#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x77 n TRP 4 N 0.00 0.78 0.42 0.00 -0.00 -1.26 -4.85 117.44 112.53 2x77 n TRP 4 Ca 0.00 0.62 0.07 0.00 -0.00 0.00 0.00 57.50 58.19 2x77 n TRP 4 Cb 0.00 -2.17 0.31 0.00 -0.00 0.00 0.00 31.31 29.44 2x77 n TRP 4 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 2x77 n LEU 5 N 0.92 0.11 -4.11 5.87 4.32 -1.26 -4.71 117.00 118.15 2x77 n LEU 5 Ca 0.10 0.53 -0.11 0.00 -0.02 0.00 0.00 56.01 56.51 2x77 n LEU 5 Cb 0.37 -0.52 -0.11 0.00 -1.62 0.00 0.00 43.42 41.54 2x77 n LEU 5 CO 0.57 -0.34 -0.39 0.00 -1.22 0.00 0.00 177.39 176.02 2x77 s ALA 6 N -3.06 0.71 1.11 -1.18 0.00 -1.26 -5.16 121.76 112.92 2x77 s ALA 6 Ca 0.06 -1.08 -0.17 0.00 0.00 0.00 0.00 51.96 50.77 2x77 s ALA 6 Cb 0.08 0.14 0.24 0.00 0.00 0.00 0.00 23.12 23.58 2x77 s ALA 6 CO 0.25 -0.18 1.13 -1.54 0.00 0.00 0.00 175.76 175.42 2x77 s SER 7 N -2.42 1.76 0.14 0.00 1.04 -1.26 -4.89 113.70 108.07 2x77 s SER 7 Ca 0.02 0.76 -0.11 0.00 0.48 0.00 0.00 55.95 57.09 2x77 s SER 7 Cb -0.01 -1.12 -0.05 0.00 0.10 0.00 0.00 66.02 64.95 2x77 s SER 7 CO -0.03 -3.62 1.46 0.25 0.98 0.00 0.00 173.24 172.28 2x77 h LEU 8 N -2.23 0.99 -0.62 2.42 5.85 -1.95 -2.47 115.31 117.29 2x77 h LEU 8 Ca -0.48 -0.47 -0.12 0.00 0.84 0.00 0.00 57.88 57.65 2x77 h LEU 8 Cb 1.30 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 2x77 h LEU 8 CO 0.43 1.26 -0.23 0.11 -0.34 0.00 0.00 178.44 179.67 2x77 h LYS 9 N 0.74 0.84 -0.07 1.25 1.57 -1.93 0.45 116.57 119.42 2x77 h LYS 9 Ca 0.06 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2x77 h LYS 9 Cb 0.99 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.27 2x77 h LYS 9 CO 0.10 0.98 0.05 1.96 -0.57 0.00 0.00 179.45 181.97 2x77 h GLN 10 N 0.73 0.10 0.08 3.15 4.20 -1.93 0.38 115.11 121.80 2x77 h GLN 10 Ca 0.10 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.81 2x77 h GLN 10 Cb 0.77 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.48 2x77 h GLN 10 CO 0.06 0.09 -0.49 1.15 -0.67 0.00 0.00 178.83 178.98 2x77 h THR 11 N 0.08 0.00 0.00 -0.54 2.02 -1.09 -0.74 112.91 112.64 2x77 h THR 11 Ca 0.03 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 2x77 h THR 11 Cb 0.01 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.42 2x77 h THR 11 CO -0.01 0.00 -0.07 -0.07 0.37 0.00 0.00 175.52 175.74 2x77 h LEU 12 N -0.67 0.00 -1.97 2.58 4.07 -0.91 -1.36 115.31 117.06 2x77 h LEU 12 Ca -0.00 0.00 0.13 0.00 0.08 0.00 0.00 57.88 58.09 2x77 h LEU 12 Cb 0.68 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.40 2x77 h LEU 12 CO -0.28 0.07 0.46 1.23 -1.08 0.00 0.00 178.44 178.84 2x77 h GLY 13 N 0.97 0.00 1.99 0.83 0.00 0.13 -2.64 103.07 104.34 2x77 h GLY 13 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2x77 h GLY 13 CO 0.01 0.00 -0.21 1.41 0.00 0.00 0.00 176.54 177.75 2x77 h LEU 14 N 0.00 0.00 -9.97 3.11 3.38 -1.08 -3.45 115.31 107.29 2x77 h LEU 14 Ca 0.21 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.65 2x77 h LEU 14 Cb 1.13 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.97 2x77 h LEU 14 CO -0.00 0.20 0.61 -0.76 0.09 0.00 0.00 178.44 178.57 2x77 s LEU 15 N -6.30 4.12 -0.28 1.67 1.43 -1.00 -4.84 118.68 113.48 2x77 s LEU 15 Ca 0.06 2.66 -0.38 0.00 -1.03 0.00 0.00 54.13 55.44 2x77 s LEU 15 Cb 0.06 -4.00 -0.14 0.00 0.03 0.00 0.00 46.19 42.14 2x77 s LEU 15 CO 0.70 -1.01 1.93 -2.65 0.23 0.00 0.00 176.35 175.55 2x77 n PRO 16 N -0.16 1.26 0.31 1.29 -0.02 -1.26 -4.68 135.00 131.74 2x77 n PRO 16 Ca 0.05 0.43 0.07 0.00 -2.02 0.00 0.00 63.50 62.03 2x77 n PRO 16 Cb 0.44 -2.29 0.38 0.00 -0.02 0.00 0.00 33.50 32.02 2x77 n PRO 16 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x77 h ALA 17 N 9.29 1.63 -3.05 3.55 0.00 -1.88 -3.09 119.26 125.71 2x77 h ALA 17 Ca -0.39 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.28 2x77 h ALA 17 Cb 1.31 0.00 -0.33 0.00 0.00 0.00 0.00 17.79 18.78 2x77 h ALA 17 CO 0.98 -0.63 -0.57 0.34 0.00 0.00 0.00 179.25 179.38 2x77 s ASP 18 N -3.63 0.25 0.00 0.00 -1.08 -1.26 -4.66 116.67 106.30 2x77 s ASP 18 Ca -0.02 0.44 0.00 0.00 -0.52 0.00 0.00 52.55 52.45 2x77 s ASP 18 Cb 0.04 0.40 0.00 0.00 -1.46 0.00 0.00 42.92 41.90 2x77 s ASP 18 CO 0.13 -0.21 0.00 0.54 0.52 0.00 0.00 175.17 176.15 2x77 n ARG 19 N 4.88 0.00 -1.67 4.34 1.74 -1.17 -5.13 116.66 119.64 2x77 n ARG 19 Ca -0.14 0.00 -0.56 0.00 -0.77 0.00 0.00 57.85 56.38 2x77 n ARG 19 Cb 0.51 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.88 2x77 n ARG 19 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2x77 n LYS 20 N 0.00 1.16 -4.00 5.56 5.02 -1.26 -4.90 118.16 119.74 2x77 n LYS 20 Ca 0.00 0.42 -0.35 0.00 -2.02 0.00 0.00 58.31 56.36 2x77 n LYS 20 Cb 0.00 -2.09 -0.13 0.00 -0.02 0.00 0.00 35.03 32.79 2x77 n LYS 20 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2x77 s ILE 21 N 2.56 3.88 -0.29 -0.18 -1.09 -0.62 -5.00 121.20 120.45 2x77 s ILE 21 Ca 0.94 -0.33 -0.05 0.00 -2.23 0.00 0.00 60.65 58.98 2x77 s ILE 21 Cb -1.03 -2.77 0.02 0.00 -1.58 0.00 0.00 42.46 37.11 2x77 s ILE 21 CO 0.59 0.41 0.04 -0.60 -1.23 0.00 0.00 174.94 174.16 2x77 s ARG 22 N 1.19 2.89 -0.17 2.79 3.52 -1.26 0.40 118.95 128.30 2x77 s ARG 22 Ca 0.03 -0.98 -0.00 0.00 -0.13 0.00 0.00 55.73 54.65 2x77 s ARG 22 Cb -0.15 -3.27 0.00 0.00 -1.56 0.00 0.00 34.95 29.98 2x77 s ARG 22 CO 0.01 -0.49 -0.15 0.08 -0.81 0.00 0.00 175.30 173.95 2x77 s VAL 23 N 1.42 2.63 -0.27 7.11 1.01 0.45 -0.94 120.40 131.80 2x77 s VAL 23 Ca 0.01 -0.77 -0.15 0.00 0.00 0.00 0.00 61.98 61.07 2x77 s VAL 23 Cb -0.18 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 2x77 s VAL 23 CO 0.00 0.51 0.36 -0.76 0.00 0.00 0.00 175.10 175.21 2x77 s LEU 24 N 1.04 4.04 -0.33 3.92 1.43 -0.76 -0.77 118.68 127.26 2x77 s LEU 24 Ca -0.01 0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 53.31 2x77 s LEU 24 Cb -0.15 -2.40 0.05 0.00 0.03 0.00 0.00 46.19 43.72 2x77 s LEU 24 CO -0.04 -0.18 0.07 -0.32 0.23 0.00 0.00 176.35 176.12 2x77 s MET 25 N 2.05 2.48 0.18 1.70 -2.45 0.03 -0.67 119.30 122.63 2x77 s MET 25 Ca 0.14 -1.28 0.06 0.00 -1.25 0.00 0.00 55.69 53.36 2x77 s MET 25 Cb -0.16 -3.36 -0.05 0.00 1.25 0.00 0.00 34.83 32.51 2x77 s MET 25 CO 0.10 -0.69 -0.11 -0.51 1.05 0.00 0.00 175.02 174.86 2x77 s LEU 26 N 1.32 2.51 0.00 4.11 1.43 -0.70 -3.87 118.68 123.48 2x77 s LEU 26 Ca -0.02 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.04 2x77 s LEU 26 Cb -0.20 -0.47 0.00 0.00 0.03 0.00 0.00 46.19 45.55 2x77 s LEU 26 CO 0.01 -0.29 0.00 0.61 0.23 0.00 0.00 176.35 176.91 2x77 n GLY 27 N -0.30 -2.27 3.77 -3.19 0.00 -1.25 -1.21 105.19 100.74 2x77 n GLY 27 Ca -0.09 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.40 2x77 n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x77 s LEU 28 N 0.00 3.26 0.66 0.99 1.43 -1.26 -1.29 118.68 122.48 2x77 s LEU 28 Ca 0.00 1.93 -0.17 0.00 -1.03 0.00 0.00 54.13 54.86 2x77 s