#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a4h n ALA 54 N 0.00 -2.74 -3.49 -5.12 0.00 -1.26 -5.00 120.51 102.90 2a4h n ALA 54 Ca 0.00 0.69 -0.29 0.00 0.00 0.00 0.00 53.44 53.84 2a4h n ALA 54 Cb 0.00 -2.85 -0.12 0.00 0.00 0.00 0.00 19.45 16.48 2a4h n ALA 54 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2a4h s SER 55 N -2.40 2.84 -0.38 0.00 1.04 -1.26 -4.96 113.70 108.57 2a4h s SER 55 Ca 0.23 -2.38 0.05 0.00 0.48 0.00 0.00 55.95 54.33 2a4h s SER 55 Cb -0.05 -0.49 0.62 0.00 0.10 0.00 0.00 66.02 66.21 2a4h s SER 55 CO 0.80 -0.28 1.81 1.41 0.98 0.00 0.00 173.24 177.96 2a4h n HIS 56 N 3.79 2.68 -2.14 5.02 8.25 -1.26 -4.07 115.22 127.49 2a4h n HIS 56 Ca 0.14 -1.60 -0.01 0.00 -0.26 0.00 0.00 57.72 55.99 2a4h n HIS 56 Cb 0.38 -0.84 -0.02 0.00 1.12 0.00 0.00 29.99 30.64 2a4h n HIS 56 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2a4h n HIS 57 N -0.81 0.00 -2.75 4.41 -0.00 -1.26 -4.91 115.22 109.90 2a4h n HIS 57 Ca 0.51 -0.32 0.01 0.00 -0.00 0.00 0.00 57.72 57.91 2a4h n HIS 57 Cb 1.51 0.18 0.04 0.00 -0.00 0.00 0.00 29.99 31.73 2a4h n HIS 57 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2a4h n HIS 58 N 0.14 1.01 -3.78 4.41 -0.00 -1.26 -5.08 115.22 110.66 2a4h n HIS 58 Ca -0.08 -1.79 -0.13 0.00 -0.00 0.00 0.00 57.72 55.72 2a4h n HIS 58 Cb 0.79 -0.21 -0.12 0.00 -0.00 0.00 0.00 29.99 30.44 2a4h n HIS 58 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2a4h s HIS 59 N -2.99 -0.26 0.03 4.41 0.09 -1.26 -5.06 115.29 110.24 2a4h s HIS 59 Ca 0.29 0.64 0.00 0.00 -0.00 0.00 0.00 55.06 55.99 2a4h s HIS 59 Cb 0.34 0.08 0.00 0.00 -0.00 0.00 0.00 32.58 33.00 2a4h s HIS 59 CO -0.07 -0.14 0.00 0.72 -0.00 0.00 0.00 174.74 175.26 2a4h n HIS 60 N 3.11 -0.08 0.00 1.40 -0.00 -1.26 -5.02 115.22 113.38 2a4h n HIS 60 Ca -0.14 0.01 0.00 0.00 -0.00 0.00 0.00 57.72 57.59 2a4h n HIS 60 Cb 0.58 0.07 0.00 0.00 -0.00 0.00 0.00 29.99 30.64 2a4h n HIS 60 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2a4h n HIS 61 N -3.07 0.00 -1.51 4.41 8.25 -1.26 -5.11 115.22 116.94 2a4h n HIS 61 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.15 2a4h n HIS 61 Cb 0.33 0.37 0.07 0.00 1.12 0.00 0.00 29.99 31.89 2a4h n HIS 61 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2a4h s LEU 62 N -4.92 2.90 -0.15 2.41 1.02 -1.26 -5.00 118.68 113.69 2a4h s LEU 62 Ca 0.00 1.53 0.12 0.00 0.02 0.00 0.00 54.13 55.81 2a4h s LEU 62 Cb 0.00 -4.28 0.29 0.00 0.02 0.00 0.00 46.19 42.21 2a4h s LEU 62 CO 0.00 -1.74 1.22 0.47 0.02 0.00 0.00 176.35 176.32 2a4h n ASP 63 N -3.31 -0.37 0.00 2.29 9.92 -1.26 -4.89 116.55 118.93 2a4h n ASP 63 Ca 0.07 -2.07 0.00 0.00 -0.53 0.00 0.00 54.79 52.26 2a4h n ASP 63 Cb 0.54 0.19 0.00 0.00 -0.64 0.00 0.00 41.12 41.21 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 -0.48 0.00 -3.64 -1.24 6.02 -1.26 -5.16 117.38 111.63 2a4h n GLN 64 Ca -0.13 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.75 2a4h n GLN 64 Cb 0.85 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 32.04 2a4h n GLN 64 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2a4h s GLN 65 N -1.02 0.62 0.87 -1.09 -0.21 -1.26 -5.18 119.66 112.39 2a4h s GLN 65 Ca 0.00 0.75 -0.12 0.00 0.02 0.00 0.00 55.36 56.01 2a4h s GLN 65 Cb 0.00 0.30 0.15 0.00 1.00 0.00 0.00 33.01 34.46 2a4h s GLN 65 CO 0.00 -0.08 1.22 -1.25 -2.12 0.00 0.00 175.29 173.06 2a4h s PRO 66 N 0.32 1.19 0.00 2.91 0.04 -1.26 -5.04 135.00 133.17 2a4h s PRO 66 Ca 0.02 -0.41 -0.03 0.00 0.04 0.00 0.00 61.00 60.61 2a4h s PRO 66 Cb -0.05 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 2a4h s PRO 66 CO -0.04 -2.00 1.00 0.00 0.04 0.00 0.00 177.00 176.00 2a4h h ALA 67 N -1.26 -0.98 -4.01 8.56 0.00 -2.08 -3.47 119.26 116.01 2a4h h ALA 67 Ca -0.43 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2a4h h ALA 67 Cb 1.26 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2a4h h ALA 67 CO 0.46 -0.98 -0.00 0.00 0.00 0.00 0.00 179.25 178.73 2a4h n ALA 68 N -2.06 0.00 -0.63 0.00 0.00 -1.26 -5.12 120.51 111.44 2a4h n ALA 68 Ca -0.01 -0.02 -0.26 0.00 0.00 0.00 0.00 53.44 53.14 2a4h n ALA 68 Cb 0.05 0.01 0.15 