#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dp3 n ALA 3 N 0.00 0.00 -3.27 3.55 0.00 -1.26 -4.78 120.51 114.75 2dp3 n ALA 3 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2dp3 n ALA 3 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2dp3 n ALA 3 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2dp3 s ARG 4 N 4.01 1.11 -0.32 0.00 3.00 -1.26 -4.50 118.95 120.99 2dp3 s ARG 4 Ca 0.00 -0.40 -0.28 0.00 0.00 0.00 0.00 55.73 55.06 2dp3 s ARG 4 Cb 0.00 0.50 0.01 0.00 0.00 0.00 0.00 34.95 35.47 2dp3 s ARG 4 CO 0.00 -0.43 1.01 0.50 0.00 0.00 0.00 175.30 176.37 2dp3 s ARG 5 N -3.09 4.03 0.74 3.54 3.52 -1.26 -5.00 118.95 121.42 2dp3 s ARG 5 Ca -0.02 0.94 -0.16 0.00 -0.13 0.00 0.00 55.73 56.37 2dp3 s ARG 5 Cb -0.00 -3.74 -0.02 0.00 -1.56 0.00 0.00 34.95 29.63 2dp3 s ARG 5 CO -0.07 -0.86 0.68 -2.30 -0.81 0.00 0.00 175.30 171.94 2dp3 n PRO 6 N 6.72 0.32 -3.76 5.12 -0.02 -1.26 -4.82 135.00 137.31 2dp3 n PRO 6 Ca 0.10 0.16 -0.13 0.00 -2.02 0.00 0.00 63.50 61.60 2dp3 n PRO 6 Cb 0.47 -1.97 -0.14 0.00 -0.02 0.00 0.00 33.50 31.84 2dp3 n PRO 6 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2dp3 s PHE 7 N -1.92 -0.17 -0.06 6.00 5.36 -0.49 -1.71 117.98 124.98 2dp3 s PHE 7 Ca 0.68 0.48 -0.01 0.00 -0.96 0.00 0.00 56.93 57.12 2dp3 s PHE 7 Cb -0.34 -0.06 0.03 0.00 -0.34 0.00 0.00 43.02 42.30 2dp3 s PHE 7 CO 0.56 -0.16 -0.01 -1.50 -1.46 0.00 0.00 175.22 172.65 2dp3 s ILE 8 N 1.05 0.41 0.04 3.12 2.07 -0.25 -1.90 121.20 125.74 2dp3 s ILE 8 Ca -0.08 0.05 0.09 0.00 -1.41 0.00 0.00 60.65 59.30 2dp3 s ILE 8 Cb -0.10 -0.53 -0.03 0.00 0.13 0.00 0.00 42.46 41.93 2dp3 s ILE 8 CO -0.05 0.24 -0.24 -0.83 -1.91 0.00 0.00 174.94 172.15 2dp3 s GLY 9 N 1.63 1.46 -0.30 1.50 0.00 -0.04 -1.48 107.32 110.09 2dp3 s GLY 9 Ca -0.00 -1.24 0.01 0.00 0.00 0.00 0.00 44.72 43.48 2dp3 s GLY 9 CO -0.04 -1.13 -0.02 -0.32 0.00 0.00 0.00 173.10 171.59 2dp3 s GLY 10 N -1.29 1.75 -0.47 0.20 0.00 0.18 0.20 107.32 107.89 2dp3 s GLY 10 Ca 0.13 -1.89 -0.21 0.00 0.00 0.00 0.00 44.72 42.74 2dp3 s GLY 10 CO 0.03 0.71 0.68 0.21 0.00 0.00 0.00 173.10 174.73 2dp3 s ASN 11 N 1.20 6.30 0.50 1.64 2.47 0.93 0.53 114.94 128.51 2dp3 s ASN 11 Ca -0.04 -0.48 0.29 0.00 0.42 0.00 0.00 52.86 53.05 2dp3 s ASN 11 Cb -0.20 -2.33 1.10 0.00 -1.45 0.00 0.00 41.25 38.37 2dp3 s ASN 11 CO -0.03 -0.86 1.89 -0.26 -3.72 0.00 0.00 177.10 174.11 2dp3 h PHE 12 N 8.96 0.00 -0.13 0.43 -1.00 -1.73 -3.40 116.94 120.07 2dp3 h PHE 12 Ca -0.26 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.52 2dp3 h PHE 12 Cb 1.09 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.65 2dp3 h PHE 12 CO 0.76 0.09 0.00 1.63 -1.61 0.00 0.00 178.31 179.18 2dp3 n LYS 13 N -3.21 0.00 -2.36 1.51 5.02 -1.26 -3.49 118.16 114.37 2dp3 n LYS 13 Ca 0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.87 2dp3 n LYS 13 Cb 0.38 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.39 2dp3 n LYS 13 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dp3 s ASN 15 N 1.31 0.36 0.00 0.00 0.01 -1.23 -5.13 114.94 110.25 2dp3 s ASN 15 Ca 0.41 -0.78 0.00 0.00 -0.71 0.00 0.00 52.86 51.78 2dp3 s ASN 15 Cb 0.08 0.19 0.00 0.00 0.41 0.00 0.00 41.25 41.93 2dp3 s ASN 15 CO -0.00 -0.52 0.00 0.61 -1.51 0.00 0.00 177.10 175.68 2dp3 n GLY 16 N 0.58 2.52 3.56 0.66 0.00 -1.26 -4.69 105.19 106.56 2dp3 n GLY 16 Ca -0.17 -1.83 -0.26 0.00 0.00 0.00 0.00 46.02 43.76 2dp3 n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dp3 s SER 17 N 0.00 3.17 0.21 1.61 1.04 -1.26 -4.99 113.70 113.48 2dp3 s SER 17 Ca 0.00 -1.47 -0.11 0.00 0.48 0.00 0.00 55.95 54.86 2dp3 s SER 17 Cb 0.00 0.01 0.16 0.00 0.10 0.00 0.00 66.02 66.29 2dp3 s SER 17 CO 0.00 -0.65 1.87 -0.07 0.98 0.00 0.00 173.24 175.37 2dp3 h LEU 18 N 1.84 0.80 -0.81 2.42 3.38 -1.99 -1.15 115.31 119.79 2dp3 h LEU 18 Ca -0.41 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.45 2dp3 h LEU 18 Cb 1.26 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2dp3 h LEU 18 CO 0.72 0.57 -0.04 0.44 0.09 0.00 0.00 178.44 180.23 2dp3 h ASP 19 N 0.95 0.83 -0.30 -0.43 3.32 -1.99 -1.65 116.42 117.15 2dp3 h ASP 19 Ca 0.27 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 2dp3 h ASP 19 Cb -0.08 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 2dp3 h ASP 19 CO -0.07 0.92 0.06 0.15 -1.72 0.00 0.00 179.24 178.58 2dp3 h PHE 20 N 0.79 0.52 -0.17 4.55 3.57 -1.85 -1.57 116.94 122.79 2dp3 h PHE 20 Ca 0.14 -0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.58 2dp3 h PHE 20 Cb 0.52 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 2dp3 h PHE 20 CO 0.03 0.57 0.08 0.82 -2.23 0.00 0.00 178.31 177.58 2dp3 h ILE 21 N 0.32 1.00 -0.04 1.41 1.08 -1.06 0.29 117.51 120.50 2dp3 h ILE 21 Ca 0.09 -0.06 0.02 0.00 -0.39 0.00 0.00 64.86 64.52 2dp3 h ILE 21 Cb 0.32 0.81 -0.02 0.00 -3.07 0.00 0.00 36.82 34.86 2dp3 h ILE 21 CO 0.00 0.03 -0.05 0.11 -0.69 0.00 0.00 178.15 177.56 2dp3 h LYS 22 N 0.18 -0.07 -0.12 2.37 1.57 -1.23 -0.16 116.57 119.11 2dp3 h LYS 22 Ca 0.07 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 2dp3 h LYS 22 Cb 0.01 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 2dp3 h LYS 22 CO -0.04 -0.04 -0.04 0.66 -0.57 0.00 0.00 179.45 179.42 2dp3 h SER 23 N -0.07 0.24 -0.37 0.86 4.64 -1.12 -1.71 113.55 116.02 2dp3 h SER 23 Ca 0.04 -0.38 -0.05 0.00 -0.47 0.00 0.00 61.79 60.92 2dp3 h SER 23 Cb 0.12 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 2dp3 h SER 23 CO -0.08 0.57 0.03 -0.74 -0.87 0.00 0.00 176.83 175.73 2dp3 h HIS 24 N -0.09 0.67 -0.75 4.77 -0.00 -0.41 0.31 115.15 119.65 2dp3 h HIS 24 Ca 0.03 -0.10 -0.06 0.00 -0.00 0.00 0.00 60.37 60.24 2dp3 h HIS 24 Cb 0.47 -0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.66 2dp3 h HIS 24 CO 0.06 0.70 0.25 0.28 -0.00 0.00 0.00 177.93 179.22 2dp3 h VAL 25 N 0.46 1.26 -0.57 5.26 2.07 -1.09 -1.14 116.25 122.49 2dp3 h VAL 25 Ca 0.11 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 2dp3 h VAL 25 Cb 0.41 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2dp3 h VAL 25 CO 0.01 0.35 0.34 0.00 0.02 0.00 0.00 177.57 178.30 2dp3 h ALA 26 N 1.16 0.73 -0.59 1.67 0.00 -0.95 0.89 119.26 122.16 2dp3 h ALA 26 Ca 0.25 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 2dp3 h ALA 26 Cb 0.28 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2dp3 h ALA 26 CO -0.01 0.22 0.11 0.00 0.00 0.00 0.00 179.25 179.57 2dp3 h ALA 27 N 1.17 1.07 -0.13 0.00 0.00 -0.55 -0.56 119.26 120.26 2dp3 h ALA 27 Ca 0.21 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2dp3 h ALA 27 Cb -0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2dp3 h ALA 27 CO -0.04 0.60 -0.09 0.82 0.00 0.00 0.00 179.25 180.55 2dp3 h ILE 28 N 0.90 1.33 0.00 0.00 2.04 -0.86 -3.04 117.51 117.88 2dp3 h ILE 28 Ca 0.19 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 2dp3 h ILE 28 Cb 0.37 1.83 -0.00 0.00 -0.74 0.00 0.00 36.82 38.28 2dp3 h ILE 28 CO 0.01 0.34 -0.05 0.00 0.00 0.00 0.00 178.15 178.45 2dp3 h ALA 29 N 0.63 1.71 0.00 1.87 0.00 -0.63 -0.74 119.26 122.10 2dp3 h ALA 29 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2dp3 h ALA 29 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2dp3 h ALA 29 CO 0.02 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.34 2dp3 n ALA 30 N -2.43 2.13 -1.85 0.00 0.00 -0.24 -4.50 120.51 113.63 2dp3 n ALA 30 Ca -0.03 -0.04 -0.36 0.00 0.00 0.00 0.00 53.44 53.01 2dp3 n ALA 30 Cb 0.13 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.09 2dp3 n ALA 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2dp3 s HIS 31 N -3.08 3.61 -0.16 0.00 5.04 -0.28 -4.99 115.29 115.43 2dp3 s HIS 31 Ca 0.11 1.67 -0.29 0.00 -1.54 0.00 0.00 55.06 55.01 2dp3 s HIS 31 Cb 0.14 -2.85 -0.03 0.00 0.04 0.00 0.00 32.58 29.88 2dp3 s HIS 31 CO 0.50 0.17 1.53 0.21 -2.34 0.00 0.00 174.74 174.81 2dp3 s LYS 32 N -2.27 4.03 -0.24 2.88 2.47 -1.26 -4.99 119.74 120.36 2dp3 s LYS 32 Ca 0.51 1.81 -0.01 0.00 -1.56 0.00 0.00 55.97 56.72 2dp3 s LYS 32 Cb -0.16 -3.95 0.03 0.00 -1.46 0.00 0.00 37.83 32.28 2dp3 s LYS 32 CO 0.21 -1.01 -0.08 0.42 0.16 0.00 0.00 175.35 175.06 2dp3 s ILE 33 N 4.40 2.76 0.73 5.43 1.01 -1.26 -4.97 121.20 129.30 2dp3 s ILE 33 Ca 0.68 -1.04 -0.15 0.00 0.00 0.00 0.00 60.65 60.14 2dp3 s ILE 33 Cb -0.26 -2.39 0.04 0.00 0.01 0.00 0.00 42.46 39.85 2dp3 s ILE 33 CO 0.26 0.22 1.18 -2.16 0.00 0.00 0.00 174.94 174.44 2dp3 s PRO 34 N 1.31 2.20 0.00 2.79 0.04 -1.26 -4.85 135.00 135.22 2dp3 s PRO 34 Ca 0.00 1.67 0.30 0.00 0.04 0.00 0.00 61.00 63.01 2dp3 s PRO 34 Cb -0.16 -1.85 1.58 0.00 0.04 0.00 0.00 34.50 34.11 2dp3 s PRO 34 CO -0.05 -1.77 2.08 -0.25 0.04 0.00 0.00 177.00 177.04 2dp3 n ASP 35 N -2.76 0.00 -0.04 6.66 8.00 -1.26 -3.41 116.55 123.74 2dp3 n ASP 35 Ca 0.13 -0.29 0.13 0.00 0.71 0.00 0.00 54.79 55.46 2dp3 n