LEU 28 Cb 0.00 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.67 2x77 s LEU 28 CO 0.00 -1.76 1.04 -0.90 0.23 0.00 0.00 176.35 174.96 2x77 n ASP 29 N -2.81 0.94 0.00 2.29 5.75 -1.26 -2.23 116.55 119.24 2x77 n ASP 29 Ca 0.10 0.75 0.00 0.00 -0.01 0.00 0.00 54.79 55.63 2x77 n ASP 29 Cb 0.52 -1.44 0.00 0.00 -1.03 0.00 0.00 41.12 39.18 2x77 n ASP 29 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2x77 n ASN 30 N -1.44 -3.14 0.08 -1.12 5.15 -1.26 -4.89 115.26 108.64 2x77 n ASN 30 Ca 0.14 0.00 -0.09 0.00 -0.60 0.00 0.00 54.58 54.03 2x77 n ASN 30 Cb 0.48 -1.47 -0.01 0.00 -0.53 0.00 0.00 39.78 38.25 2x77 n ASN 30 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2x77 h ALA 31 N 0.00 0.51 0.00 5.20 0.00 -1.78 -3.44 119.26 119.75 2x77 h ALA 31 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2x77 h ALA 31 Cb 0.29 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2x77 h ALA 31 CO 0.00 0.93 0.00 0.41 0.00 0.00 0.00 179.25 180.59 2x77 n GLY 32 N 0.90 1.98 0.15 0.00 0.00 -1.26 -4.22 105.19 102.74 2x77 n GLY 32 Ca -0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.80 2x77 n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x77 h LYS 33 N 0.00 0.45 -0.82 1.61 1.57 -1.92 -2.50 116.57 114.96 2x77 h LYS 33 Ca 0.00 -0.51 0.02 0.00 -1.87 0.00 0.00 60.65 58.28 2x77 h LYS 33 Cb 0.00 0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 2x77 h LYS 33 CO 0.00 1.16 0.54 1.15 -0.57 0.00 0.00 179.45 181.74 2x77 h THR 34 N -0.05 1.19 -0.31 -0.16 2.02 -1.97 -1.75 112.91 111.88 2x77 h THR 34 Ca -0.10 -0.37 -0.08 0.00 0.77 0.00 0.00 66.41 66.63 2x77 h THR 34 Cb 1.44 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2x77 h THR 34 CO 0.14 0.20 -0.14 0.28 0.37 0.00 0.00 175.52 176.37 2x77 h SER 35 N 1.09 0.52 -0.06 4.18 0.02 -1.96 -2.31 113.55 115.02 2x77 h SER 35 Ca 0.31 -0.14 -0.05 0.00 -0.84 0.00 0.00 61.79 61.07 2x77 h SER 35 Cb -0.08 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.32 2x77 h SER 35 CO -0.07 0.69 -0.14 0.40 -1.14 0.00 0.00 176.83 176.57 2x77 h ILE 36 N 0.49 1.43 -0.56 3.27 2.04 -1.11 0.22 117.51 123.29 2x77 h ILE 36 Ca 0.09 -1.48 0.08 0.00 1.00 0.00 0.00 64.86 64.55 2x77 h ILE 36 Cb 0.54 2.25 -0.10 0.00 -0.74 0.00 0.00 36.82 38.77 2x77 h ILE 36 CO 0.03 0.41 -0.46 -0.07 0.00 0.00 0.00 178.15 178.07 2x77 h LEU 37 N -0.30 -1.58 -0.34 1.44 3.38 -1.28 -0.06 115.31 116.57 2x77 h LEU 37 Ca -0.00 0.25 0.05 0.00 0.09 0.00 0.00 57.88 58.26 2x77 h LEU 37 Cb 0.74 0.70 -0.04 0.00 0.09 0.00 0.00 40.66 42.15 2x77 h LEU 37 CO 0.03 -0.34 0.09 0.22 0.09 0.00 0.00 178.44 178.52 2x77 h TYR 38 N -0.25 0.15 0.00 1.13 3.20 -1.39 -2.78 116.97 117.02 2x77 h TYR 38 Ca 0.16 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2x77 h TYR 38 Cb 0.56 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.82 2x77 h TYR 38 CO -0.72 0.04 0.00 -0.09 -1.64 0.00 0.00 178.16 175.75 2x77 h ARG 39 N 0.21 0.00 0.00 1.82 9.65 0.63 -2.08 114.38 124.62 2x77 h ARG 39 Ca 0.16 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.04 2x77 h ARG 39 Cb 0.16 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.74 2x77 h ARG 39 CO -0.19 0.00 0.00 -0.07 2.80 0.00 0.00 179.97 182.51 2x77 h LEU 40 N 0.00 0.00 -1.48 3.80 3.38 -0.76 -3.47 115.31 116.78 2x77 h LEU 40 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 2x77 h LEU 40 Cb 0.04 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 2x77 h LEU 