#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i55 h HIS 11 N 0.00 0.34 0.02 2.97 2.07 -2.03 -1.04 115.15 117.49 3i55 h HIS 11 Ca 0.00 0.01 -0.00 0.00 -2.85 0.00 0.00 60.37 57.53 3i55 h HIS 11 Cb 0.00 -0.09 0.00 0.00 2.57 0.00 0.00 27.41 29.89 3i55 h HIS 11 CO 0.00 -0.10 -0.01 1.49 -3.07 0.00 0.00 177.93 176.24 3i55 h GLU 12 N 0.09 -0.02 0.00 5.12 4.81 -2.04 0.73 114.58 123.26 3i55 h GLU 12 Ca 0.78 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 60.02 3i55 h GLU 12 Cb 2.68 0.01 0.00 0.00 0.63 0.00 0.00 28.75 32.06 3i55 h GLU 12 CO -0.26 0.45 0.00 -1.33 -0.73 0.00 0.00 179.01 177.15 3i55 n MET 13 N -4.87 0.85 -0.03 1.92 2.81 -0.44 -3.07 117.12 114.29 3i55 n MET 13 Ca -0.08 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.78 3i55 n MET 13 Cb 0.25 -1.41 -0.07 0.00 -0.71 0.00 0.00 33.22 31.28 3i55 n MET 13 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3i55 n ARG 14 N -0.91 2.12 -1.73 0.03 5.12 -0.91 -4.15 116.66 116.23 3i55 n ARG 14 Ca 0.17 -0.02 -0.42 0.00 -1.93 0.00 0.00 57.85 55.65 3i55 n ARG 14 Cb 0.08 -1.21 -0.03 0.00 -1.16 0.00 0.00 32.46 30.14 3i55 n ARG 14 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 3i55 s GLU 15 N -2.29 4.15 0.82 5.56 -1.05 0.24 -4.75 118.70 121.37 3i55 s GLU 15 Ca -0.04 2.55 -0.08 0.00 -0.15 0.00 0.00 54.97 57.25 3i55 s GLU 15 Cb 0.03 -4.04 0.11 0.00 -0.44 0.00 0.00 34.13 29.79 3i55 s GLU 15 CO 0.34 -0.92 0.20 -2.30 0.95 0.00 0.00 175.26 173.53 3i55 n PRO 16 N 7.15 -1.44 0.00 -4.83 -0.02 -1.26 -4.59 135.00 130.01 3i55 n PRO 16 Ca 0.19 -0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.24 3i55 n PRO 16 Cb 0.41 -1.28 0.00 0.00 -0.02 0.00 0.00 33.50 32.61 3i55 n PRO 16 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 3i55 n ARG 17 N -0.32 0.00 -3.91 -0.52 1.85 -1.25 -4.94 116.66 107.57 3i55 n ARG 17 Ca 0.04 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.54 3i55 n ARG 17 Cb 0.21 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.54 3i55 n ARG 17 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 3i55 s ILE 18 N -2.00 5.13 -0.18 8.89 1.01 -1.26 -2.13 121.20 130.66 3i55 s ILE 18 Ca 0.00 0.08 0.06 0.00 0.00 0.00 0.00 60.65 60.79 3i55 s ILE 18 Cb 0.00 -3.29 -0.22 0.00 0.01 0.00 0.00 42.46 38.96 3i55 s ILE 18 CO 0.00 0.50 0.11 1.21 0.00 0.00 0.00 174.94 176.76 3i55 n GLU 19 N 3.06 0.68 -3.60 2.79 2.13 0.28 -4.69 120.64 121.29 3i55 n GLU 19 Ca -0.17 0.16 -0.15 0.00 0.66 0.00 0.00 57.16 57.65 3i55 n GLU 19 Cb 0.53 -1.60 -0.07 0.00 0.27 0.00 0.00 31.44 30.57 3i55 n GLU 19 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 3i55 s LYS 20 N -2.53 0.88 -0.24 5.31 -2.85 -1.22 -4.62 119.74 114.47 3i55 s LYS 20 Ca -0.21 0.81 0.01 0.00 -1.00 0.00 0.00 55.97 55.58 3i55 s LYS 20 Cb 0.08 0.43 0.06 0.00 -2.06 0.00 0.00 37.83 36.33 3i55 s LYS 20 CO 0.73 -0.15 -0.07 0.08 0.10 0.00 0.00 175.35 176.04 3i55 s VAL 21 N 0.00 1.74 -0.21 1.79 1.01 -0.67 -0.81 120.40 123.25 3i55 s VAL 21 Ca -0.03 -1.36 -0.15 0.00 0.00 0.00 0.00 61.98 60.45 3i55 s VAL 21 Cb -0.04 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 3i55 s VAL 21 CO 0.03 -0.08 0.34 -0.69 0.00 0.00 0.00 175.10 174.70 3i55 s VAL 22 N 1.30 5.23 -0.21 2.92 1.01 -0.89 -1.33 120.40 128.42 3i55 s VAL 22 Ca -0.07 0.58 -0.05 0.00 0.00 0.00 0.00 61.98 62.44 3i55 s VAL 22 Cb -0.19 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 3i55 s VAL 22 CO -0.06 0.27 0.00 0.68 0.00 0.00 0.00 175.10 175.99 3i55 s VAL 23 N 1.30 3.86 -0.08 2.92 -7.23 -0.63 -1.59 120.40 118.95 3i55 s VAL 23 Ca 0.16 -0.34 -0.07 0.00 -1.81 0.00 0.00 61.98 59.92 3i55 s VAL 23 Cb -0.14 -2.76 0.02 0.00 0.56 0.00 0.00 36.38 34.06 3i55 s VAL 23 CO 0.07 0.41 0.22 -2.28 -0.31 0.00 0.00 175.10 173.21 3i55 s HIS 24 N 1.25 -0.24 -0.32 2.82 5.04 -0.86 -1.80 115.29 121.18 3i55 s HIS 24 Ca 0.04 0.60 -0.01 0.00 -1.54 0.00 0.00 55.06 54.14 3i55 s HIS 24 Cb -0.15 0.08 0.06 0.00 0.04 0.00 0.00 32.58 32.61 3i55 s HIS 24 CO 0.01 -0.12 0.02 -1.64 -2.34 0.00 0.00 174.74 170.67 3i55 s MET 25 N 0.22 2.28 -0.50 2.88 -1.94 -1.17 -1.52 119.30 119.56 3i55 s MET 25 Ca -0.01 -1.40 -0.27 0.00 -1.71 0.00 0.00 55.69 52.30 3i55 s MET 25 Cb -0.02 -3.22 0.03 0.00 2.01 0.00 0.00 34.83 33.63 3i55 s MET 25 CO -0.01 -0.71 1.05 0.20 -0.01 0.00 0.00 175.02 175.54 3i55 s GLY 26 N 1.30 1.34 0.00 -0.03 0.00 -1.26 -3.70 107.32 104.98 3i55 s GLY 26 Ca -0.02 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 43.95 3i55 s GLY 26 CO -0.02 2.25 0.00 1.39 0.00 0.00 0.00 173.10 176.72 3i55 n ILE 27 N 6.59 0.00 0.00 0.90 5.41 -0.51 -5.03 119.36 126.71 3i55 n ILE 27 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.83 3i55 n ILE 27 Cb 0.49 -0.34 0.00 0.00 -0.71 0.00 0.00 39.64 39.07 3i55 n ILE 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3i55 n GLY 28 N 3.62 0.02 0.00 7.39 