ASP 35 Cb 0.51 -0.23 0.36 0.00 -0.02 0.00 0.00 41.12 41.73 2dp3 n ASP 35 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2dp3 n SER 36 N -1.23 0.48 -4.05 -2.24 3.41 -1.26 -4.87 113.62 103.85 2dp3 n SER 36 Ca 0.16 -0.23 -0.22 0.00 -0.26 0.00 0.00 58.87 58.32 2dp3 n SER 36 Cb 0.22 0.08 -0.15 0.00 -0.26 0.00 0.00 64.21 64.09 2dp3 n SER 36 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2dp3 s VAL 37 N -2.89 0.97 -0.08 -3.33 1.01 -1.22 -4.22 120.40 110.64 2dp3 s VAL 37 Ca 0.15 -0.48 -0.28 0.00 0.00 0.00 0.00 61.98 61.37 2dp3 s VAL 37 Cb 0.18 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 2dp3 s VAL 37 CO 0.63 0.29 0.91 -1.81 0.00 0.00 0.00 175.10 175.11 2dp3 s ASP 38 N -0.01 7.18 -0.13 3.32 1.01 -0.70 -4.83 116.67 122.52 2dp3 s ASP 38 Ca -0.00 1.44 0.01 0.00 0.71 0.00 0.00 52.55 54.71 2dp3 s ASP 38 Cb -0.08 -2.51 0.02 0.00 1.01 0.00 0.00 42.92 41.36 2dp3 s ASP 38 CO 0.00 -0.32 -0.13 -0.69 0.21 0.00 0.00 175.17 174.25 2dp3 s VAL 39 N 1.50 1.41 0.01 -1.27 1.01 -1.26 -1.10 120.40 120.70 2dp3 s VAL 39 Ca 0.46 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.91 2dp3 s VAL 39 Cb -0.19 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.85 2dp3 s VAL 39 CO 0.20 0.43 -0.08 -0.69 0.00 0.00 0.00 175.10 174.96 2dp3 s VAL 40 N 1.36 0.60 0.02 2.92 1.01 -0.55 -1.81 120.40 123.95 2dp3 s VAL 40 Ca 0.01 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.49 2dp3 s VAL 40 Cb -0.13 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 2dp3 s VAL 40 CO -0.07 0.00 -0.20 0.27 0.00 0.00 0.00 175.10 175.11 2dp3 s ILE 41 N -0.53 1.58 -0.49 2.22 -4.36 -0.83 0.47 121.20 119.26 2dp3 s ILE 41 Ca -0.01 -1.06 0.04 0.00 -0.26 0.00 0.00 60.65 59.36 2dp3 s ILE 41 Cb -0.05 -1.36 0.13 0.00 1.25 0.00 0.00 42.46 42.43 2dp3 s ILE 41 CO 0.00 0.26 0.23 0.00 0.24 0.00 0.00 174.94 175.68 2dp3 s ALA 42 N -0.69 3.11 0.87 2.27 0.00 0.19 -0.77 121.76 126.73 2dp3 s ALA 42 Ca 0.07 -3.10 -0.12 0.00 0.00 0.00 0.00 51.96 48.81 2dp3 s ALA 42 Cb -0.08 -2.10 0.11 0.00 0.00 0.00 0.00 23.12 21.05 2dp3 s ALA 42 CO 0.01 -1.99 1.13 -1.25 0.00 0.00 0.00 175.76 173.67 2dp3 s PRO 43 N -0.08 1.49 0.69 0.00 0.04 -1.24 -2.29 135.00 133.61 2dp3 s PRO 43 Ca 0.16 0.33 -0.15 0.00 0.04 0.00 0.00 61.00 61.38 2dp3 s PRO 43 Cb -0.25 -1.88 0.02 0.00 0.04 0.00 0.00 34.50 32.43 2dp3 s PRO 43 CO -0.01 -1.97 1.17 0.45 0.04 0.00 0.00 177.00 176.69 2dp3 s SER 44 N -4.10 4.60 0.20 6.66 0.15 -1.26 -4.32 113.70 115.63 2dp3 s SER 44 Ca 0.63 2.24 -0.18 0.00 0.70 0.00 0.00 55.95 59.35 2dp3 s SER 44 Cb -0.14 -2.58 0.18 0.00 -1.71 0.00 0.00 66.02 61.77 2dp3 s SER 44 CO 0.53 -1.99 1.60 0.00 1.20 0.00 0.00 173.24 174.58 2dp3 h ALA 45 N -0.06 0.15 0.00 5.45 0.00 -1.94 -0.17 119.26 122.68 2dp3 h ALA 45 Ca -0.48 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2dp3 h ALA 45 Cb 1.28 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.74 2dp3 h ALA 45 CO 0.52 -0.57 0.00 1.33 0.00 0.00 0.00 179.25 180.52 2dp3 n VAL 46 N -5.44 1.40 0.95 0.00 0.24 -1.26 -2.09 118.33 112.13 2dp3 n VAL 46 Ca 0.06 0.41 0.10 0.00 -2.04 0.00 0.00 64.34 62.87 2dp3 n VAL 46 Cb 0.35 -1.32 -0.04 0.00 -1.47 0.00 0.00 33.84 31.36 2dp3 n VAL 46 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2dp3 n HIS 47 N -1.68 0.00 -0.11 6.34 -0.00 -0.09 -4.64 115.22 115.04 2dp3 n HIS 47 Ca 0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.67 2dp3 n HIS 47 Cb 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.08 2dp3 n HIS 47 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2dp3 h LEU 48 N 1.56 -0.81 -0.68 2.41 4.07 -1.24 0.29 115.31 120.90 2dp3 h LEU 48 Ca 0.00 0.17 -0.00 0.00 0.08 0.00 0.00 57.88 58.13 2dp3 h LEU 48 Cb 0.64 0.41 -0.03 0.00 1.08 0.00 0.00 40.66 42.76 2dp3 h LEU 48 CO 0.00 -0.27 0.43 0.28 -1.08 0.00 0.00 178.44 177.80 2dp3 h SER 49 N -0.18 0.81 -0.80 -0.43 0.02 -1.82 -0.55 113.55 110.60 2dp3 h SER 49 Ca 0.19 -0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 61.05 2dp3 h SER 49 Cb 0.47 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.77 2dp3 h SER 49 CO -0.50 0.62 0.32 0.74 -1.14 0.00 0.00 176.83 176.87 2dp3 h THR 50 N 0.93 1.26 -0.39 -2.27 2.02 -1.70 -1.41 112.91 111.36 2dp3 h THR 50 Ca 0.25 -0.83 -0.07 0.00 0.77 0.00 0.00 66.41 66.53 2dp3 h THR 50 Cb -0.06 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 2dp3 h THR 50 CO -0.05 0.34 -0.03 0.00 0.37 0.00 0.00 175.52 176.14 2dp3 h ALA 51 N 1.17 0.53 -0.49 6.16 0.00 -0.53 -2.02 119.26 124.08 2dp3 h ALA 51 Ca 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2dp3 h ALA 51 Cb 0.22 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2dp3 h ALA 51 CO -0.02 0.33 0.32 0.82 0.00 0.00 0.00 179.25 180.70 2dp3 h ILE 52 N 0.52 1.14 -0.88 0.00 2.04 -0.88 -0.05 117.51 119.41 2dp3 h ILE 52 Ca 0.11 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2dp3 h ILE 52 Cb 0.52 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 2dp3 h ILE 52 CO 0.03 0.14 0.49 0.00 0.00 0.00 0.00 178.15 178.81 2dp3 h ALA 53 N 1.17 1.21 0.00 1.87 0.00 -1.15 -2.68 119.26 119.68 2dp3 h ALA 53 Ca 0.18 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2dp3 h ALA 53 Cb -0.05 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.39 2dp3 h ALA 53 CO -0.04 0.64 -0.02 0.00 0.00 0.00 0.00 179.25 179.84 2dp3 h ALA 54 N 1.32 0.99 -1.30 0.00 0.00 -0.90 -3.43 119.26 115.93 2dp3 h ALA 54 Ca 0.31 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.69 2dp3 h ALA 54 Cb 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.72 2dp3 h ALA 54 CO -0.05 0.00 1.17 1.21 0.00 0.00 0.00 179.25 181.58 2dp3 s ASN 55 N -5.20 6.07 0.00 0.00 2.47 -0.07 -4.40 114.94 113.81 2dp3 s ASN 55 Ca 0.09 -0.55 0.23 0.00 0.42 0.00 0.00 52.86 53.06 2dp3 s ASN 55 Cb 0.09 -2.56 0.58 0.00 -1.45 0.00 0.00 41.25 37.92 2dp3 s ASN 55 CO 0.63 -1.88 1.48 0.35 -3.72 0.00 0.00 177.10 173.95 2dp3 n THR 56 N 6.65 0.23 -2.92 -5.21 -2.24 -1.26 -4.94 114.28 104.58 2dp3 n THR 56 Ca 0.13 -0.49 -0.36 0.00 -2.27 0.00 0.00 64.05 61.06 2dp3 n THR 56 Cb 0.50 0.81 -0.06 0.00 -2.10 0.00 0.00 70.33 69.47 2dp3 n THR 56 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2dp3 s SER 57 N -1.70 7.13 0.31 3.42 0.15 -1.26 -4.97 113.70 116.79 2dp3 s SER 57 Ca 0.34 1.63 0.23 0.00 0.70 0.00 0.00 55.95 58.85 2dp3 s SER 57 Cb 0.20 -2.50 0.16 0.00 -1.71 0.00 0.00 66.02 62.16 2dp3 s SER 57 CO 0.30 -0.10 1.30 0.11 1.20 0.00 0.00 173.24 176.05 2dp3 h LYS 58 N 2.94 0.00 0.01 5.44 1.57 -1.92 -3.38 116.57 121.24 2dp3 h LYS 58 Ca -0.48 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 57.91 2dp3 h LYS 58 Cb 1.19 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.43 2dp3 h LYS 58 CO 0.64 0.00 -2.42 1.04 -0.57 0.00 0.00 179.45 178.15 2dp3 n GLN 59 N -2.86 0.66 -1.74 3.15 3.00 -1.26 -4.97 117.38 113.36 2dp3 n GLN 59 Ca 0.02 0.18 -0.42 0.00 -0.01 0.00 0.00 57.00 56.77 2dp3 n GLN 59 Cb 0.54 -1.54 -0.02 0.00 0.00 0.00 0.00 30.24 29.22 2dp3 n GLN 59 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 2dp3 n LEU 60 N -3.40 4.22 -4.36 1.08 7.94 -1.26 -4.63 117.00 116.59 2dp3 n LEU 60 Ca -0.45 1.12 -0.29 0.00 -1.11 0.00 0.00 56.01 55.27 2dp3 n LEU 60 Cb 0.98 -1.59 -0.14 0.00 0.53 0.00 0.00 43.42 43.21 2dp3 n LEU 60 CO 0.26 0.16 -0.57 -0.13 -1.11 0.00 0.00 177.39 176.00 2dp3 s ARG 61 N 0.09 1.54 -0.10 1.96 1.81 -0.75 -4.88 118.95 118.62 2dp3 s ARG 61 Ca 0.68 -1.24 -0.05 0.00 -1.72 0.00 0.00 55.73 53.40 2dp3 s ARG 61 Cb -0.50 -1.90 -0.04 0.00 -0.45 0.00 0.00 34.95 32.06 2dp3 s ARG 61 CO 0.43 0.47 0.09 0.42 -0.68 0.00 0.00 175.30 176.03 2dp3 s ILE 62 N -0.96 5.09 0.23 1.52 1.01 -1.26 -1.96 121.20 124.87 2dp3 s ILE 62 Ca 0.13 0.03 0.04 0.00 0.00 0.00 0.00 60.65 60.85 2dp3 s ILE 62 Cb -0.10 -3.20 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 2dp3 s ILE 62 CO 0.04 0.60 -0.03 0.00 0.00 0.00 0.00 174.94 175.55 2dp3 s ALA 63 N -0.99 1.86 0.14 9.38 0.00 0.05 -4.28 121.76 127.91 2dp3 s ALA 63 Ca 0.15 -1.75 0.03 0.00 0.00 0.00 0.00 51.96 50.39 2dp3 s ALA 63 Cb -0.12 0.36 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 2dp3 s ALA 63 CO 0.04 -0.19 0.23 0.00 0.00 0.00 0.00 175.76 175.84 2dp3 s ALA 64 N -3.32 3.87 -1.24 0.00 0.00 -0.99 -3.69 121.76 116.39 2dp3 s ALA 64 Ca 0.27 -1.04 0.27 0.00 0.00 0.00 0.00 51.96 51.45 2dp3 s ALA 64 Cb 0.05 -1.68 0.79 0.00 0.00 0.00 0.00 23.12 22.28 2dp3 s ALA 64 CO 0.08 0.59 1.60 1.04 0.00 0.00 0.00 175.76 179.07 2dp3 n GLN 65 N -0.33 0.26 -3.59 0.00 6.02 -1.26 -0.48 117.38 117.99 2dp3 n GLN 65 Ca -0.07 -0.12 -0.04 0.00 -0.01 0.00 0.00 57.00 56.75 2dp3 n GLN 65 Cb 0.54 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.28 2dp3 n GLN 65 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2dp3 s ASN 66 N -2.83 -0.20 0.01 1.08 3.04 -1.21 -4.47 114.94 110.36 