0.00 0.00 0.00 0.00 19.45 19.65 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 -0.19 -1.78 -2.51 0.00 0.00 -1.26 -4.95 117.38 106.70 2a4h n GLN 69 Ca -0.00 -0.52 -0.21 0.00 0.00 0.00 0.00 57.00 56.27 2a4h n GLN 69 Cb 0.01 -1.53 0.01 0.00 0.00 0.00 0.00 30.24 28.73 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 -1.51 2.75 -0.70 2.61 1.85 -1.26 -5.07 116.66 115.34 2a4h n ARG 70 Ca 0.03 -4.10 -0.32 0.00 -1.00 0.00 0.00 57.85 52.45 2a4h n ARG 70 Cb 0.52 -1.95 0.16 0.00 -1.05 0.00 0.00 32.46 30.14 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 -0.39 0.00 -4.40 8.89 -2.24 -1.26 -5.01 114.28 109.87 2a4h n THR 71 Ca 0.30 -0.28 -0.29 0.00 -2.27 0.00 0.00 64.05 61.51 2a4h n THR 71 Cb 0.73 -0.62 -0.13 0.00 -2.10 0.00 0.00 70.33 68.21 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 -2.28 2.33 0.00 4.78 1.51 0.32 -4.98 117.35 119.04 2a4h s TYR 72 Ca 0.57 -0.37 0.00 0.00 -1.01 0.00 0.00 57.07 56.26 2a4h s TYR 72 Cb -0.15 -1.26 0.00 0.00 -0.11 0.00 0.00 41.96 40.44 2a4h s TYR 72 CO 0.66 0.34 0.76 0.00 -1.11 0.00 0.00 175.55 176.20 2a4h n ALA 73 N 0.93 -0.29 -2.51 3.71 0.00 -1.26 -4.27 120.51 116.82 2a4h n ALA 73 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.02 2a4h n ALA 73 Cb 0.53 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.88 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 -2.13 1.80 -0.30 0.00 2.20 -0.99 -4.65 119.74 115.67 2a4h s LYS 74 Ca 0.00 -1.74 -0.13 0.00 -0.36 0.00 0.00 55.97 53.74 2a4h s LYS 74 Cb 0.00 -1.83 0.17 0.00 -1.51 0.00 0.00 37.83 34.66 2a4h s LYS 74 CO 0.00 0.31 0.95 0.00 -0.36 0.00 0.00 175.35 176.25 2a4h s ALA 75 N -2.50 -2.82 0.07 3.13 0.00 -1.16 -0.39 121.76 118.10 2a4h s ALA 75 Ca 0.31 1.89 -0.00 0.00 0.00 0.00 0.00 51.96 54.16 2a4h s ALA 75 Cb -0.04 -2.16 -0.04 0.00 0.00 0.00 0.00 23.12 20.88 2a4h s ALA 75 CO 0.16 -1.11 0.22 0.42 0.00 0.00 0.00 175.76 175.45 2a4h s ILE 76 N 2.62 5.38 -0.56 0.00 1.01 0.97 -2.17 121.20 128.44 2a4h s ILE 76 Ca 0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 60.65 60.23 2a4h s ILE 76 Cb -0.08 -3.64 0.15 0.00 0.01 0.00 0.00 42.46 38.90 2a4h s ILE 76 CO -0.16 0.12 0.36 -0.22 0.00 0.00 0.00 174.94 175.04 2a4h s LEU 77 N -2.58 5.14 -0.25 2.97 2.96 -1.26 -1.05 118.68 124.61 2a4h s LEU 77 Ca 0.35 -2.68 -0.17 0.00 -0.22 0.00 0.00 54.13 51.42 2a4h s LEU 77 Cb -0.13 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 2a4h s LEU 77 CO 0.28 -0.39 0.45 -1.61 -1.32 0.00 0.00 176.35 173.76 2a4h s GLU 78 N 0.19 4.08 0.05 1.98 2.02 -1.08 -0.72 118.70 125.21 2a4h s GLU 78 Ca 0.15 0.22 -0.01 0.00 0.02 0.00 0.00 54.97 55.35 2a4h s GLU 78 Cb -0.21 -3.63 -0.04 0.00 0.10 0.00 0.00 34.13 30.35 2a4h s GLU 78 CO -0.03 -0.26 -0.03 0.08 0.02 0.00 0.00 175.26 175.03 2a4h s VAL 79 N 2.03 0.23 -1.08 2.63 1.01 -0.70 -2.39 120.40 122.13 2a4h s VAL 79 Ca 0.19 -1.76 0.10 0.00 0.00 0.00 0.00 61.98 60.51 2a4h s VAL 79 Cb -0.16 -1.45 0.13 0.00 0.00 0.00 0.00 36.38 34.91 2a4h s VAL 79 CO 0.09 -0.96 0.93 0.00 0.00 0.00 0.00 175.10 175.16 2a4h n THR 81 N 0.49 0.00 0.19 0.00 -2.24 -1.26 -4.81 114.28 106.65 2a4h n THR 81 Ca 0.07 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.92 2a4h n THR 81 Cb 0.29 -1.12 0.29 0.00 -2.10 0.00 0.00 70.33 67.69 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 -3.33 2.97 0.25 0.00 -0.00 -1.26 -4.38 118.16 112.40 2a4h n LYS 83 Ca 0.01 -1.58 0.17 0.00 -0.00 0.00 0.00 58.31 56.91 2a4h n LYS 83 Cb 0.54 -1.89 0.79 0.00 -0.00 0.00 0.00 35.03 34.48 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 2.01 0.00 0.00 5.58 3.57 -1.78 0.28 116.94 126.60 2a4h h PHE 84 Ca 0.00 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 2a4h h PHE 84 Cb 1.25 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 2a4h h PHE 84 CO 0.55 0.00 -0.39 -0.09 -2.23 0.00 0.00 178.31 176.15 2a4h h ARG 85 N 0.00 0.00 0.39 1.11 2.43 -1.88 -3.25 114.38 113.18 2a4h h ARG 85 Ca 0.07 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2a4h h ARG 85 Cb 0.80 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 2a4h h ARG 85 CO -0.00 0.34 -0.19 0.00 -1.51 0.00 0.00 