#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 4.29 -0.03 0.38 -0.14 -1.26 -1.74 119.74 121.24 1x77 s LYS 8 Ca 0.00 0.55 0.07 0.00 -1.36 0.00 0.00 55.97 55.22 1x77 s LYS 8 Cb 0.00 -3.50 -0.02 0.00 -1.68 0.00 0.00 37.83 32.63 1x77 s LYS 8 CO 0.00 -0.02 -0.23 0.08 -0.76 0.00 0.00 175.35 174.43 1x77 s VAL 9 N 1.17 2.32 -0.27 3.17 1.01 0.49 -0.44 120.40 127.84 1x77 s VAL 9 Ca 0.28 -1.00 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 1x77 s VAL 9 Cb -0.16 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 1x77 s VAL 9 CO 0.11 0.58 0.13 -0.22 0.00 0.00 0.00 175.10 175.70 1x77 s LEU 10 N -0.57 3.73 -0.24 3.92 0.20 -0.17 -0.88 118.68 124.68 1x77 s LEU 10 Ca 0.08 -0.13 -0.12 0.00 0.69 0.00 0.00 54.13 54.65 1x77 s LEU 10 Cb -0.11 -2.02 -0.05 0.00 -0.43 0.00 0.00 46.19 43.59 1x77 s LEU 10 CO 0.00 -0.05 0.24 -0.83 -0.29 0.00 0.00 176.35 175.42 1x77 s GLY 11 N 1.68 2.00 -0.19 7.98 0.00 0.13 0.42 107.32 119.34 1x77 s GLY 11 Ca 0.07 -0.81 0.01 0.00 0.00 0.00 0.00 44.72 43.99 1x77 s GLY 11 CO 0.07 0.56 -0.17 -0.42 0.00 0.00 0.00 173.10 173.14 1x77 s ILE 12 N 1.25 1.98 -0.11 0.90 1.01 -0.02 -1.42 121.20 124.78 1x77 s ILE 12 Ca 0.11 -1.01 -0.11 0.00 0.00 0.00 0.00 60.65 59.64 1x77 s ILE 12 Cb -0.14 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 1x77 s ILE 12 CO 0.06 0.42 0.23 -0.55 0.00 0.00 0.00 174.94 175.10 1x77 s SER 13 N 1.30 6.47 -0.01 3.58 0.15 -1.26 -1.45 113.70 122.48 1x77 s SER 13 Ca 0.02 0.56 0.10 0.00 0.70 0.00 0.00 55.95 57.33 1x77 s SER 13 Cb -0.14 -2.14 0.30 0.00 -1.71 0.00 0.00 66.02 62.33 1x77 s SER 13 CO -0.11 0.29 1.24 0.61 1.20 0.00 0.00 173.24 176.46 1x77 n GLY 14 N 2.49 0.64 3.19 9.45 0.00 -0.72 -4.84 105.19 115.41 1x77 n GLY 14 Ca -0.16 -0.36 -0.28 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.97 2.56 0.00 1.61 0.15 -1.26 -4.18 113.70 111.60 1x77 s SER 15 Ca 0.22 -0.42 0.22 0.00 0.70 0.00 0.00 55.95 56.67 1x77 s SER 15 Cb 0.12 -0.70 -0.13 0.00 -1.71 0.00 0.00 66.02 63.60 1x77 s SER 15 CO 0.15 0.19 0.97 0.18 1.20 0.00 0.00 173.24 175.93 1x77 n LEU 16 N 3.05 1.03 -4.77 3.45 4.77 -1.26 -4.87 117.00 118.40 1x77 n LEU 16 Ca -0.18 -0.47 -0.37 0.00 -0.03 0.00 0.00 56.01 54.97 1x77 n LEU 16 Cb 0.53 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1x77 n LEU 16 CO 0.25 0.25 0.85 0.00 -1.33 0.00 0.00 177.39 177.40 1x77 s ARG 17 N -2.96 3.59 0.37 3.23 1.70 -1.26 -4.92 118.95 118.70 1x77 s ARG 17 Ca 0.09 1.83 0.06 0.00 -0.47 0.00 0.00 55.73 57.24 1x77 s ARG 17 Cb 0.16 -2.32 0.76 0.00 -0.57 0.00 0.00 34.95 32.98 1x77 s ARG 17 CO 0.83 -0.71 1.96 0.66 -1.08 0.00 0.00 175.30 176.96 1x77 h SER 18 N 1.82 0.64 -0.33 -2.89 4.64 -2.08 -2.28 113.55 113.08 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 1.26 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1x77 h SER 18 CO 0.59 0.41 0.00 0.61 -0.87 0.00 0.00 176.83 177.58 1x77 n GLY 19 N -1.45 0.95 2.42 -0.77 0.00 -1.26 -4.98 105.19 100.10 1x77 n GLY 19 Ca 0.11 -0.53 -0.44 0.00 0.00 0.00 0.00 46.02 45.16 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 0.80 0.70 0.18 1.61 2.88 -0.86 -4.80 113.62 114.13 1x77 n SER 20 Ca 0.17 0.77 0.06 0.00 -1.33 0.00 0.00 58.87 58.54 1x77 n SER 20 Cb 0.42 -0.57 0.30 0.00 -0.75 0.00 0.00 64.21 63.60 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 3.10 0.00 -0.02 0.66 0.05 -1.94 0.81 116.97 119.63 1x77 h TYR 21 Ca -0.29 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.29 1x77 h TYR 21 Cb 0.89 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.63 1x77 h TYR 21 CO 0.42 0.37 -0.84 -0.91 -1.05 0.00 0.00 178.16 176.15 1x77 h ASN 22 N 0.00 0.40 0.03 3.88 2.35 -1.88 -0.40 115.58 119.97 1x77 h ASN 22 Ca -0.00 -0.30 -0.00 0.00 -0.55 0.00 0.00 56.30 55.44 1x77 h ASN 22 Cb 0.97 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.22 1x77 h ASN 22 CO 0.05 1.07 -0.01 0.28 -1.65 0.00 0.00 177.43 177.17 1x77 h SER 23 N 0.19 -0.03 -0.61 5.81 0.02 -1.83 -2.93 113.55 114.18 1x77 h SER 23 Ca -0.05 -0.52 0.15 0.00 -0.84 0.00 0.00 61.79 60.53 1x77 h SER 23 Cb 1.45 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.97 1x77 h SER 23 CO 0.14 0.52 0.43 0.00 -1.14 0.00 0.00 176.83 176.77 1x77 h ALA 24 N 0.33 2.36 -0.20 3.77 0.00 -0.79 -1.16 119.26 123.57 1x77 h ALA 24 Ca -0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1x77 h ALA 24 Cb 0.55 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1x77 h ALA 24 CO 0.01 -0.52 -0.18 0.00 0.00 0.00 0.00 179.25 178.55 1x77 h ALA 25 N 1.70 0.29 -0.47 0.00 0.00 -1.02 -2.40 119.26 117.35 1x77 h ALA 25 Ca 0.29 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1x77 h ALA 25 Cb 0.94 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1x77 h ALA 25 CO -0.04 0.20 0.13 -0.07 0.00 0.00 0.00 179.25 179.47 1x77 h LEU 26 N 0.14 0.65 -0.58 0.00 3.38 -1.06 -1.71 115.31 116.12 1x77 h LEU 26 Ca 0.03 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 1x77 h LEU 26 Cb 0.72 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1x77 h LEU 26 CO 0.05 0.63 0.21 -0.61 0.09 0.00 0.00 178.44 178.81 1x77 h GLN 27 N 0.69 0.89 -0.65 1.13 5.75 -1.22 -2.09 115.11 119.61 1x77 h GLN 27 Ca 0.16 -0.17 0.02 0.00 -0.15 0.00 0.00 58.65 58.50 1x77 h GLN 27 Cb 0.23 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 28.60 1x77 h GLN 27 CO -0.01 0.78 0.41 0.93 -2.65 0.00 0.00 178.83 178.29 1x77 h GLU 28 N 0.81 0.80 -0.70 1.69 4.39 -0.90 -0.78 114.58 119.88 1x77 h GLU 28 Ca 0.19 -0.05 0.14 0.00 0.34 0.00 0.00 59.36 59.99 1x77 h GLU 28 Cb 0.24 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.67 1x77 h GLU 28 CO -0.01 0.53 0.47 0.00 -1.16 0.00 0.00 179.01 178.84 1x77 h ALA 29 N 1.27 2.16 -0.42 3.43 0.00 -0.67 0.36 119.26 125.39 1x77 h ALA 29 Ca 0.25 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1x77 h ALA 29 Cb -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1x77 h ALA 29 CO -0.09 -0.34 0.08 0.82 0.00 0.00 0.00 179.25 179.72 1x77 h ILE 30 N 0.36 1.20 0.00 0.00 2.04 -0.65 0.11 117.51 