 2a4h n LYS 101 N -4.42 0.19 -3.18 0.00 5.02 -0.55 -4.38 118.16 110.85 2a4h n LYS 101 Ca 0.01 0.39 -0.46 0.00 -2.02 0.00 0.00 58.31 56.23 2a4h n LYS 101 Cb 0.14 -1.85 -0.03 0.00 -0.02 0.00 0.00 35.03 33.27 2a4h n LYS 101 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2a4h s PHE 102 N -3.28 3.35 0.18 2.13 0.08 0.10 -4.91 117.98 115.63 2a4h s PHE 102 Ca 0.05 -1.49 -0.13 0.00 0.12 0.00 0.00 56.93 55.48 2a4h s PHE 102 Cb 0.10 -3.97 0.08 0.00 -0.57 0.00 0.00 43.02 38.65 2a4h s PHE 102 CO 0.41 -1.19 1.82 -1.00 -0.10 0.00 0.00 175.22 175.17 2a4h h PRO 103 N 8.54 0.77 -0.12 0.24 0.13 -1.81 -1.55 132.00 138.20 2a4h h PRO 103 Ca -0.04 -0.06 0.03 0.00 -0.87 0.00 0.00 66.00 65.06 2a4h h PRO 103 Cb 1.06 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 32.02 2a4h h PRO 103 CO 0.96 0.54 0.25 -0.91 -0.23 0.00 0.00 178.00 178.61 2a4h h ASN 104 N 0.77 0.00 -3.01 1.44 4.21 -1.91 -3.35 115.58 113.74 2a4h h ASN 104 Ca 0.21 0.00 -0.72 0.00 1.21 0.00 0.00 56.30 56.99 2a4h h ASN 104 Cb -0.04 0.00 -0.21 0.00 -1.12 0.00 0.00 38.32 36.95 2a4h h ASN 104 CO -0.04 0.00 -0.03 -0.22 -1.29 0.00 0.00 177.43 175.85 2a4h s LEU 105 N -6.68 5.65 0.18 1.61 2.96 -0.58 -1.02 118.68 120.81 2a4h s LEU 105 Ca -0.04 -1.52 -0.13 0.00 -0.22 0.00 0.00 54.13 52.22 2a4h s LEU 105 Cb 0.13 -2.27 0.12 0.00 0.50 0.00 0.00 46.19 44.66 2a4h s LEU 105 CO 0.43 -0.99 1.81 -0.61 -1.32 0.00 0.00 176.35 175.67 2a4h h GLN 106 N 9.05 0.58 -4.94 1.98 5.75 -1.51 -3.46 115.11 122.55 2a4h h GLN 106 Ca -0.29 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.17 2a4h h GLN 106 Cb 1.09 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.51 2a4h h GLN 106 CO 1.06 0.38 -0.07 -0.89 -2.65 0.00 0.00 178.83 176.66 2a4h n ILE 107 N -4.81 -8.73 -3.75 2.39 2.08 -1.26 -4.88 119.36 100.39 2a4h n ILE 107 Ca 0.04 -0.04 -0.35 0.00 0.56 0.00 0.00 62.75 62.96 2a4h n ILE 107 Cb 0.10 -6.40 -0.05 0.00 -0.75 0.00 0.00 39.64 32.53 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 -2.89 3.59 -0.97 0.38 2.20 -0.71 -4.89 119.74 116.45 2a4h s LYS 108 Ca 0.03 -0.06 -0.01 0.00 -0.36 0.00 0.00 55.97 55.57 2a4h s LYS 108 Cb -0.01 -3.08 0.30 0.00 -1.51 0.00 0.00 37.83 33.53 2a4h s LYS 108 CO 0.62 0.65 1.32 0.66 -0.36 0.00 0.00 175.35 178.24 2a4h n TYR 109 N 1.14 2.59 -0.91 4.03 4.01 -1.26 -1.45 117.16 125.31 2a4h n TYR 109 Ca -0.11 -2.95 -0.36 0.00 -0.16 0.00 0.00 57.90 54.31 2a4h n TYR 109 Cb 0.53 -1.08 0.07 0.00 -0.31 0.00 0.00 39.34 38.55 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 1.14 0.00 0.03 -0.72 3.14 0.94 -4.80 118.33 118.06 2a4h n VAL 110 Ca 0.28 -0.08 