#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ral s ASP 2 N 0.00 7.42 0.00 6.12 2.15 -1.26 -4.35 116.67 126.75 1ral s ASP 2 Ca 0.00 1.96 0.00 0.00 0.43 0.00 0.00 52.55 54.94 1ral s ASP 2 Cb 0.00 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 1ral s ASP 2 CO 0.00 -0.10 0.00 -1.20 -0.17 0.00 0.00 175.17 173.70 1ral n SER 3 N 2.34 0.59 0.00 -0.34 7.64 -1.26 -4.95 113.62 117.64 1ral n SER 3 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1ral n SER 3 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 1ral n SER 3 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1ral n ILE 4 N 0.00 0.00 -2.19 0.44 5.41 -1.26 -4.91 119.36 116.85 1ral n ILE 4 Ca 0.00 0.00 -0.30 0.00 1.00 0.00 0.00 62.75 63.45 1ral n ILE 4 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1ral n ILE 4 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 1ral s SER 5 N -0.40 6.25 0.21 4.38 0.01 -1.26 -4.98 113.70 117.92 1ral s SER 5 Ca 0.00 1.23 -0.14 0.00 1.31 0.00 0.00 55.95 58.35 1ral s SER 5 Cb 0.00 -2.38 0.24 0.00 0.21 0.00 0.00 66.02 64.09 1ral s SER 5 CO 0.00 -0.74 1.62 0.25 0.41 0.00 0.00 173.24 174.77 1ral h LEU 6 N -0.07 -0.66 -9.11 2.44 6.46 -1.98 -3.41 115.31 108.98 1ral h LEU 6 Ca -0.45 0.20 -0.51 0.00 -0.12 0.00 0.00 57.88 57.00 1ral h LEU 6 Cb 1.20 0.42 -0.14 0.00 -0.73 0.00 0.00 40.66 41.41 1ral h LEU 6 CO 0.62 -0.23 -0.70 -0.60 -0.62 0.00 0.00 178.44 176.91 1ral s ARG 7 N -6.21 1.53 -0.05 1.25 6.06 -1.26 -1.21 118.95 119.06 1ral s ARG 7 Ca -0.14 -1.74 -0.13 0.00 -2.50 0.00 0.00 55.73 51.21 1ral s ARG 7 Cb 0.19 -1.29 0.02 0.00 0.06 0.00 0.00 34.95 33.94 1ral s ARG 7 CO 0.73 0.13 0.30 0.54 -2.50 0.00 0.00 175.30 174.51 1ral s VAL 8 N -2.89 0.04 0.36 7.11 0.11 0.64 -4.89 120.40 120.88 1ral s VAL 8 Ca 0.28 -0.33 -0.28 0.00 -2.93 0.00 0.00 61.98 58.72 1ral s VAL 8 Cb 0.01 -0.54 -0.12 0.00 -1.53 0.00 0.00 36.38 34.20 1ral s VAL 8 CO 0.11 -0.18 1.34 0.00 -3.33 0.00 0.00 175.10 173.04 1ral n ALA 9 N 1.85 1.58 -3.51 1.54 0.00 -1.26 -1.38 120.51 119.33 1ral n ALA 9 Ca -0.19 0.35 -0.11 0.00 0.00 0.00 0.00 53.44 53.49 1ral n ALA 9 Cb 0.57 -2.30 -0.10 0.00 0.00 0.00 0.00 19.45 17.61 1ral n ALA 9 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1ral s LEU 10 N -1.36 -0.49 0.00 0.00 0.20 -0.81 -4.83 118.68 111.40 1ral s LEU 10 Ca 0.55 0.42 0.00 0.00 0.69 0.00 0.00 54.13 55.79 1ral s LEU 10 Cb -0.54 0.97 0.00 0.00 -0.43 0.00 0.00 46.19 46.19 1ral s LEU 10 CO 0.62 -0.27 0.00 0.59 -0.29 0.00 0.00 176.35 177.00 1ral n ASN 11 N 5.36 0.00 0.00 3.68 3.02 -1.26 -0.52 115.26 125.54 1ral n ASN 11 Ca -0.06 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.53 1ral n ASN 11 Cb 0.50 0.00 0.18 0.00 -0.61 0.00 0.00 39.78 39.85 1ral n ASN 11 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ral n ASP 12 N 0.00 0.00 -1.06 6.41 8.00 -1.26 -4.77 116.55 123.87 1ral n ASP 12 Ca 0.00 -0.93 -0.12 0.00 0.71 0.00 0.00 54.79 54.45 1ral n ASP 12 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 1ral n ASP 12 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ral n GLY 13 N 0.09 0.88 3.62 0.44 0.00 0.32 -5.01 105.19 105.53 1ral n GLY 13 Ca 0.05 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1ral n GLY 13 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ral s ASN 14 N -2.75 4.69 -0.18 1.61 0.01 -0.79 -4.92 114.94 112.61 1ral s ASN 14 Ca 0.00 -0.24 -0.01 0.00 -0.71 0.00 0.00 52.86 51.90 1ral s ASN 14 Cb 0.00 -1.04 -0.00 0.00 0.41 0.00 0.00 41.25 40.62 1ral s ASN 14 CO 0.00 0.21 -0.13 -0.36 -1.51 0.00 0.00 177.10 175.31 1ral s PHE 15 N -1.19 2.83 0.08 2.20 0.08 -1.26 -1.91 117.98 118.81 1ral s PHE 15 Ca 0.22 -1.10 -0.17 0.00 0.12 0.00 0.00 56.93 56.00 1ral s PHE 15 Cb -0.11 -1.95 -0.06 0.00 -0.57 0.00 0.00 43.02 40.32 1ral s PHE 15 CO 0.14 -0.54 0.52 -1.50 -0.10 0.00 0.00 175.22 173.74 1ral s ILE 16 N 1.06 4.85 0.56 0.64 2.07 -0.48 -4.79 121.20 125.11 1ral s ILE 16 Ca -0.00 1.00 -0.21 0.00 -1.41 0.00 0.00 60.65 60.03 1ral s ILE 16 Cb -0.15 -3.80 -0.04 0.00 0.13 0.00 0.00 42.46 38.60 1ral s ILE 16 CO -0.03 0.47 1.33 -2.84 -1.91 0.00 0.00 174.94 171.96 1ral s PRO 17 N -1.35 3.08 0.24 3.50 0.02 -1.26 -0.26 135.00 138.96 1ral s PRO 17 Ca 0.30 2.16 0.17 0.00 0.02 0.00 0.00 61.00 63.65 1ral s PRO 17 Cb -0.17 -2.19 0.04 0.00 0.02 0.00 0.00 34.50 32.20 1ral s PRO 17 CO 0.18 -1.22 1.28 -0.24 -0.33 0.00 0.00 177.00 176.67 1ral h VAL 18 N 1.31 0.60 -3.32 3.83 3.04 -1.40 -3.44 116.25 116.87 1ral h VAL 18 Ca -0.51 -1.92 -0.57 0.00 -1.01 0.00 0.00 66.70 62.69 1ral h VAL 18 Cb 1.30 2.20 -0.34 0.00 -2.01 0.00 0.00 31.29 32.45 1ral h VAL 18 CO 0.57 0.34 -0.83 -0.22 -1.01 0.00 0.00 177.57 176.42 1ral s LEU 19 N -6.18 1.71 0.40 3.16 2.96 -1.26 -3.81 118.68 115.66 1ral s LEU 19 Ca 0.02 -0.39 0.04 0.00 -0.22 0.00 0.00 54.13 53.58 1ral s LEU 19 Cb 0.08 -1.02 -0.05 0.00 0.50 0.00 0.00 46.19 45.69 1ral s LEU 19 CO 0.76 0.03 0.04 -0.83 -1.32 0.00 0.00 176.35 175.03 1ral s GLY 20 N 0.85 2.48 0.12 7.98 0.00 0.21 -4.70 107.32 114.27 1ral s GLY 20 Ca -0.10 -1.69 0.10 0.00 0.00 0.00 0.00 44.72 43.03 1ral s GLY 20 CO 0.01 -1.98 -0.25 -0.12 0.00 0.00 0.00 173.10 170.75 1ral s PHE 21 N -3.02 2.18 0.34 1.90 2.19 -1.14 0.07 117.98 120.49 1ral s PHE 21 Ca 0.28 -0.39 0.09 0.00 0.33 0.00 0.00 56.93 57.24 1ral s PHE 21 Cb 0.07 -1.18 -0.06 0.00 -1.31 0.00 0.00 43.02 40.53 1ral s PHE 21 CO 0.14 0.31 -0.07 0.20 1.83 0.00 0.00 175.22 177.62 1ral s GLY 22 N -2.04 2.16 -0.04 13.12 0.00 0.79 -1.28 107.32 120.03 1ral s GLY 22 Ca 0.12 -2.08 0.00 0.00 0.00 0.00 0.00 44.72 42.77 1ral s GLY 22 CO 0.06 -2.00 -0.01 -0.51 0.00 0.00 0.00 173.10 170.64 1ral s THR 23 N -2.71 0.26 0.00 0.90 -4.23 -1.14 -4.58 115.64 104.15 1ral s THR 23 Ca 0.32 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.90 1ral s THR 23 Cb 0.04 -0.36 0.00 0.00 1.34 0.00 0.00 72.50 73.51 1ral s THR 23 CO 0.16 0.18 0.00 0.41 -0.54 0.00 0.00 174.62 174.83 1ral n THR 24 N 4.31 0.00 -1.43 3.99 -1.04 -1.26 -4.89 114.28 113.96 1ral n THR 24 Ca -0.22 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.35 1ral n THR 24 Cb 0.50 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.00 1ral n THR 24 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1ral n VAL 25 N 0.00 1.67 -2.90 12.58 3.14 -1.26 -4.97 118.33 126.58 1ral n VAL 25 Ca 0.00 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.88 1ral n VAL 25 Cb 0.00 -0.35 0.00 0.00 -1.06 0.00 0.00 33.84 32.43 1ral n VAL 25 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1ral n PRO 26 N 0.88 3.87 -3.66 1.45 -0.04 -1.26 -5.11 135.00 131.13 1ral n PRO 26 Ca 0.13 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.23 1ral n PRO 26 Cb 0.34 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.73 1ral n PRO 26 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1ral s GLU 27 N 1.10 4.03 0.08 0.54 8.01 -1.26 -5.02 118.70 126.17 1ral s GLU 27 Ca 0.00 -0.01 -0.36 0.00 0.01 0.00 0.00 54.97 54.61 1ral s GLU 27 Cb 0.00 -3.35 -0.17 0.00 -4.31 0.00 0.00 34.13 26.30 1ral s GLU 27 CO 0.00 0.42 1.57 -0.22 0.01 0.00 0.00 175.26 177.04 1ral h LYS 28 N 6.10 -0.99 -6.73 1.61 3.64 -2.00 -2.66 116.57 115.54 1ral h LYS 28 Ca -0.45 0.07 -0.53 0.00 -1.27 0.00 0.00 60.65 58.47 1ral h LYS 28 Cb 1.18 0.23 0.07 0.00 -0.41 0.00 0.00 32.23 33.30 1ral h LYS 28 CO 0.70 -0.66 0.95 0.54 -2.27 0.00 0.00 179.45 178.71 1ral s VAL 29 N -5.89 2.05 0.00 2.00 0.11 -1.26 -1.54 120.40 115.87 1ral s VAL 29 Ca -0.18 0.04 0.00 0.00 -2.93 0.00 0.00 61.98 58.91 1ral s VAL 29 Cb 0.04 -3.02 0.00 0.00 -1.53 0.00 0.00 36.38 31.87 1ral s VAL 29 CO 0.61 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 172.38 1ral n ALA 30 N 3.05 0.00 -0.80 1.54 0.00 -1.26 -4.99 120.51 118.05 1ral n ALA 30 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1ral n ALA 30 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1ral n ALA 30 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ral n LYS 31 N 0.00 0.00 -1.87 0.00 3.00 -0.59 -4.49 118.16 114.21 1ral n LYS 31 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 58.31 57.93 1ral n LYS 31 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.01 1ral n LYS 31 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1ral n ASP 32 N -3.20 7.80 -2.75 3.14 2.03 -1.26 -4.53 116.55 117.78 1ral n ASP 32 Ca 0.00 -3.12 -0.35 0.00 0.52 0.00 0.00 54.79 51.84 1ral n ASP 32 Cb 0.00 -1.35 0.03 0.00 -0.72 0.00 0.00 41.12 39.08 1ral n ASP 32 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1ral n GLU 33 N 1.67 3.00 -0.20 -0.67 2.13 -1.26 -4.87 120.64 120.44 1ral n GLU 33 Ca 0.61 -3.87 0.20 0.00 0.66 0.00 0.00 57.16 54.76 1ral n GLU 33 Cb 0.30 -2.26 0.56 0.00 0.27 0.00 0.00 31.44 30.31 1ral n GLU 33 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1ral h VAL 34 N 2.19 0.68 -0.74 6.31 2.07 -1.90 -1.89 116.25 122.97 1ral h VAL 34 Ca 0.47 -0.10 0.28 0.00 0.82 0.00 0.00 66.70 68.17 1ral h VAL 34 Cb 0.36 0.35 -0.14 0.00 -1.52 0.00 0.00 31.29 30.35 1ral h VAL 34 CO 1.23 0.06 0.29 0.00 0.02 0.00 0.00 177.57 179.16 1ral n ILE 35 N -4.45 -0.31 -0.10 4.57 3.06 -1.24 -1.01 119.36 119.88 1ral n ILE 35 Ca 0.17 1.55 -0.13 0.00 -2.50 0.00 0.00 62.75 61.84 1ral n ILE 35 Cb 0.71 -2.44 -0.04 0.00 0.54 0.00 0.00 39.64 38.42 1ral n ILE 35 CO 0.00 0.00 0.00 0.11 -2.50 0.00 0.00 176.55 174.16 1ral h LYS 36 N 0.00 0.80 -0.33 9.51 1.79 -1.69 0.78 116.57 127.43 1ral h LYS 36 Ca 0.58 -0.43 -0.15 0.00 -2.18 0.00 0.00 60.65 58.47 1ral h LYS 36 Cb 1.45 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 32.12 1ral h LYS 36 CO -0.61 1.06 -0.39 0.00 -1.08 0.00 0.00 179.45 178.42 1ral h ALA 37 N 0.73 0.49 0.00 3.86 0.00 -1.24 -0.10 119.26 123.00 1ral h ALA 37 Ca 0.05 -0.45 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 1ral h ALA 37 Cb 0.92 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1ral h ALA 37 CO 0.08 0.60 -0.40 1.79 0.00 0.00 0.00 179.25 181.32 1ral h THR 38 N 0.64 1.25 -0.26 0.00 1.35 -1.02 -2.99 112.91 111.88 1ral h THR 38 Ca 0.04 -1.39 -0.06 0.00 -0.55 0.00 0.00 66.41 64.46 1ral h THR 38 Cb 0.99 1.76 -0.01 0.00 -1.73 0.00 0.00 68.15 69.16 1ral h THR 38 CO 0.09 0.39 -0.06 0.11 -0.25 0.00 0.00 175.52 175.81 1ral h LYS 39 N 0.00 0.51 -0.36 4.72 1.57 -0.30 -2.03 116.57 120.67 1ral h LYS 39 Ca -0.00 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1ral h LYS 39 Cb 0.72 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1ral h