179.97 178.61 2a4h h ALA 86 N -0.75 -0.53 -1.92 2.80 0.00 -1.75 -3.36 119.26 113.75 2a4h h ALA 86 Ca -0.06 -0.18 -0.68 0.00 0.00 0.00 0.00 54.91 53.98 2a4h h ALA 86 Cb 0.56 0.20 -0.36 0.00 0.00 0.00 0.00 17.79 18.20 2a4h h ALA 86 CO -0.04 -0.57 0.04 0.66 0.00 0.00 0.00 179.25 179.34 2a4h n TYR 87 N -5.16 3.38 0.24 0.00 4.01 0.92 -4.83 117.16 115.73 2a4h n TYR 87 Ca -0.09 -3.43 0.09 0.00 -0.16 0.00 0.00 57.90 54.31 2a4h n TYR 87 Cb 0.28 -0.81 0.60 0.00 -0.31 0.00 0.00 39.34 39.10 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 3.87 0.00 -0.09 -0.72 0.13 -1.60 -2.79 132.00 130.80 2a4h h PRO 88 Ca 0.27 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.22 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 0.99 0.18 -0.71 -0.56 -0.23 0.00 0.00 178.00 177.67 2a4h h GLN 89 N 0.00 0.43 0.00 0.86 3.07 -1.89 -2.94 115.11 114.65 2a4h h GLN 89 Ca -0.00 -0.35 0.00 0.00 0.09 0.00 0.00 58.65 58.39 2a4h h GLN 89 Cb 0.39 0.07 0.00 0.00 0.08 0.00 0.00 27.48 28.02 2a4h h GLN 89 CO 0.02 0.98 0.00 -0.89 0.09 0.00 0.00 178.83 179.03 2a4h n ILE 90 N -3.85 0.00 -0.11 1.86 5.41 -1.05 -1.29 119.36 120.32 2a4h n ILE 90 Ca -0.04 0.92 0.27 0.00 1.00 0.00 0.00 62.75 64.90 2a4h n ILE 90 Cb 0.70 -1.69 0.64 0.00 -0.71 0.00 0.00 39.64 38.58 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 0.89 0.38 4.15 -1.73 -0.81 115.11 117.99 2a4h h GLN 91 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.38 2a4h h GLN 91 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2a4h h GLN 91 CO 0.00 0.00 -0.46 0.00 -1.93 0.00 0.00 178.83 176.44 2a4h h ALA 92 N 1.11 -1.32 -0.54 3.38 0.00 -1.15 -1.61 119.26 119.13 2a4h h ALA 92 Ca 0.39 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 55.13 2a4h h ALA 92 Cb 2.04 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 20.33 2a4h h ALA 92 CO -0.00 -1.24 0.37 0.27 0.00 0.00 0.00 179.25 178.65 2a4h h PHE 93 N -1.23 0.34 0.04 0.00 -5.15 0.21 0.11 116.94 111.26 2a4h h PHE 93 Ca -0.12 0.01 0.01 0.00 -0.20 0.00 0.00 57.97 57.67 2a4h h PHE 93 Cb 0.96 -0.11 -0.02 0.00 0.22 0.00 0.00 35.95 37.00 2a4h h PHE 93 CO -0.02 0.16 -0.10 0.82 -2.00 0.00 0.00 178.31 177.17 2a4h h ILE 94 N 0.32 0.75 0.00 0.88 2.04 -1.12 -2.00 117.51 118.39 2a4h h ILE 94 Ca 0.25 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.11 2a4h h ILE 94 Cb 0.56 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2a4h h ILE 94 CO -0.06 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.09 2a4h n GLN 95 N -5.23 0.19 -0.04 2.37 6.02 -0.65 -4.08 117.38 115.97 2a4h n GLN 95 Ca -0.06 0.19 -0.09 0.00 -0.01 0.00 0.00 57.00 57.03 2a4h n GLN 95 Cb 0.15 -1.74 -0.06 0.00 1.02 0.00 0.00 30.24 29.61 2a4h n GLN 95 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2a4h h SER 96 N 0.00 -1.06 0.00 1.08 0.87 -0.02 -3.47 113.55 110.95 2a4h h SER 96 Ca 0.00 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2a4h h SER 96 Cb 0.63 0.42 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 2a4h h SER 96 CO 0.00 -0.27 0.00 0.61 -0.53 0.00 0.00 176.83 176.64 2a4h n GLY 97 N -1.24 0.87 0.21 5.77 0.00 -1.25 -5.02 105.19 104.53 2a4h n GLY 97 Ca -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 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 0.65 0.00 1.61 -0.00 -1.87 -2.36 114.38 112.41 2a4h h ARG 98 Ca 0.00 -0.10 -0.01 0.00 -0.50 0.00 0.00 59.98 59.37 2a4h h ARG 98 Cb 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 29.97 29.85 2a4h h ARG 98 CO 0.00 0.56 -0.05 -1.35 0.00 0.00 0.00 179.97 179.13 2a4h h PRO 99 N 0.58 0.00 0.00 0.04 0.11 -1.83 -0.93 132.00 129.97 2a4h h PRO 99 Ca 0.15 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.24 2a4h h PRO 99 Cb 0.