#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q27 n GLY 2 N 0.00 3.95 0.00 3.17 0.00 -1.26 -5.16 105.19 105.89 1q27 n GLY 2 Ca 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1q27 n GLY 2 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q27 n GLY 3 N 5.00 4.40 3.17 -0.02 0.00 -1.26 -5.12 105.19 111.36 1q27 n GLY 3 Ca 0.00 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.15 1q27 n GLY 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q27 s VAL 4 N -0.98 2.77 -0.55 1.61 0.11 -1.26 -5.05 120.40 117.05 1q27 s VAL 4 Ca 0.00 -1.22 0.04 0.00 -2.93 0.00 0.00 61.98 57.87 1q27 s VAL 4 Cb 0.00 -2.49 0.14 0.00 -1.53 0.00 0.00 36.38 32.50 1q27 s VAL 4 CO 0.00 0.08 0.33 -0.55 -3.33 0.00 0.00 175.10 171.63 1q27 s SER 5 N 1.27 4.20 -0.17 3.54 0.15 -1.26 -5.04 113.70 116.39 1q27 s SER 5 Ca -0.03 -3.20 -0.05 0.00 0.70 0.00 0.00 55.95 53.38 1q27 s SER 5 Cb -0.18 -1.47 0.06 0.00 -1.71 0.00 0.00 66.02 62.72 1q27 s SER 5 CO -0.04 -0.19 0.09 -1.81 1.20 0.00 0.00 173.24 172.49 1q27 s ASP 6 N -0.50 2.36 -0.73 5.45 1.11 -1.26 -5.10 116.67 118.00 1q27 s ASP 6 Ca 0.20 -0.62 -0.23 0.00 0.18 0.00 0.00 52.55 52.09 1q27 s ASP 6 Cb -0.18 -0.25 0.07 0.00 1.07 0.00 0.00 42.92 43.63 1q27 s ASP 6 CO -0.06 -0.35 1.06 -1.61 1.18 0.00 0.00 175.17 175.39 1q27 s GLU 7 N 2.13 3.21 0.01 8.23 0.41 -1.26 -5.01 118.70 126.43 1q27 s GLU 7 Ca 0.02 -0.89 0.02 0.00 -0.41 0.00 0.00 54.97 53.71 1q27 s GLU 7 Cb -0.16 -4.38 -0.04 0.00 -1.78 0.00 0.00 34.13 27.77 1q27 s GLU 7 CO -0.09 -1.88 -0.01 1.03 -0.49 0.00 0.00 175.26 173.81 1q27 s ARG 8 N 4.17 2.70 -0.19 1.61 0.52 -1.26 -4.17 118.95 122.32 1q27 s ARG 8 Ca 0.27 -0.67 -0.07 0.00 -0.52 0.00 0.00 55.73 54.74 1q27 s ARG 8 Cb -0.13 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.69 1q27 s ARG 8 CO 0.07 0.61 0.05 -0.51 0.02 0.00 0.00 175.30 175.54 1q27 s LEU 9 N -1.64 3.65 -0.08 2.53 1.02 -0.16 -4.63 118.68 119.38 1q27 s LEU 9 Ca 0.20 -0.01 0.01 0.00 0.02 0.00 0.00 54.13 54.34 1q27 s LEU 9 Cb -0.11 -1.93 -0.03 0.00 0.02 0.00 0.00 46.19 44.14 1q27 s LEU 9 CO 0.11 0.13 -0.07 -1.81 0.02 0.00 0.00 176.35 174.72 1q27 s ASP 10 N 0.63 4.60 -0.32 2.29 1.01 -1.26 -0.70 116.67 122.92 1q27 s ASP 10 Ca 0.02 -0.06 0.01 0.00 0.71 0.00 0.00 52.55 53.24 1q27 s ASP 10 Cb -0.13 -1.23 0.07 0.00 1.01 0.00 0.00 42.92 42.64 1q27 s ASP 10 CO 0.02 0.33 0.01 -0.22 0.21 0.00 0.00 175.17 175.53 1q27 s LEU 11 N -0.64 4.20 0.03 1.23 2.96 -0.75 -4.58 118.68 121.13 1q27 s LEU 11 Ca 0.10 -1.64 0.07 0.00 -0.22 0.00 0.00 54.13 52.43 1q27 s LEU 11 Cb -0.11 -1.67 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 1q27 s LEU 11 CO 0.02 -0.31 -0.18 0.54 -1.32 0.00 0.00 176.35 175.09 1q27 s VAL 12 N 1.11 2.78 0.00 1.68 0.11 -1.26 0.69 120.40 125.50 1q27 s VAL 12 Ca -0.00 -1.12 0.00 0.00 -2.93 0.00 0.00 61.98 57.92 1q27 s VAL 12 Cb -0.20 -2.15 0.00 0.00 -1.53 0.00 0.00 36.38 32.50 1q27 s VAL 12 CO -0.04 0.38 0.73 0.59 -3.33 0.00 0.00 175.10 173.43 1q27 n ASN 13 N 1.70 0.00 -1.71 3.54 3.02 -0.94 -4.78 115.26 116.10 1q27 n ASN 13 Ca -0.16 0.73 -0.00 0.00 -0.03 0.00 0.00 54.58 55.11 1q27 n ASN 13 Cb 0.52 -0.23 0.03 0.00 -0.61 0.00 0.00 39.78 39.49 1q27 n ASN 13 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1q27 n GLU 14 N -1.61 0.27 0.00 3.52 2.13 -1.26 -5.07 120.64 118.62 1q27 n GLU 14 Ca 0.00 -0.24 0.00 0.00 0.66 0.00 0.00 57.16 57.58 1q27 n GLU 14 Cb 0.00 0.10 0.00 0.00 0.27 0.00 0.00 31.44 31.81 1q27 n GLU 14 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1q27 n ARG 15 N -0.30 0.00 -1.09 5.31 1.85 -1.26 -5.03 116.66 116.14 1q27 n ARG 15 Ca -0.04 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.76 1q27 n ARG 15 Cb 0.57 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.94 1q27 n ARG 15 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1q27 n ASP 16 N -0.92 -0.91 -3.94 2.89 9.92 -1.26 -5.06 116.55 117.27 1q27 n ASP 16 Ca 0.00 -1.78 -0.30 0.00 -0.53 0.00 0.00 54.79 52.18 1q27 n ASP 16 Cb 0.00 0.29 -0.14 0.00 -0.64 0.00 0.00 41.12 40.64 1q27 n ASP 16 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1q27 s GLU 17 N 0.01 2.01 -0.05 -1.24 2.02 -1.26 -5.05 118.70 115.14 1q27 s GLU 17 Ca 0.01 -2.68 -0.31 0.00 0.02 0.00 0.00 54.97 52.01 1q27 s GLU 17 Cb 0.04 -3.30 -0.09 0.00 0.10 0.00 0.00 34.13 30.87 1q27 s GLU 17 CO -0.01 -1.13 2.00 0.28 0.02 0.00 0.00 175.26 176.43 1q27 n VAL 18 N 3.00 0.64 0.14 2.63 0.31 -1.26 -2.21 118.33 121.59 1q27 n VAL 18 Ca 0.07 -0.19 -0.25 0.00 -0.01 0.00 0.00 64.34 63.96 1q27 n VAL 18 Cb 0.32 -2.24 -0.16 0.00 -0.91 0.00 0.00 33.84 30.85 1q27 n VAL 18 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1q27 h VAL 19 N 5.89 1.28 -3.06 2.52 -1.51 -0.06 -3.47 116.25 117.83 1q27 h VAL 19 Ca -0.47 -2.68 -0.06 0.00 -1.23 0.00 0.00 66.70 62.25 1q27 h VAL 19 Cb 1.25 3.05 -0.15 0.00 -2.13 0.00 0.00 31.29 33.30 1q27 h VAL 19 CO 0.95 0.81 -0.04 -0.83 -1.23 0.00 0.00 177.57 177.22 1q27 s GLY 20 N -4.61 -0.33 -0.20 5.19 0.00 -1.02 -5.07 107.32 101.27 1q27 s GLY 20 Ca -0.10 0.29 -0.06 0.00 0.00 0.00 0.00 44.72 44.85 1q27 s GLY 20 CO 0.94 0.02 0.04 1.20 0.00 0.00 0.00 173.10 175.29 1q27 s GLN 21 N -2.92 3.76 -0.20 2.90 1.11 -1.26 -1.81 119.66 121.23 1q27 s GLN 21 Ca -0.03 -0.45 -0.05 0.00 0.01 0.00 0.00 55.36 54.84 1q27 s GLN 21 Cb 0.00 -3.17 -0.03 0.00 -1.01 0.00 0.00 33.01 28.81 1q27 s GLN 21 CO -0.06 0.09 0.01 0.42 0.01 0.00 0.00 175.29 175.77 1q27 s ILE 22 N 0.84 4.07 -0.04 1.08 -1.09 0.12 -5.00 121.20 121.19 1q27 s ILE 22 Ca 0.02 -0.27 -0.04 0.00 -2.23 0.00 0.00 60.65 58.13 1q27 s ILE 22 Cb -0.14 -2.85 -0.04 0.00 -1.58 0.00 0.00 42.46 37.85 1q27 s ILE 22 CO 0.02 0.42 0.18 -0.76 -1.23 0.00 0.00 174.94 173.58 1q27 s LEU 23 N 1.00 4.38 0.21 2.97 1.02 -1.26 -0.98 118.68 126.01 1q27 s LEU 23 Ca 0.02 0.41 0.11 0.00 0.02 0.00 0.00 54.13 54.69 1q27 s LEU 23 Cb -0.14 -2.47 0.01 0.00 0.02 0.00 0.00 46.19 43.61 1q27 s LEU 23 CO 0.02 0.30 1.41 -0.09 0.02 0.00 0.00 176.35 178.01 1q27 h ARG 24 N 4.16 0.00 -0.92 1.70 1.12 -1.95 -3.23 114.38 115.26 1q27 h ARG 24 Ca -0.51 0.00 -0.53 0.00 -1.11 0.00 0.00 59.98 57.83 1q27 h ARG 24 Cb 1.20 0.00 -0.29 0.00 -0.01 0.00 0.00 29.97 30.87 1q27 h ARG 24 CO 0.66 0.76 0.58 0.25 -3.11 0.00 0.00 179.97 179.10 1q27 n THR 25 N -3.38 3.24 -4.20 0.20 -2.24 -1.26 -4.93 114.28 101.70 1q27 n THR 25 Ca 0.00 -2.41 -0.16 0.00 -2.27 0.00 0.00 64.05 59.21 1q27 n THR 25 Cb 0.81 -0.68 -0.14 0.00 -2.10 0.00 0.00 70.33 68.21 1q27 n THR 25 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1q27 s ASP 26 N -1.69 0.82 0.00 3.42 2.15 -1.22 -5.03 116.67 115.11 1q27 s ASP 26 Ca 0.58 -0.20 0.29 0.00 0.43 0.00 0.00 52.55 53.64 1q27 s ASP 26 Cb 0.48 -0.06 1.74 0.00 -0.30 0.00 0.00 42.92 44.78 1q27 s ASP 26 CO 0.06 0.03 2.09 -0.81 -0.17 0.00 0.00 175.17 176.36 1q27 n PRO 27 N 2.63 0.92 -0.33 4.34 -0.04 -1.26 -3.97 135.00 137.30 1q27 n PRO 27 Ca -0.15 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.44 1q27 n PRO 27 Cb 0.57 -1.49 0.31 0.00 -0.04 0.00 0.00 33.50 32.85 1q27 n PRO 27 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1q27 h ALA 28 N 3.84 1.56 -0.41 0.55 0.00 -1.96 0.55 119.26 123.38 1q27 h ALA 28 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1q27 h ALA 28 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1q27 h ALA 28 CO 0.00 -0.18 0.00 1.47 0.00 0.00 0.00 179.25 180.54 1q27 n LEU 29 N -4.88 3.66 -3.45 0.00 -0.00 -1.25 -4.97 117.00 106.10 1q27 n LEU 29 Ca 0.23 -1.85 -0.31 0.00 -0.00 0.00 0.00 56.01 54.07 1q27 n LEU 29 Cb 0.60 -0.53 0.03 0.00 -0.00 0.00 0.00 43.42 43.52 1q27 n LEU 29 CO 0.18 0.55 -0.21 0.54 -0.00 0.00 0.00 177.39 178.45 1q27 n ARG 30 N 0.58 -1.92 -0.88 1.47 1.74 0.19 -4.65 116.66 113.19 1q27 n ARG 30 Ca 0.18 1.42 -0.44 0.00 -0.77 0.00 0.00 57.85 58.24 1q27 n ARG 30 Cb 0.73 -2.70 -0.08 0.00 -1.02 0.00 0.00 32.46 29.38 1q27 n ARG 30 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1q27 n TRP 31 N -0.65 1.06 0.00 -1.55 7.02 -1.26 -3.78 117.44 118.28 1q27 n TRP 31 Ca -0.09 -1.22 0.00 0.00 -1.02 0.00 0.00 57.50 55.16 1q27 n TRP 31 Cb 0.65 -1.31 0.00 0.00 -2.42 0.00 0.00 31.31 28.23 1q27 n TRP 31 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1q27 n GLU 32 N 7.46 0.00 -2.32 -0.99 1.02 -1.26 -4.88 120.64 119.67 1q27 n GLU 32 Ca 0.48 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 57.36 1q27 n GLU 32 Cb 0.41 -0.26 0.01 0.00 -0.02 0.00 0.00 31.44 31.58 1q27 n GLU 32 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1q27 n ARG 33 N -2.75 3.46 -2.30 3.49 1.85 -1.25 -4.14 116.66 115.02 1q27 n ARG 33 Ca 0.00 -4.37 -0.27 0.00 -1.00 0.00 0.00 57.85 52.21 1q27 n ARG 33 Cb 0.26 -2.26 0.04 0.00 -1.05 0.00 0.00 32.46 29.45 1q27 n ARG 33 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1q27 s VAL 34 N -5.25 3.36 -0.36 8.89 1.01 -1.26 -4.65 120.40 122.14 1q27 s VAL 34 Ca 0.49 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 62.33 1q27 s VAL 34 Cb 0.41 -3.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.41 1q27 s VAL 34 CO -0.13 -0.39 0.31 -0.13 0.00 0.00 0.00 175.10 174.76 1q27 s ARG 35 N -5.08 3.40 0.24 2.72 0.52 -1.24 -1.16 118.95 118.34 1q27 s ARG 35 Ca 0.56 -0.63 0.04 0.00 -0.52 0.00 0.00 55.73 55.17 1q27 s ARG 35 Cb -0.11 -3.85 -0.05 0.00 0.52 0.00 0.00 34.95 31.46 1q27 s ARG 35 CO 0.46 -0.56 -0.00 0.08 0.02 0.00 0.00 175.30 175.30 1q27 s VAL 36 N 1.86 1.08 0.21 3.52 1.01 -0.48 -4.17 120.40 123.42 1q27 s VAL 36 Ca 0.08 -2.04 0.11 0.00 0.00 0.00 0.00 61.98 60.13 1q27 s VAL 36 Cb -0.17 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 1q27 s VAL 36 CO 0.11 -0.30 -0.19 -0.69 0.00 0.00 0.00 175.10 174.03 1q27 s VAL 37 N -3.39 2.61 0.24 2.92 1.01 0.44 -2.30 120.40 121.93 1q27 s VAL 37 Ca 0.29 -2.00 -0.14 0.00 0.00 0.00 0.00 61.98 60.13 1q27 s VAL 37 Cb 0.06 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 34.15 1q27 s VAL 37 CO 0.09 -0.17 0.49 0.20 0.00 0.00 0.00 175.10 175.72 1q27 s ASN 38 N -2.88 -0.12 -0.12 3.32 0.01 0.60 -1.12 114.94 114.64 1q27 s ASN 38 Ca 0.24 -0.84 -0.30 0.00 -0.71 0.00 0.00 52.86 51.24 1q27 s ASN 38 Cb -0.08 0.59 0.11 0.00 0.41 0.00 0.00 41.25 42.28 1q27 s ASN 38 CO 0.12 -1.13 0.90 0.00 -1.51 0.00 0.00 177.10 175.48 1q27 s ALA 39 N -3.99 -1.88 -0.14 0.60 0.00 0.09 -1.15 121.76 115.29 1q27 s ALA 39 Ca 0.19 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.64 1q27 s ALA 39 Cb -0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.64 1q27 s ALA 39 CO 0.07 -0.34 -0.14 -0.06 0.00 0.00 0.00 175.76 175.28 1q27 s PHE 40 N -1.23 2.78 -0.22 0.00 0.08 0.30 -0.98 117.98 118.71 1q27 s PHE 40 Ca -0.04 -0.80 -0.12 0.00 0.12 0.00 0.00 56.93 56.09 1q27 s PHE 40 Cb -0.00 -1.85 -0.05 0.00 -0.57 0.00 0.00 43.02 40.55 1q27 s PHE 40 CO 0.03 -0.32 0.21 -0.51 -0.10 0.00 0.00 175.22 174.54 1q27 s LEU 41 N 0.52 4.14 0.05 -0.37 1.43 -1.26 -1.92 118.68 121.27 1q27 s LEU 41 Ca -0.10 0.23 -0.01 0.00 -1.03 0.00 0.00 54.13 53.23 1q27 s LEU 41 Cb -0.16 -2.20 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 1q27 s LEU 41 CO 0.04 0.05 -0.03 -0.60 0.23 0.00 0.00 176.35 176.04 1q27 s ARG 42 N 0.99 0.60 -0.02 1.70 3.00 -0.91 -2.58 118.95 121.72 1q27 s ARG 42 Ca 0.10 -1.17 0.06 0.00 -1.00 0.00 0.00 55.73 53.72 1q27 s ARG 42 Cb -0.13 0.15 -0.01 0.00 0.00 0.00 0.00 34.95 34.95 1q27 s ARG 42 CO 0.04 -0.09 -0.20 -0.80 0.00 0.00 0.00 175.30 174.25 1q27 s ASN 43 N -2.78 2.35 0.53 -2.12 -0.87 -0.48 -2.11 114.94 109.47 1q27 s ASN 43 Ca 0.05 -0.37 0.24 0.00 -1.57 0.00 0.00 52.86 51.21 1q27 s ASN 43 Cb 0.06 -0.35 1.39 0.00 -0.02 0.00 0.00 41.25 42.33 1q27 s ASN 43 CO -0.08 0.23 2.03 -1.28 -2.57 0.00 0.00 177.10 175.43 1q27 h SER 44 N 5.77 0.00 0.90 -1.22 0.87 -1.94 0.35 113.55 118.28 1q27 h SER 44 Ca -0.37 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1q27 h SER 44 Cb 1.