0.00 0.38 -5.00 105.19 111.60 3i55 n GLY 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3i55 n GLY 28 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3i55 n HIS 29 N 0.00 0.00 0.00 1.61 -0.00 -1.24 -4.90 115.22 110.69 3i55 n HIS 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 3i55 n HIS 29 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 3i55 n HIS 29 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3i55 n ALA 35 N 0.00 0.00 0.03 1.59 0.00 -1.26 -4.71 120.51 116.16 3i55 n ALA 35 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 3i55 n ALA 35 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 3i55 n ALA 35 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3i55 n ASN 36 N 0.00 0.08 0.10 0.00 6.94 -1.26 -1.57 115.26 119.55 3i55 n ASN 36 Ca 0.00 0.41 0.12 0.00 -0.02 0.00 0.00 54.58 55.09 3i55 n ASN 36 Cb 0.00 -0.41 0.45 0.00 -2.36 0.00 0.00 39.78 37.47 3i55 n ASN 36 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3i55 n ALA 37 N -1.41 1.97 0.07 -2.53 0.00 -1.26 -4.01 120.51 113.34 3i55 n ALA 37 Ca -0.00 0.02 -0.13 0.00 0.00 0.00 0.00 53.44 53.33 3i55 n ALA 37 Cb 0.16 -1.42 -0.06 0.00 0.00 0.00 0.00 19.45 18.13 3i55 n ALA 37 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3i55 h GLU 38 N 0.00 -0.51 -0.32 0.00 5.08 -1.72 -3.24 114.58 113.87 3i55 h GLU 38 Ca 0.00 0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 3i55 h GLU 38 Cb 0.53 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 3i55 h GLU 38 CO 0.00 -0.34 -0.19 -0.25 -1.00 0.00 0.00 179.01 177.23 3i55 n ASP 39 N -5.43 -0.34 -0.32 1.42 8.00 -1.26 -0.91 116.55 117.71 3i55 n ASP 39 Ca -0.05 0.73 0.11 0.00 0.71 0.00 0.00 54.79 56.28 3i55 n ASP 39 Cb 0.35 -0.15 0.28 0.00 -0.02 0.00 0.00 41.12 41.58 3i55 n ASP 39 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 3i55 h ILE 40 N 0.00 0.67 -0.29 0.53 3.07 -1.85 -1.16 117.51 118.48 3i55 h ILE 40 Ca 0.05 -0.22 -0.13 0.00 1.55 0.00 0.00 64.86 66.11 3i55 h ILE 40 Cb 0.13 -0.02 -0.01 0.00 -0.27 0.00 0.00 36.82 36.65 3i55 h ILE 40 CO -0.30 0.12 -0.35 -0.07 -1.05 0.00 0.00 178.15 176.49 3i55 h LEU 41 N 0.64 0.68 -1.55 0.16 3.38 -1.16 0.81 115.31 118.26 3i55 h LEU 41 Ca 0.53 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 3i55 h LEU 41 Cb 0.84 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 3i55 h LEU 41 CO -0.40 0.97 -0.07 1.23 0.09 0.00 0.00 178.44 180.25 3i55 h GLY 42 N 1.00 0.21 0.14 0.83 0.00 -0.89 0.08 103.07 104.44 3i55 h GLY 42 Ca 0.06 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 3i55 h GLY 42 CO 0.07 0.11 -0.02 0.83 0.00 0.00 0.00 176.54 177.53 3i55 h GLU 43 N 0.19 -0.06 -0.30 4.80 5.08 -1.01 -2.96 114.58 120.33 3i55 h GLU 43 Ca 0.04 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 3i55 h GLU 43 Cb 0.26 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 3i55 h GLU 43 CO 0.01 0.55 -0.17 0.97 -1.00 0.00 0.00 179.01 179.37 3i55 h ILE 44 N -0.92 1.25 0.00 3.13 2.10 -0.72 -3.35 117.51 118.99 3i55 h ILE 44 Ca -0.01 -1.12 -0.06 0.00 1.08 0.00 0.00 64.86 64.75 3i55 h ILE 44 Cb 0.63 1.20 -0.01 0.00 -1.09 0.00 0.00 36.82 37.56 3i55 h ILE 44 CO 0.01 0.37 -0.59 0.71 -1.08 0.00 0.00 178.15 177.57 3i55 h THR 45 N 0.48 0.33 0.00 2.19 1.35 -1.15 -3.47 112.91 112.64 3i55 h THR 45 Ca 0.08 -1.37 0.00 0.00 -0.55 0.00 0.00 66.41 64.58 3i55 h THR 45 Cb 0.57 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 67.72 3i55 h THR 45 CO 0.04 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.03 3i55 n GLY 46 N 1.60 1.15 3.11 5.82 0.00 -1.12 -4.91 105.19 110.85 3i55 n GLY 46 Ca -0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 3i55 n GLY 46 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3i55 s GLN 47 N -0.01 0.57 0.83 1.61 -2.07 -1.26 -5.05 119.66 114.28 3i55 s GLN 47 Ca 0.00 -0.69 -0.15 0.00 -1.82 0.00 0.00 55.36 52.70 3i55 s GLN 47 Cb 0.00 0.22 -0.04 0.00 -1.09 0.00 0.00 33.01 32.10 3i55 s GLN 47 CO 0.00 -0.14 0.20 -1.33 -1.32 0.00 0.00 175.29 172.70 3i55 n MET 48 N 0.90 0.03 -3.40 9.60 2.81 -1.26 -4.48 117.12 121.32 3i55 n MET 48 Ca -0.20 0.05 -0.23 0.00 -1.81 0.00 0.00 57.70 55.51 3i55 n MET 48 Cb 0.58 -1.63 0.04 0.00 -0.71 0.00 0.00 33.22 31.50 3i55 n MET 48 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 3i55 s PRO 49 N -2.77 2.24 -0.07 0.03 0.04 -1.26 -4.82 135.00 128.39 3i55 s PRO 49 Ca 0.57 -1.85 -0.04 0.00 0.04 0.00 0.00 61.00 59.72 3i55 s PRO 49 Cb -0.29 -2.40 0.03 0.00 0.04 0.00 0.00 34.50 31.88 3i55 s PRO 49 CO 0.66 -0.83 0.16 0.14 0.04 0.00 0.00 177.00 177.17 3i55 s VAL 50 N -2.75 -0.02 0.87 -0.36 -7.23 -0.19 -4.92 120.40 105.79 3i55 s VAL 50 Ca 0.50 0.09 -0.10 0.00 -1.81 0.00 0.00 61.98 60.66 3i55 s VAL 50 Cb -0.04 -0.24 0.11 0.00 0.56 0.00 0.00 36.38 36.77 3i55 s VAL 50 CO 0.32 0.04 1.11 -0.13 -0.31 0.00 0.00 175.10 176.13 