#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x77 s LYS 8 N 0.00 4.02 -0.14 0.38 -0.14 -1.26 -2.35 119.74 120.25 1x77 s LYS 8 Ca 0.00 1.36 -0.01 0.00 -1.36 0.00 0.00 55.97 55.96 1x77 s LYS 8 Cb 0.00 -3.83 -0.01 0.00 -1.68 0.00 0.00 37.83 32.30 1x77 s LYS 8 CO 0.00 -0.98 -0.11 0.08 -0.76 0.00 0.00 175.35 173.58 1x77 s VAL 9 N 4.06 3.13 -0.26 3.17 1.01 -0.28 0.58 120.40 131.82 1x77 s VAL 9 Ca 0.55 -0.62 -0.13 0.00 0.00 0.00 0.00 61.98 61.78 1x77 s VAL 9 Cb -0.18 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1x77 s VAL 9 CO 0.20 0.51 0.26 -0.22 0.00 0.00 0.00 175.10 175.85 1x77 s LEU 10 N 0.50 4.06 -0.11 3.92 2.96 0.10 -1.40 118.68 128.73 1x77 s LEU 10 Ca -0.08 0.17 -0.16 0.00 -0.22 0.00 0.00 54.13 53.83 1x77 s LEU 10 Cb -0.15 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.23 1x77 s LEU 10 CO 0.04 -0.07 0.42 -0.83 -1.32 0.00 0.00 176.35 174.59 1x77 s GLY 11 N 1.49 2.37 -0.19 7.98 0.00 -0.28 -0.25 107.32 118.43 1x77 s GLY 11 Ca 0.11 -0.26 -0.00 0.00 0.00 0.00 0.00 44.72 44.57 1x77 s GLY 11 CO 0.09 0.57 -0.06 -0.42 0.00 0.00 0.00 173.10 173.28 1x77 s ILE 12 N 0.25 1.31 0.04 0.90 1.01 0.67 -0.35 121.20 125.04 1x77 s ILE 12 Ca 0.23 -0.85 -0.12 0.00 0.00 0.00 0.00 60.65 59.91 1x77 s ILE 12 Cb -0.15 -1.49 -0.06 0.00 0.01 0.00 0.00 42.46 40.77 1x77 s ILE 12 CO 0.09 0.08 0.40 -0.55 0.00 0.00 0.00 174.94 174.97 1x77 s SER 13 N 1.53 6.72 -0.15 3.58 0.15 -1.26 -0.64 113.70 123.63 1x77 s SER 13 Ca -0.01 0.87 0.17 0.00 0.70 0.00 0.00 55.95 57.68 1x77 s SER 13 Cb -0.16 -2.21 0.75 0.00 -1.71 0.00 0.00 66.02 62.69 1x77 s SER 13 CO -0.08 0.24 1.66 0.61 1.20 0.00 0.00 173.24 176.88 1x77 n GLY 14 N 1.32 2.77 3.10 9.45 0.00 -0.75 -4.88 105.19 116.19 1x77 n GLY 14 Ca -0.11 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 44.80 1x77 n GLY 14 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x77 s SER 15 N -0.85 1.97 0.12 1.61 0.15 -1.26 -4.12 113.70 111.32 1x77 s SER 15 Ca 0.52 -0.32 0.22 0.00 0.70 0.00 0.00 55.95 57.07 1x77 s SER 15 Cb 0.35 -0.63 -0.08 0.00 -1.71 0.00 0.00 66.02 63.96 1x77 s SER 15 CO 0.22 0.12 0.89 0.18 1.20 0.00 0.00 173.24 175.85 1x77 n LEU 16 N 3.30 0.58 -4.77 3.45 4.77 -1.26 -4.83 117.00 118.24 1x77 n LEU 16 Ca -0.19 0.19 -0.41 0.00 -0.03 0.00 0.00 56.01 55.57 1x77 n LEU 16 Cb 0.53 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.56 1x77 n LEU 16 CO 0.25 -0.10 1.09 0.00 -1.33 0.00 0.00 177.39 177.29 1x77 s ARG 17 N -3.38 4.21 0.50 3.23 1.70 -1.26 -4.91 118.95 119.04 1x77 s ARG 17 Ca -0.02 2.43 0.19 0.00 -0.47 0.00 0.00 55.73 57.86 1x77 s ARG 17 Cb 0.11 -3.02 1.24 0.00 -0.57 0.00 0.00 34.95 32.72 1x77 s ARG 17 CO 0.82 -0.41 2.04 0.66 -1.08 0.00 0.00 175.30 177.33 1x77 h SER 18 N 3.38 0.12 0.30 -2.89 4.64 -2.07 -1.49 113.55 115.54 1x77 h SER 18 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1x77 h SER 18 Cb 1.23 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1x77 h SER 18 CO 0.66 0.07 -0.34 0.61 -0.87 0.00 0.00 176.83 176.97 1x77 n GLY 19 N -1.57 -0.78 1.31 -0.77 0.00 -1.26 -4.98 105.19 97.13 1x77 n GLY 19 Ca 0.06 -0.40 -0.24 0.00 0.00 0.00 0.00 46.02 45.44 1x77 n GLY 19 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x77 n SER 20 N -0.89 0.38 0.24 1.61 2.88 -0.56 -4.80 113.62 112.48 1x77 n SER 20 Ca 0.10 0.36 0.08 0.00 -1.33 0.00 0.00 58.87 58.08 1x77 n SER 20 Cb 0.35 -0.33 0.61 0.00 -0.75 0.00 0.00 64.21 64.08 1x77 n SER 20 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 1x77 h TYR 21 N 2.46 0.00 -0.14 0.66 0.05 -1.94 -0.90 116.97 117.17 1x77 h TYR 21 Ca -0.11 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.50 1x77 h TYR 21 Cb 0.51 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 1x77 h TYR 21 CO 0.29 0.13 -0.63 -0.91 -1.05 0.00 0.00 178.16 175.99 1x77 h ASN 22 N 0.00 0.56 0.12 3.88 2.35 -1.87 -0.77 115.58 119.86 1x77 h ASN 22 Ca -0.00 -0.33 -0.17 0.00 -0.55 0.00 0.00 56.30 55.25 1x77 h ASN 22 Cb 0.25 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 1x77 h ASN 22 CO 0.02 1.05 -0.61 0.28 -1.65 0.00 0.00 177.43 176.51 1x77 h SER 23 N 0.36 0.55 -0.76 5.81 0.02 -1.74 -2.96 113.55 114.84 1x77 h SER 23 Ca -0.01 -0.32 -0.04 0.00 -0.84 0.00 0.00 61.79 60.58 1x77 h SER 23 Cb 1.18 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.53 1x77 h SER 23 CO 0.11 1.03 0.33 0.00 -1.14 0.00 0.00 176.83 177.16 1x77 h ALA 24 N 0.97 0.99 -0.58 3.77 0.00 -0.92 -1.09 119.26 122.39 1x77 h ALA 24 Ca -0.01 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 1x77 h ALA 24 Cb 1.16 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1x77 h ALA 24 CO 0.11 0.59 -0.06 0.00 0.00 0.00 0.00 179.25 179.89 1x77 h ALA 25 N 1.17 0.80 0.00 0.00 0.00 -1.09 -1.22 119.26 118.93 1x77 h ALA 25 Ca 0.26 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1x77 h ALA 25 Cb 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1x77 h ALA 25 CO -0.03 0.67 -0.43 -0.07 0.00 0.00 0.00 179.25 179.40 1x77 h LEU 26 N 0.95 0.00 -0.77 0.00 3.38 -1.34 -1.22 115.31 116.31 1x77 h LEU 26 Ca 0.16 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 1x77 h LEU 26 Cb 0.62 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1x77 h LEU 26 CO 0.04 0.43 -0.12 -0.61 0.09 0.00 0.00 178.44 178.27 1x77 h GLN 27 N 0.00 0.82 0.00 1.13 5.75 -0.61 -2.49 115.11 119.71 1x77 h GLN 27 Ca -0.00 -0.28 -0.11 0.00 -0.15 0.00 0.00 58.65 58.11 1x77 h GLN 27 Cb 0.87 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.34 1x77 h GLN 27 CO 0.06 0.89 -0.52 0.93 -2.65 0.00 0.00 178.83 177.54 1x77 h GLU 28 N 0.73 0.00 0.00 1.69 4.39 -0.87 -3.05 114.58 117.47 1x77 h GLU 28 Ca 0.12 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 1x77 h GLU 28 Cb 0.61 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1x77 h GLU 28 CO 0.04 0.52 -0.15 0.00 -1.16 0.00 0.00 179.01 178.27 1x77 h ALA 29 N 1.48 1.12 -0.58 3.43 0.00 -0.78 -2.71 119.26 121.21 1x77 h ALA 29 Ca -0.01 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1x77 h ALA 29 Cb 1.23 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1x77 h