#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 3.35 4.20 3.03 0.00 -1.26 -5.02 105.19 109.50 1q27 n GLY 2 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 0.00 2.18 3.84 -0.02 0.00 -1.26 -4.92 105.19 105.01 1q27 n GLY 3 Ca 0.00 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 1q27 n GLY 3 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q27 s VAL 4 N 0.00 4.31 0.00 1.61 1.01 -1.26 -4.91 120.40 121.16 1q27 s VAL 4 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 61.98 62.81 1q27 s VAL 4 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1q27 s VAL 4 CO 0.00 -0.90 0.00 -1.54 0.00 0.00 0.00 175.10 172.66 1q27 n SER 5 N -2.68 0.00 -4.56 3.32 3.41 -1.26 -5.08 113.62 106.78 1q27 n SER 5 Ca 0.07 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.29 1q27 n SER 5 Cb 0.54 0.16 -0.03 0.00 -0.26 0.00 0.00 64.21 64.62 1q27 n SER 5 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1q27 s ASP 6 N -1.59 5.33 0.74 4.04 -1.08 -1.26 -4.97 116.67 117.87 1q27 s ASP 6 Ca 0.00 0.53 -0.11 0.00 -0.52 0.00 0.00 52.55 52.45 1q27 s ASP 6 Cb 0.00 -2.53 0.03 0.00 -1.46 0.00 0.00 42.92 38.97 1q27 s ASP 6 CO 0.00 -2.30 1.08 -1.61 0.52 0.00 0.00 175.17 172.87 1q27 s GLU 7 N 6.88 2.59 0.24 4.34 0.41 -1.26 -5.09 118.70 126.81 1q27 s GLU 7 Ca 0.71 0.68 0.03 0.00 -0.41 0.00 0.00 54.97 55.97 1q27 s GLU 7 Cb -0.14 -1.97 -0.05 0.00 -1.78 0.00 0.00 34.13 30.18 1q27 s GLU 7 CO 0.23 -1.27 0.03 1.03 -0.49 0.00 0.00 175.26 174.79 1q27 s ARG 8 N -5.18 1.34 -0.17 1.61 0.52 -1.26 -4.64 118.95 111.17 1q27 s ARG 8 Ca 0.59 -1.69 -0.07 0.00 -0.52 0.00 0.00 55.73 54.03 1q27 s ARG 8 Cb -0.13 -0.50 -0.04 0.00 0.52 0.00 0.00 34.95 34.80 1q27 s ARG 8 CO 0.54 -0.16 0.08 -0.51 0.02 0.00 0.00 175.30 175.27 1q27 s LEU 9 N -3.30 3.92 0.04 2.53 1.02 -0.21 -4.22 118.68 118.47 1q27 s LEU 9 Ca 0.31 0.15 0.09 0.00 0.02 0.00 0.00 54.13 54.70 1q27 s LEU 9 Cb 0.06 -1.98 -0.03 0.00 0.02 0.00 0.00 46.19 44.26 1q27 s LEU 9 CO 0.10 0.22 -0.25 -1.81 0.02 0.00 0.00 176.35 174.62 1q27 s ASP 10 N 0.11 3.00 -0.18 2.29 1.11 -1.26 -1.05 116.67 120.69 1q27 s ASP 10 Ca 0.06 -0.57 -0.00 0.00 0.18 0.00 0.00 52.55 52.21 1q27 s ASP 10 Cb -0.12 -0.27 0.04 0.00 1.07 0.00 0.00 42.92 43.65 1q27 s ASP 10 CO 0.00 0.24 -0.06 -0.76 1.18 0.00 0.00 175.17 175.77 1q27 s LEU 11 N -1.22 1.88 0.02 1.23 1.43 -0.74 -4.08 118.68 117.20 1q27 s LEU 11 Ca 0.11 -0.78 0.05 0.00 -1.03 0.00 0.00 54.13 52.48 1q27 s LEU 11 Cb -0.10 -1.02 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 1q27 s LEU 11 CO 0.02 -0.18 -0.13 0.54 0.23 0.00 0.00 176.35 176.83 1q27 s VAL 12 N 1.55 3.19 0.22 -1.59 0.11 -1.26 0.11 120.40 122.73 1q27 s VAL 12 Ca -0.01 -0.98 -0.10 0.00 -2.93 0.00 0.00 61.98 57.97 1q27 s VAL 12 Cb -0.16 -2.36 0.20 0.00 -1.53 0.00 0.00 36.38 32.53 1q27 s VAL 12 CO -0.08 0.37 1.67 -0.55 -3.33 0.00 0.00 175.10 173.19 1q27 h ASN 13 N 4.56 -0.20 0.00 3.54 7.08 -1.83 -3.45 115.58 125.29 1q27 h ASN 13 Ca -0.48 0.15 0.00 0.00 -3.08 0.00 0.00 56.30 52.89 1q27 h ASN 13 Cb 1.16 0.24 0.00 0.00 -2.08 0.00 0.00 38.32 37.64 1q27 h ASN 13 CO 0.51 -0.09 0.00 1.21 -2.08 0.00 0.00 177.43 176.98 1q27 n GLU 14 N -5.24 0.00 0.00 4.14 2.13 -1.26 -5.08 120.64 115.33 1q27 n GLU 14 Ca 0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 1q27 n GLU 14 Cb 0.37 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.08 1q27 n GLU 14 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1q27 n ARG 15 N -1.54 0.00 -1.06 5.31 3.00 -1.26 -4.97 116.66 116.14 1q27 n ARG 15 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.85 57.83 1q27 n ARG 15 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 32.46 32.36 1q27 n ARG 15 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1q27 n ASP 16 N -0.30 0.02 -4.21 0.55 9.92 -1.26 -5.01 116.55 116.25 1q27 n ASP 16 Ca 0.00 -1.88 -0.40 0.00 -0.53 0.00 0.00 54.79 51.98 1q27 n ASP 16 Cb 0.00 -0.03 -0.04 0.00 -0.64 0.00 0.00 41.12 40.41 1q27 n ASP 16 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1q27 s GLU 17 N 0.00 3.63 -0.32 -1.24 2.12 -1.26 -5.02 118.70 116.61 1q27 s GLU 17 Ca 0.13 -3.18 -0.42 0.00 0.36 0.00 0.00 54.97 51.86 1q27 s GLU 17 Cb 0.15 -4.21 -0.17 0.00 0.26 0.00 0.00 34.13 30.17 1q27 s GLU 17 CO -0.06 -1.25 1.71 0.28 -0.54 0.00 0.00 175.26 175.39 1q27 n VAL 18 N 2.61 0.24 0.06 3.70 0.31 -1.26 -2.53 118.33 121.46 1q27 n VAL 18 Ca 0.21 -0.04 -0.23 0.00 -0.01 0.00 0.00 64.34 64.27 1q27 n VAL 18 Cb 0.38 -1.07 -0.15 0.00 -0.91 0.00 0.00 33.84 32.10 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 5.15 0.98 -3.41 2.52 -1.51 0.49 -3.46 116.25 117.00 1q27 h VAL 19 Ca -0.46 -2.49 -0.07 0.00 -1.23 0.00 0.00 66.70 62.44 1q27 h VAL 19 Cb 1.33 2.77 -0.15 0.00 -2.13 0.00 0.00 31.29 33.11 1q27 h VAL 19 CO 0.96 0.82 -0.19 -0.83 -1.23 0.00 0.00 177.57 177.10 1q27 s GLY 20 N -5.06 -0.15 -0.15 5.19 0.00 -1.01 -5.06 107.32 101.09 1q27 s GLY 20 Ca -0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 44.72 44.43 1q27 s GLY 20 CO 0.84 -0.34 -0.11 1.62 0.00 0.00 0.00 173.10 175.11 1q27 s GLN 21 N -3.28 3.42 -0.05 2.90 2.00 -1.26 -1.79 119.66 121.60 1q27 s GLN 21 Ca -0.00 -0.65 0.04 0.00 -2.00 0.00 0.00 55.36 52.74 1q27 s GLN 21 Cb 0.01 -2.73 -0.03 0.00 0.80 0.00 0.00 33.01 31.07 1q27 s GLN 21 CO -0.08 0.14 -0.14 0.42 -0.50 0.00 0.00 175.29 175.13 1q27 s ILE 22 N 0.55 3.05 -0.04 -2.34 -1.09 -0.21 -5.02 121.20 116.09 1q27 s ILE 22 Ca -0.07 -0.74 -0.02 0.00 -2.23 0.00 0.00 60.65 57.59 1q27 s ILE 22 Cb -0.15 -2.19 -0.04 0.00 -1.58 0.00 0.00 42.46 38.50 1q27 s ILE 22 CO 0.03 0.59 0.09 -0.76 -1.23 0.00 0.00 174.94 173.66 1q27 s LEU 23 N -0.74 3.98 0.07 2.97 1.43 -1.26 -1.04 118.68 124.08 1q27 s LEU 23 Ca 0.11 0.23 0.08 0.00 -1.03 0.00 0.00 54.13 53.53 1q27 s LEU 23 Cb -0.11 -2.17 -0.22 0.00 0.03 0.00 0.00 46.19 43.72 1q27 s LEU 23 CO 0.01 0.32 1.08 -0.09 0.23 0.00 0.00 176.35 177.89 1q27 h ARG 24 N 4.46 0.01 -1.04 1.70 2.43 -1.94 -3.30 114.38 116.70 1q27 h ARG 24 Ca -0.51 -0.02 -0.53 0.00 -0.81 0.00 0.00 59.98 58.12 1q27 h ARG 24 Cb 1.19 0.01 -0.27 0.00 -0.42 0.00 0.00 29.97 30.48 1q27 h ARG 24 CO 0.60 0.85 0.67 0.25 -1.51 0.00 0.00 179.97 180.84 1q27 n THR 25 N -3.26 3.18 -3.78 0.20 -2.24 -1.26 -4.90 114.28 102.22 1q27 n THR 25 Ca -0.06 -2.12 -0.13 0.00 -2.27 0.00 0.00 64.05 59.47 1q27 n THR 25 Cb 0.98 -0.80 -0.10 0.00 -2.10 0.00 0.00 70.33 68.31 1q27 n THR 25 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1q27 s ASP 26 N -1.21 -0.20 0.00 3.42 1.11 -1.24 -5.04 116.67 113.51 1q27 s ASP 26 Ca 0.54 0.20 0.04 0.00 0.18 0.00 0.00 52.55 53.52 1q27 s ASP 26 Cb 0.44 0.39 0.13 0.00 1.07 0.00 0.00 42.92 44.96 1q27 s ASP 26 CO 0.05 -0.33 1.11 -0.81 1.18 0.00 0.00 175.17 176.37 1q27 n PRO 27 N 1.80 1.27 -0.29 8.23 -0.04 -1.26 -4.22 135.00 140.50 1q27 n PRO 27 Ca -0.19 -0.42 0.23 0.00 -0.04 0.00 0.00 63.50 63.07 1q27 n PRO 27 Cb 0.56 -1.10 0.53 0.00 -0.04 0.00 0.00 33.50 33.46 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 3.23 2.31 -0.42 0.55 0.00 -1.96 0.83 119.26 123.80 1q27 h ALA 28 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1q27 h ALA 28 Cb 0.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1q27 h ALA 28 CO 0.00 -0.67 0.00 1.47 0.00 0.00 0.00 179.25 180.05 1q27 n LEU 29 N -4.54 3.43 -3.49 0.00 -0.00 -1.26 -4.98 117.00 106.17 1q27 n LEU 29 Ca 0.23 -1.73 -0.36 0.00 -0.00 0.00 0.00 56.01 54.14 1q27 n LEU 29 Cb 0.85 -0.49 0.03 0.00 -0.00 0.00 0.00 43.42 43.81 1q27 n LEU 29 CO 0.29 0.56 -0.27 0.54 -0.00 0.00 0.00 177.39 178.51 1q27 n ARG 30 N 0.63 -1.81 -1.60 1.47 1.74 0.29 -4.67 116.66 112.71 1q27 n ARG 30 Ca 0.17 1.27 -0.37 0.00 -0.77 0.00 0.00 57.85 58.15 1q27 n ARG 30 Cb 0.67 -1.96 -0.03 0.00 -1.02 0.00 0.00 32.46 30.12 1q27 n ARG 30 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1q27 s TRP 31 N -1.65 1.13 0.00 -1.55 0.52 -1.26 -3.65 118.94 112.47 1q27 s TRP 31 Ca 0.32 1.36 0.00 0.00 0.02 0.00 0.00 56.10 57.79 1q27 s TRP 31 Cb -0.03 -3.67 0.00 0.00 -1.15 0.00 0.00 33.47 28.62 1q27 s TRP 31 CO 0.85 -2.76 0.00 -1.91 0.02 0.00 0.00 176.95 173.15 1q27 n GLU 32 N 8.98 0.00 -0.24 4.98 4.07 -1.26 -4.95 120.64 132.22 1q27 n GLU 32 Ca 0.35 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.53 1q27 n GLU 32 Cb 0.53 0.00 0.16 0.00 -0.06 0.00 0.00 31.44 32.07 1q27 n GLU 32 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1q27 n ARG 33 N -1.12 1.42 -1.91 5.31 1.74 -1.24 -3.90 116.66 116.96 1q27 n ARG 33 Ca 0.00 -2.80 -0.30 0.00 -0.77 0.00 0.00 57.85 53.99 1q27 n ARG 33 Cb 0.00 -1.55 0.16 0.00 -1.02 0.00 0.00 32.46 30.05 1q27 n ARG 33 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1q27 s VAL 34 N -2.98 1.99 -0.08 1.55 -7.23 -1.26 -4.64 120.40 107.75 1q27 s VAL 34 Ca 0.34 0.00 -0.07 0.00 -1.81 0.00 0.00 61.98 60.45 1q27 s VAL 34 Cb 0.31 -2.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 1q27 s VAL 34 CO 0.00 0.00 0.18 -0.13 -0.31 0.00 0.00 175.10 174.84 1q27 s ARG 35 N -5.80 3.48 0.30 4.82 0.52 -1.26 -1.72 118.95 119.29 1q27 s ARG 35 Ca 0.71 -0.13 -0.10 0.00 -0.52 0.00 0.00 55.73 55.69 1q27 s ARG 35 Cb -0.06 -3.16 0.01 0.00 0.52 0.00 0.00 34.95 32.26 1q27 s ARG 35 CO 0.52 0.74 0.52 0.08 0.02 0.00 0.00 175.30 177.18 1q27 s VAL 36 N -1.12 0.00 0.14 3.52 1.01 0.53 -4.74 120.40 119.74 1q27 s VAL 36 Ca 0.19 -1.41 0.10 0.00 0.00 0.00 0.00 61.98 60.86 1q27 s VAL 36 Cb -0.13 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 1q27 s VAL 36 CO 0.09 0.00 -0.22 -0.69 0.00 0.00 0.00 175.10 174.27 1q27 s VAL 37 N -3.49 2.54 0.01 2.92 1.01 0.47 -2.15 120.40 121.70 1q27 s VAL 37 Ca 0.24 -1.70 -0.19 0.00 0.00 0.00 0.00 61.98 60.33 1q27 s VAL 37 Cb -0.01 -2.16 0.04 0.00 0.00 0.00 0.00 36.38 34.24 1q27 s VAL 37 CO 0.13 0.05 0.41 0.20 0.00 0.00 0.00 175.10 175.89 1q27 s ASN 38 N -2.22 -0.30 -0.03 3.32 -0.87 -0.04 -0.91 114.94 113.90 1q27 s ASN 38 Ca 0.17 0.14 -0.29 0.00 -1.57 0.00 0.00 52.86 51.31 1q27 s ASN 38 Cb -0.10 0.40 0.08 0.00 -0.02 0.00 0.00 41.25 41.61 1q27 s ASN 38 CO 0.09 -0.57 0.74 0.00 -2.57 0.00 0.00 177.10 174.79 1q27 s ALA 39 N -1.82 -1.77 -0.21 0.60 0.00 0.44 -0.37 121.76 118.62 1q27 s ALA 39 Ca -0.09 1.19 -0.12 0.00 0.00 0.00 0.00 51.96 52.94 1q27 s ALA 39 Cb -0.02 0.07 -0.05 0.00 0.00 0.00 0.00 23.12 23.12 1q27 s ALA 39 CO 0.02 -0.46 0.21 -0.06 0.00 0.00 0.00 175.76 175.47 1q27 s PHE 40 N -1.81 3.37 -0.37 0.00 0.08 0.13 -0.91 117.98 118.46 1q27 s PHE 40 Ca -0.06 0.36 -0.15 0.00 0.12 0.00 0.00 56.93 57.21 1q27 s PHE 40 Cb -0.00 -2.29 -0.00 0.00 -0.57 0.00 0.00 43.02 40.15 1q27 s PHE 40 CO 0.03 0.13 0.32 -0.51 -0.10 0.00 0.00 175.22 175.09 1q27 s LEU 41 N 0.84 4.67 0.05 -0.37 2.01 -1.26 -1.65 118.68 122.97 1q27 s LEU 41 Ca 0.11 -0.50 0.04 0.00 0.01 0.00 0.00 54.13 53.78 1q27 s LEU 41 Cb -0.13 -2.24 -0.02 0.00 0.01 0.00 0.00 46.19 43.81 1q27 s LEU 41 CO 0.03 -0.36 -0.12 -0.60 1.01 0.00 0.00 176.35 176.31 1q27 s ARG 42 N 1.86 0.78 0.14 1.70 3.52 -0.83 -2.52 118.95 123.60 1q27 s ARG 42 Ca 0.08 -0.78 0.06 0.00 -0.13 0.00 0.00 55.73 54.96 1q27 s ARG 42 Cb -0.17 -0.74 -0.04 0.00 -1.56 0.00 0.00 34.95 32.43 1q27 s ARG 42 CO 0.11 0.17 0.01 1.21 -0.81 0.00 0.00 175.30 176.00 1q27 s ASN 43 N -1.35 4.95 0.66 -2.12 2.47 -0.39 -0.42 114.94 118.74 1q27 s ASN 43 Ca -0.02 -0.28 0.37 0.00 0.42 0.00 0.00 52.86 53.35 1q27 s ASN 43 Cb -0.09 -1.13 2.00 0.00 -1.45 0.00 0.00 41.25 40.59 1q27 s ASN 43 CO 0.01 0.12 2.13 -1.28 -3.72 0.00 0.00 177.10 174.36 1q27 h SER 44 N 2.96 0.00 -0.52 -4.21 0.87 -1.91 -1.04 113.55 109.70 1q27 h SER 44 Ca -0.47 0.00 -0.29 0.00 -1.23 0.00 0.00 61.79 59.80 1q27 h SER 44 Cb 1.19 0.00 -0.16 0.00 -0.44 0.00 0.00 62.40 62.99 1q27 h SER 44 CO 0.59 0.00 0.37 0.00 -0.53 0.00 0.00 176.83 177.26 1q27 n GLN 45 N -2.96 1.70 -3.61 2.24 6.02 -1.26 -4.84 117.38 114.67 1q27 n GLN 45 Ca -0.02 -1.60 -0.22 0.00 -0.01 0.00 0.00 57.00 55.14 1q27 n GLN 45 Cb 0.23 -1.63 0.07 0.00 1.02 0.00 0.00 30.24 29.93 1q27 n GLN 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1q27 n GLY 46 N -0.21 -0.43 3.19 1.08 0.00 -0.42 -4.95 105.19 103.45 1q27 n GLY 46 Ca 0.32 0.17 -0.41 0.00 0.00 0.00 0.00 46.02 46.10 1q27 n GLY 46 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q27 s GLN 47 N -6.00 2.83 -0.38 1.61 -1.52 -1.07 -4.29 119.66 110.85 1q27 s GLN 47 Ca 0.31 -2.30 -0.15 0.00 -1.95 0.00 0.00 55.36 51.26 1q27 s GLN 47 Cb -0.14 -3.98 0.00 0.00 -0.22 0.00 0.00 33.01 28.67 1q27 s GLN 47 CO 0.76 -1.21 0.32 -0.51 -0.25 0.00 0.00 175.29 174.40 1q27 s LEU 48 N 0.39 4.74 -0.38 2.90 1.43 -0.59 -1.27 118.68 125.91 1q27 s LEU 48 Ca 0.14 -0.57 -0.15 0.00 -1.03 0.00 0.00 54.13 52.52 1q27 s LEU 48 Cb -0.19 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.79 1q27 s LEU 48 CO -0.04 -0.39 0.32 0.86 0.23 0.00 0.00 176.35 177.33 1q27 s TRP 49 N 1.86 3.22 -0.13 0.29 -0.00 -1.05 -0.55 118.94 122.57 1q27 s TRP 49 Ca 0.08 -0.32 -0.20 0.00 -0.00 0.00 0.00 56.10 55.67 1q27 s TRP 49 Cb -0.18 -2.63 0.05 0.00 -0.00 0.00 0.00 33.47 30.72 1q27 s TRP 49 CO 0.11 -0.51 0.51 0.42 -0.00 0.00 0.00 176.95 177.48 1q27 s ILE 50 N 1.85 0.01 0.30 5.86 1.01 0.69 -4.49 121.20 126.43 1q27 s ILE 50 Ca 0.08 -0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.35 1q27 s ILE 50 Cb -0.18 -0.75 -0.10 0.00 0.01 0.00 0.00 42.46 41.45 1q27 s ILE 50 CO 0.11 -0.05 1.14 -2.84 0.00 0.00 0.00 174.94 173.30 1q27 s PRO 51 N -0.31 4.52 0.00 2.79 0.02 -1.26 -2.52 135.00 138.24 1q27 s PRO 51 Ca -0.05 1.88 0.17 0.00 0.02 0.00 0.00 61.00 63.02 1q27 s PRO 51 Cb -0.03 -3.10 0.28 0.00 0.02 0.00 0.00 34.50 31.67 1q27 s PRO 51 CO 0.03 0.08 1.10 2.89 -0.33 0.00 0.00 177.00 180.77 1q27 n ARG 52 N 0.98 0.00 -5.18 5.54 1.85 -1.26 -4.54 116.66 114.05 1q27 n ARG 52 Ca -0.00 -1.63 -0.30 0.00 -1.00 0.00 0.00 57.85 54.92 1q27 n ARG 52 Cb 0.44 -0.07 -0.16 0.00 -1.05 0.00 0.00 32.46 31.62 1q27 n ARG 52 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1q27 s ARG 53 N 0.00 2.35 -0.08 2.89 6.06 -1.26 -5.10 118.95 123.81 1q27 s ARG 53 Ca 0.22 -0.84 -0.30 0.00 -2.50 0.00 0.00 55.73 52.31 1q27 s ARG 53 Cb 0.26 -2.02 -0.02 0.00 0.06 0.00 0.00 34.95 33.22 1q27 s ARG 53 CO -0.11 0.37 1.15 0.45 -2.50 0.00 0.00 175.30 174.66 1q27 s SER 54 N -0.16 7.09 0.10 -2.12 0.15 -1.26 -4.96 113.70 112.54 1q27 s SER 54 Ca -0.02 1.72 -0.34 0.00 0.70 0.00 0.00 55.95 58.01 1q27 s SER 54 Cb -0.13 -2.56 -0.15 0.00 -1.71 0.00 0.00 66.02 61.48 1q27 s SER 54 CO 0.03 -0.57 1.56 -0.65 1.20 0.00 0.00 173.24 174.82 1q27 h PRO 55 N 7.42 -0.78 0.00 5.44 0.11 -2.03 -3.34 132.00 138.83 1q27 h PRO 55 Ca -0.32 0.05 -0.38 0.00 0.11 0.00 0.00 66.00 65.46 1q27 h PRO 55 Cb 1.15 0.18 -0.07 0.00 0.11 0.00 0.00 31.00 32.37 1q27 h PRO 55 CO 0.88 -0.52 -2.42 0.45 -0.21 0.00 0.00 178.00 176.18 1q27 n SER 56 N -5.51 2.06 -2.73 -2.05 2.88 -1.26 -5.08 113.62 101.93 1q27 n SER 56 Ca -0.09 -0.13 -0.02 0.00 -1.33 0.00 0.00 58.87 57.30 1q27 n SER 56 Cb 0.42 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 1q27 n SER 56 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1q27 n LYS 57 N -3.25 -3.15 0.04 -1.46 4.81 -1.26 -5.03 118.16 108.87 1q27 n LYS 57 Ca -0.44 2.58 0.00 0.00 -0.87 0.00 0.00 58.31 59.58 1q27 n LYS 57 Cb 0.97 -5.42 0.00 0.00 0.02 0.00 0.00 35.03 30.60 1q27 n LYS 57 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1q27 n SER 58 N 0.41 0.77 0.00 3.14 2.88 -1.26 -5.06 113.62 114.49 1q27 n SER 58 Ca 0.03 0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1q27 n SER 58 Cb 0.13 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.38 1q27 n SER 58 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1q27 n LEU 59 N -3.25 0.00 -3.85 2.46 4.77 -1.26 -5.10 117.00 110.76 1q27 n LEU 59 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 1q27 n LEU 59 Cb 0.00 -0.01 -0.15 0.00 -2.33 0.00 0.00 43.42 40.93 1q27 n LEU 59 CO 0.00 -0.06 -0.37 0.12 -1.33 0.00 0.00 177.39 175.75 1q27 s PHE 60 N -0.12 0.19 0.98 -1.77 5.36 -1.26 -5.16 117.98 116.20 1q27 s PHE 60 Ca 0.00 0.01 -0.12 0.00 -0.96 0.00 0.00 56.93 55.85 1q27 s PHE 60 Cb 0.00 -0.22 0.18 0.00 -0.34 0.00 0.00 43.02 42.64 1q27 s PHE 60 CO 0.00 -0.06 1.10 -1.25 -1.46 0.00 0.00 175.22 173.56 1q27 s PRO 61 N 0.46 0.56 -0.66 10.12 0.04 -1.26 -4.95 135.00 139.31 1q27 s PRO 61 Ca -0.04 0.45 -0.02 0.00 0.04 0.00 0.00 61.00 61.43 1q27 s PRO 61 Cb -0.07 -1.76 0.37 0.00 0.04 0.00 0.00 34.50 33.08 1q27 s PRO 61 CO -0.01 -2.63 2.08 0.09 0.04 0.00 0.00 177.00 176.58 1q27 n ASN 62 N -4.09 7.43 -0.56 6.66 4.13 -1.26 -4.78 115.26 122.79 1q27 n ASN 62 Ca 0.05 -3.67 0.00 0.00 1.68 0.00 0.00 54.58 52.64 1q27 n ASN 62 Cb 0.58 -1.03 0.00 0.00 -1.54 0.00 0.00 39.78 37.79 1q27 n ASN 62 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1q27 n ALA 63 N -0.54 0.00 -1.96 5.41 0.00 -1.26 -4.88 120.51 117.28 1q27 n ALA 63 Ca 0.56 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.72 1q27 n ALA 63 Cb 0.53 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.15 1q27 n ALA 63 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1q27 s LEU 64 N 0.00 2.81 0.00 0.00 1.02 -1.26 -4.97 118.68 116.28 1q27 s LEU 64 Ca 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 54.13 54.12 1q27 s LEU 64 Cb 0.00 -2.05 0.00 0.00 0.02 0.00 0.00 46.19 44.16 1q27 s LEU 64 CO 0.00 -2.54 0.00 -0.90 0.02 0.00 0.00 176.35 172.93 1q27 n ASP 65 N -3.50 0.00 -4.93 2.29 