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1q27 h SER 44 CO 0.48 0.00 0.00 0.06 -0.53 0.00 0.00 176.83 176.84 1q27 h GLN 45 N 0.00 0.00 0.00 2.24 3.07 -2.01 -3.46 115.11 114.96 1q27 h GLN 45 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.93 1q27 h GLN 45 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.33 1q27 h GLN 45 CO -0.00 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.33 1q27 n GLY 46 N -0.04 0.75 2.96 0.06 0.00 0.12 -5.07 105.19 103.97 1q27 n GLY 46 Ca 0.01 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1q27 n GLY 46 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1q27 s GLN 47 N 0.20 1.56 -0.33 1.61 0.74 -1.05 -4.21 119.66 118.17 1q27 s GLN 47 Ca 0.00 -2.05 -0.11 0.00 0.05 0.00 0.00 55.36 53.25 1q27 s GLN 47 Cb 0.00 -3.10 -0.01 0.00 1.10 0.00 0.00 33.01 31.00 1q27 s GLN 47 CO 0.00 -1.01 0.20 -0.51 -0.55 0.00 0.00 175.29 173.42 1q27 s LEU 48 N 0.57 4.34 -0.40 3.68 1.43 -0.84 -1.38 118.68 126.09 1q27 s LEU 48 Ca 0.13 -0.49 -0.16 0.00 -1.03 0.00 0.00 54.13 52.58 1q27 s LEU 48 Cb -0.21 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 43.95 1q27 s LEU 48 CO -0.07 -0.22 0.36 0.86 0.23 0.00 0.00 176.35 177.51 1q27 s TRP 49 N 1.67 3.21 -0.17 0.29 -0.00 -1.07 -0.44 118.94 122.43 1q27 s TRP 49 Ca 0.05 -0.36 -0.16 0.00 -0.00 0.00 0.00 56.10 55.63 1q27 s TRP 49 Cb -0.17 -2.72 0.04 0.00 -0.00 0.00 0.00 33.47 30.63 1q27 s TRP 49 CO 0.08 -0.58 0.46 0.42 -0.00 0.00 0.00 176.95 177.33 1q27 s ILE 50 N 1.93 0.00 0.90 5.86 1.01 0.59 -4.55 121.20 126.93 1q27 s ILE 50 Ca 0.09 -0.01 -0.10 0.00 0.00 0.00 0.00 60.65 60.63 1q27 s ILE 50 Cb -0.18 -0.64 0.14 0.00 0.01 0.00 0.00 42.46 41.79 1q27 s ILE 50 CO 0.12 -0.01 1.15 -2.16 0.00 0.00 0.00 174.94 174.05 1q27 s PRO 51 N 0.19 1.11 -0.41 2.79 0.04 -1.26 -2.58 135.00 134.89 1q27 s PRO 51 Ca -0.00 1.57 0.06 0.00 0.04 0.00 0.00 61.00 62.67 1q27 s PRO 51 Cb -0.03 -1.74 0.20 0.00 0.04 0.00 0.00 34.50 32.98 1q27 s PRO 51 CO 0.01 -2.57 0.44 -2.13 0.04 0.00 0.00 177.00 172.79 1q27 n ARG 52 N -4.10 0.42 -1.25 4.56 0.63 -1.26 -4.66 116.66 110.99 1q27 n ARG 52 Ca 0.12 -3.11 0.16 0.00 -0.92 0.00 0.00 57.85 54.10 1q27 n ARG 52 Cb 0.52 -1.48 -0.06 0.00 0.45 0.00 0.00 32.46 31.89 1q27 n ARG 52 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1q27 n ARG 53 N 2.25 -2.71 -3.38 -0.14 1.74 -1.26 -4.93 116.66 108.24 1q27 n ARG 53 Ca 0.26 2.01 -0.15 0.00 -0.77 0.00 0.00 57.85 59.20 1q27 n ARG 53 Cb 0.51 -3.23 -0.09 0.00 -1.02 0.00 0.00 32.46 28.63 1q27 n ARG 53 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1q27 s SER 54 N -6.92 1.31 0.27 0.55 1.04 -1.26 -5.02 113.70 103.67 1q27 s SER 54 Ca 0.00 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.86 1q27 s SER 54 Cb 0.00 0.66 0.37 0.00 0.10 0.00 0.00 66.02 67.16 1q27 s SER 54 CO 0.00 -0.38 1.66 1.55 0.98 0.00 0.00 173.24 177.06 1q27 h PRO 55 N 8.24 0.34 -0.01 4.02 0.13 -2.04 -2.99 132.00 139.69 1q27 h PRO 55 Ca -0.13 -0.17 -0.13 0.00 -0.87 0.00 0.00 66.00 64.71 1q27 h PRO 55 Cb 1.09 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 1q27 h PRO 55 CO 0.31 0.70 -0.58 0.66 -0.23 0.00 0.00 178.00 178.86 1q27 h SER 56 N 0.29 0.05 -2.22 1.44 4.64 -2.03 -3.44 113.55 112.27 1q27 h SER 56 Ca 0.03 -0.03 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1q27 h SER 56 Cb 0.85 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.87 1q27 h SER 56 CO 0.07 0.62 -0.54 -0.54 -0.87 0.00 0.00 176.83 175.57 1q27 s LYS 57 N -3.72 2.87 -0.24 4.77 1.02 -1.13 -5.11 119.74 118.20 1q27 s LYS 57 Ca -0.02 -1.08 0.02 0.00 0.02 0.00 0.00 55.97 54.91 1q27 s LYS 57 Cb 0.13 -2.53 0.05 0.00 -0.52 0.00 0.00 37.83 34.96 1q27 s LYS 57 CO 0.76 0.40 -0.12 -1.12 -0.92 0.00 0.00 175.35 174.36 1q27 s SER 58 N -3.79 4.13 0.04 2.83 0.01 -1.26 -4.74 113.70 110.92 1q27 s SER 58 Ca 0.33 -1.24 0.03 0.00 1.31 0.00 0.00 55.95 56.38 1q27 s SER 58 Cb -0.08 -1.48 -0.02 0.00 0.21 0.00 0.00 66.02 64.65 1q27 s SER 58 CO 0.24 -0.16 -0.09 -0.76 0.41 0.00 0.00 173.24 172.88 1q27 s LEU 59 N 1.18 2.21 -0.17 2.44 1.43 -1.26 -5.07 118.68 119.44 1q27 s LEU 59 Ca -0.06 -0.48 -0.25 0.00 -1.03 0.00 0.00 54.13 52.30 1q27 s LEU 59 Cb -0.19 -0.29 -0.23 0.00 0.03 0.00 0.00 46.19 45.52 1q27 s LEU 59 CO -0.06 -0.12 0.51 0.15 0.23 0.00 0.00 176.35 177.06 1q27 h PHE 60 N 4.74 0.00 -1.97 0.29 3.04 -2.03 -3.44 116.94 117.56 1q27 h PHE 60 Ca -0.36 0.00 -0.56 0.00 3.98 0.00 0.00 57.97 61.04 1q27 h PHE 60 Cb 1.20 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.70 1q27 h PHE 60 CO 0.60 1.20 1.50 -2.14 -2.02 0.00 0.00 178.31 177.44 1q27 s PRO 61 N -2.28 2.89 -0.38 6.41 0.02 -1.26 -4.93 135.00 135.47 1q27 s PRO 61 Ca -0.23 1.79 0.03 0.00 0.02 0.00 0.00 61.00 62.61 1q27 s PRO 61 Cb 0.01 -4.41 0.11 0.00 0.02 0.00 0.00 34.50 30.23 1q27 s PRO 61 CO 0.64 -2.37 0.13 1.21 -0.33 0.00 0.00 177.00 176.27 1q27 s ASN 62 N 8.99 4.39 -0.32 2.53 3.84 -1.26 -4.89 114.94 128.22 1q27 s ASN 62 Ca 0.97 -2.29 0.10 0.00 0.21 0.00 0.00 52.86 51.85 1q27 s ASN 62 Cb -0.28 -1.41 0.34 0.00 -0.55 0.00 0.00 41.25 39.36 1q27 s ASN 62 CO 0.32 -0.34 1.36 0.00 -2.79 0.00 0.00 177.10 175.66 1q27 n ALA 63 N 4.04 1.70 -1.41 1.71 0.00 -1.25 -4.53 120.51 120.77 1q27 n ALA 63 Ca 0.04 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1q27 n ALA 63 Cb 0.39 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.00 1q27 n ALA 63 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1q27 n LEU 64 N -1.11 -1.63 -4.33 0.00 4.32 -0.20 -4.46 117.00 109.60 1q27 n LEU 64 Ca -0.13 2.59 -0.18 0.00 -0.02 0.00 0.00 56.01 58.27 1q27 n LEU 64 Cb 0.82 -2.67 -0.10 0.00 -1.62 0.00 0.00 43.42 39.84 1q27 n LEU 64 CO -0.12 -0.48 -0.44 -0.62 -1.22 0.00 0.00 177.39 174.51 1q27 s ASP 65 N -4.73 2.47 1.23 -1.43 2.15 -1.26 -5.03 116.67 110.08 1q27 s ASP 65 Ca 0.00 -0.99 -0.19 0.00 0.43 0.00 0.00 52.55 51.80 1q27 s ASP 65 Cb 0.00 -0.12 0.28 0.00 -0.30 0.00 0.00 42.92 42.78 1q27 s ASP 65 CO 0.00 -0.17 1.00 1.33 -0.17 0.00 0.00 175.17 177.16 1q27 n VAL 66 N -0.24 0.00 -0.11 1.11 0.24 -1.26 -4.23 118.33 113.85 1q27 n VAL 66 Ca -0.09 -0.44 -0.19 0.00 -2.04 0.00 0.00 64.34 61.58 1q27 n VAL 66 Cb 0.60 -1.22 -0.07 0.00 -1.47 0.00 0.00 33.84 31.68 1q27 n VAL 66 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1q27 n SER 67 N -4.72 1.91 -4.49 -1.34 3.41 -0.96 -4.65 113.62 102.78 1q27 n SER 67 Ca 0.14 0.41 -0.25 0.00 -0.26 0.00 0.00 58.87 58.91 1q27 n SER 67 Cb 0.54 -0.84 -0.10 0.00 -0.26 0.00 0.00 64.21 63.54 1q27 n SER 67 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1q27 s VAL 68 N -2.53 2.63 -0.27 -3.33 1.01 -0.15 -4.71 120.40 113.05 1q27 s VAL 68 Ca -0.30 -2.19 -0.33 0.00 0.00 0.00 0.00 61.98 59.15 1q27 s VAL 68 Cb 0.08 -2.35 0.17 0.00 0.00 0.00 0.00 36.38 34.29 1q27 s VAL 68 CO 0.45 -0.30 1.34 -0.83 0.00 0.00 0.00 175.10 175.76 1q27 s GLY 69 N -3.27 -0.06 -0.12 4.51 0.00 -1.26 -0.74 107.32 106.39 1q27 s GLY 69 Ca 0.27 2.36 -0.31 0.00 0.00 0.00 0.00 44.72 47.05 1q27 s GLY 69 CO 0.14 0.88 1.03 -0.32 0.00 0.00 0.00 173.10 174.84 1q27 s GLY 70 N -1.49 -0.33 -0.14 0.20 0.00 -0.27 -4.64 107.32 100.64 1q27 s GLY 70 Ca 0.10 1.59 -0.07 0.00 0.00 0.00 0.00 44.72 46.33 1q27 s GLY 70 CO -0.05 0.65 0.12 0.00 0.00 0.00 0.00 173.10 173.81 1q27 s ALA 71 N -2.19 3.73 0.16 3.20 0.00 -1.26 -0.42 121.76 124.97 1q27 s ALA 71 Ca 0.04 -0.68 -0.30 0.00 0.00 0.00 0.00 51.96 51.02 1q27 s ALA 71 Cb -0.01 -1.97 -0.08 0.00 0.00 0.00 0.00 23.12 21.06 1q27 s ALA 71 CO -0.05 0.45 1.30 0.14 0.00 0.00 0.00 175.76 177.61 1q27 s VAL 72 N -0.51 3.36 0.07 0.00 -7.23 -1.26 -4.97 120.40 109.85 1q27 s VAL 72 Ca 0.12 1.07 -0.31 0.00 -1.81 0.00 0.00 61.98 61.05 1q27 s VAL 72 Cb -0.12 -3.68 -0.07 0.00 0.56 0.00 0.00 36.38 33.07 1q27 s VAL 72 CO 0.02 0.14 1.33 -1.58 -0.31 0.00 0.00 175.10 174.70 1q27 s GLN 73 N 0.27 4.34 0.17 4.82 0.74 -1.26 -4.44 119.66 124.30 1q27 s GLN 73 Ca 0.58 1.96 0.00 0.00 0.05 0.00 0.00 55.36 57.95 1q27 s GLN 73 Cb -0.35 -3.35 0.00 0.00 1.10 0.00 0.00 33.01 30.40 1q27 s GLN 73 CO 0.35 -0.42 0.00 0.43 -0.55 0.00 0.00 175.29 175.11 1q27 n SER 74 N 4.28 0.00 -2.19 6.67 7.64 -1.26 -2.15 113.62 126.61 1q27 n SER 74 Ca 0.11 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.97 1q27 n SER 74 Cb 0.44 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.72 1q27 n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1q27 n GLY 75 N 0.00 1.11 3.51 0.23 0.00 -1.26 -4.92 105.19 103.85 1q27 n GLY 75 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 1q27 n GLY 75 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1q27 n GLU 76 N -1.01 -2.92 -2.76 1.61 4.71 -0.92 -5.04 120.64 114.32 1q27 n GLU 76 Ca -0.14 -1.77 -0.28 0.00 -0.01 0.00 0.00 57.16 54.97 1q27 n GLU 76 Cb 0.75 -1.59 -0.01 0.00 -1.01 0.00 0.00 31.44 29.58 1q27 n GLU 76 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 1q27 s THR 77 N -3.07 4.91 0.53 2.62 2.01 -1.26 -4.90 115.64 116.47 1q27 s THR 77 Ca 0.71 0.23 0.17 0.00 0.31 0.00 0.00 61.69 63.11 1q27 s THR 77 Cb -0.06 -3.83 0.28 0.00 0.01 0.00 0.00 72.50 68.89 1q27 s THR 77 CO 0.54 -0.74 2.16 1.88 -0.69 0.00 0.00 174.62 177.76 1q27 h TYR 78 N 0.53 0.00 -0.15 4.92 0.05 -1.98 -2.27 116.97 118.07 1q27 h TYR 78 Ca -0.47 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.22 1q27 h TYR 78 Cb 1.20 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.94 1q27 h TYR 78 CO 0.58 0.00 -0.24 1.49 -1.05 0.00 0.00 178.16 178.95 1q27 h GLU 79 N 0.00 0.42 -0.94 4.88 4.81 -1.98 -0.35 114.58 121.41 1q27 h GLU 79 Ca 0.00 -0.25 0.04 0.00 -0.13 0.00 0.00 59.36 59.02 1q27 h GLU 79 Cb 0.00 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.35 1q27 h GLU 79 CO -0.00 0.84 0.62 1.49 -0.73 0.00 0.00 179.01 181.23 1q27 h GLU 80 N 0.03 1.13 0.05 1.92 4.57 -1.81 -0.81 114.58 119.67 1q27 h GLU 80 Ca 0.01 -0.07 -0.28 0.00 -1.18 0.00 0.00 59.36 57.84 1q27 h GLU 80 Cb 0.81 -0.26 0.02 0.00 -0.16 0.00 0.00 28.75 29.17 1q27 h GLU 80 CO 0.05 0.75 -1.13 0.00 -1.18 0.00 0.00 179.01 177.51 1q27 h ALA 81 N 1.46 0.08 -0.75 2.92 0.00 -1.46 -2.68 119.26 118.82 1q27 h ALA 81 Ca 0.38 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1q27 h ALA 81 Cb 0.04 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1q27 h ALA 81 CO -0.12 0.69 0.49 0.35 0.00 0.00 0.00 179.25 180.66 1q27 h PHE 82 N 0.35 0.95 -0.06 0.00 3.57 -0.63 0.43 116.94 121.55 1q27 h PHE 82 Ca -0.15 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.31 1q27 h PHE 82 Cb 1.79 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 40.21 1q27 h PHE 82 CO 0.11 0.61 -0.16 -0.09 -2.23 0.00 0.00 178.31 176.55 1q27 h ARG 83 N 1.02 0.22 -0.42 1.11 2.43 -1.20 -1.42 114.38 116.11 1q27 h ARG 83 Ca 0.27 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1q27 h ARG 83 Cb -0.10 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1q27 h ARG 83 CO -0.06 0.76 0.28 -0.09 -1.51 0.00 0.00 179.97 179.35 1q27 h ARG 84 N -0.29 0.56 -0.32 0.20 2.43 -1.21 0.54 114.38 116.29 1q27 h ARG 84 Ca -0.00 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 1q27 h ARG 84 Cb 0.77 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.18 1q27 h ARG 84 CO 0.03 0.37 -0.20 0.93 -1.51 0.00 0.00 179.97 179.59 1q27 h GLU 85 N 0.57 0.59 -0.27 0.20 4.39 -0.98 -1.49 114.58 117.59 1q27 h GLU 85 Ca 0.16 -0.21 -0.08 0.00 0.34 0.00 0.00 59.36 59.57 1q27 h GLU 85 Cb -0.06 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 1q27 h GLU 85 CO -0.03 0.75 -0.13 0.00 -1.16 0.00 0.00 179.01 178.44 1q27 h ALA 86 N 1.26 0.37 -0.02 3.43 0.00 -0.78 -1.00 119.26 122.53 1q27 h ALA 86 Ca 0.08 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1q27 