3i55 s ARG 51 N 0.65 1.46 -0.05 4.82 1.81 -1.26 -0.92 118.95 125.45 3i55 s ARG 51 Ca -0.05 1.31 0.04 0.00 -1.72 0.00 0.00 55.73 55.31 3i55 s ARG 51 Cb -0.06 -1.79 -0.00 0.00 -0.45 0.00 0.00 34.95 32.64 3i55 s ARG 51 CO -0.03 -2.25 -0.16 0.99 -0.68 0.00 0.00 175.30 173.16 3i55 s THR 52 N -2.77 1.38 0.00 0.02 2.01 0.44 -4.78 115.64 111.94 3i55 s THR 52 Ca 0.64 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.96 3i55 s THR 52 Cb -0.20 -1.20 0.00 0.00 0.01 0.00 0.00 72.50 71.11 3i55 s THR 52 CO 0.57 0.40 0.00 0.29 -0.69 0.00 0.00 174.62 175.19 3i55 n LYS 53 N 3.21 3.78 -3.88 4.92 5.02 -1.26 0.39 118.16 130.34 3i55 n LYS 53 Ca -0.18 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.08 3i55 n LYS 53 Cb 0.53 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.55 3i55 n LYS 53 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i55 s ALA 54 N -2.30 -1.76 0.08 7.82 0.00 -1.24 -4.80 121.76 119.56 3i55 s ALA 54 Ca 0.00 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 51.79 3i55 s ALA 54 Cb 0.00 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.85 3i55 s ALA 54 CO 0.00 -1.08 -0.12 0.15 0.00 0.00 0.00 175.76 174.72 3i55 s LYS 55 N -2.22 0.80 0.13 0.00 1.02 -1.26 -4.34 119.74 113.87 3i55 s LYS 55 Ca 0.22 -1.02 0.00 0.00 0.02 0.00 0.00 55.97 55.19 3i55 s LYS 55 Cb -0.02 -0.65 0.00 0.00 -0.52 0.00 0.00 37.83 36.64 3i55 s LYS 55 CO 0.04 0.13 0.00 0.54 -0.92 0.00 0.00 175.35 175.14 3i55 n ARG 56 N 0.98 -1.22 -2.43 1.68 1.74 -1.26 -4.96 116.66 111.19 3i55 n ARG 56 Ca -0.19 0.91 -0.36 0.00 -0.77 0.00 0.00 57.85 57.44 3i55 n ARG 56 Cb 0.56 -1.02 -0.03 0.00 -1.02 0.00 0.00 32.46 30.95 3i55 n ARG 56 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3i55 s THR 57 N -2.25 3.50 -0.10 0.55 2.01 -1.26 -4.89 115.64 113.19 3i55 s THR 57 Ca 0.00 1.10 0.01 0.00 0.31 0.00 0.00 61.69 63.10 3i55 s THR 57 Cb 0.00 -3.54 0.02 0.00 0.01 0.00 0.00 72.50 68.99 3i55 s THR 57 CO 0.00 -0.04 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.10 3i55 s VAL 58 N -1.67 1.12 0.59 3.82 1.01 -0.23 -4.96 120.40 120.08 3i55 s VAL 58 Ca 0.62 -0.39 0.30 0.00 0.00 0.00 0.00 61.98 62.51 3i55 s VAL 58 Cb -0.24 -1.08 0.42 0.00 0.00 0.00 0.00 36.38 35.49 3i55 s VAL 58 CO 0.29 0.37 1.61 1.23 0.00 0.00 0.00 175.10 178.60 3i55 h GLY 59 N 7.73 0.00 -4.89 4.51 0.00 -1.97 0.16 103.07 108.61 3i55 h GLY 59 Ca -0.31 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.57 3i55 h GLY 59 CO 0.44 0.00 2.40 -1.84 0.00 0.00 0.00 176.54 177.54 3i55 n GLU 60 N -3.55 2.72 -4.38 4.80 0.28 -1.26 -4.57 120.64 114.68 3i55 n GLU 60 Ca 0.19 -1.63 -0.36 0.00 -0.16 0.00 0.00 57.16 55.20 3i55 n GLU 60 Cb 1.18 -2.46 -0.09 0.00 1.43 0.00 0.00 31.44 31.50 3i55 n GLU 60 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 3i55 n PHE 61 N 3.47 -1.19 -2.67 -1.84 -0.00 -1.03 -4.83 117.46 109.37 3i55 n PHE 61 Ca 0.58 0.63 -0.26 0.00 -0.00 0.00 0.00 57.45 58.41 3i55 n PHE 61 Cb 0.35 -2.32 -0.01 0.00 -0.00 0.00 0.00 39.48 37.49 3i55 n PHE 61 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 3i55 n ASP 62 N -2.63 4.30 -0.03 -2.13 2.03 0.53 -4.85 116.55 113.76 3i55 n ASP 62 Ca -0.12 -3.62 -0.13 0.00 0.52 0.00 0.00 54.79 51.44 3i55 n ASP 62 Cb 0.57 -0.50 -0.11 0.00 -0.72 0.00 0.00 41.12 40.36 3i55 n ASP 62 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 3i55 h ILE 63 N 2.68 1.48 -1.82 5.18 3.07 -1.88 -0.58 117.51 125.64 3i55 h ILE 63 Ca 0.21 -1.68 -0.62 0.00 1.55 0.00 0.00 64.86 64.32 3i55 h ILE 63 Cb 0.80 2.59 0.01 0.00 -0.27 0.00 0.00 36.82 39.94 3i55 h ILE 63 CO 0.81 0.42 1.25 -1.14 -1.05 0.00 0.00 178.15 178.43 3i55 n ARG 64 N -4.75 1.91 0.00 0.16 0.63 -1.26 -4.61 116.66 108.74 3i55 n ARG 64 Ca -0.09 0.64 0.00 0.00 -0.92 0.00 0.00 57.85 57.49 3i55 n ARG 64 Cb 0.35 -2.72 0.00 0.00 0.45 0.00 0.00 32.46 30.54 3i55 n ARG 64 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 3i55 n GLU 65 N 7.40 0.00 -2.63 -0.14 2.13 -1.26 -4.47 120.64 121.67 3i55 n GLU 65 Ca 0.28 0.26 -0.42 0.00 0.66 0.00 0.00 57.16 57.95 3i55 n GLU 65 Cb 0.31 -1.16 -0.03 0.00 0.27 0.00 0.00 31.44 30.83 3i55 n GLU 65 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 3i55 s GLY 66 N -0.74 1.10 -0.16 8.31 0.00 -1.26 -3.70 107.32 110.86 3i55 s GLY 66 Ca 0.00 -1.71 -0.28 0.00 0.00 0.00 0.00 44.72 42.72 3i55 s GLY 66 CO 0.00 2.51 0.81 0.51 0.00 0.00 0.00 173.10 176.94 3i55 s ASP 67 N 3.97 -0.59 -0.02 1.64 -4.77 -1.26 -5.03 116.67 110.62 3i55 s ASP 67 Ca 0.35 0.86 -0.39 0.00 -3.30 0.00 0.00 52.55 50.06 3i55 s ASP 67 Cb -0.08 0.77 -0.18 0.00 -1.09 0.00 0.00 42.92 42.34 3i55 s ASP 67 CO 0.08 -0.39 1.31 -2.65 0.70 0.00 0.00 175.17 174.22 3i55 n PRO 68 N 1.52 0.69 0.00 2.11 -0.02 -1.26 -4.34 135.00 133.70 3i55 n PRO 68 Ca -0.15 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 3i55 n PRO 68 Cb 0.57 