0.08 0.00 -2.96 0.00 0.00 64.34 61.66 2a4h n VAL 110 Cb 0.35 -0.16 -0.12 0.00 -1.06 0.00 0.00 33.84 32.86 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 1.30 0.55 0.00 1.45 5.12 -1.26 -4.01 116.66 119.81 2a4h n ARG 111 Ca -0.01 -0.13 0.00 0.00 -1.93 0.00 0.00 57.85 55.78 2a4h n ARG 111 Cb 0.70 -1.35 0.00 0.00 -1.16 0.00 0.00 32.46 30.65 2a4h n ARG 111 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2a4h n GLY 112 N 1.62 0.00 3.75 -0.13 0.00 -1.26 -4.95 105.19 104.23 2a4h n GLY 112 Ca -0.02 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.51 3.86 0.86 0.99 2.01 -1.26 -4.84 118.68 117.81 2a4h s LEU 113 Ca 0.00 2.71 -0.12 0.00 0.01 0.00 0.00 54.13 56.72 2a4h s LEU 113 Cb 0.00 -4.28 0.11 0.00 0.01 0.00 0.00 46.19 42.04 2a4h s LEU 113 CO 0.00 -1.50 1.16 1.51 1.01 0.00 0.00 176.35 178.53 2a4h s ASP 114 N -1.01 3.96 -0.22 2.29 1.47 -1.26 -2.23 116.67 119.67 2a4h s ASP 114 Ca 0.71 0.86 -0.28 0.00 1.18 0.00 0.00 52.55 55.02 2a4h s ASP 114 Cb -0.39 -1.39 -0.05 0.00 -0.34 0.00 0.00 42.92 40.76 2a4h s ASP 114 CO 0.46 -2.26 2.07 -2.84 0.68 0.00 0.00 175.17 173.28 2a4h s PRO 115 N -5.43 3.30 0.04 2.11 0.02 -1.25 -4.44 135.00 129.35 2a4h s PRO 115 Ca 0.63 1.93 -0.00 0.00 0.02 0.00 0.00 61.00 63.58 2a4h s PRO 115 Cb -0.13 -4.30 -0.03 0.00 0.02 0.00 0.00 34.50 30.07 2a4h s PRO 115 CO 0.51 -1.90 -0.04 0.08 -0.33 0.00 0.00 177.00 175.32 2a4h s VAL 116 N 7.48 0.22 -0.41 3.83 1.01 -0.47 -0.49 120.40 131.56 2a4h s VAL 116 Ca 0.93 -1.35 -0.06 0.00 0.00 0.00 0.00 61.98 61.50 2a4h s VAL 116 Cb -0.31 -0.88 0.09 0.00 0.00 0.00 0.00 36.38 35.28 2a4h s VAL 116 CO 0.35 -0.72 0.23 0.68 0.00 0.00 0.00 175.10 175.64 2a4h s VAL 117 N -2.59 3.80 -0.28 2.92 -7.23 -1.00 -2.29 120.40 113.73 2a4h s VAL 117 Ca -0.05 -1.69 -0.07 0.00 -1.81 0.00 0.00 61.98 58.37 2a4h s VAL 117 Cb -0.02 -3.43 0.00 0.00 0.56 0.00 0.00 36.38 33.49 2a4h s VAL 117 CO -0.05 -0.58 0.07 -0.54 -0.31 0.00 0.00 175.10 173.69 2a4h s LYS 118 N 1.30 3.19 0.14 4.82 1.02 -0.23 -3.01 119.74 126.97 2a4h s LYS 118 Ca 0.04 -0.79 -0.17 0.00 0.02 0.00 0.00 55.97 55.07 2a4h s LYS 118 Cb -0.23 -3.34 -0.07 0.00 -0.52 0.00 0.00 37.83 33.67 2a4h s LYS 118 CO -0.01 -0.39 0.61 -0.51 -0.92 0.00 0.00 175.35 174.13 2a4h s LEU 119 N 1.51 4.41 0.00 3.17 1.02 -0.78 0.16 118.68 128.17 2a4h s LEU 119 Ca 0.03 1.24 0.06 0.00 0.02 0.00 0.00 54.13 55.48 2a4h s LEU 119 Cb -0.17 -3.23 -0.02 0.00 0.02 0.00 0.00 46.19 42.79 2a4h s LEU 119 CO 0.02 0.14 0.21 0.18 0.02 0.00 0.00 176.35 176.92 2a4h n LEU 120 N 1.09 0.00 -0.07 1.79 4.32 0.29 -0.34 117.00 124.09 2a4h n LEU 120 Ca -0.06 -2.98 -0.14 0.00 -0.02 0.00 0.00 56.01 52.81 2a4h n LEU 120 Cb 0.51 1.31 -0.05 0.00 -1.62 0.00 0.00 43.42 43.57 2a4h n LEU 120 CO 0.42 -0.48 -0.97 -0.67 -1.22 0.00 0.00 177.39 174.48 2a4h n ASP 121 N -1.67 1.17 0.00 -1.43 2.03 -1.26 -2.13 116.55 113.26 2a4h n ASP 121 Ca 0.02 0.14 0.00 0.00 0.52 0.00 0.00 54.79 55.47 2a4h n ASP 121 Cb 0.58 -0.38 0.00 0.00 -0.72 0.00 0.00 41.12 40.59 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 -3.54 0.00 0.27 -1.67 0.00 -1.26 -4.46 120.51 109.84 2a4h n ALA 122 Ca -0.27 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.33 2a4h n ALA 122 Cb 0.70 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.79 2a4h n ALA 122 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2a4h h SER 123 N 0.00 0.00 0.00 0.00 0.02 -2.04 -3.46 113.55 108.07 2a4h h SER 123 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2a4h h SER 123 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2a4h h SER 123 CO 0.00 0.05 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 2a4h n GLY 124 N 0.05 1.90 0.22 -3.77 0.00 -1.26 -5.03 105.19 97.30 2a4h n GLY 124 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 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 0.47 -4.53 1.61 1.63 -1.93 -3.48 116.57 110.34 2a4h h LYS 125 Ca 0.00 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 2a4h h LYS 125 Cb 0.00 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.52 2a4h h LYS 125 CO 0.00 0.31 -0.33 0.28 -3.45 0.00 0.00 179.45 176.27 2a4h n VAL 126 N -4.91 -8.10 -0.27 2.00 0.31 -1.25 -4.92 118.33 101.18 2a4h n VAL 126 Ca 0.06 0.58 0.02 0.00 -0.01 0.00 0.00 64.34 64.99 2a4h n VAL 126 Cb 0.18 -6.21 0.23 0.00 -0.91 0.00 0.00 33.84 27.13 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 1.31 1.02 -3.99 5.55 1.08 -1.00 -3.44 115.11 115.64 2a4h h GLN 127 Ca 0.00 -0.06 -0.16 0.00 -1.45 0.00 0.00 58.65 56.98 2a4h h GLN 127 Cb 0.68 -0.23 -0.20 0.00 -0.05 0.00 0.00 27.48 27.68 2a4h h GLN 127 CO 0.14 0.67 -0.68 -1.21 -0.95 0.00 0.00 178.83 176.80 2a4h s GLU 128 N -5.89 0.38 -0.29 1.46 2.02 -1.18 -4.99 118.70 110.21 2a4h s GLU 128 Ca -0.11 -0.70 0.00 0.00 0.02 0.00 0.00 54.97 54.18 2a4h s GLU 128 Cb 0.19 0.14 0.15 0.00 0.10 0.00 0.00 34.13 34.70 2a4h s GLU 128 CO 0.79 -0.07 0.35 0.99 0.02 0.00 0.00 175.26 177.34 2a4h s THR 129 N -1.89 -0.51 -0.17 3.63 2.01 -1.26 -1.86 115.64 115.60 2a4h s THR 129 Ca -0.12 -0.37 0.01 0.00 0.31 0.00 0.00 61.69 61.52 2a4h s THR 129 Cb -0.07 -0.97 0.02 0.00 0.01 0.00 0.00 72.50 71.49 2a4h s THR 129 CO -0.02 -0.36 -0.20 -0.76 -0.69 0.00 0.00 174.62 172.58 