#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q82 n HIS 11 N 0.00 -1.90 0.00 2.97 1.44 -1.26 -3.72 115.22 112.75 1q82 n HIS 11 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1q82 n HIS 11 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 1q82 n HIS 11 CO 0.00 0.00 0.00 -1.91 -2.81 0.00 0.00 176.34 171.62 1q82 n GLU 12 N -1.14 0.00 -0.21 -1.40 2.13 -1.26 -4.09 120.64 114.67 1q82 n GLU 12 Ca 0.00 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.90 1q82 n GLU 12 Cb 0.00 -0.12 0.19 0.00 0.27 0.00 0.00 31.44 31.78 1q82 n GLU 12 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1q82 n MET 13 N 0.00 2.54 0.00 5.31 2.81 -1.24 -4.26 117.12 122.28 1q82 n MET 13 Ca 0.00 -2.14 0.00 0.00 -1.81 0.00 0.00 57.70 53.75 1q82 n MET 13 Cb 0.00 -1.37 0.00 0.00 -0.71 0.00 0.00 33.22 31.14 1q82 n MET 13 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1q82 n ARG 14 N 0.93 2.33 -2.56 0.03 5.12 -1.25 -4.38 116.66 116.88 1q82 n ARG 14 Ca 0.15 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.65 1q82 n ARG 14 Cb 0.48 -0.80 -0.03 0.00 -1.16 0.00 0.00 32.46 30.95 1q82 n ARG 14 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 1q82 s GLU 15 N -1.53 4.46 1.02 5.56 -1.05 -1.26 -4.86 118.70 121.04 1q82 s GLU 15 Ca 0.00 1.59 -0.23 0.00 -0.15 0.00 0.00 54.97 56.18 1q82 s GLU 15 Cb 0.00 -3.44 -0.08 0.00 -0.44 0.00 0.00 34.13 30.18 1q82 s GLU 15 CO 0.00 -0.22 -0.92 -2.30 0.95 0.00 0.00 175.26 172.77 1q82 n PRO 16 N 4.21 -0.63 -3.58 -4.83 -0.02 -1.26 -4.51 135.00 124.38 1q82 n PRO 16 Ca 0.08 -0.18 -0.07 0.00 -2.02 0.00 0.00 63.50 61.31 1q82 n PRO 16 Cb 0.48 -1.25 -0.03 0.00 -0.02 0.00 0.00 33.50 32.68 1q82 n PRO 16 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1q82 s ARG 17 N -2.53 0.48 -0.14 -0.52 1.70 -0.95 -4.94 118.95 112.05 1q82 s ARG 17 Ca 0.41 -0.04 -0.23 0.00 -0.47 0.00 0.00 55.73 55.41 1q82 s ARG 17 Cb 0.03 0.22 -0.03 0.00 -0.57 0.00 0.00 34.95 34.60 1q82 s ARG 17 CO 0.62 -0.18 0.69 0.42 -1.08 0.00 0.00 175.30 175.77 1q82 s ILE 18 N -1.86 5.01 -0.31 4.99 1.01 -1.26 -2.62 121.20 126.16 1q82 s ILE 18 Ca 0.04 1.36 0.03 0.00 0.00 0.00 0.00 60.65 62.08 1q82 s ILE 18 Cb -0.01 -4.01 0.09 0.00 0.01 0.00 0.00 42.46 38.54 1q82 s ILE 18 CO -0.04 0.15 0.02 -0.70 0.00 0.00 0.00 174.94 174.37 1q82 s GLU 19 N 1.49 1.52 0.48 2.79 2.12 -0.40 -4.67 118.70 122.03 1q82 s GLU 19 Ca 0.34 -1.57 0.00 0.00 0.36 0.00 0.00 54.97 54.10 1q82 s GLU 19 Cb -0.17 -2.91 0.00 0.00 0.26 0.00 0.00 34.13 31.31 1q82 s GLU 19 CO 0.13 -0.84 0.00 0.36 -0.54 0.00 0.00 175.26 174.37 1q82 n LYS 20 N 4.41 -4.09 -3.79 4.30 2.85 -1.20 -3.93 118.16 116.72 1q82 n LYS 20 Ca -0.02 3.06 -0.26 0.00 -1.05 0.00 0.00 58.31 60.04 1q82 n LYS 20 Cb 0.42 -3.48 -0.17 0.00 -0.65 0.00 0.00 35.03 31.15 1q82 n LYS 20 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1q82 s VAL 21 N -3.51 0.64 -0.29 0.58 1.01 0.46 -2.40 120.40 116.90 1q82 s VAL 21 Ca 0.00 -0.39 -0.16 0.00 0.00 0.00 0.00 61.98 61.43 1q82 s VAL 21 Cb 0.00 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 1q82 s VAL 21 CO 0.00 0.01 0.43 -0.69 0.00 0.00 0.00 175.10 174.85 1q82 s VAL 22 N 1.83 5.12 -0.30 2.92 1.01 -0.50 -1.44 120.40 129.04 1q82 s VAL 22 Ca 0.01 0.57 -0.06 0.00 0.00 0.00 0.00 61.98 62.50 1q82 s VAL 22 Cb -0.15 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.47 1q82 s VAL 22 CO -0.07 0.06 0.06 0.68 0.00 0.00 0.00 175.10 175.83 1q82 s VAL 23 N 2.18 3.68 -0.00 2.92 -7.23 -0.45 -0.79 120.40 120.71 1q82 s VAL 23 Ca 0.17 -0.93 0.01 0.00 -1.81 0.00 0.00 61.98 59.42 1q82 s VAL 23 Cb -0.16 -2.97 -0.00 0.00 0.56 0.00 0.00 36.38 33.81 1q82 s VAL 23 CO 0.10 0.00 -0.04 -2.28 -0.31 0.00 0.00 175.10 172.58 1q82 s HIS 24 N 1.43 0.34 -0.45 2.82 5.04 -0.65 -0.73 115.29 123.08 1q82 s HIS 24 Ca 0.00 -0.08 -0.09 0.00 -1.54 0.00 0.00 55.06 53.36 1q82 s HIS 24 Cb -0.18 -0.22 0.11 0.00 0.04 0.00 0.00 32.58 32.33 1q82 s HIS 24 CO 0.01 -0.01 0.31 -1.64 -2.34 0.00 0.00 174.74 171.07 1q82 s MET 25 N -0.15 2.47 -1.29 2.88 -1.94 -0.45 -1.90 119.30 118.92 1q82 s MET 25 Ca 0.01 -1.68 -0.18 0.00 -1.71 0.00 0.00 55.69 52.12 1q82 s MET 25 Cb -0.02 -3.85 0.03 0.00 2.01 0.00 0.00 34.83 33.00 1q82 s MET 25 CO -0.00 -1.11 1.89 0.41 -0.01 0.00 0.00 175.02 176.19 1q82 n GLY 26 N 4.88 2.77 0.47 -0.03 0.00 -1.26 -3.29 105.19 108.73 1q82 n GLY 26 Ca -0.08 -1.37 -0.04 0.00 0.00 0.00 0.00 46.02 44.53 1q82 n GLY 26 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1q82 n ILE 27 N 6.29 0.00 -1.72 -0.61 5.41 -1.19 -5.00 119.36 122.54 1q82 n ILE 27 Ca 0.49 -0.10 0.06 0.00 1.00 0.00 0.00 62.75 64.20 1q82 n ILE 27 Cb 0.44 -1.57 0.17 0.00 -0.71 0.00 0.00 39.64 37.97 1q82 n ILE 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1q82 n GLY 28 N 2.96 4.29 0.00 7.39 0.00 -1.26 -4.59 105.19 113.98 1q82 n GLY 28 Ca 0.02 