120.56 1x77 h ILE 30 Ca 0.34 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1x77 h ILE 30 Cb 0.83 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1x77 h ILE 30 CO -0.10 0.26 0.00 0.61 0.00 0.00 0.00 178.15 178.93 1x77 n GLY 31 N -0.94 -1.19 0.40 5.37 0.00 0.12 -3.24 105.19 105.71 1x77 n GLY 31 Ca 0.03 -0.13 0.06 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.30 1.75 -4.78 0.99 4.77 0.28 -5.03 117.00 113.68 1x77 n LEU 32 Ca 0.12 -0.93 -0.41 0.00 -0.03 0.00 0.00 56.01 54.77 1x77 n LEU 32 Cb 0.22 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1x77 n LEU 32 CO 0.21 0.33 1.15 0.68 -1.33 0.00 0.00 177.39 178.43 1x77 s VAL 33 N -1.12 2.01 0.69 4.08 -7.23 -0.54 -4.94 120.40 113.35 1x77 s VAL 33 Ca 0.12 0.01 -0.06 0.00 -1.81 0.00 0.00 61.98 60.24 1x77 s VAL 33 Cb 0.09 -3.00 0.06 0.00 0.56 0.00 0.00 36.38 34.09 1x77 s VAL 33 CO 0.19 0.00 0.99 -2.16 -0.31 0.00 0.00 175.10 173.81 1x77 s PRO 34 N -2.08 2.21 0.47 4.82 0.04 -1.26 -4.98 135.00 134.22 1x77 s PRO 34 Ca 0.53 -0.31 -0.24 0.00 0.04 0.00 0.00 61.00 61.02 1x77 s PRO 34 Cb -0.47 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 31.80 1x77 s PRO 34 CO 0.64 -1.20 1.40 -2.14 0.04 0.00 0.00 177.00 175.73 1x77 s PRO 35 N -5.21 3.59 0.00 0.56 0.02 -1.26 -2.69 135.00 130.02 1x77 s PRO 35 Ca 0.60 2.34 0.00 0.00 0.02 0.00 0.00 61.00 63.96 1x77 s PRO 35 Cb -0.11 -2.57 0.00 0.00 0.02 0.00 0.00 34.50 31.84 1x77 s PRO 35 CO 0.44 -0.87 0.00 0.41 -0.33 0.00 0.00 177.00 176.65 1x77 n GLY 36 N 0.62 0.76 2.97 0.52 0.00 -1.26 -5.05 105.19 103.75 1x77 n GLY 36 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.56 0.12 0.01 1.61 0.00 -1.09 -1.65 119.30 117.74 1x77 s MET 37 Ca 0.00 0.18 0.01 0.00 0.00 0.00 0.00 55.69 55.88 1x77 s MET 37 Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 34.83 34.85 1x77 s MET 37 CO 0.00 -0.04 -0.05 -1.54 0.00 0.00 0.00 175.02 173.40 1x77 s SER 38 N 0.21 0.51 -0.18 1.11 1.04 -0.71 -4.60 113.70 111.07 1x77 s SER 38 Ca -0.01 -0.24 -0.02 0.00 0.48 0.00 0.00 55.95 56.16 1x77 s SER 38 Cb -0.02 -0.01 -0.01 0.00 0.10 0.00 0.00 66.02 66.08 1x77 s SER 38 CO -0.01 -0.06 -0.10 -0.63 0.98 0.00 0.00 173.24 173.43 1x77 s ILE 39 N -0.56 3.03 -0.04 -1.02 1.01 -1.26 -0.38 121.20 121.98 1x77 s ILE 39 Ca -0.03 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.01 1x77 s ILE 39 Cb -0.05 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 1x77 s ILE 39 CO -0.00 0.48 -0.10 -0.70 0.00 0.00 0.00 174.94 174.62 1x77 s GLU 40 N 1.09 2.58 -0.39 2.79 2.12 -0.06 -4.96 118.70 121.88 1x77 s GLU 40 Ca 0.00 -0.66 -0.15 0.00 0.36 0.00 0.00 54.97 54.53 1x77 s GLU 40 Cb -0.15 -2.48 0.01 0.00 0.26 0.00 0.00 34.13 31.78 1x77 s GLU 40 CO -0.02 0.63 0.31 -0.51 -0.54 0.00 0.00 175.26 175.13 1x77 s LEU 41 N -0.95 4.90 0.77 2.70 1.43 -1.26 -0.70 118.68 125.56 1x77 s LEU 41 Ca 0.13 -0.72 -0.14 0.00 -1.03 0.00 0.00 54.13 52.37 1x77 s LEU 41 Cb -0.11 -2.20 0.06 0.00 0.03 0.00 0.00 46.19 43.97 1x77 s LEU 41 CO 0.03 -0.41 1.20 0.00 0.23 0.00 0.00 176.35 177.40 1x77 s ALA 42 N 1.77 2.00 -0.22 4.21 0.00 -0.51 -4.95 121.76 124.06 1x77 s ALA 42 Ca 0.07 0.84 0.01 0.00 0.00 0.00 0.00 51.96 52.87 1x77 s ALA 42 Cb -0.18 -3.47 0.05 0.00 0.00 0.00 0.00 23.12 19.52 1x77 s ALA 42 CO 0.11 -2.06 -0.09 0.34 0.00 0.00 0.00 175.76 174.06 1x77 s ASP 43 N -2.15 3.71 0.00 0.00 3.68 -1.26 -4.73 116.67 115.93 1x77 s ASP 43 Ca 0.73 -1.06 0.17 0.00 2.13 0.00 0.00 52.55 54.52 1x77 s ASP 43 Cb -0.28 -1.27 0.06 0.00 -1.45 0.00 0.00 42.92 39.98 1x77 s ASP 43 CO 0.48 -0.18 0.96 2.30 0.13 0.00 0.00 175.17 178.86 1x77 n ILE 44 N 4.64 0.00 -0.13 4.11 -5.35 -1.26 -4.55 119.36 116.82 1x77 n ILE 44 Ca -0.14 -0.41 0.23 0.00 -0.27 0.00 0.00 62.75 62.16 1x77 n ILE 44 Cb 0.45 1.28 0.66 0.00 -1.74 0.00 0.00 39.64 40.28 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 2.59 0.10 0.93 7.28 4.64 -1.96 0.14 113.55 127.28 1x77 h SER 45 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1x77 h SER 45 Cb 0.64 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1x77 h SER 45 CO 0.00 0.05 -0.05 0.61 -0.87 0.00 0.00 176.83 176.57 1x77 n GLY 46 N -1.64 -1.47 3.69 -0.77 0.00 -1.26 -4.83 105.19 98.91 1x77 n GLY 46 Ca 0.15 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1x77 n GLY 46 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x77 s ILE 47 N -2.98 4.00 0.93 -0.61 1.01 0.49 -4.74 121.20 119.30 1x77 s ILE 47 Ca 0.14 1.35 -0.14 0.00 0.00 0.00 0.00 60.65 62.00 1x77 s ILE 47 Cb 0.19 -3.87 0.16 0.00 0.01 0.00 0.00 42.46 38.95 1x77 s ILE 47 CO 0.54 -0.01 1.23 -2.16 0.00 0.00 0.00 174.94 174.55 1x77 s PRO 48 N 2.34 0.95 0.52 2.79 0.04 -1.26 -5.00 135.00 135.38 1x77 s PRO 48 Ca 0.60 -0.11 -0.22 0.00 0.04 0.00 0.00 61.00 61.31 1x77 s PRO 48 Cb -0.28 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 1x77 s PRO 48 CO 0.24 -2.26 1.27 -0.51 0.04 0.00 0.00 177.00 175.78 1x77 s LEU 49 N -5.92 3.88 0.22 -3.56 1.43 -1.26 -4.92 118.68 108.55 1x77 s LEU 49 Ca 0.68 2.55 -0.30 0.00 -1.03 0.00 0.00 54.13 56.04 1x77 s LEU 49 Cb -0.08 -4.31 -0.09 0.00 0.03 0.00 0.00 46.19 41.74 1x77 s LEU 49 CO 0.52 -1.34 1.16 -0.47 0.23 0.00 0.00 176.35 176.45 1x77 s TYR 50 N -1.43 3.47 -0.20 0.29 5.04 -1.26 -5.02 117.35 118.23 1x77 s TYR 50 Ca 0.70 1.52 -0.06 0.00 -2.44 0.00 0.00 57.07 56.79 1x77 s TYR 50 Cb -0.35 -3.39 0.10 0.00 0.35 0.00 0.00 41.96 38.67 1x77 s TYR 50 CO 0.41 -0.99 0.41 1.21 -1.34 0.00 0.00 175.55 175.26 1x77 s ASN 51 N -0.23 -0.19 0.40 4.32 3.84 -1.26 -5.04 114.94 116.78 1x77 s ASN 51 Ca 0.50 0.87 0.12 0.00 0.21 0.00 0.00 52.86 54.56 1x77 s ASN 51 Cb -0.32 1.32 0.94 0.00 -0.55 0.00 0.00 41.25 42.63 1x77 s ASN 51 CO 0.39 -0.24 1.94 -0.08 -2.79 0.00 0.00 177.10 176.31 1x77 h GLU 52 N 8.17 0.51 -0.15 0.43 4.57 -1.99 -1.21 114.58 124.92 1x77 h GLU 52 Ca -0.16 -0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 57.90 1x77 h GLU 52 Cb 1.12 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.58 1x77 h GLU 52 CO 0.14 0.34 -0.30 -0.44 -1.18 0.00 0.00 179.01 177.58 1x77 h ASP 53 N 0.53 0.28 -0.04 1.04 3.32 -2.00 -1.33 116.42 118.23 1x77 h ASP 53 Ca 0.35 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 1x77 h ASP 53 Cb 0.62 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1x77 h ASP 53 CO -0.12 0.58 -0.16 0.58 -1.72 0.00 0.00 179.24 178.40 1x77 h VAL 54 N 0.25 1.48 -0.69 -1.35 2.07 -1.63 -3.25 116.25 113.12 1x77 h VAL 54 Ca 0.04 -1.64 0.04 0.00 0.82 0.00 0.00 66.70 65.96 1x77 h VAL 54 Cb 0.66 2.46 -0.04 0.00 -1.52 0.00 0.00 31.29 32.84 1x77 h VAL 54 CO 0.05 0.45 0.46 0.22 0.02 0.00 0.00 177.57 178.77 1x77 h TYR 55 N -0.41 0.78 -0.13 1.57 3.20 -1.29 -1.52 116.97 119.18 1x77 h TYR 55 Ca -0.01 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.92 1x77 h TYR 55 Cb 0.82 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 1x77 h TYR 55 CO 0.14 0.45 0.14 0.00 -1.64 0.00 0.00 178.16 177.26 1x77 h ALA 56 N 1.60 1.74 -0.58 1.82 0.00 -1.27 0.11 119.26 122.69 1x77 h ALA 56 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1x77 h ALA 56 Cb 0.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1x77 h ALA 56 CO -0.08 -0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.24 1x77 n LEU 57 N -3.84 3.58 0.00 0.00 4.77 -0.57 -5.04 117.00 115.90 1x77 n LEU 57 Ca 0.00 -1.80 0.00 0.00 -0.03 0.00 0.00 56.01 54.18 1x77 n LEU 57 Cb 0.26 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1x77 n LEU 57 CO 0.28 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 177.70 1x77 n GLY 58 N 1.26 2.73 3.74 -0.72 0.00 0.37 -5.04 105.19 107.53 1x77 n GLY 58 Ca 0.21 -1.87 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 1x77 n GLY 58 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x77 s PHE 59 N -2.63 3.30 0.72 1.61 0.08 -1.26 -4.39 117.98 115.41 1x77 s PHE 59 Ca 0.00 1.29 -0.15 0.00 0.12 0.00 0.00 56.93 58.19 1x77 s PHE 59 Cb 0.00 -3.55 0.03 0.00 -0.57 0.00 0.00 43.02 38.93 1x77 s PHE 59 CO 0.00 -1.67 1.20 -2.14 -0.10 0.00 0.00 175.22 172.51 1x77 s PRO 60 N -0.21 2.24 0.20 0.24 0.02 -1.26 -4.71 135.00 131.53 1x77 s PRO 60 Ca 0.55 1.75 -0.11 0.00 0.02 0.00 0.00 61.00 63.21 1x77 s PRO 60 Cb -0.35 -1.85 0.26 0.00 0.02 0.00 0.00 34.50 32.58 1x77 s PRO 60 CO 0.38 -1.76 1.68 -1.35 -0.33 0.00 0.00 177.00 175.63 1x77 h PRO 61 N -0.18 0.16 -0.64 5.54 0.11 -1.96 -0.64 132.00 134.39 1x77 h PRO 61 Ca -0.48 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.73 1x77 h PRO 61 Cb 1.29 -0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.29 1x77 h PRO 61 CO 0.50 0.11 0.23 0.00 -0.21 0.00 0.00 178.00 178.63 1x77 h ALA 62 N 1.49 0.83 -0.66 -0.75 0.00 -1.89 0.33 119.26 118.62 1x77 h ALA 62 Ca 0.30 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.22 1x77 h ALA 62 Cb 0.46 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1x77 h ALA 62 CO -0.45 -0.21 0.09 0.28 0.00 0.00 0.00 179.25 178.96 1x77 h VAL 63 N 0.39 1.26 -0.22 0.00 2.07 -1.68 -0.87 116.25 117.20 1x77 h VAL 63 Ca 0.33 -1.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 1x77 h VAL 63 Cb 0.45 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1x77 h VAL 63 CO -0.35 0.40 0.10 -0.33 0.02 0.00 0.00 177.57 177.41 1x77 h GLU 64 N 1.02 0.33 -0.79 1.57 4.39 0.38 0.49 114.58 121.97 1x77 h GLU 64 Ca 0.20 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.88 1x77 h GLU 64 Cb 0.46 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.01 1x77 h GLU 64 CO 0.02 0.35 0.50 -0.09 -1.16 0.00 0.00 179.01 178.63 1x77 h ARG 65 N 0.22 0.95 0.15 2.33 9.65 -0.21 -2.66 114.38 124.81 1x77 h ARG 65 Ca 0.08 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.89 1x77 h ARG 65 Cb 0.14 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 28.51 1x77 h ARG 65 CO -0.01 0.63 -0.07 0.35 2.80 0.00 0.00 179.97 183.67 1x77 h PHE 66 N 0.98 -0.18 -0.83 2.20 3.57 -0.64 -2.79 116.94 119.25 1x77 h PHE 66 Ca 0.32 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.89 1x77 h PHE 66 Cb 0.01 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.76 1x77 h PHE 66 CO -0.03 -0.00 0.54 0.00 -2.23 0.00 0.00 178.31 176.59 1x77 h ARG 67 N -0.33 0.83 -0.09 1.11 3.08 -0.73 -2.10 114.38 116.15 1x77 h ARG 67 Ca -0.02 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 59.86 1x77 h ARG 67 Cb 0.26 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1x77 h ARG 67 CO 0.03 0.55 -0.48 0.93 -1.07 0.00 0.00 179.97 179.94 1x77 h GLU 68 N 0.86 0.23 -0.56 0.04 4.39 -1.40 -0.59 114.58 117.55 1x77 h GLU 68 Ca 0.37 -0.13 -0.11 0.00 0.34 0.00 0.00 59.36 59.83 1x77 h GLU 68 Cb 0.31 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 1x77 h GLU 68 CO -0.14 0.67 -0.09 1.96 -1.16 0.00 0.00 179.01 180.25 1x77 h GLN 69 N 0.19 1.05 -0.10 2.33 4.20 -1.12 -0.03 115.11 121.64 1x77 h GLN 69 Ca 0.01 -0.38 -0.01 0.00 0.06 0.00 0.00 58.65 58.33 1x77 h GLN 69 Cb 0.92 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.62 1x77 h GLN 69 CO 0.07 1.08 0.02 0.82 -0.67 0.00 0.00 178.83 180.16 1x77 h ILE 70 N 0.94 1.19 -0.89 2.54 2.04 -1.14 -0.40 117.51 121.78 1x77 h ILE 70 Ca 0.15 -0.59 0.10 0.00 1.00 0.00 0.00 64.86 65.51 1x77 h ILE 70 Cb 0.66 1.41 -0.07 0.00 -0.74 0.00 0.00 36.82 38.07 1x77 h ILE 70 CO 0.05 0.17 0.54 -0.09 0.00 0.00 0.00 178.15 178.81 1x77 h ARG 71 N -0.05 0.87 0.03 2.37 2.43 -0.88 -2.76 114.38 116.39 1x77 h ARG 71 Ca 0.03 -0.05 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 1x77 h ARG 71 Cb 0.25 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1x77 h ARG 71 CO 0.00 0.58 -0.98 0.00 -1.51 0.00 0.00 179.97 178.06 1x77 h ALA 72 N 1.48 0.39 -2.85 2.80 0.00 -0.82 -3.46 119.26 116.79 1x77 h ALA 72 Ca 0.43 -0.78 -0.52 0.00 0.00 0.00 0.00 54.91 54.04 1x77 h ALA 72 Cb 0.37 -0.06 0.06 0.00 0.00 0.00 0.00 17.79 18.15 1x77 h ALA 72 CO -0.24 0.97 0.59 0.00 0.00 0.00 0.00 179.25 180.57 1x77 s ALA 73 N -3.02 3.42 -0.05 0.00 0.00 -0.18 -4.94 121.76 117.00 1x77 s ALA 73 Ca -0.03 1.16 0.19 0.00 0.00 0.00 0.00 51.96 53.27 1x77 s ALA 73 Cb 0.09 -3.44 0.41 0.00 