2a4h s LEU 130 N 2.45 2.14 0.40 4.42 1.43 -1.16 -4.95 118.68 123.41 2a4h s LEU 130 Ca 0.10 -0.63 -0.27 0.00 -1.03 0.00 0.00 54.13 52.30 2a4h s LEU 130 Cb -0.13 -1.48 -0.10 0.00 0.03 0.00 0.00 46.19 44.51 2a4h s LEU 130 CO -0.30 0.03 1.45 -0.24 0.23 0.00 0.00 176.35 177.51 2a4h n SER 131 N 4.45 3.51 -1.23 2.29 2.88 -1.26 -2.36 113.62 121.88 2a4h n SER 131 Ca -0.21 1.18 0.00 0.00 -1.33 0.00 0.00 58.87 58.52 2a4h n SER 131 Cb 0.51 -1.60 0.12 0.00 -0.75 0.00 0.00 64.21 62.48 2a4h n SER 131 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2a4h n ILE 132 N 0.17 1.60 0.02 2.46 -5.35 0.35 -4.81 119.36 113.81 2a4h n ILE 132 Ca 0.03 -2.78 0.22 0.00 -0.27 0.00 0.00 62.75 59.96 2a4h n ILE 132 Cb 0.40 0.07 0.69 0.00 -1.74 0.00 0.00 39.64 39.06 2a4h n ILE 132 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 2a4h h THR 133 N 3.13 0.30 0.00 7.28 1.35 -1.92 -3.42 112.91 119.63 2a4h h THR 133 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 2a4h h THR 133 Cb 1.34 0.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 2a4h h THR 133 CO 0.16 0.00 0.00 2.29 -0.25 0.00 0.00 175.52 177.72 2a4h n LYS 134 N -3.63 0.00 0.00 4.72 2.85 -1.26 -4.80 118.16 116.04 2a4h n LYS 134 Ca 0.11 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.37 2a4h n LYS 134 Cb 0.81 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.19 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 0.00 0.00 5.58 7.02 -1.26 -2.81 117.44 125.97 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 -1.71 -2.02 0.00 0.00 177.69 173.96 2a4h n ASN 136 N 0.10 0.00 -0.67 -0.99 2.85 -1.26 -5.16 115.26 110.12 2a4h n ASN 136 Ca 0.00 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.51 2a4h n ASN 136 Cb 0.00 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.01 2a4h n ASN 136 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 2a4h n THR 137 N -0.01 0.00 0.00 -0.44 5.66 -1.12 -4.52 114.28 113.85 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 -0.11 0.00 0.00 -1.55 0.00 0.00 70.33 68.67 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 -3.79 0.00 -0.31 1.09 -0.08 -1.26 -3.15 116.55 109.05 2a4h n ASP 138 Ca 0.00 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.38 2a4h n ASP 138 Cb 0.15 0.00 0.22 0.00 2.34 0.00 0.00 41.12 43.82 2a4h n ASP 138 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 2a4h h THR 139 N 0.00 0.14 -0.83 5.18 1.35 -2.01 0.73 112.91 117.47 2a4h h THR 139 Ca 0.00 -0.02 0.21 0.00 -0.55 0.00 0.00 66.41 66.05 2a4h h THR 139 Cb 0.00 0.09 -0.13 0.00 -1.73 0.00 0.00 68.15 66.37 2a4h h THR 139 CO 0.00 