h ALA 86 Cb 0.63 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1q27 h ALA 86 CO 0.04 0.24 -0.41 -0.09 0.00 0.00 0.00 179.25 179.04 1q27 h ARG 87 N 0.29 0.04 0.00 0.00 2.43 -0.81 0.41 114.38 116.75 1q27 h ARG 87 Ca 0.06 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1q27 h ARG 87 Cb 0.64 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1q27 h ARG 87 CO 0.04 0.45 -0.19 0.93 -1.51 0.00 0.00 179.97 179.68 1q27 h GLU 88 N 0.04 0.00 0.00 0.20 5.08 -1.16 -3.04 114.58 115.70 1q27 h GLU 88 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1q27 h GLU 88 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1q27 h GLU 88 CO 0.06 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.46 1q27 n GLU 89 N -2.74 0.00 -0.01 2.33 1.02 -0.39 -4.70 120.64 116.15 1q27 n GLU 89 Ca 0.04 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.31 1q27 n GLU 89 Cb 0.50 -0.04 0.41 0.00 -0.02 0.00 0.00 31.44 32.29 1q27 n GLU 89 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1q27 n LEU 90 N -1.09 1.89 -2.67 -4.62 4.32 -0.70 -3.79 117.00 110.34 1q27 n LEU 90 Ca 0.00 -0.66 -0.21 0.00 -0.02 0.00 0.00 56.01 55.12 1q27 n LEU 90 Cb 0.00 -0.02 0.01 0.00 -1.62 0.00 0.00 43.42 41.79 1q27 n LEU 90 CO 0.00 0.33 -0.15 0.59 -1.22 0.00 0.00 177.39 176.94 1q27 n ASN 91 N 0.48 -5.90 -0.04 -1.43 3.02 0.05 -4.88 115.26 106.57 1q27 n ASN 91 Ca 0.18 -0.13 -0.12 0.00 -0.03 0.00 0.00 54.58 54.48 1q27 n ASN 91 Cb 0.41 -4.85 -0.14 0.00 -0.61 0.00 0.00 39.78 34.58 1q27 n ASN 91 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1q27 n VAL 92 N -4.19 1.59 -1.57 2.41 0.31 -1.16 -4.85 118.33 110.86 1q27 n VAL 92 Ca -0.19 -0.77 -0.12 0.00 -0.01 0.00 0.00 64.34 63.26 1q27 n VAL 92 Cb 0.66 -1.09 -0.04 0.00 -0.91 0.00 0.00 33.84 32.46 1q27 n VAL 92 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1q27 n GLU 93 N -3.09 -0.87 -2.69 5.55 1.02 -1.26 -3.32 120.64 115.99 1q27 n GLU 93 Ca -0.25 0.84 -0.06 0.00 -0.02 0.00 0.00 57.16 57.66 1q27 n GLU 93 Cb 1.07 -4.88 -0.01 0.00 -0.02 0.00 0.00 31.44 27.59 1q27 n GLU 93 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1q27 n ILE 94 N -3.00 0.00 -1.81 -3.67 -5.35 -1.26 -4.59 119.36 99.68 1q27 n ILE 94 Ca -0.13 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.35 1q27 n ILE 94 Cb 0.45 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 1q27 n ILE 94 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1q27 n ASP 95 N -1.54 0.00 -0.03 7.28 9.92 -1.21 -4.73 116.55 126.24 1q27 n ASP 95 Ca 0.02 -1.49 -0.03 0.00 -0.53 0.00 0.00 54.79 52.75 1q27 n ASP 95 Cb 0.46 -0.10 -0.04 0.00 -0.64 0.00 0.00 41.12 40.80 1q27 n ASP 95 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1q27 n ALA 96 N 0.00 1.87 -1.83 2.24 0.00 -1.21 -4.97 120.51 116.61 1q27 n ALA 96 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1q27 n ALA 96 Cb 0.60 0.20 0.00 0.00 0.00 0.00 0.00 19.45 20.25 1q27 n ALA 96 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1q27 n LEU 97 N -2.34 0.00 0.00 0.00 4.77 -1.26 -5.13 117.00 113.04 1q27 n LEU 97 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1q27 n LEU 97 Cb 0.66 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1q27 n LEU 97 CO 0.10 0.00 0.00 -0.24 -1.33 0.00 0.00 177.39 175.92 1q27 n SER 98 N -0.25 0.00 -4.40 -1.43 2.88 -1.26 -5.02 113.62 104.14 1q27 n SER 98 Ca 0.00 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.31 1q27 n SER 98 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 1q27 n SER 98 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1q27 s TRP 99 N 0.00 1.94 -0.30 0.66 1.48 -1.26 -1.47 118.94 119.99 1q27 s TRP 99 Ca 0.00 -1.01 -0.17 0.00 -1.06 0.00 0.00 56.10 53.85 1q27 s TRP 99 Cb 0.00 -1.29 0.20 0.00 -1.16 0.00 0.00 33.47 31.22 1q27 s TRP 99 CO 0.00 -0.03 1.25 1.03 -4.06 0.00 0.00 176.95 175.14 1q27 s ARG 100 N -3.85 0.06 0.16 3.25 1.81 -0.52 -4.96 118.95 114.90 1q27 s ARG 100 Ca 0.33 0.12 -0.32 0.00 -1.72 0.00 0.00 55.73 54.13 1q27 s ARG 100 Cb 0.07 0.04 -0.12 0.00 -0.45 0.00 0.00 34.95 34.49 1q27 s ARG 100 CO 0.15 -0.02 1.74 -2.30 -0.68 0.00 0.00 175.30 174.19 1q27 n PRO 101 N 3.73 2.65 0.00 3.54 -0.02 -1.26 -1.65 135.00 141.99 1q27 n PRO 101 Ca -0.13 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 1q27 n PRO 101 Cb 0.56 -2.81 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1q27 n PRO 101 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1q27 n LEU 102 N 4.51 0.17 -3.91 2.45 7.94 -0.98 -4.86 117.00 122.33 1q27 n LEU 102 Ca 0.17 -0.33 -0.09 0.00 -1.11 0.00 0.00 56.01 54.64 1q27 n LEU 102 Cb 0.34 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.23 1q27 n LEU 102 CO 0.65 0.04 0.02 0.00 -1.11 0.00 0.00 177.39 176.99 1q27 s ALA 103 N -0.33 -0.17 -0.30 1.96 0.00 -0.09 -5.03 121.76 117.80 1q27 s ALA 103 Ca 0.00 -0.75 -0.19 0.00 0.00 0.00 0.00 51.96 51.02 1q27 s ALA 103 Cb 0.00 0.82 0.20 0.00 0.00 0.00 0.00 23.12 24.13 1q27 s ALA 103 CO 0.00 -0.65 1.30 -1.54 0.00 0.00 0.00 175.76 174.87 1q27 s SER 104 N -2.94 -0.05 0.13 0.00 1.04 -1.26 -1.08 113.70 109.54 1q27 s SER 104 Ca 0.14 0.07 -0.00 0.00 0.48 0.00 0.00 55.95 56.64 1q27 s SER 104 Cb 0.03 1.06 -0.04 0.00 0.10 0.00 0.00 66.02 67.16 1q27 s SER 104 CO -0.02 -0.01 0.03 -0.36 0.98 0.00 0.00 173.24 173.86 1q27 s PHE 105 N 1.98 0.89 0.39 5.02 0.08 -0.94 -4.99 117.98 120.40 1q27 s PHE 105 Ca 0.00 -1.16 0.05 0.00 0.12 0.00 0.00 56.93 55.94 1q27 s PHE 105 Cb -0.01 -0.51 -0.06 0.00 -0.57 0.00 0.00 43.02 41.87 1q27 s PHE 105 CO -0.16 -0.42 0.04 -1.54 -0.10 0.00 0.00 175.22 173.04 1q27 s SER 106 N -3.06 3.21 -1.15 1.36 1.04 -1.26 -2.19 113.70 111.65 1q27 s SER 106 Ca 0.21 -1.44 -0.17 0.00 0.48 0.00 0.00 55.95 55.03 1q27 s SER 106 Cb 0.07 -0.06 -0.06 0.00 0.10 0.00 0.00 66.02 66.07 1q27 s SER 106 CO 0.00 -0.61 2.14 -0.81 0.98 0.00 0.00 173.24 174.94 1q27 n PRO 107 N -0.89 