2dp3 s ASN 66 Ca 0.17 -0.07 -0.27 0.00 0.04 0.00 0.00 52.86 52.72 2dp3 s ASN 66 Cb 0.18 0.26 0.06 0.00 -1.54 0.00 0.00 41.25 40.22 2dp3 s ASN 66 CO 0.60 -0.45 0.61 0.54 -3.04 0.00 0.00 177.10 175.36 2dp3 s VAL 67 N -2.75 0.01 0.72 -5.21 0.11 -1.26 -4.90 120.40 107.12 2dp3 s VAL 67 Ca 0.09 -0.08 -0.07 0.00 -2.93 0.00 0.00 61.98 58.99 2dp3 s VAL 67 Cb -0.00 -0.97 0.07 0.00 -1.53 0.00 0.00 36.38 33.94 2dp3 s VAL 67 CO -0.05 -0.04 1.04 -0.47 -3.33 0.00 0.00 175.10 172.25 2dp3 s TYR 68 N -1.91 2.85 -0.24 1.54 5.04 0.42 -4.93 117.35 120.12 2dp3 s TYR 68 Ca -0.08 0.45 0.14 0.00 -2.44 0.00 0.00 57.07 55.14 2dp3 s TYR 68 Cb -0.01 -3.25 0.80 0.00 0.35 0.00 0.00 41.96 39.85 2dp3 s TYR 68 CO 0.03 -1.49 1.73 1.47 -1.34 0.00 0.00 175.55 175.95 2dp3 n LEU 69 N -2.99 5.64 -4.28 6.97 -0.00 -1.26 -4.69 117.00 116.40 2dp3 n LEU 69 Ca 0.08 -2.96 -0.15 0.00 -0.00 0.00 0.00 56.01 52.98 2dp3 n LEU 69 Cb 0.60 -0.68 -0.10 0.00 -0.00 0.00 0.00 43.42 43.24 2dp3 n LEU 69 CO 0.52 0.64 -0.41 -1.61 -0.00 0.00 0.00 177.39 176.53 2dp3 s GLU 70 N -2.80 1.14 0.00 1.47 0.41 -1.26 -4.91 118.70 112.76 2dp3 s GLU 70 Ca 0.54 -1.50 0.00 0.00 -0.41 0.00 0.00 54.97 53.60 2dp3 s GLU 70 Cb 0.41 -0.74 0.00 0.00 -1.78 0.00 0.00 34.13 32.02 2dp3 s GLU 70 CO 0.15 0.09 0.00 0.41 -0.49 0.00 0.00 175.26 175.42 2dp3 n GLY 71 N -0.25 -0.45 3.77 -1.39 0.00 -1.26 -4.55 105.19 101.06 2dp3 n GLY 71 Ca -0.09 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.82 2dp3 n GLY 71 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dp3 s ASN 72 N -1.00 6.50 0.00 1.61 0.02 -1.26 -4.85 114.94 115.96 2dp3 s ASN 72 Ca 0.00 2.90 0.00 0.00 -1.02 0.00 0.00 52.86 54.74 2dp3 s ASN 72 Cb 0.00 -2.65 0.00 0.00 0.02 0.00 0.00 41.25 38.62 2dp3 s ASN 72 CO 0.00 -0.77 0.00 0.61 0.02 0.00 0.00 177.10 176.96 2dp3 n GLY 73 N 0.96 -0.53 2.66 0.66 0.00 -1.26 -5.03 105.19 102.65 2dp3 n GLY 73 Ca 0.02 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 2dp3 n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dp3 n ALA 74 N 0.00 5.93 -3.37 4.61 0.00 -1.26 -4.72 120.51 121.70 2dp3 n ALA 74 Ca 0.00 -3.86 -0.26 0.00 0.00 0.00 0.00 53.44 49.32 2dp3 n ALA 74 Cb 0.00 -3.45 -0.08 0.00 0.00 0.00 0.00 19.45 15.92 2dp3 n ALA 74 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2dp3 n TRP 75 N 5.37 2.29 -1.62 0.00 7.02 -1.26 -5.09 117.44 124.15 2dp3 n TRP 75 Ca 0.56 -3.96 -0.51 0.00 -1.02 0.00 0.00 57.50 52.57 2dp3 n TRP 75 Cb 0.36 -0.48 -0.06 0.00 -2.42 0.00 0.00 31.31 28.71 2dp3 n TRP 75 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 2dp3 n THR 76 N 1.13 0.04 -0.22 -0.99 -1.04 -1.26 -1.17 114.28 110.77 2dp3 n THR 76 Ca 0.27 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.27 2dp3 n THR 76 Cb 0.45 -1.05 0.00 0.00 -1.82 0.00 0.00 70.33 67.90 2dp3 n THR 76 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2dp3 n GLY 77 N 2.90 1.89 3.94 3.41 0.00 -1.26 -5.04 105.19 111.04 2dp3 n GLY 77 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 2dp3 n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dp3 s GLU 78 N -0.24 3.37 -0.07 1.61 0.41 -0.31 -5.12 118.70 118.35 2dp3 s GLU 78 Ca 0.00 -0.75 0.03 0.00 -0.41 0.00 0.00 54.97 53.84 2dp3 s GLU 78 Cb 0.00 -2.87 -0.02 0.00 -1.78 0.00 0.00 34.13 29.47 2dp3 s GLU 78 CO 0.00 0.45 -0.17 0.99 -0.49 0.00 0.00 175.26 176.04 2dp3 s THR 79 N -1.93 2.80 0.28 3.63 2.01 -1.26 -4.98 115.64 116.19 2dp3 s THR 79 Ca 0.34 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.57 2dp3 s THR 79 Cb -0.09 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.28 2dp3 s THR 79 CO 0.28 0.57 0.43 -0.94 -0.69 0.00 0.00 174.62 174.27 2dp3 s SER 80 N -0.30 6.31 0.22 3.53 1.04 -1.26 -0.44 113.70 122.80 2dp3 s SER 80 Ca 0.02 0.23 -0.09 0.00 0.48 0.00 0.00 55.95 56.58 2dp3 s SER 80 Cb -0.13 -1.93 0.18 0.00 0.10 0.00 0.00 66.02 64.24 2dp3 s SER 80 CO 0.03 -0.15 1.89 0.58 0.98 0.00 0.00 173.24 176.56 2dp3 h VAL 81 N 1.04 1.21 -0.80 5.02 2.07 -1.83 -2.30 116.25 120.66 2dp3 h VAL 81 Ca -0.51 -0.40 0.12 0.00 0.82 0.00 0.00 66.70 66.73 2dp3 h VAL 81 Cb 1.22 0.02 -0.08 0.00 -1.52 0.00 0.00 31.29 30.93 2dp3 h VAL 81 CO 0.62 0.21 0.42 -0.33 0.02 0.00 0.00 177.57 178.50 2dp3 h GLU 82 N 1.10 0.65 -0.53 1.57 3.07 -1.94 -0.02 114.58 118.48 2dp3 h GLU 82 Ca 0.30 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 59.10 2dp3 h GLU 82 Cb -0.12 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 27.62 2dp3 h GLU 82 CO -0.06 0.43 0.25 0.52 -1.40 0.00 0.00 179.01 178.74 2dp3 h MET 83 N 0.67 0.77 -0.37 2.33 2.86 -1.82 0.26 114.93 119.62 2dp3 h MET 83 Ca 0.41 -0.12 -0.03 0.00 -2.06 0.00 0.00 59.70 57.91 2dp3 h MET 83 Cb 0.48 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 2dp3 h MET 83 CO -0.30 0.64 0.13 -0.07 1.06 0.00 0.00 176.91 178.36 2dp3 h LEU 84 N 0.71 0.53 -0.79 1.22 3.38 -0.98 -2.40 115.31 116.99 2dp3 h LEU 84 Ca 0.18 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 2dp3 h LEU 84 Cb 0.13 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2dp3 h LEU 84 CO -0.02 0.59 -0.25 1.56 0.09 0.00 0.00 178.44 180.40 2dp3 h GLN 85 N 0.45 0.64 0.00 1.13 4.20 -0.91 -1.30 115.11 119.31 2dp3 h GLN 85 Ca 0.12 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 2dp3 h GLN 85 Cb 0.24 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 2dp3 h GLN 85 CO -0.01 0.83 -0.06 0.22 -0.67 0.00 0.00 178.83 179.15 2dp3 h ASP 86 N 0.55 0.00 0.07 1.46 3.58 -0.76 0.65 116.42 121.97 2dp3 h ASP 86 Ca 0.08 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.53 2dp3 h ASP 86 Cb 0.72 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.77 2dp3 h ASP 86 CO 0.06 0.06 -0.03 0.23 -2.88 0.00 0.00 179.24 176.67 2dp3 n MET 87 N -4.24 1.24 -0.61 0.28 2.81 -0.85 -4.91 117.12 110.84 2dp3 n MET 87 Ca -0.03 -0.50 0.00 0.00 -1.81 0.00 0.00 57.70 55.36 2dp3 n MET 87 Cb 0.14 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 2dp3 n MET 87 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dp3 n GLY 88 N 1.15 0.69 3.81 3.03 0.00 0.22 -5.05 105.19 109.03 2dp3 n GLY 88 Ca 0.19 -0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 2dp3 n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dp3 s LEU 89 N 0.00 4.47 0.00 0.99 1.43 -0.55 -4.98 118.68 120.05 2dp3 s LEU 89 Ca 0.00 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.42 2dp3 s LEU 89 Cb 0.00 -3.16 0.00 0.00 0.03 0.00 0.00 46.19 43.06 2dp3 s LEU 89 CO 0.00 0.19 0.18 0.29 0.23 0.00 0.00 176.35 177.24 2dp3 n LYS 90 N 1.35 2.70 -4.47 1.70 5.02 -1.26 -4.00 118.16 119.20 2dp3 n LYS 90 Ca -0.07 -0.18 -0.29 0.00 -2.02 0.00 0.00 58.31 55.74 2dp3 n LYS 90 Cb 0.51 -0.63 -0.13 0.00 -0.02 0.00 0.00 35.03 34.75 2dp3 n LYS 90 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2dp3 s HIS 91 N -0.44 2.32 -0.23 2.13 3.76 -1.26 0.22 115.29 121.79 2dp3 s HIS 91 Ca 0.00 -0.38 -0.19 0.00 -0.15 0.00 0.00 55.06 54.34 2dp3 s HIS 91 Cb 0.00 -1.27 0.06 0.00 1.11 0.00 0.00 32.58 32.48 2dp3 s HIS 91 CO 0.00 0.31 0.59 0.54 -0.85 0.00 0.00 174.74 175.33 2dp3 s VAL 92 N -1.02 -0.00 0.01 -0.90 0.11 -0.85 -2.36 120.40 115.38 2dp3 s VAL 92 Ca 0.14 0.01 -0.21 0.00 -2.93 0.00 0.00 61.98 58.99 2dp3 s VAL 92 Cb -0.10 -0.84 -0.06 0.00 -1.53 0.00 0.00 36.38 33.86 2dp3 s VAL 92 CO 0.06 0.00 0.60 -0.63 -3.33 0.00 0.00 175.10 171.80 2dp3 s ILE 93 N 0.61 4.86 -0.01 7.04 1.01 0.36 -1.66 121.20 133.41 2dp3 s ILE 93 Ca -0.02 1.27 0.02 0.00 0.00 0.00 0.00 60.65 61.92 2dp3 s ILE 93 Cb -0.05 -3.94 -0.00 0.00 0.01 0.00 0.00 42.46 38.48 2dp3 s ILE 93 CO -0.03 0.44 -0.06 -0.69 0.00 0.00 0.00 174.94 174.59 2dp3 s VAL 94 N -0.34 0.49 -0.54 2.92 1.01 -0.26 -3.34 120.40 120.34 2dp3 s VAL 94 Ca 0.31 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.06 2dp3 s VAL 94 Cb -0.19 -0.43 0.00 0.00 0.00 0.00 0.00 36.38 35.76 2dp3 s VAL 94 CO 0.18 0.15 0.00 0.61 0.00 0.00 0.00 175.10 176.04 2dp3 n GLY 95 N 3.11 0.69 3.66 4.51 0.00 -1.26 -1.43 105.19 114.46 2dp3 n GLY 95 Ca -0.15 -0.80 -0.44 0.00 0.00 0.00 0.00 46.02 44.63 2dp3 n GLY 95 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2dp3 n HIS 96 N -3.03 2.04 0.07 1.61 -0.00 -1.26 -4.40 115.22 110.24 2dp3 n HIS 96 Ca -0.05 0.50 0.21 0.00 -0.00 0.00 0.00 57.72 58.37 2dp3 n HIS 96 Cb 0.23 -2.42 0.74 0.00 -0.00 0.00 0.00 29.99 28.55 2dp3 n HIS 96 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.34 177.11 2dp3 h SER 97 N 3.56 0.00 -0.37 0.26 0.02 -1.93 0.13 113.55 115.21 2dp3 h SER 97 Ca -0.45 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.44 2dp3 h SER 97 Cb 1.29 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 2dp3 h SER 97 CO 0.71 0.00 0.01 -0.33 -1.14 0.00 0.00 176.83 176.08 2dp3 h GLU 98 N 0.00 0.74 0.07 3.45 5.08 -1.97 0.49 114.58 122.44 2dp3 h GLU 98 Ca 0.21 -0.19 -0.28 0.00 -1.00 