0.01 0.16 1.62 -0.25 0.00 0.00 175.52 177.06 2a4h h VAL 140 N 0.05 0.35 -1.00 6.82 3.04 -1.88 1.06 116.25 124.69 2a4h h VAL 140 Ca 0.51 -0.07 0.21 0.00 -1.01 0.00 0.00 66.70 66.35 2a4h h VAL 140 Cb 0.97 0.14 -0.11 0.00 -2.01 0.00 0.00 31.29 30.28 2a4h h VAL 140 CO -0.84 0.04 0.61 -0.08 -1.01 0.00 0.00 177.57 176.29 2a4h h GLU 141 N 0.19 0.65 -0.03 4.17 4.81 0.20 0.94 114.58 125.50 2a4h h GLU 141 Ca 0.49 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.56 2a4h h GLU 141 Cb 0.94 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 2a4h h GLU 141 CO -0.64 0.43 -0.54 1.49 -0.73 0.00 0.00 179.01 179.02 2a4h h GLU 142 N 0.67 0.10 -0.82 1.92 4.81 0.12 -3.09 114.58 118.28 2a4h h GLU 142 Ca 0.59 -0.06 0.20 0.00 -0.13 0.00 0.00 59.36 59.96 2a4h h GLU 142 Cb 1.05 0.01 -0.13 0.00 0.63 0.00 0.00 28.75 30.30 2a4h h GLU 142 CO -0.38 0.62 0.18 0.35 -0.73 0.00 0.00 179.01 179.05 2a4h h PHE 143 N 0.07 0.27 0.26 0.92 3.57 0.26 0.20 116.94 122.49 2a4h h PHE 143 Ca -0.00 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 2a4h h PHE 143 Cb 0.99 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.74 2a4h h PHE 143 CO 0.01 -0.18 -0.13 0.74 -2.23 0.00 0.00 178.31 176.52 2a4h h PHE 144 N 0.21 -0.33 -0.90 0.41 0.04 -1.45 -0.97 116.94 113.96 2a4h h PHE 144 Ca 0.49 -0.01 0.26 0.00 2.80 0.00 0.00 57.97 61.52 2a4h h PHE 144 Cb 0.94 0.11 -0.04 0.00 2.20 0.00 0.00 35.95 39.16 2a4h h PHE 144 CO -0.29 -0.20 0.77 1.05 -0.60 0.00 0.00 178.31 179.03 2a4h h GLU 145 N -0.98 0.00 0.06 1.51 -0.00 -1.41 1.47 114.58 115.23 2a4h h GLU 145 Ca -0.04 0.00 -0.32 0.00 -0.00 0.00 0.00 59.36 59.00 2a4h h GLU 145 Cb 0.27 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 28.99 2a4h h GLU 145 CO 0.06 0.00 -1.81 1.79 -0.00 0.00 0.00 179.01 179.05 2a4h h THR 146 N 0.00 0.78 -0.01 -1.06 1.35 -0.67 -3.36 112.91 109.94 2a4h h THR 146 Ca 0.43 -2.56 0.00 0.00 -0.55 0.00 0.00 66.41 63.73 2a4h h THR 146 Cb 1.96 2.49 0.00 0.00 -1.73 0.00 0.00 68.15 70.87 2a4h h THR 146 CO -0.00 0.70 -0.33 1.41 -0.25 0.00 0.00 175.52 177.04 2a4h n HIS 147 N -3.27 0.00 -3.99 4.73 8.25 0.63 -4.68 115.22 116.88 2a4h n HIS 147 Ca -0.23 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 56.97 2a4h n HIS 147 Cb 1.05 -0.10 -0.03 0.00 1.12 0.00 0.00 29.99 32.03 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 -2.54 2.79 0.06 2.41 1.43 0.47 0.94 118.68 124.25 2a4h s LEU 148 Ca 0.22 -1.21 0.06 0.00 -1.03 0.00 0.00 54.13 52.17 2a4h s LEU 148 Cb 0.19 -1.27 -0.03 0.00 0.03 0.00 0.00 46.19 45.11 2a4h s LEU 148 CO 0.55 -0.94 -0.17 0.00 0.23 0.00 0.00 176.35 176.02 2a4h