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1q82 n GLY 28 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1q82 n HIS 29 N -0.84 0.00 -2.68 1.61 -0.00 -1.26 -4.98 115.22 107.07 1q82 n HIS 29 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.88 1q82 n HIS 29 Cb 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.76 1q82 n HIS 29 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1q82 n ALA 35 N 0.00 0.00 0.07 1.59 0.00 -1.26 -4.76 120.51 116.14 1q82 n ALA 35 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1q82 n ALA 35 Cb 0.00 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.64 1q82 n ALA 35 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1q82 n ASN 36 N 3.00 0.00 0.25 0.00 6.94 -1.26 -0.23 115.26 123.96 1q82 n ASN 36 Ca 0.00 0.59 0.10 0.00 -0.02 0.00 0.00 54.58 55.25 1q82 n ASN 36 Cb 0.00 -0.12 0.64 0.00 -2.36 0.00 0.00 39.78 37.94 1q82 n ASN 36 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1q82 h ALA 37 N 0.23 1.41 -0.69 -2.53 0.00 -2.01 -3.18 119.26 112.50 1q82 h ALA 37 Ca 0.22 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.13 1q82 h ALA 37 Cb 2.32 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 19.98 1q82 h ALA 37 CO -0.00 0.19 0.13 0.93 0.00 0.00 0.00 179.25 180.50 1q82 h GLU 38 N 0.00 0.23 -0.82 0.00 5.08 -1.04 -2.52 114.58 115.51 1q82 h GLU 38 Ca -0.00 -0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.47 1q82 h GLU 38 Cb 0.35 -0.05 -0.13 0.00 0.50 0.00 0.00 28.75 29.42 1q82 h GLU 38 CO 0.02 0.15 -0.41 -0.44 -1.00 0.00 0.00 179.01 177.33 1q82 h ASP 39 N 0.23 -1.47 -0.44 1.42 3.32 -1.79 0.19 116.42 117.88 1q82 h ASP 39 Ca 0.38 0.28 -0.06 0.00 0.02 0.00 0.00 57.03 57.65 1q82 h ASP 39 Cb 0.63 0.73 -0.02 0.00 0.22 0.00 0.00 39.33 40.88 1q82 h ASP 39 CO -0.50 -0.30 0.08 0.16 -1.72 0.00 0.00 179.24 176.96 1q82 h ILE 40 N -0.08 1.23 -0.72 0.35 3.07 -1.68 -1.94 117.51 117.73 1q82 h ILE 40 Ca 0.27 -0.88 -0.05 0.00 1.55 0.00 0.00 64.86 65.75 1q82 h ILE 40 Cb 0.56 0.76 -0.03 0.00 -0.27 0.00 0.00 36.82 37.84 1q82 h ILE 40 CO -0.86 0.32 0.24 -0.07 -1.05 0.00 0.00 178.15 176.73 1q82 h LEU 41 N 0.76 1.02 -1.09 0.16 3.38 -0.88 0.29 115.31 118.94 1q82 h LEU 41 Ca 0.16 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1q82 h LEU 41 Cb 0.35 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 1q82 h LEU 41 CO 0.01 0.93 0.61 1.23 0.09 0.00 0.00 178.44 181.31 1q82 h GLY 42 N 1.10 1.33 1.02 0.83 0.00 0.06 -1.44 103.07 105.97 1q82 h GLY 42 Ca 0.24 -0.47 -0.30 0.00 0.00 0.00 0.00 47.33 46.79 1q82 h GLY 42 CO -0.01 0.42 -1.38 0.83 0.00 0.00 0.00 176.54 176.40 1q82 h GLU 43 N 1.20 0.45 0.00 4.80 5.08 -1.22 -0.49 114.58 124.39 1q82 h GLU 43 Ca 0.36 -0.76 -0.01 0.00 -1.00 0.00 0.00 59.36 57.95 1q82 h GLU 43 Cb -0.04 0.28 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 1q82 h GLU 43 CO -0.10 1.36 -0.07 0.97 -1.00 0.00 0.00 179.01 180.18 1q82 h ILE 44 N -0.01 0.73 0.00 3.13 2.10 -0.76 -3.34 117.51 119.37 1q82 h ILE 44 Ca -0.25 -0.27 -0.01 0.00 1.08 0.00 0.00 64.86 65.41 1q82 h ILE 44 Cb 2.02 1.16 -0.00 0.00 -1.09 0.00 0.00 36.82 38.90 1q82 h ILE 44 CO 0.22 0.07 -0.65 0.35 -1.08 0.00 0.00 178.15 177.05 1q82 n THR 45 N -4.00 1.37 0.00 2.19 -2.24 -0.56 -4.94 114.28 106.10 1q82 n THR 45 Ca -0.03 0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 1q82 n THR 45 Cb 0.16 -2.02 0.00 0.00 -2.10 0.00 0.00 70.33 66.37 1q82 n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1q82 n GLY 46 N 2.29 0.61 3.28 3.38 0.00 -0.20 -4.94 105.19 109.62 1q82 n GLY 46 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 1q82 n GLY 46 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1q82 s GLN 47 N 0.00 0.82 0.24 1.61 -2.07 -1.23 -5.02 119.66 114.01 1q82 s GLN 47 Ca 0.00 -0.35 -0.28 0.00 -1.82 0.00 0.00 55.36 52.91 1q82 s GLN 47 Cb 0.00 0.36 -0.16 0.00 -1.09 0.00 0.00 33.01 32.12 1q82 s GLN 47 CO 0.00 -0.26 0.70 -1.33 -1.32 0.00 0.00 175.29 173.08 1q82 n MET 48 N 0.73 0.52 -2.63 9.60 2.81 -1.26 -4.55 117.12 122.34 1q82 n MET 48 Ca -0.19 0.18 -0.24 0.00 -1.81 0.00 0.00 57.70 55.64 1q82 n MET 48 Cb 0.59 -1.32 0.03 0.00 -0.71 0.00 0.00 33.22 31.80 1q82 n MET 48 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 1q82 s PRO 49 N -1.22 2.83 -0.02 0.03 0.02 -1.26 -4.86 135.00 130.53 1q82 s PRO 49 Ca 0.62 -0.34 0.07 0.00 0.02 0.00 0.00 61.00 61.36 1q82 s PRO 49 Cb -0.84 -2.40 -0.02 0.00 0.02 0.00 0.00 34.50 31.26 1q82 s PRO 49 CO 0.58 -0.60 -0.23 0.08 -0.33 0.00 0.00 177.00 176.49 1q82 s VAL 50 N -2.82 1.82 0.93 3.83 1.01 0.18 -4.90 120.40 120.45 1q82 s VAL 50 Ca 0.53 -0.98 -0.11 0.00 0.00 0.00 0.00 61.98 61.42 1q82 s VAL 50 Cb -0.10 -1.51 0.10 0.00 0.00 0.00 0.00 36.38 34.87 1q82 s VAL 50 CO 0.41 0.51 0.84 0.54 0.00 0.00 0.00 175.10 177.40 1q82 n ARG 51 N 2.53 -0.38 -3.64 2.72 5.12 -1.26 -1.53 116.66 120.22 1q82 n ARG 51 Ca -0.16 -0.06 -0.29 0.00 -1.93 0.00 0.00 57.85 55.42 1q82 n ARG 51 Cb 0.52 -2.16 -0.13 0.00 -1.16 0.00 0.00 32.46 29.54 1q82 n ARG 51 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1q82 s THR 52 N -2.53 1.07 1.00 0.55 2.01 0.32 -4.71 115.64 113.35 1q82 s THR 52 Ca 0.63 -2.40 -0.12 0.00 0.31 0.00 0.00 61.69 60.11 1q82 s THR 52 Cb -0.22 -1.75 0.19 0.00 0.01 0.00 0.00 72.50 70.72 1q82 s THR 52 CO 0.62 -0.94 1.08 -0.54 -0.69 0.00 0.00 174.62 174.15 1q82 s LYS 53 N 0.46 0.43 0.20 4.92 1.02 -1.25 -1.44 119.74 124.08 1q82 s LYS 53 Ca 0.19 0.87 0.07 0.00 0.02 0.00 0.00 55.97 57.11 1q82 s LYS 53 Cb -0.22 -1.71 -0.05 0.00 -0.52 0.00 0.00 37.83 35.34 1q82 s LYS 53 CO -0.01 -2.82 -0.12 0.00 -0.92 0.00 0.00 175.35 171.47 1q82 s ALA 54 N -2.76 1.94 0.13 5.17 0.00 -1.17 -4.85 121.76 120.22 1q82 s ALA 54 Ca 0.66 -1.66 0.08 0.00 0.00 0.00 0.00 51.96 51.04 1q82 s ALA 54 Cb -0.21 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 1q82 s ALA 54 CO 0.59 0.02 -0.11 0.15 0.00 0.00 0.00 175.76 176.41 1q82 s LYS 55 N -3.68 2.05 0.18 0.00 1.02 -1.26 -4.27 119.74 113.78 1q82 s LYS 55 Ca 0.22 -1.12 0.00 0.00 0.02 0.00 0.00 55.97 55.09 1q82 s LYS 55 Cb 0.00 -2.23 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 1q82 s LYS 55 CO 0.06 0.48 0.00 0.54 -0.92 0.00 0.00 175.35 175.51 1q82 n ARG 56 N 0.51 -1.41 -3.24 1.68 1.74 -1.26 -4.94 116.66 109.74 1q82 n ARG 56 Ca -0.13 1.07 -0.39 0.00 -0.77 0.00 0.00 57.85 57.63 1q82 n ARG 56 Cb 0.53 -1.26 -0.06 0.00 -1.02 0.00 0.00 32.46 30.65 1q82 n ARG 56 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1q82 s THR 57 N -3.43 5.11 0.05 0.55 2.01 -1.26 -4.70 115.64 113.97 1q82 s THR 57 Ca 0.00 1.00 -0.01 0.00 0.31 0.00 0.00 61.69 62.99 1q82 s THR 57 Cb 0.00 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 1q82 s THR 57 CO 0.00 0.21 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.41 1q82 s VAL 58 N 1.41 0.27 0.50 3.82 1.01 0.17 -4.90 120.40 122.67 1q82 s VAL 58 Ca 0.25 -1.74 0.29 0.00 0.00 0.00 0.00 61.98 60.79 1q82 s VAL 58 Cb -0.15 -1.42 0.48 0.00 0.00 0.00 0.00 36.38 35.29 1q82 s VAL 58 CO 0.10 -0.94 1.84 1.23 0.00 0.00 0.00 175.10 177.33 1q82 h GLY 59 N 3.27 0.31 -4.74 4.51 0.00 -1.98 -2.10 103.07 102.34 1q82 h GLY 59 Ca -0.34 -0.06 -0.19 0.00 0.00 0.00 0.00 47.33 46.74 1q82 h GLY 59 CO 0.63 -0.03 0.81 -1.84 0.00 0.00 0.00 176.54 176.12 1q82 n GLU 60 N -4.33 1.44 -2.46 4.80 0.28 -1.26 -4.49 120.64 114.62 1q82 n GLU 60 Ca 0.22 -0.85 -0.07 0.00 -0.16 0.00 0.00 57.16 56.31 1q82 n GLU 60 Cb 1.01 -1.99 -0.01 0.00 1.43 0.00 0.00 31.44 31.88 1q82 n GLU 60 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1q82 n PHE 61 N 3.17 -1.48 -3.53 -1.84 -0.00 -1.20 -4.77 117.46 107.81 1q82 n PHE 61 Ca 0.31 0.11 -0.31 0.00 -0.00 0.00 0.00 57.45 57.55 1q82 n PHE 61 Cb 0.40 -0.94 -0.07 0.00 -0.00 0.00 0.00 39.48 38.87 1q82 n PHE 61 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1q82 n ASP 62 N -1.32 4.05 -0.06 -2.13 2.03 -0.79 -4.76 116.55 113.56 1q82 n ASP 62 Ca 0.02 -3.32 -0.02 0.00 0.52 0.00 0.00 54.79 51.99 1q82 n ASP 62 Cb 0.39 -0.85 -0.16 0.00 -0.72 0.00 0.00 41.12 39.78 1q82 n ASP 62 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1q82 n ILE 63 N 1.47 0.85 -1.76 5.18 -5.35 -1.25 0.44 119.36 118.94 1q82 n ILE 63 Ca 0.25 -0.72 -0.42 0.00 -0.27 0.00 0.00 62.75 61.60 1q82 n ILE 63 Cb 0.38 -0.29 -0.03 0.00 -1.74 0.00 0.00 39.64 37.95 1q82 n ILE 63 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1q82 s ARG 64 N -2.90 4.15 0.00 6.28 3.52 -1.26 -4.28 118.95 124.46 1q82 s ARG 64 Ca -0.09 2.54 0.00 0.00 -0.13 0.00 0.00 55.73 58.05 1q82 s ARG 64 Cb 0.09 -3.65 0.00 0.00 -1.56 0.00 0.00 34.95 29.83 1q82 s ARG 64 CO 0.86 -0.83 0.30 -1.91 -0.81 0.00 0.00 175.30 172.91 1q82 n GLU 65 N 5.86 0.00 -2.39 5.12 2.13 -1.26 -4.49 120.64 125.60 1q82 n GLU 65 Ca 0.18 0.21 -0.43 0.00 0.66 0.00 0.00 57.16 57.78 1q82 n GLU 65 Cb 0.39 -0.93 -0.02 0.00 0.27 0.00 0.00 31.44 31.15 1q82 n GLU 65 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1q82 s GLY 66 N -1.00 1.34 -0.29 8.31 0.00 -1.26 -3.07 107.32 111.35 1q82 s GLY 66 Ca 0.00 0.09 -0.15 0.00 0.00 0.00 0.00 44.72 44.66 1q82 s GLY 66 CO 0.00 2.63 0.89 0.51 0.00 0.00 0.00 173.10 177.13 1q82 s ASP 67 N 3.02 -0.67 0.05 1.64 -4.77 -1.26 -4.95 116.67 109.72 1q82 s ASP 67 Ca 0.58 1.02 -0.32 0.00 -3.30 0.00 0.00 52.55 50.54 1q82 s ASP 67 Cb -0.17 1.43 -0.10 0.00 -1.09 0.00 0.00 42.92 42.99 1q82 s ASP 67 CO 0.25 -0.16 1.89 -2.65 0.70 0.00 0.00 175.17 175.20 1q82 n PRO 68 N 4.23 2.67 -2.00 2.11 -0.02 -1.26 -3.54 135.00 137.18 1q82 n PRO 68 Ca -0.16 0.97 0.01 0.00 -2.02 0.00 0.00 63.50 62.30 1q82 n PRO 68 Cb 0.56 -2.88 0.03 0.00 -0.02 0.00 0.00 33.50 31.19 1q82 n PRO 68 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1q82 