ALA 29 CO 0.07 0.18 0.37 0.82 0.00 0.00 0.00 179.25 180.69 1x77 h ILE 30 N 0.00 1.10 -0.26 0.00 2.04 -1.40 -1.84 117.51 117.15 1x77 h ILE 30 Ca -0.00 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1x77 h ILE 30 Cb 0.52 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1x77 h ILE 30 CO 0.02 0.13 0.00 0.61 0.00 0.00 0.00 178.15 178.91 1x77 n GLY 31 N -1.26 0.38 0.10 5.37 0.00 -1.03 -3.50 105.19 105.26 1x77 n GLY 31 Ca 0.05 -0.29 0.02 0.00 0.00 0.00 0.00 46.02 45.80 1x77 n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x77 n LEU 32 N 0.28 0.85 -4.70 0.99 4.77 -0.73 -5.04 117.00 113.41 1x77 n LEU 32 Ca 0.09 -0.77 -0.33 0.00 -0.03 0.00 0.00 56.01 54.97 1x77 n LEU 32 Cb 0.25 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.47 1x77 n LEU 32 CO 0.06 0.18 0.74 0.68 -1.33 0.00 0.00 177.39 177.73 1x77 s VAL 33 N -0.86 2.27 0.74 4.08 -7.23 -0.96 -4.61 120.40 113.83 1x77 s VAL 33 Ca 0.04 0.11 -0.02 0.00 -1.81 0.00 0.00 61.98 60.29 1x77 s VAL 33 Cb 0.04 -2.45 0.13 0.00 0.56 0.00 0.00 36.38 34.66 1x77 s VAL 33 CO 0.11 -0.09 1.02 -2.16 -0.31 0.00 0.00 175.10 173.67 1x77 s PRO 34 N -4.30 1.58 0.27 4.82 0.04 -1.26 -4.98 135.00 131.17 1x77 s PRO 34 Ca 0.70 -1.05 -0.30 0.00 0.04 0.00 0.00 61.00 60.39 1x77 s PRO 34 Cb -0.26 -2.29 -0.10 0.00 0.04 0.00 0.00 34.50 31.89 1x77 s PRO 34 CO 0.52 -1.54 1.48 -2.14 0.04 0.00 0.00 177.00 175.35 1x77 s PRO 35 N -5.21 4.23 0.00 0.56 0.02 -1.26 -2.55 135.00 130.79 1x77 s PRO 35 Ca 0.67 2.38 0.00 0.00 0.02 0.00 0.00 61.00 64.07 1x77 s PRO 35 Cb -0.05 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.39 1x77 s PRO 35 CO 0.45 -0.47 0.00 0.41 -0.33 0.00 0.00 177.00 177.06 1x77 n GLY 36 N 2.07 3.36 3.70 0.52 0.00 -1.26 -5.05 105.19 108.53 1x77 n GLY 36 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1x77 n GLY 36 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1x77 s MET 37 N -0.80 2.55 -0.09 1.61 0.00 -1.06 -1.27 119.30 120.24 1x77 s MET 37 Ca 0.00 -0.96 -0.15 0.00 0.00 0.00 0.00 55.69 54.59 1x77 s MET 37 Cb 0.00 -2.48 0.03 0.00 0.00 0.00 0.00 34.83 32.38 1x77 s MET 37 CO 0.00 0.49 0.37 -1.54 0.00 0.00 0.00 175.02 174.34 1x77 s SER 38 N -2.72 -0.33 -0.07 1.11 1.04 -0.99 -4.65 113.70 107.09 1x77 s SER 38 Ca 0.27 0.52 0.04 0.00 0.48 0.00 0.00 55.95 57.26 1x77 s SER 38 Cb -0.10 0.60 -0.02 0.00 0.10 0.00 0.00 66.02 66.60 1x77 s SER 38 CO 0.19 -0.26 -0.18 -0.63 0.98 0.00 0.00 173.24 173.34 1x77 s ILE 39 N -0.40 2.68 -0.09 -1.02 1.01 -1.26 -1.12 121.20 121.00 1x77 s ILE 39 Ca -0.05 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1x77 s ILE 39 Cb -0.03 -2.04 0.01 0.00 0.01 0.00 0.00 42.46 40.41 1x77 s ILE 39 CO 0.02 0.57 -0.15 -0.70 0.00 0.00 0.00 174.94 174.68 1x77 s GLU 40 N -0.28 2.13 0.19 2.79 2.12 -0.49 -4.94 118.70 120.23 1x77 s GLU 40 Ca 0.01 -0.55 -0.29 0.00 0.36 0.00 0.00 54.97 54.50 1x77 s GLU 40 Cb -0.13 -1.75 -0.08 0.00 0.26 0.00 0.00 34.13 32.43 1x77 s GLU 40 CO 0.03 0.01 0.92 -0.51 -0.54 0.00 0.00 175.26 175.17 1x77 s LEU 41 N 0.75 4.59 0.23 2.70 1.43 -1.26 -1.13 118.68 125.99 1x77 s LEU 41 Ca -0.12 1.85 -0.07 0.00 -1.03 0.00 0.00 54.13 54.76 1x77 s LEU 41 Cb -0.16 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.45 1x77 s LEU 41 CO 0.02 0.10 0.51 0.00 0.23 0.00 0.00 176.35 177.22 1x77 s ALA 42 N -0.81 3.63 -0.22 4.21 0.00 0.53 -4.87 121.76 124.22 1x77 s ALA 42 Ca 0.42 -0.41 -0.03 0.00 0.00 0.00 0.00 51.96 51.95 1x77 s ALA 42 Cb -0.25 -2.34 0.00 0.00 0.00 0.00 0.00 23.12 20.54 1x77 s ALA 42 CO 0.30 0.48 -0.08 0.34 0.00 0.00 0.00 175.76 176.81 1x77 s ASP 43 N -2.57 4.06 0.00 0.00 2.15 -1.26 -4.67 116.67 114.38 1x77 s ASP 43 Ca 0.45 -0.52 0.07 0.00 0.43 0.00 0.00 52.55 52.99 1x77 s ASP 43 Cb -0.11 -1.68 0.18 0.00 -0.30 0.00 0.00 42.92 41.01 1x77 s ASP 43 CO 0.24 -0.03 1.10 2.30 -0.17 0.00 0.00 175.17 178.61 1x77 n ILE 44 N 4.74 0.84 0.30 4.11 -5.35 -1.26 -4.62 119.36 118.12 1x77 n ILE 44 Ca -0.18 -0.92 0.16 0.00 -0.27 0.00 0.00 62.75 61.54 1x77 n ILE 44 Cb 0.50 0.61 0.93 0.00 -1.74 0.00 0.00 39.64 39.94 1x77 n ILE 44 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1x77 h SER 45 N 1.36 0.00 1.05 7.28 4.64 -1.98 -2.00 113.55 123.91 1x77 h SER 45 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1x77 h SER 45 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1x77 h SER 45 CO 0.00 0.03 -0.46 1.23 -0.87 0.00 0.00 176.83 176.75 1x77 h GLY 46 N 0.28 0.00 -4.48 -0.77 0.00 -1.94 -3.46 103.07 92.69 1x77 h GLY 46 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 1x77 h GLY 46 CO 0.00 0.00 0.65 -0.42 0.00 0.00 0.00 176.54 176.77 1x77 s ILE 47 N -3.16 3.58 0.75 2.60 1.01 -0.75 -4.75 121.20 120.48 1x77 s ILE 47 Ca 0.07 1.15 -0.05 0.00 0.00 0.00 0.00 60.65 61.83 1x77 s ILE 47 Cb 0.13 -3.74 0.12 0.00 0.01 0.00 0.00 42.46 38.98 1x77 s ILE 47 CO 0.69 0.10 1.04 -2.16 0.00 0.00 0.00 174.94 174.61 1x77 s PRO 48 N 0.93 1.65 0.26 2.79 0.04 -1.26 -5.04 135.00 134.37 1x77 s PRO 48 Ca 0.61 -0.78 -0.30 0.00 0.04 0.00 0.00 61.00 60.57 1x77 s PRO 48 Cb -0.34 -2.22 -0.10 0.00 0.04 0.00 0.00 34.50 31.88 1x77 s PRO 48 CO 0.31 -1.53 1.38 -0.51 0.04 0.00 0.00 177.00 176.68 1x77 s LEU 49 N -5.27 4.40 0.20 -3.56 1.43 -1.26 -4.92 118.68 109.70 1x77 s LEU 49 Ca 0.66 2.60 -0.31 0.00 -1.03 0.00 0.00 54.13 56.05 1x77 s LEU 49 Cb -0.06 -3.63 -0.11 0.00 0.03 0.00 0.00 46.19 42.42 1x77 s LEU 49 CO 0.46 -0.62 1.59 -0.47 0.23 0.00 0.00 176.35 177.54 1x77 s TYR 50 N -0.24 2.98 -0.24 0.29 5.04 -1.26 -4.99 117.35 118.93 1x77 s TYR 50 Ca 0.56 0.63 -0.03 0.00 -2.44 0.00 0.00 57.07 55.79 1x77 s TYR 50 Cb -0.40 -3.98 0.11 0.00 0.35 0.00 0.00 41.96 38.03 1x77 s TYR 50 CO 0.44 -3.56 0.23 1.21 -1.34 0.00 0.00 175.55 172.52 1x77 s ASN 51 N 0.96 1.80 0.35 4.32 3.84 -1.26 -5.03 114.94 119.92 1x77 s ASN 51 Ca 0.69 -0.54 0.17 0.00 0.21 0.00 0.00 52.86 53.39 1x77 s ASN 51 Cb -0.46 0.30 1.20 0.00 -0.55 0.00 0.00 41.25 41.74 1x77 s ASN 51 CO 0.35 -0.36 1.63 -0.08 -2.79 0.00 0.00 177.10 175.85 1x77 h GLU 52 N 8.31 0.19 -0.61 0.43 4.57 -1.98 0.28 114.58 125.77 1x77 h GLU 