40 CO 0.00 0.00 -0.82 1.41 0.09 0.00 0.00 178.44 179.12 2x77 n HIS 41 N -2.97 -1.94 0.67 1.13 8.25 -0.78 -4.90 115.22 114.68 2x77 n HIS 41 Ca 0.02 0.83 0.08 0.00 -0.26 0.00 0.00 57.72 58.39 2x77 n HIS 41 Cb 0.38 -3.91 0.01 0.00 1.12 0.00 0.00 29.99 27.58 2x77 n HIS 41 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2x77 n LEU 42 N -4.45 1.68 0.00 2.41 4.32 -1.26 -5.07 117.00 114.63 2x77 n LEU 42 Ca -0.15 -0.80 0.00 0.00 -0.02 0.00 0.00 56.01 55.04 2x77 n LEU 42 Cb 0.61 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.41 2x77 n LEU 42 CO 0.75 0.32 0.00 0.61 -1.22 0.00 0.00 177.39 177.84 2x77 n GLY 43 N 1.08 0.79 3.94 -0.72 0.00 -1.26 -4.80 105.19 104.22 2x77 n GLY 43 Ca 0.07 -1.90 -0.26 0.00 0.00 0.00 0.00 46.02 43.93 2x77 n GLY 43 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2x77 s ASP 44 N -1.16 6.36 -0.09 1.61 1.47 -1.26 -4.96 116.67 118.64 2x77 s ASP 44 Ca 0.00 0.32 -0.29 0.00 1.18 0.00 0.00 52.55 53.76 2x77 s ASP 44 Cb 0.00 -1.98 -0.02 0.00 -0.34 0.00 0.00 42.92 40.59 2x77 s ASP 44 CO 0.00 -0.06 0.97 -0.69 0.68 0.00 0.00 175.17 176.08 2x77 s VAL 45 N -1.91 4.82 -0.35 2.11 1.01 -1.26 -4.70 120.40 120.12 2x77 s VAL 45 Ca 0.37 1.98 -0.15 0.00 0.00 0.00 0.00 61.98 64.18 2x77 s VAL 45 Cb -0.11 -4.29 -0.01 0.00 0.00 0.00 0.00 36.38 31.98 2x77 s VAL 45 CO 0.30 0.04 0.37 -0.69 0.00 0.00 0.00 175.10 175.12 2x77 s VAL 46 N 1.82 5.16 0.33 2.92 1.01 -0.47 -4.92 120.40 126.25 2x77 s VAL 46 Ca 0.48 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 62.28 2x77 s VAL 46 Cb -0.19 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.26 2x77 s VAL 46 CO 0.19 -0.12 0.83 -0.89 0.00 0.00 0.00 175.10 175.11 2x77 s THR 47 N 2.03 4.48 0.00 3.92 2.01 -1.26 -1.03 115.64 125.80 2x77 s THR 47 Ca 0.12 1.34 0.00 0.00 0.31 0.00 0.00 61.69 63.46 2x77 s THR 47 Cb -0.17 -3.75 0.00 0.00 0.01 0.00 0.00 72.50 68.60 2x77 s THR 47 CO 0.12 -0.06 0.00 0.41 -0.69 0.00 0.00 174.62 174.40 2x77 n THR 48 N 0.01 0.00 -4.37 -0.82 -1.04 -1.26 -4.98 114.28 101.82 2x77 n THR 48 Ca 0.03 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.81 2x77 n THR 48 Cb 0.52 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.92 2x77 n THR 48 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2x77 s ASN 55 N 0.00 2.90 -0.02 8.00 4.22 -1.26 -4.85 114.94 123.93 2x77 s ASN 55 Ca 0.00 -0.91 0.02 0.00 -2.14 0.00 0.00 52.86 49.83 2x77 s ASN 55 Cb 0.00 -0.19 0.00 0.00 1.28 0.00 0.00 41.25 42.35 2x77 s ASN 55 CO 0.00 -0.02 -0.06 -0.22 -2.04 0.00 0.00 177.10 174.76 2x77 s LEU 56 N -2.89 1.76 -0.07 3.54 1.98 -1.26 -4.63 118.68 117.11 2x77 s LEU 56 Ca 0.20 -0.13 0.03 0.00 -2.89 0.00 0.00 54.13 51.34 2x77 s LEU 56 Cb -0.05 -0.39 -0.02 0.00 0.66 0.00 0.00 46.19 46.38 2x77 s LEU 56 CO 0.08 0.04 -0.15 -1.61 -1.89 0.00 0.00 176.35 172.82 2x77 s GLU 57 N 0.22 2.68 -0.01 1.98 2.02 -0.96 -4.11 118.70 120.52 2x77 s GLU 57 Ca -0.03 -0.71 0.03 0.00 0.02 0.00 0.00 54.97 54.28 2x77 s GLU 57 Cb -0.07 -2.41 -0.00 0.00 0.10 0.00 0.00 34.13 31.75 2x77 s GLU 57 CO -0.00 0.52 -0.09 0.99 0.02 0.00 0.00 175.26 176.70 2x77 s THR 58 N -0.47 0.75 -0.16 3.63 2.01 -0.20 -0.61 115.64 120.59 2x77 s THR 58 Ca 0.06 -0.39 -0.00 0.00 0.31 0.00 0.00 61.69 61.67 2x77 s THR 58 Cb -0.12 -0.65 0.04 0.00 0.01 0.00 0.00 72.50 71.78 2x77 s THR 58 CO 0.02 0.22 -0.06 -0.22 -0.69 0.00 0.00 174.62 173.89 2x77 s LEU 59 N -0.08 1.59 -0.20 4.42 2.96 0.03 -1.36 