0.00 0.00 59.36 58.10 2dp3 h GLU 98 Cb 1.04 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 30.22 2dp3 h GLU 98 CO -0.00 0.74 -1.16 0.00 -1.00 0.00 0.00 179.01 177.59 2dp3 h ARG 99 N 0.70 0.64 0.40 2.33 3.08 -1.12 -1.43 114.38 118.98 2dp3 h ARG 99 Ca 0.14 -0.79 -0.02 0.00 0.07 0.00 0.00 59.98 59.39 2dp3 h ARG 99 Cb 0.41 0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.71 2dp3 h ARG 99 CO 0.02 1.35 -0.19 0.00 -1.07 0.00 0.00 179.97 180.07 2dp3 h ARG 100 N 0.32 -0.52 0.13 0.04 3.08 -1.01 -1.19 114.38 115.24 2dp3 h ARG 100 Ca -0.16 0.04 -0.28 0.00 0.07 0.00 0.00 59.98 59.64 2dp3 h ARG 100 Cb 1.83 0.12 0.01 0.00 0.08 0.00 0.00 29.97 32.00 2dp3 h ARG 100 CO 0.22 -0.23 -1.24 0.00 -1.07 0.00 0.00 179.97 177.66 2dp3 h ARG 101 N -0.79 0.35 0.03 0.04 2.47 -0.16 -3.19 114.38 113.12 2dp3 h ARG 101 Ca -0.06 -0.55 -0.37 0.00 -1.26 0.00 0.00 59.98 57.75 2dp3 h ARG 101 Cb 0.53 0.20 -0.06 0.00 -1.65 0.00 0.00 29.97 28.99 2dp3 h ARG 101 CO 0.09 1.25 -2.28 -0.89 0.56 0.00 0.00 179.97 178.70 2dp3 n ILE 102 N -3.60 1.54 0.14 2.04 5.41 -0.55 -4.57 119.36 119.76 2dp3 n ILE 102 Ca -0.10 -0.68 0.11 0.00 1.00 0.00 0.00 62.75 63.08 2dp3 n ILE 102 Cb 1.01 -1.20 0.21 0.00 -0.71 0.00 0.00 39.64 38.95 2dp3 n ILE 102 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 2dp3 n MET 103 N -3.15 2.45 -1.12 0.38 2.81 -0.90 -4.98 117.12 112.60 2dp3 n MET 103 Ca -0.37 -2.26 -0.04 0.00 -1.81 0.00 0.00 57.70 53.23 2dp3 n MET 103 Cb 1.05 -1.48 -0.02 0.00 -0.71 0.00 0.00 33.22 32.07 2dp3 n MET 103 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dp3 n GLY 104 N 1.36 0.69 3.63 3.03 0.00 -0.96 -4.95 105.19 107.99 2dp3 n GLY 104 Ca 0.18 -0.61 -0.43 0.00 0.00 0.00 0.00 46.02 45.17 2dp3 n GLY 104 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dp3 s GLU 105 N -1.97 3.87 0.81 1.61 2.12 -0.50 -4.97 118.70 119.67 2dp3 s GLU 105 Ca 0.00 1.63 -0.11 0.00 0.36 0.00 0.00 54.97 56.85 2dp3 s GLU 105 Cb 0.00 -3.99 0.07 0.00 0.26 0.00 0.00 34.13 30.48 2dp3 s GLU 105 CO 0.00 -1.19 1.10 0.95 -0.54 0.00 0.00 175.26 175.57 2dp3 s THR 106 N 4.86 3.03 0.25 -1.70 -4.23 -1.26 -4.31 115.64 112.28 2dp3 s THR 106 Ca 0.68 0.34 -0.05 0.00 -1.18 0.00 0.00 61.69 61.48 2dp3 s THR 106 Cb -0.24 -3.06 0.24 0.00 1.34 0.00 0.00 72.50 70.78 2dp3 s THR 106 CO 0.27 -0.44 1.87 0.44 -0.54 0.00 0.00 174.62 176.23 2dp3 h ASP 107 N -1.12 0.94 -0.21 3.99 5.19 -1.96 -1.96 116.42 121.29 2dp3 h ASP 107 Ca -0.47 0.01 -0.16 0.00 -0.62 0.00 0.00 57.03 55.79 2dp3 h ASP 107 Cb 1.27 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 40.58 2dp3 h ASP 107 CO 0.59 0.61 -0.46 -0.08 -3.12 0.00 0.00 179.24 176.78 2dp3 h GLU 108 N 1.09 0.77 -0.36 3.56 4.81 -1.92 -1.89 114.58 120.63 2dp3 h GLU 108 Ca 0.39 -0.44 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 2dp3 h GLU 108 Cb 0.13 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 2dp3 h GLU 108 CO -0.16 1.06 0.10 1.96 -0.73 0.00 0.00 179.01 181.24 2dp3 h GLN 109 N 0.61 0.57 -0.42 1.92 4.20 -1.84 0.14 115.11 120.30 2dp3 h GLN 109 Ca 0.04 -0.13 0.01 0.00 0.06 0.00 0.00 58.65 58.62 2dp3 h GLN 109 Cb 1.03 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.71 2dp3 h GLN 109 CO 0.10 0.61 0.26 0.77 -0.67 0.00 0.00 178.83 179.90 2dp3 h SER 110 N 0.43 0.44 -0.77 1.46 0.02 -1.36 -0.51 113.55 113.27 2dp3 h SER 110 Ca 0.11 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2dp3 h SER 110 Cb 0.29 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.69 2dp3 h SER 110 CO -0.00 0.32 0.50 0.00 -1.14 0.00 0.00 176.83 176.51 2dp3 h ALA 111 N 1.17 0.98 -0.19 3.77 0.00 -0.97 -1.27 119.26 122.76 2dp3 h ALA 111 Ca 0.16 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2dp3 h ALA 111 Cb -0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 2dp3 h ALA 111 CO -0.06 0.36 -0.40 0.87 0.00 0.00 0.00 179.25 180.03 2dp3 h LYS 112 N 1.02 0.43 -0.20 0.00 1.57 -0.28 -0.96 116.57 118.14 2dp3 h LYS 112 Ca 0.29 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 2dp3 h LYS 112 Cb -0.09 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2dp3 h LYS 112 CO -0.07 0.76 0.03 0.87 -0.57 0.00 0.00 179.45 180.47 2dp3 h LYS 113 N 0.36 0.34 -0.13 3.15 1.57 -0.70 -2.04 116.57 119.12 2dp3 h LYS 113 Ca 0.03 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2dp3 h LYS 113 Cb 0.85 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 2dp3 h LYS 113 CO 0.07 0.49 0.08 0.00 -0.57 0.00 0.00 179.45 179.52 2dp3 h ALA 114 N 0.83 0.17 -0.47 3.86 0.00 -1.10 -1.78 119.26 120.77 2dp3 h ALA 114 Ca 0.06 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.99 2dp3 h ALA 114 Cb 0.32 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 2dp3 h ALA 114 CO 0.00 -0.31 0.18 -0.22 0.00 0.00 0.00 179.25 178.90 2dp3 h LYS 115 N 0.14 0.35 -0.58 0.00 3.64 -1.11 0.21 116.57 119.22 2dp3 h LYS 115 Ca 0.05 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2dp3 h LYS 115 Cb 0.04 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 2dp3 h LYS 115 CO -0.01 0.23 0.29 -0.09 -2.27 0.00 0.00 179.45 177.60 2dp3 h ARG 116 N 0.36 0.82 -0.24 1.90 2.43 -1.22 0.11 114.38 118.54 2dp3 h ARG 116 Ca 0.22 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 2dp3 h ARG 116 Cb 0.21 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2dp3 h ARG 116 CO -0.21 0.66 0.12 0.00 -1.51 0.00 0.00 179.97 179.02 2dp3 h ALA 117 N 1.12 0.31 -0.48 2.80 0.00 -0.65 -2.75 119.26 119.61 2dp3 h ALA 117 Ca 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2dp3 h ALA 117 Cb 0.10 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2dp3 h ALA 117 CO -0.03 -0.13 0.27 -0.07 0.00 0.00 0.00 179.25 179.29 2dp3 h LEU 118 N 0.26 0.60 -1.91 0.00 3.38 -0.34 -1.85 115.31 115.44 2dp3 h LEU 118 Ca 0.08 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dp3 h LEU 118 Cb 0.11 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2dp3 h LEU 118 CO -0.01 0.52 0.06 -0.33 0.09 0.00 0.00 178.44 178.77 2dp3 h GLU 119 N 0.64 0.11 -0.01 1.13 5.08 -0.89 -1.05 114.58 119.59 2dp3 h GLU 119 Ca 0.17 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2dp3 h GLU 119 Cb 0.05 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2dp3 h GLU 119 CO -0.03 0.08 0.00 1.63 -1.00 0.00 0.00 179.01 179.69 2dp3 n LYS 120 N -4.52 1.41 0.00 2.33 5.02 -0.97 -4.93 118.16 116.49 2dp3 n LYS 120 Ca -0.01 -0.59 0.00 0.00 -2.02 0.00 0.00 58.31 55.69 2dp3 n LYS 120 Cb 0.09 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.62 2dp3 n LYS 120 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dp3 n GLY 121 N 1.10 0.73 3.89 0.72 0.00 -0.40 -5.10 105.19 106.14 2dp3 n GLY 121 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 2dp3 n GLY 121 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dp3 s MET 122 N -0.89 3.48 -0.20 1.61 -1.94 -0.74 -5.00 119.30 115.62 2dp3 s MET 122 Ca 0.00 0.45 -0.11 0.00 -1.71 0.00 0.00 55.69 54.32 2dp3 s MET 122 Cb 0.00 -2.21 -0.05 0.00 2.01 0.00 0.00 34.83 34.58 2dp3 s MET 122 CO 0.00 -0.46 0.16 0.99 -0.01 0.00 0.00 175.02 175.70 2dp3 s THR 123 N -3.00 5.39 -0.15 2.05 2.01 0.13 -4.32 115.64 117.76 2dp3 s THR 123 Ca 0.52 0.25 -0.01 0.00 0.31 0.00 0.00 61.69 62.75 2dp3 s THR 123 Cb -0.11 -3.50 -0.02 0.00 0.01 0.00 0.00 72.50 68.89 2dp3 s THR 123 CO 0.49 0.43 -0.10 -0.69 -0.69 0.00 0.00 174.62 174.06 2dp3 s VAL 124 N 0.40 3.25 -0.68 3.82 1.01 0.40 -2.01 120.40 126.59 2dp3 s VAL 124 Ca 0.09 -0.58 -0.19 0.00 0.00 0.00 0.00 61.98 61.30 2dp3 s VAL 124 Cb -0.11 -2.39 0.12 0.00 0.00 0.00 0.00 36.38 33.99 2dp3 s VAL 124 CO -0.01 0.50 0.81 -0.63 0.00 0.00 0.00 175.10 175.78 2dp3 s ILE 125 N 0.53 4.82 -0.38 2.22 1.01 -0.67 -0.09 121.20 128.64 2dp3 s ILE 125 Ca -0.07 -1.16 -0.20 0.00 0.00 0.00 0.00 60.65 59.22 2dp3 s ILE 125 Cb -0.15 -4.56 0.01 0.00 0.01 0.00 0.00 42.46 37.76 2dp3 s ILE 125 CO 0.04 -1.22 0.62 0.12 0.00 0.00 0.00 174.94 174.49 2dp3 s PHE 126 N 2.61 3.13 0.15 3.97 5.36 0.08 -1.10 117.98 132.19 2dp3 s PHE 126 Ca 0.17 0.19 -0.17 0.00 -0.96 0.00 0.00 56.93 56.15 2dp3 s PHE 126 Cb -0.19 -3.17 -0.07 0.00 -0.34 0.00 0.00 43.02 39.25 2dp3 s PHE 126 CO 0.03 -0.69 0.61 0.00 -1.46 0.00 0.00 175.22 173.71 2dp3 s VAL 128 N -1.38 0.16 0.00 0.00 -7.23 -0.64 -4.69 120.40 106.62 2dp3 s VAL 128 Ca 0.37 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 59.25 2dp3 s VAL 128 Cb -0.17 -1.22 0.00 0.00 0.56 0.00 0.00 36.38 35.55 2dp3 s VAL 128 CO 0.20 -0.71 0.00 0.61 -0.31 0.00 0.00 175.10 174.88 2dp3 n GLY 129 N 0.29 2.33 3.80 2.32 0.00 -1.26 -1.24 105.19 111.44 2dp3 n GLY 129 Ca -0.16 -0.47 -0.24 0.00 0.00 0.00 0.00 46.02 45.15 2dp3 n GLY 129 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dp3 s GLU 130 N -2.00 2.88 0.71 1.61 1.03 -1.26 -4.72 118.70 116.95 2dp3 s GLU 130 Ca 0.00 -1.00 -0.06 0.00 