5.68 -1.26 -5.02 116.55 109.81 1q27 n ASP 65 Ca 0.16 -0.96 -0.25 0.00 -0.50 0.00 0.00 54.79 53.24 1q27 n ASP 65 Cb 0.60 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.58 1q27 n ASP 65 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1q27 s VAL 66 N -2.13 4.48 -0.13 2.12 1.01 -1.26 -4.76 120.40 119.73 1q27 s VAL 66 Ca 0.00 -0.17 -0.14 0.00 0.00 0.00 0.00 61.98 61.68 1q27 s VAL 66 Cb 0.00 -3.69 -0.12 0.00 0.00 0.00 0.00 36.38 32.58 1q27 s VAL 66 CO 0.00 -0.58 0.26 0.77 0.00 0.00 0.00 175.10 175.55 1q27 h SER 67 N 0.31 0.00 -3.39 3.32 4.64 -1.76 -3.44 113.55 113.24 1q27 h SER 67 Ca -0.47 -0.40 -0.71 0.00 -0.47 0.00 0.00 61.79 59.74 1q27 h SER 67 Cb 1.23 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 63.00 1q27 h SER 67 CO 0.60 0.83 -0.47 -0.69 -0.87 0.00 0.00 176.83 176.23 1q27 s VAL 68 N -1.97 3.78 -0.12 0.95 1.01 -0.09 -4.84 120.40 119.12 1q27 s VAL 68 Ca -0.12 -1.90 -0.00 0.00 0.00 0.00 0.00 61.98 59.96 1q27 s VAL 68 Cb 0.00 -3.53 0.02 0.00 0.00 0.00 0.00 36.38 32.87 1q27 s VAL 68 CO 0.34 -0.73 -0.10 -0.83 0.00 0.00 0.00 175.10 173.78 1q27 s GLY 69 N 2.27 0.91 0.14 4.51 0.00 -1.26 -0.42 107.32 113.47 1q27 s GLY 69 Ca 0.07 -0.64 -0.09 0.00 0.00 0.00 0.00 44.72 44.06 1q27 s GLY 69 CO -0.02 0.69 0.26 -0.32 0.00 0.00 0.00 173.10 173.71 1q27 s GLY 70 N 1.59 0.38 0.31 0.20 0.00 -0.08 -4.80 107.32 104.91 1q27 s GLY 70 Ca 0.04 -0.81 0.07 0.00 0.00 0.00 0.00 44.72 44.02 1q27 s GLY 70 CO -0.08 -0.83 0.30 0.00 0.00 0.00 0.00 173.10 172.49 1q27 s ALA 71 N -3.94 3.84 0.26 3.20 0.00 -1.26 -0.40 121.76 123.46 1q27 s ALA 71 Ca 0.14 -1.53 0.07 0.00 0.00 0.00 0.00 51.96 50.64 1q27 s ALA 71 Cb 0.04 -1.32 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 1q27 s ALA 71 CO -0.03 0.08 0.20 0.08 0.00 0.00 0.00 175.76 176.10 1q27 s VAL 72 N -2.22 4.30 -0.16 0.00 1.01 -1.26 -4.84 120.40 117.23 1q27 s VAL 72 Ca 0.39 -1.42 -0.19 0.00 0.00 0.00 0.00 61.98 60.75 1q27 s VAL 72 Cb -0.07 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 33.00 1q27 s VAL 72 CO 0.27 -0.33 0.52 0.00 0.00 0.00 0.00 175.10 175.56 1q27 s GLN 73 N -3.86 0.68 -0.29 2.72 -2.07 -1.26 -4.90 119.66 110.69 1q27 s GLN 73 Ca 0.34 0.56 -0.04 0.00 -1.82 0.00 0.00 55.36 54.40 1q27 s GLN 73 Cb -0.08 0.33 0.00 0.00 -1.09 0.00 0.00 33.01 32.17 1q27 s GLN 73 CO 0.25 -0.12 0.15 0.43 -1.32 0.00 0.00 175.29 174.68 1q27 n SER 74 N 2.37 -7.00 0.00 12.60 7.64 -1.26 -4.57 113.62 123.40 1q27 n SER 74 Ca -0.15 0.98 0.00 0.00 1.01 0.00 0.00 58.87 60.71 1q27 n SER 74 Cb 0.56 -4.63 0.00 0.00 -1.01 0.00 0.00 64.21 59.13 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 0.31 2.45 3.04 0.23 0.00 -1.26 -4.85 105.19 105.11 1q27 n GLY 75 Ca 0.03 -0.89 -0.03 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 -1.44 -3.66 1.61 1.02 -1.26 -5.02 120.64 111.88 1q27 n GLU 76 Ca 0.00 1.35 -0.20 0.00 -0.02 0.00 0.00 57.16 58.28 1q27 n GLU 76 Cb 0.00 -5.63 -0.18 0.00 -0.02 0.00 0.00 31.44 25.61 1q27 n GLU 76 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1q27 s THR 77 N -3.07 -0.12 0.22 2.62 -4.23 -1.26 -5.03 115.64 104.77 1q27 s THR 77 Ca 0.08 0.38 -0.08 0.00 -1.18 0.00 0.00 61.69 60.89 1q27 s THR 77 Cb -0.01 -0.19 0.18 0.00 1.34 0.00 0.00 72.50 73.81 1q27 s THR 77 CO 0.72 0.14 1.71 1.88 -0.54 0.00 0.00 174.62 178.54 1q27 h TYR 78 N 8.43 0.30 -0.95 3.99 -1.99 -2.00 -0.32 116.97 124.43 1q27 h TYR 78 Ca -0.12 0.04 0.04 0.00 2.00 0.00 0.00 58.73 60.68 1q27 h TYR 78 Cb 1.12 -0.04 -0.06 0.00 2.00 0.00 0.00 36.73 39.76 1q27 h TYR 78 CO 0.45 0.01 0.62 0.93 -0.00 0.00 0.00 178.16 180.17 1q27 h GLU 79 N 0.32 1.14 0.68 4.88 5.08 -1.98 -0.53 114.58 124.17 1q27 h GLU 79 Ca 0.34 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.60 1q27 h GLU 79 Cb 0.50 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1q27 h GLU 79 CO -0.39 0.75 -0.44 1.49 -1.00 0.00 0.00 179.01 179.41 1q27 h GLU 80 N 1.17 -1.02 -0.48 2.33 4.22 -1.48 0.12 114.58 119.43 1q27 h GLU 80 Ca 0.38 0.07 0.03 0.00 0.08 0.00 0.00 59.36 59.92 1q27 h GLU 80 Cb 0.05 0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1q27 h GLU 80 CO -0.12 -0.68 0.32 0.00 -2.18 0.00 0.00 179.01 176.34 1q27 h ALA 81 N -1.23 1.78 -0.21 2.92 0.00 -1.34 -2.30 119.26 118.88 1q27 h ALA 81 Ca -0.09 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1q27 h ALA 81 Cb 0.86 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1q27 h ALA 81 CO 0.08 0.17 0.04 0.35 0.00 0.00 0.00 179.25 179.89 1q27 h PHE 82 N 0.54 0.37 -0.24 0.00 3.57 -0.76 -0.62 116.94 119.80 1q27 h PHE 82 Ca 0.19 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.69 1q27 h PHE 82 Cb 0.10 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 1q27 h PHE 82 CO -0.00 0.47 -0.03 -0.09 -2.23 0.00 0.00 178.31 176.43 1q27 h ARG 83 N 0.16 0.03 -0.05 1.11 2.43 -0.20 0.14 114.38 117.99 1q27 h ARG 83 Ca 0.07 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1q27 h ARG 83 Cb 0.30 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1q27 h ARG 83 CO 0.00 0.02 0.00 -0.09 -1.51 0.00 0.00 179.97 178.40 1q27 h ARG 84 N 0.03 0.09 -0.50 0.20 2.43 -1.46 -0.61 114.38 114.57 1q27 h ARG 84 Ca 0.12 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.31 1q27 h ARG 84 Cb 0.17 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 1q27 h ARG 84 CO -0.23 0.36 0.24 0.93 -1.51 0.00 0.00 179.97 179.76 1q27 h GLU 85 N -0.19 0.45 -0.10 0.20 5.08 -0.91 0.04 114.58 119.16 1q27 h GLU 85 Ca 0.02 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1q27 h GLU 85 Cb 0.31 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1q27 h GLU 85 CO 0.00 0.30 0.00 0.00 -1.00 0.00 0.00 179.01 178.32 1q27 h ALA 86 N 1.28 0.13 -0.94 3.43 0.00 -0.70 -2.56 119.26 119.90 1q27 h ALA 86 Ca 0.22 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1q27 