118.68 126.03 2x77 s LEU 59 Ca 0.01 -0.62 -0.08 0.00 -0.22 0.00 0.00 54.13 53.22 2x77 s LEU 59 Cb -0.05 -0.93 -0.04 0.00 0.50 0.00 0.00 46.19 45.67 2x77 s LEU 59 CO -0.00 -0.17 0.09 -1.10 -1.32 0.00 0.00 176.35 173.85 2x77 s GLN 60 N 1.63 3.99 -0.09 1.98 -1.52 -1.26 -0.31 119.66 124.07 2x77 s GLN 60 Ca 0.01 -0.33 -0.01 0.00 -1.95 0.00 0.00 55.36 53.08 2x77 s GLN 60 Cb -0.15 -3.32 0.03 0.00 -0.22 0.00 0.00 33.01 29.35 2x77 s GLN 60 CO -0.08 0.18 -0.00 -0.47 -0.25 0.00 0.00 175.29 174.68 2x77 s TYR 61 N 0.64 0.80 0.00 0.91 5.04 0.14 -4.85 117.35 120.03 2x77 s TYR 61 Ca 0.05 -0.32 0.00 0.00 -2.44 0.00 0.00 57.07 54.36 2x77 s TYR 61 Cb -0.13 -0.88 0.00 0.00 0.35 0.00 0.00 41.96 41.31 2x77 s TYR 61 CO 0.01 -0.39 0.00 1.63 -1.34 0.00 0.00 175.55 175.46 2x77 n LYS 62 N 5.11 0.00 0.00 4.97 4.76 -1.26 0.34 118.16 132.09 2x77 n LYS 62 Ca -0.08 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.50 2x77 n LYS 62 Cb 0.50 0.00 0.52 0.00 -1.84 0.00 0.00 35.03 34.20 2x77 n LYS 62 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2x77 n ASN 63 N 4.43 0.21 -4.65 4.39 3.02 -1.26 -4.89 115.26 116.51 2x77 n ASN 63 Ca 0.00 0.11 -0.35 0.00 -0.03 0.00 0.00 54.58 54.31 2x77 n ASN 63 Cb 0.00 -0.21 -0.09 0.00 -0.61 0.00 0.00 39.78 38.86 2x77 n ASN 63 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2x77 s ILE 64 N -2.91 4.86 -0.11 2.41 -1.09 0.15 -1.59 121.20 122.92 2x77 s ILE 64 Ca 0.16 -0.01 -0.01 0.00 -2.23 0.00 0.00 60.65 58.56 2x77 s ILE 64 Cb 0.19 -3.19 -0.03 0.00 -1.58 0.00 0.00 42.46 37.85 2x77 s ILE 64 CO 0.57 0.46 -0.06 -0.55 -1.23 0.00 0.00 174.94 174.14 2x77 s SER 65 N 0.32 4.69 -0.23 3.58 0.15 0.16 0.26 113.70 122.64 2x77 s SER 65 Ca 0.04 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.62 2x77 s SER 65 Cb -0.12 -1.45 0.03 0.00 -1.71 0.00 0.00 66.02 62.77 2x77 s SER 65 CO -0.00 0.28 -0.12 -0.36 1.20 0.00 0.00 173.24 174.24 2x77 s PHE 66 N -0.29 3.02 -0.09 3.44 0.08 0.57 -0.41 117.98 124.29 2x77 s PHE 66 Ca 0.04 -1.76 0.02 0.00 0.12 0.00 0.00 56.93 55.36 2x77 s PHE 66 Cb -0.13 -1.98 -0.02 0.00 -0.57 0.00 0.00 43.02 40.33 2x77 s PHE 66 CO 0.02 -0.79 -0.16 -1.21 -0.10 0.00 0.00 175.22 172.98 2x77 s GLU 67 N 1.26 2.92 -0.10 0.44 2.02 0.05 -0.79 118.70 124.51 2x77 s GLU 67 Ca -0.00 -0.74 0.02 0.00 0.02 0.00 0.00 54.97 54.27 2x77 s GLU 67 Cb -0.16 -2.44 0.01 0.00 0.10 0.00 0.00 34.13 31.64 2x77 s GLU 67 CO -0.07 0.38 -0.15 0.08 0.02 0.00 0.00 175.26 175.51 2x77 s VAL 68 N -0.11 1.46 0.21 2.63 1.01 0.22 -0.79 120.40 125.03 2x77 s VAL 68 Ca -0.03 -0.64 -0.00 0.00 0.00 0.00 0.00 61.98 61.31 2x77 s VAL 68 Cb -0.14 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2x77 s VAL 68 CO 0.04 0.43 0.10 -1.66 0.00 0.00 0.00 175.10 174.01 2x77 s TRP 69 N 0.82 1.25 0.20 5.22 -2.14 -1.25 -2.27 118.94 120.77 2x77 s TRP 69 Ca -0.10 -1.28 -0.09 0.00 2.66 0.00 0.00 56.10 57.29 2x77 s TRP 69 Cb -0.16 -0.67 -0.07 0.00 -3.10 0.00 0.00 33.47 29.48 2x77 s TRP 69 CO 0.01 -0.50 0.51 -0.51 -2.66 0.00 0.00 176.95 173.81 2x77 s ASP 70 N -3.20 6.62 0.20 -2.66 1.01 -1.26 -3.77 116.67 113.60 2x77 s ASP 70 Ca 0.36 0.87 0.08 0.00 0.71 0.00 0.00 52.55 54.57 2x77 s ASP 70 Cb 0.07 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.76 2x77 s ASP 70 CO 0.11 -0.03 -0.03 -0.76 0.21 0.00 0.00 175.17 174.67 2x77 s LEU 71 N -2.70 3.18 -1.12 1.23 1.43 -0.41 -4.68 118.68 115.61 2x77 s LEU 71 Ca 0.45 