#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aw4 s ARG 2 N 0.00 4.25 0.09 1.43 3.00 -1.26 -5.04 118.95 121.42 2aw4 s ARG 2 Ca 0.00 1.94 0.01 0.00 -1.00 0.00 0.00 55.73 56.68 2aw4 s ARG 2 Cb 0.00 -3.71 0.01 0.00 0.00 0.00 0.00 34.95 31.24 2aw4 s ARG 2 CO 0.00 -0.67 0.06 0.28 0.00 0.00 0.00 175.30 174.97 2aw4 n VAL 3 N 5.01 0.00 -3.69 7.11 0.31 -1.26 -5.15 118.33 120.67 2aw4 n VAL 3 Ca 0.14 -0.38 0.02 0.00 -0.01 0.00 0.00 64.34 64.11 2aw4 n VAL 3 Cb 0.44 -0.32 -0.00 0.00 -0.91 0.00 0.00 33.84 33.04 2aw4 n VAL 3 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2aw4 s ALA 4 N -2.14 -2.26 -0.30 3.52 0.00 -1.26 -5.15 121.76 114.18 2aw4 s ALA 4 Ca 0.04 0.56 -0.18 0.00 0.00 0.00 0.00 51.96 52.38 2aw4 s ALA 4 Cb -0.00 0.46 0.20 0.00 0.00 0.00 0.00 23.12 23.78 2aw4 s ALA 4 CO 0.03 -1.07 1.29 0.21 0.00 0.00 0.00 175.76 176.22 2aw4 s LYS 5 N -2.36 0.02 0.00 0.00 2.47 -1.26 -5.00 119.74 113.62 2aw4 s LYS 5 Ca 0.17 0.05 0.00 0.00 -1.56 0.00 0.00 55.97 54.63 2aw4 s LYS 5 Cb 0.04 0.02 0.00 0.00 -1.46 0.00 0.00 37.83 36.43 2aw4 s LYS 5 CO -0.03 -0.01 0.00 0.00 0.16 0.00 0.00 175.35 175.47 2aw4 n ALA 6 N 3.93 0.00 -1.88 3.13 0.00 -1.26 -5.00 120.51 119.43 2aw4 n ALA 6 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.95 2aw4 n ALA 6 Cb 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.98 2aw4 n ALA 6 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2aw4 s PRO 7 N -1.54 2.59 -0.32 0.00 0.02 -1.26 -4.59 135.00 129.90 2aw4 s PRO 7 Ca 0.00 1.01 0.02 0.00 0.02 0.00 0.00 61.00 62.05 2aw4 s PRO 7 Cb 0.00 -4.42 0.15 0.00 0.02 0.00 0.00 34.50 30.25 2aw4 s PRO 7 CO 0.00 -2.75 0.36 0.08 -0.33 0.00 0.00 177.00 174.36 2aw4 s VAL 8 N 9.67 -0.47 0.34 3.83 1.01 -1.26 -5.02 120.40 128.51 2aw4 s VAL 8 Ca 0.79 -0.57 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 2aw4 s VAL 8 Cb -0.16 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 2aw4 s VAL 8 CO 0.25 -0.44 0.56 0.54 0.00 0.00 0.00 175.10 176.01 2aw4 s VAL 9 N 2.11 5.07 -0.57 2.92 0.11 -1.26 -3.06 120.40 125.73 2aw4 s VAL 9 Ca 0.12 -0.28 -0.10 0.00 -2.93 0.00 0.00 61.98 58.79 2aw4 s VAL 9 Cb -0.14 -3.83 0.15 0.00 -1.53 0.00 0.00 36.38 31.03 2aw4 s VAL 9 CO -0.22 -0.51 0.46 0.54 -3.33 0.00 0.00 175.10 172.04 2aw4 s VAL 10 N -2.28 4.58 0.00 2.04 0.11 0.31 -4.91 120.40 120.25 2aw4 s VAL 10 Ca 0.41 -2.02 0.00 0.00 -2.93 0.00 0.00 61.98 57.44 2aw4 s VAL 10 Cb -0.10 -3.96 0.00 0.00 -1.53 0.00 0.00 36.38 30.79 2aw4 s VAL 10 CO 0.35 -0.85 0.00 -0.81 -3.33 0.00 0.00 175.10 170.46 2aw4 n PRO 11 N 4.60 1.73 -2.79 1.54 -0.04 -1.26 -4.95 135.00 133.84 2aw4 n PRO 11 Ca -0.03 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.21 2aw4 n PRO 11 Cb 0.41 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.90 2aw4 n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2aw4 s ALA 12 N -2.66 3.79 0.00 0.55 0.00 -1.26 -4.33 121.76 117.85 2aw4 s ALA 12 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.79 2aw4 s ALA 12 Cb 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 20.98 2aw4 s ALA 12 CO 0.00 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.59 2aw4 n GLY 13 N -2.23 0.88 3.66 0.00 0.00 -1.26 -4.94 105.19 101.30 2aw4 n GLY 13 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2aw4 n GLY 13 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2aw4 s VAL 14 N 0.00 2.11 -0.22 1.61 -7.23 -1.26 -3.97 120.40 111.44 2aw4 s VAL 14 Ca 0.00 0.04 -0.11 0.00 -1.81 0.00 0.00 61.98 60.09 2aw4 s VAL 14 Cb 0.00 -2.48 0.07 0.00 0.56 0.00 0.00 36.38 34.53 2aw4 s VAL 14 CO 0.00 -0.05 0.52 -0.62 -0.31 0.00 0.00 175.10 174.65 2aw4 s ASP 15 N -3.36 -0.68 0.33 4.85 2.15 0.99 -4.83 116.67 116.13 2aw4 s ASP 15 Ca 0.65 1.16 -0.09 0.00 0.43 0.00 0.00 52.55 54.71 2aw4 s ASP 15 Cb -0.19 1.13 -0.06 0.00 -0.30 0.00 0.00 42.92 43.50 2aw4 s ASP 15 CO 0.58 -0.22 0.66 -0.69 -0.17 0.00 0.00 175.17 175.33 2aw4 s VAL 16 N 1.69 4.89 -0.39 1.11 1.01 -1.26 -0.26 120.40 127.18 2aw4 s VAL 16 Ca -0.09 0.41 -0.01 0.00 0.00 0.00 0.00 61.98 62.29 2aw4 s VAL 16 Cb -0.08 -3.71 0.20 0.00 0.00 0.00 0.00 36.38 32.79 2aw4 s VAL 16 CO -0.16 -0.36 0.91 -0.75 0.00 0.00 0.00 175.10 174.74 2aw4 s LYS 17 N -3.54 0.53 0.95 2.72 2.36 -1.24 -4.90 119.74 116.62 2aw4 s LYS 17 Ca 0.48 -0.39 -0.15 0.00 -2.55 0.00 0.00 55.97 53.36 2aw4 s LYS 17 Cb -0.11 0.01 0.17 0.00 -1.05 0.00 0.00 37.83 36.85 2aw4 s LYS 17 CO 0.28 -0.69 1.23 0.96 1.55 0.00 0.00 175.35 178.68 2aw4 s ILE 18 N 1.36 1.95 0.00 5.43 -0.00 -1.26 -2.03 121.20 126.65 2aw4 s ILE 18 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.86 2aw4 s ILE 18 Cb 0.04 -2.89 0.00 0.00 -0.00 0.00 0.00 42.46 39.61 2aw4 s ILE 18 CO -0.10 0.00 0.00 -3.20 -0.00 0.00 0.00 174.94 171.64 2aw4 n ASN 19 N -3.79 0.00 0.00 4.36 2.85 -0.53 -4.88 115.26 113.27 2aw4 n ASN 19 Ca 0.12 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.59 2aw4 n ASN 19 Cb 0.60 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.62 2aw4 n ASN 19 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2aw4 n GLY 20 N 0.00 2.94 0.38 8.20 0.00 -1.26 -2.59 105.19 112.86 2aw4 n GLY 20 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 46.02 45.69 2aw4 n GLY 20 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2aw4 h GLN 21 N 0.00 -0.01 -6.97 1.61 4.20 -1.81 -3.40 115.11 108.73 2aw4 h GLN 21 Ca 0.00 0.00 -0.45 0.00 0.06 0.00 0.00 58.65 58.26 2aw4 h GLN 21 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 2aw4 h GLN 21 CO 0.00 -0.01 0.34 0.54 -0.67 0.00 0.00 178.83 179.04 2aw4 s VAL 22 N -5.93 4.30 -0.09 -0.54 0.11 -1.07 -3.95 120.40 113.23 2aw4 s VAL 22 Ca -0.14 1.66 -0.30 0.00 -2.93 0.00 0.00 61.98 60.26 2aw4 s VAL 22 Cb 0.20 -3.80 0.09 0.00 -1.53 0.00 0.00 36.38 31.33 2aw4 s VAL 22 CO 0.71 -0.09 0.77 -0.51 -3.33 0.00 0.00 175.10 172.65 2aw4 s ILE 23 N -1.90 0.00 0.21 7.04 1.10 -1.26 -1.46 121.20 124.93 2aw4 s ILE 23 Ca 0.56 0.00 0.03 0.00 -0.51 0.00 0.00 60.65 60.73 2aw4 s ILE 23 Cb -0.14 -1.00 -0.01 0.00 0.15 0.00 0.00 42.46 41.46 2aw4 s ILE 23 CO 0.18 0.00 0.10 1.07 -2.11 0.00 0.00 174.94 174.18 2aw4 n THR 24 N 0.97 0.00 -3.15 4.00 5.66 -0.86 -3.60 114.28 117.31 2aw4 n THR 24 Ca -0.16 -1.31 0.05 0.00 -3.05 0.00 0.00 64.05 59.58 2aw4 n THR 24 Cb 0.57 0.51 -0.01 0.00 -1.55 0.00 0.00 70.33 69.86 2aw4 n THR 24 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 2aw4 s ILE 25 N -2.47 -0.54 0.76 1.09 1.10 -1.26 -3.68 121.20 116.21 2aw4 s ILE 25 Ca 0.14 0.00 -0.11 0.00 -0.51 0.00 0.00 60.65 60.17 2aw4 s ILE 25 Cb 0.01 -0.74 0.05 0.00 0.15 0.00 0.00 42.46 41.92 2aw4 s ILE 25 CO 0.10 0.00 1.08 -0.54 -2.11 0.00 0.00 174.94 173.47 2aw4 s LYS 26 N 2.92 2.37 0.00 3.50 1.02 0.64 -3.66 119.74 126.54 2aw4 s LYS 26 Ca 0.14 0.98 0.00 0.00 0.02 0.00 0.00 55.97 57.12 2aw4 s LYS 26 Cb -0.08 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 35.31 2aw4 s LYS 26 CO -0.20 -1.51 0.00 0.41 -0.92 0.00 0.00 175.35 173.14 2aw4 n GLY 27 N -1.60 0.37 0.35 -3.33 0.00 0.21 -0.00 105.19 101.18 2aw4 n GLY 27 Ca 0.08 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 2aw4 n GLY 27 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2aw4 h LYS 28 N 0.00 -0.15 -0.38 1.61 1.57 -1.66 -0.56 116.57 116.99 2aw4 h LYS 28 Ca 0.00 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 2aw4 h LYS 28 Cb 0.00 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2aw4 h LYS 28 CO 0.00 -0.10 0.11 -0.91 -0.57 0.00 0.00 179.45 177.98 2aw4 h ASN 29 N -0.16 0.50 0.00 0.86 -0.26 -0.19 -3.49 115.58 112.84 2aw4 h ASN 29 Ca 0.09 -0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.77 2aw4 h ASN 29 Cb 0.40 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.53 2aw4 h ASN 29 CO -0.61 0.49 0.00 0.61 -1.06 0.00 0.00 177.43 176.86 2aw4 n GLY 30 N -1.10 -0.35 0.00 2.83 0.00 -0.22 -5.00 105.19 101.36 2aw4 n GLY 30 Ca 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2aw4 n GLY 30 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2aw4 n GLU 31 N 0.00 0.00 -3.37 1.61 1.02 -1.24 0.67 120.64 119.34 2aw4 n GLU 31 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2aw4 n GLU 31 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2aw4 n GLU 31 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2aw4 n LEU 32 N 0.00 0.00 -3.62 -4.62 -0.00 -1.26 -4.86 117.00 102.64 2aw4 n LEU 32 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 56.01 55.98 2aw4 n LEU 32 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.39 2aw4 n LEU 32 CO 0.00 0.00 1.09 -0.89 -0.00 0.00 0.00 177.39 177.59 2aw4 s THR 33 N -2.61 0.00 -0.16 1.47 2.01 -1.24 -3.89 115.64 111.23 2aw4 s THR 33 Ca 0.00 0.00 -0.31 0.00 0.31 0.00 0.00 61.69 61.69 2aw4 s THR 33 Cb 0.00 -1.00 0.14 0.00 0.01 0.00 0.00 72.50 71.65 2aw4 s THR 33 CO 0.00 0.00 1.08 -0.60 -0.69 0.00 0.00 174.62 174.41 2aw4 s ARG 34 N -1.85 0.49 0.81 4.92 6.06 -1.24 -4.99 118.95 123.16 2aw4 s ARG 34 Ca 0.09 0.00 -0.11 0.00 -2.50 0.00 0.00 55.73 53.22 2aw4 s ARG 34 Cb -0.01 0.23 0.08 0.00 0.06 0.00 0.00 34.95 35.31 2aw4 s ARG 34 CO -0.04 -0.18 1.09 -0.08 -2.50 0.00 0.00 175.30 173.59 2aw4 s THR 35 N -1.66 3.14 0.00 4.11 -1.32 -1.26 -4.26 115.64 114.38 2aw4 s THR 35 Ca 0.03 0.37 0.00 0.00 -1.21 0.00 0.00 61.69 60.88 2aw4 s THR 35 Cb -0.01 -2.91 0.00 0.00 -1.51 0.00 0.00 72.50 68.08 2aw4 s THR 35 CO -0.03 -0.48 0.00 0.18 -2.21 0.00 0.00 174.62 172.08 2aw4 n LEU 36 N -3.60 0.00 -4.69 9.08 4.32 -1.25 -4.99 117.00 115.87 2aw4 n LEU 36 Ca 0.08 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.65 2aw4 n LEU 36 Cb 0.54 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.31 2aw4 n LEU 36 CO 0.55 0.00 1.16 0.21 -1.22 0.00 0.00 177.39 178.09 2aw4 s ASN 37 N 0.35 6.80 0.08 -1.43 3.84 -1.26 -4.94 114.94 118.38 2aw4 s ASN 37 Ca 0.00 2.19 -0.23 0.00 0.21 0.00 0.00 52.86 55.03 2aw4 s ASN 37 Cb 0.00 -2.56 -0.15 0.00 -0.55 0.00 0.00 41.25 37.98 2aw4 s ASN 37 CO 0.00 -0.75 1.71 -2.24 -2.79 0.00 0.00 177.10 173.03 2aw4 h ASP 38 N 7.89 -0.02 -0.15 -4.21 2.03 -2.00 -2.93 116.42 117.03 2aw4 h ASP 38 Ca -0.39 -0.03 0.00 0.00 -0.73 0.00 0.00 57.03 55.88 2aw4 h ASP 38 Cb 1.18 0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.69 2aw4 h ASP 38 CO 0.91 0.01 0.00 0.00 -1.03 0.00 0.00 179.24 179.13 2aw4 n ALA 39 N -2.12 2.52 -2.52 4.15 0.00 -1.26 -4.78 120.51 116.49 2aw4 n ALA 39 Ca -0.07 -0.35 -0.24 0.00 0.00 0.00 0.00 53.44 52.77 2aw4 n ALA 39 Cb 0.05 -1.09 -0.13 0.00 0.00 0.00 0.00 19.45 18.29 2aw4 n ALA 39 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2aw4 s VAL 40 N -1.81 1.70 0.18 0.00 1.01 -1.11 -4.52 120.40 115.85 2aw4 s VAL 40 Ca 0.22 -1.44 -0.00 0.00 0.00 0.00 0.00 61.98 60.76 2aw4 s VAL 40 Cb 0.11 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 2aw4 s VAL 40 CO 0.17 0.03 0.09 -1.61 0.00 0.00 0.00 175.10 173.77 2aw4 s GLU 41 N -1.68 1.11 0.00 2.72 2.02 -1.25 -4.47 118.70 117.15 2aw4 s GLU 41 Ca 0.07 -1.56 0.00 0.00 0.02 0.00 0.00 54.97 53.49 2aw4 s GLU 41 Cb -0.10 0.14 0.00 0.00 0.10 0.00 0.00 34.13 34.28 2aw4 s GLU 41 CO 0.03 -0.30 0.00 1.33 0.02 0.00 0.00 175.26 176.34 2aw4 n VAL 42 N -0.22 0.00 -3.16 2.63 0.24 -1.26 -2.75 118.33 113.81 2aw4 n VAL 42 Ca -0.02 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.33 2aw4 n VAL 42 Cb 0.65 -0.23 -0.02 0.00 -1.47 0.00 0.00 33.84 32.76 2aw4 n VAL 42 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2aw4 s LYS 43 N 1.91 0.07 -0.68 7.34 2.20 -1.16 -4.79 119.74 124.63 2aw4 s LYS 43 Ca 0.00 0.14 -0.14 0.00 -0.36 0.00 0.00 55.97 55.60 2aw4 s LYS 43 Cb 0.00 0.08 0.17 0.00 -1.51 0.00 0.00 37.83 36.57 2aw4 s LYS 43 CO 0.00 -0.07 0.62 -1.58 -0.36 0.00 0.00 175.35 173.97 2aw4 s HIS 44 N 2.80 3.51 0.00 4.03 2.46 -1.26 -1.09 115.29 125.74 2aw4 s HIS 44 Ca -0.06 -1.69 0.00 0.00 0.47 0.00 0.00 55.06 53.78 2aw4 s HIS 44 Cb -0.07 -3.78 0.00 0.00 -0.13 0.00 0.00 32.58 28.59 2aw4 s HIS 44 CO -0.10 -1.00 0.04 0.00 -2.47 0.00 0.00 174.74 171.22 2aw4 n ALA 45 N 