n ILE 69 N 5.07 0.45 0.00 4.25 5.41 -0.52 -4.28 119.36 129.73 1q82 n ILE 69 Ca 0.20 -1.60 0.00 0.00 1.00 0.00 0.00 62.75 62.34 1q82 n ILE 69 Cb 0.37 1.07 0.00 0.00 -0.71 0.00 0.00 39.64 40.37 1q82 n ILE 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1q82 n GLY 70 N -0.05 3.03 3.21 7.39 0.00 -1.25 -3.20 105.19 114.31 1q82 n GLY 70 Ca 0.02 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.19 1q82 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q82 s ALA 71 N -1.92 0.42 0.19 4.61 0.00 -1.21 0.12 121.76 123.97 1q82 s ALA 71 Ca 0.00 -1.15 -0.03 0.00 0.00 0.00 0.00 51.96 50.78 1q82 s ALA 71 Cb 0.00 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.82 1q82 s ALA 71 CO 0.00 -0.52 0.16 -1.59 0.00 0.00 0.00 175.76 173.81 1q82 s LYS 72 N -3.98 1.19 -0.19 0.00 -2.85 -0.58 -1.34 119.74 111.98 1q82 s LYS 72 Ca 0.17 -1.54 -0.05 0.00 -1.00 0.00 0.00 55.97 53.55 1q82 s LYS 72 Cb 0.06 0.29 0.10 0.00 -2.06 0.00 0.00 37.83 36.22 1q82 s LYS 72 CO -0.02 -0.40 0.35 0.08 0.10 0.00 0.00 175.35 175.46 1q82 s VAL 73 N -4.12 -0.54 -0.39 1.79 1.01 0.09 -0.65 120.40 117.59 1q82 s VAL 73 Ca 0.34 0.11 -0.18 0.00 0.00 0.00 0.00 61.98 62.25 1q82 s VAL 73 Cb 0.06 -0.65 0.01 0.00 0.00 0.00 0.00 36.38 35.80 1q82 s VAL 73 CO 0.10 0.00 0.49 0.42 0.00 0.00 0.00 175.10 176.11 1q82 s THR 74 N 2.52 5.03 -0.14 3.92 -4.23 -1.26 -1.34 115.64 120.13 1q82 s THR 74 Ca 0.04 0.01 -0.06 0.00 -1.18 0.00 0.00 61.69 60.50 1q82 s THR 74 Cb -0.13 -4.02 -0.04 0.00 1.34 0.00 0.00 72.50 69.65 1q82 s THR 74 CO -0.12 -0.34 0.08 -0.76 -0.54 0.00 0.00 174.62 172.93 1q82 s LEU 75 N 2.33 3.98 0.03 4.79 1.43 -0.52 -4.87 118.68 125.84 1q82 s LEU 75 Ca 0.16 0.23 0.05 0.00 -1.03 0.00 0.00 54.13 53.54 1q82 s LEU 75 Cb -0.16 -1.97 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 1q82 s LEU 75 CO 0.14 0.29 -0.15 -0.13 0.23 0.00 0.00 176.35 176.74 1q82 s ARG 76 N -0.35 1.05 6.63 1.70 0.52 -1.26 -0.40 118.95 126.83 1q82 s ARG 76 Ca 0.10 -0.71 0.00 0.00 -0.52 0.00 0.00 55.73 54.60 1q82 s ARG 76 Cb -0.12 -1.05 0.00 0.00 0.52 0.00 0.00 34.95 34.30 1q82 s ARG 76 CO 0.02 0.27 0.00 -0.25 0.02 0.00 0.00 175.30 175.36 1q82 n ASP 77 N 2.13 0.00 -0.18 0.23 8.00 -1.26 -3.43 116.55 122.03 1q82 n ASP 77 Ca -0.17 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.25 1q82 n ASP 77 Cb 0.55 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.66 1q82 n ASP 77 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1q82 h GLU 78 N 0.00 0.75 -0.99 -1.24 5.08 -1.99 -1.69 114.58 114.50 1q82 h GLU 78 Ca 0.00 -0.11 0.28 0.00 -1.00 0.00 0.00 59.36 58.53 1q82 h GLU 78 Cb 0.00 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.07 1q82 h GLU 78 CO 0.00 0.62 0.71 0.52 -1.00 0.00 0.00 179.01 179.86 1q82 h MET 79 N 0.69 0.02 0.22 2.33 2.86 -1.95 0.25 114.93 119.35 1q82 h MET 79 Ca 0.18 -0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.47 1q82 h MET 79 Cb 0.12 -0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.80 1q82 h MET 79 CO -0.02 0.01 -1.61 0.00 1.06 0.00 0.00 176.91 176.35 1q82 h ALA 80 N 1.51 -0.00 0.51 6.32 0.00 -1.45 -3.18 119.26 122.96 1q82 h ALA 80 Ca 0.47 -1.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1q82 h ALA 80 Cb 1.86 0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.96 1q82 h ALA 80 CO -0.01 0.86 -0.24 0.93 0.00 0.00 0.00 179.25 180.78 1q82 h GLU 81 N 0.13 -0.66 0.00 0.00 5.08 -0.56 -0.84 114.58 117.72 1q82 h GLU 81 Ca -0.30 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1q82 h GLU 81 Cb 2.14 0.15 0.00 0.00 0.50 0.00 0.00 28.75 31.54 1q82 h GLU 81 CO 0.23 -0.44 0.68 0.93 -1.00 0.00 0.00 179.01 179.41 1q82 h GLU 82 N -1.10 0.00 0.04 2.33 5.08 -0.76 1.01 114.58 121.18 1q82 h GLU 82 Ca -0.07 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.03 1q82 h GLU 82 Cb 0.52 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 1q82 h GLU 82 CO 0.11 0.00 -1.40 0.35 -1.00 0.00 0.00 179.01 177.07 1q82 h PHE 83 N 0.00 0.17 0.00 4.33 3.57 -1.49 -3.35 116.94 120.16 1q82 h PHE 83 Ca 0.00 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.38 1q82 h PHE 83 Cb 1.35 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.08 1q82 h PHE 83 CO 0.00 1.55 0.00 -0.07 -2.23 0.00 0.00 178.31 177.56 1q82 h LEU 84 N -0.67 0.00 -0.51 0.59 3.38 0.23 -1.35 115.31 116.98 1q82 h LEU 84 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1q82 h LEU 84 Cb 1.