0.03 0.00 0.00 54.97 53.94 2dp3 s GLU 130 Cb 0.00 -2.58 0.07 0.00 -0.80 0.00 0.00 34.13 30.83 2dp3 s GLU 130 CO 0.00 0.43 1.02 0.95 -1.33 0.00 0.00 175.26 176.33 2dp3 s THR 131 N -1.98 2.27 0.18 1.83 -4.23 -1.26 -1.10 115.64 111.35 2dp3 s THR 131 Ca 0.32 -0.31 -0.14 0.00 -1.18 0.00 0.00 61.69 60.38 2dp3 s THR 131 Cb -0.09 -2.96 0.07 0.00 1.34 0.00 0.00 72.50 70.86 2dp3 s THR 131 CO 0.24 0.00 1.83 0.25 -0.54 0.00 0.00 174.62 176.40 2dp3 h LEU 132 N -0.62 0.59 -0.79 4.79 5.85 -1.97 -1.68 115.31 121.49 2dp3 h LEU 132 Ca -0.44 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.20 2dp3 h LEU 132 Cb 1.30 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 2dp3 h LEU 132 CO 0.56 0.42 0.13 0.44 -0.34 0.00 0.00 178.44 179.65 2dp3 h ASP 133 N 0.70 0.99 -0.35 1.25 3.32 -1.98 0.24 116.42 120.59 2dp3 h ASP 133 Ca 0.20 -0.22 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 2dp3 h ASP 133 Cb -0.06 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.21 2dp3 h ASP 133 CO -0.05 0.97 -0.10 -0.33 -1.72 0.00 0.00 179.24 178.01 2dp3 h GLU 134 N 0.98 0.78 -0.39 3.56 5.08 -1.87 0.10 114.58 122.83 2dp3 h GLU 134 Ca 0.20 -0.25 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 2dp3 h GLU 134 Cb 0.39 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2dp3 h GLU 134 CO 0.01 0.85 -0.27 -0.09 -1.00 0.00 0.00 179.01 178.51 2dp3 h ARG 135 N 0.71 0.86 -0.13 2.33 2.43 -0.98 0.48 114.38 120.09 2dp3 h ARG 135 Ca 0.12 -0.41 -0.04 0.00 -0.81 0.00 0.00 59.98 58.84 2dp3 h ARG 135 Cb 0.57 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 2dp3 h ARG 135 CO 0.04 1.06 -0.12 -0.22 -1.51 0.00 0.00 179.97 179.21 2dp3 h LYS 136 N 0.67 0.20 -0.07 0.20 3.64 -0.61 0.82 116.57 121.42 2dp3 h LYS 136 Ca 0.08 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2dp3 h LYS 136 Cb 0.84 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 2dp3 h LYS 136 CO 0.07 0.33 0.00 0.00 -2.27 0.00 0.00 179.45 177.59 2dp3 n ALA 137 N -2.49 2.57 -3.21 5.00 0.00 0.33 -4.89 120.51 117.82 2dp3 n ALA 137 Ca -0.01 -0.27 -0.20 0.00 0.00 0.00 0.00 53.44 52.96 2dp3 n ALA 137 Cb 0.25 -1.20 0.05 0.00 0.00 0.00 0.00 19.45 18.56 2dp3 n ALA 137 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2dp3 n ASN 138 N -0.34 -5.71 -0.43 0.00 4.05 0.28 -4.91 115.26 108.21 2dp3 n ASN 138 Ca 0.14 -0.37 0.09 0.00 0.45 0.00 0.00 54.58 54.89 2dp3 n ASN 138 Cb 0.16 -4.42 0.19 0.00 1.23 0.00 0.00 39.78 36.94 2dp3 n ASN 138 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2dp3 n ARG 139 N -4.05 2.05 0.06 1.20 1.74 0.16 -4.82 116.66 113.00 2dp3 n ARG 139 Ca -0.04 -2.67 -0.15 0.00 -0.77 0.00 0.00 57.85 54.21 2dp3 n ARG 139 Cb 0.58 -1.64 -0.09 0.00 -1.02 0.00 0.00 32.46 30.28 2dp3 n ARG 139 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 2dp3 h THR 140 N 0.81 0.03 -0.37 0.55 2.02 -1.84 -1.92 112.91 112.19 2dp3 h THR 140 Ca 0.00 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.08 2dp3 h THR 140 Cb 1.18 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 2dp3 h THR 140 CO 0.10 0.00 -0.17 0.24 0.37 0.00 0.00 175.52 176.05 2dp3 h MET 141 N -0.66 0.70 -0.26 6.66 2.86 -1.95 -2.56 114.93 119.72 2dp3 h MET 141 Ca 0.02 -0.25 0.04 0.00 -2.06 0.00 0.00 59.70 57.45 2dp3 h MET 141 Cb 0.72 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.29 2dp3 h MET 141 CO -0.35 0.83 0.04 1.49 1.06 0.00 0.00 176.91 179.98 2dp3 h GLU 142 N 0.62 0.13 0.29 1.72 4.81 -1.84 0.05 114.58 120.37 2dp3 h GLU 142 Ca 0.10 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 2dp3 h GLU 142 Cb 0.64 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.99 2dp3 h GLU 142 CO 0.05 0.09 -0.14 0.28 -0.73 0.00 0.00 179.01 178.55 2dp3 h VAL 143 N 0.14 0.75 -0.92 0.32 2.07 -1.28 -0.60 116.25 116.73 2dp3 h VAL 143 Ca 0.12 -0.47 0.09 0.00 0.82 0.00 0.00 66.70 67.26 2dp3 h VAL 143 Cb 0.13 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.83 2dp3 h VAL 143 CO -0.17 0.10 0.57 0.78 0.02 0.00 0.00 177.57 178.87 2dp3 h ASN 144 N -0.64 0.86 -0.25 0.57 2.35 -1.38 -1.02 115.58 116.07 2dp3 h ASN 144 Ca -0.04 0.03 -0.12 0.00 -0.55 0.00 0.00 56.30 55.63 2dp3 h ASN 144 Cb 0.46 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 2dp3 h ASN 144 CO 0.07 0.51 -0.25 0.40 -1.65 0.00 0.00 177.43 176.50 2dp3 h ILE 145 N 0.97 1.27 -0.68 2.81 2.04 -0.93 -2.08 117.51 120.91 2dp3 h ILE 145 Ca 0.43 -1.35 -0.04 0.00 1.00 0.00 0.00 64.86 64.90 2dp3 h ILE 145 Cb 0.32 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2dp3 h ILE 145 CO -0.22 0.45 0.27 0.00 0.00 0.00 0.00 178.15 178.65 2dp3 h ALA 146 N 1.09 0.88 -0.47 1.87 0.00 0.12 0.37 119.26 123.13 2dp3 h ALA 146 Ca 0.08 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2dp3 h ALA 146 Cb 0.75 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2dp3 h ALA 146 CO 0.06 0.50 -0.05 1.96 0.00 0.00 0.00 179.25 181.72 2dp3 h GLN 147 N 0.97 0.82 -0.08 0.00 4.20 -1.11 -1.66 115.11 118.24 2dp3 h GLN 147 Ca 0.23 -0.25 -0.17 0.00 0.06 0.00 0.00 58.65 58.52 2dp3 h GLN 147 Cb 0.21 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 2dp3 h GLN 147 CO -0.02 0.86 -0.69 1.25 -0.67 0.00 0.00 178.83 179.56 2dp3 h LEU 148 N 0.75 0.43 -0.93 1.46 5.85 -0.96 -3.14 115.31 118.77 2dp3 h LEU 148 Ca 0.14 -0.27 -0.08 0.00 0.84 0.00 0.00 57.88 58.50 2dp3 h LEU 148 Cb 0.53 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 2dp3 h LEU 148 CO 0.03 0.99 -0.10 -0.33 -0.34 0.00 0.00 178.44 178.68 2dp3 h GLU 149 N 0.26 0.67 -0.98 1.25 4.39 0.14 0.28 114.58 120.59 2dp3 h GLU 149 Ca -0.02 -0.21 0.01 0.00 0.34 0.00 0.00 59.36 59.48 2dp3 h GLU 149 Cb 1.25 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.78 2dp3 h GLU 149 CO 0.12 0.76 0.63 0.00 -1.16 0.00 0.00 179.01 179.36 2dp3 h ALA 150 N 1.27 1.24 -0.39 3.43 0.00 -1.27 0.35 119.26 123.89 2dp3 h ALA 150 Ca 0.11 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 2dp3 h ALA 150 Cb 0.54 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2dp3 h ALA 150 CO 0.03 0.65 -0.34 1.25 0.00 0.00 0.00 179.25 180.84 2dp3 h LEU 151 N 1.33 0.97 -1.50 0.00 5.85 -1.44 -2.74 115.31 117.79 2dp3 h LEU 151 Ca 0.36 -0.45 0.01 0.00 0.84 0.00 0.00 57.88 58.63 2dp3 h LEU 151 Cb -0.13 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.60 2dp3 h LEU 151 CO -0.07 1.22 0.34 1.23 -0.34 0.00 0.00 178.44 180.82 2dp3 h GLY 152 N 0.73 0.72 1.05 3.75 0.00 0.15 0.04 103.07 109.51 2dp3 h GLY 152 Ca 0.07 -0.27 -0.09 0.00 0.00 0.00 0.00 47.33 47.04 2dp3 h GLY 152 CO 0.09 0.26 -0.01 1.70 0.00 0.00 0.00 176.54 178.58 2dp3 h LYS 153 N 0.69 0.97 -0.23 4.80 3.64 -0.08 2.37 116.57 128.74 2dp3 h LYS 153 Ca 0.19 -0.31 -0.17 0.00 -1.27 0.00 0.00 60.65 59.09 2dp3 h LYS 153 Cb -0.07 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 2dp3 h LYS 153 CO -0.04 0.98 -0.52 0.93 -2.27 0.00 0.00 179.45 178.53 2dp3 h GLU 154 N 0.85 0.77 0.00 1.90 4.39 -1.08 -3.34 114.58 118.06 2dp3 h GLU 154 Ca 0.15 -0.51 -0.08 0.00 0.34 0.00 0.00 59.36 59.26 2dp3 h GLU 154 Cb 0.55 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.26 2dp3 h GLU 154 CO 0.03 1.14 -0.55 -0.07 -1.16 0.00 0.00 179.01 178.39 2dp3 h LEU 155 N 0.50 0.00 0.00 1.33 3.38 -0.99 -3.47 115.31 116.06 2dp3 h LEU 155 Ca 0.00 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2dp3 h LEU 155 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2dp3 h LEU 155 CO 0.11 1.06 0.00 0.61 0.09 0.00 0.00 178.44 180.31 2dp3 n GLY 156 N 1.57 0.55 0.26 0.83 0.00 0.80 -1.29 105.19 107.92 2dp3 n GLY 156 Ca -0.16 0.73 -0.15 0.00 0.00 0.00 0.00 46.02 46.44 2dp3 n GLY 156 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2dp3 h GLU 157 N 0.00 -0.57 -2.54 1.61 4.57 -1.90 -3.28 114.58 112.47 2dp3 h GLU 157 Ca 0.00 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2dp3 h GLU 157 Cb 0.00 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 2dp3 h GLU 157 CO 0.00 -0.29 0.18 0.45 -1.18 0.00 0.00 179.01 178.17 2dp3 n SER 158 N -5.27 0.00 -0.34 1.04 2.88 -0.41 -4.51 113.62 107.01 2dp3 n SER 158 Ca -0.11 -0.82 0.10 0.00 -1.33 0.00 0.00 58.87 56.71 2dp3 n SER 158 Cb 0.29 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 63.96 2dp3 n SER 158 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2dp3 h LYS 159 N 4.18 0.01 -1.51 -1.46 6.56 -1.79 0.65 116.57 123.21 2dp3 h LYS 159 Ca 0.00 -0.00 0.47 0.00 -1.06 0.00 0.00 60.65 60.06 2dp3 h LYS 159 Cb 0.00 -0.00 -0.11 0.00 -0.57 0.00 0.00 32.23 31.55 2dp3 h LYS 159 CO 0.18 0.01 1.03 0.00 -2.06 0.00 0.00 179.45 178.60 2dp3 h MET 160 N 0.01 0.05 0.00 3.15 -0.00 -1.94 1.55 114.93 117.74 2dp3 h MET 160 Ca 0.53 -0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.23 2dp3 h MET 160 Cb 0.97 -0.01 0.00 0.00 -0.00 0.00 0.00 31.60 32.56 2dp3 h MET 160 CO -0.95 0.03 0.00 -0.07 -0.00 0.00 0.00 176.91 175.92 2dp3 h LEU 161 N 0.05 0.00 -1.64 -0.10 3.38 -1.24 -0.63 115.31 115.13 2dp3 h LEU 161 Ca 0.83 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.80 2dp3 h LEU 161 Cb 2.