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 3i55 n PRO 68 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3i55 n ILE 69 N 2.49 0.00 -3.46 4.25 5.41 0.16 -3.67 119.36 124.55 3i55 n ILE 69 Ca 0.21 0.00 -0.00 0.00 1.00 0.00 0.00 62.75 63.95 3i55 n ILE 69 Cb 0.13 -0.08 0.00 0.00 -0.71 0.00 0.00 39.64 38.98 3i55 n ILE 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3i55 n GLY 70 N 0.91 1.26 3.49 7.39 0.00 -1.18 -0.47 105.19 116.59 3i55 n GLY 70 Ca 0.00 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 3i55 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i55 s ALA 71 N -1.05 0.49 0.21 4.61 0.00 -1.24 0.17 121.76 124.94 3i55 s ALA 71 Ca 0.01 -1.33 -0.23 0.00 0.00 0.00 0.00 51.96 50.41 3i55 s ALA 71 Cb -0.00 1.15 0.06 0.00 0.00 0.00 0.00 23.12 24.33 3i55 s ALA 71 CO 0.00 -0.79 0.93 -1.59 0.00 0.00 0.00 175.76 174.31 3i55 s LYS 72 N -3.47 1.43 -0.18 0.00 -2.85 -0.10 -3.04 119.74 111.52 3i55 s LYS 72 Ca 0.29 -0.84 -0.14 0.00 -1.00 0.00 0.00 55.97 54.28 3i55 s LYS 72 Cb 0.00 0.45 0.05 0.00 -2.06 0.00 0.00 37.83 36.28 3i55 s LYS 72 CO 0.16 -0.66 0.47 0.08 0.10 0.00 0.00 175.35 175.50 3i55 s VAL 73 N -3.00 -0.01 -0.25 1.79 1.01 -0.74 -1.02 120.40 118.17 3i55 s VAL 73 Ca 0.15 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 62.08 3i55 s VAL 73 Cb -0.03 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 3i55 s VAL 73 CO 0.05 0.01 0.08 0.42 0.00 0.00 0.00 175.10 175.66 3i55 s THR 74 N 0.77 4.36 -0.16 3.92 -4.23 -1.26 -1.60 115.64 117.43 3i55 s THR 74 Ca -0.04 -0.18 -0.08 0.00 -1.18 0.00 0.00 61.69 60.21 3i55 s THR 74 Cb -0.05 -3.05 -0.04 0.00 1.34 0.00 0.00 72.50 70.69 3i55 s THR 74 CO -0.06 0.32 0.11 -0.76 -0.54 0.00 0.00 174.62 173.69 3i55 s LEU 75 N 1.62 4.11 -0.02 4.79 1.43 -0.44 -4.90 118.68 125.27 3i55 s LEU 75 Ca 0.06 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.45 3i55 s LEU 75 Cb -0.15 -2.03 -0.00 0.00 0.03 0.00 0.00 46.19 44.03 3i55 s LEU 75 CO 0.04 0.26 -0.11 -0.13 0.23 0.00 0.00 176.35 176.64 3i55 s ARG 76 N -0.13 1.08 6.71 1.70 0.52 -1.26 -1.67 118.95 125.90 3i55 s ARG 76 Ca 0.09 -0.38 0.00 0.00 -0.52 0.00 0.00 55.73 54.92 3i55 s ARG 76 Cb -0.12 -1.00 0.00 0.00 0.52 0.00 0.00 34.95 34.35 3i55 s ARG 76 CO 0.01 0.17 0.00 -0.25 0.02 0.00 0.00 175.30 175.25 3i55 n ASP 77 N 3.12 0.00 0.10 0.23 8.00 -1.26 -3.52 116.55 123.22 3i55 n ASP 77 Ca -0.17 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.25 3i55 n ASP 77 Cb 0.55 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.60 3i55 n ASP 77 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3i55 h GLU 78 N 0.00 -0.41 -1.13 -1.24 5.08 -1.99 -1.50 114.58 113.40 3i55 h GLU 78 Ca 0.00 0.03 0.35 0.00 -1.00 0.00 0.00 59.36 58.74 3i55 h GLU 78 Cb 0.00 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.28 3i55 h GLU 78 CO 0.00 -0.27 0.79 -1.33 -1.00 0.00 0.00 179.01 177.19 3i55 n MET 79 N -3.86 -0.01 -0.05 2.33 2.81 -1.23 0.08 117.12 117.19 3i55 n MET 79 Ca -0.05 0.75 -0.01 0.00 -1.81 0.00 0.00 57.70 56.58 3i55 n MET 79 Cb 0.21 -1.62 -0.00 0.00 -0.71 0.00 0.00 33.22 31.10 3i55 n MET 79 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3i55 h ALA 80 N 0.80 0.00 -0.10 3.04 0.00 -1.43 -3.29 119.26 118.28 3i55 h ALA 80 Ca 0.60 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.43 3i55 h ALA 80 Cb 2.21 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 20.05 3i55 h ALA 80 CO -0.13 0.09 -0.30 0.93 0.00 0.00 0.00 179.25 179.84 3i55 h GLU 81 N -0.85 -0.29 -1.24 0.00 5.08 0.55 0.65 114.58 118.47 3i55 h GLU 81 Ca 0.00 0.02 0.45 0.00 -1.00 0.00 0.00 59.36 58.83 3i55 h GLU 81 Cb 0.09 0.07 -0.15 0.00 0.50 0.00 0.00 28.75 29.25 3i55 h GLU 81 CO 0.00 -0.20 0.76 0.93 -1.00 0.00 0.00 179.01 179.51 3i55 h GLU 82 N -0.31 0.02 -0.05 2.33 5.08 -1.39 2.05 114.58 122.32 3i55 h GLU 82 Ca 0.02 -0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.16 3i55 h GLU 82 Cb 0.37 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3i55 h GLU 82 CO -0.26 0.02 -0.86 0.35 -1.00 0.00 0.00 179.01 177.25 3i55 h PHE 83 N 0.02 0.71 -0.38 4.33 3.57 -1.10 -3.29 116.94 120.81 3i55 h PHE 83 Ca 0.86 -0.35 -0.14 0.00 3.53 0.00 0.00 57.97 61.87 3i55 h PHE 83 Cb 2.59 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 41.22 3i55 h PHE 83 CO -0.01 1.16 -0.33 -0.07 -2.23 0.00 0.00 178.31 176.83 3i55 h LEU 84 N 0.31 0.88 -1.39 0.59 3.38 0.53 0.14 115.31 119.75 3i55 h LEU 84 Ca -0.07 -0.37 0.31 0.00 0.09 0.00 0.00 57.88 57.84 3i55 h LEU 84 Cb 1.48 -0.25 -0.10 0.00 0.09 0.00 0.00 40.66 41.88 3i55 h LEU 84 CO 0.16 1.13 0.71 1.56 0.09 0.00 0.00 178.44 182.09 3i55 h GLN 85 N 0.70 0.30 0.04 1.13 4.20 -0.86 0.20 115.11 120.82 3i55 h GLN 85 Ca 0.07 -0.02 -0.36 0.00 0.06 0.00 0.00 58.65 58.40 3i55 h GLN 85 Cb 0.88 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.55 3i55 