4.57 0.00 -1.98 1.58 0.00 -1.24 -5.02 120.51 118.43 2aw4 n ALA 45 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2aw4 n ALA 45 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 2aw4 n ALA 45 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2aw4 n ASP 46 N -0.08 0.00 0.04 0.00 5.75 -1.26 -4.99 116.55 116.01 2aw4 n ASP 46 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 54.79 54.62 2aw4 n ASP 46 Cb 0.00 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 39.95 2aw4 n ASP 46 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2aw4 h ASN 47 N 0.00 0.34 -0.94 -1.12 -1.07 -1.93 -3.46 115.58 107.39 2aw4 h ASN 47 Ca 0.00 -0.53 -0.50 0.00 0.07 0.00 0.00 56.30 55.35 2aw4 h ASN 47 Cb 0.00 -0.11 0.01 0.00 -2.07 0.00 0.00 38.32 36.15 2aw4 h ASN 47 CO 0.00 1.45 -0.20 0.28 0.07 0.00 0.00 177.43 179.03 2aw4 s THR 48 N -2.61 2.25 0.34 6.14 -1.32 -1.25 0.11 115.64 119.30 2aw4 s THR 48 Ca -0.10 -1.13 0.04 0.00 -1.21 0.00 0.00 61.69 59.28 2aw4 s THR 48 Cb 0.07 -2.38 -0.06 0.00 -1.51 0.00 0.00 72.50 68.62 2aw4 s THR 48 CO 0.84 0.00 0.06 -0.76 -2.21 0.00 0.00 174.62 172.55 2aw4 s LEU 49 N -4.48 2.20 -0.32 9.08 1.02 -1.17 -3.59 118.68 121.41 2aw4 s LEU 49 Ca 0.54 -1.41 0.00 0.00 0.02 0.00 0.00 54.13 53.29 2aw4 s LEU 49 Cb -0.05 -0.39 0.14 0.00 0.02 0.00 0.00 46.19 45.91 2aw4 s LEU 49 CO 0.33 -0.63 0.30 0.42 0.02 0.00 0.00 176.35 176.79 2aw4 s THR 50 N -3.26 -0.28 0.70 5.49 -4.23 -0.25 -4.79 115.64 109.02 2aw4 s THR 50 Ca 0.35 -0.83 -0.14 0.00 -1.18 0.00 0.00 61.69 59.89 2aw4 s THR 50 Cb 0.08 -0.89 0.02 0.00 1.34 0.00 0.00 72.50 73.05 2aw4 s THR 50 CO 0.15 -0.60 1.13 0.12 -0.54 0.00 0.00 174.62 174.88 2aw4 s PHE 51 N 1.86 2.46 -0.29 3.99 5.36 -1.26 -2.99 117.98 127.10 2aw4 s PHE 51 Ca 0.13 1.57 -0.15 0.00 -0.96 0.00 0.00 56.93 57.52 2aw4 s PHE 51 Cb -0.16 -3.22 0.14 0.00 -0.34 0.00 0.00 43.02 39.44 2aw4 s PHE 51 CO -0.19 -1.93 0.90 0.20 -1.46 0.00 0.00 175.22 172.73 2aw4 s GLY 52 N -2.58 -0.22 0.27 13.12 0.00 -1.11 -4.96 107.32 111.83 2aw4 s GLY 52 Ca 0.68 2.92 -0.28 0.00 0.00 0.00 0.00 44.72 48.04 2aw4 s GLY 52 CO 0.45 2.76 0.92 -4.14 0.00 0.00 0.00 173.10 173.10 2aw4 s PRO 53 N 1.81 4.71 -0.23 2.90 0.02 -1.26 -3.90 135.00 139.05 2aw4 s PRO 53 Ca -0.07 1.39 0.04 0.00 0.02 0.00 0.00 61.00 62.37 2aw4 s PRO 53 Cb -0.05 -3.08 0.42 0.00 0.02 0.00 0.00 34.50 31.81 2aw4 s PRO 53 CO -0.17 0.42 1.45 0.54 -0.33 0.00 0.00 177.00 178.92 2aw4 n ARG 54 N 1.10 2.19 -3.67 5.54 5.12 -1.26 -4.84 116.66 120.84 2aw4 n ARG 54 Ca -0.01 -1.79 -0.11 0.00 -1.93 0.00 0.00 57.85 54.01 2aw4 n ARG 54 Cb 0.48 -1.77 -0.09 0.00 -1.16 0.00 0.00 32.46 29.93 2aw4 n ARG 54 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2aw4 s ASP 55 N -0.38 -0.68 -0.51 0.55 -1.08 -1.26 -5.13 116.67 108.19 2aw4 s ASP 55 Ca 0.33 1.20 -0.18 0.00 -0.52 0.00 0.00 52.55 53.39 2aw4 s ASP 55 Cb 0.27 1.15 0.08 0.00 -1.46 0.00 0.00 42.92 42.96 2aw4 s ASP 55 CO 0.07 -0.21 0.56 -0.83 0.52 0.00 0.00 175.17 175.28 2aw4 s GLY 56 N 0.88 1.89 0.00 2.66 0.00 -1.26 -4.77 107.32 106.71 2aw4 s GLY 56 Ca -0.05 -2.01 0.00 0.00 0.00 0.00 0.00 44.72 42.67 2aw4 s GLY 56 CO -0.07 1.34 0.00 1.58 0.00 0.00 0.00 173.10 175.94 2aw4 n TYR 57 N 5.82 -0.50 0.32 1.90 4.11 -1.26 -5.08 117.16 122.47 2aw4 n TYR 57 Ca -0.09 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.68 2aw4 n TYR 57 Cb 0.44 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.72 2aw4 n TYR 57 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2aw4 h ALA 58 N 2.00 -0.94 0.00 -3.48 0.00 -2.05 -3.22 119.26 111.57 2aw4 h ALA 58 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2aw4 h ALA 58 Cb 0.00 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2aw4 h ALA 58 CO 0.00 -0.88 0.00 -0.25 0.00 0.00 0.00 179.25 178.12 2aw4 n ASP 59 N -4.95 2.27 0.00 0.00 8.00 -1.26 -4.25 116.55 116.37 2aw4 n ASP 59 Ca -0.10 -1.42 0.00 0.00 0.71 0.00 0.00 54.79 53.97 2aw4 n ASP 59 Cb 0.33 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 2aw4 n ASP 59 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2aw4 n GLY 60 N 1.18 0.02 0.57 0.44 0.00 -1.22 -4.60 105.19 101.58 2aw4 n GLY 60 Ca 0.00 0.00 0.45 0.00 0.00 0.00 0.00 46.02 46.47 2aw4 n GLY 60 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2aw4 n TRP 61 N -0.14 0.31 -0.07 1.61 8.01 -1.26 0.76 117.44 126.66 2aw4 n TRP 61 Ca 0.00 0.31 0.10 0.00 -1.31 0.00 0.00 57.50 56.60 2aw4 n TRP 61 Cb 0.00 -0.77 0.48 0.00 -2.01 0.00 0.00 31.31 29.01 2aw4 n TRP 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2aw4 h ALA 62 N 1.21 1.94 -0.37 6.99 0.00 -1.85 -1.67 119.26 125.50 2aw4 h ALA 62 Ca 0.87 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.66 2aw4 h ALA 62 Cb 3.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 20.85 2aw4 h ALA 62 CO -0.21 -0.04 -0.21 -0.56 0.00 0.00 0.00 179.25 178.23 2aw4 h GLN 63 N 0.45 0.71 -0.43 0.00 3.07 0.09 -3.01 115.11 115.99 2aw4 h GLN 63 Ca 0.25 -0.27 -0.06 0.00 0.09 0.00 0.00 58.65 58.65 2aw4 h GLN 63 Cb 0.40 -0.04 -0.02 0.00 0.08 0.00 0.00 27.48 27.90 2aw4 h GLN 63 CO -0.07 0.86 0.02 0.00 0.09 0.00 0.00 178.83 179.73 2aw4 h ALA 64 N 1.14 0.58 -0.79 0.06 0.00 -1.42 -2.88 119.26 115.96 2aw4 h ALA 64 Ca 0.09 -0.26 0.18 0.00 0.00 0.00 0.00 54.91 54.93 2aw4 h ALA 64 Cb 0.69 -0.16 -0.14 0.00 0.00 0.00 0.00 17.79 18.18 2aw4 h ALA 64 CO 0.05 0.35 -0.01 0.78 0.00 0.00 0.00 179.25 180.43 2aw4 h GLY 65 N 0.60 0.86 2.00 0.00 0.00 -1.34 0.30 103.07 105.49 2aw4 h GLY 65 Ca 0.13 0.13 -0.05 0.00 0.00 0.00 0.00 47.33 47.53 2aw4 h GLY 65 CO 0.02 -0.31 -0.24 -0.84 0.00 0.00 0.00 176.54 175.16 2aw4 h THR 66 N 0.09 0.45 0.00 4.70 2.02 -1.60 -3.14 112.91 115.42 2aw4 h THR 66 Ca 0.43 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 66.15 2aw4 h THR 66 Cb 0.77 2.08 0.00 0.00 -1.74 0.00 0.00 68.15 69.26 2aw4 h THR 66 CO -0.71 0.24 0.00 0.00 0.37 0.00 0.00 175.52 175.42 2aw4 n ALA 67 N -2.17 -0.18 -0.15 6.16 0.00 0.97 -1.78 120.51 123.35 2aw4 