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.27 1q82 h LEU 84 CO -0.10 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.43 1q82 n GLN 85 N -2.94 0.60 0.00 1.13 6.02 0.13 -2.28 117.38 120.04 1q82 n GLN 85 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1q82 n GLN 85 Cb 0.21 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.32 1q82 n GLN 85 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1q82 n THR 86 N -0.14 0.00 0.15 5.09 -2.24 -0.94 -4.88 114.28 111.32 1q82 n THR 86 Ca 0.00 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.72 1q82 n THR 86 Cb 0.08 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.28 1q82 n THR 86 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1q82 h ALA 87 N 0.00 -0.87 -0.99 6.98 0.00 -1.06 -3.08 119.26 120.25 1q82 h ALA 87 Ca 0.00 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 54.96 1q82 h ALA 87 Cb 0.00 0.15 -0.14 0.00 0.00 0.00 0.00 17.79 17.79 1q82 h ALA 87 CO 0.00 -0.85 -0.47 -0.07 0.00 0.00 0.00 179.25 177.87 1q82 h LEU 88 N -0.46 -1.71 -1.90 0.00 3.38 -1.73 0.71 115.31 113.60 1q82 h LEU 88 Ca -0.04 0.32 0.36 0.00 0.09 0.00 0.00 57.88 58.61 1q82 h LEU 88 Cb 0.29 0.83 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 1q82 h LEU 88 CO 0.06 -0.27 0.89 -0.65 0.09 0.00 0.00 178.44 178.57 1q82 h PRO 89 N -0.01 0.05 -0.12 1.13 0.11 -1.76 0.88 132.00 132.27 1q82 h PRO 89 Ca 0.27 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 1q82 h PRO 89 Cb 0.53 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.63 1q82 h PRO 89 CO -0.96 0.03 0.00 1.28 -0.21 0.00 0.00 178.00 178.14 1q82 n LEU 90 N -4.23 0.87 -4.28 2.35 4.77 0.25 -4.80 117.00 111.92 1q82 n LEU 90 Ca 0.28 -0.40 -0.20 0.00 -0.03 0.00 0.00 56.01 55.66 1q82 n LEU 90 Cb 1.29 -0.08 -0.11 0.00 -2.33 0.00 0.00 43.42 42.18 1q82 n LEU 90 CO 0.38 0.20 -0.47 0.00 -1.33 0.00 0.00 177.39 176.17 1q82 s ALA 91 N -1.84 1.72 0.02 -1.18 0.00 0.31 -5.00 121.76 115.79 1q82 s ALA 91 Ca 0.22 -1.34 -0.04 0.00 0.00 0.00 0.00 51.96 50.79 1q82 s ALA 91 Cb 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 1q82 s ALA 91 CO 0.17 0.20 -0.08 0.39 0.00 0.00 0.00 175.76 176.44 1q82 n GLU 92 N 0.58 0.11 -0.28 0.00 1.02 -1.26 -4.94 120.64 115.87 1q82 n GLU 92 Ca -0.16 0.05 -0.11 0.00 -0.02 0.00 0.00 57.16 56.92 1q82 n GLU 92 Cb 0.56 -0.64 0.01 0.00 -0.02 0.00 0.00 31.44 31.35 1q82 n GLU 92 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1q82 n LEU 93 N -3.56 -1.28 0.00 -4.62 4.77 -1.26 -4.90 117.00 106.15 1q82 n LEU 93 Ca -0.03 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1q82 n LEU 93 Cb 0.11 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1q82 n LEU 93 CO 0.05 -1.21 0.00 0.00 -1.33 0.00 0.00 177.39 174.89 1q82 n ALA 94 N -0.85 0.00 -1.21 -1.18 0.00 -1.24 -4.83 120.51 111.20 1q82 n ALA 94 Ca -0.01 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.49 1q82 n ALA 94 Cb 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.61 1q82 n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1q82 n THR 95 N -0.16 -1.13 0.00 0.00 -2.24 -1.26 -4.27 114.28 105.22 1q82 n THR 95 Ca 0.00 0.72 0.00 0.00 -2.27 0.00 0.00 64.05 62.50 1q82 n THR 95 Cb 0.00 -1.15 0.00 0.00 -2.10 0.00 0.00 70.33 67.08 1q82 n THR 95 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1q82 n SER 96 N -3.14 0.00 -0.49 3.42 3.41 -1.26 -4.08 113.62 111.48 1q82 n SER 96 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1q82 n SER 96 Cb 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 1q82 n SER 96 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1q82 n GLN 97 N 0.00 0.97 -4.22 4.33 7.27 -1.26 -4.79 117.38 119.68 1q82 n GLN 97 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.77 1q82 n GLN 97 Cb 0.00 -1.47 -0.09 0.00 2.41 0.00 0.00 30.24 31.08 1q82 n GLN 97 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1q82 s PHE 98 N -1.03 2.81 1.08 3.69 0.40 -1.26 -4.11 117.98 119.57 1q82 s PHE 98 Ca 0.00 -0.12 -0.15 0.00 -0.60 0.00 0.00 56.93 56.07 1q82 s PHE 98 Cb 0.00 -1.47 0.23 0.00 0.51 0.00 0.00 43.02 42.29 1q82 s PHE 98 CO 0.00 0.44 1.09 0.34 0.70 0.00 0.00 175.22 177.78 1q82 s ASP 99 N -2.17 1.88 0.00 1.36 2.15 0.41 -4.90 116.67 115.41 1q82 s ASP 99 Ca 0.22 1.03 0.25 0.00 0.43 0.00 0.00 52.55 54.48 1q82 s ASP 99 Cb -0.11 -1.59 0.48 0.00 -0.30 0.00 0.00 42.92 41.39 1q82 s ASP 99 CO 0.14 -3.57 1.39 0.47 -0.17 0.00 0.00 175.17 173.43 1q82 n ASP 100 N -4.45 0.60 -0.84 -0.34 9.92 -1.26 -3.45 116.55 116.73 1q82 n ASP 100 Ca 0.07 -0.38 0.08 0.00 -0.53 0.00 0.00 54.79 54.03 1q82 n ASP 100 Cb 0.58 0.29 0.19 0.00 -0.64 0.00 0.00 41.12 41.54 1q82 n ASP 100 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1q82 n THR 101 N -1.40 0.83 -1.51 -3.53 -1.04 -1.26 -4.29 114.28 102.08 1q82 n THR 101 Ca 0.06 -0.92 0.00 0.00 -2.04 0.00 0.00 64.05 61.16 1q82 n THR 101 Cb 0.34 0.64 0.00 0.00 -1.82 0.00 0.00 70.33 69.49 1q82 n THR 101 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1q82 n GLY 102 N 0.90 0.86 3.85 3.41 0.00 -1.11 -4.21 105.19 108.89 1q82 n GLY 102 Ca 0.15 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1q82 n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1q82 s ASN 103 N -2.72 4.46 -0.26 1.61 0.02 -1.26 -4.19 114.94 