52 Ca -0.16 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 1x77 h GLU 52 Cb 1.11 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.63 1x77 h GLU 52 CO 0.32 0.13 0.39 -0.44 -1.18 0.00 0.00 179.01 178.23 1x77 h ASP 53 N 0.19 0.70 -0.39 1.04 3.32 -1.99 0.23 116.42 119.52 1x77 h ASP 53 Ca 0.78 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.73 1x77 h ASP 53 Cb 1.92 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 41.28 1x77 h ASP 53 CO -0.67 0.52 -0.05 0.58 -1.72 0.00 0.00 179.24 177.91 1x77 h VAL 54 N 0.82 1.27 -0.80 -1.35 2.07 -0.89 -2.85 116.25 114.53 1x77 h VAL 54 Ca 0.22 -1.09 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1x77 h VAL 54 Cb -0.08 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 1x77 h VAL 54 CO -0.05 0.37 0.49 0.22 0.02 0.00 0.00 177.57 178.62 1x77 h TYR 55 N 0.54 0.91 -0.68 1.57 3.20 -0.63 -1.30 116.97 120.57 1x77 h TYR 55 Ca 0.11 0.03 0.10 0.00 3.14 0.00 0.00 58.73 62.10 1x77 h TYR 55 Cb 0.54 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.48 1x77 h TYR 55 CO 0.04 0.47 0.45 0.00 -1.64 0.00 0.00 178.16 177.49 1x77 h ALA 56 N 1.37 1.90 0.00 1.82 0.00 -0.33 0.12 119.26 124.14 1x77 h ALA 56 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1x77 h ALA 56 Cb 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1x77 h ALA 56 CO -0.16 -0.05 0.00 1.28 0.00 0.00 0.00 179.25 180.32 1x77 n LEU 57 N -4.48 0.00 0.00 0.00 4.77 -0.52 -5.00 117.00 111.77 1x77 n LEU 57 Ca 0.11 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.59 1x77 n LEU 57 Cb 0.35 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1x77 n LEU 57 CO 0.33 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1x77 n GLY 58 N 1.47 3.52 3.70 -0.72 0.00 0.40 -5.08 105.19 108.49 1x77 n GLY 58 Ca 0.07 -1.68 -0.44 0.00 0.00 0.00 0.00 46.02 43.97 1x77 n GLY 58 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1x77 n PHE 59 N -0.99 2.43 -2.10 1.61 3.72 -1.26 -4.51 117.46 116.36 1x77 n PHE 59 Ca 0.00 0.37 -0.37 0.00 -0.05 0.00 0.00 57.45 57.40 1x77 n PHE 59 Cb 0.00 -2.51 0.01 0.00 -0.94 0.00 0.00 39.48 36.04 1x77 n PHE 59 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 1x77 s PRO 60 N -0.47 3.37 0.24 -1.08 0.02 -1.26 -4.77 135.00 131.04 1x77 s PRO 60 Ca 0.66 1.86 -0.11 0.00 0.02 0.00 0.00 61.00 63.43 1x77 s PRO 60 Cb -0.59 -2.19 0.33 0.00 0.02 0.00 0.00 34.50 32.07 1x77 s PRO 60 CO 0.49 -0.89 1.61 -1.35 -0.33 0.00 0.00 177.00 176.53 1x77 h PRO 61 N 1.51 0.01 -0.06 5.54 0.11 -1.96 0.18 132.00 137.32 1x77 h PRO 61 Ca -0.50 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.63 1x77 h PRO 61 Cb 1.27 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 1x77 h PRO 61 CO 0.58 0.01 0.04 0.00 -0.21 0.00 0.00 178.00 178.42 1x77 h ALA 62 N 1.76 2.00 0.00 -0.75 0.00 -1.90 -2.07 119.26 118.30 1x77 h ALA 62 Ca 0.37 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 55.12 1x77 h ALA 62 Cb 0.58 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1x77 h ALA 62 CO -0.78 -0.07 -0.78 0.28 0.00 0.00 0.00 179.25 177.90 1x77 h VAL 63 N 0.00 1.32 -0.18 0.00 2.07 -1.01 -2.94 116.25 115.50 1x77 h VAL 63 Ca 0.03 -2.87 -0.09 0.00 0.82 0.00 0.00 66.70 64.59 1x77 h VAL 63 Cb 0.11 2.65 -0.00 0.00 -1.52 0.00 0.00 31.29 32.53 1x77 h VAL 63 CO -0.00 0.75 -0.25 -0.33 0.02 0.00 0.00 177.57 177.77 1x77 h GLU 64 N 0.00 0.48 -0.39 1.57 4.39 -0.69 -1.42 114.58 118.52 1x77 h GLU 64 Ca -0.01 -0.28 0.03 0.00 0.34 0.00 0.00 59.36 59.44 1x77 h GLU 64 Cb 1.60 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 30.24 1x77 h GLU 64 CO 0.10 0.87 0.19 0.00 -1.16 0.00 0.00 179.01 179.01 1x77 h ARG 65 N 0.13 0.37 0.68 2.33 3.08 -1.52 -1.05 114.38 118.40 1x77 h ARG 65 Ca 0.02 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1x77 h ARG 65 Cb 0.81 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.79 1x77 h ARG 65 CO 0.06 0.25 -0.33 0.35 -1.07 0.00 0.00 179.97 179.23 1x77 h PHE 66 N 0.38 -0.85 -0.95 3.04 3.57 -1.50 -1.73 116.94 118.91 1x77 h PHE 66 Ca 0.17 -0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.84 1x77 h PHE 66 Cb 0.08 0.28 -0.11 0.00 2.79 0.00 0.00 35.95 38.99 1x77 h PHE 66 CO -0.10 -0.52 0.53 0.00 -2.23 0.00 0.00 178.31 175.99 1x77 h ARG 67 N -0.95 0.63 0.00 1.11 3.08 -1.05 0.16 114.38 117.36 1x77 h ARG 67 Ca -0.09 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1x77 h ARG 67 Cb 0.71 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.62 1x77 h ARG 67 CO 0.15 0.42 0.00 0.93 -1.07 0.00 0.00 179.97 180.40 1x77 h GLU 68 N 0.65 0.00 0.04 0.04 4.39 -0.98 -1.22 114.58 117.50 1x77 h GLU 68 Ca 0.56 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 60.03 1x77 h GLU 68 Cb 0.91 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.56 1x77 h GLU 68 CO -0.41 0.00 -1.02 1.96 -1.16 0.00 0.00 179.01 178.37 1x77 h GLN 69 N 0.00 0.29 -0.06 2.33 4.20 0.22 -2.69 115.11 119.41 1x77 h GLN 69 Ca 0.00 -0.37 -0.04 0.00 0.06 0.00 0.00 58.65 58.30 1x77 h GLN 69 Cb 0.66 0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1x77 h GLN 69 CO 0.00 1.10 -0.11 0.82 -0.67 0.00 0.00 178.83 179.97 1x77 h ILE 70 N 0.14 1.41 -0.59 2.54 2.04 -0.98 -1.04 117.51 121.04 1x77 h ILE 70 Ca -0.08 -1.40 0.07 0.00 1.00 0.00 0.00 64.86 64.45 1x77 h ILE 70 Cb 1.69 2.20 -0.06 0.00 -0.74 0.00 0.00 36.82 39.92 1x77 h ILE 70 CO 0.17 0.39 0.27 -0.09 0.00 0.00 0.00 178.15 178.88 1x77 h ARG 71 N -0.32 0.48 -0.08 2.37 2.43 -1.30 -2.99 114.38 114.98 1x77 h ARG 71 Ca 0.00 -0.03 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 1x77 h ARG 71 Cb 0.68 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1x77 h ARG 71 CO 0.02 0.32 -0.82 0.00 -1.51 0.00 0.00 179.97 177.98 1x77 h ALA 72 N 1.36 0.39 -3.04 2.80 0.00 -1.50 -3.46 119.26 115.81 1x77 h ALA 72 Ca 0.28 -0.63 -0.55 0.00 0.00 0.00 0.00 54.91 54.00 1x77 h ALA 72 Cb 0.26 -0.02 0.14 0.00 0.00 0.00 0.00 17.79 18.17 1x77 h ALA 72 CO -0.23 0.73 0.58 0.00 0.00 0.00 0.00 179.25 180.33 1x77 s ALA 73 N -3.57 2.69 -0.20 0.00 0.00 -0.40 -4.92 121.76 115.37 1x77 s ALA 73 Ca -0.08 1.30 0.17 