n ALA 67 Ca 0.02 0.00 0.28 0.00 0.00 0.00 0.00 53.44 53.74 2aw4 n ALA 67 Cb 0.57 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.74 2aw4 n ALA 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aw4 h ARG 68 N 0.00 0.00 -0.07 0.00 3.08 -1.52 0.33 114.38 116.20 2aw4 h ARG 68 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 2aw4 h ARG 68 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 2aw4 h ARG 68 CO 0.00 0.00 -0.77 0.00 -1.07 0.00 0.00 179.97 178.13 2aw4 h ALA 69 N 1.56 0.54 -0.37 0.04 0.00 -1.62 -2.78 119.26 116.62 2aw4 h ALA 69 Ca 0.40 -0.63 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2aw4 h ALA 69 Cb 1.64 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 2aw4 h ALA 69 CO -0.00 0.77 -0.27 1.25 0.00 0.00 0.00 179.25 181.00 2aw4 h LEU 70 N 0.28 0.80 -1.01 0.00 7.12 0.45 -2.86 115.31 120.09 2aw4 h LEU 70 Ca -0.04 -0.31 -0.10 0.00 0.13 0.00 0.00 57.88 57.56 2aw4 h LEU 70 Cb 1.36 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 41.26 2aw4 h LEU 70 CO 0.13 1.02 -0.48 -0.07 -0.13 0.00 0.00 178.44 178.91 2aw4 h LEU 71 N 0.67 0.03 0.33 2.25 4.07 -1.33 -3.14 115.31 118.18 2aw4 h LEU 71 Ca 0.08 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 2aw4 h LEU 71 Cb 0.79 -0.01 -0.03 0.00 1.08 0.00 0.00 40.66 42.49 2aw4 h LEU 71 CO 0.07 0.51 -0.52 -1.13 -1.08 0.00 0.00 178.44 176.28 2aw4 h ASN 72 N 0.02 -1.51 -0.05 -0.43 -1.24 -1.25 -0.61 115.58 110.52 2aw4 h ASN 72 Ca -0.00 0.14 0.01 0.00 0.71 0.00 0.00 56.30 57.16 2aw4 h ASN 72 Cb 0.86 0.53 -0.00 0.00 0.73 0.00 0.00 38.32 40.44 2aw4 h ASN 72 CO 0.06 -0.62 0.31 0.77 -1.29 0.00 0.00 177.43 176.66 2aw4 h SER 73 N -0.90 0.00 0.39 1.15 4.64 -1.56 -2.23 113.55 115.05 2aw4 h SER 73 Ca -0.04 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 2aw4 h SER 73 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2aw4 h SER 73 CO -0.17 0.00 -0.19 0.24 -0.87 0.00 0.00 176.83 175.84 2aw4 h MET 74 N 0.00 -0.51 -0.52 4.77 2.86 -1.10 0.17 114.93 120.61 2aw4 h MET 74 Ca 0.02 0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.76 2aw4 h MET 74 Cb 0.64 0.12 -0.05 0.00 0.06 0.00 0.00 31.60 32.36 2aw4 h MET 74 CO -0.00 -0.34 0.22 -0.39 1.06 0.00 0.00 176.91 177.46 2aw4 h VAL 75 N -0.98 0.87 -0.97 -2.22 -1.51 -1.31 0.28 116.25 110.41 2aw4 h VAL 75 Ca -0.05 -0.15 0.10 0.00 -1.23 0.00 0.00 66.70 65.37 2aw4 h VAL 75 Cb 0.40 0.41 -0.07 0.00 -2.13 0.00 0.00 31.29 29.90 2aw4 h VAL 75 CO 0.09 0.08 0.62 0.40 -1.23 0.00 0.00 177.57 177.52 2aw4 h ILE 76 N 0.42 0.97 0.23 7.19 2.04 -1.48 -1.77 117.51 125.12 2aw4 h ILE 76 Ca 0.24 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 2aw4 h ILE 76 Cb 0.23 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.20 2aw4 h ILE 76 CO -0.22 0.18 -0.11 1.23 0.00 0.00 0.00 178.15 179.23 2aw4 h GLY 77 N 1.00 -0.33 2.00 5.37 0.00 0.26 0.29 103.07 111.66 2aw4 h GLY 77 Ca 0.45 0.12 -0.05 0.00 0.00 0.00 0.00 47.33 47.85 2aw4 h GLY 77 CO -0.21 -0.12 -0.25 -0.39 0.00 0.00 0.00 176.54 175.57 2aw4 h VAL 78 N -0.59 0.70 0.00 4.60 -1.51 -0.86 -3.09 116.25 115.50 2aw4 h VAL 78 Ca -0.03 -1.09 0.00 0.00 -1.23 0.00 0.00 66.70 64.34 2aw4 h VAL 78 Cb 0.43 1.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.29 2aw4 h VAL 78 CO 0.05 0.25 -0.57 0.35 -1.23 0.00 0.00 177.57 176.42 2aw4 n THR 79 N -3.54 0.98 -0.22 7.19 -2.24 -0.68 0.53 114.28 116.30 2aw4 n THR 79 Ca -0.01 0.28 -0.07 0.00 -2.27 0.00 0.00 64.05 61.98 2aw4 n THR 79 Cb 0.40 -2.07 0.03 0.00 -2.10 0.00 0.00 70.33 66.59 2aw4 n THR 79 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2aw4 h GLU 80 N -0.67 0.92 0.00 -0.78 4.39 -1.10 -3.47 114.58 113.87 2aw4 h GLU 80 Ca 0.00 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.54 2aw4 h GLU 80 Cb 0.57 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2aw4 h GLU 80 CO 0.00 0.77 0.00 0.41 -1.16 0.00 0.00 179.01 179.03 2aw4 n GLY 81 N -0.85 -0.30 3.41 -3.84 0.00 -1.17 -5.03 105.19 97.41 2aw4 n GLY 81 Ca 0.04 -1.40 -0.33 0.00 0.00 0.00 0.00 46.02 44.33 2aw4 n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2aw4 s PHE 82 N -1.68 2.80 0.23 1.61 0.08 0.15 -4.94 117.98 116.22 2aw4 s PHE 82 Ca 0.00 -0.48 0.04 0.00 0.12 0.00 0.00 56.93 56.62 2aw4 s PHE 82 Cb 0.00 -1.79 -0.05 0.00 -0.57 0.00 0.00 43.02 40.61 2aw4 s PHE 82 CO 0.00 -0.08 -0.03 0.95 -0.10 0.00 0.00 175.22 175.96 2aw4 s THR 83 N 0.03 1.16 -0.30 0.64 -4.23 -1.26 -1.50 115.64 110.19 2aw4 s THR 83 Ca -0.04 -2.06 -0.14 0.00 -1.18 0.00 0.00 61.69 58.28 2aw4 s THR 83 Cb -0.14 -2.30 0.18 0.00 1.34 0.00 0.00 72.50 71.58 2aw4 s THR 83 CO 0.04 -0.38 1.10 -0.75 -0.54 0.00 0.00 174.62 174.09 2aw4 s LYS 84 N -3.82 0.13 0.80 3.99 2.47 -1.24 -4.89 119.74 117.17 2aw4 s LYS 84 Ca 0.27 0.19 -0.12 0.00 -1.56 0.00 0.00 55.97 54.75 2aw4 s LYS 84 Cb 0.05 0.10 0.07 0.00 -1.46 0.00 0.00 37.83 36.59 2aw4 s LYS 84 CO 0.08 -0.17 1.16 0.15 0.16 0.00 0.00 175.35 176.73 2aw4 s LYS 85 N 2.97 2.08 -0.16 4.03 1.02 -1.25 -2.09 119.74 126.33 2aw4 s LYS 85 Ca 0.08 0.20 -0.05 0.00 0.02 0.00 0.00 55.97 56.21 2aw4 s LYS 85 Cb -0.07 -1.96 0.08 0.00 -0.52 0.00 0.00 37.83 35.36 2aw4 s LYS 85 CO -0.14 -1.53 0.31 -0.51 -0.92 0.00 0.00 175.35 172.56 2aw4 s LEU 86 N -5.57 -0.41 -0.16 3.17 2.01 0.13 -2.86 118.68 114.99 2aw4 s LEU 86 Ca 0.61 0.66 -0.13 0.00 0.01 0.00 0.00 54.13 55.29 2aw4 s LEU 86 Cb -0.11 0.90 -0.05 0.00 0.01 0.00 0.00 46.19 46.94 2aw4 s LEU 86 CO 0.50 -0.24 0.27 -1.10 1.01 0.00 0.00 176.35 176.78 2aw4 s GLN 87 N 2.48 4.18 -0.53 1.70 -0.21 0.67 -1.79 119.66 126.17 2aw4 s GLN 87 Ca 0.01 0.06 -0.22 0.00 0.02 0.00 0.00 55.36 55.23 2aw4 s GLN 87 Cb -0.12 -3.40 0.05 0.00 1.00 0.00 0.00 33.01 30.53 2aw4 s GLN 87 CO -0.10 0.30 0.80 -0.51 -2.12 0.00 0.00 175.29 173.66 2aw4 s LEU 88 N 0.29 4.47 -0.24 2.90 1.43 -0.67 -2.46 118.68 124.40 2aw4 s LEU 88 Ca 0.16 -0.58 -0.13 0.00 -1.03 0.00 0.00 54.13 52.54 2aw4 s LEU 88 Cb -0.13 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.38 2aw4 s LEU 