h GLN 85 CO 0.08 0.20 -2.18 0.25 -0.67 0.00 0.00 178.83 176.51 3i55 n THR 86 N -4.63 1.58 0.41 -0.54 -2.24 -1.14 -4.37 114.28 103.34 3i55 n THR 86 Ca 0.28 -0.69 -0.18 0.00 -2.27 0.00 0.00 64.05 61.19 3i55 n THR 86 Cb 1.02 -1.28 -0.09 0.00 -2.10 0.00 0.00 70.33 67.88 3i55 n THR 86 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i55 h ALA 87 N 0.38 -1.01 -0.46 6.98 0.00 0.10 -3.17 119.26 122.08 3i55 h ALA 87 Ca -0.48 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 54.30 3i55 h ALA 87 Cb 2.03 0.39 -0.10 0.00 0.00 0.00 0.00 17.79 20.11 3i55 h ALA 87 CO 0.02 -1.05 -0.21 -0.07 0.00 0.00 0.00 179.25 177.93 3i55 h LEU 88 N -1.05 -0.74 -0.90 0.00 3.38 -0.94 -1.72 115.31 113.34 3i55 h LEU 88 Ca -0.10 0.17 0.16 0.00 0.09 0.00 0.00 57.88 58.19 3i55 h LEU 88 Cb 0.79 0.40 -0.10 0.00 0.09 0.00 0.00 40.66 41.84 3i55 h LEU 88 CO 0.17 -0.24 0.50 -0.65 0.09 0.00 0.00 178.44 178.31 3i55 h PRO 89 N -0.12 0.67 0.00 1.13 0.11 -1.76 -0.61 132.00 131.42 3i55 h PRO 89 Ca 0.22 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.29 3i55 h PRO 89 Cb 0.46 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.42 3i55 h PRO 89 CO -0.53 0.44 0.00 1.28 -0.21 0.00 0.00 178.00 178.98 3i55 n LEU 90 N -4.83 0.00 -4.15 2.35 4.77 -0.65 -4.70 117.00 109.80 3i55 n LEU 90 Ca 0.19 0.04 -0.19 0.00 -0.03 0.00 0.00 56.01 56.02 3i55 n LEU 90 Cb 0.47 -0.04 -0.13 0.00 -2.33 0.00 0.00 43.42 41.39 3i55 n LEU 90 CO 0.21 -0.03 -0.45 0.00 -1.33 0.00 0.00 177.39 175.79 3i55 s ALA 91 N -2.08 1.11 -0.53 -1.18 0.00 -0.24 -5.10 121.76 113.74 3i55 s ALA 91 Ca 0.09 -0.89 -0.16 0.00 0.00 0.00 0.00 51.96 51.00 3i55 s ALA 91 Cb 0.04 -0.12 0.12 0.00 0.00 0.00 0.00 23.12 23.16 3i55 s ALA 91 CO 0.07 0.17 0.48 -1.21 0.00 0.00 0.00 175.76 175.28 3i55 s GLU 92 N -1.42 2.98 0.33 0.00 2.02 -1.26 -4.99 118.70 116.35 3i55 s GLU 92 Ca -0.01 -1.66 -0.28 0.00 0.02 0.00 0.00 54.97 53.04 3i55 s GLU 92 Cb -0.09 -4.27 -0.09 0.00 0.10 0.00 0.00 34.13 29.78 3i55 s GLU 92 CO 0.02 -1.29 1.18 -0.51 0.02 0.00 0.00 175.26 174.68 3i55 s LEU 93 N 1.60 4.41 0.31 1.80 1.43 -1.26 -5.06 118.68 121.91 3i55 s LEU 93 Ca 0.03 2.42 0.03 0.00 -1.03 0.00 0.00 54.13 55.58 3i55 s LEU 93 Cb -0.29 -3.75 -0.05 0.00 0.03 0.00 0.00 46.19 42.13 3i55 s LEU 93 CO 0.03 -0.42 0.10 0.00 0.23 0.00 0.00 176.35 176.30 3i55 s ALA 94 N -1.23 2.16 -0.04 4.21 0.00 -1.25 -4.64 121.76 120.97 3i55 s ALA 94 Ca 0.49 -1.81 -0.18 0.00 0.00 0.00 0.00 51.96 50.47 3i55 s ALA 94 Cb -0.34 0.89 -0.11 0.00 0.00 0.00 0.00 23.12 23.56 3i55 s ALA 94 CO 0.44 -0.40 0.74 1.15 0.00 0.00 0.00 175.76 177.69 3i55 h THR 95 N 2.17 0.35 0.00 0.00 2.02 -1.91 -3.15 112.91 112.40 3i55 h THR 95 Ca -0.38 -0.81 0.00 0.00 0.77 0.00 0.00 66.41 66.00 3i55 h THR 95 Cb 1.25 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 3i55 h THR 95 CO 0.62 0.09 0.00 -1.54 0.37 0.00 0.00 175.52 175.05 3i55 n SER 96 N -5.05 0.05 -1.04 4.18 3.41 -1.26 -1.56 113.62 112.35 3i55 n SER 96 Ca -0.07 -0.30 0.08 0.00 -0.26 0.00 0.00 58.87 58.31 3i55 n SER 96 Cb 0.23 -0.02 0.27 0.00 -0.26 0.00 0.00 64.21 64.43 3i55 n SER 96 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i55 n GLN 97 N -0.20 3.24 -4.33 4.33 6.02 -1.19 -5.00 117.38 120.26 3i55 n GLN 97 Ca 0.00 -2.73 -0.28 0.00 -0.01 0.00 0.00 57.00 53.98 3i55 n GLN 97 Cb 0.01 -1.79 -0.11 0.00 1.02 0.00 0.00 30.24 29.38 3i55 n GLN 97 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3i55 s PHE 98 N -2.36 2.51 0.03 1.08 0.40 -0.60 -3.93 117.98 115.12 3i55 s PHE 98 Ca 0.41 -0.27 -0.10 0.00 -0.60 0.00 0.00 56.93 56.37 3i55 s PHE 98 Cb 0.31 -1.27 -0.05 0.00 0.51 0.00 0.00 43.02 42.51 3i55 s PHE 98 CO 0.13 0.46 0.36 0.34 0.70 0.00 0.00 175.22 177.21 3i55 s ASP 99 N -2.54 6.63 0.58 1.36 3.68 0.51 -4.92 116.67 121.97 3i55 s ASP 99 Ca 0.21 0.76 0.29 0.00 2.13 0.00 0.00 52.55 55.95 3i55 s ASP 99 Cb -0.09 -2.17 1.58 0.00 -1.45 0.00 0.00 42.92 40.79 3i55 s ASP 99 CO 0.12 0.24 1.87 0.44 0.13 0.00 0.00 175.17 177.97 3i55 h ASP 100 N 4.08 0.00 -0.53 -0.34 5.19 -1.95 0.48 116.42 123.35 3i55 h ASP 100 Ca -0.50 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.91 3i55 h ASP 100 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 3i55 h ASP 100 CO 0.65 0.00 0.00 0.41 -3.12 0.00 0.00 179.24 177.18 3i55 n THR 101 N -2.72 2.00 -2.45 0.35 -1.04 -1.26 -4.26 114.28 104.90 3i55 n THR 101 Ca -0.02 -1.35 -0.04 0.00 -2.04 0.00 0.00 64.05 60.60 3i55 n THR 101 Cb 0.28 0.03 0.02 0.00 -1.82 0.00 0.00 70.33 68.84 3i55 n THR 101 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3i55 n GLY 102 N 0.65 0.35 3.14 3.41 0.00 0.17 -4.43 105.19 108.48 3i55 n GLY 102 Ca 0.24 -0.37 -0.16 0.00 0.00 0.00 0.00 46.02 45.72 3i55 n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i55 s ASN 103 N -3.25 1.40 -0.01 1.61 -0.87 -1.23 -3.69 114.94 108.90 3i55 s