0.00 0.00 0.00 0.00 51.96 53.35 1x77 s ALA 73 Cb 0.09 -3.56 0.06 0.00 0.00 0.00 0.00 23.12 19.70 1x77 s ALA 73 CO 0.88 -1.43 1.31 -0.44 0.00 0.00 0.00 175.76 176.07 1x77 h ASP 74 N 1.20 0.00 -5.02 0.00 3.32 -0.17 -3.48 116.42 112.27 1x77 h ASP 74 Ca -0.51 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.50 1x77 h ASP 74 Cb 1.31 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.72 1x77 h ASP 74 CO 0.56 0.40 0.10 0.00 -1.72 0.00 0.00 179.24 178.58 1x77 s ALA 75 N -3.02 -1.40 -0.04 3.45 0.00 -0.92 -4.34 121.76 115.49 1x77 s ALA 75 Ca 0.03 0.49 0.06 0.00 0.00 0.00 0.00 51.96 52.53 1x77 s ALA 75 Cb 0.08 0.62 -0.02 0.00 0.00 0.00 0.00 23.12 23.79 1x77 s ALA 75 CO 0.75 -0.63 -0.20 -0.51 0.00 0.00 0.00 175.76 175.17 1x77 s LEU 76 N -2.38 2.38 -0.19 0.00 1.43 -0.58 -0.72 118.68 118.62 1x77 s LEU 76 Ca -0.02 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1x77 s LEU 76 Cb -0.00 -1.45 0.03 0.00 0.03 0.00 0.00 46.19 44.80 1x77 s LEU 76 CO -0.07 0.33 -0.16 -0.22 0.23 0.00 0.00 176.35 176.45 1x77 s LEU 77 N -0.64 2.23 -0.12 1.79 2.96 0.65 -0.23 118.68 125.33 1x77 s LEU 77 Ca 0.10 -0.75 -0.05 0.00 -0.22 0.00 0.00 54.13 53.21 1x77 s LEU 77 Cb -0.11 -1.39 -0.04 0.00 0.50 0.00 0.00 46.19 45.16 1x77 s LEU 77 CO -0.00 -0.06 0.08 -0.36 -1.32 0.00 0.00 176.35 174.69 1x77 s PHE 78 N 1.32 3.38 -0.60 5.38 0.08 0.15 -0.24 117.98 127.46 1x77 s PHE 78 Ca 0.02 0.34 0.04 0.00 0.12 0.00 0.00 56.93 57.45 1x77 s PHE 78 Cb -0.14 -1.91 0.16 0.00 -0.57 0.00 0.00 43.02 40.56 1x77 s PHE 78 CO -0.11 0.55 0.40 0.00 -0.10 0.00 0.00 175.22 175.96 1x77 s ALA 79 N -0.75 3.16 -0.18 5.36 0.00 0.19 -0.95 121.76 128.60 1x77 s ALA 79 Ca 0.13 -3.39 -0.16 0.00 0.00 0.00 0.00 51.96 48.53 1x77 s ALA 79 Cb -0.12 -2.04 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 1x77 s ALA 79 CO 0.03 -2.06 0.41 -0.08 0.00 0.00 0.00 175.76 174.05 1x77 s THR 80 N -0.83 5.21 0.52 0.00 -1.32 -0.90 -1.82 115.64 116.50 1x77 s THR 80 Ca 0.24 0.76 -0.07 0.00 -1.21 0.00 0.00 61.69 61.40 1x77 s THR 80 Cb -0.09 -3.74 -0.04 0.00 -1.51 0.00 0.00 72.50 67.12 1x77 s THR 80 CO -0.13 0.28 0.86 -2.16 -2.21 0.00 0.00 174.62 171.27 1x77 s PRO 81 N 1.07 3.57 -0.22 7.08 0.04 -1.26 -3.81 135.00 141.48 1x77 s PRO 81 Ca 0.21 0.38 -0.09 0.00 0.04 0.00 0.00 61.00 61.53 1x77 s PRO 81 Cb -0.15 -2.29 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 1x77 s PRO 81 CO 0.08 -0.31 0.12 -2.00 0.04 0.00 0.00 177.00 174.94 1x77 s GLU 82 N -4.82 4.05 -0.27 4.56 2.12 -1.26 -2.71 118.70 120.38 1x77 s GLU 82 Ca 0.50 -0.29 0.03 0.00 0.36 0.00 0.00 54.97 55.57 1x77 s GLU 82 Cb -0.10 -3.42 0.06 0.00 0.26 0.00 0.00 34.13 30.93 1x77 s GLU 82 CO 0.47 0.16 -0.10 0.71 -0.54 0.00 0.00 175.26 175.96 1x77 s TYR 83 N 0.74 3.28 -1.14 5.30 1.51 0.68 -4.83 117.35 122.89 1x77 s TYR 83 Ca 0.06 -2.31 -0.14 0.00 -1.01 0.00 0.00 57.07 53.67 1x77 s TYR 83 Cb -0.13 -1.97 -0.02 0.00 -0.11 0.00 0.00 41.96 39.73 1x77 s TYR 83 CO 0.02 -0.88 0.81 0.09 -1.11 0.00 0.00 175.55 174.48 1x77 n ASN 84 N 4.44 -5.04 -2.19 2.29 3.02 -1.26 -2.81 115.26 113.71 1x77 n ASN 84 Ca -0.13 -0.91 -0.19 0.00 -0.03 0.00 0.00 54.58 53.32 1x77 n ASN 84 Cb 0.42 -3.94 -0.01 0.00 -0.61 0.00 0.00 39.78 35.64 1x77 n ASN 84 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1x77 n TYR 85 N -3.95 -0.95 -3.71 3.10 4.02 -1.26 -4.96 117.16 109.45 1x77 n TYR 85 Ca -0.12 0.03 -0.04 0.00 -0.01 0.00 0.00 57.90 57.76 1x77 n TYR 85 Cb 0.61 -3.72 0.02 0.00 -0.02 0.00 0.00 39.34 36.23 1x77 n TYR 85 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1x77 n SER 86 N -1.63 -1.52 -4.80 7.72 2.88 -1.12 -4.70 113.62 110.44 1x77 n SER 86 Ca -0.22 -1.93 -0.31 0.00 -1.33 0.00 0.00 58.87 55.09 1x77 n SER 86 Cb 0.67 2.51 0.07 0.00 -0.75 0.00 0.00 64.21 66.70 1x77 n SER 86 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1x77 s MET 87 N -2.05 2.58 0.29 -1.46 0.23 -1.26 -0.23 119.30 117.40 1x77 s MET 87 Ca 0.15 0.95 -0.29 0.00 -1.03 0.00 0.00 55.69 55.47 1x77 s MET 87 Cb -0.03 -1.95 -0.10 0.00 -1.53 0.00 0.00 34.83 31.22 1x77 s MET 87 CO 0.06 -1.35 1.37 0.00 -2.03 0.00 0.00 175.02 173.07 1x77 s ALA 88 N -3.03 3.55 0.21 3.16 0.00 -1.10 -4.36 121.76 120.20 1x77 s ALA 88 Ca 0.59 1.29 -0.10 0.00 0.00 0.00 0.00 51.96 53.74 1x77 s ALA 88 Cb -0.15 -3.52 0.30 0.00 0.00 0.00 0.00 23.12 19.75 1x77 s ALA 88 CO 0.55 -0.69 1.70 0.78 0.00 0.00 0.00 175.76 178.10 1x77 h GLY 89 N 4.19 0.76 0.12 0.00 0.00 -1.91 -2.32 103.07 103.91 1x77 h GLY 89 Ca -0.47 -0.02 0.09 0.00 0.00 0.00 0.00 47.33 46.93 1x77 h GLY 89 CO 0.71 -0.12 -0.08 -2.08 0.00 0.00 0.00 176.54 174.97 1x77 h VAL 90 N 0.25 0.57 -0.49 4.60 2.07 -1.91 0.33 116.25 121.67 1x77 h VAL 90 Ca 0.32 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.82 1x77 h VAL 90 Cb 0.47 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1x77 h VAL 90 CO -0.41 0.01 0.27 0.25 0.02 0.00 0.00 177.57 177.71 1x77 h LEU 91 N 0.03 0.60 -0.41 2.57 5.85 -1.59 -1.97 115.31 120.40 1x77 h LEU 91 Ca 0.23 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1x77 h LEU 91 Cb 0.35 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1x77 h LEU 91 CO -0.45 0.51 0.22 0.50 -0.34 0.00 0.00 178.44 178.88 1x77 h LYS 92 N 0.65 0.58 -0.98 1.25 1.63 -0.84 -2.08 116.57 116.77 1x77 h LYS 92 Ca 0.17 -0.07 0.09 0.00 -0.85 0.00 0.00 60.65 60.00 1x77 h LYS 92 Cb 0.04 -0.11 -0.07 0.00 -0.60 0.00 0.00 32.23 31.48 1x77 h LYS 92 CO -0.03 0.47 0.63 -0.97 -3.45 0.00 0.00 179.45 176.10 1x77 h ASN 93 N 0.53 0.94 -0.40 4.20 -1.24 -0.06 0.22 115.58 119.76 1x77 h ASN 93 Ca 0.14 0.03 -0.08 0.00 0.71 0.00 0.00 56.30 57.11 1x77 h ASN 93 Cb 0.07 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 1x77 h ASN 93 CO -0.02 0.55 -0.04 0.00 -1.29 0.00 0.00 177.43 176.62 1x77 h ALA 94 N 1.51 0.55 -0.80 1.57 0.00 -0.97 -2.07 119.26 119.05 1x77 h ALA 94 Ca 0.45 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1x77 h ALA 94 Cb 0.35 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1x77 h ALA 94 CO -0.21 0.37 0.33 0.82 0.00 0.00 0.00 179.25 180.56 1x77 h ILE 