88 CO 0.04 -1.08 0.28 -0.69 0.23 0.00 0.00 176.35 175.13 2aw4 s VAL 89 N 3.37 5.26 0.00 -1.59 1.01 0.02 -4.93 120.40 123.54 2aw4 s VAL 89 Ca 0.24 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.64 2aw4 s VAL 89 Cb -0.15 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.61 2aw4 s VAL 89 CO 0.16 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.13 2aw4 n GLY 90 N 4.39 4.53 0.00 4.51 0.00 -1.26 0.18 105.19 117.53 2aw4 n GLY 90 Ca -0.11 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.63 2aw4 n GLY 90 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2aw4 n VAL 91 N -1.82 0.00 0.00 1.61 0.31 -1.26 -3.29 118.33 113.88 2aw4 n VAL 91 Ca 0.00 0.32 0.00 0.00 -0.01 0.00 0.00 64.34 64.65 2aw4 n VAL 91 Cb 0.00 -1.06 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 2aw4 n VAL 91 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2aw4 n GLY 92 N 0.00 -0.17 3.73 2.92 0.00 -1.26 -4.71 105.19 105.70 2aw4 n GLY 92 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2aw4 n GLY 92 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2aw4 s TYR 93 N -2.17 3.27 -0.30 1.61 2.02 -1.21 -4.77 117.35 115.81 2aw4 s TYR 93 Ca 0.00 1.13 -0.14 0.00 -0.37 0.00 0.00 57.07 57.69 2aw4 s TYR 93 Cb 0.00 -3.61 0.16 0.00 -0.40 0.00 0.00 41.96 38.11 2aw4 s TYR 93 CO 0.00 -2.00 0.94 -0.98 -1.57 0.00 0.00 175.55 171.94 2aw4 s ARG 94 N 0.45 0.34 0.09 -0.62 1.70 -1.25 -4.87 118.95 114.78 2aw4 s ARG 94 Ca 0.60 0.83 -0.12 0.00 -0.47 0.00 0.00 55.73 56.57 2aw4 s ARG 94 Cb -0.36 0.49 -0.06 0.00 -0.57 0.00 0.00 34.95 34.45 2aw4 s ARG 94 CO 0.34 -0.11 0.44 0.00 -1.08 0.00 0.00 175.30 174.89 2aw4 s ALA 95 N 2.46 3.68 -0.21 7.88 0.00 -1.24 -3.56 121.76 130.77 2aw4 s ALA 95 Ca -0.03 -0.29 -0.04 0.00 0.00 0.00 0.00 51.96 51.60 2aw4 s ALA 95 Cb -0.07 -2.36 0.07 0.00 0.00 0.00 0.00 23.12 20.77 2aw4 s ALA 95 CO -0.18 0.52 0.09 0.00 0.00 0.00 0.00 175.76 176.20 2aw4 s ALA 96 N -1.37 0.63 0.24 0.00 0.00 -0.73 -4.44 121.76 116.08 2aw4 s ALA 96 Ca 0.33 -0.62 -0.30 0.00 0.00 0.00 0.00 51.96 51.37 2aw4 s ALA 96 Cb -0.15 -1.17 -0.09 0.00 0.00 0.00 0.00 23.12 21.72 2aw4 s ALA 96 CO 0.18 -1.30 1.18 0.08 0.00 0.00 0.00 175.76 175.89 2aw4 s VAL 97 N 2.05 3.41 -0.01 0.00 1.01 -1.26 -1.78 120.40 123.82 2aw4 s VAL 97 Ca 0.03 1.30 0.03 0.00 0.00 0.00 0.00 61.98 63.34 2aw4 s VAL 97 Cb -0.16 -3.83 0.05 0.00 0.00 0.00 0.00 36.38 32.44 2aw4 s VAL 97 CO -0.16 0.26 1.02 0.29 0.00 0.00 0.00 175.10 176.51 2aw4 n LYS 98 N 1.77 0.09 -1.48 2.72 4.01 -1.24 -4.96 118.16 119.07 2aw4 n LYS 98 Ca 0.02 -1.18 0.00 0.00 -0.51 0.00 0.00 58.31 56.64 2aw4 n LYS 98 Cb 0.44 -0.54 0.00 0.00 -0.51 0.00 0.00 35.03 34.42 2aw4 n LYS 98 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2aw4 n GLY 99 N -0.07 -3.99 4.28 0.72 0.00 -1.26 -4.45 105.19 100.43 2aw4 n GLY 99 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2aw4 n GLY 99 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2aw4 n ASN 100 N 0.69 0.00 -3.30 1.61 4.13 -1.26 -4.78 115.26 112.35 2aw4 n ASN 100 Ca 0.00 0.00 -0.24 0.00 1.68 0.00 0.00 54.58 56.02 2aw4 n ASN 100 Cb 0.00 -1.99 -0.08 0.00 -1.54 0.00 0.00 39.78 36.17 2aw4 n ASN 100 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2aw4 s VAL 101 N -1.17 0.15 0.14 2.41 1.01 -1.26 -2.58 120.40 119.10 2aw4 s VAL 101 Ca 0.00 -2.42 -0.30 0.00 0.00 0.00 0.00 61.98 59.26 2aw4 s VAL 101 Cb 0.00 -1.08 -0.07 0.00 0.00 0.00 0.00 36.38 35.23 2aw4 s VAL 101 CO 0.00 -1.07 1.24 -0.51 0.00 0.00 0.00 175.10 174.76 2aw4 s ILE 102 N 0.17 3.62 -0.26 2.22 1.10 -1.23 -3.63 121.20 123.20 2aw4 s ILE 102 Ca 0.33 1.26 -0.07 0.00 -0.51 0.00 0.00 60.65 61.66 2aw4 s ILE 102 Cb 0.03 -3.81 -0.01 0.00 0.15 0.00 0.00 42.46 38.83 2aw4 s ILE 102 CO -0.18 0.15 0.06 0.21 -2.11 0.00 0.00 174.94 173.07 2aw4 s ASN 103 N 0.58 4.99 0.06 4.50 2.47 -0.73 -1.43 114.94 125.38 2aw4 s ASN 103 Ca 0.57 -0.44 0.08 0.00 0.42 0.00 0.00 52.86 53.49 2aw4 s ASN 103 Cb -0.33 -1.88 -0.03 0.00 -1.45 0.00 0.00 41.25 37.56 2aw4 s ASN 103 CO 0.34 -0.10 -0.21 -0.76 -3.72 0.00 0.00 177.10 172.65 2aw4 s LEU 104 N 1.55 2.49 -0.45 3.21 1.02 -0.45 -1.78 118.68 124.27 2aw4 s LEU 104 Ca 0.05 -0.51 0.03 0.00 0.02 0.00 0.00 54.13 53.72 2aw4 s LEU 104 Cb -0.16 -1.44 0.13 0.00 0.02 0.00 0.00 46.19 44.74 2aw4 s LEU 104 CO 0.02 0.24 0.23 -0.94 0.02 0.00 0.00 176.35 175.92 2aw4 s SER 105 N -1.53 3.94 -0.75 2.29 1.04 -1.23 -0.04 113.70 117.42 2aw4 s SER 105 Ca 0.14 -2.66 0.01 0.00 0.48 0.00 0.00 55.95 53.92 2aw4 s SER 105 Cb -0.10 -1.25 0.36 0.00 0.10 0.00 0.00 66.02 65.13 2aw4 s SER 105 CO 0.05 -0.27 1.61 0.18 0.98 0.00 0.00 173.24 175.79 2aw4 n LEU 106 N 3.53 6.38 0.00 2.42 4.32 -1.26 -3.77 117.00 128.62 2aw4 n LEU 106 Ca 0.06 -5.17 0.00 0.00 -0.02 0.00 0.00 56.01 50.88 2aw4 n LEU 106 Cb 0.35 -0.87 0.00 0.00 -1.62 0.00 0.00 43.42 41.27 2aw4 n LEU 106 CO 0.26 2.03 0.00 0.61 -1.22 0.00 0.00 177.39 179.07 2aw4 n GLY 107 N -0.38 1.00 3.70 -0.72 0.00 -1.26 -4.93 105.19 102.61 2aw4 n GLY 107 Ca 0.46 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.05 2aw4 n GLY 107 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2aw4 n PHE 108 N 0.00 2.31 -1.75 1.61 3.72 -1.26 -4.85 117.46 117.24 2aw4 n PHE 108 Ca 0.00 0.54 -0.42 0.00 -0.05 0.00 0.00 57.45 57.52 2aw4 n PHE 108 Cb 0.00 -2.42 -0.00 0.00 -0.94 0.00 0.00 39.48 36.12 2aw4 n PHE 108 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2aw4 n SER 109 N 0.67 3.50 -0.67 4.37 7.64 -1.26 -4.56 113.62 123.31 2aw4 n SER 109 Ca 0.05 1.22 0.00 0.00 1.01 0.00 0.00 58.87 61.15 2aw4 n SER 109 Cb 0.37 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 61.99 2aw4 n SER 109 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2aw4 n HIS 110 N 0.42 -1.84 -1.76 1.43 -0.00 -1.26 -4.98 115.22 107.23 2aw4 n HIS 110 Ca 0.02 0.99 -0.29 0.00 -0.00 0.00 0.00 57.72 58.44 2aw4 n HIS 110 Cb 0.38 -1.95 0.12 0.00 -0.00 0.00 0.00 29.99 28.55 2aw4 n HIS 110 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.34 