h ALA 86 Cb 0.15 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1q27 h ALA 86 CO -0.17 -0.19 0.60 -0.09 0.00 0.00 0.00 179.25 179.40 1q27 h ARG 87 N -0.10 1.08 0.00 0.00 2.43 -0.84 -0.69 114.38 116.26 1q27 h ARG 87 Ca 0.03 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 1q27 h ARG 87 Cb 0.33 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1q27 h ARG 87 CO 0.00 0.72 -0.22 0.93 -1.51 0.00 0.00 179.97 179.89 1q27 h GLU 88 N 1.11 0.00 0.00 0.20 4.39 -0.90 0.12 114.58 119.50 1q27 h GLU 88 Ca 0.40 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.10 1q27 h GLU 88 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1q27 h GLU 88 CO -0.16 0.22 0.00 0.39 -1.16 0.00 0.00 179.01 178.30 1q27 n GLU 89 N -3.92 0.00 -1.70 2.33 1.02 -0.28 -4.70 120.64 113.38 1q27 n GLU 89 Ca -0.02 0.45 0.00 0.00 -0.02 0.00 0.00 57.16 57.57 1q27 n GLU 89 Cb 0.30 -1.32 0.01 0.00 -0.02 0.00 0.00 31.44 30.42 1q27 n GLU 89 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1q27 n LEU 90 N -1.86 0.37 -2.80 -4.62 7.94 -1.13 -4.59 117.00 110.32 1q27 n LEU 90 Ca 0.00 -2.28 -0.21 0.00 -1.11 0.00 0.00 56.01 52.41 1q27 n LEU 90 Cb 0.00 0.09 0.04 0.00 0.53 0.00 0.00 43.42 44.08 1q27 n LEU 90 CO 0.00 0.95 0.01 0.59 -1.11 0.00 0.00 177.39 177.84 1q27 n ASN 91 N 0.01 -5.77 0.05 1.96 3.02 0.41 -4.90 115.26 110.03 1q27 n ASN 91 Ca -0.05 -0.28 -0.14 0.00 -0.03 0.00 0.00 54.58 54.09 1q27 n ASN 91 Cb 0.95 -4.58 -0.04 0.00 -0.61 0.00 0.00 39.78 35.50 1q27 n ASN 91 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1q27 h VAL 92 N -1.36 1.37 -1.18 2.41 3.04 -1.76 -3.47 116.25 115.31 1q27 h VAL 92 Ca -0.49 -2.34 -0.33 0.00 -1.01 0.00 0.00 66.70 62.53 1q27 h VAL 92 Cb 1.34 2.33 -0.13 0.00 -2.01 0.00 0.00 31.29 32.82 1q27 h VAL 92 CO 0.52 0.70 -0.30 -0.62 -1.01 0.00 0.00 177.57 176.86 1q27 n GLU 93 N -3.79 -1.38 -2.03 4.17 1.02 -1.26 -2.53 120.64 114.84 1q27 n GLU 93 Ca -0.07 0.97 -0.02 0.00 -0.02 0.00 0.00 57.16 58.01 1q27 n GLU 93 Cb 0.82 -5.27 -0.00 0.00 -0.02 0.00 0.00 31.44 26.96 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 -2.09 -0.07 -0.77 -3.67 -5.35 -1.26 -4.58 119.36 101.57 1q27 n ILE 94 Ca -0.16 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.32 1q27 n ILE 94 Cb 0.54 -0.28 0.00 0.00 -1.74 0.00 0.00 39.64 38.16 1q27 n ILE 94 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1q27 n ASP 95 N -0.81 0.17 -0.01 7.28 -0.08 -1.05 -4.73 116.55 117.32 1q27 n ASP 95 Ca -0.03 -0.94 0.03 0.00 -1.51 0.00 0.00 54.79 52.34 1q27 n ASP 95 Cb 0.38 0.01 -0.06 0.00 2.34 0.00 0.00 41.12 43.79 1q27 n ASP 95 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1q27 n ALA 96 N -0.01 2.21 -1.87 -1.67 0.00 -1.10 -4.94 120.51 113.13 1q27 n ALA 96 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1q27 n ALA 96 Cb 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.44 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 -1.82 0.00 0.00 0.00 7.99 -1.26 -5.14 117.00 116.76 1q27 n LEU 97 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.97 1q27 n LEU 97 Cb 0.26 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.57 1q27 n LEU 97 CO 0.15 0.00 0.00 -1.20 -1.51 0.00 0.00 177.39 174.83 1q27 n SER 98 N -0.18 0.00 -3.83 -1.43 7.64 -1.26 -4.98 113.62 109.59 1q27 n SER 98 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.77 1q27 n SER 98 Cb 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.12 1q27 n SER 98 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 1q27 s TRP 99 N -0.17 0.01 -0.28 1.43 1.48 -1.26 -0.75 118.94 119.40 1q27 s TRP 99 Ca 0.00 -0.16 -0.20 0.00 -1.06 0.00 0.00 56.10 54.68 1q27 s TRP 99 Cb 0.00 -0.00 0.11 0.00 -1.16 0.00 0.00 33.47 32.42 1q27 s TRP 99 CO 0.00 -0.41 0.89 -0.98 -4.06 0.00 0.00 176.95 172.38 1q27 s ARG 100 N -2.26 0.55 -0.15 3.25 1.70 -0.79 -4.96 118.95 116.29 1q27 s ARG 100 Ca -0.07 0.83 -0.29 0.00 -0.47 0.00 0.00 55.73 55.73 1q27 s ARG 100 Cb -0.02 0.18 -0.06 0.00 -0.57 0.00 0.00 34.95 34.48 1q27 s ARG 100 CO -0.02 -0.09 2.02 -1.25 -1.08 0.00 0.00 175.30 174.88 1q27 s PRO 101 N 0.99 3.55 0.08 3.89 0.04 -1.26 -0.30 135.00 142.00 1q27 s PRO 101 Ca -0.05 2.11 0.11 0.00 0.04 0.00 0.00 61.00 63.22 1q27 s PRO 101 Cb -0.05 -4.25 -0.17 0.00 0.04 0.00 0.00 34.50 30.08 1q27 s PRO 101 CO -0.12 -1.62 1.04 1.25 0.04 0.00 0.00 177.00 177.59 1q27 h LEU 102 N 13.12 0.00 0.00 -3.56 6.46 -1.25 -3.47 115.31 126.61 1q27 h LEU 102 Ca -0.42 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.34 1q27 h LEU 102 Cb 1.22 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.15 1q27 h LEU 102 CO 0.97 0.87 0.00 0.00 -0.62 0.00 0.00 178.44 179.65 1q27 n ALA 103 N -2.40 0.00 -3.56 1.25 0.00 -0.31 -5.04 120.51 110.45 1q27 n ALA 103 Ca -0.07 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.25 1q27 n ALA 103 Cb 0.93 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.30 1q27 n ALA 103 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1q27 s SER 104 N -4.00 -0.70 -0.40 0.00 0.15 -1.26 -0.41 113.70 107.08 1q27 s SER 104 Ca 0.00 1.28 -0.14 0.00 0.70 0.00 0.00 55.95 57.78 1q27 s SER 104 Cb 0.00 1.25 0.02 0.00 -1.71 0.00 0.00 66.02 65.59 1q27 s SER 104 CO 0.00 -0.22 0.28 -0.36 1.20 0.00 0.00 173.24 174.14 1q27 s PHE 105 N 0.67 3.24 0.36 3.44 0.08 0.47 -4.92 117.98 121.32 1q27 s PHE 105 Ca -0.03 -0.67 0.08 0.00 0.12 0.00 0.00 56.93 56.43 1q27 s PHE 105 Cb -0.05 -2.57 -0.05 0.00 -0.57 0.00 0.00 43.02 39.78 1q27 s PHE 105 CO -0.04 -0.61 0.07 -1.54 -0.10 0.00 0.00 175.22 173.00 1q27 s SER 106 N 1.67 4.28 -0.85 1.36 1.04 -1.26 -2.37 113.70 117.57 1q27 s SER 106 Ca 0.04 -1.02 -0.19 0.00 0.48 0.00 0.00 55.95 55.27 1q27 s SER 106 Cb -0.19 -0.53 -0.21 0.00 0.10 0.00 0.00 66.02 65.19 1q27 s SER 106 CO 