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 2x77 s LEU 71 Cb -0.12 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.30 2x77 s LEU 71 CO 0.21 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.48 2x77 n GLY 72 N -0.25 0.90 0.11 -3.19 0.00 -1.26 -4.16 105.19 97.33 2x77 n GLY 72 Ca -0.09 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.24 2x77 n GLY 72 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2x77 h GLY 73 N 0.00 0.23 0.00 -0.02 0.00 -1.98 -3.50 103.07 97.80 2x77 h GLY 73 Ca -0.24 -0.60 0.00 0.00 0.00 0.00 0.00 47.33 46.49 2x77 h GLY 73 CO 0.33 0.52 0.00 0.00 0.00 0.00 0.00 176.54 177.39 2x77 h TYR 84 N 0.00 0.00 -0.00 0.00 3.20 -2.06 -2.95 116.97 115.15 2x77 h TYR 84 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2x77 h TYR 84 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2x77 h TYR 84 CO 0.00 0.00 -0.14 1.19 -1.64 0.00 0.00 178.16 177.57 2x77 n PHE 85 N -2.31 0.00 -1.99 -3.82 3.01 -1.26 -4.94 117.46 106.16 2x77 n PHE 85 Ca 0.00 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.08 2x77 n PHE 85 Cb 0.15 -0.26 0.01 0.00 -0.01 0.00 0.00 39.48 39.37 2x77 n PHE 85 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2x77 s SER 86 N -2.66 6.00 -1.34 4.37 1.04 -1.12 -3.55 113.70 116.43 2x77 s SER 86 Ca 0.23 2.66 -0.06 0.00 0.48 0.00 0.00 55.95 59.27 2x77 s SER 86 Cb 0.19 -2.63 0.02 0.00 0.10 0.00 0.00 66.02 63.70 2x77 s SER 86 CO 0.52 -1.07 1.02 0.47 0.98 0.00 0.00 173.24 175.17 2x77 n ASP 87 N -0.27 -4.11 -4.66 7.02 9.92 -1.26 -4.97 116.55 118.22 2x77 n ASP 87 Ca 0.06 -0.65 -0.38 0.00 -0.53 0.00 0.00 54.79 53.29 2x77 n ASP 87 Cb 0.44 -4.70 -0.08 0.00 -0.64 0.00 0.00 41.12 36.14 2x77 n ASP 87 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2x77 s THR 88 N -3.38 5.23 -0.18 -3.53 2.01 -1.23 -4.60 115.64 109.95 2x77 s THR 88 Ca 0.35 0.59 0.18 0.00 0.31 0.00 0.00 61.69 63.12 2x77 s THR 88 Cb -0.16 -3.68 -0.01 0.00 0.01 0.00 0.00 72.50 68.65 2x77 s THR 88 CO 0.76 0.26 1.11 0.44 -0.69 0.00 0.00 174.62 176.51 2x77 h ASP 89 N 7.47 0.00 -5.00 3.53 5.19 -1.42 -3.40 116.42 122.79 2x77 h ASP 89 Ca -0.36 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 55.98 2x77 h ASP 89 Cb 1.16 0.00 -0.19 0.00 0.18 0.00 0.00 39.33 40.49 2x77 h ASP 89 CO 0.70 0.40 0.13 0.00 -3.12 0.00 0.00 179.24 177.35 2x77 s ALA 90 N -3.04 -1.62 -0.17 3.45 0.00 -1.13 -2.77 121.76 116.48 2x77 s ALA 90 Ca 0.00 1.14 -0.01 0.00 0.00 0.00 0.00 51.96 53.10 2x77 s ALA 90 Cb 0.08 0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.25 2x77 s ALA 90 CO 0.78 -0.37 -0.12 0.08 0.00 0.00 0.00 175.76 176.13 2x77 s VAL 91 N -1.33 2.90 -0.31 0.00 1.01 0.14 -1.82 120.40 120.99 2x77 s VAL 91 Ca -0.11 -0.68 -0.15 0.00 0.00 0.00 0.00 61.98 61.05 2x77 s VAL 91 Cb -0.01 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 2x77 s VAL 91 CO 0.08 0.49 0.35 -0.63 0.00 0.00 0.00 175.10 175.39 2x77 s ILE 92 N 0.97 5.19 -0.26 2.22 1.01 0.15 -0.43 121.20 130.06 2x77 s ILE 92 Ca -0.02 0.21 -0.07 0.00 0.00 0.00 0.00 60.65 60.78 2x77 s ILE 92 Cb -0.15 -3.75 -0.02 0.00 0.01 0.00 0.00 42.46 38.55 2x77 s ILE 92 CO -0.01 0.02 0.07 -0.47 0.00 0.00 0.00 174.94 174.54 2x77 s TYR 93 N 2.01 3.09 -0.18 3.97 5.04 0.14 -1.72 117.35 129.69 2x77 s TYR 93 Ca 0.12 -0.55 -0.07 0.00 -2.44 0.00 0.00 57.07 54.13 2x77 s TYR 93 Cb -0.16 -2.24 -0.04 0.00 0.35 0.00 0.00 41.96 39.87 2x77 s TYR 93 CO 0.11 -0.41 0.06 0.08 -1.34 0.00 0.00 