s ALA 149 N -2.72 1.41 -0.96 4.21 0.00 -1.26 -4.78 121.76 117.67 2a4h s ALA 149 Ca 0.33 -1.01 -0.01 0.00 0.00 0.00 0.00 51.96 51.28 2a4h s ALA 149 Cb -0.01 -0.20 0.30 0.00 0.00 0.00 0.00 23.12 23.21 2a4h s ALA 149 CO 0.20 0.27 1.33 0.36 0.00 0.00 0.00 175.76 177.91 2a4h n LYS 150 N 1.54 4.07 0.20 0.00 0.00 -1.26 -4.45 118.16 118.27 2a4h n LYS 150 Ca -0.19 -4.61 0.13 0.00 -0.00 0.00 0.00 58.31 53.64 2a4h n LYS 150 Cb 0.54 -2.44 0.71 0.00 -0.00 0.00 0.00 35.03 33.84 2a4h n LYS 150 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2a4h h ASP 151 N 4.95 0.00 -3.98 -5.58 1.82 -1.98 -3.42 116.42 108.23 2a4h h ASP 151 Ca 0.23 0.00 -0.10 0.00 -0.39 0.00 0.00 57.03 56.76 2a4h h ASP 151 Cb 0.59 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.62 2a4h h ASP 151 CO 1.19 0.00 0.01 0.61 -1.61 0.00 0.00 179.24 179.45 2a4h n GLY 152 N -1.52 1.08 3.15 -0.78 0.00 -1.26 -5.12 105.19 100.74 2a4h n GLY 152 Ca 0.00 -2.02 0.05 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.65 -3.82 0.01 4.61 0.00 -1.26 -5.11 121.76 113.53 2a4h s ALA 153 Ca 0.14 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.46 2a4h s ALA 153 Cb -0.01 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.37 2a4h s ALA 153 CO 0.09 -1.92 0.00 0.41 0.00 0.00 0.00 175.76 174.34 2a4h n GLY 154 N 5.22 -3.36 0.09 0.00 0.00 -1.26 -5.07 105.19 100.80 2a4h n GLY 154 Ca 0.05 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.11 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 -0.47 0.00 -4.24 1.61 2.85 -1.26 -5.14 118.16 111.50 2a4h n LYS 155 Ca 0.00 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.95 2a4h n LYS 155 Cb 0.00 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.29 2a4h n LYS 155 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 2a4h s ASN 156 N -1.26 4.89 0.18 -5.58 2.47 -1.26 -5.13 114.94 109.25 2a4h s ASN 156 Ca 0.00 -0.16 0.02 0.00 0.42 0.00 0.00 52.86 53.14 2a4h s ASN 156 Cb 0.00 -1.16 -0.01 0.00 -1.45 0.00 0.00 41.25 38.63 2a4h s ASN 156 CO 0.00 0.22 0.07 -0.24 -3.72 0.00 0.00 177.10 173.44 2a4h n SER 157 N 0.98 0.89 -3.56 -4.21 2.88 -1.26 -5.13 113.62 104.20 2a4h n SER 157 Ca -0.13 -1.98 -0.10 0.00 -1.33 0.00 0.00 58.87 55.32 2a4h n SER 157 Cb 0.52 0.50 -0.02 0.00 -0.75 0.00 0.00 64.21 64.46 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 -2.28 -0.41 0.00 0.66 2.02 -1.26 -5.11 117.35 110.97 2a4h s TYR 158 Ca 0.10 0.12 0.00 0.00 -0.37 0.00 0.00 57.07 56.93 2a4h s TYR 158 Cb 0.01 0.58 0.00 0.00 -0.40 0.00 0.00 41.96 42.14 2a4h s TYR 158 CO 0.07 -0.95 0.49 0.43 -1.57 0.00 0.00 175.55 174.02 2a4h