95 N 0.57 1.26 0.13 0.00 2.04 -0.55 -2.13 117.51 118.82 1x77 h ILE 95 Ca 0.11 -0.81 0.02 0.00 1.00 0.00 0.00 64.86 65.18 1x77 h ILE 95 Cb 0.55 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 1x77 h ILE 95 CO 0.03 0.33 -0.38 0.44 0.00 0.00 0.00 178.15 178.57 1x77 h ASP 96 N 1.16 -1.11 0.14 1.72 3.32 -0.28 -0.42 116.42 120.95 1x77 h ASP 96 Ca 0.27 0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.45 1x77 h ASP 96 Cb 0.20 0.42 -0.03 0.00 0.22 0.00 0.00 39.33 40.14 1x77 h ASP 96 CO -0.02 -0.46 -0.40 -0.50 -1.72 0.00 0.00 179.24 176.13 1x77 h TRP 97 N -0.62 -1.16 -0.06 4.55 4.06 -1.21 -2.35 115.95 119.16 1x77 h TRP 97 Ca 0.02 0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.02 1x77 h TRP 97 Cb 0.64 0.49 -0.00 0.00 -1.00 0.00 0.00 29.16 29.29 1x77 h TRP 97 CO -0.33 -0.47 0.39 0.00 -3.56 0.00 0.00 178.44 174.47 1x77 h ALA 98 N -0.83 1.49 -0.01 1.49 0.00 -1.21 -2.02 119.26 118.17 1x77 h ALA 98 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1x77 h ALA 98 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1x77 h ALA 98 CO -0.19 -0.43 -0.09 -1.13 0.00 0.00 0.00 179.25 177.41 1x77 n SER 99 N -2.98 0.64 -4.77 0.00 3.41 -0.18 -4.45 113.62 105.28 1x77 n SER 99 Ca -0.00 -0.81 -0.37 0.00 -0.26 0.00 0.00 58.87 57.42 1x77 n SER 99 Cb 0.46 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.36 1x77 n SER 99 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1x77 s ARG 100 N -2.34 3.89 0.86 4.33 1.81 -0.76 -4.69 118.95 122.04 1x77 s ARG 100 Ca 0.32 1.72 -0.10 0.00 -1.72 0.00 0.00 55.73 55.95 1x77 s ARG 100 Cb 0.20 -2.47 0.11 0.00 -0.45 0.00 0.00 34.95 32.35 1x77 s ARG 100 CO 0.44 -0.43 1.13 -2.14 -0.68 0.00 0.00 175.30 173.63 1x77 s PRO 101 N -2.61 1.46 0.36 3.54 0.02 -1.26 -4.15 135.00 132.36 1x77 s PRO 101 Ca 0.61 1.44 -0.05 0.00 0.02 0.00 0.00 61.00 63.02 1x77 s PRO 101 Cb -0.27 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.41 1x77 s PRO 101 CO 0.33 -2.29 0.64 -1.25 -0.33 0.00 0.00 177.00 174.11 1x77 s PRO 102 N -4.70 3.62 -1.36 5.54 0.04 -1.26 -4.94 135.00 131.94 1x77 s PRO 102 Ca 0.65 0.08 -0.18 0.00 0.04 0.00 0.00 61.00 61.59 1x77 s PRO 102 Cb -0.21 -2.54 0.02 0.00 0.04 0.00 0.00 34.50 31.81 1x77 s PRO 102 CO 0.57 0.07 0.40 0.39 0.04 0.00 0.00 177.00 178.46 1x77 n GLU 103 N -1.41 -0.73 -1.60 4.56 1.02 -1.26 -4.77 120.64 116.44 1x77 n GLU 103 Ca -0.01 0.11 -0.54 0.00 -0.02 0.00 0.00 57.16 56.70 1x77 n GLU 103 Cb 0.54 -3.12 -0.07 0.00 -0.02 0.00 0.00 31.44 28.78 1x77 n GLU 103 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x77 n GLN 104 N -4.81 1.25 0.29 3.49 -0.00 -1.26 -4.79 117.38 111.55 1x77 n GLN 104 Ca -0.21 0.42 0.07 0.00 -0.00 0.00 0.00 57.00 57.29 1x77 n GLN 104 Cb 0.63 -2.29 0.39 0.00 -0.00 0.00 0.00 30.24 28.97 1x77 n GLN 104 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.06 176.06 1x77 h PRO 105 N 9.36 0.00 -0.18 2.61 0.13 -1.86 -2.55 132.00 139.52 1x77 h PRO 105 Ca -0.39 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.68 1x77 h PRO 105 Cb 1.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 1x77 h PRO 105 CO 0.99 0.00 -0.14 0.74 -0.23 0.00 0.00 178.00 179.35 1x77 h PHE 106 N 0.00 0.32 -1.13 1.56 0.04 -1.86 -3.40 116.94 112.46 1x77 h PHE 106 Ca 0.00 -0.04 -0.76 0.00 2.80 0.00 0.00 57.97 59.97 1x77 h PHE 106 Cb 1.19 -0.09 -0.00 0.00 2.20 0.00 0.00 35.95 39.25 1x77 h PHE 106 CO 0.00 0.44 1.03 0.45 -0.60 0.00 0.00 178.31 179.63 1x77 n SER 107 N -4.24 1.90 0.00 2.17 2.88 -0.96 -1.75 113.62 113.62 1x77 n SER 107 Ca -0.00 0.91 0.00 0.00 -1.33 0.00 0.00 58.87 58.45 1x77 n SER 107 Cb 0.29 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.67 1x77 n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x77 n GLY 108 N 5.11 3.15 3.77 0.46 0.00 0.35 -5.01 105.19 113.01 1x77 n GLY 108 Ca 0.34 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.96 1x77 n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x77 s LYS 109 N -0.38 4.31 0.41 1.61 -0.14 -0.71 -4.66 119.74 120.17 1x77 s LYS 109 Ca 0.00 2.28 -0.06 0.00 -1.36 0.00 0.00 55.97 56.84 1x77 s LYS 109 Cb 0.00 -3.05 -0.05 0.00 -1.68 0.00 0.00 37.83 33.05 1x77 s LYS 109 CO 0.00 -0.25 0.71 -1.25 -0.76 0.00 0.00 175.35 173.80 1x77 s PRO 110 N -1.84 3.61 0.17 -1.68 0.04 -1.26 -1.43 135.00 132.61 1x77 s PRO 110 Ca 0.50 0.17 -0.16 0.00 0.04 0.00 0.00 61.00 61.55 1x77 s PRO 110 Cb -0.41 -2.46 0.02 0.00 0.04 0.00 0.00 34.50 31.69 1x77 s PRO 110 CO 0.55 -0.05 0.45 0.00 0.04 0.00 0.00 177.00 177.99 1x77 s ALA 111 N -2.48 -0.79 0.01 8.56 0.00 -0.96 -1.53 121.76 124.56 1x77 s ALA 111 Ca 0.47 -0.27 0.05 0.00 0.00 0.00 0.00 51.96 52.21 1x77 s ALA 111 Cb -0.10 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 23.80 1x77 s ALA 111 CO 0.38 -0.73 -0.14 0.00 0.00 0.00 0.00 175.76 175.27 1x77 s ALA 112 N -3.86 1.20 0.01 0.00 0.00 0.68 -0.30 121.76 119.48 1x77 s ALA 112 Ca 0.08 -0.72 0.08 0.00 0.00 0.00 0.00 51.96 51.40 1x77 s ALA 112 Cb 0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 1x77 s ALA 112 CO -0.05 0.27 -0.24 0.42 0.00 0.00 0.00 175.76 176.15 1x77 s ILE 113 N -0.57 1.88 0.08 0.00 1.01 -1.26 -0.68 121.20 121.66 1x77 s ILE 113 Ca 0.04 -1.12 -0.15 0.00 0.00 0.00 0.00 60.65 59.42 1x77 s ILE 113 Cb -0.07 -1.58 0.03 0.00 0.01 0.00 0.00 42.46 40.85 1x77 s ILE 113 CO 0.00 0.43 0.35 -1.48 0.00 0.00 0.00 174.94 174.25 1x77 s LEU 114 N -0.81 0.64 -0.02 2.97 0.05 -0.13 -4.37 118.68 117.01 1x77 s LEU 114 Ca 0.09 -0.23 -0.14 0.00 0.05 0.00 0.00 54.13 53.90 1x77 s LEU 114 Cb -0.09 1.59 0.02 0.00 -2.05 0.00 0.00 46.19 45.66 1x77 s LEU 114 CO 0.00 -0.72 0.30 -0.83 -0.55 0.00 0.00 176.35 174.55 1x77 s GLY 115 N -2.39 -0.15 -0.07 -3.48 0.00 -0.91 -2.13 107.32 98.19 1x77 s GLY 115 Ca -0.01 0.35 0.05 0.00 0.00 0.00 0.00 44.72 45.10 1x77 s GLY 115 CO -0.07 0.15 -0.22 0.00 0.00 0.00 0.00 173.10 172.97 1x77 s ALA 116 N -1.19 1.92 0.21 3.20 0.00 -1.25 -0.59 121.76 124.06 1x77 s ALA 116 Ca -0.12 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 50.98 1x77 s ALA 116 Cb -0.05 -0.66 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 