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.24 2a4h h PRO 99 CO -0.02 0.05 -0.13 0.00 -0.21 0.00 0.00 178.00 177.69 2a4h h ALA 100 N 1.95 1.74 0.00 -0.75 0.00 -1.71 0.02 119.26 120.51 2a4h h ALA 100 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2a4h h ALA 100 Cb 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2a4h h ALA 100 CO 0.01 0.17 0.00 1.63 0.00 0.00 0.00 179.25 181.05 2a4h n LYS 101 N -4.32 0.15 -3.09 0.00 5.02 -0.35 -4.39 118.16 111.17 2a4h n LYS 101 Ca -0.03 0.35 -0.45 0.00 -2.02 0.00 0.00 58.31 56.16 2a4h n LYS 101 Cb 0.20 -1.77 -0.03 0.00 -0.02 0.00 0.00 35.03 33.41 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 -3.22 3.25 0.11 2.13 0.08 -0.01 -4.92 117.98 115.40 2a4h s PHE 102 Ca 0.06 -1.41 -0.26 0.00 0.12 0.00 0.00 56.93 55.44 2a4h s PHE 102 Cb 0.10 -4.07 -0.09 0.00 -0.57 0.00 0.00 43.02 38.39 2a4h s PHE 102 CO 0.39 -1.29 1.66 -1.00 -0.10 0.00 0.00 175.22 174.88 2a4h h PRO 103 N 8.66 -0.36 -0.95 0.24 0.13 -1.82 -2.19 132.00 135.71 2a4h h PRO 103 Ca -0.01 0.02 0.23 0.00 -0.87 0.00 0.00 66.00 65.37 2a4h h PRO 103 Cb 1.05 0.08 -0.12 0.00 0.13 0.00 0.00 31.00 32.14 2a4h h PRO 103 CO 1.01 -0.24 0.50 -0.91 -0.23 0.00 0.00 178.00 178.13 2a4h h ASN 104 N -0.37 0.54 -3.18 1.44 4.21 -1.82 -3.39 115.58 113.00 2a4h h ASN 104 Ca 0.03 0.14 -0.53 0.00 1.21 0.00 0.00 56.30 57.14 2a4h h ASN 104 Cb 0.39 0.07 0.02 0.00 -1.12 0.00 0.00 38.32 37.67 2a4h h ASN 104 CO -0.11 0.08 0.63 -0.22 -1.29 0.00 0.00 177.43 176.53 2a4h s LEU 105 N -10.40 4.39 -0.18 1.61 2.96 -0.82 -2.99 118.68 113.25 2a4h s LEU 105 Ca -0.11 2.20 -0.20 0.00 -0.22 0.00 0.00 54.13 55.80 2a4h s LEU 105 Cb 0.26 -3.59 -0.22 0.00 0.50 0.00 0.00 46.19 43.14 2a4h s LEU 105 CO 0.79 -0.53 0.34 -0.61 -1.32 0.00 0.00 176.35 175.02 2a4h h GLN 106 N 6.45 0.06 -4.77 1.98 5.75 -1.65 -3.46 115.11 119.47 2a4h h GLN 106 Ca -0.42 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 57.97 2a4h h GLN 106 Cb 1.21 0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.80 2a4h h GLN 106 CO 0.82 1.05 -0.24 -0.89 -2.65 0.00 0.00 178.83 176.92 2a4h n ILE 107 N -4.29 -8.65 -4.01 2.39 2.08 -1.26 -4.88 119.36 100.74 2a4h n ILE 107 Ca -0.29 0.37 -0.30 0.00 0.56 0.00 0.00 62.75 63.09 2a4h n ILE 107 Cb 0.73 -6.39 -0.06 0.00 -0.75 0.00 0.00 39.64 33.17 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 -2.51 3.06 -0.81 0.38 2.20 0.10 -4.88 119.74 117.28 2a4h s LYS 108 Ca 0.12 -0.63 0.02 0.00 -0.36 0.00 0.00 55.97 55.12 2a4h s LYS 108 Cb -0.03 -2.82 0.25 0.00 -1.51 0.00 0.00 37.83 33.72 2a4h s LYS 108 CO 0.58 0.57 0.91 0.66 -0.36 0.00 0.00 175.35 177.71 2a4h n TYR 109 N 0.30 3.43 -0.86 4.03 4.01 -1.26 -1.71 117.16 125.10 2a4h n TYR 109 Ca -0.08 -3.80 -0.32 0.00 -0.16 0.00 0.00 57.90 53.54 2a4h n TYR 109 Cb 0.52 -0.86 0.03 0.00 -0.31 0.00 0.00 39.34 38.72 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 1.38 0.00 -0.03 -0.72 3.14 0.21 -4.77 118.33 117.54 2a4h n VAL 110 Ca 0.26 -0.23 -0.11 0.00 -2.96 0.00 0.00 64.34 61.30 2a4h n VAL 110 Cb 0.38 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 33.10 2a4h n VAL 110 CO 0.00 0.00 0.00 0.03 -6.46 0.00 0.00 176.83 170.40 2a4h h ARG 111 N -0.86 0.19 0.00 1.45 2.47 -1.96 -3.38 114.38 112.30 2a4h h ARG 111 Ca -0.36 -0.03 -0.10 0.00 -1.26 0.00 0.00 59.98 58.23 2a4h h ARG 111 Cb 1.16 -0.03 -0.12 0.00 -1.65 0.00 0.00 29.97 29.33 2a4h h ARG 111 CO 0.19 0.25 0.00 0.41 0.56 0.00 0.00 179.97 181.38 2a4h n GLY 112 N -0.79 -1.44 1.21 0.04 0.00 -1.26 -4.89 105.19 98.06 2a4h n GLY 112 Ca -0.05 0.85 -0.10 0.00 0.00 0.00 0.00 46.02 46.72 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 0.85 0.00 -4.86 0.99 4.77 -1.26 -5.01 117.00 112.47 2a4h n LEU 113 Ca -0.03 -1.09 -0.32 0.00 -0.03 0.00 0.00 56.01 54.54 2a4h n LEU 113 Cb 0.74 0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 42.00 2a4h n LEU 113 CO -0.10 -0.16 0.33 1.51 -1.33 0.00 0.00 177.39 177.63 2a4h s ASP 114 N -1.92 6.68 -0.25 -1.43 -4.77 -1.26 -3.74 116.67 109.98 2a4h s ASP 114 Ca 0.03 1.10 -0.28 0.00 -3.30 0.00 0.00 52.55 50.09 2a4h s ASP 114 Cb 0.00 -2.30 -0.03 0.00 -1.09 0.00 0.00 42.92 39.50 2a4h s ASP 114 CO 0.02 -0.17 1.94 -2.84 0.70 0.00 0.00 175.17 174.83 2a4h s PRO 115 N -3.01 3.36 0.13 2.11 0.02 -1.26 -4.66 135.00 131.68 2a4h s PRO 115 Ca 0.51 1.75 0.03 0.00 0.02 0.00 0.00 61.00 63.31 2a4h s PRO 115 Cb -0.11 -4.24 -0.04 0.00 0.02 0.00 0.00 34.50 30.13 2a4h s PRO 115 CO 0.21 -1.83 -0.07 0.08 -0.33 0.00 0.00 177.00 175.05 2a4h s VAL 116 N 7.08 0.88 -0.28 3.83 