112.59 1q82 s ASN 103 Ca 0.00 -1.39 -0.27 0.00 -1.02 0.00 0.00 52.86 50.18 1q82 s ASN 103 Cb 0.00 0.45 0.15 0.00 0.02 0.00 0.00 41.25 41.88 1q82 s ASN 103 CO 0.00 -1.01 1.20 0.72 0.02 0.00 0.00 177.10 178.02 1q82 s PHE 104 N -2.81 -0.27 -0.03 2.20 -0.12 -1.19 0.16 117.98 115.92 1q82 s PHE 104 Ca 0.24 0.59 0.05 0.00 -0.05 0.00 0.00 56.93 57.76 1q82 s PHE 104 Cb -0.01 0.43 -0.01 0.00 -0.63 0.00 0.00 43.02 42.81 1q82 s PHE 104 CO 0.15 -0.16 -0.17 0.45 -0.05 0.00 0.00 175.22 175.43 1q82 s SER 105 N -0.27 2.10 0.10 1.98 0.15 -1.26 -1.81 113.70 114.69 1q82 s SER 105 Ca 0.04 -0.34 -0.00 0.00 0.70 0.00 0.00 55.95 56.35 1q82 s SER 105 Cb -0.04 -0.46 -0.04 0.00 -1.71 0.00 0.00 66.02 63.78 1q82 s SER 105 CO -0.08 0.17 -0.00 0.72 1.20 0.00 0.00 173.24 175.25 1q82 s PHE 106 N -0.12 0.76 0.00 3.44 -0.71 -0.78 -5.00 117.98 115.58 1q82 s PHE 106 Ca 0.00 -1.09 0.00 0.00 -1.04 0.00 0.00 56.93 54.80 1q82 s PHE 106 Cb -0.10 -0.47 0.00 0.00 -1.21 0.00 0.00 43.02 41.24 1q82 s PHE 106 CO 0.01 -0.37 0.00 0.41 -1.34 0.00 0.00 175.22 173.93 1q82 n GLY 107 N -0.02 0.25 0.12 1.99 0.00 -1.26 -1.99 105.19 104.29 1q82 n GLY 107 Ca -0.10 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1q82 n GLY 107 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1q82 n LEU 128 N 0.00 0.00 -4.79 0.99 0.00 -1.26 -4.93 117.00 107.01 1q82 n LEU 128 Ca 0.00 0.08 -0.31 0.00 0.00 0.00 0.00 56.01 55.78 1q82 n LEU 128 Cb 0.00 -0.12 -0.06 0.00 0.00 0.00 0.00 43.42 43.23 1q82 n LEU 128 CO 0.00 -0.03 -0.25 -1.81 0.00 0.00 0.00 177.39 175.30 1q82 s ASP 129 N -0.03 5.64 -0.19 1.96 1.01 -0.80 -5.00 116.67 119.26 1q82 s ASP 129 Ca 0.00 0.04 -0.04 0.00 0.71 0.00 0.00 52.55 53.26 1q82 s ASP 129 Cb 0.00 -1.55 0.08 0.00 1.01 0.00 0.00 42.92 42.46 1q82 s ASP 129 CO 0.00 0.18 0.18 -0.69 0.21 0.00 0.00 175.17 175.05 1q82 s VAL 130 N -1.38 -0.25 0.04 -1.27 1.01 -0.84 -1.64 120.40 116.08 1q82 s VAL 130 Ca 0.29 -0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.18 1q82 s VAL 130 Cb -0.12 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 1q82 s VAL 130 CO 0.22 -0.23 -0.03 -0.89 0.00 0.00 0.00 175.10 174.16 1q82 s THR 131 N 2.26 3.85 -0.16 3.92 2.01 0.03 -1.86 115.64 125.69 1q82 s THR 131 Ca 0.05 -0.87 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1q82 s THR 131 Cb -0.16 -2.75 0.03 0.00 0.01 0.00 0.00 72.50 69.63 1q82 s THR 131 CO -0.11 0.26 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.27 1q82 s VAL 132 N -1.15 1.51 -0.22 3.82 1.01 -0.75 -1.41 120.40 123.22 1q82 s VAL 132 Ca 0.21 -0.68 -0.13 0.00 0.00 0.00 0.00 61.98 61.38 1q82 s VAL 132 Cb -0.11 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1q82 s VAL 132 CO 0.12 0.37 0.26 0.21 0.00 0.00 0.00 175.10 176.06 1q82 s ASN 133 N 1.50 6.26 -0.01 3.32 3.04 -1.01 -3.16 114.94 124.87 1q82 s ASN 133 Ca 0.03 0.29 0.08 0.00 0.04 0.00 0.00 52.86 53.31 1q82 s ASN 133 Cb -0.14 -2.16 -0.02 0.00 -1.54 0.00 0.00 41.25 37.40 1q82 s ASN 133 CO -0.10 0.02 -0.25 -0.76 -3.04 0.00 0.00 177.10 172.97 1q82 s LEU 134 N 1.09 2.06 0.26 3.21 1.43 -1.26 -1.28 118.68 124.20 1q82 s LEU 134 Ca 0.12 -0.47 -0.21 0.00 -1.03 0.00 0.00 54.13 52.55 1q82 s LEU 134 Cb -0.14 -1.28 0.05 0.00 0.03 0.00 0.00 46.19 44.85 1q82 s LEU 134 CO 0.05 0.30 0.84 0.54 0.23 0.00 0.00 176.35 178.31 1q82 s VAL 135 N -0.62 0.00 0.06 -1.59 0.11 -1.08 -4.80 120.40 112.50 1q82 s VAL 135 Ca 0.10 -0.87 0.01 0.00 -2.93 0.00 0.00 61.98 58.29 1q82 s VAL 135 Cb -0.10 -2.33 -0.04 0.00 -1.53 0.00 0.00 36.38 32.39 1q82 s VAL 135 CO -0.01 0.00 0.16 0.00 -3.33 0.00 0.00 175.10 171.92 1q82 s ARG 136 N -3.15 3.24 0.00 1.54 1.70 -1.26 -2.23 118.95 118.79 1q82 s ARG 136 Ca 0.14 -0.53 0.00 0.00 -0.47 0.00 0.00 55.73 54.87 1q82 s ARG 136 Cb -0.04 -2.93 0.00 0.00 -0.57 0.00 0.00 34.95 31.41 1q82 s ARG 136 CO 0.07 0.60 0.00 -2.30 -1.08 0.00 0.00 175.30 172.58 1q82 n PRO 137 N 0.38 0.00 -1.00 3.89 -0.02 -1.26 -2.50 135.00 134.50 1q82 n PRO 137 Ca -0.07 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.20 1q82 n PRO 137 Cb 0.51 0.00 0.08 0.00 -0.02 0.00 0.00 33.50 34.07 1q82 n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1q82 n GLY 138 N -0.73 4.45 0.16 -1.23 0.00 -1.26 -4.53 105.19 102.04 1q82 n GLY 138 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.73 1q82 n GLY 138 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1q82 h TYR 139 N 1.34 0.00 -0.58 1.61 3.20 -1.90 -3.15 116.97 117.48 1q82 h TYR 139 Ca 0.43 0.00 0.17 0.00 3.14 0.00 0.00 58.73 62.47 1q82 h TYR 139 Cb 1.38 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.63 1q82 h TYR 139 CO 1.08 0.52 0.47 -0.09 -1.64 0.00 0.00 178.16 178.50 1q82 h ARG 140 N 0.00 0.00 -0.33 1.82 2.43 -1.90 -0.25 114.38 116.15 1q82 h ARG 140 Ca -0.01 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.26 1q82 h ARG 