LYS 39 CO 0.05 0.72 0.00 0.44 -0.57 0.00 0.00 179.45 180.09 1ral n ILE 40 N -4.54 0.00 -0.03 1.86 -5.35 -0.10 -2.61 119.36 108.60 1ral n ILE 40 Ca -0.04 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.40 1ral n ILE 40 Cb 0.30 -0.26 -0.01 0.00 -1.74 0.00 0.00 39.64 37.93 1ral n ILE 40 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ral n ALA 41 N -0.04 1.62 0.29 -1.28 0.00 -0.80 -4.60 120.51 115.70 1ral n ALA 41 Ca 0.00 -0.41 0.18 0.00 0.00 0.00 0.00 53.44 53.20 1ral n ALA 41 Cb 0.09 0.09 0.75 0.00 0.00 0.00 0.00 19.45 20.38 1ral n ALA 41 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1ral h ILE 42 N -0.47 0.00 0.00 0.00 5.03 -1.42 -1.17 117.51 119.48 1ral h ILE 42 Ca 0.00 -0.44 0.00 0.00 -0.12 0.00 0.00 64.86 64.30 1ral h ILE 42 Cb 0.47 1.42 0.00 0.00 -3.03 0.00 0.00 36.82 35.68 1ral h ILE 42 CO 0.00 0.00 0.00 0.47 -0.68 0.00 0.00 178.15 177.94 1ral n ASP 43 N -3.05 0.00 -0.03 1.72 9.92 -1.07 -2.98 116.55 121.05 1ral n ASP 43 Ca 0.00 -0.80 0.00 0.00 -0.53 0.00 0.00 54.79 53.47 1ral n ASP 43 Cb 0.27 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 1ral n ASP 43 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1ral n ASN 44 N -0.86 0.99 0.00 -2.24 5.15 -0.46 -4.97 115.26 112.87 1ral n ASN 44 Ca 0.11 -0.99 0.00 0.00 -0.60 0.00 0.00 54.58 53.09 1ral n ASN 44 Cb 0.05 0.08 0.00 0.00 -0.53 0.00 0.00 39.78 39.38 1ral n ASN 44 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ral n GLY 45 N 0.12 1.44 3.60 8.20 0.00 -1.16 -5.05 105.19 112.34 1ral n GLY 45 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1ral n GLY 45 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ral s PHE 46 N -1.69 1.16 -0.01 1.61 0.08 -1.12 -4.81 117.98 113.21 1ral s PHE 46 Ca 0.00 0.49 0.04 0.00 0.12 0.00 0.00 56.93 57.58 1ral s PHE 46 Cb 0.00 -3.94 -0.06 0.00 -0.57 0.00 0.00 43.02 38.45 1ral s PHE 46 CO 0.00 -4.16 0.07 0.54 -0.10 0.00 0.00 175.22 171.57 1ral n ARG 47 N 8.70 0.47 -4.01 0.44 1.74 -1.26 -3.19 116.66 119.57 1ral n ARG 47 Ca 0.29 -0.03 -0.35 0.00 -0.77 0.00 0.00 57.85 56.99 1ral n ARG 47 Cb 0.45 -1.09 -0.11 0.00 -1.02 0.00 0.00 32.46 30.69 1ral n ARG 47 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1ral s HIS 48 N -2.24 3.15 0.13 -1.55 2.46 -1.26 -1.48 115.29 114.50 1ral s HIS 48 Ca -0.01 -0.16 0.08 0.00 0.47 0.00 0.00 55.06 55.43 1ral s HIS 48 Cb 0.02 -2.11 -0.04 0.00 -0.13 0.00 0.00 32.58 30.33 1ral s HIS 48 CO 0.15 -0.05 -0.18 -0.06 -2.47 0.00 0.00 174.74 172.13 1ral s PHE 49 N 0.79 1.66 -0.08 3.88 0.08 -0.53 -2.90 117.98 120.87 1ral s PHE 49 Ca 0.03 -0.48 0.00 0.00 0.12 0.00 0.00 56.93 56.60 1ral s PHE 49 Cb -0.14 -0.87 0.02 0.00 -0.57 0.00 0.00 43.02 41.47 1ral s PHE 49 CO 0.02 0.23 -0.07 0.34 -0.10 0.00 0.00 175.22 175.64 1ral s ASP 50 N -2.34 1.75 0.34 1.36 -1.08 -0.40 -0.95 116.67 115.35 1ral s ASP 50 Ca 0.10 -0.23 0.06 0.00 -0.52 0.00 0.00 52.55 51.97 1ral s ASP 50 Cb -0.07 -0.69 -0.03 0.00 -1.46 0.00 0.00 42.92 40.67 1ral s ASP 50 CO 0.05 -0.09 0.25 -0.55 0.52 0.00 0.00 175.17 175.35 1ral s SER 51 N 1.37 1.81 0.17 -0.34 0.15 -0.11 -2.87 113.70 113.88 1ral s SER 51 Ca -0.02 -1.74 -0.12 0.00 0.70 0.00 0.00 55.95 54.77 1ral s SER 51 Cb -0.14 0.55 0.01 0.00 -1.71 0.00 0.00 66.02 64.73 1ral s SER 51 CO -0.03 -1.04 0.37 0.00 1.20 0.00 0.00 173.24 173.73 1ral s ALA 52 N -3.43 -0.35 0.08 5.45 0.00 -1.26 -3.49 121.76 118.75 1ral s ALA 52 Ca 0.38 -0.63 -0.27 0.00 0.00 0.00 0.00 51.96 51.44 1ral s ALA 52 Cb 0.02 0.84 -0.17 0.00 0.00 0.00 0.00 23.12 23.82 1ral s ALA 52 CO 0.25 -0.70 1.68 -0.92 0.00 0.00 0.00 175.76 176.07 1ral h TYR 53 N 2.43 -0.31 0.00 0.00 3.20 -1.96 -3.18 116.97 117.14 1ral h TYR 53 Ca -0.31 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.56 1ral h TYR 53 Cb 1.24 0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.61 1ral h TYR 53 CO 0.38 -0.18 0.00 -0.11 -1.64 0.00 0.00 178.16 176.61 1ral n LEU 54 N -5.23 0.00 -3.18 2.82 7.94 -1.26 -2.84 117.00 115.25 1ral n LEU 54 Ca -0.09 0.82 -0.36 0.00 -1.11 0.00 0.00 56.01 55.26 1ral n LEU 54 Cb 0.16 -0.32 -0.04 0.00 0.53 0.00 0.00 43.42 43.76 1ral n LEU 54 CO 0.35 -0.32 2.79 0.00 -1.11 0.00 0.00 177.39 179.10 1ral n TYR 55 N -1.65 2.18 -1.66 1.96 0.18 -1.25 -4.92 117.16 112.00 1ral n TYR 55 Ca 0.00 -2.77 -0.52 0.00 1.88 0.00 0.00 57.90 56.48 1ral n TYR 55 Cb 0.00 -2.12 -0.06 0.00 -0.38 0.00 0.00 39.34 36.78 1ral n TYR 55 CO 0.00 0.00 0.00 -0.85 -2.08 0.00 0.00 176.86 173.93 1ral n GLU 56 N 2.68 1.52 0.00 -3.48 0.00 -1.13 -4.62 120.64 115.61 1ral n GLU 56 Ca 0.68 0.55 0.00 0.00 0.00 0.00 0.00 57.16 58.40 1ral n GLU 56 Cb 0.32 -2.27 0.00 0.00 0.00 0.00 0.00 31.44 29.49 1ral n GLU 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1ral n VAL 57 N 3.91 0.00 0.00 3.84 0.31 -1.26 -4.99 118.33 120.14 1ral n VAL 57 Ca 0.22 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.55 1ral n VAL 57 Cb 0.21 -0.37 0.00 0.00 -0.91 0.00 0.00 33.84 32.77 1ral n VAL 57 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ral n GLU 58 N -1.75 0.00 -0.33 5.55 1.02 -1.26 0.25 120.64 124.12 1ral n GLU 58 Ca 0.00 0.00 0.18 0.00 -0.02 0.00 0.00 57.16 57.32 1ral n GLU 58 Cb 0.26 0.00 0.36 0.00 -0.02 0.00 0.00 31.44 32.05 1ral n GLU 58 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1ral h GLU 59 N 0.00 0.05 -0.02 3.49 4.81 -1.92 0.59 114.58 121.59 1ral h GLU 59 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ral h GLU 59 Cb 0.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1ral h GLU 59 CO 0.00 0.04 -0.10 -0.85 -0.73 0.00 0.00 179.01 177.36 1ral n GLU 60 N -5.37 1.65 -0.12 1.92 0.28 0.14 -3.64 120.64 115.50 1ral n GLU 60 Ca 0.26 -1.45 -0.16 0.00 -0.16 0.00 0.00 57.16 55.65 1ral n GLU 60 Cb 0.87 -1.37 -0.12 0.00 1.43 0.00 0.00 31.44 32.25 1ral n GLU 60 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1ral n VAL 61 N 0.78 1.45 0.00 3.84 0.31 -0.17 -3.59 118.33 120.95 1ral n VAL 61 Ca 0.10 -0.61 -0.10 0.00 -0.01 0.00 0.00 64.34 63.73 1ral n VAL 61 Cb 0.46 -1.25 -0.03 0.00 -0.91 0.00 0.00 33.84 32.11 1ral n VAL 61 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1ral h GLY 62 N 2.29 -0.27 0.54 2.92 0.00 -0.05 -2.27 103.07 106.23 1ral h GLY 62 Ca -0.57 0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.07 1ral h GLY 62 CO -0.07 -0.20 -0.34 -1.61 0.00 0.00 0.00 176.54 174.32 1ral h GLN 63 N -0.31 -0.63 -0.77 4.80 -0.00 -1.67 0.18 115.11 116.70 1ral h GLN 63 Ca 0.10 0.04 0.06 0.00 -0.00 0.00 0.00 58.65 58.86 1ral h GLN 63 Cb 0.46 0.14 -0.05 0.00 0.00 0.00 0.00 27.48 28.04 1ral h GLN 63 CO -0.31 -0.42 0.50 0.00 0.00 0.00 0.00 178.83 178.61 1ral h ALA 64 N -0.12 1.65 0.06 3.38 0.00 -1.63 0.97 119.26 123.58 1ral h ALA 64 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ral h ALA 64 Cb 0.63 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1ral h ALA 64 CO -0.12 0.23 -0.03 0.82 0.00 0.00 0.00 179.25 180.15 1ral h ILE 65 N 0.83 0.97 0.00 0.00 2.04 -0.68 -1.17 117.51 119.49 1ral h ILE 65 Ca 0.33 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 66.10 1ral h ILE 65 Cb 0.24 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1ral h ILE 65 CO -0.11 0.02 0.00 0.54 0.00 0.00 0.00 178.15 178.60 1ral n ARG 66 N -5.11 0.52 0.00 2.37 5.12 0.51 0.10 116.66 120.18 1ral n ARG 66 Ca -0.08 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.84 1ral n ARG 66 Cb 0.08 -1.24 0.00 0.00 -1.16 0.00 0.00 32.46 30.14 1ral n ARG 66 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1ral n SER 67 N 0.74 2.21 0.18 0.55 3.41 -0.48 -4.78 113.62 115.45 1ral n SER 67 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.74 1ral n SER 67 Cb 0.26 0.20 0.29 0.00 -0.26 0.00 0.00 64.21 64.70 1ral n SER 67 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ral h LYS 68 N 0.00 0.00 -2.25 4.33 6.56 0.06 -1.29 116.57 123.98 1ral h LYS 68 Ca 0.00 0.00 -0.62 0.00 -1.06 0.00 0.00 60.65 58.97 1ral h LYS 68 Cb 0.45 0.00 -0.17 0.00 -0.57 0.00 0.00 32.23 31.95 1ral h LYS 68 CO 0.00 0.00 1.24 -0.89 -2.06 0.00 0.00 179.45 177.74 1ral n ILE 69 N -2.76 4.24 0.18 1.86 5.41 -0.96 -2.37 119.36 124.96 1ral n ILE 69 Ca 0.04 -3.75 0.00 0.00 1.00 0.00 0.00 62.75 60.05 1ral n ILE 69 Cb 0.48 -1.76 0.00 0.00 -0.71 0.00 0.00 39.64 37.65 1ral n ILE 69 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1ral n GLU 70 N 1.07 0.00 -0.27 0.38 0.00 -0.88 -4.91 120.64 116.03 1ral n GLU 70 Ca 0.54 0.00 0.23 0.00 0.00 0.00 0.00 57.16 57.93 1ral n GLU 70 Cb 0.40 0.00 0.56 0.00 0.00 0.00 0.00 31.44 32.40 1ral n GLU 70 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1ral h ASP 71 N 0.00 0.34 -0.17 4.31 5.19 -1.14 -3.44 116.42 121.51 1ral h ASP 71 Ca 0.00 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 1ral h ASP 71 Cb 0.00 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.50 1ral h ASP 71 CO 0.00 0.10 0.00 0.61 -3.12 0.00 0.00 179.24 176.83 1ral n GLY 72 N -1.55 1.04 0.12 2.75 0.00 -1.07 -5.02 105.19 101.46 1ral n GLY 72 Ca 0.22 -0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1ral n GLY 72 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ral n THR 73 N -0.53 1.52 -3.89 2.61 -1.04 -1.00 -5.02 114.28 106.94 1ral n THR 73 Ca 0.00 -0.19 -0.21 0.00 -2.04 0.00 0.00 64.05 61.62 1ral n THR 73 Cb 0.09 -2.05 -0.03 0.00 -1.82 0.00 0.00 70.33 66.52 1ral n THR 73 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1ral s VAL 74 N -2.63 4.41 -0.24 12.58 1.01 -1.09 -5.03 120.40 129.41 1ral s VAL 74 Ca -0.35 -1.20 -0.03 0.00 0.00 0.00 0.00 61.98 60.39 1ral s VAL 74 Cb 0.11 -3.49 0.10 0.00 0.00 0.00 0.00 36.38 33.10 1ral s VAL 74 CO 0.47 -0.27 0.18 -0.54 0.00 0.00 0.00 175.10 174.94 1ral s LYS 75 N -3.98 0.19 0.00 2.72 1.02 -1.26 -4.40 119.74 114.04 1ral s LYS 75 Ca 0.37 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.22 1ral s LYS 75 Cb -0.08 -1.21 0.00 0.00 -0.52 0.00 0.00 37.83 36.02 1ral s LYS 75 CO 0.28 -0.84 0.00 0.54 -0.92 0.00 0.00 175.35 174.40 1ral n ARG 76 N 5.29 0.00 -0.08 1.68 5.12 -1.26 -0.67 116.66 126.74 1ral n ARG 76 Ca -0.05 0.00 0.22 0.00 -1.93 0.00 0.00 57.85 56.09 1ral n ARG 76 Cb 0.47 0.00 0.67 0.00 -1.16 0.00 0.00 32.46 32.44 1ral n ARG 76 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1ral h GLU 77 N 0.00 0.06 0.00 5.56 5.08 -2.04 0.70 114.58 123.94 1ral h GLU 77 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ral h GLU 77 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1ral h