1.01 -1.00 -1.02 120.40 130.89 2a4h s VAL 116 Ca 0.87 -1.99 -0.02 0.00 0.00 0.00 0.00 61.98 60.84 2a4h s VAL 116 Cb -0.28 -1.81 0.04 0.00 0.00 0.00 0.00 36.38 34.33 2a4h s VAL 116 CO 0.34 -0.77 -0.02 0.68 0.00 0.00 0.00 175.10 175.34 2a4h s VAL 117 N -3.51 3.00 -0.32 2.92 -7.23 -0.86 -2.65 120.40 111.75 2a4h s VAL 117 Ca 0.15 -1.25 -0.06 0.00 -1.81 0.00 0.00 61.98 59.02 2a4h s VAL 117 Cb 0.04 -2.66 0.03 0.00 0.56 0.00 0.00 36.38 34.36 2a4h s VAL 117 CO -0.02 -0.01 0.08 -0.54 -0.31 0.00 0.00 175.10 174.31 2a4h s LYS 118 N 1.29 2.70 -0.79 4.82 1.02 -0.21 -2.44 119.74 126.12 2a4h s LYS 118 Ca -0.03 -1.12 -0.21 0.00 0.02 0.00 0.00 55.97 54.63 2a4h s LYS 118 Cb -0.19 -3.40 0.09 0.00 -0.52 0.00 0.00 37.83 33.82 2a4h s LYS 118 CO -0.02 -0.61 1.06 -0.51 -0.92 0.00 0.00 175.35 174.35 2a4h s LEU 119 N 1.40 4.58 0.00 3.17 1.02 -0.45 -0.02 118.68 128.38 2a4h s LEU 119 Ca -0.01 -1.43 0.00 0.00 0.02 0.00 0.00 54.13 52.71 2a4h s LEU 119 Cb -0.19 -2.42 0.08 0.00 0.02 0.00 0.00 46.19 43.68 2a4h s LEU 119 CO 0.02 -1.30 0.58 0.18 0.02 0.00 0.00 176.35 175.84 2a4h n LEU 120 N 7.34 0.00 -0.10 1.79 4.32 0.48 0.19 117.00 131.03 2a4h n LEU 120 Ca 0.09 -1.23 -0.19 0.00 -0.02 0.00 0.00 56.01 54.66 2a4h n LEU 120 Cb 0.47 -0.37 -0.06 0.00 -1.62 0.00 0.00 43.42 41.84 2a4h n LEU 120 CO 0.59 -0.78 -1.06 -0.67 -1.22 0.00 0.00 177.39 174.25 2a4h n ASP 121 N -2.93 1.63 0.00 -1.43 -0.08 -1.26 -2.35 116.55 110.13 2a4h n ASP 121 Ca 0.10 0.28 0.00 0.00 -1.51 0.00 0.00 54.79 53.65 2a4h n ASP 121 Cb 0.34 -0.66 0.00 0.00 2.34 0.00 0.00 41.12 43.14 2a4h n ASP 121 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2a4h n ALA 122 N -4.08 0.00 0.13 -1.67 0.00 -1.26 -3.75 120.51 109.89 2a4h n ALA 122 Ca -0.35 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 52.85 2a4h n ALA 122 Cb 0.70 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.99 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 0.79 0.00 0.00 0.87 -2.03 -3.47 113.55 109.70 2a4h h SER 123 Ca 0.00 -0.90 0.00 0.00 -1.23 0.00 0.00 61.79 59.66 2a4h h SER 123 Cb 0.00 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.70 2a4h h SER 123 CO 0.00 1.71 0.00 0.61 -0.53 0.00 0.00 176.83 178.62 2a4h n GLY 124 N 1.74 0.00 0.13 5.77 0.00 -1.26 -5.06 105.19 106.50 2a4h n GLY 124 Ca -0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 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 0.35 -2.77 1.61 1.63 -1.94 -3.49 116.57 111.96 2a4h h LYS 125 Ca 0.00 -0.38 0.00 0.00 -0.85 0.00 0.00 60.65 59.42 2a4h h LYS 125 Cb 0.00 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 2a4h h LYS 125 CO 0.00 1.06 -0.41 0.28 -3.45 0.00 0.00 179.45 176.93 2a4h n VAL 126 N -4.29 -6.95 -0.13 2.00 0.31 -1.26 -4.96 118.33 103.05 2a4h n VAL 126 Ca -0.10 1.42 -0.24 0.00 -0.01 0.00 0.00 64.34 65.41 2a4h n VAL 126 Cb 0.63 -3.90 -0.11 0.00 -0.91 0.00 0.00 33.84 29.55 2a4h n VAL 126 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2a4h n GLN 127 N 0.80 0.63 -3.89 5.55 1.13 0.52 -4.91 117.38 117.20 2a4h n GLN 127 Ca 0.00 0.22 -0.11 0.00 -1.94 0.00 0.00 57.00 55.17 2a4h n GLN 127 Cb 0.00 -1.52 -0.10 0.00 0.11 0.00 0.00 30.24 28.73 2a4h n GLN 127 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2a4h s GLU 128 N -2.51 0.47 -0.06 -1.09 2.02 -1.16 -4.96 118.70 111.40 2a4h s GLU 128 Ca -0.36 -0.45 -0.01 0.00 0.02 0.00 0.00 54.97 54.17 2a4h s GLU 128 Cb 0.11 0.19 0.03 0.00 0.10 0.00 0.00 34.13 34.56 2a4h s GLU 128 CO 0.56 -0.11 0.02 0.99 0.02 0.00 0.00 175.26 176.74 2a4h s THR 129 N -1.46 0.25 -0.10 3.63 2.01 -1.25 -1.34 115.64 117.38 2a4h s THR 129 Ca -0.15 0.20 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 2a4h s THR 129 Cb -0.08 -0.43 0.03 0.00 0.01 0.00 0.00 72.50 72.04 2a4h s THR 129 CO 0.01 0.24 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.41 2a4h s LEU 130 N 1.98 0.80 -0.13 4.42 1.43 -1.02 -4.96 118.68 121.21 2a4h s LEU 130 Ca 0.04 -0.24 -0.29 0.00 -1.03 0.00 0.00 54.13 52.61 2a4h s LEU 130 Cb -0.12 -0.55 -0.05 0.00 0.03 0.00 0.00 46.19 45.50 2a4h s LEU 130 CO -0.05 -0.20 1.76 -0.55 0.23 0.00 0.00 176.35 177.55 