2.29 -3.23 4.02 -0.04 -1.25 -4.42 135.00 131.48 1q27 n PRO 107 Ca -0.06 -2.19 -0.20 0.00 -0.04 0.00 0.00 63.50 61.01 1q27 n PRO 107 Cb 0.67 -3.05 -0.07 0.00 -0.04 0.00 0.00 33.50 31.00 1q27 n PRO 107 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1q27 s PHE 108 N 3.91 0.26 -1.32 0.54 5.36 -1.26 -4.91 117.98 120.56 1q27 s PHE 108 Ca 0.52 -1.72 -0.08 0.00 -0.96 0.00 0.00 56.93 54.69 1q27 s PHE 108 Cb 0.14 -0.55 0.01 0.00 -0.34 0.00 0.00 43.02 42.28 1q27 s PHE 108 CO 0.00 -0.96 1.15 1.04 -1.46 0.00 0.00 175.22 175.00 1q27 n GLN 109 N 3.05 -7.73 -1.40 10.12 6.02 -1.26 -5.00 117.38 121.18 1q27 n GLN 109 Ca 0.24 0.81 0.00 0.00 -0.01 0.00 0.00 57.00 58.04 1q27 n GLN 109 Cb 0.49 -5.80 0.00 0.00 1.02 0.00 0.00 30.24 25.96 1q27 n GLN 109 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1q27 n THR 110 N -4.91 0.00 -0.00 5.09 -1.04 -1.26 -5.07 114.28 107.09 1q27 n THR 110 Ca -0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.83 1q27 n THR 110 Cb 0.56 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.93 1q27 n THR 110 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1q27 n THR 111 N 0.00 1.73 -2.39 12.58 -2.24 -1.26 -4.89 114.28 117.81 1q27 n THR 111 Ca 0.00 -0.70 -0.41 0.00 -2.27 0.00 0.00 64.05 60.67 1q27 n THR 111 Cb 0.00 -1.52 -0.04 0.00 -2.10 0.00 0.00 70.33 66.67 1q27 n THR 111 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1q27 s LEU 112 N -6.75 4.46 0.00 3.22 1.02 -1.26 -4.92 118.68 114.45 1q27 s LEU 112 Ca -0.17 2.23 0.22 0.00 0.02 0.00 0.00 54.13 56.43 1q27 s LEU 112 Cb 0.07 -3.61 1.16 0.00 0.02 0.00 0.00 46.19 43.84 1q27 s LEU 112 CO 0.79 -0.34 1.77 -1.20 0.02 0.00 0.00 176.35 177.39 1q27 n SER 113 N 2.34 0.42 -3.31 2.29 7.64 -1.26 -4.31 113.62 117.43 1q27 n SER 113 Ca 0.04 -1.41 -0.10 0.00 1.01 0.00 0.00 58.87 58.40 1q27 n SER 113 Cb 0.45 -0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.62 1q27 n SER 113 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1q27 s SER 114 N -1.67 0.18 -0.79 6.43 0.15 -1.26 -4.68 113.70 112.07 1q27 s SER 114 Ca 0.33 -1.12 -0.25 0.00 0.70 0.00 0.00 55.95 55.61 1q27 s SER 114 Cb 0.16 0.75 0.05 0.00 -1.71 0.00 0.00 66.02 65.26 1q27 s SER 114 CO 0.26 -1.46 1.23 0.12 1.20 0.00 0.00 173.24 174.59 1q27 s PHE 115 N -3.00 2.46 0.11 3.44 5.36 -0.31 -3.74 117.98 122.31 1q27 s PHE 115 Ca 0.20 -0.38 -0.02 0.00 -0.96 0.00 0.00 56.93 55.76 1q27 s PHE 115 Cb -0.03 -4.55 -0.03 0.00 -0.34 0.00 0.00 43.02 38.06 1q27 s PHE 115 CO 0.13 -1.93 0.07 0.00 -1.46 0.00 0.00 175.22 172.03 1q27 s MET 116 N 5.06 0.87 0.39 10.12 0.23 -0.93 -1.39 119.30 133.65 1q27 s MET 116 Ca 0.34 -1.33 0.08 0.00 -1.03 0.00 0.00 55.69 53.75 1q27 s MET 116 Cb -0.08 0.26 -0.03 0.00 -1.53 0.00 0.00 34.83 33.44 1q27 s MET 116 CO 0.08 -0.24 0.27 0.00 -2.03 0.00 0.00 175.02 173.10 1q27 s VAL 118 N -2.47 0.18 -0.12 0.00 1.01 -0.24 -0.29 120.40 118.47 1q27 s VAL 118 Ca 0.43 0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.59 1q27 s VAL 118 Cb -0.02 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 1q27 s VAL 118 CO 0.25 0.18 -0.08 -0.31 0.00 0.00 0.00 175.10 175.15 1q27 s TYR 119 N 2.05 2.93 -0.18 5.22 2.02 -0.30 -0.91 117.35 128.18 1q27 s TYR 119 Ca 0.05 -0.29 -0.11 0.00 -0.37 0.00 0.00 57.07 56.35 1q27 s TYR 119 Cb -0.13 -1.84 -0.05 0.00 -0.40 0.00 0.00 41.96 39.54 1q27 s TYR 119 CO -0.05 0.03 0.18 -1.21 -1.57 0.00 0.00 175.55 172.93 1q27 s GLU 120 N -0.02 4.14 0.20 -0.62 2.02 -0.66 -0.54 118.70 123.21 1q27 s GLU 120 Ca -0.01 -0.12 -0.03 0.00 0.02 0.00 0.00 54.97 54.84 1q27 s GLU 120 Cb -0.14 -3.40 -0.03 0.00 0.10 0.00 0.00 34.13 30.66 1q27 s GLU 120 CO 0.03 0.33 0.17 -0.48 0.02 0.00 0.00 175.26 175.33 1q27 s LEU 121 N 0.24 1.11 0.27 1.80 2.34 -0.81 -1.43 118.68 122.21 1q27 s LEU 121 Ca 0.11 -1.30 -0.29 0.00 0.06 0.00 0.00 54.13 52.71 1q27 s LEU 121 Cb -0.12 0.56 -0.09 0.00 -0.56 0.00 0.00 46.19 45.98 1q27 s LEU 121 CO 0.00 -0.87 1.12 -0.13 -1.06 0.00 0.00 176.35 175.42 1q27 s ARG 122 N -4.12 4.61 0.12 1.48 0.52 -0.54 -2.15 118.95 118.87 1q27 s ARG 122 Ca 0.35 1.84 0.05 0.00 -0.52 0.00 0.00 55.73 57.45 1q27 s ARG 122 Cb 0.06 -3.19 -0.04 0.00 0.52 0.00 0.00 34.95 32.30 1q27 s ARG 122 CO 0.10 0.16 0.03 0.45 0.02 0.00 0.00 175.30 176.06 1q27 s SER 123 N -0.75 5.08 0.00 0.23 0.15 -0.90 -4.78 113.70 112.74 1q27 s SER 123 Ca 0.46 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.89 1q27 s SER 123 Cb -0.32 -1.21 0.00 0.00 -1.71 0.00 0.00 66.02 62.77 1q27 s SER 123 CO 0.41 0.14 0.00 0.47 1.20 0.00 0.00 173.24 175.46 1q27 n ASP 124 N 0.24 1.98 -0.71 5.45 9.92 -1.26 -4.82 116.55 127.35 1q27 n ASP 124 Ca -0.10 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.16 1q27 n ASP 124 Cb 0.53 0.04 0.00 0.00 -0.64 0.00 0.00 41.12 41.05 1q27 n ASP 124 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1q27 n ALA 125 N -1.84 0.00 -2.89 2.24 0.00 -1.26 -5.17 120.51 111.59 1q27 n ALA 125 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1q27 n ALA 125 Cb 0.24 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.64 1q27 n ALA 125 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1q27 s THR 126 N -2.28 5.28 0.00 0.00 2.01 -1.26 -5.05 115.64 114.34 1q27 s THR 126 Ca 0.00 -0.34 0.00 0.00 0.31 0.00 0.00 61.69 61.66 1q27 s THR 126 Cb 0.00 -3.52 0.00 0.00 0.01 0.00 0.00 72.50 68.99 1q27 s THR 126 CO 0.00 0.22 0.00 -0.81 -0.69 0.00 0.00 174.62 173.34 1q27 n PRO 127 N 0.60 1.04 -1.59 4.92 -0.04 -1.26 -4.78 135.00 133.90 1q27 n PRO 127 Ca -0.08 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.10 1q27 n PRO 127 Cb 0.52 0.00 0.21 0.00 -0.04 0.00 0.00 33.50 34.19 1q27 n PRO 127 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1q27 n ILE 128 N -0.96 0.00 0.02 0.52 -5.35 -1.25 -4.97 119.36 107.37 1q27 n ILE 128 Ca 0.00 -0.81 -0.01 0.00 -0.27 0.00 0.00 62.75 61.67 1q27 n ILE 