GLU 77 CO 0.00 0.04 0.00 -0.25 -1.00 0.00 0.00 179.01 177.80 1ral n ASP 78 N -4.36 0.00 -3.90 1.42 8.00 0.16 -4.82 116.55 113.04 1ral n ASP 78 Ca 0.13 -1.54 -0.19 0.00 0.71 0.00 0.00 54.79 53.90 1ral n ASP 78 Cb 0.71 0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 41.65 1ral n ASP 78 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1ral s ILE 79 N -2.00 0.49 -0.14 0.53 1.10 0.24 -4.82 121.20 116.60 1ral s ILE 79 Ca 0.06 -0.13 0.02 0.00 -0.51 0.00 0.00 60.65 60.09 1ral s ILE 79 Cb 0.03 -0.50 0.01 0.00 0.15 0.00 0.00 42.46 42.15 1ral s ILE 79 CO 0.04 0.20 -0.20 0.12 -2.11 0.00 0.00 174.94 173.00 1ral s PHE 80 N 0.71 2.49 -0.14 3.50 2.19 -0.55 -4.94 117.98 121.24 1ral s PHE 80 Ca -0.09 -1.28 -0.00 0.00 0.33 0.00 0.00 56.93 55.88 1ral s PHE 80 Cb -0.12 -1.72 0.03 0.00 -1.31 0.00 0.00 43.02 39.89 1ral s PHE 80 CO -0.00 -0.61 -0.10 -0.47 1.83 0.00 0.00 175.22 175.87 1ral s TYR 81 N 0.97 1.81 -0.08 10.12 5.04 -1.26 -1.45 117.35 132.50 1ral s TYR 81 Ca -0.04 -1.00 -0.10 0.00 -2.44 0.00 0.00 57.07 53.49 1ral s TYR 81 Cb -0.15 -1.40 -0.05 0.00 0.35 0.00 0.00 41.96 40.72 1ral s TYR 81 CO -0.04 -0.60 0.23 0.99 -1.34 0.00 0.00 175.55 174.79 1ral s THR 82 N 1.60 5.35 0.36 4.34 2.01 -0.13 -2.56 115.64 126.61 1ral s THR 82 Ca 0.04 0.42 0.05 0.00 0.31 0.00 0.00 61.69 62.50 1ral s THR 82 Cb -0.13 -3.51 -0.03 0.00 0.01 0.00 0.00 72.50 68.84 1ral s THR 82 CO -0.09 0.60 0.18 -0.44 -0.69 0.00 0.00 174.62 174.18 1ral s SER 83 N -1.06 2.16 -0.06 3.53 0.01 -1.20 -0.94 113.70 116.14 1ral s SER 83 Ca 0.18 -1.67 -0.08 0.00 1.31 0.00 0.00 55.95 55.69 1ral s SER 83 Cb -0.14 0.50 0.02 0.00 0.21 0.00 0.00 66.02 66.61 1ral s SER 83 CO 0.07 -0.96 0.20 -0.54 0.41 0.00 0.00 173.24 172.42 1ral s LYS 84 N -3.66 0.30 0.10 12.44 3.01 -1.24 -2.63 119.74 128.07 1ral s LYS 84 Ca 0.32 0.15 -0.24 0.00 -1.01 0.00 0.00 55.97 55.19 1ral s LYS 84 Cb 0.03 0.14 -0.07 0.00 -1.01 0.00 0.00 37.83 36.92 1ral s LYS 84 CO 0.19 -0.05 0.74 -1.17 0.51 0.00 0.00 175.35 175.57 1ral s LEU 85 N -0.20 4.53 0.02 3.17 1.98 -0.67 -3.78 118.68 123.72 1ral s LEU 85 Ca -0.03 1.51 -0.06 0.00 -2.89 0.00 0.00 54.13 52.66 1ral s LEU 85 Cb -0.03 -3.21 -0.05 0.00 0.66 0.00 0.00 46.19 43.57 1ral s LEU 85 CO 0.01 0.15 0.26 0.86 -1.89 0.00 0.00 176.35 175.73 1ral s TRP 86 N -0.72 3.56 0.33 5.38 -0.00 -1.26 -3.34 118.94 122.89 1ral s TRP 86 Ca 0.36 0.52 0.21 0.00 -0.00 0.00 0.00 56.10 57.19 1ral s TRP 86 Cb -0.22 -1.96 1.16 0.00 -0.00 0.00 0.00 33.47 32.46 1ral s TRP 86 CO 0.24 0.60 1.30 0.43 -0.00 0.00 0.00 176.95 179.52 1ral n SER 87 N 0.98 0.25 0.10 5.86 7.64 -1.26 -1.68 113.62 125.51 1ral n SER 87 Ca -0.10 1.29 -0.11 0.00 1.01 0.00 0.00 58.87 60.95 1ral n SER 87 Cb 0.53 -0.63 -0.07 0.00 -1.01 0.00 0.00 64.21 63.03 1ral n SER 87 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1ral h THR 88 N 0.00 0.67 0.00 0.44 1.35 -1.83 -1.34 112.91 112.20 1ral h THR 88 Ca 0.71 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1ral h THR 88 Cb 2.04 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 69.54 1ral h THR 88 CO -0.54 0.16 0.00 0.49 -0.25 0.00 0.00 175.52 175.38 1ral n PHE 89 N -5.01 0.00 0.29 4.73 3.01 -0.67 -3.84 117.46 115.96 1ral n PHE 89 Ca -0.08 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.55 1ral n PHE 89 Cb 0.26 0.00 0.87 0.00 -0.01 0.00 0.00 39.48 40.60 1ral n PHE 89 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1ral h HIS 90 N 0.00 0.00 -2.91 1.38 2.76 -1.48 -3.34 115.15 111.57 1ral h HIS 90 Ca 0.00 0.00 -0.53 0.00 -2.20 0.00 0.00 60.37 57.64 1ral h HIS 90 Cb 0.00 0.00 0.02 0.00 1.55 0.00 0.00 27.41 28.98 1ral h HIS 90 CO 0.00 0.05 0.81 0.50 -1.30 0.00 0.00 177.93 177.98 1ral s ARG 91 N -4.05 4.28 0.19 5.26 6.06 -1.25 -4.72 118.95 124.72 1ral s ARG 91 Ca -0.02 2.15 -0.12 0.00 -2.50 0.00 0.00 55.73 55.24 1ral s ARG 91 Cb 0.12 -3.31 0.15 0.00 0.06 0.00 0.00 34.95 31.97 1ral s ARG 91 CO 0.52 -0.53 1.80 -1.00 -2.50 0.00 0.00 175.30 173.60 1ral h PRO 92 N 7.12 0.59 0.00 5.12 0.13 -1.90 -2.18 132.00 140.88 1ral h PRO 92 Ca -0.42 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1ral h PRO 92 Cb 1.20 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1ral h PRO 92 CO 0.89 0.39 0.00 -0.85 -0.23 0.00 0.00 178.00 178.20 1ral n GLU 93 N -4.82 0.10 0.00 0.86 -0.00 -1.26 -2.95 120.64 112.57 1ral n GLU 93 Ca 0.05 0.24 0.00 0.00 -0.00 0.00 0.00 57.16 57.45 1ral n GLU 93 Cb 0.12 -1.50 0.00 0.00 -0.00 0.00 0.00 31.44 30.06 1ral n GLU 93 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.13 178.60 1ral n LEU 94 N -1.36 0.25 -0.21 -1.84 -0.00 -0.82 -4.89 117.00 108.12 1ral n LEU 94 Ca 0.04 -0.60 -0.06 0.00 -0.00 0.00 0.00 56.01 55.39 1ral n LEU 94 Cb 0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.46 1ral n LEU 94 CO 0.08 0.06 0.27 0.52 -0.00 0.00 0.00 177.39 178.32 1ral n VAL 95 N -0.71 -0.34 0.13 1.47 0.31 -1.15 -0.93 118.33 117.10 1ral n VAL 95 Ca 0.00 1.31 0.19 0.00 -0.01 0.00 0.00 64.34 65.83 1ral n VAL 95 Cb 0.00 -1.62 0.72 0.00 -0.91 0.00 0.00 33.84 32.03 1ral n VAL 95 CO 0.00 0.00 0.00 0.08 -1.32 0.00 0.00 176.83 175.59 1ral h ARG 96 N 0.00 0.00 -0.65 5.55 0.11 -1.86 1.00 114.38 118.53 1ral h ARG 96 Ca 0.08 0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.19 1ral h ARG 96 Cb 0.21 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.25 1ral h ARG 96 CO -0.48 0.00 0.40 1.15 0.10 0.00 0.00 179.97 181.14 1ral h THR 97 N 0.00 1.08 -0.65 0.08 2.02 -1.42 0.42 112.91 114.44 1ral h THR 97 Ca 0.17 -0.27 -0.06 0.00 0.77 0.00 0.00 66.41 67.02 1ral h THR 97 Cb 1.15 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 1ral h THR 97 CO -0.00 0.14 0.16 0.00 0.37 0.00 0.00 175.52 176.19 1ral h LEU 99 N 0.97 -0.90 -0.23 0.00 6.46 -1.45 0.52 115.31 120.67 1ral h LEU 99 Ca 0.21 0.02 0.04 0.00 -0.12 0.00 0.00 57.88 58.02 1ral h LEU 99 Cb 0.34 0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 40.47 1ral h LEU 99 CO 0.00 -0.55 0.00 -0.33 -0.62 0.00 0.00 178.44 176.94 1ral h GLU 100 N -1.24 0.07 -0.95 1.25 5.08 -0.32 0.72 114.58 119.20 1ral h GLU 100 Ca -0.11 -0.00 0.24 0.00 -1.00 0.00 0.00 59.36 58.49 1ral h GLU 100 Cb 0.83 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.99 1ral h GLU 100 CO 0.18 0.05 0.64 -0.22 -1.00 0.00 0.00 179.01 178.66 1ral h LYS 101 N 0.08 0.28 -0.02 2.33 3.11 -0.10 0.23 116.57 122.46 1ral h LYS 101 Ca 0.11 -0.02 -0.22 0.00 -2.81 0.00 0.00 60.65 57.71 1ral h LYS 101 Cb 0.14 -0.06 0.02 0.00 -1.00 0.00 0.00 32.23 31.32 1ral h LYS 101 CO -0.18 0.18 -0.86 1.15 -2.81 0.00 0.00 179.45 176.93 1ral h THR 102 N 0.28 1.32 0.18 1.00 2.02 0.55 -3.31 112.91 114.96 1ral h THR 102 Ca 0.50 -2.14 -0.32 0.00 0.77 0.00 0.00 66.41 65.21 1ral h THR 102 Cb 1.45 2.38 0.01 0.00 -1.74 0.00 0.00 68.15 70.25 1ral h THR 102 CO -0.16 0.65 -1.50 -0.07 0.37 0.00 0.00 175.52 174.82 1ral h LEU 103 N 0.26 0.60 0.04 2.58 3.38 0.21 -2.21 115.31 120.16 1ral h LEU 103 Ca -0.10 -0.72 -0.00 0.00 0.09 0.00 0.00 57.88 57.14 1ral h LEU 103 Cb 1.53 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1ral h LEU 103 CO 0.17 1.59 -0.02 0.11 0.09 0.00 0.00 178.44 180.38 1ral h LYS 104 N 0.10 -0.05 -0.76 1.13 1.79 -0.87 -2.25 116.57 115.67 1ral h LYS 104 Ca -0.25 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.22 1ral h LYS 104 Cb 2.08 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 32.70 1ral h LYS 104 CO 0.21 -0.03 0.45 0.77 -1.08 0.00 0.00 179.45 179.78 1ral h SER 105 N -0.05 0.91 1.23 0.86 0.02 -1.67 -2.69 113.55 112.16 1ral h SER 105 Ca -0.00 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1ral h SER 105 Cb 0.04 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.35 1ral h SER 105 CO 0.01 0.72 -0.02 0.71 -1.14 0.00 0.00 176.83 177.10 1ral h THR 106 N 1.04 0.05 -0.86 -2.27 1.35 -0.97 -3.31 112.91 107.93 1ral h THR 106 Ca 0.27 -0.68 -0.32 0.00 -0.55 0.00 0.00 66.41 65.13 1ral h THR 106 Cb -0.03 1.65 -0.13 0.00 -1.73 0.00 0.00 68.15 67.91 1ral h THR 106 CO -0.05 0.02 -0.29 0.00 -0.25 0.00 0.00 175.52 174.95 1ral n GLN 107 N -3.12 -1.54 -2.87 4.72 1.13 -0.88 -3.88 117.38 110.94 1ral n GLN 107 Ca 0.01 1.01 -0.28 0.00 -1.94 0.00 0.00 57.00 55.80 1ral n GLN 107 Cb 0.37 -5.37 -0.02 0.00 0.11 0.00 0.00 30.24 25.33 1ral n GLN 107 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1ral s LEU 108 N -3.66 3.79 0.06 1.08 1.02 -1.25 -5.00 118.68 114.73 1ral s LEU 108 Ca 0.00 0.94 -0.27 0.00 0.02 0.00 0.00 54.13 54.83 1ral s LEU 108 Cb 0.00 -3.84 -0.17 0.00 0.02 0.00 0.00 46.19 42.20 1ral s LEU 108 CO 0.00 -0.44 1.60 0.44 0.02 0.00 0.00 176.35 177.97 1ral h ASP 109 N 0.87 -0.29 -1.05 2.29 3.32 -1.93 -3.45 116.42 116.18 1ral h ASP 109 Ca -0.47 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.53 1ral h ASP 109 Cb 1.20 0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1ral h ASP 109 CO 0.63 -0.13 0.00 -1.22 -1.72 0.00 0.00 179.24 176.80 1ral n TYR 110 N -5.20 -0.79 -4.42 4.55 4.01 -1.26 -5.05 117.16 109.01 1ral n TYR 110 Ca -0.10 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.40 1ral n TYR 110 Cb 0.18 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.10 1ral n TYR 110 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1ral s VAL 111 N -2.85 2.26 0.04 -0.72 -7.23 -1.13 -5.01 120.40 105.77 1ral s VAL 111 Ca 0.00 -2.12 -0.04 0.00 -1.81 0.00 0.00 61.98 58.02 1ral s VAL 111 Cb 0.00 -2.11 -0.28 0.00 0.56 0.00 0.00 36.38 34.55 1ral s VAL 111 CO 0.00 -0.25 1.02 0.44 -0.31 0.00 0.00 175.10 176.00 1ral h ASP 112 N 2.94 0.41 -4.69 4.85 5.19 -1.88 1.05 116.42 124.28 1ral h ASP 112 Ca -0.44 -0.48 -0.17 0.00 -0.62 0.00 0.00 57.03 55.32 1ral h ASP 112 Cb 1.22 -0.13 -0.22 0.00 0.18 0.00 0.00 39.33 40.38 1ral h ASP 112 CO 0.52 1.39 -0.63 -0.22 -3.12 0.00 0.00 179.24 177.18 1ral s LEU 113 N -7.06 1.94 -0.02 1.55 2.96 -1.06 -1.75 118.68 115.24 1ral s LEU 113 Ca -0.06 -0.27 0.03 0.00 -0.22 0.00 0.00 54.13 53.60 1ral s LEU 113 Cb 0.07 0.29 -0.00 0.00 0.50 0.00 0.00 46.19 47.04 1ral s LEU 113 CO 0.87 -0.26 -0.10 -0.47 -1.32 0.00 0.00 176.35 175.08 1ral s TYR 114 N -1.09 0.93 0.09 5.38 5.04 -0.96 -3.25 117.35 123.48 1ral s TYR 114 Ca -0.12 -0.20 0.03 0.00 -2.44 0.00 0.00 57.07 54.34 1ral s TYR 114 Cb -0.07 -0.62 -0.04 0.00 0.35 0.00 0.00 41.96 41.58 1ral s TYR 114 CO -0.00 -0.05 -0.08 0.96 -1.34 0.00 0.00 175.55 175.04 1ral s ILE 115 N -0.06 0.79 -0.47 3.14 -4.36 -1.08 -0.79 121.20 118.38 1ral s ILE 115 Ca 0.01 -1.72 -0.29 0.00 -0.26 0.00 0.00 60.65 58.39 1ral s ILE 115 Cb -0.06 -1.43 0.02 0.00 1.25 0.00 0.00 42.46 42.24 1ral s ILE 115 CO -0.00 -0.69 1.35 -0.63 0.24 0.00 0.00 174.94 175.21 1ral s ILE 116 N -2.88 3.94 0.18 8.37 1.01 -0.84 -1.67 121.20 129.32 1ral s ILE 116 Ca 0.07 0.93 0.04 0.00 0.00 0.00 0.00 60.65 61.69 1ral s ILE 116 Cb 0.00 -4.36 -0.13 0.00 0.01 0.00 0.00 42.46 37.98 1ral s ILE 116 CO -0.02 -0.93 1.41 -0.74 0.00 0.00 0.00 174.94 174.66 1ral h HIS 117 N 10.44 0.21 -2.24 3.97 2.76 -1.80 0.37 115.15 128.86 1ral h HIS 117 Ca -0.26 -0.11 -0.07 0.00 -2.20 0.00 0.00 60.37 57.72 1ral h HIS 117 Cb 1.09 -0.02 -0.19 0.00 1.55 0.00 0.00 27.41 29.83 1ral h HIS 117 CO 0.99 0.91 0.08 -0.06 -1.30 0.00 0.00 177.93 178.55 1ral s PHE 118 N -3.24 -0.56 0.18 5.26 0.40 -1.26 -4.58 117.98 114.18 1ral s PHE 118 Ca -0.02 0.97 -0.09 0.00 -0.60 0.00 0.00 56.93 57.19 1ral s PHE 118 Cb 0.11 0.33 0.07 0.00 0.51 0.00 0.00 43.02 44.04 1ral s PHE 118 CO 0.81 -0.55 1.64 -1.35 0.70 0.00 0.00 175.22 176.48 1ral h PRO 119 N 3.31 1.09 -6.04 0.24 0.11 -1.88 -3.44 132.00 125.39 1ral h PRO 119 Ca -0.28 -0.34 -0.70 0.00 0.11 0.00 0.00 66.00 64.79 1ral h PRO 119 Cb 1.15 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1ral h PRO 119 CO 0.38 1.05 1.27 -0.12 -0.21 0.00 0.00 178.00 180.38 1ral n MET 120 N -4.18 1.03 -5.21 1.05 0.00 -1.26 -4.95 117.12 103.60 1ral n MET 120 Ca 0.03 0.31 -0.32 0.00 0.00 0.00 0.00 57.70 57.73 1ral n MET 120 Cb 0.35 -2.28 -0.17 0.00 0.00 0.00 0.00 33.22 31.12 1ral n MET 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1ral s ALA 121 N 6.15 2.20 0.50 -5.12 0.00 -1.26 -4.41 121.76 119.82 1ral s ALA 121 Ca 1.07 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 52.05 1ral s ALA 121 Cb -0.97 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 1ral s ALA 121 CO 0.55 0.34 0.00 -0.51 0.00 0.00 0.00 175.76 176.15 1ral s LEU 122 N 0.12 2.32 0.55 0.00 1.02 -0.51 -3.09 118.68 119.08 1ral s LEU 122 Ca -0.12 -1.64 -0.16 0.00 0.02 0.00 0.00 54.13 52.23 1ral s LEU 122 Cb -0.16 -0.73 -0.06 0.00 0.02 0.00 0.00 46.19 45.26 1ral s LEU 122 CO 0.06 -0.83 1.02 -1.58 0.02 0.00 0.00 176.35 175.04 1ral s GLN 123 N -3.87 3.67 0.23 1.70 2.00 -1.23 -4.20 119.66 117.96 1ral s GLN 123 Ca 0.07 1.07 -0.32 0.00 -2.00 0.00 0.00 55.36 54.18 1ral s GLN 123 Cb 0.02 -2.09 -0.13 0.00 0.80 0.00 0.00 33.01 31.61 1ral s GLN 123 CO 0.04 -0.51 1.59 -0.35 -0.50 0.00 0.00 175.29 175.56 1ral n PRO 124 N -1.78 2.44 -3.54 1.67 -0.04 -1.25 -4.66 135.00 127.84 1ral n PRO 124 Ca 0.08 0.88 0.00 0.00 -0.04 0.00 0.00 63.50 64.41 1ral n PRO 124 Cb 0.53 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 1ral n PRO 124 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ral n GLY 125 N 2.95 -1.61 0.10 0.55 0.00 -1.26 -5.01 105.19 100.91 1ral n GLY 125 Ca 0.13 -1.09 -0.02 0.00 0.00 0.00 0.00 46.02 45.04 1ral n GLY 125 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1ral h ASP 126 N 0.00 0.00 -3.66 1.61 3.58 -2.04 -3.44 116.42 112.47 1ral h ASP 126 Ca 0.00 0.00 -0.65 0.00 0.42 0.00 0.00 57.03 56.80 1ral h ASP 126 Cb 0.00 0.00 -0.22 0.00 1.72 0.00 0.00 39.33 40.83 1ral h ASP 126 CO 0.00 0.74 -0.62 0.27 -2.88 0.00 0.00 179.24 176.75 1ral s ILE 127 N -2.83 4.37 -1.06 2.25 -0.00 -1.26 -4.99 121.20 117.67 1ral s ILE 127 Ca 0.02 -0.17 0.01 0.00 -0.00 0.00 0.00 60.65 60.50 1ral s ILE 127 Cb 0.09 -3.06 0.01 0.00 -0.00 0.00 0.00 42.46 39.50 1ral s ILE 127 CO 0.79 0.32 0.99 0.49 -0.00 0.00 0.00 174.94 177.52 1ral n PHE 128 N 4.93 0.00 -3.29 1.37 3.01 -1.26 -3.34 117.46 118.89 1ral n PHE 128 Ca -0.16 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.14 1ral n PHE 128 Cb 0.51 -0.47 -0.07 0.00 -0.01 0.00 0.00 39.48 39.45 1ral n PHE 128 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1ral s PHE 129 N -2.94 -0.33 -0.92 1.38 0.08 -1.26 -4.85 117.98 109.14 1ral s PHE 129 Ca 0.00 -0.96 -0.23 0.00 0.12 0.00 0.00 56.93 55.87 1ral s PHE 129 Cb 0.00 -0.35 0.07 0.00 -0.57 0.00 0.00 43.02 42.17 1ral s PHE 129 CO 0.01 -1.00 1.31 -1.25 -0.10 0.00 0.00 175.22 174.19 1ral s PRO 130 N 1.18 3.49 0.35 0.24 0.04 -1.21 -5.01 135.00 134.07 1ral s PRO 130 Ca 0.21 -1.10 -0.26 0.00 0.04 0.00 0.00 61.00 59.89 1ral s PRO 130 Cb -0.10 -4.97 -0.09 0.00 0.04 0.00 0.00 34.50 29.37 1ral s PRO 130 CO -0.05 -2.07 1.01 1.03 0.04 0.00 0.00 177.00 176.96 1ral s ARG 131 N 4.49 4.41 -0.60 4.56 3.00 -1.26 -1.97 118.95 131.58 1ral s ARG 131 Ca 0.39 1.48 -0.16 0.00 0.00 0.00 0.00 55.73 57.44 1ral s ARG 131 Cb -0.04 -2.74 -0.14 0.00 0.00 0.00 0.00 34.95 32.03 1ral s ARG 131 CO -0.04 0.09 1.81 -0.40 0.00 0.00 0.00 175.30 176.76 1ral n ASP 132 N 0.38 2.67 0.00 0.23 5.68 -0.41 -3.92 116.55 121.18 1ral n ASP 132 Ca 0.03 -2.46 0.00 0.00 -0.50 0.00 0.00 54.79 51.86 1ral n ASP 132 Cb 0.49 -0.94 0.00 0.00 -1.14 0.00 0.00 41.12 39.53 1ral n ASP 132 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1ral n GLU 133 N 6.09 0.00 -1.37 0.11 4.71 -1.26 -4.66 120.64 124.26 1ral n GLU 133 Ca 0.41 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.56 1ral n GLU 133 Cb 0.28 -1.04 0.00 0.00 -1.01 0.00 0.00 31.44 29.67 1ral n GLU 133 CO 0.00 0.00 0.00 -2.39 0.09 0.00 0.00 177.13 174.83 1ral n HIS 134 N 0.00 -0.47 0.00 -0.32 1.44 -1.25 -5.10 115.22 109.51 1ral n HIS 134 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1ral n HIS 134 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 1ral n HIS 134 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1ral n GLY 135 N 0.00 2.58 0.00 -1.39 0.00 -1.26 -4.67 105.19 100.45 1ral n GLY 135 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1ral n GLY 135 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ral n LYS 136 N 7.67 3.22 -4.28 1.61 5.02 -1.26 -4.94 118.16 125.20 1ral n LYS 136 Ca 0.00 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.03 1ral n LYS 136 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 1ral n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ral s LEU 137 N 0.00 3.10 -0.19 -0.35 2.01 -1.26 -1.28 118.68 120.70 1ral s LEU 137 Ca 0.00 -0.57 -0.29 0.00 0.01 0.00 0.00 54.13 53.28 1ral s LEU 137 Cb 0.00 -1.72 -0.03 0.00 0.01 0.00 0.00 46.19 44.45 1ral s LEU 137 CO 0.00 0.07 1.58 -0.76 1.01 0.00 0.00 176.35 178.25 1ral s LEU 138 N -3.11 3.99 0.01 1.79 1.43 -0.83 -4.67 118.68 117.28 1ral s LEU 138 Ca 0.27 1.71 0.04 0.00 -1.03 0.00 0.00 54.13 55.13 1ral s LEU 138 Cb -0.08 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.57 1ral s LEU 138 CO 0.17 -1.16 -0.11 0.72 0.23 0.00 0.00 176.35 176.21 1ral s PHE 139 N 4.84 2.78 0.08 0.29 -0.71 -1.26 -3.58 117.98 120.42 1ral s PHE 139 Ca 0.70 -0.11 0.08 0.00 -1.04 0.00 0.00 56.93 56.56 1ral s PHE 139 Cb -0.26 -1.57 -0.03 0.00 -1.21 0.00 0.00 43.02 39.95 1ral s PHE 139 CO 0.28 0.32 -0.22 -2.00 -1.34 0.00 0.00 175.22 172.26 1ral s GLU 140 N -1.36 1.33 -0.85 1.99 2.12 -1.18 -4.83 118.70 115.92 1ral s GLU 140 Ca 0.16 -1.11 -0.25 0.00 0.36 0.00 0.00 54.97 54.13 1ral s GLU 140 Cb -0.11 -1.57 0.04 0.00 0.26 0.00 0.00 34.13 32.75 1ral s GLU 140 CO 0.06 0.38 1.34 0.95 -0.54 0.00 0.00 175.26 177.46 1ral s THR 141 N -0.98 3.81 0.53 -1.70 -4.23 -1.26 -4.73 115.64 107.08 1ral s THR 141 Ca 0.09 -0.07 0.09 0.00 -1.18 0.00 0.00 61.69 60.62 1ral s THR 141 Cb -0.10 -4.97 0.06 0.00 1.34 0.00 0.00 72.50 68.84 1ral s THR 141 CO 0.03 -1.89 0.72 0.54 -0.54 0.00 0.00 174.62 173.48 1ral s VAL 142 N 5.41 2.39 0.01 2.29 0.11 -1.26 -5.13 120.40 124.22 1ral s VAL 142 Ca 0.39 -1.01 0.08 0.00 -2.93 0.00 0.00 61.98 58.51 1ral s VAL 142 Cb -0.05 -2.41 -0.02 0.00 -1.53 0.00 0.00 36.38 32.37 1ral s VAL 142 CO 0.05 0.00 -0.25 -0.62 -3.33 0.00 0.00 175.10 170.95 1ral s ASP 143 N -4.56 3.18 0.06 3.54 2.15 -1.26 -5.04 116.67 114.74 1ral s ASP 143 Ca 0.59 -0.51 -0.29 0.00 0.43 0.00 0.00 52.55 52.77 1ral s ASP 143 Cb -0.07 -0.35 -0.18 0.00 -0.30 0.00 0.00 42.92 42.02 1ral s ASP 143 CO 0.37 0.29 1.59 -0.29 -0.17 0.00 0.00 175.17 176.96 1ral h ILE 144 N 4.33 0.56 -0.76 4.11 2.10 -1.97 -1.05 117.51 124.83 1ral h ILE 144 Ca -0.45 -0.10 0.22 0.00 1.08 0.00 0.00 64.86 65.61 1ral h ILE 144 Cb 1.13 0.62 -0.03 0.00 -1.09 0.00 0.00 36.82 37.45 1ral h ILE 144 CO 0.46 0.02 0.55 0.00 -1.08 0.00 0.00 178.15 178.09 1ral h ASP 146 N 0.01 0.58 0.08 0.00 1.82 -1.89 0.18 116.42 117.20 1ral h ASP 146 Ca 0.36 -0.60 -0.17 0.00 -0.39 0.00 0.00 57.03 56.23 1ral h ASP 146 Cb 1.45 -0.19 -0.00 0.00 0.68 0.00 0.00 39.33 41.27 1ral h ASP 146 CO -0.01 1.46 -0.61 0.74 -1.61 0.00 0.00 179.24 179.21 1ral h THR 147 N 0.12 1.33 -0.51 2.25 2.02 -0.02 -0.26 112.91 117.85 1ral h THR 147 Ca -0.17 -1.90 -0.07 0.00 0.77 0.00 0.00 66.41 65.04 1ral h THR 147 Cb 1.98 1.88 -0.02 0.00 -1.74 0.00 0.00 68.15 70.25 1ral h THR 147 CO 0.22 0.59 0.05 -0.25 0.37 0.00 0.00 175.52 176.50 1ral h TRP 148 N 0.39 0.92 0.01 3.16 2.91 -1.04 0.11 115.95 122.41 1ral h TRP 148 Ca -0.01 -0.14 0.03 0.00 1.13 0.00 0.00 58.89 59.90 1ral h TRP 148 Cb 1.17 -0.25 -0.05 0.00 -0.51 0.00 0.00 29.16 29.52 1ral h TRP 148 CO 0.05 0.84 -0.37 0.93 -1.03 0.00 0.00 178.44 178.86 1ral h GLU 149 N 0.73 -0.51 0.00 2.65 5.08 -0.55 0.14 114.58 122.12 1ral h GLU 149 Ca 0.15 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1ral h GLU 149 Cb 0.44 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1ral h GLU 149 CO 0.02 -0.34 0.00 0.00 -1.00 0.00 0.00 179.01 177.68 1ral n ALA 150 N -2.82 1.71 -0.12 3.43 0.00 -0.12 -2.34 120.51 120.25 1ral n ALA 150 Ca -0.05 -0.04 -0.21 0.00 0.00 0.00 0.00 53.44 53.13 1ral n ALA 150 Cb 0.35 -1.11 -0.08 0.00 0.00 0.00 0.00 19.45 18.61 1ral n ALA 150 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1ral n MET 151 N -1.06 0.56 -0.30 0.00 1.56 0.32 -4.53 117.12 113.68 1ral n MET 151 Ca 0.05 0.32 0.09 0.00 -0.27 0.00 0.00 57.70 57.88 1ral n MET 151 Cb 0.03 -1.53 0.25 0.00 2.15 0.00 0.00 33.22 34.12 1ral n MET 151 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 175.97 176.17 1ral h GLU 152 N -1.00 0.55 -0.66 2.12 5.08 -0.87 -2.10 114.58 117.69 1ral h GLU 152 Ca -0.41 -0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.06 1ral h GLU 152 Cb 1.31 -0.12 -0.12 0.00 0.50 0.00 0.00 28.75 30.32 1ral h GLU 152 CO -0.25 0.36 -0.06 0.87 -1.00 0.00 0.00 179.01 178.93 1ral h LYS 153 N 0.56 0.06 -0.11 2.33 1.79 -1.78 -0.13 116.57 119.30 1ral h LYS 153 Ca 0.49 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.92 1ral h LYS 153 