0.09 -0.34 2.25 -0.81 0.98 0.00 0.00 173.24 175.41 1q27 n PRO 107 N -1.05 0.31 0.01 4.02 -0.04 -1.26 -3.10 135.00 133.89 1q27 n PRO 107 Ca -0.03 -0.59 0.00 0.00 -0.04 0.00 0.00 63.50 62.84 1q27 n PRO 107 Cb 0.63 -2.70 0.00 0.00 -0.04 0.00 0.00 33.50 31.40 1q27 n PRO 107 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1q27 n PHE 108 N 13.80 -1.39 -2.21 0.54 -0.00 -1.26 -4.97 117.46 121.97 1q27 n PHE 108 Ca 0.52 0.09 0.03 0.00 -0.00 0.00 0.00 57.45 58.09 1q27 n PHE 108 Cb 0.34 0.45 0.04 0.00 -0.00 0.00 0.00 39.48 40.30 1q27 n PHE 108 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1q27 n GLN 109 N -2.50 0.21 -1.95 -4.13 6.02 -1.18 -5.09 117.38 108.76 1q27 n GLN 109 Ca 0.00 -1.87 -0.41 0.00 -0.01 0.00 0.00 57.00 54.71 1q27 n GLN 109 Cb 0.00 -0.36 -0.02 0.00 1.02 0.00 0.00 30.24 30.88 1q27 n GLN 109 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1q27 s THR 110 N -0.43 2.46 -0.09 5.09 -4.23 -1.23 -4.92 115.64 112.28 1q27 s THR 110 Ca 0.25 0.40 0.13 0.00 -1.18 0.00 0.00 61.69 61.29 1q27 s THR 110 Cb 0.28 -3.26 0.20 0.00 1.34 0.00 0.00 72.50 71.06 1q27 s THR 110 CO -0.10 0.07 1.11 1.07 -0.54 0.00 0.00 174.62 176.22 1q27 n THR 111 N 1.94 1.60 -3.55 3.99 5.66 -1.26 -5.04 114.28 117.62 1q27 n THR 111 Ca 0.06 -1.84 -0.05 0.00 -3.05 0.00 0.00 64.05 59.17 1q27 n THR 111 Cb 0.40 0.01 0.00 0.00 -1.55 0.00 0.00 70.33 69.18 1q27 n THR 111 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1q27 n LEU 112 N -1.10 0.00 0.14 1.09 4.32 -1.26 -5.01 117.00 115.17 1q27 n LEU 112 Ca 0.11 -0.52 0.00 0.00 -0.02 0.00 0.00 56.01 55.58 1q27 n LEU 112 Cb 0.51 -0.01 0.15 0.00 -1.62 0.00 0.00 43.42 42.45 1q27 n LEU 112 CO 0.01 -0.32 0.48 -1.28 -1.22 0.00 0.00 177.39 175.06 1q27 h SER 113 N 0.12 0.00 -2.38 -1.43 0.87 -1.96 -3.47 113.55 105.30 1q27 h SER 113 Ca -0.06 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.40 1q27 h SER 113 Cb 0.23 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.17 1q27 h SER 113 CO 0.10 0.60 -0.03 -0.24 -0.53 0.00 0.00 176.83 176.73 1q27 n SER 114 N -3.54 -0.57 -4.77 6.23 2.88 -1.25 -4.63 113.62 107.97 1q27 n SER 114 Ca -0.00 -1.70 -0.40 0.00 -1.33 0.00 0.00 58.87 55.44 1q27 n SER 114 Cb 0.66 1.04 -0.06 0.00 -0.75 0.00 0.00 64.21 65.11 1q27 n SER 114 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 1q27 s PHE 115 N -4.57 3.93 0.05 0.66 0.08 -0.70 -4.91 117.98 112.52 1q27 s PHE 115 Ca 0.10 1.73 -0.28 0.00 0.12 0.00 0.00 56.93 58.60 1q27 s PHE 115 Cb -0.01 -2.84 0.10 0.00 -0.57 0.00 0.00 43.02 39.70 1q27 s PHE 115 CO 0.07 0.49 1.11 0.00 -0.10 0.00 0.00 175.22 176.80 1q27 s MET 116 N -1.18 0.77 0.31 0.44 0.23 -1.00 -0.34 119.30 118.53 1q27 s MET 116 Ca 0.38 -0.41 0.06 0.00 -1.03 0.00 0.00 55.69 54.68 1q27 s MET 116 Cb -0.24 0.27 -0.02 0.00 -1.53 0.00 0.00 34.83 33.32 1q27 s MET 116 CO 0.28 -0.35 0.44 0.00 -2.03 0.00 0.00 175.02 173.36 1q27 s VAL 118 N -2.13 1.44 0.29 0.00 1.01 0.45 -0.86 120.40 120.62 1q27 s VAL 118 Ca 0.42 -0.91 0.09 0.00 0.00 0.00 0.00 61.98 61.58 1q27 s VAL 118 Cb -0.09 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 1q27 s VAL 118 CO 0.31 0.12 0.04 -0.31 0.00 0.00 0.00 175.10 175.26 1q27 s TYR 119 N 1.48 2.70 -0.31 5.22 1.51 0.50 -0.78 117.35 127.67 1q27 s TYR 119 Ca -0.01 -0.28 -0.00 0.00 -1.01 0.00 0.00 57.07 55.77 1q27 s TYR 119 Cb -0.16 -1.34 0.07 0.00 -0.11 0.00 0.00 41.96 40.41 1q27 s TYR 119 CO -0.08 0.53 0.01 -2.00 -1.11 0.00 0.00 175.55 172.91 1q27 s GLU 120 N -3.73 2.21 -0.13 -0.62 2.56 0.59 -0.70 118.70 118.89 1q27 s GLU 120 Ca 0.33 -1.44 -0.04 0.00 0.00 0.00 0.00 54.97 53.83 1q27 s GLU 120 Cb -0.05 -3.18 -0.03 0.00 2.00 0.00 0.00 34.13 32.86 1q27 s GLU 120 CO 0.21 -0.72 0.01 -0.51 -0.56 0.00 0.00 175.26 173.69 1q27 s LEU 121 N 1.16 3.58 -0.47 2.70 1.02 -0.66 -1.89 118.68 124.12 1q27 s LEU 121 Ca -0.02 0.07 -0.16 0.00 0.02 0.00 0.00 54.13 54.04 1q27 s LEU 121 Cb -0.20 -1.85 0.06 0.00 0.02 0.00 0.00 46.19 44.22 1q27 s LEU 121 CO -0.03 0.27 0.43 -0.60 0.02 0.00 0.00 176.35 176.44 1q27 s ARG 122 N -0.25 3.01 0.00 1.70 3.00 0.07 -1.96 118.95 124.52 1q27 s ARG 122 Ca 0.06 -1.18 0.00 0.00 -1.00 0.00 0.00 55.73 53.61 1q27 s ARG 122 Cb -0.12 -4.10 0.00 0.00 0.00 0.00 0.00 34.95 30.73 1q27 s ARG 122 CO 0.02 -1.02 0.00 0.45 0.00 0.00 0.00 175.30 174.75 1q27 n SER 123 N 5.40 0.00 -3.22 -2.12 2.88 0.43 -4.25 113.62 112.75 1q27 n SER 123 Ca -0.11 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.26 1q27 n SER 123 Cb 0.45 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.84 1q27 n SER 123 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1q27 s ASP 124 N -4.00 0.55 0.12 -3.46 2.15 -1.26 -3.10 116.67 107.66 1q27 s ASP 124 Ca 0.00 -2.10 0.05 0.00 0.43 0.00 0.00 52.55 50.94 1q27 s ASP 124 Cb 0.00 0.59 -0.04 0.00 -0.30 0.00 0.00 42.92 43.17 1q27 s ASP 124 CO 0.00 -0.18 -0.13 0.00 -0.17 0.00 0.00 175.17 174.70 1q27 s ALA 125 N 0.85 1.42 0.19 3.66 0.00 -1.26 -5.01 121.76 121.61 1q27 s ALA 125 Ca 0.25 -1.29 -0.08 0.00 0.00 0.00 0.00 51.96 50.84 1q27 s ALA 125 Cb -0.05 -0.04 -0.07 0.00 0.00 0.00 0.00 23.12 22.96 1q27 s ALA 125 CO -0.09 0.05 0.48 0.99 0.00 0.00 0.00 175.76 177.20 1q27 s THR 126 N -2.32 5.03 0.22 0.00 2.01 -1.26 -5.04 115.64 114.28 1q27 s THR 126 Ca 0.09 0.29 -0.04 0.00 0.31 0.00 0.00 61.69 62.35 1q27 s THR 126 Cb -0.04 -3.62 0.05 0.00 0.01 0.00 0.00 72.50 68.91 1q27 s THR 126 CO 0.02 -0.03 0.23 -0.81 -0.69 0.00 0.00 174.62 173.35 1q27 n PRO 127 N -0.05 -0.91 -4.46 4.92 -0.04 -1.26 -4.64 135.00 128.56 1q27 n PRO 127 Ca -0.01 -0.37 -0.24 0.00 -0.04 0.00 0.00 63.50 62.85 1q27 n PRO 127 Cb 0.52 -0.30 -0.10 0.00 -0.04 0.00 0.00 33.50 33.59 1q27 n PRO 127 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1q27 s ILE 128 N -1.47 2.53 -0.34 0.52 1.09 -1.26 -5.02 121.20 117.26 1q27 s ILE 128 Ca 0.14 -2.34 -0.34 0.00 -1.10 0.00 0.00 60.65 57.01 1q27 s ILE 128 Cb -0.01 -2.39 -0.11 0.00 -1.06 0.00 0.00 42.46 38.89 1q27 s ILE 128 CO 0.10 -0.37 2.21 0.33 -0.10 0.00 0.00 174.94 177.11 1q27 n PHE 129 N -0.67 1.63 -3.10 3.97 7.35 -1.26 -4.81 117.46 120.58 1q27 n PHE 129 Ca -0.05 0.22 -0.14 0.00 -0.76 0.00 0.00 57.45 56.72 1q27 n PHE 129 Cb 0.60 -2.56 -0.04 0.00 0.35 0.00 0.00 39.48 37.83 1q27 n PHE 129 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1q27 s ASN 130 N 7.59 -0.04 -0.05 -2.13 2.47 -1.26 -5.02 114.94 116.49 1q27 s ASN 130 Ca 1.09 -2.18 -0.05 0.00 0.42 0.00 0.00 52.86 52.14 1q27 s ASN 130 Cb -0.78 0.85 -0.19 0.00 -1.45 0.00 0.00 41.25 39.69 1q27 s ASN 130 CO 0.47 -0.13 3.27 -0.81 -3.72 0.00 0.00 177.10 176.17 1q27 n PRO 131 N 3.13 1.88 0.00 0.43 -0.05 -1.26 -2.92 135.00 136.21 1q27 n PRO 131 Ca 0.21 -0.98 0.00 0.00 -0.05 0.00 0.00 63.50 62.69 1q27 n PRO 131 Cb 0.52 -1.85 0.00 0.00 -0.05 0.00 0.00 33.50 32.12 1q27 n PRO 131 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 175.50 173.74 1q27 n ASN 132 N 2.15 0.00 -0.11 3.54 5.15 -1.26 -4.99 115.26 119.75 1q27 n ASN 132 Ca 0.37 0.00 -0.17 0.00 -0.60 0.00 0.00 54.58 54.18 1q27 n ASN 132 Cb 0.81 0.04 -0.06 0.00 -0.53 0.00 0.00 39.78 40.05 1q27 n ASN 132 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1q27 n ASP 133 N -2.22 1.95 -3.34 1.20 -0.08 -1.24 -5.04 116.55 107.78 1q27 n ASP 133 Ca 0.00 0.34 0.02 0.00 -1.51 0.00 0.00 54.79 53.64 1q27 n ASP 133 Cb 0.00 -0.77 -0.03 0.00 2.34 0.00 0.00 41.12 42.66 1q27 n ASP 133 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1q27 s ILE 134 N -2.75 -0.54 0.32 5.18 -1.16 -1.18 -5.04 121.20 116.03 1q27 s ILE 134 Ca -0.33 0.00 0.11 0.00 -0.51 0.00 0.00 60.65 59.92 1q27 s ILE 134 Cb 0.08 -1.00 0.04 0.00 0.61 0.00 0.00 42.46 42.19 1q27 s ILE 134 CO 0.45 0.00 1.72 0.28 -2.81 0.00 0.00 174.94 174.59 1q27 h SER 135 N 7.68 0.02 0.00 4.50 0.02 -1.84 -3.41 113.55 120.53 1q27 h SER 135 Ca -0.16 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1q27 h SER 135 Cb 1.13 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1q27 h SER 135 CO 0.06 0.50 0.00 0.61 -1.14 0.00 0.00 176.83 176.86 1q27 n GLY 136 N -0.14 3.71 0.00 -3.77 0.00 -1.26 -4.61 105.19 99.13 1q27 n GLY 136 Ca -0.02 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 -0.14 3.24 -0.02 0.00 -1.26 -4.87 105.19 102.13 1q27 n GLY 137 Ca 0.00 -0.86 -0.14 0.00 0.00 0.00 0.00 46.02 45.02 1q27 n GLY 137 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q27 s GLU 138 N 0.00 1.32 -0.56 1.61 8.01 -1.05 -4.76 118.70 123.26 1q27 s GLU 138 Ca 0.00 -1.71 -0.17 0.00 0.01 0.00 0.00 54.97 53.10 1q27 s GLU 138 Cb 0.00 0.17 0.13 0.00 -4.31 0.00 0.00 34.13 30.11 1q27 s GLU 138 CO 0.00 -0.41 0.57 -1.58 0.01 0.00 0.00 175.26 173.85 1q27 s TRP 139 N -3.98 3.20 0.36 1.61 0.51 -1.26 -0.23 118.94 119.15 1q27 s TRP 139 Ca 0.39 -1.23 0.08 0.00 -2.12 0.00 0.00 56.10 53.22 1q27 s TRP 139 Cb 0.06 -3.86 -0.03 0.00 -0.81 0.00 0.00 33.47 28.83 1q27 s TRP 139 CO 0.14 -1.10 0.24 -0.51 -0.51 0.00 0.00 176.95 175.22 1q27 s LEU 140 N 1.85 3.37 0.38 2.99 1.43 0.28 -4.94 118.68 124.05 1q27 s LEU 140 Ca 0.06 -0.72 -0.00 0.00 -1.03 0.00 0.00 54.13 52.43 1q27 s LEU 140 Cb -0.28 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1q27 s LEU 140 CO 0.03 -0.42 0.60 0.42 0.23 0.00 0.00 176.35 177.21 1q27 s THR 141 N -2.42 4.92 0.25 5.49 -4.23 -1.26 -1.54 115.64 116.85 1q27 s THR 141 Ca 0.41 -0.37 -0.05 0.00 -1.18 0.00 0.00 61.69 60.50 1q27 s THR 141 Cb -0.03 -3.81 0.21 0.00 1.34 0.00 0.00 72.50 70.21 1q27 s THR 141 CO 0.25 -0.57 1.87 1.55 -0.54 0.00 0.00 174.62 177.18 1q27 h PRO 142 N 0.62 1.16 -0.18 3.99 0.13 -1.92 0.17 132.00 135.98 1q27 h PRO 142 Ca -0.49 -0.14 -0.05 0.00 -0.87 0.00 0.00 66.00 64.45 1q27 h PRO 142 Cb 1.22 -0.23 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 1q27 h PRO 142 CO 0.61 0.86 -0.09 0.93 -0.23 0.00 0.00 178.00 180.08 1q27 h GLU 143 N 1.17 0.37 -0.01 0.86 5.08 -1.95 -2.79 114.58 117.32 1q27 h GLU 143 Ca 0.29 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1q27 h GLU 143 Cb 0.04 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1q27 h GLU 143 CO -0.05 0.68 -0.37 0.45 -1.00 0.00 0.00 179.01 178.73 1q27 h HIS 144 N 0.06 0.02 0.51 4.33 3.86 -1.91 -2.53 115.15 119.48 1q27 h HIS 144 Ca 0.04 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.22 1q27 h HIS 144 Cb 0.57 -0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.04 1q27 h HIS 144 CO 0.06 0.38 -0.25 1.25 0.86 0.00 0.00 177.93 180.24 1q27 h LEU 145 N 0.01 -0.58 -1.42 2.43 5.85 -0.52 0.14 115.31 121.23 1q27 h LEU 145 Ca -0.00 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.74 1q27 h LEU 145 Cb 0.66 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1q27 h LEU 145 CO 0.05 -0.38 0.42 -0.07 -0.34 0.00 0.00 178.44 178.12 1q27 h LEU 146 N -0.74 0.66 -0.94 2.25 4.07 -1.43 -0.49 115.31 118.69 1q27 h LEU 146 Ca -0.07 -0.01 -0.10 0.00 0.08 0.00 0.00 57.88 57.78 1q27 h LEU 146 Cb 0.55 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.12 1q27 h LEU 146 CO 0.12 0.46 -0.36 0.00 -1.08 0.00 0.00 178.44 177.58 1q27 h ALA 147 N 1.63 1.10 0.14 1.53 0.00 -1.11 -2.22 119.26 120.34 1q27 h ALA 147 Ca 0.25 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1q27 h ALA 147 Cb 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1q27 h ALA 147 CO -0.06 0.57 -0.07 0.00 0.00 0.00 0.00 179.25 179.69 1q27 h ARG 148 N 0.28 -0.19 -0.39 0.00 3.08 0.54 -2.96 114.38 114.74 1q27 h ARG 148 Ca 0.03 0.01 0.11 0.00 0.07 0.00 0.00 59.98 60.21 1q27 h ARG 148 Cb 0.77 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1q27 h ARG 148 CO 0.06 0.24 0.29 -0.84 -1.07 0.00 0.00 