2a4h s SER 131 N 1.90 6.36 -0.62 2.29 0.15 -1.26 -2.02 113.70 120.50 2a4h s SER 131 Ca 0.04 2.01 -0.01 0.00 0.70 0.00 0.00 55.95 58.69 2a4h s SER 131 Cb -0.13 -2.53 0.47 0.00 -1.71 0.00 0.00 66.02 62.12 2a4h s SER 131 CO -0.06 -1.21 2.02 2.30 1.20 0.00 0.00 173.24 177.48 2a4h n ILE 132 N 6.16 3.52 0.16 6.45 -5.35 -0.19 -4.49 119.36 125.62 2a4h n ILE 132 Ca 0.20 -2.71 0.03 0.00 -0.27 0.00 0.00 62.75 60.00 2a4h n ILE 132 Cb 0.44 -1.07 0.19 0.00 -1.74 0.00 0.00 39.64 37.46 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 1.00 0.99 0.00 7.28 1.35 -1.90 -3.47 112.91 118.15 2a4h h THR 133 Ca 0.60 -1.94 0.00 0.00 -0.55 0.00 0.00 66.41 64.52 2a4h h THR 133 Cb 1.12 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 69.71 2a4h h THR 133 CO 1.48 0.48 0.00 0.29 -0.25 0.00 0.00 175.52 177.52 2a4h n LYS 134 N -3.44 0.00 0.00 4.72 5.02 -1.26 -4.89 118.16 118.31 2a4h n LYS 134 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2a4h n LYS 134 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.63 2a4h n LYS 134 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2a4h n TRP 135 N 0.00 0.00 0.00 2.13 8.01 -1.26 -2.72 117.44 123.60 2a4h n TRP 135 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 2a4h n TRP 135 Cb 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.30 2a4h n TRP 135 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.69 176.95 2a4h n ASN 136 N 1.39 0.00 -0.07 -0.99 6.94 -1.26 -5.16 115.26 116.12 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 -1.10 -4.58 114.28 119.79 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 -3.60 0.00 0.06 1.09 8.00 -1.26 -3.13 116.55 117.71 2a4h n ASP 138 Ca 0.00 0.00 0.21 0.00 0.71 0.00 0.00 54.79 55.71 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 0.28 -0.61 -3.53 2.02 -1.99 0.28 112.91 109.35 2a4h h THR 139 Ca 0.00 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.27 2a4h h THR 139 Cb 0.00 0.54 -0.07 0.00 -1.74 0.00 0.00 68.15 66.88 2a4h h THR 139 CO 0.00 0.00 0.23 1.62 0.37 0.00 0.00 175.52 177.74 2a4h h VAL 140 N 0.00 0.77 -0.79 3.16 3.04 -1.89 1.37 116.25 121.91 2a4h h VAL 140 Ca 0.23 -0.14 -0.00 0.00 -1.01 0.00 0.00 66.70 65.77 2a4h h VAL 140 Cb 1.36 0.32 -0.04 0.00 -2.01 0.00 0.00 31.29 30.93 2a4h h VAL 140 CO -0.00 0.08 0.48 -0.08 -1.01 0.00 0.00 177.57 177.04 2a4h h GLU 141 N 0.41 1.07 -0.11 4.17 4.81 -0.76 -1.21 114.58 122.97 2a4h h GLU 141 Ca 0.31 -0.09 -0.09 0.00 -0.13 0.00 0.00 59.36 59.35 2a4h h GLU 141 Cb 0.38 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 2a4h h GLU 141 CO -0.31 0.75 -0.35 1.49 -0.73 0.00 0.00 179.01 179.87 2a4h h GLU 142 N 1.08 0.23 -0.65 1.92 4.81 -0.88 -3.03 114.58 118.06 2a4h h GLU 142 Ca 0.29 -0.09 0.13 0.00 -0.13 0.00 0.00 59.36 59.55 2a4h h GLU 142 Cb -0.05 -0.01 -0.12 0.00 0.63 0.00 0.00 28.75 29.20 2a4h h GLU 142 CO -0.05 0.56 -0.14 0.35 -0.73 0.00 0.00 179.01 178.99 2a4h h PHE 143 N 0.20 -0.30 0.44 0.92 3.57 0.30 0.18 116.94 122.25 2a4h h PHE 143 Ca 0.02 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 2a4h h PHE 143 Cb 0.72 0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.70 2a4h h PHE 143 CO 0.01 -0.27 -0.21 0.74 -2.23 0.00 0.00 178.31 176.35 2a4h h PHE 144 N 0.01 -0.55 -0.89 0.41 0.04 -1.44 0.35 116.94 114.86 2a4h h PHE 144 Ca 0.32 -0.01 0.26 0.00 2.80 0.00 0.00 57.97 61.33 2a4h h PHE 144 Cb 0.49 0.18 -0.04 0.00 2.20 0.00 0.00 35.95 38.79 2a4h h PHE 144 CO -0.51 -0.34 0.78 1.05 -0.60 0.00 0.00 178.31 178.69 2a4h h GLU 145 N -0.95 0.00 0.09 1.51 -0.00 -1.40 1.15 114.58 114.98 2a4h h GLU 145 Ca -0.06 0.00 -0.36 0.00 -0.00 0.00 0.00 59.36 58.94 2a4h h GLU 145 Cb 0.46 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 29.18 2a4h h GLU 145 CO 0.10 0.00 -2.04 0.25 -0.00 0.00 0.00 179.01 177.32 2a4h n THR 146 N -3.86 1.71 0.58 -1.06 -2.24 0.61 -4.20 114.28 105.82 2a4h n THR 146 Ca 0.19 -0.59 0.13 0.00 -2.27 0.00 0.00 64.05 61.51 2a4h n THR 146 Cb 1.08 -1.71 0.41 0.00 -2.10 0.00 0.00 70.33 68.01 2a4h n THR 146 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2a4h h HIS 147 N -0.05 0.00 -1.06 4.78 3.86 