174.20 2aw4 s PRO 111 N -4.83 1.39 -0.03 1.57 0.02 -1.26 -4.78 135.00 127.08 2aw4 s PRO 111 Ca 0.00 0.09 -0.01 0.00 0.02 0.00 0.00 61.00 61.09 2aw4 s PRO 111 Cb 0.00 -1.89 0.03 0.00 0.02 0.00 0.00 34.50 32.66 2aw4 s PRO 111 CO 0.00 -1.99 0.05 0.14 -0.33 0.00 0.00 177.00 174.87 2aw4 s VAL 112 N -3.51 -0.08 -0.18 3.83 -7.23 0.94 -4.97 120.40 109.21 2aw4 s VAL 112 Ca 0.65 0.35 -0.11 0.00 -1.81 0.00 0.00 61.98 61.06 2aw4 s VAL 112 Cb -0.11 -0.14 -0.05 0.00 0.56 0.00 0.00 36.38 36.65 2aw4 s VAL 112 CO 0.51 0.15 0.20 -1.81 -0.31 0.00 0.00 175.10 173.84 2aw4 s ASP 113 N 1.80 6.32 -0.56 4.85 1.11 -1.26 -1.34 116.67 127.59 2aw4 s ASP 113 Ca 0.00 0.36 -0.08 0.00 0.18 0.00 0.00 52.55 53.02 2aw4 s ASP 113 Cb -0.12 -2.12 0.15 0.00 1.07 0.00 0.00 42.92 41.89 2aw4 s ASP 113 CO -0.03 0.17 0.42 -2.28 1.18 0.00 0.00 175.17 174.63 2aw4 s HIS 114 N 0.26 3.49 0.17 4.23 2.46 -0.51 -4.93 115.29 120.46 2aw4 s HIS 114 Ca 0.12 -2.17 -0.33 0.00 0.47 0.00 0.00 55.06 53.14 2aw4 s HIS 114 Cb -0.12 -3.44 -0.13 0.00 -0.13 0.00 0.00 32.58 28.75 2aw4 s HIS 114 CO 0.01 -0.95 1.61 0.94 -2.47 0.00 0.00 174.74 173.88 2aw4 n GLN 115 N 4.35 2.29 -3.30 2.88 7.27 -1.26 -3.49 117.38 126.11 2aw4 n GLN 115 Ca 0.00 0.82 -0.40 0.00 0.07 0.00 0.00 57.00 57.50 2aw4 n GLN 115 Cb 0.41 -2.61 -0.08 0.00 2.41 0.00 0.00 30.24 30.37 2aw4 n GLN 115 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 2aw4 s LEU 116 N 0.96 4.05 0.02 1.69 0.20 -1.06 -4.99 118.68 119.55 2aw4 s LEU 116 Ca 0.78 0.43 -0.34 0.00 0.69 0.00 0.00 54.13 55.69 2aw4 s LEU 116 Cb -0.64 -2.57 -0.13 0.00 -0.43 0.00 0.00 46.19 42.42 2aw4 s LEU 116 CO 0.37 -0.24 1.75 -2.65 -0.29 0.00 0.00 176.35 175.29 2aw4 n PRO 117 N 5.42 2.17 -1.69 0.98 -0.02 -1.26 -4.78 135.00 135.82 2aw4 n PRO 117 Ca -0.06 0.79 -0.64 0.00 -2.02 0.00 0.00 63.50 61.57 2aw4 n PRO 117 Cb 0.50 -2.60 -0.09 0.00 -0.02 0.00 0.00 33.50 31.29 2aw4 n PRO 117 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2aw4 n ALA 118 N 5.26 -1.68 0.00 3.55 0.00 -1.26 -3.62 120.51 122.76 2aw4 n ALA 118 Ca 0.20 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.15 2aw4 n ALA 118 Cb 0.29 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.81 2aw4 n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aw4 n GLY 119 N 3.45 0.55 3.02 0.00 0.00 -1.26 -5.13 105.19 105.82 2aw4 n GLY 119 Ca 0.28 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.17 2aw4 n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2aw4 s ILE 120 N 0.00 -0.03 0.32 -0.61 1.09 -1.24 -4.30 121.20 116.44 2aw4 s ILE 120 Ca 0.00 0.11 0.07 0.00 -1.10 0.00 0.00 60.65 59.73 2aw4 s ILE 120 Cb 0.00 -0.30 -0.02 0.00 -1.06 0.00 0.00 42.46 41.08 2aw4 s ILE 120 CO 0.00 0.05 0.41 0.42 -0.10 0.00 0.00 174.94 175.71 2aw4 s THR 121 N 0.87 4.05 0.06 2.92 -4.23 0.21 -4.84 115.64 114.68 2aw4 s THR 121 Ca -0.06 -1.10 -0.14 0.00 -1.18 0.00 0.00 61.69 59.21 2aw4 s THR 121 Cb -0.08 -3.39 0.02 0.00 1.34 0.00 0.00 72.50 70.39 2aw4 s THR 121 CO -0.05 -0.18 0.31 0.00 -0.54 0.00 0.00 174.62 174.16 2aw4 s ALA 122 N -2.19 -0.68 -0.36 3.99 0.00 -1.25 0.10 121.76 121.37 2aw4 s ALA 122 Ca 0.43 -0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.33 2aw4 s ALA 122 Cb -0.08 0.40 0.18 0.00 0.00 0.00 0.00 23.12 23.62 2aw4 s ALA 122 CO 0.30 -0.46 0.79 -1.21 0.00 0.00 0.00 175.76 175.17 2aw4 s GLU 123 N -2.92 0.54 -0.24 0.00 2.02 -1.20 -4.87 118.70 112.03 2aw4 s GLU 123 Ca -0.02 -0.09 -0.28 0.00 0.02 0.00 0.00 54.97 54.59 2aw4 s GLU 123 Cb 0.00 0.08 -0.05 0.00 0.10 0.00 0.00 34.13 34.27 2aw4 s GLU 123 CO -0.06 -0.80 2.20 0.00 0.02 0.00 0.00 175.26 176.63 2aw4 h PRO 125 N 15.14 0.55 -6.07 0.00 0.13 -1.97 -3.43 132.00 136.35 2aw4 h PRO 125 Ca -0.40 -0.03 -0.54 0.00 -0.87 0.00 0.00 66.00 64.15 2aw4 h PRO 125 Cb 1.24 -0.12 -0.07 0.00 0.13 0.00 0.00 31.00 32.17 2aw4 h PRO 125 CO 0.97 0.36 -0.52 -0.08 -0.23 0.00 0.00 178.00 178.50 2aw4 s THR 126 N -6.11 2.88 -0.94 1.56 -1.32 -1.26 -4.97 115.64 105.47 2aw4 s THR 126 Ca -0.13 -1.68 0.00 0.00 -1.21 0.00 0.00 61.69 58.67 2aw4 s THR 126 Cb 0.15 -2.98 0.00 0.00 -1.51 0.00 0.00 72.50 68.16 2aw4 s THR 126 CO 0.75 -0.14 0.19 0.00 -2.21 0.00 0.00 174.62 173.20 2aw4 n GLN 127 N -1.19 0.36 0.00 7.08 10.64 -1.26 -2.63 117.38 130.38 2aw4 n GLN 127 Ca -0.02 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.15 2aw4 n GLN 127 Cb 0.62 -1.19 0.00 0.00 -0.86 0.00 0.00 30.24 28.81 2aw4 n GLN 127 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 2aw4 n THR 128 N 0.35 0.01 -3.86 -0.39 -2.24 -1.26 -3.70 114.28 103.18 2aw4 n THR 128 Ca 0.00 -0.16 -0.05 0.00 -2.27 0.00 0.00 64.05 61.57 2aw4 n THR 128 Cb 0.09 1.67 -0.01 0.00 -2.10 0.00 0.00 70.33 69.99 2aw4 n THR 128 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2aw4 n GLU 129 N -0.00 1.59 -3.31 -0.78 1.02 -1.08 -1.67 120.64 116.40 2aw4 n GLU 129 Ca 0.00 -0.60 0.03 0.00 -0.02 0.00 0.00 57.16 56.56 2aw4 n GLU 129 Cb 0.18 0.12 -0.02 0.00 -0.02 0.00 0.00 31.44 31.70 2aw4 n GLU 129 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2aw4 s ILE 130 N -0.90 -0.89 -0.12 -3.67 1.09 -0.74 -4.43 121.20 111.54 2aw4 s ILE 130 Ca 0.02 0.00 0.03 0.00 -1.10 0.00 0.00 60.65 59.60 2aw4 s ILE 130 Cb -0.00 -1.00 -0.00 0.00 -1.06 0.00 0.00 42.46 40.40 2aw4 s ILE 130 CO 0.02 0.00 -0.21 0.54 -0.10 0.00 0.00 174.94 175.19 2aw4 s VAL 131 N 2.85 2.31 0.25 2.92 0.11 -1.26 0.18 120.40 127.76 2aw4 s VAL 131 Ca 0.09 -0.92 -0.15 0.00 -2.93 0.00 0.00 61.98 58.07 2aw4 s VAL 131 Cb -0.13 -1.92 -0.08 0.00 -1.53 0.00 0.00 36.38 32.72 2aw4 s VAL 131 CO -0.19 0.55 0.67 -0.76 -3.33 0.00 0.00 175.10 172.04 2aw4 s LEU 132 N 0.49 4.19 -0.32 2.54 1.43 -0.89 -3.24 118.68 122.89 2aw4 s LEU 132 Ca -0.14 1.23 -0.01 0.00 -1.03 0.00 0.00 54.13 54.18 2aw4 s LEU 132 Cb -0.17 -3.77 0.12 0.00 0.03 0.00 0.00 46.19 42.41 2aw4 s LEU 132 CO 0.05 -0.08 0.20 -0.54 0.23 0.00 0.00 176.35 176.22 2aw4 s LYS 133 N -2.54 0.38 0.00 1.70 3.01 0.28 -3.65 