0.00 0.00 0.00 23.12 20.18 1x77 s ALA 73 CO 0.84 -0.55 1.60 -0.44 0.00 0.00 0.00 175.76 177.21 1x77 h ASP 74 N 3.33 0.00 -5.11 0.00 5.19 -1.06 -3.47 116.42 115.30 1x77 h ASP 74 Ca -0.49 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 55.87 1x77 h ASP 74 Cb 1.23 0.00 -0.13 0.00 0.18 0.00 0.00 39.33 40.61 1x77 h ASP 74 CO 0.65 0.38 -0.14 0.00 -3.12 0.00 0.00 179.24 177.01 1x77 s ALA 75 N -3.26 -0.72 0.02 3.45 0.00 -1.04 -4.32 121.76 115.89 1x77 s ALA 75 Ca 0.03 -0.25 0.08 0.00 0.00 0.00 0.00 51.96 51.82 1x77 s ALA 75 Cb 0.09 0.68 -0.03 0.00 0.00 0.00 0.00 23.12 23.86 1x77 s ALA 75 CO 0.70 -0.63 -0.23 -0.51 0.00 0.00 0.00 175.76 175.08 1x77 s LEU 76 N -2.84 2.29 -0.23 0.00 1.43 -0.62 -1.00 118.68 117.71 1x77 s LEU 76 Ca 0.05 -0.49 -0.00 0.00 -1.03 0.00 0.00 54.13 52.66 1x77 s LEU 76 Cb 0.02 -1.38 0.06 0.00 0.03 0.00 0.00 46.19 44.93 1x77 s LEU 76 CO -0.10 0.28 -0.02 -0.22 0.23 0.00 0.00 176.35 176.52 1x77 s LEU 77 N -1.09 2.20 -0.16 1.79 2.96 0.17 -1.28 118.68 123.26 1x77 s LEU 77 Ca 0.12 -1.12 -0.10 0.00 -0.22 0.00 0.00 54.13 52.81 1x77 s LEU 77 Cb -0.10 -1.00 -0.05 0.00 0.50 0.00 0.00 46.19 45.54 1x77 s LEU 77 CO 0.02 -0.27 0.16 -0.36 -1.32 0.00 0.00 176.35 174.58 1x77 s PHE 78 N 1.53 3.49 -0.41 5.38 0.08 -0.63 -0.84 117.98 126.57 1x77 s PHE 78 Ca -0.03 0.45 0.03 0.00 0.12 0.00 0.00 56.93 57.49 1x77 s PHE 78 Cb -0.18 -2.11 0.12 0.00 -0.57 0.00 0.00 43.02 40.27 1x77 s PHE 78 CO -0.08 0.44 0.17 0.00 -0.10 0.00 0.00 175.22 175.66 1x77 s ALA 79 N -0.14 2.60 -0.19 5.36 0.00 -0.53 -1.36 121.76 127.52 1x77 s ALA 79 Ca 0.12 -2.63 -0.06 0.00 0.00 0.00 0.00 51.96 49.39 1x77 s ALA 79 Cb -0.12 -1.95 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 1x77 s ALA 79 CO 0.01 -1.88 0.03 -0.08 0.00 0.00 0.00 175.76 173.84 1x77 s THR 80 N 0.53 4.35 0.74 0.00 -1.32 -0.83 -1.75 115.64 117.37 1x77 s THR 80 Ca 0.14 -0.18 -0.12 0.00 -1.21 0.00 0.00 61.69 60.32 1x77 s THR 80 Cb -0.22 -2.96 0.04 0.00 -1.51 0.00 0.00 72.50 67.84 1x77 s THR 80 CO -0.06 0.44 1.13 -2.16 -2.21 0.00 0.00 174.62 171.76 1x77 s PRO 81 N 0.65 2.53 -0.21 7.08 0.04 -1.26 -3.87 135.00 139.96 1x77 s PRO 81 Ca 0.01 0.34 -0.01 0.00 0.04 0.00 0.00 61.00 61.38 1x77 s PRO 81 Cb -0.14 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.42 1x77 s PRO 81 CO 0.02 -1.24 -0.12 -2.00 0.04 0.00 0.00 177.00 173.69 1x77 s GLU 82 N -5.44 3.04 -0.12 4.56 2.12 -1.26 -2.88 118.70 118.72 1x77 s GLU 82 Ca 0.60 -0.82 0.01 0.00 0.36 0.00 0.00 54.97 55.11 1x77 s GLU 82 Cb -0.11 -2.79 -0.01 0.00 0.26 0.00 0.00 34.13 31.48 1x77 s GLU 82 CO 0.51 -0.26 -0.15 0.71 -0.54 0.00 0.00 175.26 175.53 1x77 s TYR 83 N 1.34 2.77 -1.02 5.30 2.02 -0.14 -4.79 117.35 122.83 1x77 s TYR 83 Ca 0.04 -0.69 -0.17 0.00 -0.37 0.00 0.00 57.07 55.87 1x77 s TYR 83 Cb -0.14 -1.82 0.02 0.00 -0.40 0.00 0.00 41.96 39.62 1x77 s TYR 83 CO -0.08 -0.23 0.65 0.09 -1.57 0.00 0.00 175.55 174.40 1x77 n ASN 84 N 3.49 -4.58 -2.54 2.29 3.02 -1.26 -2.41 115.26 113.27 1x77 n ASN 84 Ca -0.18 -1.12 -0.19 0.00 -0.03 0.00 0.00 54.58 53.06 1x77 n ASN 84 Cb 0.53 -1.78 -0.00 0.00 -0.61 0.00 0.00 39.78 37.91 1x77 n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x77 n TYR 85 N -3.83 -1.27 -3.74 3.10 4.19 -1.26 -4.93 117.16 109.42 1x77 n TYR 85 Ca -0.21 0.10 -0.01 0.00 3.31 0.00 0.00 57.90 61.08 1x77 n TYR 85 Cb 0.63 -3.78 0.01 0.00 0.49 0.00 0.00 39.34 36.69 1x77 n TYR 85 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 1x77 n SER 86 N -2.06 -1.04 -4.80 2.98 2.88 -1.01 -4.73 113.62 105.84 1x77 n SER 86 Ca -0.20 -1.52 -0.31 0.00 -1.33 0.00 0.00 58.87 55.51 1x77 n SER 86 Cb 0.66 1.68 0.07 0.00 -0.75 0.00 0.00 64.21 65.87 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 -2.03 2.55 0.26 -1.46 0.23 -1.26 -0.97 119.30 116.61 1x77 s MET 87 Ca 0.15 0.97 -0.31 0.00 -1.03 0.00 0.00 55.69 55.47 1x77 s MET 87 Cb -0.02 -1.94 -0.11 0.00 -1.53 0.00 0.00 34.83 31.23 1x77 s MET 87 CO 0.03 -1.38 1.60 0.00 -2.03 0.00 0.00 175.02 173.24 1x77 s ALA 88 N -3.01 3.78 0.45 3.16 0.00 -1.14 -4.45 121.76 120.55 1x77 s ALA 88 Ca 0.60 1.52 0.14 0.00 0.00 0.00 0.00 51.96 54.22 1x77 s ALA 88 Cb -0.15 -3.64 1.07 0.00 0.00 0.00 0.00 23.12 20.40 1x77 s ALA 88 CO 0.55 -0.92 2.03 0.78 0.00 0.00 0.00 175.76 178.20 1x77 h GLY 89 N 5.49 0.41 0.87 0.00 0.00 -1.92 -2.12 103.07 105.79 1x77 h GLY 89 Ca -0.46 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 1x77 h GLY 89 CO 0.84 0.10 0.04 -2.08 0.00 0.00 0.00 176.54 175.44 1x77 h VAL 90 N 0.33 1.14 -0.40 4.60 2.07 -1.90 -1.61 116.25 120.48 1x77 h VAL 90 Ca 0.20 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1x77 h VAL 90 Cb 0.36 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1x77 h VAL 90 CO -0.04 0.13 0.18 0.25 0.02 0.00 0.00 177.57 178.11 1x77 h LEU 91 N -0.00 0.53 -1.20 2.57 5.85 -1.59 -2.32 115.31 119.15 1x77 h LEU 91 Ca 0.03 -0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.66 1x77 h LEU 91 Cb 0.17 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 1x77 h LEU 91 CO -0.00 0.52 0.55 0.50 -0.34 0.00 0.00 178.44 179.67 1x77 h LYS 92 N 0.51 0.98 -0.63 1.25 1.63 -1.31 -1.27 116.57 117.72 1x77 h LYS 92 Ca 0.14 -0.06 -0.09 0.00 -0.85 0.00 0.00 60.65 59.79 1x77 h LYS 92 Cb 0.14 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.52 1x77 h LYS 92 CO -0.02 0.65 0.03 -0.97 -3.45 0.00 0.00 179.45 175.69 1x77 h ASN 93 N 1.01 1.05 -0.65 4.20 -1.24 -0.87 0.15 115.58 119.22 1x77 h ASN 93 Ca 0.35 -0.28 -0.07 0.00 0.71 0.00 0.00 56.30 57.01 1x77 h ASN 93 Cb 0.10 -0.28 -0.03 0.00 0.73 0.00 0.00 38.32 38.84 1x77 h ASN 93 CO -0.11 1.08 0.15 0.00 -1.29 0.00 0.00 177.43 177.26 1x77 h ALA 94 N 1.03 0.86 -0.65 1.57 0.00 -0.87 -0.68 119.26 120.53 1x77 h ALA 94 Ca 0.18 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1x77 h ALA 94 Cb 0.52 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1x77 h ALA 94 CO 0.03 0.59 0.09 0.82 0.00 0.00 0.00 179.25 180.78 1x77 h ILE 95 N 0.98 1.26 -0.20 0.00 2.04 -0.90 -0.38 117.51 