140 Cb 0.93 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1q82 h ARG 140 CO 0.07 0.00 0.29 0.28 -1.51 0.00 0.00 179.97 179.10 1q82 h VAL 141 N 0.00 0.59 -0.00 0.20 2.07 -1.87 -0.15 116.25 117.08 1q82 h VAL 141 Ca 0.28 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.80 1q82 h VAL 141 Cb 1.21 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1q82 h VAL 141 CO -0.00 0.00 -0.84 0.00 0.02 0.00 0.00 177.57 176.75 1q82 n ALA 142 N -2.46 4.39 0.34 1.67 0.00 -0.11 -0.26 120.51 124.08 1q82 n ALA 142 Ca 0.05 -0.59 0.06 0.00 0.00 0.00 0.00 53.44 52.96 1q82 n ALA 142 Cb 0.46 -0.74 -0.08 0.00 0.00 0.00 0.00 19.45 19.09 1q82 n ALA 142 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1q82 n LYS 143 N -1.14 2.01 -1.56 0.00 4.76 -0.41 -4.76 118.16 117.05 1q82 n LYS 143 Ca 0.05 -0.04 -0.30 0.00 -2.87 0.00 0.00 58.31 55.14 1q82 n LYS 143 Cb 0.35 -1.15 0.23 0.00 -1.84 0.00 0.00 35.03 32.61 1q82 n LYS 143 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 1q82 n ARG 144 N -1.53 -2.13 -0.07 1.97 1.85 -0.20 -5.05 116.66 111.51 1q82 n ARG 144 Ca 0.01 -1.96 -0.05 0.00 -1.00 0.00 0.00 57.85 54.85 1q82 n ARG 144 Cb 0.24 -1.52 -0.02 0.00 -1.05 0.00 0.00 32.46 30.12 1q82 n ARG 144 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1q82 n ASP 145 N -4.32 1.68 -4.75 2.89 10.43 -1.26 -4.65 116.55 116.56 1q82 n ASP 145 Ca 0.16 0.59 -0.41 0.00 2.57 0.00 0.00 54.79 57.70 1q82 n ASP 145 Cb 0.59 -0.84 -0.03 0.00 1.84 0.00 0.00 41.12 42.69 1q82 n ASP 145 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1q82 s LYS 146 N -2.19 4.48 -0.50 -1.24 1.02 -1.26 -3.72 119.74 116.34 1q82 s LYS 146 Ca -0.15 1.98 0.00 0.00 0.02 0.00 0.00 55.97 57.83 1q82 s LYS 146 Cb 0.02 -3.17 0.00 0.00 -0.52 0.00 0.00 37.83 34.16 1q82 s LYS 146 CO 0.22 -0.06 0.00 0.00 -0.92 0.00 0.00 175.35 174.59 1q82 n ALA 147 N 1.69 -0.56 -1.02 5.17 0.00 -1.26 -4.88 120.51 119.64 1q82 n ALA 147 Ca 0.02 0.06 -0.35 0.00 0.00 0.00 0.00 53.44 53.17 1q82 n ALA 147 Cb 0.43 -0.84 0.09 0.00 0.00 0.00 0.00 19.45 19.14 1q82 n ALA 147 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1q82 n SER 148 N -0.79 -1.75 -3.67 0.00 3.41 -1.24 -5.01 113.62 104.57 1q82 n SER 148 Ca -0.06 0.45 -0.14 0.00 -0.26 0.00 0.00 58.87 58.86 1q82 n SER 148 Cb 0.39 -1.20 -0.08 0.00 -0.26 0.00 0.00 64.21 63.06 1q82 n SER 148 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1q82 s ARG 149 N -3.19 0.72 0.29 4.33 3.52 0.64 -4.98 118.95 120.29 1q82 s ARG 149 Ca 0.61 0.43 -0.29 0.00 -0.13 0.00 0.00 55.73 56.34 1q82 s ARG 149 Cb -0.27 0.34 -0.10 0.00 -1.56 0.00 0.00 34.95 33.36 1q82 s ARG 149 CO 0.63 -0.15 1.25 0.45 -0.81 0.00 0.00 175.30 176.67 1q82 s SER 150 N -0.38 6.94 0.18 -2.12 0.15 -1.26 -3.28 113.70 113.93 1q82 s SER 150 Ca -0.05 2.51 -0.30 0.00 0.70 0.00 0.00 55.95 58.81 1q82 s SER 150 Cb -0.03 -2.64 -0.08 0.00 -1.71 0.00 0.00 66.02 61.56 1q82 s SER 150 CO 0.03 -0.42 1.22 -0.63 1.20 0.00 0.00 173.24 174.65 1q82 s ILE 151 N -0.93 3.51 0.20 6.45 -1.09 -1.26 -4.98 121.20 123.10 1q82 s ILE 151 Ca 0.49 1.26 -0.31 0.00 -2.23 0.00 0.00 60.65 59.85 1q82 s ILE 151 Cb -0.37 -3.80 -0.11 0.00 -1.58 0.00 0.00 42.46 36.60 1q82 s ILE 151 CO 0.47 0.19 1.61 -2.84 -1.23 0.00 0.00 174.94 173.14 1q82 s PRO 152 N -0.17 4.18 0.41 2.79 0.02 -1.26 -4.86 135.00 136.11 1q82 s PRO 152 Ca 0.54 2.46 0.26 0.00 0.02 0.00 0.00 61.00 64.28 1q82 s PRO 152 Cb -0.33 -3.11 1.35 0.00 0.02 0.00 0.00 34.50 32.43 1q82 s PRO 152 CO 0.37 -0.64 1.63 1.79 -0.33 0.00 0.00 177.00 179.81 1q82 h THR 153 N 3.85 0.14 -0.61 0.99 1.35 -1.97 0.75 112.91 117.41 1q82 h THR 153 Ca -0.43 -0.04 -0.06 0.00 -0.55 0.00 0.00 66.41 65.32 1q82 h THR 153 Cb 1.21 0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 67.61 1q82 h THR 153 CO 0.91 0.02 0.14 0.11 -0.25 0.00 0.00 175.52 176.45 1q82 h LYS 154 N 0.12 0.96 -0.01 4.72 6.56 -2.03 -2.05 116.57 124.83 1q82 h LYS 154 Ca 0.80 -0.22 0.00 0.00 -1.06 0.00 0.00 60.65 60.18 1q82 h LYS 154 Cb 2.36 -0.13 0.00 0.00 -0.57 0.00 0.00 32.23 33.88 1q82 h LYS 154 CO -0.49 0.86 0.00 1.58 -2.06 0.00 0.00 179.45 179.34 1q82 n HIS 155 N -4.25 0.01 -1.51 -1.35 -0.00 0.26 -4.87 115.22 103.51 1q82 n HIS 155 Ca 0.04 -0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.93 1q82 n HIS 155 Cb 0.25 0.00 0.14 0.00 -0.12 0.00 0.00 29.99 30.26 1q82 n HIS 155 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1q82 s ARG 156 N -1.99 1.06 -0.22 1.57 1.81 -0.77 -4.72 118.95 115.69 1q82 s ARG 156 Ca 0.42 0.30 -0.08 0.00 -1.72 0.00 0.00 55.73 54.65 1q82 s ARG 156 Cb 0.21 -1.83 -0.04 0.00 -0.45 0.00 0.00 34.95 32.84 1q82 s ARG 156 CO 0.34 -2.25 0.08 -1.17 -0.68 0.00 0.00 175.30 171.62 1q82 s LEU 157 N -6.07 3.70 0.54 2.53 2.96 -1.26 -5.00 118.68 116.08 1q82 s LEU 157 Ca 0.64 -0.03 -0.06 0.00 -0.22 0.00 0.00 54.13 54.46 1q82 s LEU 