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.68 2dp3 h LEU 161 CO -0.25 0.00 0.00 -0.50 0.09 0.00 0.00 178.44 177.78 2dp3 h TRP 162 N 0.00 0.00 -0.83 1.13 4.06 0.21 -2.97 115.95 117.55 2dp3 h TRP 162 Ca 0.00 0.00 0.07 0.00 2.06 0.00 0.00 58.89 61.02 2dp3 h TRP 162 Cb 0.12 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.22 2dp3 h TRP 162 CO 0.00 0.00 0.54 -0.22 -3.56 0.00 0.00 178.44 175.20 2dp3 h LYS 163 N 0.00 0.88 -0.69 0.49 3.64 -1.25 -1.71 116.57 117.92 2dp3 h LYS 163 Ca 0.00 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2dp3 h LYS 163 Cb 0.35 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 2dp3 h LYS 163 CO 0.00 0.58 0.03 0.39 -2.27 0.00 0.00 179.45 178.18 2dp3 n GLU 164 N -4.49 3.94 -4.09 1.90 -0.58 -1.12 -4.89 120.64 111.31 2dp3 n GLU 164 Ca 0.13 -2.46 -0.35 0.00 -0.42 0.00 0.00 57.16 54.06 2dp3 n GLU 164 Cb 0.22 -2.10 -0.10 0.00 -0.57 0.00 0.00 31.44 28.90 2dp3 n GLU 164 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2dp3 s VAL 165 N -2.40 4.66 -0.24 2.62 1.01 -0.65 -0.45 120.40 124.96 2dp3 s VAL 165 Ca 0.43 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.35 2dp3 s VAL 165 Cb 0.33 -3.08 0.05 0.00 0.00 0.00 0.00 36.38 33.68 2dp3 s VAL 165 CO 0.12 0.49 -0.13 -0.69 0.00 0.00 0.00 175.10 174.90 2dp3 s VAL 166 N 0.14 2.20 0.05 2.92 1.01 0.87 -4.34 120.40 123.25 2dp3 s VAL 166 Ca 0.04 -1.43 -0.29 0.00 0.00 0.00 0.00 61.98 60.30 2dp3 s VAL 166 Cb -0.12 -2.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.01 2dp3 s VAL 166 CO 0.01 0.12 0.91 -0.63 0.00 0.00 0.00 175.10 175.51 2dp3 s ILE 167 N 1.16 4.71 -0.30 2.22 -1.09 -0.65 -0.74 121.20 126.52 2dp3 s ILE 167 Ca -0.05 1.94 0.02 0.00 -2.23 0.00 0.00 60.65 60.33 2dp3 s ILE 167 Cb -0.18 -4.26 0.07 0.00 -1.58 0.00 0.00 42.46 36.51 2dp3 s ILE 167 CO -0.07 0.27 -0.03 0.00 -1.23 0.00 0.00 174.94 173.88 2dp3 s ALA 168 N 0.39 2.73 -0.32 9.38 0.00 -0.05 0.01 121.76 133.90 2dp3 s ALA 168 Ca 0.46 -1.98 -0.22 0.00 0.00 0.00 0.00 51.96 50.22 2dp3 s ALA 168 Cb -0.22 -1.80 -0.00 0.00 0.00 0.00 0.00 23.12 21.11 2dp3 s ALA 168 CO 0.27 -1.36 0.73 -0.47 0.00 0.00 0.00 175.76 174.93 2dp3 s TYR 169 N 1.09 3.18 -0.34 0.00 5.04 0.51 -1.62 117.35 125.22 2dp3 s TYR 169 Ca -0.03 0.65 0.00 0.00 -2.44 0.00 0.00 57.07 55.25 2dp3 s TYR 169 Cb -0.20 -3.19 0.11 0.00 0.35 0.00 0.00 41.96 39.03 2dp3 s TYR 169 CO -0.05 -0.58 0.13 -1.21 -1.34 0.00 0.00 175.55 172.50 2dp3 s GLU 170 N 2.87 0.86 0.19 4.97 2.02 -0.37 -0.81 118.70 128.42 2dp3 s GLU 170 Ca 0.29 -1.31 -0.33 0.00 0.02 0.00 0.00 54.97 53.65 2dp3 s GLU 170 Cb -0.14 -2.09 -0.13 0.00 0.10 0.00 0.00 34.13 31.88 2dp3 s GLU 170 CO 0.13 -1.03 1.68 -0.35 0.02 0.00 0.00 175.26 175.72 2dp3 n PRO 171 N 4.52 2.57 -0.05 0.39 -0.04 -1.25 -4.31 135.00 136.82 2dp3 n PRO 171 Ca 0.01 0.93 0.14 0.00 -0.04 0.00 0.00 63.50 64.54 2dp3 n PRO 171 Cb 0.40 -2.75 0.56 0.00 -0.04 0.00 0.00 33.50 31.67 2dp3 n PRO 171 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2dp3 h VAL 172 N 3.77 0.85 0.00 0.52 2.07 -1.40 0.12 116.25 122.18 2dp3 h VAL 172 Ca -0.44 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 66.99 2dp3 h VAL 172 Cb 1.22 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2dp3 h VAL 172 CO 0.93 0.05 0.00 -2.67 0.02 0.00 0.00 177.57 175.91 2dp3 n TRP 173 N -4.45 0.00 0.84 1.57 4.27 -1.26 -2.25 117.44 116.16 2dp3 n TRP 173 Ca 0.10 0.00 0.08 0.00 -3.89 0.00 0.00 57.50 53.79 2dp3 n TRP 173 Cb 0.44 -0.39 -0.10 0.00 -1.36 0.00 0.00 31.31 29.91 2dp3 n TRP 173 CO 0.00 0.00 0.00 0.43 -2.29 0.00 0.00 177.69 175.83 2dp3 n SER 174 N -1.39 0.87 -4.61 -0.67 7.64 0.42 -4.59 113.62 111.30 2dp3 n SER 174 Ca 0.07 -0.94 -0.43 0.00 1.01 0.00 0.00 58.87 58.58 2dp3 n SER 174 Cb 0.17 0.98 -0.02 0.00 -1.01 0.00 0.00 64.21 64.34 2dp3 n SER 174 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2dp3 s ILE 175 N -2.66 4.10 0.00 0.44 1.01 -0.95 -2.18 121.20 120.95 2dp3 s ILE 175 Ca 0.07 1.17 0.00 0.00 0.00 0.00 0.00 60.65 61.89 2dp3 s ILE 175 Cb 0.13 -4.31 0.00 0.00 0.01 0.00 0.00 42.46 38.29 2dp3 s ILE 175 CO 0.72 -0.72 0.00 0.61 0.00 0.00 0.00 174.94 175.55 2dp3 n GLY 176 N 4.71 0.17 0.00 6.18 0.00 -1.26 -4.83 105.19 110.16 2dp3 n GLY 176 Ca 0.14 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.27 2dp3 n GLY 176 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dp3 n THR 177 N -2.26 0.00 -0.11 2.61 -2.24 -1.25 -4.96 114.28 106.08 2dp3 n THR 177 Ca 0.00 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2dp3 n THR 177 Cb 0.30 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 2dp3 n THR 177 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dp3 n GLY 178 N 1.39 2.17 3.35 3.38 0.00 -1.26 -4.94 105.19 109.28 2dp3 n GLY 178 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 2dp3 n GLY 178 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2dp3 n VAL 179 N -2.00 4.24 -1.96 1.61 0.31 -1.26 -4.99 118.33 114.28 2dp3 n VAL 179 Ca 0.00 -4.60 -0.34 0.00 -0.01 0.00 0.00 64.34 59.40 2dp3 n VAL 179 Cb 0.00 -2.44 0.03 0.00 -0.91 0.00 0.00 33.84 30.52 2dp3 n VAL 179 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2dp3 s VAL 180 N 1.57 3.28 0.48 2.52 0.11 -1.26 -4.09 120.40 123.00 2dp3 s VAL 180 Ca 0.43 0.66 -0.20 0.00 -2.93 0.00 0.00 61.98 59.95 2dp3 s VAL 180 Cb 0.00 -3.19 -0.09 0.00 -1.53 0.00 0.00 36.38 31.57 2dp3 s VAL 180 CO 0.01 -0.30 1.00 0.00 -3.33 0.00 0.00 175.10 172.47 2dp3 s ALA 181 N -2.16 2.96 0.71 1.54 0.00 -1.26 -5.04 121.76 118.51 2dp3 s ALA 181 Ca 0.69 0.44 -0.11 0.00 0.00 0.00 0.00 51.96 52.97 2dp3 s ALA 181 Cb -0.21 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 19.74 2dp3 s ALA 181 CO 0.36 -0.17 1.07 0.95 0.00 0.00 0.00 175.76 177.97 2dp3 s THR 182 N -2.20 3.84 0.28 0.00 -4.23 -1.26 -4.81 115.64 107.26 2dp3 s THR 182 Ca 0.63 0.60 -0.00 0.00 -1.18 0.00 0.00 61.69 61.74 2dp3 s THR 182 Cb -0.12 -3.42 0.28 0.00 1.34 0.00 0.00 72.50 70.58 2dp3 s THR 182 CO 0.20 -0.78 1.87 -0.65 -0.54 0.00 0.00 174.62 174.72 2dp3 h PRO 183 N -0.73 1.05 -0.33 3.99 0.11 -1.96 -1.03 132.00 133.11 2dp3 h PRO 183 Ca -0.45 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2dp3 h PRO 183 Cb 1.23 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 2dp3 h PRO 183 CO 0.59 0.70 0.12 0.93 -0.21 0.00 0.00 178.00 180.13 2dp3 h GLU 184 N 1.08 0.50 -0.27 1.05 3.07 -1.96 0.78 114.58 118.83 2dp3 h GLU 184 Ca 0.45 -0.10 -0.00 0.00 -0.50 0.00 0.00 59.36 59.21 2dp3 h GLU 184 Cb 0.30 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 2dp3 h GLU 184 CO -0.20 0.51 0.16 1.96 -1.40 0.00 0.00 179.01 180.04 2dp3 h GLN 185 N 0.38 0.38 0.42 2.33 4.20 -1.77 -0.48 115.11 120.56 2dp3 h GLN 185 Ca 0.11 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2dp3 h GLN 185 Cb 0.21 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.92 2dp3 h GLN 185 CO -0.01 0.31 -0.20 0.00 -0.67 0.00 0.00 178.83 178.27 2dp3 h ALA 186 N 1.04 -0.56 -0.88 3.87 0.00 -1.09 -2.73 119.26 118.91 2dp3 h ALA 186 Ca 0.10 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.94 2dp3 h ALA 186 Cb 0.04 0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.97 2dp3 h ALA 186 CO -0.02 -0.74 0.52 1.49 0.00 0.00 0.00 179.25 180.51 2dp3 h GLU 187 N -0.72 0.85 -0.73 0.00 4.57 -0.83 -0.68 114.58 117.05 2dp3 h GLU 187 Ca -0.06 -0.05 0.07 0.00 -1.18 0.00 0.00 59.36 58.14 2dp3 h GLU 187 Cb 0.51 -0.19 -0.06 0.00 -0.16 0.00 0.00 28.75 28.85 2dp3 h GLU 187 CO 0.09 0.56 0.41 0.93 -1.18 0.00 0.00 179.01 179.83 2dp3 h GLU 188 N 0.88 0.73 -0.23 1.92 5.08 -0.99 0.16 114.58 122.12 2dp3 h GLU 188 Ca 0.42 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.59 2dp3 h GLU 188 Cb 0.36 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2dp3 h GLU 188 CO -0.24 0.48 -0.41 0.28 -1.00 0.00 0.00 179.01 178.12 2dp3 h VAL 189 N 0.75 1.31 -0.38 3.13 2.07 -0.95 -2.32 116.25 119.86 2dp3 h VAL 189 Ca 0.33 -1.61 -0.02 0.00 0.82 0.00 0.00 66.70 66.22 2dp3 h VAL 189 Cb 0.22 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 2dp3 h VAL 189 CO -0.19 0.51 0.15 0.45 0.02 0.00 0.00 177.57 178.51 2dp3 h HIS 190 N 0.40 0.52 -0.37 1.57 3.86 -0.71 0.06 115.15 120.49 2dp3 h HIS 190 Ca 0.02 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 2dp3 h HIS 190 Cb 1.00 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 29.29 2dp3 h HIS 190 CO 0.08 0.41 0.17 0.28 0.86 0.00 0.00 177.93 179.73 2dp3 h VAL 191 N 0.53 1.17 -0.11 2.45 2.07 -0.55 0.11 116.25 121.92 2dp3 h VAL 191 Ca 0.13 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 2dp3 h VAL 191 Cb 0.11 