179.97 178.65 1q27 h ILE 149 N -0.91 0.77 0.00 2.04 3.07 -1.19 0.13 117.51 121.43 1q27 h ILE 149 Ca -0.02 0.00 -0.11 0.00 1.55 0.00 0.00 64.86 66.28 1q27 h ILE 149 Cb 0.51 0.80 -0.02 0.00 -0.27 0.00 0.00 36.82 37.84 1q27 h ILE 149 CO 0.03 0.00 -0.53 0.00 -1.05 0.00 0.00 178.15 176.60 1q27 h ALA 150 N 1.79 0.92 -0.44 0.16 0.00 -1.43 -3.35 119.26 116.91 1q27 h ALA 150 Ca 0.19 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1q27 h ALA 150 Cb 0.76 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1q27 h ALA 150 CO -0.00 0.67 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1q27 n ALA 151 N -2.35 -0.34 0.00 0.00 0.00 0.45 -4.90 120.51 113.36 1q27 n ALA 151 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1q27 n ALA 151 Cb 0.60 0.09 0.00 0.00 0.00 0.00 0.00 19.45 20.14 1q27 n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q27 n GLY 152 N -0.94 0.00 2.89 0.00 0.00 -1.24 -5.05 105.19 100.85 1q27 n GLY 152 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 2.81 -1.75 1.61 4.71 -1.26 -4.79 120.64 121.96 1q27 n GLU 153 Ca 0.00 -3.59 -0.19 0.00 -0.01 0.00 0.00 57.16 53.37 1q27 n GLU 153 Cb 0.00 -2.27 -0.06 0.00 -1.01 0.00 0.00 31.44 28.10 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 -0.53 -0.38 -1.69 0.62 0.00 -1.26 -4.37 120.51 112.90 1q27 n ALA 154 Ca 0.53 0.27 -0.32 0.00 0.00 0.00 0.00 53.44 53.92 1q27 n ALA 154 Cb 0.26 -1.90 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 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 0.35 6.50 -0.99 0.00 0.00 -1.26 -4.05 120.51 121.07 1q27 n ALA 155 Ca -0.20 -3.47 -0.32 0.00 0.00 0.00 0.00 53.44 49.45 1q27 n ALA 155 Cb 0.63 -2.20 0.02 0.00 0.00 0.00 0.00 19.45 17.89 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 0.67 0.00 0.12 0.00 5.02 -1.26 -4.36 118.16 118.35 1q27 n LYS 156 Ca 0.52 0.00 0.19 0.00 -2.02 0.00 0.00 58.31 57.00 1q27 n LYS 156 Cb 0.44 -0.86 0.77 0.00 -0.02 0.00 0.00 35.03 35.35 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 -0.34 0.00 1.01 0.72 0.00 -1.95 -0.73 103.07 101.77 1q27 h GLY 157 Ca -0.36 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 1q27 h GLY 157 CO 0.30 0.00 0.42 -1.80 0.00 0.00 0.00 176.54 175.46 1q27 h ASP 158 N 0.00 0.88 0.02 0.19 3.58 -1.99 0.14 116.42 119.25 1q27 h ASP 158 Ca 0.17 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.54 1q27 h ASP 158 Cb 0.91 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.74 1q27 h ASP 158 CO -0.00 0.70 -0.01 -0.07 -2.88 0.00 0.00 179.24 176.98 1q27 h LEU 159 N 0.99 -0.02 -0.35 2.28 4.07 -1.41 -2.69 115.31 118.18 1q27 h LEU 159 Ca 0.26 -0.64 0.03 0.00 0.08 0.00 0.00 57.88 57.61 1q27 h LEU 159 Cb -0.01 0.01 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 1q27 h LEU 159 CO -0.05 0.64 0.15 0.00 -1.08 0.00 0.00 178.44 178.11 1q27 h ALA 160 N 0.23 0.42 0.27 1.53 0.00 -1.44 -0.27 119.26 120.00 1q27 h ALA 160 Ca -0.00 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1q27 h ALA 160 Cb 0.66 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1q27 h ALA 160 CO 0.00 -0.23 -0.17 0.93 0.00 0.00 0.00 179.25 179.79 1q27 h GLU 161 N 0.32 -0.40 0.61 0.00 5.08 -0.81 0.14 114.58 119.51 1q27 h GLU 161 Ca 0.15 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1q27 h GLU 161 Cb 0.09 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1q27 h GLU 161 CO -0.13 -0.27 -0.38 1.25 -1.00 0.00 0.00 179.01 178.48 1q27 h LEU 162 N -0.42 -0.96 -1.14 1.33 5.85 -1.32 0.15 115.31 118.81 1q27 h LEU 162 Ca -0.03 0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.83 1q27 h LEU 162 Cb 0.35 0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 1q27 h LEU 162 CO 0.02 -0.59 0.60 0.58 -0.34 0.00 0.00 178.44 178.71 1q27 h VAL 163 N -0.94 1.03 0.00 1.05 2.07 -1.04 -0.18 116.25 118.24 1q27 h VAL 163 Ca -0.07 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.10 1q27 h VAL 163 Cb 0.76 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1q27 h VAL 163 CO 0.07 0.18 0.00 0.03 0.02 0.00 0.00 177.57 177.87 1q27 h ARG 164 N 1.00 0.00 0.16 1.57 3.08 -0.47 -2.24 114.38 117.48 1q27 h ARG 164 Ca 0.41 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 60.15 1q27 h ARG 164 Cb 0.28 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.37 1q27 h ARG 164 CO -0.17 0.00 -1.29 -0.09 -1.07 0.00 0.00 179.97 177.35 1q27 h ARG 165 N 0.00 0.60 0.14 0.04 2.43 0.11 0.46 114.38 118.15 1q27 h ARG 165 Ca 0.00 -0.85 -0.28 0.00 -0.81 0.00 0.00 59.98 58.04 1q27 h ARG 165 Cb 0.72 0.29 0.01 0.00 -0.42 0.00 0.00 29.97 30.57 1q27 h ARG 165 CO 0.00 1.39 -1.27 0.00 -1.51 0.00 0.00 179.97 178.58 1q27 n TYR 167 N -3.54 0.00 0.13 0.00 4.01 -0.84 -4.63 117.16 112.28 1q27 n TYR 167 Ca -0.09 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.51 1q27 n TYR 167 Cb 1.03 -0.13 -0.08 0.00 -0.31 0.00 0.00 39.34 39.85 1q27 n TYR 167 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 1q27 h ARG 168 N 0.00 -0.30 -3.14 -0.72 2.43 -1.56 -3.47 114.38 107.62 1q27 h ARG 168 Ca 0.00 0.02 -0.40 0.00 -0.81 0.00 0.00 59.98 58.79 1q27 h ARG 168 Cb 0.00 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1q27 h ARG 168 CO 0.00 -0.03 -0.51 -1.91 -1.51 0.00 0.00 179.97 176.01 1q27 n GLU 169 N -5.12 -1.82 -3.92 0.20 0.00 0.15 -4.96 120.64 105.17 1q27 n GLU 169 Ca -0.09 0.96 -0.35 0.00 0.00 0.00 0.00 57.16 57.68 1q27 n GLU 169 Cb 0.22 -5.63 -0.11 0.00 0.00 0.00 0.00 31.44 25.92 1q27 n GLU 169 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.13 175.13 1q27 s GLU 170 N -5.06 3.85 0.00 5.31 -6.30 -1.26 -5.04 118.70 110.19 1q27 s GLU 170 Ca 0.01 -0.40 0.00 0.00 -2.50 0.00 0.00 54.97 52.08 1q27 s GLU 170 Cb -0.00 -3.27 0.00 0.00 0.00 0.00 0.00 34.13 30.86 1q27 s GLU 170 CO 0.01 0.08 0.12 -1.91 0.02 0.00 0.00 175.26 173.58