120.31 1x77 h ILE 95 Ca 0.20 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.02 1x77 h ILE 95 Cb 0.38 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1x77 h ILE 95 CO 0.00 0.39 0.12 0.44 0.00 0.00 0.00 178.15 179.10 1x77 h ASP 96 N 1.00 0.25 0.04 1.72 3.32 -0.13 -0.93 116.42 121.69 1x77 h ASP 96 Ca 0.20 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1x77 h ASP 96 Cb 0.45 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1x77 h ASP 96 CO 0.01 0.24 -0.02 -0.50 -1.72 0.00 0.00 179.24 177.25 1x77 h TRP 97 N 0.24 -0.05 0.00 4.55 4.06 -0.91 -2.92 115.95 120.92 1x77 h TRP 97 Ca 0.07 -0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.01 1x77 h TRP 97 Cb 0.04 0.02 -0.00 0.00 -1.00 0.00 0.00 29.16 28.21 1x77 h TRP 97 CO -0.05 0.02 -0.04 0.00 -3.56 0.00 0.00 178.44 174.81 1x77 h ALA 98 N 0.85 1.36 -0.00 1.49 0.00 -0.93 -3.03 119.26 118.99 1x77 h ALA 98 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1x77 h ALA 98 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1x77 h ALA 98 CO 0.01 0.05 -0.07 -1.13 0.00 0.00 0.00 179.25 178.12 1x77 n SER 99 N -3.65 0.22 -4.78 0.00 3.41 -0.37 -4.38 113.62 104.07 1x77 n SER 99 Ca -0.02 -0.30 -0.35 0.00 -0.26 0.00 0.00 58.87 57.94 1x77 n SER 99 Cb 0.14 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 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 -2.57 3.37 0.76 4.33 1.81 -1.15 -4.63 118.95 120.87 1x77 s ARG 100 Ca 0.27 1.53 -0.11 0.00 -1.72 0.00 0.00 55.73 55.70 1x77 s ARG 100 Cb 0.20 -2.02 0.05 0.00 -0.45 0.00 0.00 34.95 32.73 1x77 s ARG 100 CO 0.48 -0.82 1.08 -1.25 -0.68 0.00 0.00 175.30 174.11 1x77 s PRO 101 N -3.40 2.39 0.02 3.54 0.04 -1.26 -3.83 135.00 132.49 1x77 s PRO 101 Ca 0.71 0.76 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 1x77 s PRO 101 Cb -0.22 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1x77 s PRO 101 CO 0.28 -1.43 1.00 -1.25 0.04 0.00 0.00 177.00 175.64 1x77 s PRO 102 N -5.11 4.55 -0.83 0.56 0.04 -1.26 -4.94 135.00 128.01 1x77 s PRO 102 Ca 0.60 1.46 -0.03 0.00 0.04 0.00 0.00 61.00 63.07 1x77 s PRO 102 Cb -0.14 -3.44 -0.00 0.00 0.04 0.00 0.00 34.50 30.96 1x77 s PRO 102 CO 0.55 -0.06 0.67 -1.91 0.04 0.00 0.00 177.00 176.28 1x77 n GLU 103 N 3.82 -1.41 -1.75 4.56 2.13 -1.26 -4.88 120.64 121.86 1x77 n GLU 103 Ca 0.06 1.02 -0.42 0.00 0.66 0.00 0.00 57.16 58.48 1x77 n GLU 103 Cb 0.50 -3.90 -0.03 0.00 0.27 0.00 0.00 31.44 28.28 1x77 n GLU 103 CO 0.00 0.00 0.00 1.14 -0.41 0.00 0.00 177.13 177.86 1x77 s GLN 104 N -4.30 4.13 0.12 5.31 1.03 -1.25 -4.89 119.66 119.82 1x77 s GLN 104 Ca 0.06 2.59 0.09 0.00 0.04 0.00 0.00 55.36 58.13 1x77 s GLN 104 Cb -0.02 -3.08 0.46 0.00 0.03 0.00 0.00 33.01 30.40 1x77 s GLN 104 CO 0.83 -0.74 1.26 -0.35 -2.54 0.00 0.00 175.29 173.76 1x77 n PRO 105 N 3.98 0.05 0.14 9.60 -0.04 -1.26 -3.32 135.00 144.16 1x77 n PRO 105 Ca 0.16 0.54 0.01 0.00 -0.04 0.00 0.00 63.50 64.17 1x77 n PRO 105 Cb 0.35 -1.67 0.32 0.00 -0.04 0.00 0.00 33.50 32.47 1x77 n PRO 105 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1x77 h PHE 106 N 0.00 0.16 -1.22 0.54 0.04 -1.87 -3.40 116.94 111.19 1x77 h PHE 106 Ca 0.00 -0.03 -0.72 0.00 2.80 0.00 0.00 57.97 60.02 1x77 h PHE 106 Cb 0.01 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 38.12 1x77 h PHE 106 CO 0.00 0.45 1.14 0.45 -0.60 0.00 0.00 178.31 179.75 1x77 n SER 107 N -4.13 2.14 0.00 2.17 2.88 -1.19 -2.25 113.62 113.25 1x77 n SER 107 Ca -0.01 0.80 0.00 0.00 -1.33 0.00 0.00 58.87 58.32 1x77 n SER 107 Cb 0.39 -1.16 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 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 5.41 2.88 3.76 0.46 0.00 0.16 -5.00 105.19 112.87 1x77 n GLY 108 Ca 0.35 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.91 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 0.00 4.16 0.24 1.61 3.01 -0.95 -4.61 119.74 123.19 1x77 s LYS 109 Ca 0.00 2.51 -0.14 0.00 -1.01 0.00 0.00 55.97 57.33 1x77 s LYS 109 Cb 0.00 -3.02 -0.08 0.00 -1.01 0.00 0.00 37.83 33.73 1x77 s LYS 109 CO 0.00 -0.52 0.64 -1.25 0.51 0.00 0.00 175.35 174.72 1x77 s PRO 110 N -1.27 3.98 0.04 -1.68 0.04 -1.26 -1.17 135.00 133.67 1x77 s PRO 110 Ca 0.57 0.54 -0.13 0.00 0.04 0.00 0.00 61.00 62.02 1x77 s PRO 110 Cb -0.46 -2.68 0.02 0.00 0.04 0.00 0.00 34.50 31.42 1x77 s PRO 110 CO 0.54 0.31 0.29 0.00 0.04 0.00 0.00 177.00 178.19 1x77 s ALA 111 N -1.74 -0.65 0.12 8.56 0.00 -0.48 -1.59 121.76 125.97 1x77 s ALA 111 Ca 0.47 0.01 0.10 0.00 0.00 0.00 0.00 51.96 52.53 1x77 s ALA 111 Cb -0.13 0.29 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 1x77 s ALA 111 CO 0.19 -0.39 -0.24 0.00 0.00 0.00 0.00 175.76 175.32 1x77 s ALA 112 N -2.41 2.13 0.07 0.00 0.00 -0.41 -1.21 121.76 119.94 1x77 s ALA 112 Ca -0.06 -1.37 0.09 0.00 0.00 0.00 0.00 51.96 50.62 1x77 s ALA 112 Cb -0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.75 1x77 s ALA 112 CO -0.03 0.46 -0.22 0.42 0.00 0.00 0.00 175.76 176.39 1x77 s ILE 113 N -1.10 2.49 0.06 0.00 -1.09 -1.26 -1.61 121.20 118.70 1x77 s ILE 113 Ca 0.11 -1.42 -0.18 0.00 -2.23 0.00 0.00 60.65 56.93 1x77 s ILE 113 Cb -0.10 -2.06 0.04 0.00 -1.58 0.00 0.00 42.46 38.76 1x77 s ILE 113 CO 0.05 0.26 0.41 -1.48 -1.23 0.00 0.00 174.94 172.95 1x77 s LEU 114 N -1.62 0.41 -0.10 2.97 0.05 -0.46 -4.22 118.68 115.71 1x77 s LEU 114 Ca 0.14 -0.07 -0.09 0.00 0.05 0.00 0.00 54.13 54.16 1x77 s LEU 114 Cb -0.10 1.76 0.03 0.00 -2.05 0.00 0.00 46.19 45.82 1x77 s LEU 114 CO 0.05 -0.70 0.26 -0.83 -0.55 0.00 0.00 176.35 174.58 1x77 s GLY 115 N -2.18 -0.20 -0.12 -3.48 0.00 -0.74 -1.97 107.32 98.63 1x77 s GLY 115 Ca -0.03 0.78 -0.01 0.00 0.00 0.00 0.00 44.72 45.46 1x77 s GLY 115 CO -0.04 0.71 -0.10 0.00 0.00 0.00 0.00 173.10 173.66 1x77 s ALA 116 N 0.25 2.74 0.01 3.20 0.00 -1.25 -1.13 121.76 125.58 1x77 s ALA 116 Ca -0.01 -0.88 -0.16 0.00 0.00 0.00 0.00 51.96 50.92 1x77 s ALA 116 Cb -0.03 -1.27 0.03 0.00 0.00 0.00 0.00 23.12 21.85 1x77 s ALA 116 CO -0.01 0.30 0.34 -1.54 0.00 0.00 0.00 175.76 