Cb 0.76 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.39 1ral h LYS 153 CO -0.41 0.04 -0.08 0.00 -1.08 0.00 0.00 179.45 177.92 1ral h LYS 155 N 0.16 -0.18 -0.72 0.00 1.63 -1.11 -1.68 116.57 114.67 1ral h LYS 155 Ca 0.04 0.01 0.19 0.00 -0.85 0.00 0.00 60.65 60.04 1ral h LYS 155 Cb 0.25 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.89 1ral h LYS 155 CO 0.01 0.26 0.51 0.22 -3.45 0.00 0.00 179.45 177.00 1ral h ASP 156 N -0.72 0.13 -0.19 4.20 3.58 -1.16 0.99 116.42 123.26 1ral h ASP 156 Ca -0.02 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1ral h ASP 156 Cb 0.52 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.56 1ral h ASP 156 CO 0.03 0.06 0.00 0.00 -2.88 0.00 0.00 179.24 176.45 1ral n ALA 157 N -2.62 2.55 -0.70 -0.78 0.00 0.12 -4.93 120.51 114.15 1ral n ALA 157 Ca 0.14 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1ral n ALA 157 Cb 0.70 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1ral n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ral n GLY 158 N 0.68 0.31 0.16 0.00 0.00 0.34 -4.85 105.19 101.83 1ral n GLY 158 Ca 0.07 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.15 1ral n GLY 158 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ral h LEU 159 N 0.00 0.00 -6.31 0.99 5.85 -1.53 -3.44 115.31 110.88 1ral h LEU 159 Ca 0.00 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 1ral h LEU 159 Cb 0.07 0.00 -0.27 0.00 0.37 0.00 0.00 40.66 40.82 1ral h LEU 159 CO 0.00 0.31 -0.45 0.00 -0.34 0.00 0.00 178.44 177.95 1ral s ALA 160 N -3.07 -1.41 0.46 1.25 0.00 -1.24 -2.85 121.76 114.90 1ral s ALA 160 Ca 0.04 0.87 0.15 0.00 0.00 0.00 0.00 51.96 53.02 1ral s ALA 160 Cb 0.07 -1.94 0.51 0.00 0.00 0.00 0.00 23.12 21.76 1ral s ALA 160 CO 0.73 -1.46 0.91 1.17 0.00 0.00 0.00 175.76 177.12 1ral n LYS 161 N 5.38 0.01 -3.64 0.00 3.00 0.36 -4.33 118.16 118.94 1ral n LYS 161 Ca -0.01 0.75 -0.06 0.00 -0.00 0.00 0.00 58.31 58.99 1ral n LYS 161 Cb 0.50 -1.90 -0.02 0.00 0.00 0.00 0.00 35.03 33.61 1ral n LYS 161 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1ral s SER 162 N -3.19 -0.26 0.20 3.14 0.01 -0.72 -4.97 113.70 107.90 1ral s SER 162 Ca -0.01 -0.22 0.09 0.00 1.31 0.00 0.00 55.95 57.11 1ral s SER 162 Cb 0.08 0.44 -0.04 0.00 0.21 0.00 0.00 66.02 66.71 1ral s SER 162 CO 0.26 -0.78 -0.18 0.27 0.41 0.00 0.00 173.24 173.22 1ral s ILE 163 N -3.22 1.95 0.17 1.44 -5.25 -1.26 -2.26 121.20 112.77 1ral s ILE 163 Ca 0.09 -2.09 -0.08 0.00 -0.99 0.00 0.00 60.65 57.58 1ral s ILE 163 Cb -0.01 -2.00 0.03 0.00 2.95 0.00 0.00 42.46 43.43 1ral s ILE 163 CO -0.03 -0.39 0.42 0.61 -1.79 0.00 0.00 174.94 173.76 1ral n GLY 164 N -0.04 1.36 0.00 6.27 0.00 0.03 -3.32 105.19 109.48 1ral n GLY 164 Ca -0.10 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1ral n GLY 164 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ral n VAL 165 N -0.29 0.00 -3.62 1.61 0.24 -0.48 -1.99 118.33 113.80 1ral n VAL 165 Ca -0.04 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.19 1ral n VAL 165 Cb 0.29 -0.38 -0.06 0.00 -1.47 0.00 0.00 33.84 32.22 1ral n VAL 165 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1ral s SER 166 N -0.57 -0.27 -1.24 -1.34 0.01 0.13 -4.00 113.70 106.42 1ral s SER 166 Ca 0.00 0.44 -0.05 0.00 1.31 0.00 0.00 55.95 57.65 1ral s SER 166 Cb 0.00 0.42 0.03 0.00 0.21 0.00 0.00 66.02 66.68 1ral s SER 166 CO 0.00 -0.15 0.32 0.59 0.41 0.00 0.00 173.24 174.40 1ral n ASN 167 N 1.42 -4.15 -4.92 2.44 3.02 -1.21 -4.30 115.26 107.56 1ral n ASN 167 Ca -0.10 -0.15 -0.29 0.00 -0.03 0.00 0.00 54.58 54.02 1ral n ASN 167 Cb 0.57 -3.45 -0.04 0.00 -0.61 0.00 0.00 39.78 36.25 1ral n ASN 167 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1ral s PHE 168 N -2.85 3.49 0.24 3.10 0.40 -1.26 -4.83 117.98 116.27 1ral s PHE 168 Ca 0.23 0.35 0.11 0.00 -0.60 0.00 0.00 56.93 57.02 1ral s PHE 168 Cb -0.12 -1.85 -0.05 0.00 0.51 0.00 0.00 43.02 41.51 1ral s PHE 168 CO 0.29 0.44 -0.21 1.21 0.70 0.00 0.00 175.22 177.65 1ral s ASN 169 N -2.89 3.42 0.00 1.36 3.84 -1.26 -4.91 114.94 114.50 1ral s ASN 169 Ca 0.38 -0.97 0.00 0.00 0.21 0.00 0.00 52.86 52.48 1ral s ASN 169 Cb -0.12 -0.27 0.00 0.00 -0.55 0.00 0.00 41.25 40.32 1ral s ASN 169 CO 0.28 0.04 0.00 0.00 -2.79 0.00 0.00 177.10 174.63 1ral h ARG 171 N 0.00 0.10 0.00 0.00 2.43 -1.99 -3.05 114.38 111.86 1ral h ARG 171 Ca 0.00 -0.17 -0.05 0.00 -0.81 0.00 0.00 59.98 58.95 1ral h ARG 171 Cb 0.00 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1ral h ARG 171 CO 0.00 1.08 -0.23 1.96 -1.51 0.00 0.00 179.97 181.28 1ral h GLN 172 N -0.75 0.00 0.12 0.20 4.20 -0.25 -3.13 115.11 115.49 1ral h GLN 172 Ca -0.16 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.55 1ral h GLN 172 Cb 1.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.11 1ral h GLN 172 CO -0.00 0.23 -0.06 1.25 -0.67 0.00 0.00 178.83 179.57 1ral h LEU 173 N 0.00 -0.13 -1.38 1.46 5.85 -0.55 -2.99 115.31 117.57 1ral h LEU 173 Ca -0.00 -0.42 0.09 0.00 0.84 0.00 0.00 57.88 58.39 1ral h LEU 173 Cb 0.83 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.84 1ral h LEU 173 CO 0.03 0.41 0.50 -0.08 -0.34 0.00 0.00 178.44 178.96 1ral h GLU 174 N -0.75 0.68 0.21 1.25 4.81 -1.62 -2.12 114.58 117.04 1ral h GLU 174 Ca -0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1ral h GLU 174 Cb 0.54 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1ral h GLU 174 CO 0.03 0.45 -0.10 -0.09 -0.73 0.00 0.00 179.01 178.57 1ral h ARG 175 N 0.70 -0.27 -0.87 1.92 9.65 -1.54 -1.43 114.38 122.53 1ral h ARG 175 Ca 0.35 0.02 0.23 0.00 -1.10 0.00 0.00 59.98 59.48 1ral h ARG 175 Cb 0.43 0.06 -0.15 0.00 -1.39 0.00 0.00 29.97 28.92 1ral h ARG 175 CO -0.13 0.04 0.16 0.82 2.80 0.00 0.00 179.97 183.65 1ral h ILE 176 N -0.59 0.27 -0.00 1.20 1.08 -1.23 0.17 117.51 118.41 1ral h ILE 176 Ca -0.03 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.39 1ral h ILE 176 Cb 0.43 0.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.29 1ral h ILE 176 CO 0.05 0.03 -0.17 -0.11 -0.69 0.00 0.00 178.15 177.25 1ral n LEU 177 N -5.30 0.25 -0.00 1.44 0.00 -1.12 -3.86 117.00 108.42 1ral n LEU 177 Ca 0.20 0.23 0.07 0.00 0.00 0.00 0.00 56.01 56.51 1ral n LEU 177 Cb 0.66 -0.35 -0.10 0.00 0.00 0.00 0.00 43.42 43.63 1ral n LEU 177 CO 0.04 0.06 -0.37 0.59 0.00 0.00 0.00 177.39 177.71 1ral n ASN 178 N -1.37 1.17 -4.73 1.96 5.03 0.52 -5.05 115.26 112.79 1ral n ASN 178 Ca 0.08 -0.40 -0.35 0.00 0.87 0.00 0.00 54.58 54.78 1ral n ASN 178 Cb 0.32 1.35 0.08 0.00 -1.02 0.00 0.00 39.78 40.51 1ral n ASN 178 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 1ral s LYS 179 N -2.70 2.26 0.17 3.52 -2.85 -0.76 -4.94 119.74 114.44 1ral s LYS 179 Ca -0.00 1.78 -0.31 0.00 -1.00 0.00 0.00 55.97 56.44 1ral s LYS 179 Cb 0.10 -1.85 -0.17 0.00 -2.06 0.00 0.00 37.83 33.85 1ral s LYS 179 CO 0.60 -1.75 0.71 -2.30 0.10 0.00 0.00 175.35 172.71 1ral n PRO 180 N -2.54 0.19 -3.64 1.78 -0.02 -1.26 -3.50 135.00 126.01 1ral n PRO 180 Ca 0.14 0.07 -0.26 0.00 -2.02 0.00 0.00 63.50 61.42 1ral n PRO 180 Cb 0.50 -1.23 -0.03 0.00 -0.02 0.00 0.00 33.50 32.73 1ral n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ral n GLY 181 N 1.84 -0.46 3.68 -1.23 0.00 -1.26 -4.94 105.19 102.82 1ral n GLY 181 Ca 0.17 0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.89 1ral n GLY 181 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ral n LEU 182 N -3.69 4.98 0.04 0.99 0.00 -1.23 -4.99 117.00 113.10 1ral n LEU 182 Ca 0.04 0.84 0.00 0.00 0.00 0.00 0.00 56.01 56.88 1ral n LEU 182 Cb 0.50 -1.49 0.00 0.00 0.00 0.00 0.00 43.42 42.44 1ral n LEU 182 CO 0.59 -1.31 0.00 1.17 0.00 0.00 0.00 177.39 177.84 1ral n LYS 183 N -1.41 0.00 -3.49 1.96 4.81 -1.26 -5.01 118.16 113.76 1ral n LYS 183 Ca 0.14 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.17 1ral n LYS 183 Cb 0.47 -0.26 -0.10 0.00 0.02 0.00 0.00 35.03 35.16 1ral n LYS 183 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1ral s TYR 184 N -1.61 3.23 0.49 5.64 2.02 -1.26 -5.07 117.35 120.79 1ral s TYR 184 Ca 0.00 -0.40 -0.15 0.00 -0.37 0.00 0.00 57.07 56.15 1ral s TYR 184 Cb 0.00 -2.54 -0.08 0.00 -0.40 0.00 0.00 41.96 38.94 1ral s TYR 184 CO 0.00 -0.48 0.93 0.21 -1.57 0.00 0.00 175.55 174.65 1ral s LYS 185 N 1.71 3.91 0.20 -0.62 2.20 -1.26 -4.90 119.74 120.98 1ral s LYS 185 Ca 0.06 0.84 -0.31 0.00 -0.36 0.00 0.00 55.97 56.20 1ral s LYS 185 Cb -0.18 -2.20 -0.16 0.00 -1.51 0.00 0.00 37.83 33.78 1ral s LYS 185 CO 0.10 -0.21 0.96 -0.35 -0.36 0.00 0.00 175.35 175.49 1ral n PRO 186 N -1.50 0.86 0.00 4.03 -0.04 -1.26 -4.88 135.00 132.21 1ral n PRO 186 Ca 0.06 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 1ral n PRO 186 Cb 0.54 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 1ral n PRO 186 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1ral n VAL 187 N 0.75 0.00 -3.92 0.52 0.24 -1.21 -4.62 118.33 110.09 1ral n VAL 187 Ca 0.14 0.28 -0.21 0.00 -2.04 0.00 0.00 64.34 62.51 1ral n VAL 187 Cb 0.26 -1.25 -0.04 0.00 -1.47 0.00 0.00 33.84 31.34 1ral n VAL 187 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ral s ASN 189 N -3.94 3.35 -1.35 0.00 2.47 -1.07 -1.38 114.94 113.02 1ral s ASN 189 Ca 0.38 -1.61 -0.17 0.00 0.42 0.00 0.00 52.86 51.89 1ral s ASN 189 Cb -0.07 -0.38 0.05 0.00 -1.45 0.00 0.00 41.25 39.40 1ral s ASN 189 CO 0.26 -0.39 1.94 1.67 -3.72 0.00 0.00 177.10 176.86 1ral n GLN 190 N 4.82 2.98 -2.95 0.43 0.00 -1.25 -3.54 117.38 117.87 1ral n GLN 190 Ca 0.00 -2.96 -0.19 0.00 -0.00 0.00 0.00 57.00 53.86 1ral n GLN 190 Cb 0.40 -3.41 0.04 0.00 0.00 0.00 0.00 30.24 27.27 1ral n GLN 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1ral s VAL 191 N 4.05 2.57 -0.16 1.69 0.11 -1.17 -3.31 120.40 124.18 1ral s VAL 191 Ca 0.52 -0.93 -0.13 0.00 -2.93 0.00 0.00 61.98 58.50 1ral s VAL 191 Cb 0.08 -2.64 -0.05 0.00 -1.53 0.00 0.00 36.38 32.24 1ral s VAL 191 CO 0.02 0.00 0.28 -0.70 -3.33 0.00 0.00 175.10 171.36 1ral s GLU 192 N -4.58 4.25 0.06 1.54 2.12 -1.26 -2.76 118.70 118.08 1ral s GLU 192 Ca 0.59 0.07 -0.11 0.00 0.36 0.00 0.00 54.97 55.88 1ral s GLU 192 Cb -0.08 -3.43 0.01 0.00 0.26 0.00 0.00 34.13 30.89 1ral s GLU 192 CO 0.37 0.24 0.23 0.00 -0.54 0.00 0.00 175.26 175.56 1ral n HIS 194 N 0.37 0.00 0.12 0.00 1.44 0.09 -3.46 115.22 113.78 1ral n HIS 194 Ca -0.17 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.58 1ral n HIS 194 Cb 0.60 0.00 0.26 0.00 0.12 0.00 0.00 29.99 30.98 