128 Cb 0.00 -1.45 -0.00 0.00 -1.74 0.00 0.00 39.64 36.45 1q27 n ILE 128 CO 0.00 0.00 0.00 0.15 -1.76 0.00 0.00 176.55 174.94 1q27 h PHE 129 N -2.00 -0.05 -5.68 4.28 3.04 -1.90 -3.46 116.94 111.16 1q27 h PHE 129 Ca -0.41 -0.00 -0.12 0.00 3.98 0.00 0.00 57.97 61.42 1q27 h PHE 129 Cb 1.16 0.02 0.00 0.00 2.56 0.00 0.00 35.95 39.69 1q27 h PHE 129 CO 0.00 -0.03 -0.49 -1.71 -2.02 0.00 0.00 178.31 174.05 1q27 n ASN 130 N -2.47 -7.16 -2.09 0.41 2.85 -1.26 -4.27 115.26 101.27 1q27 n ASN 130 Ca -0.01 0.02 -0.15 0.00 -0.11 0.00 0.00 54.58 54.33 1q27 n ASN 130 Cb 0.02 -4.37 -0.14 0.00 1.24 0.00 0.00 39.78 36.53 1q27 n ASN 130 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1q27 n PRO 131 N -1.14 2.07 0.00 1.20 -0.05 -1.26 -3.28 135.00 132.54 1q27 n PRO 131 Ca -0.01 -1.27 0.00 0.00 -0.05 0.00 0.00 63.50 62.17 1q27 n PRO 131 Cb 0.54 -2.01 0.00 0.00 -0.05 0.00 0.00 33.50 31.97 1q27 n PRO 131 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 175.50 175.54 1q27 n ASN 132 N 2.14 0.00 -0.10 3.54 3.02 -1.26 -4.98 115.26 117.62 1q27 n ASN 132 Ca 0.44 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.85 1q27 n ASN 132 Cb 0.84 0.03 -0.05 0.00 -0.61 0.00 0.00 39.78 39.99 1q27 n ASN 132 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1q27 n ASP 133 N -2.08 1.93 -3.57 6.41 8.00 -1.24 -4.96 116.55 121.03 1q27 n ASP 133 Ca 0.00 0.36 -0.26 0.00 0.71 0.00 0.00 54.79 55.60 1q27 n ASP 133 Cb 0.00 -0.77 -0.16 0.00 -0.02 0.00 0.00 41.12 40.17 1q27 n ASP 133 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1q27 s ILE 134 N -2.76 -0.12 0.35 0.53 1.09 -1.21 -4.91 121.20 114.18 1q27 s ILE 134 Ca -0.30 -0.30 0.06 0.00 -1.10 0.00 0.00 60.65 59.01 1q27 s ILE 134 Cb 0.06 -0.69 0.30 0.00 -1.06 0.00 0.00 42.46 41.07 1q27 s ILE 134 CO 0.43 -0.38 1.94 0.28 -0.10 0.00 0.00 174.94 177.11 1q27 h SER 135 N 8.40 0.69 0.00 3.58 0.02 -1.74 -3.41 113.55 121.09 1q27 h SER 135 Ca -0.16 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1q27 h SER 135 Cb 1.12 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.52 1q27 h SER 135 CO 0.32 0.43 0.00 0.61 -1.14 0.00 0.00 176.83 177.05 1q27 n GLY 136 N -1.44 0.50 0.00 -3.77 0.00 -1.26 -4.76 105.19 94.46 1q27 n GLY 136 Ca 0.12 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1q27 n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q27 n GLY 137 N 1.39 -2.48 3.44 -0.02 0.00 -1.26 -4.90 105.19 101.37 1q27 n GLY 137 Ca 0.00 -0.96 -0.22 0.00 0.00 0.00 0.00 46.02 44.83 1q27 n GLY 137 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1q27 s GLU 138 N 0.00 1.73 -0.56 1.61 2.12 -1.06 -4.74 118.70 117.80 1q27 s GLU 138 Ca 0.00 -2.01 -0.17 0.00 0.36 0.00 0.00 54.97 53.15 1q27 s GLU 138 Cb 0.00 -0.56 0.12 0.00 0.26 0.00 0.00 34.13 33.95 1q27 s GLU 138 CO 0.00 -0.37 0.57 -1.58 -0.54 0.00 0.00 175.26 173.34 1q27 s TRP 139 N -3.36 3.18 0.48 5.30 0.52 -1.26 -0.30 118.94 123.50 1q27 s TRP 139 Ca 0.31 -1.20 0.08 0.00 0.02 0.00 0.00 56.10 55.31 1q27 s TRP 139 Cb 0.05 -3.87 0.04 0.00 -1.15 0.00 0.00 33.47 28.54 1q27 s TRP 139 CO 0.15 -1.10 0.62 -0.51 0.02 0.00 0.00 176.95 176.12 1q27 s LEU 140 N 1.90 3.36 0.36 2.99 1.43 0.42 -4.95 118.68 124.19 1q27 s LEU 140 Ca 0.06 -0.67 -0.02 0.00 -1.03 0.00 0.00 54.13 52.47 1q27 s LEU 140 Cb -0.28 -2.12 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 1q27 s LEU 140 CO 0.04 -0.98 0.59 0.42 0.23 0.00 0.00 176.35 176.65 1q27 s THR 141 N -2.51 5.05 0.15 5.49 -4.23 -1.26 -1.98 115.64 116.36 1q27 s THR 141 Ca 0.55 -0.22 -0.12 0.00 -1.18 0.00 0.00 61.69 60.72 1q27 s THR 141 Cb -0.07 -3.84 0.03 0.00 1.34 0.00 0.00 72.50 69.96 1q27 s THR 141 CO 0.34 -0.56 1.62 1.55 -0.54 0.00 0.00 174.62 177.03 1q27 h PRO 142 N 0.85 0.87 -0.14 3.99 0.13 -1.91 0.13 132.00 135.93 1q27 h PRO 142 Ca -0.49 -0.25 -0.14 0.00 -0.87 0.00 0.00 66.00 64.25 1q27 h PRO 142 Cb 1.21 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1q27 h PRO 142 CO 0.62 0.88 -0.50 1.49 -0.23 0.00 0.00 178.00 180.26 1q27 h GLU 143 N 0.75 0.37 -0.00 0.86 4.81 -1.95 -2.78 114.58 116.63 1q27 h GLU 143 Ca 0.15 -0.21 -0.23 0.00 -0.13 0.00 0.00 59.36 58.94 1q27 h GLU 143 Cb 0.45 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1q27 h GLU 143 CO 0.02 0.79 -0.94 0.45 -0.73 0.00 0.00 179.01 178.59 1q27 h HIS 144 N 0.29 0.62 0.89 0.92 3.86 -1.92 -2.01 115.15 117.80 1q27 h HIS 144 Ca 0.01 -0.34 -0.04 0.00 -1.16 0.00 0.00 60.37 58.84 1q27 h HIS 144 Cb 0.99 -0.07 0.01 0.00 1.06 0.00 0.00 27.41 29.40 1q27 h HIS 144 CO 0.03 1.16 -0.43 1.25 0.86 0.00 0.00 177.93 180.80 1q27 h LEU 145 N 0.24 -1.01 -1.40 2.43 7.12 -0.65 0.13 115.31 122.17 1q27 h LEU 145 Ca -0.08 0.03 -0.06 0.00 0.13 0.00 0.00 57.88 57.90 1q27 h LEU 145 Cb 1.58 0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 41.96 1q27 h LEU 145 CO 0.16 -0.70 -0.22 -0.07 -0.13 0.00 0.00 178.44 177.49 1q27 h LEU 146 N -1.23 0.12 -0.38 2.25 -0.00 -1.61 -1.29 115.31 113.16 1q27 h LEU 146 Ca -0.12 -0.03 -0.13 0.00 -0.00 0.00 0.00 57.88 57.60 1q27 h LEU 146 Cb 0.92 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.54 1q27 h LEU 146 CO 0.20 0.34 -0.28 0.00 -0.00 0.00 0.00 178.44 178.70 1q27 h ALA 147 N 1.67 0.54 0.16 1.53 0.00 -1.19 -1.80 119.26 120.17 1q27 h ALA 147 Ca 0.02 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1q27 h ALA 147 Cb 0.45 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1q27 h ALA 147 CO 0.03 0.57 -0.08 -0.09 0.00 0.00 0.00 179.25 179.69 1q27 h ARG 148 N 0.67 -0.21 -0.26 0.00 2.43 -0.48 -2.95 114.38 113.58 1q27 h ARG 148 Ca 0.07 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.33 1q27 h ARG 148 Cb 0.86 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 1q27 h ARG 148 CO 0.08 0.22 0.21 -0.84 -1.51 0.00 0.00 179.97 178.13 1q27 h ILE 149 N -0.87 0.69 -0.00 1.20 3.07 -1.34 0.69 117.51 120.95 1q27 h ILE 149 Ca -0.02 0.00 -0.14 0.00 1.55 0.00 0.00 64.86 66.25 1q27 h ILE 149 Cb 0.52 0.84 -0.02 0.00 -0.27 0.00 0.00 36.82 37.90 1q27 h ILE 149 CO 0.04 0.00 -0.66 0.00 -1.05 0.00 0.00 178.15 176.48 1q27 h ALA 150 N 1.82 0.91 0.02 0.16 0.00 -1.34 -3.17 119.26 117.66 1q27 h ALA 150 Ca 0.12 -0.60 -0.24 0.00 0.00 0.00 0.00 54.91 54.20 1q27 h ALA 150 Cb 0.54 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.24 1q27 h ALA 150 CO -0.00 0.82 -0.99 0.00 0.00 0.00 0.00 179.25 179.08 1q27 h ALA 151 N 1.34 0.31 0.00 0.00 0.00 -0.70 -3.48 119.26 116.72 1q27 h ALA 151 Ca -0.01 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1q27 h ALA 151 Cb 1.16 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1q27 h ALA 151 CO 0.09 0.81 0.00 0.41 0.00 0.00 0.00 179.25 180.56 1q27 n GLY 152 N 1.03 0.62 2.37 0.00 0.00 -0.86 -5.04 105.19 103.30 1q27 n GLY 152 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 1q27 n GLY 152 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1q27 n GLU 153 N 0.00 2.41 -2.40 1.61 4.71 -1.16 -4.86 120.64 120.94 1q27 n GLU 153 Ca 0.00 -2.68 -0.04 0.00 -0.01 0.00 0.00 57.16 54.42 1q27 n GLU 153 Cb 0.00 -2.08 0.01 0.00 -1.01 0.00 0.00 31.44 28.36 1q27 n GLU 153 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1q27 n ALA 154 N -0.13 -3.08 -1.71 0.62 0.00 -1.26 -4.67 120.51 110.28 1q27 n ALA 154 Ca 0.49 0.72 -0.02 0.00 0.00 0.00 0.00 53.44 54.64 1q27 n ALA 154 Cb 0.53 -2.24 -0.02 0.00 0.00 0.00 0.00 19.45 17.72 1q27 n ALA 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q27 n ALA 155 N -0.20 1.52 -1.70 0.00 0.00 -1.26 -1.03 120.51 117.84 1q27 n ALA 155 Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1q27 n ALA 155 Cb 0.25 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.60 1q27 n ALA 155 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1q27 n LYS 156 N 0.00 -4.73 0.07 0.00 5.02 -1.26 -3.52 118.16 113.75 1q27 n LYS 156 Ca -0.06 3.55 -0.21 0.00 -2.02 0.00 0.00 58.31 59.56 1q27 n LYS 156 Cb 0.40 -4.10 -0.12 0.00 -0.02 0.00 0.00 35.03 31.19 1q27 n LYS 156 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1q27 h GLY 157 N 1.41 0.72 1.00 0.72 0.00 -1.98 -2.63 103.07 102.32 1q27 h GLY 157 Ca 0.00 -1.41 -0.12 0.00 0.00 0.00 0.00 47.33 45.80 1q27 h GLY 157 CO 0.00 1.24 -0.27 -0.55 0.00 0.00 0.00 176.54 176.97 1q27 h ASP 158 N 0.29 0.81 -0.27 0.19 5.19 -1.99 -2.67 116.42 117.96 1q27 h ASP 158 Ca -0.16 -0.45 -0.02 0.00 -0.62 0.00 0.00 57.03 55.77 1q27 h ASP 158 Cb 1.81 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 41.09 1q27 h ASP 158 CO 0.22 1.09 0.08 -0.07 -3.12 0.00 0.00 179.24 177.44 1q27 h LEU 159 N 0.54 0.40 -0.62 1.55 3.38 -1.78 0.13 115.31 118.91 1q27 h LEU 159 Ca 0.06 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 57.87 1q27 h LEU 159 Cb 0.83 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.43 1q27 h LEU 159 CO 0.07 0.51 0.35 0.00 0.09 0.00 0.00 178.44 179.46 1q27 h ALA 160 N 0.91 0.82 -0.08 1.53 0.00 -1.48 0.12 119.26 121.08 1q27 h ALA 160 Ca 0.09 0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 1q27 h ALA 160 Cb 0.25 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1q27 h ALA 160 CO -0.00 0.04 -0.70 1.49 0.00 0.00 0.00 179.25 180.07 1q27 h GLU 161 N 0.66 0.38 0.34 0.00 4.81 -1.36 -2.64 114.58 116.79 1q27 h GLU 161 Ca 0.27 -0.30 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1q27 h GLU 161 Cb 0.13 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1q27 h GLU 161 CO -0.16 0.94 -0.17 -0.07 -0.73 0.00 0.00 179.01 178.83 1q27 h LEU 162 N 0.27 -0.39 -0.54 1.64 3.38 -0.13 -1.80 115.31 117.74 1q27 h LEU 162 Ca -0.02 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 57.85 1q27 h LEU 162 Cb 1.27 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 42.07 1q27 h LEU 162 CO 0.12 -0.04 0.28 -0.37 0.09 0.00 0.00 178.44 178.52 1q27 h VAL 163 N -0.78 0.96 0.00 1.22 -1.51 -0.86 -0.77 116.25 114.51 1q27 h VAL 163 Ca -0.05 -0.19 -0.03 0.00 -1.23 0.00 0.00 66.70 65.21 1q27 h VAL 163 Cb 0.51 0.37 -0.00 0.00 -2.13 0.00 0.00 31.29 30.04 1q27 h VAL 163 CO 0.08 0.10 -0.13 -0.09 -1.23 0.00 0.00 177.57 176.30 1q27 h ARG 164 N 0.54 0.00 0.08 5.19 1.12 -1.49 0.57 114.38 120.40 1q27 h ARG 164 Ca 0.24 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 59.11 1q27 h ARG 164 Cb 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.10 1q27 h ARG 164 CO -0.16 0.13 -0.04 0.00 -3.11 0.00 0.00 179.97 176.79 1q27 h ARG 165 N 0.00 -0.10 -0.70 0.20 2.47 -0.31 -1.16 114.38 114.78 1q27 h ARG 165 Ca -0.00 0.01 -0.06 0.00 -1.26 0.00 0.00 59.98 58.66 1q27 h ARG 165 Cb 0.23 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.55 1q27 h ARG 165 CO 0.02 0.44 0.19 0.00 0.56 0.00 0.00 179.97 181.18 1q27 h TYR 167 N 1.04 -0.12 -5.14 0.00 0.05 -1.00 -3.49 116.97 108.31 1q27 h TYR 167 Ca 0.22 -0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.91 1q27 h TYR 167 Cb 0.34 0.04 0.07 0.00 1.01 0.00 0.00 36.73 38.19 1q27 h TYR 167 CO 0.03 -0.08 -0.30 -2.13 -1.05 0.00 0.00 178.16 174.63 1q27 n ARG 168 N -2.72 -1.50 -2.59 4.88 0.63 -0.44 -4.95 116.66 109.96 1q27 n ARG 168 Ca -0.02 1.15 -0.42 0.00 -0.92 0.00 0.00 57.85 57.65 1q27 n ARG 168 Cb 0.05 -5.34 -0.03 0.00 0.45 0.00 0.00 32.46 27.59 1q27 n ARG 168 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1q27 s GLU 169 N -3.49 4.53 0.01 -0.14 2.02 -1.26 -4.61 118.70 115.77 1q27 s GLU 169 Ca 0.16 1.57 -0.00 0.00 0.02 0.00 0.00 54.97 56.72 1q27 s GLU 169 Cb -0.02 -3.40 0.00 0.00 0.10 0.00 0.00 34.13 30.81 1q27 s GLU 169 CO 0.67 -0.09 0.01 -1.91 0.02 0.00 0.00 175.26 173.96 1q27 n GLU 170 N 3.68 -5.25 -0.55 1.61 2.13 -1.26 -5.13 120.64 115.87 1q27 n GLU 170 Ca 0.06 3.81 0.00 0.00 0.66 0.00 0.00 57.16 61.69 1q27 n GLU 170 Cb 0.49 -4.80 0.00 0.00 0.27 0.00 0.00 31.44 27.40 1q27 n GLU 170 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11