174.85 1x77 s SER 117 N 0.16 -0.20 0.37 0.00 1.04 -0.44 -4.46 113.70 110.17 1x77 s SER 117 Ca -0.06 0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.37 1x77 s SER 117 Cb -0.15 0.35 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 1x77 s SER 117 CO 0.04 -0.54 0.59 0.00 0.98 0.00 0.00 173.24 174.32 1x77 s ALA 118 N -1.88 3.64 0.00 5.32 0.00 -1.26 -1.19 121.76 126.39 1x77 s ALA 118 Ca -0.10 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.04 1x77 s ALA 118 Cb -0.03 -2.21 0.00 0.00 0.00 0.00 0.00 23.12 20.89 1x77 s ALA 118 CO 0.01 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.10 1x77 n GLY 119 N -1.86 -0.38 0.00 0.00 0.00 -1.26 -4.58 105.19 97.11 1x77 n GLY 119 Ca -0.04 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1x77 n GLY 119 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1x77 n ARG 120 N 0.00 0.00 0.00 1.61 3.00 -1.26 -3.13 116.66 116.88 1x77 n ARG 120 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1x77 n ARG 120 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 32.46 32.22 1x77 n ARG 120 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1x77 n PHE 121 N 0.00 0.00 0.00 -0.14 3.72 -1.26 -4.78 117.46 115.00 1x77 n PHE 121 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1x77 n PHE 121 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1x77 n PHE 121 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1x77 n GLY 122 N 5.00 4.85 4.89 1.37 0.00 -1.26 -4.71 105.19 115.32 1x77 n GLY 122 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.81 0.00 -0.28 2.61 -2.24 -1.26 -4.74 114.28 106.56 1x77 n THR 123 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1x77 n THR 123 Cb 0.00 0.00 0.29 0.00 -2.10 0.00 0.00 70.33 68.52 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 1.61 0.03 6.98 0.00 -1.96 0.79 119.26 126.70 1x77 h ALA 124 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1x77 h ALA 124 Cb 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.58 1x77 h ALA 124 CO 0.00 0.22 -0.24 0.00 0.00 0.00 0.00 179.25 179.23 1x77 h ARG 125 N 0.91 0.11 -0.60 0.00 -0.00 -1.91 -2.90 114.38 109.98 1x77 h ARG 125 Ca 0.40 -0.16 0.08 0.00 -0.50 0.00 0.00 59.98 59.81 1x77 h ARG 125 Cb 0.35 0.05 -0.07 0.00 0.00 0.00 0.00 29.97 30.31 1x77 h ARG 125 CO -0.16 1.01 0.25 0.00 0.00 0.00 0.00 179.97 181.06 1x77 h ALA 126 N 0.11 0.78 -0.65 0.04 0.00 -1.67 0.52 119.26 118.38 1x77 h ALA 126 Ca -0.04 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1x77 h ALA 126 Cb 1.12 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1x77 h ALA 126 CO 0.05 -0.16 0.33 1.96 0.00 0.00 0.00 179.25 181.43 1x77 h GLN 127 N 0.44 0.91 0.20 0.00 4.20 0.50 0.27 115.11 121.64 1x77 h GLN 127 Ca 0.30 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.89 1x77 h GLN 127 Cb 0.33 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1x77 h GLN 127 CO -0.28 0.69 -0.10 -0.92 -0.67 0.00 0.00 178.83 177.56 1x77 h TYR 128 N 0.92 -0.25 -0.73 2.96 5.03 -0.97 0.75 116.97 124.67 1x77 h TYR 128 Ca 0.23 -0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.57 1x77 h TYR 128 Cb 0.07 0.08 -0.05 0.00 1.55 0.00 0.00 36.73 38.38 1x77 h TYR 128 CO 0.01 0.07 0.45 0.45 -1.32 0.00 0.00 178.16 177.82 1x77 h HIS 129 N -0.60 0.83 -0.30 -3.82 3.86 -0.67 -0.07 115.15 114.38 1x77 h HIS 129 Ca -0.03 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1x77 h HIS 129 Cb 0.44 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 1x77 h HIS 129 CO 0.03 0.45 0.14 1.25 0.86 0.00 0.00 177.93 180.66 1x77 h LEU 130 N 0.85 0.40 -0.61 2.43 5.85 -0.41 0.11 115.31 123.93 1x77 h LEU 130 Ca 0.31 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.96 1x77 h LEU 130 Cb 0.08 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1x77 h LEU 130 CO -0.14 0.41 0.32 -0.09 -0.34 0.00 0.00 178.44 178.61 1x77 h ARG 131 N 0.35 0.58 0.61 1.25 2.43 -0.26 0.36 114.38 119.71 1x77 h ARG 131 Ca 0.10 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1x77 h ARG 131 Cb 0.12 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1x77 h ARG 131 CO -0.01 0.38 -0.29 0.37 -1.51 0.00 0.00 179.97 178.91 1x77 h GLN 132 N 0.60 -0.79 -0.99 0.20 4.15 -0.61 -1.67 115.11 115.99 1x77 h GLN 132 Ca 0.27 0.05 0.15 0.00 0.77 0.00 0.00 58.65 59.89 1x77 h GLN 132 Cb 0.19 0.18 -0.09 0.00 0.21 0.00 0.00 27.48 27.97 1x77 h GLN 132 CO -0.19 -0.49 0.62 1.15 -1.93 0.00 0.00 178.83 178.00 1x77 h THR 133 N -0.98 0.84 -0.32 2.39 2.02 -0.55 -0.72 112.91 115.60 1x77 h THR 133 Ca -0.08 -0.30 -0.13 0.00 0.77 0.00 0.00 66.41 66.67 1x77 h THR 133 Cb 0.68 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1x77 h THR 133 CO 0.14 0.16 -0.32 -0.07 0.37 0.00 0.00 175.52 175.79 1x77 h LEU 134 N 0.88 0.72 -0.85 2.58 3.38 -0.80 -2.57 115.31 118.66 1x77 h LEU 134 Ca 0.51 -0.29 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 1x77 h LEU 134 Cb 0.65 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1x77 h LEU 134 CO -0.29 0.99 0.00 0.58 0.09 0.00 0.00 178.44 179.81 1x77 h VAL 135 N 0.58 1.25 -0.03 1.22 2.07 -0.35 -0.41 116.25 120.59 1x77 h VAL 135 Ca 0.06 -1.04 0.01 0.00 0.82 0.00 0.00 66.70 66.55 1x77 h VAL 135 Cb 0.84 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1x77 h VAL 135 CO 0.07 0.37 0.04 0.15 0.02 0.00 0.00 177.57 178.22 1x77 h PHE 136 N 0.80 0.00 -0.69 1.57 3.57 -0.77 0.23 116.94 121.65 1x77 h PHE 136 Ca 0.15 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.65 1x77 h PHE 136 Cb 0.48 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.22 1x77 h PHE 136 CO 0.03 0.00 0.00 1.28 -2.23 0.00 0.00 178.31 177.39 1x77 n LEU 137 N -3.64 4.10 -2.63 0.59 4.77 -0.54 -4.95 117.00 114.71 1x77 n LEU 137 Ca -0.02 -2.12 -0.13 0.00 -0.03 0.00 0.00 56.01 53.71 1x77 n LEU 137 Cb 0.12 -0.50 0.06 0.00 -2.33 0.00 0.00 43.42 40.78 1x77 n LEU 137 CO 0.25 0.93 0.10 0.47 -1.33 0.00 0.00 177.39 177.81 1x77 n ASP 138 N 1.42 -2.84 -4.93 -1.43 9.92 0.80 -3.16 116.55 116.34 1x77 n ASP 138 Ca 0.24 -0.40 -0.29 