1ral n HIS 194 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1ral n LEU 195 N 0.00 0.25 -0.44 2.39 4.77 -1.26 -1.88 117.00 120.83 1ral n LEU 195 Ca 0.00 0.48 0.04 0.00 -0.03 0.00 0.00 56.01 56.51 1ral n LEU 195 Cb 0.00 -0.44 0.08 0.00 -2.33 0.00 0.00 43.42 40.73 1ral n LEU 195 CO 0.00 -0.57 0.51 -1.22 -1.33 0.00 0.00 177.39 174.78 1ral n TYR 196 N -1.86 0.20 0.00 -1.77 4.02 -1.26 0.28 117.16 116.77 1ral n TYR 196 Ca -0.01 -0.27 0.00 0.00 -0.01 0.00 0.00 57.90 57.61 1ral n TYR 196 Cb 0.30 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.60 1ral n TYR 196 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 176.86 175.74 1ral n LEU 197 N 0.40 0.00 -3.96 7.72 -0.00 -0.79 -1.59 117.00 118.78 1ral n LEU 197 Ca 0.07 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.78 1ral n LEU 197 Cb 0.31 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.60 1ral n LEU 197 CO 0.06 0.00 -0.14 0.54 -0.00 0.00 0.00 177.39 177.85 1ral s ASN 198 N 0.00 4.47 -0.66 1.96 4.22 -0.82 -0.73 114.94 123.37 1ral s ASN 198 Ca 0.00 -3.11 -0.26 0.00 -2.14 0.00 0.00 52.86 47.35 1ral s ASN 198 Cb 0.00 -1.66 -0.04 0.00 1.28 0.00 0.00 41.25 40.83 1ral s ASN 198 CO 0.00 -0.22 2.01 -1.10 -2.04 0.00 0.00 177.10 175.74 1ral s GLN 199 N -0.42 2.46 0.44 3.55 1.11 -1.26 -4.70 119.66 120.83 1ral s GLN 199 Ca 0.18 0.54 0.13 0.00 0.01 0.00 0.00 55.36 56.22 1ral s GLN 199 Cb -0.23 -4.59 0.96 0.00 -1.01 0.00 0.00 33.01 28.14 1ral s GLN 199 CO -0.02 -3.07 1.99 0.77 0.01 0.00 0.00 175.29 174.97 1ral h SER 200 N 14.82 0.10 1.53 5.90 0.02 -1.98 -0.02 113.55 133.92 1ral h SER 200 Ca -0.16 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.71 1ral h SER 200 Cb 1.14 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 1ral h SER 200 CO 1.19 0.23 -0.48 0.50 -1.14 0.00 0.00 176.83 177.13 1ral h LYS 201 N 0.10 0.00 0.00 3.45 3.11 -1.90 -0.22 116.57 121.12 1ral h LYS 201 Ca 0.02 0.00 -0.27 0.00 -2.81 0.00 0.00 60.65 57.59 1ral h LYS 201 Cb 0.28 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 31.46 1ral h LYS 201 CO 0.02 0.25 -1.51 0.52 -2.81 0.00 0.00 179.45 175.91 1ral h MET 202 N 0.00 0.01 0.06 1.90 2.86 -1.73 -3.34 114.93 114.69 1ral h MET 202 Ca -0.02 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1ral h MET 202 Cb 1.23 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.89 1ral h MET 202 CO 0.03 0.66 -0.03 1.25 1.06 0.00 0.00 176.91 179.88 1ral h LEU 203 N 0.00 -0.06 -4.86 1.22 5.85 -0.95 0.36 115.31 116.87 1ral h LEU 203 Ca -0.21 -0.39 -0.59 0.00 0.84 0.00 0.00 57.88 57.52 1ral h LEU 203 Cb 1.95 0.02 0.01 0.00 0.37 0.00 0.00 40.66 43.00 1ral h LEU 203 CO 0.10 0.37 3.09 0.47 -0.34 0.00 0.00 178.44 182.12 1ral n ASP 204 N -4.92 8.16 0.04 1.25 8.00 -0.10 -3.12 116.55 125.86 1ral n ASP 204 Ca -0.08 -2.58 0.00 0.00 0.71 0.00 0.00 54.79 52.83 1ral n ASP 204 Cb 0.24 -1.53 0.00 0.00 -0.02 0.00 0.00 41.12 39.81 1ral n ASP 204 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ral n TYR 205 N 3.31 -2.16 -0.00 1.24 9.36 -1.08 -4.88 117.16 122.95 1ral n TYR 205 Ca 0.72 0.27 -0.09 0.00 3.32 0.00 0.00 57.90 62.12 1ral n TYR 205 Cb 0.35 0.95 -0.04 0.00 -0.63 0.00 0.00 39.34 39.97 1ral n TYR 205 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1ral h LYS 207 N -0.11 0.77 -0.98 0.00 1.57 -1.63 0.26 116.57 116.46 1ral h LYS 207 Ca 0.08 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.86 1ral h LYS 207 Cb 0.22 -0.17 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 1ral h LYS 207 CO -0.18 0.52 0.64 1.03 -0.57 0.00 0.00 179.45 180.89 1ral h SER 208 N 0.79 1.04 -1.06 0.86 0.87 -1.31 -1.94 113.55 112.80 1ral h SER 208 Ca 0.21 -0.00 -0.64 0.00 -1.23 0.00 0.00 61.79 60.13 1ral h SER 208 Cb -0.07 -0.23 -0.34 0.00 -0.44 0.00 0.00 62.40 61.32 1ral h SER 208 CO -0.04 0.69 0.24 0.29 -0.53 0.00 0.00 176.83 177.48 1ral n LYS 209 N -4.47 3.05 -0.99 2.24 4.01 0.73 -4.90 118.16 117.83 1ral n LYS 209 Ca 0.14 -3.68 -0.03 0.00 -0.51 0.00 0.00 58.31 54.23 1ral n LYS 209 Cb 0.14 -2.28 -0.01 0.00 -0.51 0.00 0.00 35.03 32.37 1ral n LYS 209 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1ral n ASP 210 N -0.78 -0.78 -4.64 4.39 2.03 -0.73 -4.90 116.55 111.14 1ral n ASP 210 Ca 0.54 0.07 -0.43 0.00 0.52 0.00 0.00 54.79 55.49 1ral n ASP 210 Cb 0.72 -1.09 -0.02 0.00 -0.72 0.00 0.00 41.12 40.00 1ral n ASP 210 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ral s ILE 211 N -1.14 4.57 -0.54 5.18 1.01 -0.07 -4.69 121.20 125.53 1ral s ILE 211 Ca 0.00 1.74 -0.26 0.00 0.00 0.00 0.00 60.65 62.13 1ral s ILE 211 Cb 0.00 -4.37 0.03 0.00 0.01 0.00 0.00 42.46 38.14 1ral s ILE 211 CO 0.00 -0.40 1.01 0.27 0.00 0.00 0.00 174.94 175.82 1ral s ILE 212 N 3.49 4.30 -0.60 2.92 -4.36 0.17 -3.77 121.20 123.35 1ral s ILE 212 Ca 0.44 0.59 -0.27 0.00 -0.26 0.00 0.00 60.65 61.14 1ral s ILE 212 Cb -0.13 -4.57 -0.00 0.00 1.25 0.00 0.00 42.46 39.01 1ral s ILE 212 CO 0.13 -1.11 1.60 -0.22 0.24 0.00 0.00 174.94 175.59 1ral s LEU 213 N 4.19 3.32 0.16 0.37 0.20 -1.26 -2.60 118.68 123.06 1ral s LEU 213 Ca 0.36 0.25 -0.20 0.00 0.69 0.00 0.00 54.13 55.23 1ral s LEU 213 Cb -0.10 -2.78 -0.08 0.00 -0.43 0.00 0.00 46.19 42.80 1ral s LEU 213 CO 0.23 -2.01 0.68 -0.69 -0.29 0.00 0.00 176.35 174.27 1ral s VAL 214 N 7.30 4.59 -0.03 1.68 1.01 -1.23 -1.64 120.40 132.08 1ral s VAL 214 Ca 0.57 1.33 0.02 0.00 0.00 0.00 0.00 61.98 63.90 1ral s VAL 214 Cb -0.12 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.34 1ral s VAL 214 CO 0.22 0.39 -0.10 -0.94 0.00 0.00 0.00 175.10 174.67 1ral s SER 215 N -1.38 1.35 0.17 3.32 1.04 -0.64 -3.03 113.70 114.54 1ral s SER 215 Ca 0.37 -0.21 0.05 0.00 0.48 0.00 0.00 55.95 56.63 1ral s SER 215 Cb -0.19 -0.43 -0.04 0.00 0.10 0.00 0.00 66.02 65.46 1ral s SER 215 CO 0.22 0.06 0.18 -0.72 0.98 0.00 0.00 173.24 173.95 1ral s TYR 216 N 0.32 3.22 -0.73 5.02 1.13 -1.11 -1.14 117.35 124.06 1ral s TYR 216 Ca -0.06 -0.00 0.00 0.00 -1.41 0.00 0.00 57.07 55.60 1ral s TYR 216 Cb -0.11 -1.53 0.00 0.00 -1.10 0.00 0.00 41.96 39.22 1ral s TYR 216 CO 0.01 0.52 0.00 0.00 -2.51 0.00 0.00 175.55 173.57 1ral h THR 218 N 0.00 0.92 -0.48 0.00 2.02 -1.78 -0.69 112.91 112.90 1ral h THR 218 Ca -0.15 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.74 1ral h THR 218 Cb 0.62 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1ral h THR 218 CO 0.21 0.15 0.00 -0.11 0.37 0.00 0.00 175.52 176.15 1ral n LEU 219 N -4.71 4.76 0.00 2.58 0.00 -1.26 -4.56 117.00 113.80 1ral n LEU 219 Ca 0.14 -2.41 0.00 0.00 0.00 0.00 0.00 56.01 53.74 1ral n LEU 219 Cb 0.28 -0.64 0.00 0.00 0.00 0.00 0.00 43.42 43.07 1ral n LEU 219 CO 0.27 0.57 0.00 0.61 0.00 0.00 0.00 177.39 178.85 1ral n GLY 220 N 0.57 1.38 5.04 -3.96 0.00 -0.27 -4.73 105.19 103.23 1ral n GLY 220 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1ral n GLY 220 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ral n SER 221 N 0.00 0.00 0.00 1.61 7.64 -1.26 -4.85 113.62 116.76 1ral n SER 221 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ral n SER 221 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1ral n SER 221 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ral n SER 222 N 1.29 0.00 -4.64 6.43 7.64 -1.26 -4.88 113.62 118.20 1ral n SER 222 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1ral n SER 222 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1ral n SER 222 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1ral s ARG 223 N 0.00 3.84 0.00 1.43 0.52 -1.26 -4.09 118.95 119.39 1ral s ARG 223 Ca 0.00 2.29 0.00 0.00 -0.52 0.00 0.00 55.73 57.50 1ral s ARG 223 Cb 0.00 -4.18 0.00 0.00 0.52 0.00 0.00 34.95 31.29 1ral s ARG 223 CO 0.00 -1.29 0.00 -3.47 0.02 0.00 0.00 175.30 170.56 1ral n ASP 224 N 8.70 0.00 -3.13 0.23 2.03 -1.26 -4.86 116.55 118.26 1ral n ASP 224 Ca 0.22 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.53 1ral n ASP 224 Cb 0.43 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.83 1ral n ASP 224 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1ral n LYS 225 N 0.00 -0.79 -0.43 -0.67 2.85 -1.26 -4.74 118.16 113.12 1ral n LYS 225 Ca 0.00 1.03 -0.06 0.00 -1.05 0.00 0.00 58.31 58.22 1ral n LYS 225 Cb 0.00 -1.06 -0.06 0.00 -0.65 0.00 0.00 35.03 33.26 1ral n LYS 225 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1ral n THR 226 N 1.78 1.31 -1.93 0.58 -2.24 -1.26 -1.97 114.28 110.55 1ral n THR 226 Ca -0.01 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1ral n THR 226 Cb 0.30 -1.74 0.00 0.00 -2.10 0.00 0.00 70.33 66.79 1ral n THR 226 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 1ral n TRP 227 N 3.00 0.00 -2.36 4.78 2.14 -1.26 -5.10 117.44 118.64 1ral n TRP 227 Ca 0.20 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.35 1ral n TRP 227 Cb 0.34 0.09 -0.03 0.00 -0.81 0.00 0.00 31.31 30.91 1ral n TRP 227 CO 0.00 0.00 0.00 0.54 2.07 0.00 0.00 177.69 180.30 1ral s VAL 228 N 0.00 3.92 0.05 -1.67 0.11 -0.83 -4.79 120.40 117.19 1ral s VAL 228 Ca 0.00 1.34 0.00 0.00 -2.93 0.00 0.00 61.98 60.39 1ral s VAL 228 Cb 0.00 -3.86 0.00 0.00 -1.53 0.00 0.00 36.38 30.99 1ral s VAL 228 CO 0.00 0.06 0.00 -0.67 -3.33 0.00 0.00 175.10 171.16 1ral n ASP 229 N 4.44 -0.02 -4.64 3.54 -0.08 -1.26 -5.07 116.55 113.46 1ral n ASP 229 Ca 0.10 0.09 -0.43 0.00 -1.51 0.00 0.00 54.79 53.05 1ral n ASP 229 Cb 0.45 0.07 -0.03 0.00 2.34 0.00 0.00 41.12 43.96 1ral n ASP 229 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 1ral s GLN 230 N -2.00 3.95 -1.30 -0.67 1.11 -1.26 -4.90 119.66 114.59 1ral s GLN 230 Ca 0.00 2.02 -0.18 0.00 0.01 0.00 0.00 55.36 57.21 1ral s GLN 230 Cb 0.00 -4.05 0.06 0.00 -1.01 0.00 0.00 33.01 28.01 1ral s GLN 230 CO 0.00 -1.12 1.76 1.17 0.01 0.00 0.00 175.29 177.11 1ral n LYS 231 N 7.49 3.11 0.00 2.91 3.00 -1.26 -4.44 118.16 128.97 1ral n LYS 231 Ca 0.19 -3.22 0.00 0.00 -0.00 0.00 0.00 58.31 55.28 1ral n LYS 231 Cb 0.44 -3.50 0.00 0.00 0.00 0.00 0.00 35.03 31.96 1ral n LYS 231 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1ral n SER 232 N 8.60 0.00 -4.34 3.14 3.41 -1.26 -5.14 113.62 118.03 1ral n SER 232 Ca 0.49 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.67 1ral n SER 232 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1ral n SER 232 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1ral n PRO 233 N 0.00 3.33 -2.56 4.33 -0.04 -1.26 -4.96 135.00 133.84 1ral n PRO 233 Ca 0.00 -3.56 -0.41 0.00 -0.04 0.00 0.00 63.50 