157 Cb -0.15 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 1q82 s LEU 157 CO 0.54 0.08 0.87 0.20 -1.32 0.00 0.00 176.35 176.71 1q82 s ASN 158 N 0.95 5.99 0.24 3.68 -0.87 -1.26 -2.75 114.94 120.92 1q82 s ASN 158 Ca 0.04 0.91 -0.04 0.00 -1.57 0.00 0.00 52.86 52.20 1q82 s ASN 158 Cb -0.14 -2.06 0.38 0.00 -0.02 0.00 0.00 41.25 39.41 1q82 s ASN 158 CO 0.03 -0.81 1.83 -0.65 -2.57 0.00 0.00 177.10 174.92 1q82 h PRO 159 N -0.01 0.83 0.33 -0.60 0.11 -1.75 -2.02 132.00 128.89 1q82 h PRO 159 Ca -0.46 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1q82 h PRO 159 Cb 1.22 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1q82 h PRO 159 CO 0.61 0.55 -0.16 0.00 -0.21 0.00 0.00 178.00 178.80 1q82 h ALA 160 N 1.44 -0.45 0.00 -0.75 0.00 -1.93 -1.90 119.26 115.67 1q82 h ALA 160 Ca 0.39 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1q82 h ALA 160 Cb 0.30 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1q82 h ALA 160 CO -0.22 -0.63 0.11 -0.44 0.00 0.00 0.00 179.25 178.07 1q82 h ASP 161 N -0.69 0.00 0.00 0.00 3.32 -1.88 -1.25 116.42 115.92 1q82 h ASP 161 Ca -0.05 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.94 1q82 h ASP 161 Cb 0.48 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1q82 h ASP 161 CO 0.07 0.00 -0.47 0.00 -1.72 0.00 0.00 179.24 177.13 1q82 h ALA 162 N 1.73 0.08 -0.84 3.45 0.00 -1.08 -3.23 119.26 119.37 1q82 h ALA 162 Ca 0.00 -0.59 0.21 0.00 0.00 0.00 0.00 54.91 54.53 1q82 h ALA 162 Cb 0.21 0.32 -0.13 0.00 0.00 0.00 0.00 17.79 18.19 1q82 h ALA 162 CO 0.00 0.31 0.23 0.28 0.00 0.00 0.00 179.25 180.07 1q82 h VAL 163 N -1.00 0.38 0.26 0.00 2.07 -0.44 -1.37 116.25 116.14 1q82 h VAL 163 Ca -0.10 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1q82 h VAL 163 Cb 0.76 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1q82 h VAL 163 CO -0.06 0.04 -0.24 0.00 0.02 0.00 0.00 177.57 177.34 1q82 h ALA 164 N 1.73 -0.96 -0.77 1.67 0.00 -1.54 0.31 119.26 119.71 1q82 h ALA 164 Ca 0.52 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.44 1q82 h ALA 164 Cb 0.99 0.45 -0.12 0.00 0.00 0.00 0.00 17.79 19.12 1q82 h ALA 164 CO -0.61 -0.97 -0.46 0.35 0.00 0.00 0.00 179.25 177.56 1q82 h PHE 165 N -0.49 -1.36 0.24 0.00 3.57 -1.29 0.45 116.94 118.07 1q82 h PHE 165 Ca -0.03 0.10 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1q82 h PHE 165 Cb 0.41 0.70 0.00 0.00 2.79 0.00 0.00 35.95 39.86 1q82 h PHE 165 CO -0.13 -0.41 -0.12 0.82 -2.23 0.00 0.00 178.31 176.25 1q82 h ILE 166 N -0.13 0.79 -1.16 1.41 2.04 -1.35 -2.94 117.51 116.17 1q82 h ILE 166 Ca 0.22 -0.75 0.33 0.00 1.00 0.00 0.00 64.86 65.65 1q82 h ILE 166 Cb 0.54 1.18 -0.07 0.00 -0.74 0.00 0.00 36.82 37.73 1q82 h ILE 166 CO -0.81 0.15 0.80 -0.08 0.00 0.00 0.00 178.15 178.20 1q82 h GLU 167 N -0.75 0.16 -1.13 2.37 4.81 -0.08 0.77 114.58 120.73 1q82 h GLU 167 Ca -0.03 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1q82 h GLU 167 Cb 0.50 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1q82 h GLU 167 CO 0.05 0.10 0.04 0.45 -0.73 0.00 0.00 179.01 178.93 1q82 n SER 168 N -4.40 3.37 -2.88 1.04 2.88 0.12 -3.86 113.62 109.90 1q82 n SER 168 Ca 0.27 -2.15 -0.12 0.00 -1.33 0.00 0.00 58.87 55.54 1q82 n SER 168 Cb 1.14 -0.60 0.03 0.00 -0.75 0.00 0.00 64.21 64.03 1q82 n SER 168 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1q82 n THR 169 N 0.53 -0.14 -2.13 2.46 -1.04 0.27 -5.01 114.28 109.22 1q82 n THR 169 Ca 0.04 -2.37 -0.01 0.00 -2.04 0.00 0.00 64.05 59.66 1q82 n THR 169 Cb 0.56 0.67 0.00 0.00 -1.82 0.00 0.00 70.33 69.75 1q82 n THR 169 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1q82 n TYR 170 N 0.97 -0.09 -3.47 -1.42 4.02 -1.26 -5.02 117.16 110.90 1q82 n TYR 170 Ca 0.12 0.04 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 1q82 n TYR 170 Cb 0.64 -1.97 0.00 0.00 -0.02 0.00 0.00 39.34 38.00 1q82 n TYR 170 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1q82 n ASP 171 N -0.70 0.00 -4.03 7.72 5.68 -1.25 -4.93 116.55 119.04 1q82 n ASP 171 Ca -0.01 0.00 -0.11 0.00 -0.50 0.00 0.00 54.79 54.17 1q82 n ASP 171 Cb 0.51 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.37 1q82 n ASP 171 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1q82 s VAL 172 N -3.00 0.35 0.00 2.12 1.01 -1.26 -4.75 120.40 114.87 1q82 s VAL 172 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 60.93 1q82 s VAL 172 Cb 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 36.38 35.86 1q82 s VAL 172 CO 0.00 -0.46 0.00 -1.84 0.00 0.00 0.00 175.10 172.80 1q82 n GLU 173 N 1.44 0.70 0.00 2.72 0.28 -1.26 -4.95 120.64 119.56 1q82 n GLU 173 Ca -0.23 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.77 1q82 n GLU 173 Cb 0.55 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.42 1q82 n GLU 173 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25