ASN 103 Ca 0.04 -0.62 -0.01 0.00 -1.57 0.00 0.00 52.86 50.69 3i55 s ASN 103 Cb -0.02 -0.02 0.00 0.00 -0.02 0.00 0.00 41.25 41.20 3i55 s ASN 103 CO 0.17 -0.14 0.04 0.72 -2.57 0.00 0.00 177.10 175.32 3i55 s PHE 104 N -1.45 -0.02 -0.01 2.20 -0.12 -1.19 0.19 117.98 117.58 3i55 s PHE 104 Ca -0.03 0.05 0.06 0.00 -0.05 0.00 0.00 56.93 56.95 3i55 s PHE 104 Cb -0.09 -0.00 -0.01 0.00 -0.63 0.00 0.00 43.02 42.28 3i55 s PHE 104 CO 0.01 -0.04 -0.19 0.45 -0.05 0.00 0.00 175.22 175.41 3i55 s SER 105 N -0.13 2.18 -0.15 1.98 0.15 -1.25 -1.75 113.70 114.72 3i55 s SER 105 Ca -0.02 -0.34 -0.07 0.00 0.70 0.00 0.00 55.95 56.22 3i55 s SER 105 Cb -0.01 -0.24 0.06 0.00 -1.71 0.00 0.00 66.02 64.12 3i55 s SER 105 CO 0.00 0.22 0.34 0.72 1.20 0.00 0.00 173.24 175.72 3i55 s PHE 106 N -0.45 -0.54 -1.42 3.44 -0.71 -0.97 -4.97 117.98 112.36 3i55 s PHE 106 Ca 0.07 1.15 0.00 0.00 -1.04 0.00 0.00 56.93 57.11 3i55 s PHE 106 Cb -0.07 0.15 0.00 0.00 -1.21 0.00 0.00 43.02 41.89 3i55 s PHE 106 CO -0.01 -0.35 0.00 0.41 -1.34 0.00 0.00 175.22 173.93 3i55 n GLY 107 N 4.77 -0.55 0.00 1.99 0.00 -1.26 -3.19 105.19 106.95 3i55 n GLY 107 Ca -0.16 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.14 3i55 n GLY 107 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3i55 n LEU 128 N 0.00 0.00 -4.89 0.99 0.00 -1.26 -5.03 117.00 106.80 3i55 n LEU 128 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 56.01 55.71 3i55 n LEU 128 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.38 3i55 n LEU 128 CO 0.00 0.00 0.16 -1.81 0.00 0.00 0.00 177.39 175.74 3i55 s ASP 129 N 0.00 6.51 -0.14 1.96 1.01 -0.57 -4.97 116.67 120.47 3i55 s ASP 129 Ca 0.00 0.74 -0.04 0.00 0.71 0.00 0.00 52.55 53.96 3i55 s ASP 129 Cb 0.00 -2.15 0.07 0.00 1.01 0.00 0.00 42.92 41.84 3i55 s ASP 129 CO 0.00 -0.09 0.18 -0.69 0.21 0.00 0.00 175.17 174.78 3i55 s VAL 130 N -1.89 -0.28 0.20 -1.27 1.01 -1.19 -2.03 120.40 114.95 3i55 s VAL 130 Ca 0.44 0.13 0.11 0.00 0.00 0.00 0.00 61.98 62.66 3i55 s VAL 130 Cb -0.11 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 3i55 s VAL 130 CO 0.26 -0.02 -0.20 -0.89 0.00 0.00 0.00 175.10 174.25 3i55 s THR 131 N 2.30 2.59 -0.07 3.92 2.01 -0.62 -2.29 115.64 123.48 3i55 s THR 131 Ca 0.04 -1.98 0.00 0.00 0.31 0.00 0.00 61.69 60.06 3i55 s THR 131 Cb -0.14 -2.27 0.02 0.00 0.01 0.00 0.00 72.50 70.12 3i55 s THR 131 CO -0.08 -0.15 -0.05 -0.69 -0.69 0.00 0.00 174.62 172.95 3i55 s VAL 132 N -1.79 0.69 -0.41 3.82 1.01 -0.71 -2.10 120.40 120.91 3i55 s VAL 132 Ca 0.23 -0.16 -0.16 0.00 0.00 0.00 0.00 61.98 61.89 3i55 s VAL 132 Cb -0.08 -0.73 0.02 0.00 0.00 0.00 0.00 36.38 35.59 3i55 s VAL 132 CO 0.12 0.28 0.36 0.21 0.00 0.00 0.00 175.10 176.07 3i55 s ASN 133 N 1.25 6.15 0.04 3.32 3.84 0.01 -3.19 114.94 126.36 3i55 s ASN 133 Ca -0.05 -0.76 0.04 0.00 0.21 0.00 0.00 52.86 52.30 3i55 s ASN 133 Cb -0.14 -2.19 -0.04 0.00 -0.55 0.00 0.00 41.25 38.34 3i55 s ASN 133 CO -0.02 -0.49 -0.03 -0.76 -2.79 0.00 0.00 177.10 173.01 3i55 s LEU 134 N 1.89 3.35 -0.24 3.21 1.43 -1.24 -0.56 118.68 126.52 3i55 s LEU 134 Ca 0.08 -0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 52.75 3i55 s LEU 134 Cb -0.18 -1.99 0.17 0.00 0.03 0.00 0.00 46.19 44.21 3i55 s LEU 134 CO 0.12 0.24 1.22 0.54 0.23 0.00 0.00 176.35 178.70 3i55 s VAL 135 N -1.14 0.00 0.54 -1.59 0.11 -0.90 -4.83 120.40 112.59 3i55 s VAL 135 Ca 0.21 0.00 -0.21 0.00 -2.93 0.00 0.00 61.98 59.05 3i55 s VAL 135 Cb -0.11 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.69 3i55 s VAL 135 CO 0.12 0.00 1.25 -0.13 -3.33 0.00 0.00 175.10 173.01 3i55 s ARG 136 N -1.13 3.23 0.00 1.54 0.52 -1.26 -3.79 118.95 118.06 3i55 s ARG 136 Ca 0.05 1.96 0.00 0.00 -0.52 0.00 0.00 55.73 57.22 3i55 s ARG 136 Cb -0.01 -2.17 0.00 0.00 0.52 0.00 0.00 34.95 33.29 3i55 s ARG 136 CO -0.04 -1.03 0.00 -2.30 0.02 0.00 0.00 175.30 171.94 3i55 n PRO 137 N -1.10 0.00 -0.49 3.54 -0.02 -1.26 -3.36 135.00 132.31 3i55 n PRO 137 Ca 0.11 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.29 3i55 n PRO 137 Cb 0.47 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.89 3i55 n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i55 n GLY 138 N -0.18 1.45 0.09 -1.23 0.00 -1.26 -4.32 105.19 99.73 3i55 n GLY 138 Ca 0.00 -0.72 -0.06 0.00 0.00 0.00 0.00 46.02 45.24 3i55 n GLY 138 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3i55 n TYR 139 N 7.14 0.63 -0.24 1.61 9.36 -1.21 -4.10 117.16 130.34 3i55 n TYR 139 Ca 0.34 0.22 0.29 0.00 3.32 0.00 0.00 57.90 62.07 3i55 n TYR 139 Cb 0.27 -1.07 0.70 0.00 -0.63 0.00 0.00 39.34 38.61 3i55 n TYR 139 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 3i55 h ARG 140 N 0.00 0.07 -1.09 2.98 2.43 -1.91 0.62 114.38 117.48 3i55 h ARG 140 Ca -0.33 -0.00 0.31 0.00 -0.81 0.00 0.00 59.98 59.15 3i55 h ARG 140 Cb 1.94 