119.74 118.93 2aw4 s LYS 133 Ca 0.48 -0.83 0.00 0.00 -1.01 0.00 0.00 55.97 54.60 2aw4 s LYS 133 Cb -0.13 -1.12 0.00 0.00 -1.01 0.00 0.00 37.83 35.57 2aw4 s LYS 133 CO 0.19 -1.11 0.00 0.41 0.51 0.00 0.00 175.35 175.35 2aw4 n GLY 134 N 4.69 3.84 0.00 -3.33 0.00 -0.56 0.64 105.19 110.47 2aw4 n GLY 134 Ca 0.03 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2aw4 n GLY 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aw4 n ALA 135 N -3.00 1.49 -2.99 4.61 0.00 -1.26 0.30 120.51 119.65 2aw4 n ALA 135 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 2aw4 n ALA 135 Cb 0.00 0.04 -0.08 0.00 0.00 0.00 0.00 19.45 19.42 2aw4 n ALA 135 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2aw4 s ASP 136 N -1.67 6.09 0.51 0.00 -1.08 -1.26 -4.29 116.67 114.97 2aw4 s ASP 136 Ca 0.00 -1.42 0.20 0.00 -0.52 0.00 0.00 52.55 50.81 2aw4 s ASP 136 Cb 0.00 -2.16 1.33 0.00 -1.46 0.00 0.00 42.92 40.63 2aw4 s ASP 136 CO 0.00 -0.66 2.12 0.07 0.52 0.00 0.00 175.17 177.22 2aw4 h LYS 137 N 8.73 0.00 0.00 4.34 2.10 -1.93 0.17 116.57 129.98 2aw4 h LYS 137 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 2aw4 h LYS 137 Cb 1.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.44 2aw4 h LYS 137 CO 0.89 0.07 0.00 0.94 -2.00 0.00 0.00 179.45 179.34 2aw4 n GLN 138 N -4.24 0.00 -0.07 0.07 -0.06 -1.26 -0.86 117.38 110.97 2aw4 n GLN 138 Ca -0.03 0.60 -0.07 0.00 -2.00 0.00 0.00 57.00 55.50 2aw4 n GLN 138 Cb 0.15 -1.44 -0.01 0.00 -4.06 0.00 0.00 30.24 24.88 2aw4 n GLN 138 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 2aw4 h VAL 139 N 0.00 0.69 -0.45 1.69 2.07 -1.92 -1.07 116.25 117.26 2aw4 h VAL 139 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 2aw4 h VAL 139 Cb 0.00 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2aw4 h VAL 139 CO 0.00 0.00 0.30 0.16 0.02 0.00 0.00 177.57 178.05 2aw4 h ILE 140 N -0.03 0.95 -0.02 4.57 -0.00 -0.67 -2.67 117.51 119.64 2aw4 h ILE 140 Ca 0.13 -0.12 0.01 0.00 -0.00 0.00 0.00 64.86 64.89 2aw4 h ILE 140 Cb 0.23 0.58 -0.03 0.00 -0.00 0.00 0.00 36.82 37.60 2aw4 h ILE 140 CO -0.29 0.06 -0.26 1.23 -0.00 0.00 0.00 178.15 178.88 2aw4 h GLY 141 N 0.34 -1.29 -0.17 0.16 0.00 0.37 0.60 103.07 103.08 2aw4 h GLY 141 Ca 0.20 0.65 0.09 0.00 0.00 0.00 0.00 47.33 48.27 2aw4 h GLY 141 CO -0.05 -0.39 -0.28 1.46 0.00 0.00 0.00 176.54 177.29 2aw4 h GLN 142 N -0.31 -0.18 -0.95 4.80 1.08 -1.46 0.26 115.11 118.35 2aw4 h GLN 142 Ca 0.01 0.01 0.15 0.00 -1.45 0.00 0.00 58.65 57.37 2aw4 h GLN 142 Cb 0.35 0.04 -0.08 0.00 -0.05 0.00 0.00 27.48 27.74 2aw4 h GLN 142 CO -0.19 -0.12 0.60 0.28 -0.95 0.00 0.00 178.83 178.45 2aw4 h VAL 143 N -0.18 0.83 -0.17 -0.54 2.07 -1.36 0.23 116.25 117.13 2aw4 h VAL 143 Ca 0.20 -0.27 -0.14 0.00 0.82 0.00 0.00 66.70 67.31 2aw4 h VAL 143 Cb 0.51 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 2aw4 h VAL 143 CO -0.56 0.14 -0.51 0.00 0.02 0.00 0.00 177.57 176.67 2aw4 h ALA 144 N 1.59 0.81 0.61 1.67 0.00 0.16 -2.03 119.26 122.07 2aw4 h ALA 144 Ca 0.49 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2aw4 h ALA 144 Cb 0.71 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.41 2aw4 h ALA 144 CO -0.25 0.67 -0.29 0.00 0.00 0.00 0.00 179.25 179.38 2aw4 h ALA 145 N 1.09 -0.82 -0.64 0.00 0.00 0.24 -2.38 119.26 116.75 2aw4 h ALA 145 Ca 0.01 -0.20 0.14 0.00 0.00 0.00 0.00 54.91 54.87 2aw4 h ALA 145 Cb 1.02 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 2aw4 h ALA 145 CO 0.09 -0.79 0.44 -0.44 0.00 0.00 0.00 179.25 178.55 2aw4 h ASP 146 N -1.16 0.24 0.20 0.00 3.32 -0.82 0.76 116.42 118.97 2aw4 h ASP 146 Ca -0.08 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 2aw4 h ASP 146 Cb 0.66 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2aw4 h ASP 146 CO 0.14 0.13 -0.10 -0.07 -1.72 0.00 0.00 179.24 177.62 2aw4 h LEU 147 N 0.26 -0.23 -0.35 1.55 3.38 -1.27 -1.93 115.31 116.72 2aw4 h LEU 147 Ca 0.31 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 2aw4 h LEU 147 Cb 0.86 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2aw4 h LEU 147 CO -0.07 -0.02 -0.15 -0.09 0.09 0.00 0.00 178.44 178.20 2aw4 h ARG 148 N -0.43 0.73 -0.23 1.13 2.43 -0.72 -2.87 114.38 114.43 2aw4 h ARG 148 Ca -0.03 -0.31 0.07 0.00 -0.81 0.00 0.00 59.98 58.90 2aw4 h ARG 148 Cb 0.33 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 2aw4 h ARG 148 CO 0.05 0.91 0.36 0.00 -1.51 0.00 0.00 179.97 179.78 2aw4 h ALA 149 N 0.79 1.77 -0.65 2.80 0.00 0.59 0.43 119.26 124.99 2aw4 h ALA 149 Ca 0.08 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.15 2aw4 h ALA 149 Cb 0.69 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2aw4 h ALA 149 CO 0.05 -0.48 0.46 1.88 0.00 0.00 0.00 179.25 181.16 2aw4 h TYR 150 N 0.00 0.14 0.00 0.00 0.05 -1.11 -3.35 116.97 112.70 2aw4 h TYR 150 Ca 0.11 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.79 2aw4 h TYR 150 Cb 0.83 -0.04 -0.10 0.00 1.01 0.00 0.00 36.73 38.42 2aw4 h TYR 150 CO 0.00 0.05 0.09 -2.13 -1.05 0.00 0.00 178.16 175.12 2aw4 n ARG 151 N -4.39 0.24 -1.37 4.88 0.63 -0.17 -5.06 116.66 111.42 2aw4 n ARG 151 Ca 0.13 -0.80 -0.46 0.00 -0.92 0.00 0.00 57.85 55.79 2aw4 n ARG 151 Cb 0.65 -0.12 -0.02 0.00 0.45 0.00 0.00 32.46 33.41 2aw4 n ARG 151 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 2aw4 n ARG 152 N -0.01 0.06 -1.95 -0.14 1.85 0.13 -2.23 116.66 114.38 2aw4 n ARG 152 Ca -0.15 0.02 -0.42 0.00 -1.00 0.00 0.00 57.85 56.31 2aw4 n ARG 152 Cb 0.71 -1.05 -0.03 0.00 -1.05 0.00 0.00 32.46 31.05 2aw4 n ARG 152 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 2aw4 s PRO 153 N -1.04 4.22 0.06 2.89 0.02 -1.26 -4.67 135.00 135.23 2aw4 s PRO 153 Ca 0.62 2.36 -0.18 0.00 0.02 0.00 0.00 61.00 63.82 2aw4 s PRO 153 Cb -0.81 -3.13 -0.06 0.00 0.02 0.00 0.00 34.50 30.51 2aw4 s PRO 153 CO 0.58 -0.56 0.53 -1.83 -0.33 0.00 0.00 177.00 175.40 2aw4 s GLU 154 N 0.61 4.13 0.00 5.54 4.04 -1.26 -4.84 118.70 126.91 2aw4 s GLU 154 Ca 0.67 0.65 0.00 0.00 0.04 0.00 0.00 