n SER 159 N -0.39 0.00 -3.26 2.29 7.64 -1.26 -5.01 113.62 113.64 2a4h n SER 159 Ca -0.13 0.49 -0.12 0.00 1.01 0.00 0.00 58.87 60.11 2a4h n SER 159 Cb 0.63 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.81 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 -0.98 0.00 -0.03 0.44 -7.23 -1.26 -5.18 120.40 106.16 2a4h s VAL 160 Ca 0.00 -1.42 -0.10 0.00 -1.81 0.00 0.00 61.98 58.65 2a4h s VAL 160 Cb 0.00 -2.64 0.01 0.00 0.56 0.00 0.00 36.38 34.31 2a4h s VAL 160 CO 0.00 0.00 0.22 -0.69 -0.31 0.00 0.00 175.10 174.32 2a4h s VAL 161 N -2.98 0.05 0.17 1.32 1.01 -1.26 -5.17 120.40 113.54 2a4h s VAL 161 Ca 0.26 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 61.90 2a4h s VAL 161 Cb -0.02 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 2a4h s VAL 161 CO 0.17 -0.22 0.13 -1.61 0.00 0.00 0.00 175.10 173.57 2a4h s GLU 162 N -0.85 2.86 -0.27 2.72 8.01 -1.26 -5.09 118.70 124.83 2a4h s GLU 162 Ca -0.09 -0.90 -0.23 0.00 0.01 0.00 0.00 54.97 53.76 2a4h s GLU 162 Cb -0.05 -2.62 -0.01 0.00 -4.31 0.00 0.00 34.13 27.15 2a4h s GLU 162 CO 0.02 0.48 0.74 0.34 0.01 0.00 0.00 175.26 176.84 2a4h s ASP 163 N -3.13 6.68 0.58 -0.19 2.15 -1.26 -4.93 116.67 116.56 2a4h s ASP 163 Ca 0.31 0.78 0.00 0.00 0.43 0.00 0.00 52.55 54.07 2a4h s ASP 163 Cb -0.10 -2.39 0.00 0.00 -0.30 0.00 0.00 42.92 40.13 2a4h s ASP 163 CO 0.23 -0.49 0.00 0.00 -0.17 0.00 0.00 175.17 174.74 2a4h n ALA 164 N 5.95 0.00 -3.43 3.66 0.00 -1.26 -4.93 120.51 120.50 2a4h n ALA 164 Ca 0.03 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.48 2a4h n ALA 164 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.88 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 -4.00 -0.32 0.00 0.00 2.15 -1.26 -5.14 116.67 108.10 2a4h s ASP 165 Ca 0.00 0.46 0.00 0.00 0.43 0.00 0.00 52.55 53.44 2a4h s ASP 165 Cb 0.00 1.28 0.00 0.00 -0.30 0.00 0.00 42.92 43.90 2a4h s ASP 165 CO 0.00 -0.07 0.00 0.61 -0.17 0.00 0.00 175.17 175.54 2a4h n GLY 166 N 4.24 -2.81 0.45 2.66 0.00 -1.26 -5.00 105.19 103.48 2a4h n GLY 166 Ca -0.12 -1.02 0.02 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.47 0.52 -4.15 1.61 2.03 -1.26 -5.09 116.55 109.74 2a4h n ASP 167 Ca 0.00 -2.23 -0.11 0.00 0.52 0.00 0.00 54.79 52.97 2a4h n ASP 167 Cb 0.00 -0.25 -0.09 0.00 -0.72 0.00 0.00 41.12 40.06 2a4h n ASP 167 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2a4h s ASP 168 N -1.43 0.12 0.00 1.67 1.01 -1.26 -5.15 116.67 111.63 2a4h s ASP 168 Ca 0.08 -1.28 0.00 0.00 0.71 0.00 0.00 52.55 52.06 2a4h s ASP 168 Cb 0.07 0.41 0.00 0.00 1.01 0.00 0.00 42.92 44.42 2a4h s ASP 168 CO -0.00 -0.89 