59.49 1ral n PRO 233 Cb 0.00 -3.16 -0.03 0.00 -0.04 0.00 0.00 33.50 30.27 1ral n PRO 233 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ral s VAL 234 N 2.17 3.77 0.32 0.52 1.01 -1.26 -4.91 120.40 122.02 1ral s VAL 234 Ca 0.45 0.14 -0.00 0.00 0.00 0.00 0.00 61.98 62.57 1ral s VAL 234 Cb 0.02 -4.95 0.26 0.00 0.00 0.00 0.00 36.38 31.72 1ral s VAL 234 CO 0.02 -1.87 1.99 0.17 0.00 0.00 0.00 175.10 175.40 1ral h LEU 235 N 12.95 0.85 -4.23 3.92 -0.00 -1.94 -3.17 115.31 123.69 1ral h LEU 235 Ca -0.17 -0.02 -0.48 0.00 -0.00 0.00 0.00 57.88 57.20 1ral h LEU 235 Cb 1.04 -0.21 -0.18 0.00 -0.00 0.00 0.00 40.66 41.31 1ral h LEU 235 CO 1.31 0.61 0.48 0.00 -0.00 0.00 0.00 178.44 180.85 1ral n LEU 236 N -4.42 6.64 0.00 0.17 -0.00 -1.26 -0.71 117.00 117.42 1ral n LEU 236 Ca 0.08 -3.93 0.00 0.00 -0.00 0.00 0.00 56.01 52.16 1ral n LEU 236 Cb 0.04 -1.15 0.00 0.00 -0.00 0.00 0.00 43.42 42.30 1ral n LEU 236 CO 0.36 1.57 0.00 -0.67 -0.00 0.00 0.00 177.39 178.66 1ral n ASP 237 N 0.49 0.00 -4.74 1.45 2.03 -1.21 -4.80 116.55 109.77 1ral n ASP 237 Ca 0.45 -0.88 -0.35 0.00 0.52 0.00 0.00 54.79 54.53 1ral n ASP 237 Cb 0.54 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 41.00 1ral n ASP 237 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1ral s ASP 238 N 0.00 4.78 0.00 1.67 -1.08 0.12 -4.86 116.67 117.30 1ral s ASP 238 Ca 0.00 2.29 0.00 0.00 -0.52 0.00 0.00 52.55 54.32 1ral s ASP 238 Cb 0.00 -2.58 0.00 0.00 -1.46 0.00 0.00 42.92 38.88 1ral s ASP 238 CO 0.00 -1.86 0.84 -0.81 0.52 0.00 0.00 175.17 173.86 1ral n PRO 239 N -2.21 0.00 0.15 4.34 -0.04 -1.26 -1.01 135.00 134.97 1ral n PRO 239 Ca 0.13 0.72 -0.15 0.00 -0.04 0.00 0.00 63.50 64.16 1ral n PRO 239 Cb 0.50 -1.34 -0.08 0.00 -0.04 0.00 0.00 33.50 32.54 1ral n PRO 239 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1ral h VAL 240 N 0.00 0.15 -0.77 0.52 2.07 -1.96 -1.71 116.25 114.55 1ral h VAL 240 Ca 0.00 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.68 1ral h VAL 240 Cb 0.00 0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 29.87 1ral h VAL 240 CO 0.00 0.00 0.51 -0.07 0.02 0.00 0.00 177.57 178.03 1ral h LEU 241 N -0.70 0.37 -0.21 2.57 3.38 -1.92 0.28 115.31 119.07 1ral h LEU 241 Ca 0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ral h LEU 241 Cb 0.70 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1ral h LEU 241 CO -0.20 0.19 -0.30 0.00 0.09 0.00 0.00 178.44 178.21 1ral h ALA 243 N 3.35 -0.16 -0.91 0.00 0.00 -0.13 -3.39 119.26 118.02 1ral h ALA 243 Ca 0.00 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.03 1ral h ALA 243 Cb 0.48 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 1ral h ALA 243 CO 0.00 -0.16 0.59 0.82 0.00 0.00 0.00 179.25 180.50 1ral h ILE 244 N -0.30 0.87 -0.42 0.00 2.04 -1.43 0.36 117.51 118.62 1ral h ILE 244 Ca -0.01 -0.27 -0.27 0.00 1.00 0.00 0.00 64.86 65.31 1ral h ILE 244 Cb 0.04 0.01 -0.10 0.00 -0.74 0.00 0.00 36.82 36.03 1ral h ILE 244 CO 0.01 0.14 0.14 0.00 0.00 0.00 0.00 178.15 178.44 1ral n ALA 245 N -2.41 5.54 0.00 1.87 0.00 -1.21 -0.74 120.51 123.56 1ral n ALA 245 Ca 0.17 -1.73 0.00 0.00 0.00 0.00 0.00 53.44 51.89 1ral n ALA 245 Cb 0.42 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.15 1ral n ALA 245 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ral n LYS 246 N 1.22 0.00 0.08 0.00 0.00 0.11 -3.37 118.16 116.20 1ral n LYS 246 Ca 0.32 0.00 0.21 0.00 0.00 0.00 0.00 58.31 58.84 1ral n LYS 246 Cb 0.63 -0.18 0.71 0.00 0.00 0.00 0.00 35.03 36.19 1ral n LYS 246 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 1ral h LYS 247 N 0.00 0.00 -3.40 1.64 1.63 -0.63 -3.06 116.57 112.75 1ral h LYS 247 Ca 0.00 0.00 -0.54 0.00 -0.85 0.00 0.00 60.65 59.26 1ral h LYS 247 Cb 0.00 0.00 -0.40 0.00 -0.60 0.00 0.00 32.23 31.23 1ral h LYS 247 CO 0.00 0.00 -0.76 0.71 -3.45 0.00 0.00 179.45 175.95 1ral s TYR 248 N -4.54 1.09 0.06 1.91 2.02 0.08 -5.06 117.35 112.91 1ral s TYR 248 Ca -0.04 -1.13 -0.31 0.00 -0.37 0.00 0.00 57.07 55.23 1ral s TYR 248 Cb 0.15 -1.21 -0.06 0.00 -0.40 0.00 0.00 41.96 40.43 1ral s TYR 248 CO 0.51 -0.73 1.35 -1.59 -1.57 0.00 0.00 175.55 173.52 1ral s LYS 249 N 1.83 4.33 0.00 -0.62 -2.85 -1.16 -4.35 119.74 116.92 1ral s LYS 249 Ca 0.04 1.97 0.00 0.00 -1.00 0.00 0.00 55.97 56.98 1ral s LYS 249 Cb -0.17 -3.39 0.00 0.00 -2.06 0.00 0.00 37.83 32.21 1ral s LYS 249 CO -0.19 -0.45 0.00 1.04 0.10 0.00 0.00 175.35 175.85 1ral n GLN 250 N 4.49 0.00 -0.02 1.78 1.13 -1.22 -4.96 117.38 118.58 1ral n GLN 250 Ca 0.12 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.17 1ral n GLN 250 Cb 0.44 0.00 -0.00 0.00 0.11 0.00 0.00 30.24 30.79 1ral n GLN 250 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1ral n THR 251 N 0.00 0.03 0.16 5.09 -1.04 -1.22 -4.64 114.28 112.66 1ral n THR 251 Ca 0.00 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1ral n THR 251 Cb 0.00 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 68.53 1ral n THR 251 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1ral n PRO 252 N 0.02 0.08 -0.01 -2.82 -0.04 -1.26 -3.45 135.00 127.51 1ral n PRO 252 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.34 1ral n PRO 252 Cb 0.00 -1.14 -0.09 0.00 -0.04 0.00 0.00 33.50 32.23 1ral n PRO 252 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ral h ALA 253 N 1.45 0.04 -0.40 0.55 0.00 -1.91 0.23 119.26 119.23 1ral h ALA 253 Ca 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1ral h ALA 253 Cb 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1ral h ALA 253 CO 0.00 -0.25 0.18 -0.07 0.00 0.00 0.00 179.25 179.11 1ral h LEU 254 N -0.31 0.53 -0.98 0.00 3.38 -1.82 0.20 115.31 116.31 1ral h LEU 254 Ca 0.01 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1ral h LEU 254 Cb 0.41 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1ral h LEU 254 CO 0.00 0.53 0.17 0.58 0.09 0.00 0.00 178.44 179.81 1ral h VAL 255 N 0.50 1.23 -0.58 1.22 2.07 -1.79 0.86 116.25 119.77 1ral h VAL 255 Ca 0.13 -0.82 0.11 0.00 0.82 0.00 0.00 66.70 66.94 1ral h VAL 255 Cb 0.15 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1ral h VAL 255 CO -0.01 0.31 0.39 0.00 0.02 0.00 0.00 177.57 178.28 1ral h ALA 256 N 1.30 2.09 0.02 1.67 0.00 0.93 -1.89 119.26 123.39 1ral h ALA 256 Ca 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ral h ALA 256 Cb 0.28 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ral h ALA 256 CO -0.01 -0.22 -0.01 1.25 0.00 0.00 0.00 179.25 180.26 1ral h LEU 257 N 0.34 -0.03 -0.79 0.00 7.12 -0.75 -3.36 115.31 117.85 1ral h LEU 257 Ca 0.27 0.00 0.15 0.00 0.13 0.00 0.00 57.88 58.43 1ral h LEU 257 Cb 0.61 0.01 -0.14 0.00 -0.53 0.00 0.00 40.66 40.60 1ral h LEU 257 CO -0.07 0.01 -0.23 0.54 -0.13 0.00 0.00 178.44 178.55 1ral n ARG 258 N -2.22 -0.11 0.10 1.25 5.12 0.27 -0.11 116.66 120.96 1ral n ARG 258 Ca -0.00 1.23 -0.14 0.00 -1.93 0.00 0.00 57.85 57.00 1ral n ARG 258 Cb 0.01 -1.83 -0.07 0.00 -1.16 0.00 0.00 32.46 29.41 1ral n ARG 258 CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 1ral h TYR 259 N 0.00 -1.22 -0.53 -1.55 3.20 -1.64 0.47 116.97 115.71 1ral h TYR 259 Ca 0.34 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.23 1ral h TYR 259 Cb 0.54 0.52 -0.02 0.00 1.54 0.00 0.00 36.73 39.31 1ral h TYR 259 CO -0.64 -0.52 0.25 1.96 -1.64 0.00 0.00 178.16 177.58 1ral h GLN 260 N -0.64 0.76 -0.38 1.82 1.08 -0.65 0.14 115.11 117.23 1ral h GLN 260 Ca 0.03 -0.11 0.06 0.00 -1.45 0.00 0.00 58.65 57.18 1ral h GLN 260 Cb 0.68 -0.14 -0.06 0.00 -0.05 0.00 0.00 27.48 27.92 1ral h GLN 260 CO -0.27 0.63 0.04 -0.07 -0.95 0.00 0.00 178.83 178.20 1ral h LEU 261 N 0.71 -0.08 -1.69 1.46 3.38 -1.16 -0.78 115.31 117.15 1ral h LEU 261 Ca 0.18 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.19 1ral h LEU 261 Cb 0.12 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1ral h LEU 261 CO -0.02 -0.00 -0.18 -0.61 0.09 0.00 0.00 178.44 177.71 1ral h GLN 262 N 0.15 0.00 0.00 1.13 5.75 0.26 -1.85 115.11 120.54 1ral h GLN 262 Ca 0.19 0.00 -0.13 0.00 -0.15 0.00 0.00 58.65 58.56 1ral h GLN 262 Cb 0.24 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 1ral h GLN 262 CO -0.28 0.18 -0.61 0.00 -2.65 0.00 0.00 178.83 175.48 1ral h ARG 263 N 0.00 0.00 -0.26 1.69 3.08 0.70 -3.44 114.38 116.15 1ral h ARG 263 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ral h ARG 263 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1ral h ARG 263 CO 0.02 0.61 0.00 0.41 -1.07 0.00 0.00 179.97 179.94 1ral n GLY 264 N 0.71 0.86 3.06 0.04 0.00 -0.70 -2.56 105.19 106.61 1ral n GLY 264 Ca 0.00 -0.70 -0.18 0.00 0.00 0.00 0.00 46.02 45.14 1ral n GLY 264 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ral s VAL 265 N -1.99 0.78 -0.61 1.61 1.01 -1.13 -4.52 120.40 115.55 1ral s VAL 265 Ca 0.00 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.18 1ral s VAL 265 Cb 0.00 -0.70 0.16 0.00 0.00 0.00 0.00 36.38 35.83 1ral s VAL 265 CO 0.00 0.04 0.53 -0.69 0.00 0.00 0.00 175.10 174.98 1ral s VAL 266 N -0.59 4.89 0.59 2.92 1.01 -0.65 -4.18 120.40 124.39 1ral s VAL 266 Ca 0.01 -2.02 -0.15 0.00 0.00 0.00 0.00 61.98 59.82 1ral s VAL 266 Cb -0.06 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1ral s VAL 266 CO 0.00 -0.89 1.04 -2.16 0.00 0.00 0.00 175.10 173.09 1ral s PRO 267 N 0.94 3.42 -0.18 2.72 0.04 -1.25 -1.62 135.00 139.08 1ral s PRO 267 Ca 0.10 1.08 -0.01 0.00 0.04 0.00 0.00 61.00 62.21 1ral s PRO 267 Cb -0.22 -2.05 -0.00 0.00 0.04 0.00 0.00 34.50 32.27 1ral s PRO 267 CO -0.02 -0.72 -0.13 -0.51 0.04 0.00 0.00 177.00 175.66 1ral s LEU 268 N -4.61 2.55 -0.12 -3.56 2.01 -0.29 0.67 118.68 115.33 1ral s LEU 268 Ca 0.61 -0.47 -0.06 0.00 0.01 0.00 0.00 54.13 54.22 1ral s LEU 268 Cb -0.14 -1.60 -0.04 0.00 0.01 0.00 0.00 46.19 44.42 1ral s LEU 268 CO 0.39 0.04 0.10 0.27 1.01 0.00 0.00 176.35 178.17 1ral s ILE 269 N 1.08 5.19 0.51 -0.59 -5.25 0.11 -4.45 121.20 117.80 1ral s ILE 269 Ca -0.00 0.09 0.08 0.00 -0.99 0.00 0.00 60.65 59.83 1ral s ILE 269 Cb -0.14 -3.26 0.03 0.00 2.95 0.00 0.00 42.46 42.04 1ral s ILE 269 CO -0.03 0.59 0.53 -0.60 -1.79 0.00 0.00 174.94 173.64 1ral s ARG 270 N -0.77 2.40 0.00 0.37 3.52 -1.26 -0.15 118.95 123.06 1ral s ARG 270 Ca 0.13 -1.70 0.00 0.00 -0.13 0.00 0.00 55.73 54.03 1ral s ARG 270 Cb -0.12 -2.41 0.00 0.00 -1.56 0.00 0.00 34.95 30.86 1ral s ARG 270 CO 0.03 -0.55 0.00 0.43 -0.81 0.00 0.00 175.30 174.40 1ral n SER 271 N -1.86 0.00 0.00 -2.12 