1x77 s ALA 116 CO 0.04 0.32 0.02 -1.54 0.00 0.00 0.00 175.76 174.60 1x77 s SER 117 N 0.09 1.40 -0.16 0.00 1.04 -0.60 -4.38 113.70 111.08 1x77 s SER 117 Ca -0.09 -1.23 0.15 0.00 0.48 0.00 0.00 55.95 55.26 1x77 s SER 117 Cb -0.14 0.09 -0.20 0.00 0.10 0.00 0.00 66.02 65.87 1x77 s SER 117 CO 0.05 -0.59 0.05 0.00 0.98 0.00 0.00 173.24 173.73 1x77 n ALA 118 N -0.35 1.59 -1.00 5.32 0.00 -1.26 -1.89 120.51 122.92 1x77 n ALA 118 Ca -0.05 -1.09 0.00 0.00 0.00 0.00 0.00 53.44 52.30 1x77 n ALA 118 Cb 0.64 -0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1x77 n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x77 n GLY 119 N 1.98 -1.52 0.00 0.00 0.00 -1.26 -3.38 105.19 101.01 1x77 n GLY 119 Ca -0.27 -0.34 0.01 0.00 0.00 0.00 0.00 46.02 45.42 1x77 n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x77 n ARG 120 N 0.00 5.47 0.00 1.61 1.74 -1.26 -2.44 116.66 121.78 1x77 n ARG 120 Ca 0.00 -0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1x77 n ARG 120 Cb 0.00 -0.68 0.00 0.00 -1.02 0.00 0.00 32.46 30.76 1x77 n ARG 120 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1x77 n PHE 121 N -1.12 0.00 -1.23 -1.55 7.35 -1.26 -4.89 117.46 114.75 1x77 n PHE 121 Ca 0.00 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.84 1x77 n PHE 121 Cb 0.05 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 39.83 1x77 n PHE 121 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1x77 n GLY 122 N 3.49 -2.00 4.84 7.13 0.00 -1.26 -4.70 105.19 112.69 1x77 n GLY 122 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1x77 n GLY 122 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1x77 n THR 123 N -3.76 0.00 -0.09 2.61 -2.24 -1.26 -4.67 114.28 104.86 1x77 n THR 123 Ca -0.03 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.66 1x77 n THR 123 Cb 0.64 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.85 1x77 n THR 123 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x77 h ALA 124 N 0.00 0.40 0.01 6.98 0.00 -1.97 0.49 119.26 125.17 1x77 h ALA 124 Ca 0.00 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.65 1x77 h ALA 124 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1x77 h ALA 124 CO 0.00 -0.09 -0.91 -0.09 0.00 0.00 0.00 179.25 178.16 1x77 h ARG 125 N 0.39 0.19 -0.12 0.00 2.43 -1.90 -2.58 114.38 112.79 1x77 h ARG 125 Ca 0.11 -0.22 -0.20 0.00 -0.81 0.00 0.00 59.98 58.85 1x77 h ARG 125 Cb 0.03 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1x77 h ARG 125 CO -0.02 0.98 -0.75 0.00 -1.51 0.00 0.00 179.97 178.67 1x77 h ALA 126 N 0.94 0.45 -0.15 2.80 0.00 -1.73 -1.54 119.26 120.03 1x77 h ALA 126 Ca -0.05 -0.60 -0.11 0.00 0.00 0.00 0.00 54.91 54.15 1x77 h ALA 126 Cb 1.55 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 1x77 h ALA 126 CO 0.14 0.72 -0.40 1.96 0.00 0.00 0.00 179.25 181.67 1x77 h GLN 127 N 0.42 0.33 0.08 0.00 4.20 -0.03 0.74 115.11 120.85 1x77 h GLN 127 Ca -0.04 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.51 1x77 h GLN 127 Cb 1.35 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.13 1x77 h GLN 127 CO 0.14 0.69 -0.04 -0.92 -0.67 0.00 0.00 178.83 178.03 1x77 h TYR 128 N 0.28 -0.10 -0.71 2.96 5.03 -1.40 -0.85 116.97 122.17 1x77 h TYR 128 Ca 0.03 -0.00 0.09 0.00 2.58 0.00 0.00 58.73 61.42 1x77 h TYR 128 Cb 0.83 0.03 -0.07 0.00 1.55 0.00 0.00 36.73 39.08 1x77 h TYR 128 CO 0.02 0.38 0.36 0.45 -1.32 0.00 0.00 178.16 178.06 1x77 h HIS 129 N -0.66 0.65 -0.52 -3.82 3.86 -1.19 -0.68 115.15 112.80 1x77 h HIS 129 Ca -0.01 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1x77 h HIS 129 Cb 0.53 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.79 1x77 h HIS 129 CO 0.10 0.25 0.25 1.25 0.86 0.00 0.00 177.93 180.64 1x77 h LEU 130 N 0.63 0.67 -0.46 2.43 5.85 -0.84 -0.24 115.31 123.35 1x77 h LEU 130 Ca 0.34 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.96 1x77 h LEU 130 Cb 0.34 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 1x77 h LEU 130 CO -0.25 0.61 0.26 -0.09 -0.34 0.00 0.00 178.44 178.63 1x77 h ARG 131 N 0.69 0.50 -0.48 1.25 2.43 0.11 0.56 114.38 119.44 1x77 h ARG 131 Ca 0.18 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.26 1x77 h ARG 131 Cb 0.12 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1x77 h ARG 131 CO -0.02 0.33 0.08 1.96 -1.51 0.00 0.00 179.97 180.81 1x77 h GLN 132 N 0.52 0.80 -0.49 0.20 1.08 -0.93 0.60 115.11 116.88 1x77 h GLN 132 Ca 0.19 -0.21 -0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1x77 h GLN 132 Cb 0.05 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 1x77 h GLN 132 CO -0.10 0.80 0.29 1.15 -0.95 0.00 0.00 178.83 180.02 1x77 h THR 133 N 0.67 1.15 -0.17 -0.54 2.02 -0.65 0.86 112.91 116.25 1x77 h THR 133 Ca 0.15 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 1x77 h THR 133 Cb 0.38 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1x77 h THR 133 CO 0.01 0.16 0.06 -0.07 0.37 0.00 0.00 175.52 176.05 1x77 h LEU 134 N 0.66 0.25 -1.48 2.58 3.38 -0.69 -2.24 115.31 117.77 1x77 h LEU 134 Ca 0.18 -0.19 0.08 0.00 0.09 0.00 0.00 57.88 58.04 1x77 h LEU 134 Cb 0.00 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 1x77 h LEU 134 CO -0.03 0.38 0.45 0.58 0.09 0.00 0.00 178.44 179.90 1x77 h VAL 135 N 0.11 0.96 -0.10 1.22 2.07 -0.58 0.16 116.25 120.09 1x77 h VAL 135 Ca 0.06 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 1x77 h VAL 135 Cb 0.21 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1x77 h VAL 135 CO -0.00 0.11 0.01 0.15 0.02 0.00 0.00 177.57 177.86 1x77 h PHE 136 N 0.61 0.14 -0.35 1.57 3.04 -0.23 -1.47 116.94 120.24 1x77 h PHE 136 Ca 0.30 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.25 1x77 h PHE 136 Cb 0.40 -0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.86 1x77 h PHE 136 CO -0.00 0.14 0.00 1.28 -2.02 0.00 0.00 178.31 177.71 1x77 n LEU 137 N -4.46 3.46 -2.51 0.59 4.77 0.52 -4.90 117.00 114.47 1x77 n LEU 137 Ca -0.01 -1.75 -0.16 0.00 -0.03 0.00 0.00 56.01 54.05 1x77 n LEU 137 Cb 0.13 -0.55 0.05 0.00 -2.33 0.00 0.00 43.42 40.72 1x77 n LEU 