0.00 -0.90 0.21 0.00 0.00 175.17 173.59 2a4h n ASP 169 N -0.27 0.00 -3.98 0.27 5.75 -1.26 -5.08 116.55 111.98 2a4h n ASP 169 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.36 2a4h n ASP 169 Cb 0.65 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.75 2a4h n ASP 169 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2a4h n GLU 170 N 0.00 3.88 -0.01 0.11 1.02 -1.26 -4.63 120.64 119.75 2a4h n GLU 170 Ca 0.00 -3.92 -0.01 0.00 -0.02 0.00 0.00 57.16 53.20 2a4h n GLU 170 Cb 0.00 -2.78 -0.12 0.00 -0.02 0.00 0.00 31.44 28.52 2a4h n GLU 170 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2a4h n ASP 171 N 3.13 0.51 0.00 1.62 5.68 -1.26 -4.78 116.55 121.45 2a4h n ASP 171 Ca 0.34 0.23 -0.00 0.00 -0.50 0.00 0.00 54.79 54.86 2a4h n ASP 171 Cb 0.36 0.65 -0.00 0.00 -1.14 0.00 0.00 41.12 40.98 2a4h n ASP 171 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2a4h n TYR 172 N -2.76 0.00 0.00 2.11 9.36 -1.26 -5.10 117.16 119.50 2a4h n TYR 172 Ca -0.15 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.07 2a4h n TYR 172 Cb 0.89 -0.01 0.00 0.00 -0.63 0.00 0.00 39.34 39.59 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 -2.65 0.00 -0.01 2.98 4.77 -1.26 -5.04 117.00 115.79 2a4h n LEU 173 Ca -0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 2a4h n LEU 173 Cb 0.01 0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 41.43 2a4h n LEU 173 CO 0.01 -0.49 -0.56 0.54 -1.33 0.00 0.00 177.39 175.55 2a4h n ARG 174 N -2.47 0.04 -3.37 3.23 1.74 -1.26 -4.88 116.66 109.69 2a4h n ARG 174 Ca 0.00 0.02 -0.11 0.00 -0.77 0.00 0.00 57.85 56.99 2a4h n ARG 174 Cb 0.00 -0.65 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 2a4h n ARG 174 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2a4h n THR 175 N -2.99 -7.41 -0.04 0.55 -1.04 -1.26 -4.83 114.28 97.27 2a4h n THR 175 Ca -0.04 -0.19 -0.06 0.00 -2.04 0.00 0.00 64.05 61.73 2a4h n THR 175 Cb 0.53 -5.31 -0.02 0.00 -1.82 0.00 0.00 70.33 63.70 2a4h n THR 175 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2a4h n ASN 176 N -2.15 1.60 -2.10 8.00 3.02 -1.26 -4.85 115.26 117.53 2a4h n ASN 176 Ca -0.13 0.25 0.01 0.00 -0.03 0.00 0.00 54.58 54.68 2a4h n ASN 176 Cb 0.58 -0.58 0.03 0.00 -0.61 0.00 0.00 39.78 39.20 2a4h n ASN 176 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2a4h n ARG 177 N -4.07 0.82 0.00 3.52 1.74 -1.26 -5.22 116.66 112.20 2a4h n ARG 177 Ca -0.10 -2.41 0.00 0.00 -0.77 0.00 0.00 57.85 54.57 2a4h n ARG 177 Cb 0.33 -0.54 0.00 0.00 -1.02 0.00 0.00 32.46 31.23 2a4h n ARG 177 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62