0.00 -0.53 0.00 0.00 54.79 53.81 1x77 n ASP 138 Cb 0.68 -3.61 -0.04 0.00 -0.64 0.00 0.00 41.12 37.51 1x77 n ASP 138 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1x77 s VAL 139 N -3.24 5.33 -0.63 2.53 1.01 -0.28 0.40 120.40 125.53 1x77 s VAL 139 Ca 0.11 -0.47 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 1x77 s VAL 139 Cb -0.05 -3.68 0.16 0.00 0.00 0.00 0.00 36.38 32.81 1x77 s VAL 139 CO 0.49 0.01 0.45 -1.00 0.00 0.00 0.00 175.10 175.06 1x77 s HIS 140 N -1.64 3.44 0.26 5.22 0.09 -0.32 -4.36 115.29 117.98 1x77 s HIS 140 Ca 0.36 -2.64 -0.21 0.00 -0.00 0.00 0.00 55.06 52.57 1x77 s HIS 140 Cb -0.12 -3.24 -0.09 0.00 -0.00 0.00 0.00 32.58 29.13 1x77 s HIS 140 CO 0.28 -0.86 0.78 -1.25 -0.00 0.00 0.00 174.74 173.69 1x77 s PRO 141 N 0.03 4.29 0.33 8.40 0.04 -1.26 -1.39 135.00 145.45 1x77 s PRO 141 Ca 0.16 0.95 -0.27 0.00 0.04 0.00 0.00 61.00 61.89 1x77 s PRO 141 Cb -0.20 -2.80 -0.09 0.00 0.04 0.00 0.00 34.50 31.45 1x77 s PRO 141 CO -0.04 0.33 1.04 -0.51 0.04 0.00 0.00 177.00 177.87 1x77 s LEU 142 N -2.12 4.37 -0.03 -3.56 1.02 -0.35 -4.91 118.68 113.09 1x77 s LEU 142 Ca 0.46 2.09 -0.03 0.00 0.02 0.00 0.00 54.13 56.67 1x77 s LEU 142 Cb -0.16 -3.90 -0.27 0.00 0.02 0.00 0.00 46.19 41.87 1x77 s LEU 142 CO 0.21 -0.25 0.72 0.78 0.02 0.00 0.00 176.35 177.83 1x77 h ASN 143 N 3.23 0.39 -4.32 2.29 -0.26 -1.96 -3.44 115.58 111.52 1x77 h ASN 143 Ca -0.47 -0.62 -0.59 0.00 -0.56 0.00 0.00 56.30 54.05 1x77 h ASN 143 Cb 1.21 -0.13 -0.27 0.00 -1.06 0.00 0.00 38.32 38.07 1x77 h ASN 143 CO 0.65 1.53 -0.85 -0.54 -1.06 0.00 0.00 177.43 177.16 1x77 s LYS 144 N -2.60 1.49 0.48 0.81 -0.14 -1.26 -4.28 119.74 114.25 1x77 s LYS 144 Ca -0.12 -0.91 -0.02 0.00 -1.36 0.00 0.00 55.97 53.57 1x77 s LYS 144 Cb 0.07 -1.57 -0.00 0.00 -1.68 0.00 0.00 37.83 34.65 1x77 s LYS 144 CO 0.84 0.41 0.73 -1.25 -0.76 0.00 0.00 175.35 175.31 1x77 s PRO 145 N -1.02 3.08 -0.06 -1.68 0.04 -1.26 -4.98 135.00 129.12 1x77 s PRO 145 Ca 0.08 -0.31 -0.26 0.00 0.04 0.00 0.00 61.00 60.54 1x77 s PRO 145 Cb -0.09 -2.48 -0.03 0.00 0.04 0.00 0.00 34.50 31.95 1x77 s PRO 145 CO 0.01 -0.35 0.84 -1.21 0.04 0.00 0.00 177.00 176.33 1x77 s GLU 146 N -4.67 4.46 -0.34 4.56 0.41 -1.26 -4.93 118.70 116.93 1x77 s GLU 146 Ca 0.49 1.13 0.03 0.00 -0.41 0.00 0.00 54.97 56.22 1x77 s GLU 146 Cb -0.10 -3.48 0.10 0.00 -1.78 0.00 0.00 34.13 28.87 1x77 s GLU 146 CO 0.40 -0.07 0.05 0.08 -0.49 0.00 0.00 175.26 175.23 1x77 s VAL 147 N 1.19 2.34 -0.19 2.63 1.01 -1.26 -5.06 120.40 121.05 1x77 s VAL 147 Ca 0.43 -2.29 0.01 0.00 0.00 0.00 0.00 61.98 60.14 1x77 s VAL 147 Cb -0.19 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.52 1x77 s VAL 147 CO 0.21 -0.57 -0.16 -0.04 0.00 0.00 0.00 175.10 174.53 1x77 s MET 148 N 0.93 2.65 -0.63 2.72 -1.94 -1.26 -1.80 119.30 119.96 1x77 s MET 148 Ca 0.10 -0.90 -0.16 0.00 -1.71 0.00 0.00 55.69 53.02 1x77 s MET 148 Cb -0.19 -2.55 0.16 0.00 2.01 0.00 0.00 34.83 34.25 1x77 s MET 148 CO -0.08 -0.31 0.60 0.42 -0.01 0.00 0.00 175.02 175.64 1x77 s ILE 149 N 1.29 5.31 0.60 2.53 1.01 -0.28 -5.00 121.20 126.66 1x77 s ILE 149 Ca 0.02 -1.77 -0.02 0.00 0.00 0.00 0.00 60.65 58.88 1x77 s ILE 149 Cb -0.15 -4.39 0.04 0.00 0.01 0.00 0.00 42.46 37.97 1x77 s ILE 149 CO -0.11 -0.94 0.86 -0.55 0.00 0.00 0.00 174.94 174.20 1x77 s SER 150 N 3.17 5.19 -1.47 3.58 0.15 -1.26 -1.33 113.70 121.73 1x77 s SER 150 Ca 0.08 0.21 -0.14 0.00 0.70 0.00 0.00 55.95 56.80 1x77 s SER 150 Cb -0.23 -1.06 0.12 0.00 -1.71 0.00 0.00 66.02 63.14 1x77 s SER 150 CO -0.01 -1.26 0.64 -1.20 1.20 0.00 0.00 173.24 172.61 1x77 n SER 151 N -2.53 -3.35 -0.33 5.45 7.64 -0.89 -4.71 113.62 114.90 1x77 n SER 151 Ca 0.07 -0.70 0.23 0.00 1.01 0.00 0.00 58.87 59.48 1x77 n SER 151 Cb 0.60 -2.77 0.51 0.00 -1.01 0.00 0.00 64.21 61.54 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 0.94 2.24 -0.12 -0.43 0.00 -1.31 0.69 119.26 121.28 1x77 h ALA 152 Ca -0.50 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.51 1x77 h ALA 152 Cb 1.33 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 1x77 h ALA 152 CO 0.65 -0.66 0.14 -0.56 0.00 0.00 0.00 179.25 178.83 1x77 h GLN 153 N 0.38 0.00 0.00 0.00 -0.00 -1.87 -1.18 115.11 112.44 1x77 h GLN 153 Ca 0.61 0.00 -0.22 0.00 -0.00 0.00 0.00 58.65 59.04 1x77 h GLN 153 Cb 1.55 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 28.99 1x77 h GLN 153 CO -0.31 0.00 -2.14 0.09 -0.00 0.00 0.00 178.83 176.47 1x77 n ASN 154 N -3.76 0.47 0.22 0.06 3.02 0.15 -4.41 115.26 111.01 1x77 n ASN 154 Ca 0.00 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.62 1x77 n ASN 154 Cb 0.25 1.28 0.52 0.00 -0.61 0.00 0.00 39.78 41.23 1x77 n ASN 154 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x77 h ALA 155 N 1.22 1.47 -3.86 5.41 0.00 -0.27 -3.43 119.26 119.79 1x77 h ALA 155 Ca -0.33 -0.20 -0.68 0.00 0.00 0.00 0.00 54.91 53.70 1x77 h ALA 155 Cb 1.71 -0.04 -0.20 0.00 0.00 0.00 0.00 17.79 19.26 1x77 h ALA 155 CO 0.02 0.28 -0.78 -0.06 0.00 0.00 0.00 179.25 178.70 1x77 s PHE 156 N -4.35 2.63 0.55 0.00 0.40 -0.79 -1.01 117.98 115.42 1x77 s PHE 156 Ca -0.03 -0.21 0.08 0.00 -0.60 0.00 0.00 56.93 56.17 1x77 s PHE 156 Cb 0.14 -1.48 0.07 0.00 0.51 0.00 0.00 43.02 42.26 1x77 s PHE 156 CO 0.67 0.29 0.65 0.16 0.70 0.00 0.00 175.22 177.69 1x77 s ASP 157 N -1.53 4.97 0.25 1.36 1.47 -1.03 -4.89 116.67 117.28 1x77 s ASP 157 Ca 0.16 -0.96 -0.31 0.00 1.18 0.00 0.00 52.55 52.62 1x77 s ASP 157 Cb -0.11 0.28 -0.14 0.00 -0.34 0.00 0.00 42.92 42.62 1x77 s ASP 157 CO 0.07 -1.23 1.28 0.00 0.68 0.00 0.00 175.17 175.97 1x77 n ALA 158 N -2.06 0.54 -3.61 2.11 0.00 -1.26 -2.80 120.51 113.44 1x77 n ALA 158 Ca 0.09 0.41 -0.23 0.00 0.00 0.00 0.00 53.44 53.72 1x77 n ALA 158 Cb 0.62 -2.18 0.04 0.00 0.00 0.00 0.00 19.45 17.93 1x77 n ALA 158 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1x77 n GLN 159 N 1.58 -3.31 0.00 0.00 1.13 -1.26 -4.78 117.38 110.73 1x77 n GLN 159 Ca 0.11 0.61 0.00 0.00 -1.94 0.00 0.00 57.00 55.79 1x77 n GLN 159 Cb 