137 CO 0.35 0.49 0.13 0.47 -1.33 0.00 0.00 177.39 177.50 1x77 n ASP 138 N 0.43 -4.94 -4.90 -1.43 8.00 -0.55 -3.64 116.55 109.52 1x77 n ASP 138 Ca 0.16 -0.33 -0.34 0.00 0.71 0.00 0.00 54.79 54.98 1x77 n ASP 138 Cb 0.72 -3.59 -0.05 0.00 -0.02 0.00 0.00 41.12 38.18 1x77 n ASP 138 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1x77 s VAL 139 N -3.16 5.42 -0.68 2.53 1.01 -0.91 -0.50 120.40 124.11 1x77 s VAL 139 Ca 0.36 -0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.30 1x77 s VAL 139 Cb -0.16 -3.52 0.17 0.00 0.00 0.00 0.00 36.38 32.88 1x77 s VAL 139 CO 0.44 0.39 0.51 -1.00 0.00 0.00 0.00 175.10 175.45 1x77 s HIS 140 N -1.26 3.49 0.33 5.22 0.09 -0.51 -4.24 115.29 118.41 1x77 s HIS 140 Ca 0.25 -2.79 -0.22 0.00 -0.00 0.00 0.00 55.06 52.30 1x77 s HIS 140 Cb -0.13 -3.20 -0.10 0.00 -0.00 0.00 0.00 32.58 29.16 1x77 s HIS 140 CO 0.15 -0.81 0.86 -1.25 -0.00 0.00 0.00 174.74 173.70 1x77 s PRO 141 N -0.37 4.32 0.23 8.40 0.04 -1.26 -2.28 135.00 144.09 1x77 s PRO 141 Ca 0.19 1.07 -0.30 0.00 0.04 0.00 0.00 61.00 62.00 1x77 s PRO 141 Cb -0.17 -2.59 -0.10 0.00 0.04 0.00 0.00 34.50 31.67 1x77 s PRO 141 CO -0.05 0.20 1.47 -0.51 0.04 0.00 0.00 177.00 178.15 1x77 s LEU 142 N -2.48 4.38 -0.05 -3.56 1.43 0.58 -4.89 118.68 114.10 1x77 s LEU 142 Ca 0.52 2.66 -0.26 0.00 -1.03 0.00 0.00 54.13 56.02 1x77 s LEU 142 Cb -0.14 -3.62 -0.22 0.00 0.03 0.00 0.00 46.19 42.24 1x77 s LEU 142 CO 0.19 -0.73 1.13 0.78 0.23 0.00 0.00 176.35 177.96 1x77 h ASN 143 N 5.38 0.05 -5.33 2.29 4.21 -1.96 -3.44 115.58 116.78 1x77 h ASN 143 Ca -0.45 -0.63 -0.15 0.00 1.21 0.00 0.00 56.30 56.27 1x77 h ASN 143 Cb 1.22 -0.02 -0.15 0.00 -1.12 0.00 0.00 38.32 38.25 1x77 h ASN 143 CO 0.80 0.68 -0.64 -0.54 -1.29 0.00 0.00 177.43 176.45 1x77 s LYS 144 N -3.68 0.81 1.10 0.81 1.02 -1.26 -4.63 119.74 113.90 1x77 s LYS 144 Ca -0.16 -1.32 -0.14 0.00 0.02 0.00 0.00 55.97 54.36 1x77 s LYS 144 Cb 0.01 0.24 0.24 0.00 -0.52 0.00 0.00 37.83 37.80 1x77 s LYS 144 CO 0.69 -0.21 1.07 -1.25 -0.92 0.00 0.00 175.35 174.73 1x77 s PRO 145 N -3.99 -0.38 -0.23 -1.68 0.04 -1.26 -4.96 135.00 122.53 1x77 s PRO 145 Ca 0.16 0.48 -0.06 0.00 0.04 0.00 0.00 61.00 61.62 1x77 s PRO 145 Cb 0.07 -1.65 -0.02 0.00 0.04 0.00 0.00 34.50 32.94 1x77 s PRO 145 CO -0.04 -3.27 0.04 -2.00 0.04 0.00 0.00 177.00 171.77 1x77 s GLU 146 N -4.89 3.62 -0.22 4.56 2.12 -1.26 -4.95 118.70 117.67 1x77 s GLU 146 Ca 0.67 -0.50 0.01 0.00 0.36 0.00 0.00 54.97 55.50 1x77 s GLU 146 Cb -0.19 -3.22 0.03 0.00 0.26 0.00 0.00 34.13 31.01 1x77 s GLU 146 CO 0.59 -0.13 -0.14 0.08 -0.54 0.00 0.00 175.26 175.13 1x77 s VAL 147 N 1.41 2.34 -0.03 3.70 1.01 -1.26 -5.08 120.40 122.48 1x77 s VAL 147 Ca 0.05 -1.14 0.02 0.00 0.00 0.00 0.00 61.98 60.91 1x77 s VAL 147 Cb -0.15 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1x77 s VAL 147 CO 0.02 0.30 -0.07 -0.04 0.00 0.00 0.00 175.10 175.30 1x77 s MET 148 N 1.25 0.93 -0.53 2.72 -1.94 -1.26 -2.15 119.30 118.32 1x77 s MET 148 Ca 0.00 -0.24 -0.07 0.00 -1.71 0.00 0.00 55.69 53.68 1x77 s MET 148 Cb -0.16 -0.87 0.14 0.00 2.01 0.00 0.00 34.83 35.95 1x77 s MET 148 CO -0.08 0.04 0.38 0.42 -0.01 0.00 0.00 175.02 175.77 1x77 s ILE 149 N 0.44 4.03 0.60 2.53 -1.09 0.24 -4.98 121.20 122.97 1x77 s ILE 149 Ca -0.07 -2.22 -0.05 0.00 -2.23 0.00 0.00 60.65 56.08 1x77 s ILE 149 Cb -0.11 -3.65 0.02 0.00 -1.58 0.00 0.00 42.46 37.14 1x77 s ILE 149 CO 0.01 -0.81 0.90 -0.44 -1.23 0.00 0.00 174.94 173.36 1x77 s SER 150 N 1.93 5.49 -1.67 3.58 0.01 -1.26 -1.56 113.70 120.22 1x77 s SER 150 Ca 0.10 0.62 -0.11 0.00 1.31 0.00 0.00 55.95 57.88 1x77 s SER 150 Cb -0.22 -1.58 0.11 0.00 0.21 0.00 0.00 66.02 64.53 1x77 s SER 150 CO -0.03 -1.12 0.38 -1.20 0.41 0.00 0.00 173.24 171.69 1x77 n SER 151 N -2.59 -0.84 -0.23 2.44 7.64 -1.02 -4.74 113.62 114.29 1x77 n SER 151 Ca 0.05 -1.19 0.15 0.00 1.01 0.00 0.00 58.87 58.89 1x77 n SER 151 Cb 0.58 -1.97 0.45 0.00 -1.01 0.00 0.00 64.21 62.26 1x77 n SER 151 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x77 h ALA 152 N 0.84 2.02 0.00 -0.43 0.00 -1.52 -1.27 119.26 118.90 1x77 h ALA 152 Ca -0.62 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1x77 h ALA 152 Cb 1.39 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1x77 h ALA 152 CO 0.77 -0.26 0.04 -0.56 0.00 0.00 0.00 179.25 179.25 1x77 h GLN 153 N 0.53 0.00 0.00 0.00 -0.00 -1.82 0.22 115.11 114.04 1x77 h GLN 153 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.08 1x77 h GLN 153 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.35 1x77 h GLN 153 CO -0.17 0.00 -1.45 0.09 -0.00 0.00 0.00 178.83 177.30 1x77 n ASN 154 N -2.45 2.46 0.09 0.06 3.02 -0.54 -4.50 115.26 113.40 1x77 n ASN 154 Ca -0.02 -0.03 0.12 0.00 -0.03 0.00 0.00 54.58 54.62 1x77 n ASN 154 Cb 0.09 1.47 0.45 0.00 -0.61 0.00 0.00 39.78 41.18 1x77 n ASN 154 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x77 n ALA 155 N -1.85 2.01 -2.32 5.41 0.00 0.72 -4.83 120.51 119.65 1x77 n ALA 155 Ca -0.02 0.01 -0.17 0.00 0.00 0.00 0.00 53.44 53.26 1x77 n ALA 155 Cb 0.27 -1.42 -0.10 0.00 0.00 0.00 0.00 19.45 18.20 1x77 n ALA 155 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1x77 s PHE 156 N -3.16 1.53 0.55 0.00 0.40 -0.80 -1.63 117.98 114.87 1x77 s PHE 156 Ca 0.08 -0.81 0.05 0.00 -0.60 0.00 0.00 56.93 55.66 1x77 s PHE 156 Cb 0.12 -0.84 0.04 0.00 0.51 0.00 0.00 43.02 42.85 1x77 s PHE 156 CO 0.49 0.08 0.39 0.16 0.70 0.00 0.00 175.22 177.03 1x77 s ASP 157 N -3.28 4.59 0.22 1.36 3.84 -1.14 -4.91 116.67 117.34 1x77 s ASP 157 Ca 0.24 -1.30 -0.13 0.00 -0.00 0.00 0.00 52.55 51.37 1x77 s ASP 157 Cb 0.04 0.49 0.26 0.00 -1.38 0.00 0.00 42.92 42.33 1x77 s ASP 157 CO 0.06 -1.13 1.62 0.00 -0.00 0.00 0.00 175.17 175.73 1x77 h ALA 158 N 0.75 0.45 -0.24 2.11 0.00 -1.99 -1.08 119.26 119.27 1x77 h ALA 158 Ca -0.37 0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 1x77 h ALA 158 Cb 1.31 0.49 -0.07 0.00 0.00 0.00 0.00 17.79 19.51 1x77 h ALA 158 CO 0.58 -0.42 0.21 0.94 0.00 0.00 0.00 179.25 180.55 1x77 n GLN 159 N -5.43 1.39 -3.97 0.00 0.00 -1.26 -4.88 117.38 103.23 1x77 n GLN 159 Ca 0.08 -0.79 -0.39 0.00 -0.00 0.00 0.00 57.00 55.91 1x77 n GLN 159 Cb 0.34 -1.31 0.02 0.00 0.00 0.00 0.00 30.24 29.29 1x77 n GLN 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1x77 n GLY 160 N 0.80 -1.00 3.10 1.69 0.00 -0.41 -4.99 105.19 104.38 1x77 n GLY 160 Ca 0.15 0.43 -0.28 0.00 0.00 0.00 0.00 46.02 46.32 1x77 n GLY 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x77 s ARG 161 N -6.58 2.29 -0.11 1.61 0.52 -1.26 -4.88 118.95 110.54 1x77 s ARG 161 Ca 0.34 -0.61 -0.30 0.00 -0.52 0.00 0.00 55.73 54.64 1x77 s ARG 161 Cb -0.18 -1.83 -0.03 0.00 0.52 0.00 0.00 34.95 33.43 1x77 s ARG 161 CO 0.94 0.06 1.33 -1.17 0.02 0.00 0.00 175.30 176.49 1x77 s LEU 162 N 0.61 4.24 0.00 2.53 2.96 -1.26 -2.86 118.68 124.90 1x77 s LEU 162 Ca -0.15 1.85 0.17 0.00 -0.22 0.00 0.00 54.13 55.78 1x77 s LEU 162 Cb -0.16 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.80 1x77 s LEU 162 CO 0.05 -0.75 0.68 0.18 -1.32 0.00 0.00 176.35 175.18 1x77 n LEU 163 N 6.27 0.69 -4.64 -0.68 4.77 -0.65 -4.90 117.00 117.87 1x77 n LEU 163 Ca 0.14 0.31 -0.43 0.00 -0.03 0.00 0.00 56.01 56.00 1x77 n LEU 163 Cb 0.45 0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 41.65 1x77 n LEU 163 CO 0.57 0.22 1.13 -0.62 -1.33 0.00 0.00 177.39 177.36 1x77 s ASP 164 N -5.71 6.74 0.37 -1.43 3.68 -1.26 -4.89 116.67 114.18 1x77 s ASP 164 Ca -0.04 1.40 0.05 0.00 2.13 0.00 0.00 52.55 56.09 1x77 s ASP 164 Cb 0.09 -2.54 0.73 0.00 -1.45 0.00 0.00 42.92 39.75 1x77 s ASP 164 CO 0.82 -0.98 2.01 -2.24 0.13 0.00 0.00 175.17 174.90 1x77 h ASP 165 N 9.02 0.64 -0.57 -0.34 2.03 -1.99 -0.19 116.42 125.02 1x77 h ASP 165 Ca -0.27 -0.01 0.04 0.00 -0.73 0.00 0.00 57.03 56.06 1x77 h ASP 165 Cb 1.10 -0.15 -0.04 0.00 -0.83 0.00 0.00 39.33 39.41 1x77 h ASP 165 CO 1.01 0.44 0.33 0.11 -1.03 0.00 0.00 179.24 180.10 1x77 h LYS 166 N 0.74 0.62 0.12 4.15 1.79 -1.98 0.26 116.57 122.26 1x77 h LYS 166 Ca 0.24 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.67 1x77 h LYS 166 Cb 0.04 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.56 1x77 h LYS 166 CO -0.06 0.41 -0.06 0.00 -1.08 0.00 0.00 179.45 178.66 1x77 h ALA 167 N 1.28 -0.16 -0.84 3.86 0.00 -1.61 0.15 119.26 121.95 1x77 h ALA 167 Ca 0.24 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 55.10 1x77 h ALA 167 Cb 0.09 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 1x77 h ALA 167 CO -0.13 -0.43 0.47 0.00 0.00 0.00 0.00 179.25 179.15 1x77 h ARG 168 N -0.47 0.73 -0.25 0.00 3.08 -0.77 -1.03 114.38 115.67 1x77 h ARG 168 Ca -0.02 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.82 1x77 h ARG 168 Cb 0.38 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 1x77 h ARG 168 CO 0.03 0.48 -0.54 1.49 -1.07 0.00 0.00 179.97 180.36 1x77 h GLU 169 N 0.75 0.74 -0.80 0.04 4.81 -0.37 -2.52 114.58 117.24 1x77 h GLU 169 Ca 0.42 -0.46 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1x77 h GLU 169 Cb 0.44 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1x77 h GLU 169 CO -0.28 1.09 0.35 -0.07 -0.73 0.00 0.00 179.01 179.37 1x77 h LEU 170 N 0.57 1.07 -0.34 1.64 3.38 0.21 -0.45 115.31 121.40 1x77 h LEU 170 Ca 0.01 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 1x77 h LEU 170 Cb 1.12 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1x77 h LEU 170 CO 0.11 0.93 -0.08 0.40 0.09 0.00 0.00 178.44 179.89 1x77 h ILE 171 N 1.14 1.28 -0.62 1.22 2.04 -1.20 -0.94 117.51 120.43 1x77 h ILE 171 Ca 0.27 -1.14 0.08 0.00 1.00 0.00 0.00 64.86 65.07 1x77 h ILE 171 Cb 0.17 1.32 -0.06 0.00 -0.74 0.00 0.00 36.82 37.51 1x77 h ILE 171 CO -0.03 0.37 0.29 1.56 0.00 0.00 0.00 178.15 180.35 1x77 h GLN 172 N 0.43 0.52 0.19 2.37 4.20 -1.12 0.12 115.11 121.83 1x77 h GLN 172 Ca 0.09 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.77 1x77 h GLN 172 Cb 0.58 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.22 1x77 h GLN 172 CO 0.03 0.34 -0.25 1.96 -0.67 0.00 0.00 178.83 180.24 1x77 h GLN 173 N 0.53 -0.48 -0.55 1.46 4.20 -0.80 -1.82 115.11 117.65 1x77 h GLN 173 Ca 0.30 0.03 0.05 0.00 0.06 0.00 0.00 58.65 59.09 1x77 h GLN 173 Cb 0.29 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.13 1x77 h GLN 173 CO -0.24 -0.32 0.28 0.37 -0.67 0.00 0.00 178.83 178.24 1x77 h GLN 174 N -0.50 0.52 -0.31 1.46 4.15 -0.54 0.40 115.11 120.29 1x77 h GLN 174 Ca 0.01 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1x77 h GLN 174 Cb 0.49 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 1x77 h GLN 174 CO -0.09 0.34 0.19 -0.07 -1.93 0.00 0.00 178.83 177.27 1x77 h LEU 175 N 0.53 0.36 0.00 -2.39 3.38 -0.54 0.71 115.31 117.36 1x77 h LEU 175 Ca 0.24 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1x77 h LEU 175 Cb 0.16 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1x77 h LEU 175 CO -0.17 0.27 -0.02 1.56 0.09 0.00 0.00 178.44 180.17 1x77 h GLN 176 N 0.42 0.01 -0.52 1.13 4.20 -0.38 -1.07 115.11 118.90 1x77 h GLN 176 Ca 0.11 -0.01 0.15 0.00 0.06 0.00 0.00 58.65 58.96 1x77 h GLN 176 Cb -0.03 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 1x77 h GLN 176 CO -0.02 0.82 0.41 0.00 -0.67 0.00 0.00 178.83 179.37 1x77 h ALA 177 N 0.20 2.39 0.06 3.87 0.00 0.39 0.23 119.26 126.41 1x77 h ALA 177 Ca -0.00 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 1x77 h ALA 177 Cb 0.82 0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.67 1x77 h ALA 177 CO 0.00 -0.68 -0.85 1.25 0.00 0.00 0.00 179.25 178.97 1x77 h LEU 178 N 0.00 0.64 -1.97 0.00 6.46 0.51 -3.23 115.31 117.72 1x77 h LEU 178 Ca 0.24 -0.82 -0.01 0.00 -0.12 0.00 0.00 57.88 57.17 1x77 h LEU 178 Cb 1.07 -0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 40.80 1x77 h LEU 178 CO -0.00 1.39 -0.06 -0.61 -0.62 0.00 0.00 178.44 178.53 1x77 h GLN 179 N -0.03 0.00 0.00 1.25 4.15 0.76 -3.51 115.11 117.73 1x77 h GLN 179 Ca -0.12 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.30 1x77 h GLN 179 Cb 1.58 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.27 1x77 h GLN 179 CO 0.16 0.06 0.00 1.28 -1.93 0.00 0.00 178.83 178.41