175.55 174.04 2x77 s VAL 94 N 1.59 4.72 0.01 3.14 1.01 -0.35 -1.16 120.40 129.35 2x77 s VAL 94 Ca 0.06 -0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.04 2x77 s VAL 94 Cb -0.15 -3.12 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 2x77 s VAL 94 CO 0.03 0.46 -0.19 0.68 0.00 0.00 0.00 175.10 176.08 2x77 s VAL 95 N 0.40 1.49 -0.48 2.92 -7.23 -0.31 -4.33 120.40 112.86 2x77 s VAL 95 Ca 0.03 -0.93 -0.27 0.00 -1.81 0.00 0.00 61.98 58.99 2x77 s VAL 95 Cb -0.13 -1.26 0.03 0.00 0.56 0.00 0.00 36.38 35.58 2x77 s VAL 95 CO 0.00 0.32 1.06 -0.62 -0.31 0.00 0.00 175.10 175.55 2x77 s ASP 96 N -0.72 6.55 0.00 4.85 2.15 -1.26 0.04 116.67 128.28 2x77 s ASP 96 Ca 0.07 0.27 0.17 0.00 0.43 0.00 0.00 52.55 53.49 2x77 s ASP 96 Cb -0.08 -2.51 0.94 0.00 -0.30 0.00 0.00 42.92 40.98 2x77 s ASP 96 CO 0.00 -1.20 1.48 -1.20 -0.17 0.00 0.00 175.17 174.08 2x77 n SER 97 N 7.64 0.00 -0.02 -0.34 7.64 -1.05 -1.93 113.62 125.55 2x77 n SER 97 Ca 0.09 -0.22 0.01 0.00 1.01 0.00 0.00 58.87 59.76 2x77 n SER 97 Cb 0.49 -0.16 -0.13 0.00 -1.01 0.00 0.00 64.21 63.40 2x77 n SER 97 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2x77 n THR 98 N -1.16 0.86 -2.90 0.44 -1.04 -1.26 -1.02 114.28 108.20 2x77 n THR 98 Ca 0.10 -0.68 -0.44 0.00 -2.04 0.00 0.00 64.05 60.99 2x77 n THR 98 Cb 0.10 -0.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 2x77 n THR 98 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2x77 n ASP 99 N -2.63 5.37 -0.25 8.00 -0.08 -0.81 -4.83 116.55 121.31 2x77 n ASP 99 Ca -0.15 -3.06 -0.06 0.00 -1.51 0.00 0.00 54.79 50.01 2x77 n ASP 99 Cb 0.85 -1.49 -0.01 0.00 2.34 0.00 0.00 41.12 42.81 2x77 n ASP 99 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 2x77 h ARG 100 N 6.59 -0.14 -0.01 -0.67 2.47 -1.86 -2.93 114.38 117.82 2x77 h ARG 100 Ca 0.30 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.03 2x77 h ARG 100 Cb 0.80 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.15 2x77 h ARG 100 CO 1.29 -0.10 -0.14 -0.40 0.56 0.00 0.00 179.97 181.18 2x77 n ASP 101 N -5.42 1.38 -0.46 7.04 5.68 -1.26 -2.57 116.55 120.95 2x77 n ASP 101 Ca 0.04 -1.25 0.12 0.00 -0.50 0.00 0.00 54.79 53.20 2x77 n ASP 101 Cb 0.36 0.08 0.18 0.00 -1.14 0.00 0.00 41.12 40.59 2x77 n ASP 101 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2x77 n ARG 102 N -0.15 1.23 0.09 0.11 1.74 -1.12 -4.56 116.66 114.01 2x77 n ARG 102 Ca 0.15 -0.92 -0.05 0.00 -0.77 0.00 0.00 57.85 56.26 2x77 n ARG 102 Cb 0.37 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 2x77 n ARG 102 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 2x77 h MET 103 N 2.25 0.01 -0.89 5.56 4.05 -1.33 -1.11 114.93 123.47 2x77 h MET 103 Ca 0.00 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.41 2x77 h MET 103 Cb 0.68 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.44 2x77 h MET 103 CO 0.00 0.84 0.54 0.78 0.23 0.00 0.00 176.91 179.30 2x77 h GLY 104 N 2.48 1.28 1.63 1.39 0.00 -1.80 0.74 103.07 108.79 2x77 h GLY 104 Ca -0.01 -0.53 -0.09 0.00 0.00 0.00 0.00 47.33 46.70 2x77 h GLY 104 CO 0.11 0.51 -0.24 -2.08 0.00 0.00 0.00 176.54 174.85 2x77 h VAL 105 N 1.22 1.26 -0.54 4.60 2.07 -1.70 -1.77 116.25 121.39 2x77 h VAL 105 Ca 0.32 -1.21 -0.10 0.00 0.82 0.00 0.00 66.70 66.52 2x77 h VAL 105 Cb -0.06 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2x77 h VAL 105 CO -0.06 0.38 -0.07 0.00 0.02 0.00 0.00 177.57 177.84 2x77 h ALA 106 N 1.36 