54.97 56.33 2aw4 s GLU 154 Cb -0.43 -3.22 0.00 0.00 0.02 0.00 0.00 34.13 30.50 2aw4 s GLU 154 CO 0.36 0.64 0.45 -0.35 -1.84 0.00 0.00 175.26 174.52 2aw4 n PRO 155 N 1.69 0.00 0.01 -4.83 -0.04 -1.26 -1.67 135.00 128.89 2aw4 n PRO 155 Ca -0.11 0.10 0.03 0.00 -0.04 0.00 0.00 63.50 63.48 2aw4 n PRO 155 Cb 0.51 -1.68 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 2aw4 n PRO 155 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2aw4 n TYR 156 N -0.95 0.54 0.00 0.54 4.01 -1.25 -3.52 117.16 116.53 2aw4 n TYR 156 Ca 0.00 0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 2aw4 n TYR 156 Cb 0.18 -0.90 0.00 0.00 -0.31 0.00 0.00 39.34 38.31 2aw4 n TYR 156 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2aw4 n LYS 157 N -2.66 0.00 0.00 -0.72 4.76 -0.86 -4.69 118.16 113.99 2aw4 n LYS 157 Ca -0.11 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 2aw4 n LYS 157 Cb 0.78 -0.33 0.00 0.00 -1.84 0.00 0.00 35.03 33.64 2aw4 n LYS 157 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2aw4 n GLY 158 N 1.95 1.23 3.55 0.72 0.00 -0.67 -4.83 105.19 107.13 2aw4 n GLY 158 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2aw4 n GLY 158 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2aw4 n LYS 159 N -1.88 0.59 -2.87 1.61 2.85 -1.26 -4.53 118.16 112.67 2aw4 n LYS 159 Ca 0.00 -0.47 0.01 0.00 -1.05 0.00 0.00 58.31 56.81 2aw4 n LYS 159 Cb 0.00 -3.18 0.01 0.00 -0.65 0.00 0.00 35.03 31.21 2aw4 n LYS 159 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2aw4 n GLY 160 N 6.42 0.42 3.47 2.58 0.00 0.48 -4.37 105.19 114.18 2aw4 n GLY 160 Ca 0.48 -0.93 -0.44 0.00 0.00 0.00 0.00 46.02 45.13 2aw4 n GLY 160 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2aw4 n VAL 161 N -0.44 4.16 -3.27 1.61 0.31 -0.95 -0.80 118.33 118.96 2aw4 n VAL 161 Ca 0.02 -4.53 -0.33 0.00 -0.01 0.00 0.00 64.34 59.49 2aw4 n VAL 161 Cb 0.27 -2.43 -0.06 0.00 -0.91 0.00 0.00 33.84 30.71 2aw4 n VAL 161 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2aw4 s ARG 162 N 2.29 3.93 0.84 5.55 1.70 -1.03 -4.44 118.95 127.79 2aw4 s ARG 162 Ca 0.46 0.51 -0.10 0.00 -0.47 0.00 0.00 55.73 56.12 2aw4 s ARG 162 Cb -0.00 -2.59 0.10 0.00 -0.57 0.00 0.00 34.95 31.89 2aw4 s ARG 162 CO 0.02 0.26 1.11 0.71 -1.08 0.00 0.00 175.30 176.33 2aw4 s TYR 163 N -1.85 2.17 0.15 5.89 2.02 -1.26 -0.23 117.35 124.23 2aw4 s TYR 163 Ca 0.49 1.64 -0.24 0.00 -0.37 0.00 0.00 57.07 58.59 2aw4 s TYR 163 Cb -0.11 -3.17 0.02 0.00 -0.40 0.00 0.00 41.96 38.29 2aw4 s TYR 163 CO 0.19 -2.26 1.61 0.00 -1.57 0.00 0.00 175.55 173.53 2aw4 h ALA 164 N -1.47 -0.24 -0.13 3.71 0.00 -1.85 -1.48 119.26 117.80 2aw4 h ALA 164 Ca -0.44 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2aw4 h ALA 164 Cb 1.25 0.61 0.00 0.00 0.00 0.00 0.00 17.79 19.65 2aw4 h ALA 164 CO 0.47 -0.74 0.00 -0.25 0.00 0.00 0.00 179.25 178.74 2aw4 n ASP 165 N -5.40 1.37 -4.54 0.00 8.00 -1.26 -4.88 116.55 109.83 2aw4 n ASP 165 Ca -0.01 -1.65 -0.19 0.00 0.71 0.00 0.00 54.79 53.65 2aw4 n ASP 165 Cb 0.32 -0.08 -0.10 0.00 -0.02 0.00 0.00 41.12 41.24 2aw4 n ASP 165 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2aw4 n GLU 166 N 0.12 0.49 -2.14 -1.24 2.13 -0.56 -4.86 120.64 114.59 2aw4 n GLU 166 Ca 0.16 -0.54 -0.41 0.00 0.66 0.00 0.00 57.16 57.03 2aw4 n GLU 166 Cb 0.28 -3.06 -0.03 0.00 0.27 0.00 0.00 31.44 28.90 2aw4 n GLU 166 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2aw4 s VAL 167 N 11.46 3.54 -0.12 6.31 0.11 -1.26 -4.81 120.40 135.64 2aw4 s VAL 167 Ca 1.03 0.45 0.01 0.00 -2.93 0.00 0.00 61.98 60.54 2aw4 s VAL 167 Cb -0.32 -4.01 -0.01 0.00 -1.53 0.00 0.00 36.38 30.51 2aw4 s VAL 167 CO 0.22 -0.83 -0.16 0.54 -3.33 0.00 0.00 175.10 171.53 2aw4 s VAL 168 N 7.45 2.77 -1.31 2.04 0.11 -1.26 -5.02 120.40 125.17 2aw4 s VAL 168 Ca 0.66 -0.77 -0.10 0.00 -2.93 0.00 0.00 61.98 58.84 2aw4 s VAL 168 Cb -0.15 -2.13 0.15 0.00 -1.53 0.00 0.00 36.38 32.72 2aw4 s VAL 168 CO 0.26 0.54 1.94 0.54 -3.33 0.00 0.00 175.10 175.04 2aw4 n ARG 169 N 3.45 3.51 0.00 1.54 5.12 -1.26 -4.67 116.66 124.35 2aw4 n ARG 169 Ca -0.18 -3.38 0.02 0.00 -1.93 0.00 0.00 57.85 52.38 2aw4 n ARG 169 Cb 0.53 -2.98 0.11 0.00 -1.16 0.00 0.00 32.46 28.96 2aw4 n ARG 169 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 2aw4 n THR 170 N 3.58 1.37 -1.84 0.55 -2.24 -1.26 -4.36 114.28 110.08 2aw4 n THR 170 Ca 0.42 0.34 -0.28 0.00 -2.27 0.00 0.00 64.05 62.26 2aw4 n THR 170 Cb 0.37 -1.26 -0.05 0.00 -2.10 0.00 0.00 70.33 67.29 2aw4 n THR 170 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2aw4 s LYS 171 N -2.83 2.25 -0.24 -0.78 2.20 -1.25 -3.95 119.74 115.14 2aw4 s LYS 171 Ca 0.03 0.41 -0.16 0.00 -0.36 0.00 0.00 55.97 55.89 2aw4 s LYS 171 Cb 0.03 -4.75 0.07 0.00 -1.51 0.00 0.00 37.83 31.67 2aw4 s LYS 171 CO 0.08 -3.48 0.60 -1.21 -0.36 0.00 0.00 175.35 170.98 2aw4 s GLU 172 N 7.71 0.63 0.00 4.03 0.41 -1.23 -5.01 118.70 125.24 2aw4 s GLU 172 Ca 0.80 1.00 0.00 0.00 -0.41 0.00 0.00 54.97 56.36 2aw4 s GLU 172 Cb -0.11 0.17 0.00 0.00 -1.78 0.00 0.00 34.13 32.40 2aw4 s GLU 172 CO 0.11 -0.13 0.00 0.00 -0.49 0.00 0.00 175.26 174.75 2aw4 n ALA 173 N 3.81 0.00 -0.87 5.21 0.00 -1.26 -4.63 120.51 122.77 2aw4 n ALA 173 Ca -0.19 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.31 2aw4 n ALA 173 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.01 2aw4 n ALA 173 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2aw4 n LYS 174 N 0.00 -0.87 -4.35 0.00 4.01 -1.26 -5.01 118.16 110.68 2aw4 n LYS 174 Ca 0.00 0.57 -0.19 0.00 -0.51 0.00 0.00 58.31 58.19 2aw4 n LYS 174 Cb 0.00 -1.06 -0.10 0.00 -0.51 0.00 0.00 35.03 33.36 2aw4 n LYS 174 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 2aw4 s LYS 175 N -0.77 1.36 0.00 1.97 2.36 -1.26 -5.30 119.74 118.11 2aw4 s LYS 175 Ca 0.00 -1.64 0.00 0.00 -2.55 0.00 0.00 55.97 51.78 2aw4 s LYS 175 Cb 0.00 -1.01 0.00 0.00 -1.05 0.00 0.00 37.83 35.77 2aw4 s LYS 175 CO 0.00 0.09 0.00 1.17 1.55 0.00 0.00 175.35 178.16