0.17 -3.46 115.15 119.40 2a4h h HIS 147 Ca -0.45 0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.27 2a4h h HIS 147 Cb 1.95 0.00 0.01 0.00 1.06 0.00 0.00 27.41 30.42 2a4h h HIS 147 CO 0.07 0.00 -0.22 -0.51 0.86 0.00 0.00 177.93 178.13 2a4h s LEU 148 N -4.62 3.25 -0.11 2.43 1.43 0.38 0.12 118.68 121.56 2a4h s LEU 148 Ca 0.10 -0.77 0.01 0.00 -1.03 0.00 0.00 54.13 52.44 2a4h s LEU 148 Cb 0.12 -1.93 0.02 0.00 0.03 0.00 0.00 46.19 44.42 2a4h s LEU 148 CO 0.57 -1.03 -0.10 0.00 0.23 0.00 0.00 176.35 176.02 2a4h s ALA 149 N -2.56 1.42 0.47 4.21 0.00 -1.26 -4.81 121.76 119.23 2a4h s ALA 149 Ca 0.54 -0.58 0.30 0.00 0.00 0.00 0.00 51.96 52.21 2a4h s ALA 149 Cb -0.06 -0.83 1.63 0.00 0.00 0.00 0.00 23.12 23.85 2a4h s ALA 149 CO 0.33 -0.24 2.14 0.87 0.00 0.00 0.00 175.76 178.86 2a4h h LYS 150 N 7.77 0.00 0.00 0.00 1.79 -1.93 -3.42 116.57 120.77 2a4h h LYS 150 Ca -0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 2a4h h LYS 150 Cb 1.15 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.80 2a4h h LYS 150 CO 0.45 0.07 0.00 -0.25 -1.08 0.00 0.00 179.45 178.64 2a4h n ASP 151 N -3.63 0.00 0.00 0.86 8.00 -1.26 -4.68 116.55 115.85 2a4h n ASP 151 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2a4h n ASP 151 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.29 2a4h n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a4h n GLY 152 N 0.00 3.34 0.00 0.44 0.00 -1.26 -5.15 105.19 102.56 2a4h n GLY 152 Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 0.54 0.00 -2.56 4.61 0.00 -1.26 -4.96 120.51 116.88 2a4h n ALA 153 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2a4h n ALA 153 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 -0.50 3.80 0.00 0.00 -1.26 -4.92 105.19 102.31 2a4h n GLY 154 Ca 0.00 0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 2a4h n GLY 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2a4h s LYS 155 N -5.16 4.05 -0.26 1.61 2.20 -1.26 -5.01 119.74 115.91 2a4h s LYS 155 Ca 0.05 1.33 -0.23 0.00 -0.36 0.00 0.00 55.97 56.77 2a4h s LYS 155 Cb -0.03 -2.26 -0.01 0.00 -1.51 0.00 0.00 37.83 34.02 2a4h s LYS 155 CO 0.07 -0.21 0.74 1.21 -0.36 0.00 0.00 175.35 176.79 2a4h s ASN 156 N -1.92 6.70 0.51 1.43 3.84 -1.26 -4.93 114.94 119.31 2a4h s ASN 156 Ca 0.63 0.84 0.16 0.00 0.21 0.00 0.00 52.86 54.69 2a4h s ASN 156 Cb -0.16 -2.39 1.25 0.00 -0.55 0.00 0.00 41.25 39.40 2a4h s ASN 156 CO 0.20 -0.47 2.13 -1.28 -2.79 0.00 0.00 177.10 174.89 2a4h h SER 157 N 7.84 0.04 -3.89 -4.21 0.87 -2.02 -3.43 113.55 108.75 2a4h h SER 157 Ca -0.25 -0.00 -0.44 0.00 -1.23 0.00 0.00 61.79 59.87 2a4h h SER 157 Cb 1.11 -0.01 0.17 0.00 -0.44 0.00 0.00 62.40 63.22 2a4h h SER 157 CO 0.83 0.03 0.29 -0.31 -0.53 0.00 0.00 176.83 177.14 2a4h s TYR 158 N -5.10 1.43 0.00 2.24 2.02 -1.26 -5.04 117.35 111.64 2a4h s TYR 158 Ca -0.05 0.52 0.00 0.00 -0.37 0.00 0.00 57.07 57.17 2a4h s TYR 158 Cb 0.17 -3.68 0.00 0.00 -0.40 0.00 0.00 41.96 38.05 2a4h s TYR 158 CO 0.68 -3.03 0.32 0.43 -1.57 0.00 0.00 175.55 172.38 2a4h n SER 159 N -4.13 0.00 -3.97 2.29 7.64 -1.26 -5.01 113.62 109.18 2a4h n SER 159 Ca 0.12 0.35 -0.25 0.00 1.01 0.00 0.00 58.87 60.10 2a4h n SER 159 Cb 0.59 -0.08 -0.08 0.00 -1.01 0.00 0.00 64.21 63.64 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 -0.79 0.46 -0.74 0.44 -7.23 -1.26 -5.04 120.40 106.25 2a4h s VAL 160 Ca 0.00 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 57.91 2a4h s VAL 160 Cb 0.00 -2.33 0.04 0.00 0.56 0.00 0.00 36.38 34.65 2a4h s VAL 160 CO 0.00 0.00 1.23 -0.69 -0.31 0.00 0.00 175.10 175.33 2a4h s VAL 161 N -3.22 3.84 0.28 1.32 1.01 -1.26 -5.00 120.40 117.37 2a4h s VAL 161 Ca 0.25 0.21 -0.28 0.00 0.00 0.00 0.00 61.98 62.16 2a4h s VAL 161 Cb 0.02 -4.88 -0.09 0.00 0.00 0.00 0.00 36.38 31.42 2a4h s VAL 161 CO 0.17 -1.79 0.96 -1.83 0.00 0.00 0.00 175.10 172.61 2a4h s GLU 162 N 5.39 4.70 -0.27 2.72 -1.05 -1.26 -4.95 118.70 123.98 2a4h s GLU 162 Ca 0.33 1.46 0.02 0.00 -0.15 0.00 0.00 54.97 56.64 2a4h s GLU 162 Cb -0.09 -3.06 0.39 0.00 -0.44 0.00 0.00 34.13 30.93 2a4h s GLU 162 CO 0.13 0.37 1.54 -3.47 0.95 0.00 0.00 