0.31 -4.98 0.00 0.00 0.11 0.00 0.00 30.24 25.68 1x77 n GLN 159 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1x77 n GLY 160 N -1.55 0.03 2.29 1.08 0.00 -1.12 -5.07 105.19 100.84 1x77 n GLY 160 Ca -0.20 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.63 1x77 n GLY 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x77 n ARG 161 N 4.11 -4.28 -2.65 1.61 1.74 -1.26 -2.45 116.66 113.48 1x77 n ARG 161 Ca 0.00 3.09 -0.42 0.00 -0.77 0.00 0.00 57.85 59.75 1x77 n ARG 161 Cb 0.00 -3.95 -0.03 0.00 -1.02 0.00 0.00 32.46 27.46 1x77 n ARG 161 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1x77 s LEU 162 N -0.49 3.58 0.40 0.55 2.96 -1.26 -3.14 118.68 121.27 1x77 s LEU 162 Ca 0.00 -0.27 0.15 0.00 -0.22 0.00 0.00 54.13 53.78 1x77 s LEU 162 Cb 0.00 -2.83 0.82 0.00 0.50 0.00 0.00 46.19 44.68 1x77 s LEU 162 CO 0.00 -1.54 1.86 -0.07 -1.32 0.00 0.00 176.35 175.28 1x77 h LEU 163 N 12.03 0.00 -8.75 -0.68 4.07 -1.40 -3.42 115.31 117.16 1x77 h LEU 163 Ca -0.27 0.00 -0.56 0.00 0.08 0.00 0.00 57.88 57.13 1x77 h LEU 163 Cb 1.06 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.75 1x77 h LEU 163 CO 1.20 0.32 1.09 -0.62 -1.08 0.00 0.00 178.44 179.35 1x77 s ASP 164 N -6.83 6.26 0.49 -0.43 2.15 -1.24 -4.90 116.67 112.17 1x77 s ASP 164 Ca -0.03 0.73 0.15 0.00 0.43 0.00 0.00 52.55 53.83 1x77 s ASP 164 Cb 0.14 -2.54 1.16 0.00 -0.30 0.00 0.00 42.92 41.38 1x77 s ASP 164 CO 0.71 -1.51 2.10 0.44 -0.17 0.00 0.00 175.17 176.73 1x77 h ASP 165 N 10.93 0.04 0.40 -0.34 3.45 -1.97 -3.03 116.42 125.90 1x77 h ASP 165 Ca -0.28 -0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.17 1x77 h ASP 165 Cb 1.11 -0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 39.86 1x77 h ASP 165 CO 1.10 0.08 -0.26 0.50 -1.57 0.00 0.00 179.24 179.09 1x77 h LYS 166 N 0.04 -0.62 -0.18 3.56 3.64 -1.97 -2.30 116.57 118.75 1x77 h LYS 166 Ca 0.01 0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1x77 h LYS 166 Cb 0.09 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1x77 h LYS 166 CO 0.00 -0.41 0.12 0.00 -2.27 0.00 0.00 179.45 176.89 1x77 h ALA 167 N -0.09 1.97 0.02 5.00 0.00 -1.92 -2.31 119.26 121.93 1x77 h ALA 167 Ca -0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1x77 h ALA 167 Cb 0.54 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1x77 h ALA 167 CO 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 179.25 179.27 1x77 h ARG 168 N 0.16 -0.03 -0.64 0.00 3.08 -1.32 -1.86 114.38 113.78 1x77 h ARG 168 Ca 0.07 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.23 1x77 h ARG 168 Cb 0.10 0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.08 1x77 h ARG 168 CO -0.01 0.02 0.25 0.93 -1.07 0.00 0.00 179.97 180.08 1x77 h GLU 169 N -0.07 0.41 -0.35 0.04 5.08 -1.00 -1.78 114.58 116.91 1x77 h GLU 169 Ca -0.00 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1x77 h GLU 169 Cb 0.06 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1x77 h GLU 169 CO 0.00 0.27 0.17 -0.07 -1.00 0.00 0.00 179.01 178.39 1x77 h LEU 170 N 0.43 0.45 -0.03 1.33 3.38 -1.35 0.72 115.31 120.24 1x77 h LEU 170 Ca 0.33 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.20 1x77 h LEU 170 Cb 0.42 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1x77 h LEU 170 CO -0.32 0.45 -0.16 0.40 0.09 0.00 0.00 178.44 178.89 1x77 h ILE 171 N 0.43 0.60 -0.13 1.22 1.08 -0.85 0.68 117.51 120.54 1x77 h ILE 171 Ca 0.12 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.64 1x77 h ILE 171 Cb 0.11 0.60 -0.06 0.00 -3.07 0.00 0.00 36.82 34.40 1x77 h ILE 171 CO -0.02 0.00 -0.35 1.56 -0.69 0.00 0.00 178.15 178.66 1x77 h GLN 172 N -0.25 -0.41 -0.61 2.37 4.20 -1.09 0.48 115.11 119.80 1x77 h GLN 172 Ca 0.06 0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.84 1x77 h GLN 172 Cb 0.34 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.16 1x77 h GLN 172 CO -0.17 -0.27 0.34 1.96 -0.67 0.00 0.00 178.83 180.02 1x77 h GLN 173 N -0.42 0.63 -0.61 1.46 4.20 -0.43 0.59 115.11 120.53 1x77 h GLN 173 Ca 0.09 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 1x77 h GLN 173 Cb 0.57 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 1x77 h GLN 173 CO -0.36 0.42 0.29 0.37 -0.67 0.00 0.00 178.83 178.87 1x77 h GLN 174 N 0.65 0.88 -0.23 1.46 4.15 0.12 0.62 115.11 122.77 1x77 h GLN 174 Ca 0.26 -0.13 -0.09 0.00 0.77 0.00 0.00 58.65 59.46 1x77 h GLN 174 Cb 0.12 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 1x77 h GLN 174 CO -0.15 0.72 -0.25 -0.07 -1.93 0.00 0.00 178.83 177.15 1x77 h LEU 175 N 0.84 0.44 -0.15 -2.39 3.38 0.57 -1.11 115.31 116.88 1x77 h LEU 175 Ca 0.21 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1x77 h LEU 175 Cb 0.13 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1x77 h LEU 175 CO -0.02 0.69 -0.27 -0.61 0.09 0.00 0.00 178.44 178.32 1x77 h GLN 176 N 0.39 0.45 -0.57 1.13 4.15 -0.39 -2.19 115.11 118.08 1x77 h GLN 176 Ca 0.06 -0.28 0.01 0.00 0.77 0.00 0.00 58.65 59.21 1x77 h GLN 176 Cb 0.65 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 1x77 h GLN 176 CO 0.05 0.88 0.38 0.00 -1.93 0.00 0.00 178.83 178.20 1x77 h ALA 177 N 0.57 0.73 -0.61 3.38 0.00 -0.77 -2.47 119.26 120.08 1x77 h ALA 177 Ca 0.01 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1x77 h ALA 177 Cb 0.85 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.36 1x77 h ALA 177 CO 0.06 0.16 0.31 1.25 0.00 0.00 0.00 179.25 181.03 1x77 h LEU 178 N 0.77 0.44 -1.09 0.00 6.46 -1.17 -1.04 115.31 119.68 1x77 h LEU 178 Ca 0.21 0.04 0.04 0.00 -0.12 0.00 0.00 57.88 58.06 1x77 h LEU 178 Cb -0.08 -0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 39.75 1x77 h LEU 178 CO -0.05 0.28 0.62 -0.61 -0.62 0.00 0.00 178.44 178.06 1x77 h GLN 179 N 0.58 1.12 0.00 1.25 4.15 -0.95 -3.51 115.11 117.75 1x77 h GLN 179 Ca 0.28 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.64 1x77 h GLN 179 Cb 0.22 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.66 1x77 h GLN 179 CO -0.20 0.74 0.00 1.28 -1.93 0.00 0.00 178.83 178.72