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2dp3 h VAL 191 CO -0.01 0.19 -0.13 1.23 0.02 0.00 0.00 177.57 178.86 2dp3 h GLY 192 N 0.45 0.18 1.53 2.17 0.00 -0.68 -1.60 103.07 105.13 2dp3 h GLY 192 Ca 0.13 -0.11 -0.20 0.00 0.00 0.00 0.00 47.33 47.15 2dp3 h GLY 192 CO -0.01 0.10 -0.80 1.41 0.00 0.00 0.00 176.54 177.23 2dp3 h LEU 193 N 0.16 0.55 -0.06 3.11 3.38 -0.49 -2.19 115.31 119.77 2dp3 h LEU 193 Ca 0.03 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 2dp3 h LEU 193 Cb 0.34 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 2dp3 h LEU 193 CO 0.02 1.15 0.03 0.03 0.09 0.00 0.00 178.44 179.76 2dp3 h ARG 194 N 0.29 0.08 -0.79 1.13 2.47 -0.45 -1.11 114.38 116.01 2dp3 h ARG 194 Ca -0.05 -0.01 0.06 0.00 -1.26 0.00 0.00 59.98 58.72 2dp3 h ARG 194 Cb 1.40 -0.02 -0.06 0.00 -1.65 0.00 0.00 29.97 29.65 2dp3 h ARG 194 CO 0.14 0.13 0.48 0.87 0.56 0.00 0.00 179.97 182.14 2dp3 h LYS 195 N 0.02 0.85 -0.36 0.04 1.57 -1.27 0.53 116.57 117.95 2dp3 h LYS 195 Ca 0.02 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2dp3 h LYS 195 Cb 0.07 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2dp3 h LYS 195 CO -0.00 0.56 0.17 2.35 -0.57 0.00 0.00 179.45 181.95 2dp3 h TRP 196 N 0.87 0.53 -0.48 -1.35 7.01 -1.11 -1.88 115.95 119.55 2dp3 h TRP 196 Ca 0.35 -0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.33 2dp3 h TRP 196 Cb 0.17 -0.16 -0.03 0.00 -2.10 0.00 0.00 29.16 27.04 2dp3 h TRP 196 CO -0.05 0.46 0.30 0.35 -2.79 0.00 0.00 178.44 176.72 2dp3 h PHE 197 N 0.45 0.56 -0.76 2.65 3.57 -0.38 0.25 116.94 123.28 2dp3 h PHE 197 Ca 0.12 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.70 2dp3 h PHE 197 Cb 0.14 -0.19 -0.06 0.00 2.79 0.00 0.00 35.95 38.63 2dp3 h PHE 197 CO -0.01 0.34 0.44 0.28 -2.23 0.00 0.00 178.31 177.13 2dp3 h VAL 198 N 0.60 1.00 0.06 1.41 2.07 -0.69 0.33 116.25 121.04 2dp3 h VAL 198 Ca 0.18 -0.28 -0.11 0.00 0.82 0.00 0.00 66.70 67.31 2dp3 h VAL 198 Cb -0.03 0.11 0.01 0.00 -1.52 0.00 0.00 31.29 29.87 2dp3 h VAL 198 CO -0.06 0.15 -0.49 -0.08 0.02 0.00 0.00 177.57 177.11 2dp3 h GLU 199 N 0.81 0.22 0.00 1.57 4.81 -0.86 -3.29 114.58 117.84 2dp3 h GLU 199 Ca 0.34 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2dp3 h GLU 199 Cb 0.19 0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2dp3 h GLU 199 CO -0.18 1.11 -0.80 1.63 -0.73 0.00 0.00 179.01 180.03 2dp3 n LYS 200 N -4.32 0.24 0.00 1.92 4.76 0.85 -4.78 118.16 116.82 2dp3 n LYS 200 Ca -0.12 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.35 2dp3 n LYS 200 Cb 0.66 -1.61 0.00 0.00 -1.84 0.00 0.00 35.03 32.24 2dp3 n LYS 200 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2dp3 n VAL 201 N -1.94 0.00 -3.64 -0.18 0.31 0.10 -5.04 118.33 107.94 2dp3 n VAL 201 Ca 0.03 0.01 -0.05 0.00 -0.01 0.00 0.00 64.34 64.31 2dp3 n VAL 201 Cb 0.42 -0.64 -0.07 0.00 -0.91 0.00 0.00 33.84 32.64 2dp3 n VAL 201 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dp3 s ALA 202 N -2.17 -2.12 0.20 3.52 0.00 -0.44 -4.99 121.76 115.76 2dp3 s ALA 202 Ca 0.00 1.76 -0.10 0.00 0.00 0.00 0.00 51.96 53.62 2dp3 s ALA 202 Cb 0.00 -1.64 0.18 0.00 0.00 0.00 0.00 23.12 21.66 2dp3 s ALA 202 CO 0.00 -0.16 1.83 0.00 0.00 0.00 0.00 175.76 177.44 2dp3 h ALA 203 N 3.58 0.87 -0.42 0.00 0.00 -1.82 -1.60 119.26 119.87 2dp3 h ALA 203 Ca -0.28 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.63 2dp3 h ALA 203 Cb 1.19 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2dp3 h ALA 203 CO 0.15 0.14 0.26 1.49 0.00 0.00 0.00 179.25 181.29 2dp3 h GLU 204 N 0.78 0.52 -0.45 0.00 4.57 -1.95 -2.86 114.58 115.19 2dp3 h GLU 204 Ca 0.27 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.37 2dp3 h GLU 204 Cb 0.06 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 2dp3 h GLU 204 CO -0.12 0.34 0.05 0.78 -1.18 0.00 0.00 179.01 178.88 2dp3 h GLY 205 N 0.53 0.75 2.00 1.92 0.00 -1.81 -2.46 103.07 104.01 2dp3 h GLY 205 Ca 0.16 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 2dp3 h GLY 205 CO -0.06 0.42 -0.13 0.00 0.00 0.00 0.00 176.54 176.77 2dp3 h ALA 206 N 1.39 1.52 0.00 3.60 0.00 -1.08 -0.53 119.26 124.15 2dp3 h ALA 206 Ca 0.14 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2dp3 h ALA 206 Cb 0.34 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2dp3 h ALA 206 CO 0.01 0.17 -0.21 1.96 0.00 0.00 0.00 179.25 181.17 2dp3 h GLN 207 N 0.00 0.00 0.00 0.00 4.20 -1.32 -3.36 115.11 114.62 2dp3 h GLN 207 Ca -0.00 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.43 2dp3 h GLN 207 Cb 0.28 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.01 2dp3 h GLN 207 CO 0.02 0.21 -2.06 0.72 -0.67 0.00 0.00 178.83 177.05 2dp3 n HIS 208 N -3.25 0.00 -1.76 2.96 8.25 -0.52 -4.20 115.22 116.70 2dp3 n HIS 208 Ca 0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.06 2dp3 n HIS 208 Cb 0.51 -0.74 -0.02 0.00 1.12 0.00 0.00 29.99 30.86 2dp3 n HIS 208 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2dp3 s ILE 209 N -2.37 2.05 0.13 1.59 2.07 -0.32 -4.84 121.20 119.50 2dp3 s ILE 209 Ca -0.16 0.04 -0.27 0.00 -1.41 0.00 0.00 60.65 58.84 2dp3 s ILE 209 Cb 0.06 -3.02 -0.07 0.00 0.13 0.00 0.00 42.46 39.55 2dp3 s ILE 209 CO 0.53 0.01 0.84 -0.13 -1.91 0.00 0.00 174.94 174.27 2dp3 s ARG 210 N -0.07 4.62 -0.21 3.50 3.00 -1.26 -4.98 118.95 123.55 2dp3 s ARG 210 Ca 0.66 1.25 -0.00 0.00 0.00 0.00 0.00 55.73 57.64 2dp3 s ARG 210 Cb -0.48 -3.32 0.06 0.00 0.00 0.00 0.00 34.95 31.21 2dp3 s ARG 210 CO 0.44 0.41 -0.03 0.42 0.00 0.00 0.00 175.30 176.53 2dp3 s ILE 211 N -0.61 1.24 0.17 1.52 1.01 -1.26 -1.64 121.20 121.63 2dp3 s ILE 211 Ca 0.40 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 60.13 2dp3 s ILE 211 Cb -0.23 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 2dp3 s ILE 211 CO 0.27 -0.08 0.15 0.27 0.00 0.00 0.00 174.94 175.55 2dp3 s ILE 212 N 1.54 4.53 -0.08 2.92 -4.36 0.10 -1.42 121.20 124.43 2dp3 s ILE 212 Ca -0.04 -1.09 -0.05 0.00 -0.26 0.00 0.00 60.65 59.21 2dp3 s ILE 212 Cb -0.18 -3.33 -0.04 0.00 1.25 0.00 0.00 42.46 40.16 2dp3 s ILE 212 CO -0.07 -0.13 0.12 -0.47 0.24 0.00 0.00 174.94 174.63 2dp3 s TYR 213 N -1.79 3.49 0.05 1.37 5.04 -0.66 -0.36 117.35 124.48 2dp3 s TYR 213 Ca 0.31 0.41 -0.02 0.00 -2.44 0.00 0.00 57.07 55.34 2dp3 s TYR 213 Cb -0.10 -1.87 -0.03 0.00 0.35 0.00 0.00 41.96 40.31 2dp3 s TYR 213 CO 0.24 0.66 0.00 0.20 -1.34 0.00 0.00 175.55 175.31 2dp3 s GLY 214 N -1.25 0.37 0.00 8.97 0.00 0.01 -1.21 107.32 114.22 2dp3 s GLY 214 Ca 0.18 -1.00 0.00 0.00 0.00 0.00 0.00 44.72 43.90 2dp3 s GLY 214 CO 0.08 -1.11 0.00 0.61 0.00 0.00 0.00 173.10 172.67 2dp3 n GLY 215 N 0.37 1.45 2.39 0.20 0.00 -1.26 -3.97 105.19 104.37 2dp3 n GLY 215 Ca -0.16 -0.67 -0.16 0.00 0.00 0.00 0.00 46.02 45.03 2dp3 n GLY 215 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dp3 n SER 216 N 0.00 -4.80 -4.71 1.61 7.64 -0.93 -4.44 113.62 107.99 2dp3 n SER 216 Ca 0.00 0.22 -0.42 0.00 1.01 0.00 0.00 58.87 59.68 2dp3 n SER 216 Cb 0.00 -3.79 -0.03 0.00 -1.01 0.00 0.00 64.21 59.38 2dp3 n SER 216 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dp3 s ALA 217 N -2.66 3.27 0.23 -0.43 0.00 -1.26 -4.68 121.76 116.23 2dp3 s ALA 217 Ca 0.00 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.65 2dp3 s ALA 217 Cb 0.00 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.74 2dp3 s ALA 217 CO 0.00 -0.29 0.29 0.27 0.00 0.00 0.00 175.76 176.02 2dp3 n ASN 218 N 3.71 -0.78 -0.02 0.00 0.23 -1.26 -4.62 115.26 112.52 2dp3 n ASN 218 Ca 0.07 -2.30 0.09 0.00 -0.53 0.00 0.00 54.58 51.90 2dp3 n ASN 218 Cb 0.49 1.52 0.49 0.00 -2.08 0.00 0.00 39.78 40.20 2dp3 n ASN 218 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2dp3 h GLY 219 N 1.32 0.52 1.10 4.83 0.00 -1.95 -1.22 103.07 107.67 2dp3 h GLY 219 Ca -0.17 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2dp3 h GLY 219 CO 0.24 0.13 -0.47 -1.14 0.00 0.00 0.00 176.54 175.30 2dp3 n SER 220 N -4.48 0.47 0.00 0.19 3.41 -1.26 -4.30 113.62 107.66 2dp3 n SER 220 Ca 0.06 -0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 2dp3 n SER 220 Cb 0.24 0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 2dp3 n SER 220 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2dp3 n ASN 221 N -1.56 0.17 0.19 4.04 0.23 -1.09 -4.78 115.26 112.47 2dp3 n ASN 221 Ca 0.05 -0.54 0.05 0.00 -0.53 0.00 0.00 54.58 53.61 2dp3 n ASN 221 Cb 0.35 0.69 0.37 0.00 -2.08 0.00 0.00 39.78 39.11 2dp3 n ASN 221 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2dp3 h GLU 223 N 0.00 0.12 -0.20 0.00 4.81 -1.84 0.29 114.58 117.76 2dp3 h GLU 223 Ca -0.00 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2dp3 h GLU 223 Cb 0.79 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 2dp3 h GLU 223 CO 0.05 0.20 -0.07 0.87 -0.73 0.00 0.00 179.01 179.33 2dp3 h LYS 224 N 0.01 0.30 -0.07 1.92 1.79 -1.91 -1.98 116.57 116.64 2dp3 h LYS 224 Ca 0.03 -0.06 -0.16 0.00 -2.18 0.00 0.00 60.65 58.28 2dp3 h LYS 224 Cb 0.12 -0.05 0.01 0.00 -1.58 0.00 0.00 32.23 30.73 2dp3 h LYS 224 CO -0.00 0.39 -0.57 -0.07 -1.08 0.00 0.00 179.45 178.12 2dp3 h LEU 225 N 0.29 0.61 -1.82 2.94 3.38 -1.50 -3.19 115.31 116.03 2dp3 h LEU 225 Ca 0.06 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.35 2dp3 h LEU 225 Cb 0.31 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2dp3 h LEU 225 CO 0.01 1.20 0.00 1.23 0.09 0.00 0.00 178.44 180.98 2dp3 h GLY 226 N 0.07 0.00 1.83 0.83 0.00 -0.00 -1.67 103.07 104.12 2dp3 h GLY 226 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2dp3 h GLY 226 CO 0.11 0.00 -0.05 -1.06 0.00 0.00 0.00 176.54 175.54 2dp3 n GLN 227 N -2.73 0.06 -2.59 4.80 6.02 -0.78 -4.77 117.38 117.39 2dp3 n GLN 227 Ca -0.01 -0.01 -0.42 0.00 -0.01 0.00 0.00 57.00 56.55 2dp3 n GLN 227 Cb 0.15 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.88 2dp3 n GLN 227 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2dp3 h PRO 229 N 6.95 0.35 -0.32 0.00 0.13 -1.88 -1.63 132.00 135.59 2dp3 h PRO 229 Ca -0.38 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2dp3 h PRO 229 Cb 1.20 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2dp3 h PRO 229 CO 0.80 0.23 0.00 0.09 -0.23 0.00 0.00 178.00 178.89 2dp3 n ASN 230 N -5.07 2.31 -4.24 1.44 3.02 -1.26 -4.72 115.26 106.74 2dp3 n ASN 230 Ca 0.26 -1.88 -0.41 0.00 -0.03 0.00 0.00 54.58 52.52 2dp3 n ASN 230 Cb 0.79 -0.21 -0.08 0.00 -0.61 0.00 0.00 39.78 39.66 2dp3 n ASN 230 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2dp3 s ILE 231 N -1.58 4.37 -2.05 2.41 1.01 -0.62 -4.58 121.20 120.17 2dp3 s ILE 231 Ca 0.33 -1.64 0.31 0.00 0.00 0.00 0.00 60.65 59.64 2dp3 s ILE 231 Cb 0.18 -3.82 0.75 0.00 0.01 0.00 0.00 42.46 39.58 2dp3 s ILE 231 CO 0.25 -0.72 2.06 0.47 0.00 0.00 0.00 174.94 177.00 2dp3 n ASP 232 N 4.96 0.42 0.00 3.58 8.00 -0.51 -4.73 116.55 128.28 2dp3 n ASP 232 Ca -0.09 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.38 2dp3 n ASP 232 Cb 0.41 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 2dp3 n ASP 232 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dp3 n GLY 233 N 1.09 -0.50 3.09 0.44 0.00 -1.25 -1.40 105.19 106.66 2dp3 n GLY 233 Ca 0.21 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.14 2dp3 n GLY 233 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dp3 s PHE 234 N -3.29 0.24 -0.35 1.61 0.08 -0.80 -1.66 117.98 113.81 2dp3 s PHE 234 Ca 0.00 -0.56 -0.04 0.00 0.12 0.00 0.00 56.93 56.45 2dp3 s PHE 234 Cb 0.00 -0.18 0.07 0.00 -0.57 0.00 0.00 43.02 42.34 2dp3 s PHE 234 CO 0.00 -0.33 0.11 -1.17 -0.10 0.00 0.00 175.22 173.73 2dp3 s LEU 235 N -2.07 4.55 -0.16 -0.37 2.96 -0.35 -0.86 118.68 122.38 2dp3 s LEU 235 Ca -0.06 -1.53 -0.15 0.00 -0.22 0.00 0.00 54.13 52.17 2dp3 s LEU 235 Cb -0.02 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 2dp3 s LEU 235 CO -0.04 -0.39 0.33 -0.69 -1.32 0.00 0.00 176.35 174.24 2dp3 s VAL 236 N 1.25 5.27 0.00 1.68 1.01 0.13 -4.03 120.40 125.72 2dp3 s VAL 236 Ca 0.01 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.62 2dp3 s VAL 236 Cb -0.21 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.50 2dp3 s VAL 236 CO -0.01 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.06 2dp3 n GLY 237 N 3.45 0.31 0.26 4.51 0.00 -1.26 -0.05 105.19 112.42 2dp3 n GLY 237 Ca -0.11 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.93 2dp3 n GLY 237 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2dp3 h GLY 238 N 0.00 1.05 2.00 -0.02 0.00 -1.91 -1.56 103.07 102.62 2dp3 h GLY 238 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.14 2dp3 h GLY 238 CO 0.00 0.01 0.00 0.00 0.00 0.00 0.00 176.54 176.55 2dp3 h ALA 239 N 1.45 1.00 0.00 3.60 0.00 -1.88 -1.82 119.26 121.61 2dp3 h ALA 239 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2dp3 h ALA 239 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2dp3 h ALA 239 CO -0.30 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 177.82 2dp3 n SER 240 N -2.86 0.40 -0.52 0.00 3.41 -0.59 -2.30 113.62 111.16 2dp3 n SER 240 Ca -0.02 0.56 0.14 0.00 -0.26 0.00 0.00 58.87 59.29 2dp3 n SER 240 Cb 0.10 -0.66 0.44 0.00 -0.26 0.00 0.00 64.21 63.84 2dp3 n SER 240 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2dp3 n LEU 241 N -1.90 1.66 -4.61 1.04 4.77 -0.68 -4.86 117.00 112.42 2dp3 n LEU 241 Ca 0.05 -0.55 -0.26 0.00 -0.03 0.00 0.00 56.01 55.22 2dp3 n LEU 241 Cb 0.30 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.28 2dp3 n LEU 241 CO 0.23 0.28 -0.31 -0.54 -1.33 0.00 0.00 177.39 175.72 2dp3 s LYS 242 N -2.07 1.97 0.64 3.23 1.02 -0.97 -5.03 119.74 118.53 2dp3 s LYS 242 Ca 0.35 -1.92 0.42 0.00 0.02 0.00 0.00 55.97 54.84 2dp3 s LYS 242 Cb 0.21 -1.78 2.15 0.00 -0.52 0.00 0.00 37.83 37.89 2dp3 s LYS 242 CO 0.36 0.07 2.27 -1.00 -0.92 0.00 0.00 175.35 176.13 2dp3 h PRO 243 N 1.84 0.00 0.00 -1.68 0.13 -1.92 -2.03 132.00 128.34 2dp3 h PRO 243 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2dp3 h PRO 243 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2dp3 h PRO 243 CO 0.72 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.54 2dp3 h GLU 244 N 0.00 0.00 -1.00 0.86 4.11 -1.96 -2.24 114.58 114.35 2dp3 h GLU 244 Ca -0.00 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.45 2dp3 h GLU 244 Cb 0.13 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 2dp3 h GLU 244 CO 0.00 0.00 0.66 0.35 0.07 0.00 0.00 179.01 180.09 2dp3 h PHE 245 N 0.00 1.25 -0.30 2.06 3.04 -1.39 -0.53 116.94 121.08 2dp3 h PHE 245 Ca 0.00 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 61.90 2dp3 h PHE 245 Cb 0.23 -0.42 -0.02 0.00 2.56 0.00 0.00 35.95 38.30 2dp3 h PHE 245 CO 0.00 0.77 -0.14 0.52 -2.02 0.00 0.00 178.31 177.44 2dp3 h MET 246 N 1.34 0.51 -0.55 1.11 2.86 -1.62 -2.07 114.93 116.51 2dp3 h MET 246 Ca 0.38 -0.15 -0.09 0.00 -2.06 0.00 0.00 59.70 57.78 2dp3 h MET 246 Cb -0.11 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.48 2dp3 h MET 246 CO -0.09 0.64 0.01 1.15 1.06 0.00 0.00 176.91 179.67 2dp3 h THR 247 N 0.47 1.26 -0.76 2.22 2.02 -1.33 -2.35 112.91 114.44 2dp3 h THR 247 Ca 0.08 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.16 2dp3 h THR 247 Cb 0.52 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 2dp3 h THR 247 CO 0.03 0.39 0.48 0.24 0.37 0.00 0.00 175.52 177.04 2dp3 h MET 248 N 0.85 1.01 -0.15 6.66 2.07 -0.70 0.51 114.93 125.18 2dp3 h MET 248 Ca 0.16 -0.07 -0.00 0.00 -2.07 0.00 0.00 59.70 57.71 2dp3 h MET 248 Cb 0.53 -0.22 -0.01 0.00 -1.87 0.00 0.00 31.60 30.03 2dp3 h MET 248 CO 0.03 0.68 0.09 0.82 1.07 0.00 0.00 176.91 179.60 2dp3 h ILE 249 N 1.03 1.08 -0.47 -1.22 2.04 -1.03 -0.15 117.51 118.79 2dp3 h ILE 249 Ca 0.28 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 2dp3 h ILE 249 Cb -0.09 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 2dp3 h ILE 249 CO -0.06 0.08 0.27 0.44 0.00 0.00 0.00 178.15 178.88 2dp3 h ASP 250 N 0.17 0.59 -0.79 1.72 3.32 -0.84 -1.37 116.42 119.21 2dp3 h ASP 250 Ca 0.06 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 2dp3 h ASP 250 Cb 0.05 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 2dp3 h ASP 250 CO -0.01 0.50 0.49 0.40 -1.72 0.00 0.00 179.24 178.90 2dp3 h ILE 251 N 0.63 1.22 -0.67 0.35 2.04 -0.73 -0.85 117.51 119.49 2dp3 h ILE 251 Ca 0.17 -0.47 -0.08 0.00 1.00 0.00 0.00 64.86 65.48 2dp3 h ILE 251 Cb 0.04 0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.19 2dp3 h ILE 251 CO -0.03 0.23 0.12 0.25 0.00 0.00 0.00 178.15 178.72 2dp3 h LEU 252 N 1.08 1.06 0.00 1.44 5.85 -0.71 -1.19 115.31 122.85 2dp3 h LEU 252 Ca 0.29 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2dp3 h LEU 252 Cb -0.06 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.69 2dp3 h LEU 252 CO -0.06 1.04 -0.00 0.74 -0.34 0.00 0.00 178.44 179.83 2dp3 h THR 253 N 1.03 1.18 0.00 1.05 2.02 -0.83 -2.54 112.91 114.82 2dp3 h THR 253 Ca 0.21 -0.53 -0.06 0.00 0.77 0.00 0.00 66.41 66.79 2dp3 h THR 253 Cb 0.43 1.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 2dp3 h THR 253 CO 0.01 0.14 -0.30 0.50 0.37 0.00 0.00 175.52 176.24 2dp3 h LYS 254 N -0.23 0.00 0.04 6.66 3.64 -1.11 -3.23 116.57 122.33 2dp3 h LYS 254 Ca -0.00 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.17 2dp3 h LYS 254 Cb 0.23 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2dp3 h LYS 254 CO 0.00 0.30 -0.82 1.15 -2.27 0.00 0.00 179.45 177.81 2dp3 h THR 255 N 0.00 1.38 0.00 1.00 2.02 -1.12 -3.51 112.91 112.69 2dp3 h THR 255 Ca -0.00 -2.23 0.00 0.00 0.77 0.00 0.00 66.41 64.94 2dp3 h THR 255 Cb 0.59 2.65 0.00 0.00 -1.74 0.00 0.00 68.15 69.65 2dp3 h THR 255 CO 0.04 0.66 0.00 -2.11 0.37 0.00 0.00 175.52 174.48