175.26 174.78 2a4h n ASP 163 N 1.04 3.46 -4.97 0.83 2.03 -1.26 -4.91 116.55 112.76 2a4h n ASP 163 Ca -0.00 -2.95 -0.21 0.00 0.52 0.00 0.00 54.79 52.15 2a4h n ASP 163 Cb 0.48 -0.70 0.02 0.00 -0.72 0.00 0.00 41.12 40.20 2a4h n ASP 163 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2a4h s ALA 164 N -1.95 4.53 -0.30 -1.67 0.00 -1.26 -5.13 121.76 115.99 2a4h s ALA 164 Ca 0.34 -1.81 -0.06 0.00 0.00 0.00 0.00 51.96 50.43 2a4h s ALA 164 Cb 0.28 -1.21 0.18 0.00 0.00 0.00 0.00 23.12 22.37 2a4h s ALA 164 CO 0.06 -0.60 0.79 0.34 0.00 0.00 0.00 175.76 176.36 2a4h s ASP 165 N -4.45 -0.99 0.00 0.00 -1.08 -1.26 -4.94 116.67 103.95 2a4h s ASP 165 Ca 0.51 0.61 0.00 0.00 -0.52 0.00 0.00 52.55 53.16 2a4h s ASP 165 Cb -0.05 1.83 0.00 0.00 -1.46 0.00 0.00 42.92 43.24 2a4h s ASP 165 CO 0.32 -0.19 0.00 0.61 0.52 0.00 0.00 175.17 176.43 2a4h n GLY 166 N 5.45 0.68 2.57 2.66 0.00 -1.26 -4.98 105.19 110.30 2a4h n GLY 166 Ca -0.03 -0.29 -0.26 0.00 0.00 0.00 0.00 46.02 45.44 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 0.53 4.39 0.00 1.61 2.03 -1.26 -4.84 116.55 119.00 2a4h n ASP 167 Ca 0.00 -3.63 0.00 0.00 0.52 0.00 0.00 54.79 51.68 2a4h n ASP 167 Cb 0.00 -0.48 0.00 0.00 -0.72 0.00 0.00 41.12 39.92 2a4h n ASP 167 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2a4h n ASP 168 N -0.40 0.00 -4.27 1.67 9.92 -1.26 -5.00 116.55 117.21 2a4h n ASP 168 Ca 0.35 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 54.18 2a4h n ASP 168 Cb 0.63 0.08 0.00 0.00 -0.64 0.00 0.00 41.12 41.19 2a4h n ASP 168 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2a4h n ASP 169 N -1.63 5.03 -2.22 -2.24 9.92 -1.26 -4.75 116.55 119.40 2a4h n ASP 169 Ca 0.00 -2.99 -0.28 0.00 -0.53 0.00 0.00 54.79 50.99 2a4h n ASP 169 Cb 0.00 -1.59 0.03 0.00 -0.64 0.00 0.00 41.12 38.93 2a4h n ASP 169 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2a4h n GLU 170 N 5.69 3.30 -0.03 -1.24 1.02 -1.26 -4.56 120.64 123.57 2a4h n GLU 170 Ca 0.41 -3.96 -0.03 0.00 -0.02 0.00 0.00 57.16 53.56 2a4h n GLU 170 Cb 0.41 -2.28 -0.04 0.00 -0.02 0.00 0.00 31.44 29.51 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 -0.72 3.57 -4.99 1.62 2.03 -1.26 -5.03 116.55 111.77 2a4h n ASP 171 Ca 0.49 -0.00 -0.19 0.00 0.52 0.00 0.00 54.79 55.60 2a4h n ASP 171 Cb 0.80 0.59 0.02 0.00 -0.72 0.00 0.00 41.12 41.81 2a4h n ASP 171 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2a4h s TYR 172 N -2.14 2.90 -1.36 -0.67 5.04 -1.26 -4.51 117.35 115.34 2a4h s TYR 172 Ca -0.03 -0.18 -0.08 0.00 -2.44 0.00 0.00 57.07 54.33 2a4h s TYR 172 Cb 0.02 -2.47 0.02 0.00 0.35 0.00 0.00 41.96 39.88 2a4h s TYR 172 CO 0.23 -0.54 1.10 1.28 -1.34 0.00 0.00 175.55 176.28 2a4h n LEU 173 N -2.03 -3.34 0.00 6.97 4.77 -1.26 -4.92 117.00 117.19 2a4h n LEU 173 Ca 0.07 -0.61 -0.00 0.00 -0.03 0.00 0.00 56.01 55.44 2a4h n LEU 173 Cb 0.59 -2.95 -0.00 0.00 -2.33 0.00 0.00 43.42 38.73 2a4h n LEU 173 CO 0.42 0.57 -0.01 0.54 -1.33 0.00 0.00 177.39 177.59 2a4h n ARG 174 N -4.79 0.00 -1.54 3.23 1.74 -1.26 -4.81 116.66 109.24 2a4h n ARG 174 Ca -0.04 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.74 2a4h n ARG 174 Cb 0.58 -0.13 -0.02 0.00 -1.02 0.00 0.00 32.46 31.87 2a4h n ARG 174 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2a4h n THR 175 N -2.54 3.36 -3.64 0.55 -2.24 -1.26 -4.85 114.28 103.65 2a4h n THR 175 Ca -0.00 -3.19 -0.04 0.00 -2.27 0.00 0.00 64.05 58.55 2a4h n THR 175 Cb 0.00 -1.47 -0.07 0.00 -2.10 0.00 0.00 70.33 66.69 2a4h n THR 175 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2a4h s ASN 176 N -0.09 -0.15 -0.27 3.42 3.84 -1.26 -5.07 114.94 115.37 2a4h s ASN 176 Ca 0.55 0.28 -0.24 0.00 0.21 0.00 0.00 52.86 53.66 2a4h s ASN 176 Cb 0.39 0.28 0.04 0.00 -0.55 0.00 0.00 41.25 41.41 2a4h s ASN 176 CO -0.24 -0.05 0.40 -2.11 -2.79 0.00 0.00 177.10 172.30 2a4h n ARG 177 N 1.67 -1.23 0.00 0.43 1.85 -1.26 -4.77 116.66 113.35 2a4h n ARG 177 Ca -0.10 1.10 0.00 0.00 -1.00 0.00 0.00 57.85 57.84 2a4h n ARG 177 Cb 0.57 -1.51 0.00 0.00 -1.05 0.00 0.00 32.46 30.47 2a4h n ARG 177 CO 0.00 0.00 0.00 1.51 -0.01 0.00 0.00 177.63 179.13