7.64 -1.26 -4.94 113.62 111.07 1ral n SER 271 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1ral n SER 271 Cb 0.62 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 1ral n SER 271 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1ral n PHE 272 N 1.72 -0.16 -1.90 1.43 3.72 -1.26 -4.96 117.46 116.05 1ral n PHE 272 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 1ral n PHE 272 Cb 0.00 0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.54 1ral n PHE 272 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1ral s ASN 273 N -1.42 6.59 0.12 4.37 0.02 -1.26 -4.81 114.94 118.55 1ral s ASN 273 Ca 0.00 2.42 -0.25 0.00 -1.02 0.00 0.00 52.86 54.01 1ral s ASN 273 Cb 0.00 -2.54 -0.07 0.00 0.02 0.00 0.00 41.25 38.66 1ral s ASN 273 CO 0.00 -0.95 1.43 0.00 0.02 0.00 0.00 177.10 177.60 1ral h ALA 274 N 9.42 -0.51 -0.85 0.60 0.00 -1.97 -3.00 119.26 122.96 1ral h ALA 274 Ca -0.43 0.06 0.22 0.00 0.00 0.00 0.00 54.91 54.76 1ral h ALA 274 Cb 1.20 1.22 -0.16 0.00 0.00 0.00 0.00 17.79 20.05 1ral h ALA 274 CO 0.94 -0.81 -0.04 1.17 0.00 0.00 0.00 179.25 180.51 1ral n LYS 275 N -4.79 -0.07 0.00 0.00 3.00 -1.26 0.53 118.16 115.57 1ral n LYS 275 Ca 0.00 1.28 0.13 0.00 -0.00 0.00 0.00 58.31 59.72 1ral n LYS 275 Cb 0.23 -2.01 0.37 0.00 0.00 0.00 0.00 35.03 33.62 1ral n LYS 275 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1ral n ARG 276 N -5.27 0.47 0.11 1.64 0.63 -1.14 -2.43 116.66 110.67 1ral n ARG 276 Ca 0.18 -0.26 0.04 0.00 -0.92 0.00 0.00 57.85 56.90 1ral n ARG 276 Cb 0.59 -1.49 -0.00 0.00 0.45 0.00 0.00 32.46 32.01 1ral n ARG 276 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 1ral h ILE 277 N 0.62 0.50 0.12 5.15 2.04 0.14 -3.33 117.51 122.76 1ral h ILE 277 Ca 0.00 -1.81 -0.30 0.00 1.00 0.00 0.00 64.86 63.75 1ral h ILE 277 Cb 0.49 2.09 -0.00 0.00 -0.74 0.00 0.00 36.82 38.66 1ral h ILE 277 CO 0.00 0.29 -1.47 0.11 0.00 0.00 0.00 178.15 177.08 1ral h LYS 278 N 0.00 0.25 0.00 2.37 1.57 -1.12 -3.16 116.57 116.48 1ral h LYS 278 Ca -0.06 -0.43 -0.03 0.00 -1.87 0.00 0.00 60.65 58.27 1ral h LYS 278 Cb 1.35 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.82 1ral h LYS 278 CO 0.04 1.13 -0.12 1.05 -0.57 0.00 0.00 179.45 180.98 1ral h GLU 279 N 0.07 0.00 0.00 3.15 4.11 -1.64 -2.78 114.58 117.49 1ral h GLU 279 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.21 1ral h GLU 279 Cb 2.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.26 1ral h GLU 279 CO 0.17 0.12 0.00 1.28 0.07 0.00 0.00 179.01 180.65 1ral n LEU 280 N -4.38 0.32 0.23 3.06 4.32 -1.20 -1.91 117.00 117.43 1ral n LEU 280 Ca -0.03 0.54 0.12 0.00 -0.02 0.00 0.00 56.01 56.62 1ral n LEU 280 Cb 0.19 -0.45 0.28 0.00 -1.62 0.00 0.00 43.42 41.83 1ral n LEU 280 CO 0.35 -0.12 0.83 0.71 -1.22 0.00 0.00 177.39 177.94 1ral h THR 281 N 0.00 0.08 0.00 -5.08 1.35 -1.50 -2.94 112.91 104.81 1ral h THR 281 Ca 0.00 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 1ral h THR 281 Cb 0.54 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 1ral h THR 281 CO 0.00 0.04 0.00 1.56 -0.25 0.00 0.00 175.52 176.87 1ral h GLN 282 N 0.00 0.00 0.00 4.72 7.50 -1.48 -3.32 115.11 122.53 1ral h GLN 282 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1ral h GLN 282 Cb 0.91 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.44 1ral h GLN 282 CO 0.01 0.00 0.13 1.33 -1.50 0.00 0.00 178.83 178.79 1ral n VAL 283 N -2.82 0.44 0.33 -0.54 0.24 -1.11 -0.04 118.33 114.83 1ral n VAL 283 Ca -0.01 0.24 0.05 0.00 -2.04 0.00 0.00 64.34 62.58 1ral n VAL 283 Cb 0.15 -1.24 -0.07 0.00 -1.47 0.00 0.00 33.84 31.22 1ral n VAL 283 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1ral n PHE 284 N -0.97 0.00 1.51 6.34 3.72 -1.25 -4.53 117.46 122.28 1ral n PHE 284 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1ral n PHE 284 Cb 0.13 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 1ral n PHE 284 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1ral n GLU 285 N -1.49 1.02 -2.48 -1.08 0.00 0.94 -4.87 120.64 112.68 1ral n GLU 285 Ca 0.01 -0.02 -0.06 0.00 0.00 0.00 0.00 57.16 57.09 1ral n GLU 285 Cb 0.22 -1.24 -0.01 0.00 0.00 0.00 0.00 31.44 30.40 1ral n GLU 285 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1ral n PHE 286 N -0.25 0.14 -3.75 4.31 3.72 -1.26 -5.16 117.46 115.21 1ral n PHE 286 Ca 0.00 -0.48 -0.09 0.00 -0.05 0.00 0.00 57.45 56.84 1ral n PHE 286 Cb 0.12 -0.04 -0.02 0.00 -0.94 0.00 0.00 39.48 38.61 1ral n PHE 286 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1ral s GLN 287 N -2.32 1.62 -0.10 -1.08 -0.21 -1.26 -5.12 119.66 111.18 1ral s GLN 287 Ca 0.02 -0.87 -0.04 0.00 0.02 0.00 0.00 55.36 54.49 1ral s GLN 287 Cb 0.00 0.59 0.05 0.00 1.00 0.00 0.00 33.01 34.66 1ral s GLN 287 CO 0.01 -0.73 0.19 -1.17 -2.12 0.00 0.00 175.29 171.48 1ral s LEU 288 N -2.88 -0.15 0.35 2.90 2.96 -1.26 -5.09 118.68 115.51 1ral s LEU 288 Ca 0.09 0.39 -0.22 0.00 -0.22 0.00 0.00 54.13 54.17 1ral s LEU 288 Cb -0.04 0.41 -0.10 0.00 0.50 0.00 0.00 46.19 46.96 1ral s LEU 288 CO 0.01 -0.25 0.89 0.00 -1.32 0.00 0.00 176.35 175.68 1ral s ALA 289 N 2.33 3.19 0.52 5.97 0.00 -1.26 -4.89 121.76 127.62 1ral s ALA 289 Ca 0.03 0.36 0.17 0.00 0.00 0.00 0.00 51.96 52.51 1ral s ALA 289 Cb -0.12 -3.06 1.29 0.00 0.00 0.00 0.00 23.12 21.23 1ral s ALA 289 CO -0.07 0.20 2.14 0.66 0.00 0.00 0.00 175.76 178.70 1ral h SER 290 N 2.57 0.00 -0.24 0.00 4.64 -2.01 0.17 113.55 118.68 1ral h SER 290 Ca -0.48 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.81 1ral h SER 290 Cb 1.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1ral h SER 290 CO 0.63 0.00 0.02 1.05 -0.87 0.00 0.00 176.83 177.67 1ral h GLU 291 N 0.00 0.40 0.11 4.77 4.11 -1.99 -0.87 114.58 121.12 1ral h GLU 291 Ca 0.01 -0.12 -0.01 0.00 0.07 0.00 0.00 59.36 59.32 1ral h GLU 291 Cb 0.06 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1ral h GLU 291 CO -0.00 0.55 -0.05 -0.44 0.07 0.00 0.00 179.01 179.14 1ral h ASP 292 N 0.19 -0.13 -0.91 3.06 5.19 -1.57 -0.35 116.42 121.90 1ral h ASP 292 Ca 0.07 -0.29 0.13 0.00 -0.62 0.00 0.00 57.03 56.32 1ral h ASP 292 Cb 0.36 0.03 -0.14 0.00 0.18 0.00 0.00 39.33 39.76 1ral h ASP 292 CO 0.01 0.24 -0.43 -0.03 -3.12 0.00 0.00 179.24 175.90 1ral h MET 293 N -0.51 -0.04 0.00 3.56 4.05 -0.74 0.77 114.93 122.02 1ral h MET 293 Ca -0.02 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.37 1ral h MET 293 Cb 0.42 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 1ral h MET 293 CO 0.03 -0.03 -0.19 0.87 0.23 0.00 0.00 176.91 177.82 1ral h LYS 294 N -0.04 0.00 0.00 0.39 1.79 -0.51 1.14 116.57 119.33 1ral h LYS 294 Ca 0.28 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.75 1ral h LYS 294 Cb 0.55 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 1ral h LYS 294 CO -0.92 0.19 0.00 0.00 -1.08 0.00 0.00 179.45 177.64 1ral n ALA 295 N -2.29 1.98 -0.11 3.86 0.00 0.23 -2.67 120.51 121.51 1ral n ALA 295 Ca -0.01 -0.03 -0.14 0.00 0.00 0.00 0.00 53.44 53.26 1ral n ALA 295 Cb 0.32 -1.38 -0.11 0.00 0.00 0.00 0.00 19.45 18.27 1ral n ALA 295 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ral n LEU 296 N -1.79 2.27 -1.88 0.00 4.77 0.10 -4.47 117.00 116.00 1ral n LEU 296 Ca 0.05 -0.09 -0.11 0.00 -0.03 0.00 0.00 56.01 55.82 1ral n LEU 296 Cb 0.28 -0.49 -0.05 0.00 -2.33 0.00 0.00 43.42 40.83 1ral n LEU 296 CO 0.22 0.77 1.31 -0.67 -1.33 0.00 0.00 177.39 177.70 1ral n ASP 297 N -3.03 5.74 0.00 -1.43 -0.08 0.36 -2.56 116.55 115.55 1ral n ASP 297 Ca -0.37 -2.70 0.00 0.00 -1.51 0.00 0.00 54.79 50.22 1ral n ASP 297 Cb 0.96 -1.21 0.00 0.00 2.34 0.00 0.00 41.12 43.20 1ral n ASP 297 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1ral n GLY 298 N 1.44 0.00 0.33 0.27 0.00 -1.21 -4.92 105.19 101.10 1ral n GLY 298 Ca 0.26 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.53 1ral n GLY 298 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ral h LEU 299 N 0.00 0.41 -1.51 0.99 4.07 -1.67 -3.45 115.31 114.15 1ral h LEU 299 Ca 0.00 0.21 -0.13 0.00 0.08 0.00 0.00 57.88 58.04 1ral h LEU 299 Cb 0.07 0.18 0.01 0.00 1.08 0.00 0.00 40.66 42.01 1ral h LEU 299 CO 0.00 -0.20 -0.01 -3.20 -1.08 0.00 0.00 178.44 173.95 1ral n ASN 300 N -5.12 -0.04 -0.06 -0.43 5.15 0.14 -4.74 115.26 110.16 1ral n ASN 300 Ca 0.32 0.19 -0.05 0.00 -0.60 0.00 0.00 54.58 54.45 1ral n ASN 300 Cb 1.01 -0.16 -0.02 0.00 -0.53 0.00 0.00 39.78 40.09 1ral n ASN 300 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1ral n ARG 301 N 0.24 0.34 0.00 1.20 5.12 -0.62 -4.95 116.66 117.99 1ral n ARG 301 Ca 0.03 0.29 0.00 0.00 -1.93 0.00 0.00 57.85 56.24 1ral n ARG 301 Cb 0.02 -1.28 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 1ral n ARG 301 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1ral n ASN 302 N -3.89 0.00 -4.61 0.55 4.05 -0.73 -5.01 115.26 105.62 1ral n ASN 302 Ca -0.07 0.00 -0.42 0.00 0.45 0.00 0.00 54.58 54.53 1ral n ASN 302 Cb 0.28 0.00 -0.05 0.00 1.23 0.00 0.00 39.78 41.24 1ral n ASN 302 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 1ral s PHE 303 N -1.64 3.17 -0.52 1.20 5.36 -1.17 -4.93 117.98 119.44 1ral s PHE 303 Ca 0.00 0.78 -0.27 0.00 -0.96 0.00 0.00 56.93 56.47 1ral s PHE 303 Cb 0.00 -3.34 -0.01 0.00 -0.34 0.00 0.00 43.02 39.33 1ral s PHE 303 CO 0.00 -0.65 1.77 0.50 -1.46 0.00 0.00 175.22 175.38 1ral s ARG 304 N 3.09 2.94 0.61 10.12 3.52 -1.26 -4.69 118.95 133.28 1ral s ARG 304 Ca 0.34 0.82 0.37 0.00 -0.13 0.00 0.00 55.73 57.13 1ral s ARG 304 Cb -0.14 -4.29 1.98 0.00 -1.56 0.00 0.00 34.95 30.95 1ral s ARG 304 CO 0.14 -2.36 2.24 1.88 -0.81 0.00 0.00 175.30 176.39 1ral h TYR 305 N 13.75 0.00 -3.53 5.12 -1.99 -1.96 -3.40 116.97 124.96 1ral h TYR 305 Ca -0.28 0.00 -0.68 0.00 2.00 0.00 0.00 58.73 59.77 1ral h TYR 305 Cb 1.15 0.00 -0.17 0.00 2.00 0.00 0.00 36.73 39.71 1ral h TYR 305 CO 1.02 0.02 -0.67 1.21 -0.00 0.00 0.00 178.16 179.74 1ral s ASN 306 N -5.59 4.86 0.04 3.88 2.47 -1.26 -4.88 114.94 114.47 1ral s ASN 306 Ca -0.04 0.01 0.01 0.00 0.42 0.00 0.00 52.86 53.26 1ral s ASN 306 Cb 0.13 -1.26 -0.03 0.00 -1.45 0.00 0.00 41.25 38.64 1ral s ASN 306 CO 0.49 0.35 -0.05 0.54 -3.72 0.00 0.00 177.10 174.71 1ral s ASN 307 N -0.99 0.57 0.00 -4.21 6.03 -1.26 -5.15 114.94 109.93 1ral s ASN 307 Ca 0.14 -0.69 0.27 0.00 -1.03 0.00 0.00 52.86 51.55 1ral s ASN 307 Cb -0.11 0.11 1.62 0.00 -3.03 0.00 0.00 41.25 39.84 1ral s ASN 307 CO 0.03 -0.36 1.97 0.00 -2.03 0.00 0.00 177.10 176.71