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 31.43 3i55 h ARG 140 CO 0.05 0.04 0.78 0.28 -1.51 0.00 0.00 179.97 179.61 3i55 h VAL 141 N 0.07 0.46 0.00 0.20 2.07 -1.90 0.21 116.25 117.36 3i55 h VAL 141 Ca 0.49 -0.02 -0.25 0.00 0.82 0.00 0.00 66.70 67.74 3i55 h VAL 141 Cb 1.82 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.95 3i55 h VAL 141 CO -0.05 0.01 -2.08 0.00 0.02 0.00 0.00 177.57 175.47 3i55 n ALA 142 N -2.72 1.84 0.63 1.67 0.00 0.20 -1.03 120.51 121.11 3i55 n ALA 142 Ca 0.24 -0.98 0.12 0.00 0.00 0.00 0.00 53.44 52.81 3i55 n ALA 142 Cb 1.13 -0.49 0.13 0.00 0.00 0.00 0.00 19.45 20.22 3i55 n ALA 142 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i55 n LYS 143 N -2.70 0.25 -0.96 0.00 4.76 -0.26 -4.67 118.16 114.58 3i55 n LYS 143 Ca -0.22 0.04 -0.24 0.00 -2.87 0.00 0.00 58.31 55.03 3i55 n LYS 143 Cb 0.97 -1.63 0.20 0.00 -1.84 0.00 0.00 35.03 32.73 3i55 n LYS 143 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 3i55 n ARG 144 N -1.97 -2.46 -0.07 1.97 1.85 0.59 -5.04 116.66 111.52 3i55 n ARG 144 Ca 0.03 -1.45 -0.07 0.00 -1.00 0.00 0.00 57.85 55.35 3i55 n ARG 144 Cb 0.42 -1.29 -0.02 0.00 -1.05 0.00 0.00 32.46 30.52 3i55 n ARG 144 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 3i55 n ASP 145 N -4.38 1.64 -4.69 2.89 10.43 -1.26 -4.71 116.55 116.47 3i55 n ASP 145 Ca 0.12 0.32 -0.42 0.00 2.57 0.00 0.00 54.79 57.38 3i55 n ASP 145 Cb 0.47 -0.72 -0.03 0.00 1.84 0.00 0.00 41.12 42.69 3i55 n ASP 145 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 3i55 s LYS 146 N -2.57 4.15 -1.36 -1.24 1.02 -1.26 -3.52 119.74 114.96 3i55 s LYS 146 Ca -0.23 2.53 -0.02 0.00 0.02 0.00 0.00 55.97 58.27 3i55 s LYS 146 Cb 0.03 -3.57 0.02 0.00 -0.52 0.00 0.00 37.83 33.79 3i55 s LYS 146 CO 0.35 -0.81 0.04 0.00 -0.92 0.00 0.00 175.35 174.01 3i55 n ALA 147 N 5.56 -1.81 -0.84 5.17 0.00 -1.26 -4.91 120.51 122.43 3i55 n ALA 147 Ca 0.17 -0.35 -0.28 0.00 0.00 0.00 0.00 53.44 52.98 3i55 n ALA 147 Cb 0.39 -0.80 0.22 0.00 0.00 0.00 0.00 19.45 19.26 3i55 n ALA 147 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3i55 s SER 148 N -4.10 1.51 -0.03 0.00 1.04 -1.23 -5.02 113.70 105.87 3i55 s SER 148 Ca 0.06 1.27 -0.27 0.00 0.48 0.00 0.00 55.95 57.48 3i55 s SER 148 Cb -0.03 -1.98 0.06 0.00 0.10 0.00 0.00 66.02 64.17 3i55 s SER 148 CO 0.87 -3.84 0.61 -0.60 0.98 0.00 0.00 173.24 171.26 3i55 s ARG 149 N -4.74 1.01 0.36 4.02 6.06 -0.20 -4.98 118.95 120.47 3i55 s ARG 149 Ca 0.67 0.11 -0.19 0.00 -2.50 0.00 0.00 55.73 53.83 3i55 s ARG 149 Cb -0.21 0.47 -0.10 0.00 0.06 0.00 0.00 34.95 35.17 3i55 s ARG 149 CO 0.61 -0.32 0.84 0.45 -2.50 0.00 0.00 175.30 174.37 3i55 s SER 150 N -1.36 6.91 -0.05 -2.12 0.15 -1.26 -3.34 113.70 112.63 3i55 s SER 150 Ca -0.10 1.50 -0.30 0.00 0.70 0.00 0.00 55.95 57.75 3i55 s SER 150 Cb -0.01 -2.46 -0.03 0.00 -1.71 0.00 0.00 66.02 61.82 3i55 s SER 150 CO 0.07 -0.23 1.06 -0.63 1.20 0.00 0.00 173.24 174.71 3i55 s ILE 151 N -1.99 4.61 0.28 6.45 -1.09 -1.26 -5.00 121.20 123.19 3i55 s ILE 151 Ca 0.56 1.89 -0.30 0.00 -2.23 0.00 0.00 60.65 60.57 3i55 s ILE 151 Cb -0.11 -4.21 -0.13 0.00 -1.58 0.00 0.00 42.46 36.43 3i55 s ILE 151 CO 0.16 0.05 1.28 -2.65 -1.23 0.00 0.00 174.94 172.56 3i55 n PRO 152 N 4.67 1.88 -0.43 2.79 -0.02 -1.26 -4.77 135.00 137.86 3i55 n PRO 152 Ca 0.09 0.66 0.40 0.00 -2.02 0.00 0.00 63.50 62.63 3i55 n PRO 152 Cb 0.48 -2.24 0.72 0.00 -0.02 0.00 0.00 33.50 32.45 3i55 n PRO 152 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3i55 h THR 153 N 2.67 0.16 0.03 3.45 1.35 -1.96 0.10 112.91 118.71 3i55 h THR 153 Ca -0.44 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.42 3i55 h THR 153 Cb 1.29 0.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.89 3i55 h THR 153 CO 0.68 0.00 -0.01 0.11 -0.25 0.00 0.00 175.52 176.05 3i55 h LYS 154 N 0.00 -0.03 0.00 4.72 6.56 -2.01 -3.07 116.57 122.74 3i55 h LYS 154 Ca 0.68 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.27 3i55 h LYS 154 Cb 2.93 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 34.60 3i55 h LYS 154 CO -0.01 0.47 0.00 1.58 -2.06 0.00 0.00 179.45 179.43 3i55 n HIS 155 N -4.86 0.00 -2.53 -1.35 -0.00 0.33 -4.72 115.22 102.09 3i55 n HIS 155 Ca -0.09 0.00 -0.40 0.00 0.46 0.00 0.00 57.72 57.69 3i55 n HIS 155 Cb 0.26 -0.21 -0.05 0.00 -0.12 0.00 0.00 29.99 29.88 3i55 n HIS 155 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 3i55 s ARG 156 N -2.41 4.67 0.57 1.57 1.81 -1.03 -4.54 118.95 119.59 3i55 s ARG 156 Ca 0.17 1.74 -0.18 0.00 -1.72 0.00 0.00 55.73 55.73 3i55 s ARG 156 Cb 0.10 -3.19 -0.04 0.00 -0.45 0.00 0.00 34.95 31.37 3i55 s ARG 156 CO 0.22 0.27 1.13 -1.17 -0.68 0.00 0.00 175.30 175.07 3i55 s LEU 157 N -1.42 3.66 0.17 2.53 2.96 -1.26 -5.03 118.68 120.29 3i55 s LEU 157 Ca 0.44 2.15 0.08 0.00 -0.22 0.00 0.00 54.13 56.58 3i55 s LEU 157 Cb -0.31 -4.58 -0.04 0.00 0.50 0.00 0.00 46.19 41.77 3i55 s LEU 157 CO 0.39 -1.35 -0.03 0.20 -1.32 0.00 0.00 176.35 174.24 3i55 s ASN 158 N -1.95 4.60 0.21 3.68 -0.87 -1.26 -4.02 114.94 115.33 3i55 s ASN 158 Ca 0.72 -0.45 -0.10 0.00 -1.57 0.00 0.00 52.86 51.46 3i55 s ASN 158 Cb -0.24 -0.92 0.29 0.00 -0.02 0.00 0.00 41.25 40.37 3i55 s ASN 158 CO 0.31 0.10 1.70 -0.65 -2.57 0.00 0.00 177.10 175.99 3i55 h PRO 159 N 2.79 0.24 0.29 -0.60 0.11 -1.76 0.17 132.00 133.24 3i55 h PRO 159 Ca -0.47 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3i55 h PRO 159 Cb 1.20 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 3i55 h PRO 159 CO 0.57 0.16 -0.18 0.00 -0.21 0.00 0.00 178.00 178.34 3i55 h ALA 160 N 1.48 -1.03 -0.44 -0.75 0.00 -1.95 -0.29 119.26 116.28 3i55 h ALA 160 Ca 0.31 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.26 3i55 h ALA 160 Cb 0.47 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3i55 h ALA 160 CO -0.41 -1.02 0.71 -0.44 0.00 0.00 0.00 179.25 178.10 3i55 h ASP 161 N -0.44 0.00 0.14 0.00 3.32 -1.86 0.10 116.42 117.69 3i55 h ASP 161 Ca -0.04 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 3i55 h ASP 161 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 3i55 h ASP 161 CO 0.04 0.00 -0.07 0.00 -1.72 0.00 0.00 179.24 177.49 3i55 h ALA 162 N 0.99 -0.19 -0.54 3.45 0.00 0.03 -2.91 119.26 120.08 3i55 h ALA 162 Ca 0.21 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 55.06 3i55 h ALA 162 Cb 1.63 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 19.40 3i55 h ALA 162 CO -0.00 -0.21 -0.12 0.28 0.00 0.00 0.00 179.25 179.20 3i55 h VAL 163 N -0.99 0.47 0.00 0.00 2.07 0.91 -1.66 116.25 117.05 3i55 h VAL 163 Ca -0.02 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 3i55 h VAL 163 Cb 0.39 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 3i55 h VAL 163 CO 0.03 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.62 3i55 n ALA 164 N -2.90 -0.15 -0.38 1.67 0.00 -0.59 0.68 120.51 118.85 3i55 n ALA 164 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.42 3i55 n ALA 164 Cb 0.29 0.18 -0.05 0.00 0.00 0.00 0.00 19.45 19.86 3i55 n ALA 164 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3i55 n PHE 165 N -1.68 -0.26 0.38 0.00 7.35 -1.10 0.52 117.46 122.66 3i55 n PHE 165 Ca 0.00 1.15 -0.18 0.00 -0.76 0.00 0.00 57.45 57.66 3i55 n PHE 165 Cb 0.00 -0.66 -0.09 0.00 0.35 0.00 0.00 39.48 39.08 3i55 n PHE 165 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3i55 h ILE 166 N 0.00 0.00 -0.91 -2.13 2.04 -1.25 -2.48 117.51 112.79 3i55 h ILE 166 Ca 0.20 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.32 3i55 h ILE 166 Cb 0.44 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.36 3i55 h ILE 166 CO -0.88 0.00 0.19 -0.08 0.00 0.00 0.00 178.15 177.37 3i55 h GLU 167 N -1.09 0.13 -1.82 2.37 4.81 0.15 0.41 114.58 119.54 3i55 h GLU 167 Ca -0.09 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 3i55 h GLU 167 Cb 0.88 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.23 3i55 h GLU 167 CO 0.08 0.09 0.00 0.45 -0.73 0.00 0.00 179.01 178.89 3i55 n SER 168 N -5.30 2.21 -2.78 1.04 2.88 0.18 -3.60 113.62 108.25 3i55 n SER 168 Ca 0.22 -1.44 -0.10 0.00 -1.33 0.00 0.00 58.87 56.23 3i55 n SER 168 Cb 0.73 -0.44 0.08 0.00 -0.75 0.00 0.00 64.21 63.83 3i55 n SER 168 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 3i55 n THR 169 N 1.40 0.01 -1.79 2.46 -1.04 0.14 -4.98 114.28 110.48 3i55 n THR 169 Ca 0.00 -1.90 -0.02 0.00 -2.04 0.00 0.00 64.05 60.08 3i55 n THR 169 Cb 0.25 1.18 0.01 0.00 -1.82 0.00 0.00 70.33 69.95 3i55 n THR 169 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3i55 n TYR 170 N 0.17 -0.39 0.00 -1.42 4.02 -1.24 -5.05 117.16 113.25 3i55 n TYR 170 Ca 0.07 0.14 0.00 0.00 -0.01 0.00 0.00 57.90 58.09 3i55 n TYR 170 Cb 0.73 -2.75 0.00 0.00 -0.02 0.00 0.00 39.34 37.29 3i55 n TYR 170 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 3i55 n ASP 171 N -1.77 0.00 -4.71 7.72 5.68 -1.25 -4.90 116.55 117.33 3i55 n ASP 171 Ca -0.01 0.00 -0.23 0.00 -0.50 0.00 0.00 54.79 54.05 3i55 n ASP 171 Cb 0.52 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.43 3i55 n ASP 171 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3i55 s VAL 172 N -2.00 3.19 0.00 2.12 1.01 -1.26 -4.72 120.40 118.74 3i55 s VAL 172 Ca 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 61.98 60.23 3i55 s VAL 172 Cb 0.00 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.42 3i55 s VAL 172 CO 0.00 -0.24 0.00 -1.84 0.00 0.00 0.00 175.10 173.02 3i55 n GLU 173 N -1.08 0.00 -0.05 2.72 0.28 -1.26 -4.77 120.64 116.48 3i55 n GLU 173 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.96 3i55 n GLU 173 Cb 0.61 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.48 3i55 n GLU 173 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25