0.74 -0.10 1.67 0.00 -0.64 -1.11 119.26 121.18 2x77 h ALA 106 Ca 0.06 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.65 2x77 h ALA 106 Cb 0.63 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2x77 h ALA 106 CO 0.05 0.63 0.02 -0.22 0.00 0.00 0.00 179.25 179.72 2x77 h LYS 107 N 0.88 0.07 -0.12 0.00 3.64 -0.71 -0.70 116.57 119.63 2x77 h LYS 107 Ca 0.15 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.56 2x77 h LYS 107 Cb 0.63 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.39 2x77 h LYS 107 CO 0.04 0.04 -0.17 1.25 -2.27 0.00 0.00 179.45 178.35 2x77 h HIS 108 N 0.07 -0.43 -0.82 1.91 2.76 -1.07 0.24 115.15 117.81 2x77 h HIS 108 Ca 0.05 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.22 2x77 h HIS 108 Cb 0.04 0.21 -0.04 0.00 1.55 0.00 0.00 27.41 29.17 2x77 h HIS 108 CO -0.11 -0.24 0.42 0.93 -1.30 0.00 0.00 177.93 177.63 2x77 h GLU 109 N -0.21 1.16 0.05 5.26 4.39 -1.11 0.29 114.58 124.41 2x77 h GLU 109 Ca 0.09 -0.15 0.01 0.00 0.34 0.00 0.00 59.36 59.65 2x77 h GLU 109 Cb 0.35 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2x77 h GLU 109 CO -0.25 0.87 -0.10 1.25 -1.16 0.00 0.00 179.01 179.62 2x77 h LEU 110 N 1.16 -0.28 -1.37 1.33 5.85 -0.70 -2.23 115.31 119.07 2x77 h LEU 110 Ca 0.29 0.04 0.04 0.00 0.84 0.00 0.00 57.88 59.09 2x77 h LEU 110 Cb 0.07 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 2x77 h LEU 110 CO -0.04 -0.15 0.46 1.88 -0.34 0.00 0.00 178.44 180.25 2x77 h TYR 111 N -0.20 0.78 -0.67 1.25 -1.99 -0.17 -1.85 116.97 114.13 2x77 h TYR 111 Ca 0.02 0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.81 2x77 h TYR 111 Cb 0.22 -0.26 -0.05 0.00 2.00 0.00 0.00 36.73 38.64 2x77 h TYR 111 CO -0.14 0.44 0.41 0.00 -0.00 0.00 0.00 178.16 178.87 2x77 h ALA 112 N 1.60 0.88 -0.20 3.88 0.00 -0.21 -2.87 119.26 122.35 2x77 h ALA 112 Ca 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2x77 h ALA 112 Cb 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2x77 h ALA 112 CO -0.09 0.14 0.13 -0.07 0.00 0.00 0.00 179.25 179.36 2x77 h LEU 113 N 0.78 0.23 -0.37 0.00 3.38 -0.74 -3.23 115.31 115.35 2x77 h LEU 113 Ca 0.28 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2x77 h LEU 113 Cb 0.07 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2x77 h LEU 113 CO -0.13 0.18 0.00 0.18 0.09 0.00 0.00 178.44 178.76 2x77 n LEU 114 N -4.94 0.64 -0.33 1.67 4.32 -0.87 -2.33 117.00 115.15 2x77 n LEU 114 Ca -0.03 0.61 0.07 0.00 -0.02 0.00 0.00 56.01 56.64 2x77 n LEU 114 Cb 0.03 -0.48 0.30 0.00 -1.62 0.00 0.00 43.42 41.66 2x77 n LEU 114 CO 0.34 -0.38 0.71 -0.90 -1.22 0.00 0.00 177.39 175.95 2x77 n ASP 115 N -2.16 0.99 -4.71 -1.43 3.85 -1.10 -4.83 116.55 107.17 2x77 n ASP 115 Ca 0.04 -1.75 -0.40 0.00 -0.71 0.00 0.00 54.79 51.96 2x77 n ASP 115 Cb 0.30 -0.09 -0.05 0.00 -1.35 0.00 0.00 41.12 39.94 2x77 n ASP 115 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 2x77 s GLU 116 N -1.82 4.43 0.26 0.11 0.41 -0.98 -4.95 118.70 116.16 2x77 s GLU 116 Ca 0.23 0.92 0.01 0.00 -0.41 0.00 0.00 54.97 55.73 2x77 s GLU 116 Cb 0.12 -3.46 0.35 0.00 -1.78 0.00 0.00 34.13 29.36 2x77 s GLU 116 CO 0.18 0.03 1.69 0.22 -0.49 0.00 0.00 175.26 176.89 2x77 h ASP 117 N 6.81 0.54 -0.02 -0.19 3.58 -1.89 -2.54 116.42 122.71 2x77 h ASP 117 Ca -0.40 -0.19 0.01 0.00 0.42 0.00 0.00 57.03 56.86 2x77 h ASP 117 Cb 1.19 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 42.09 2x77 h ASP 117 CO 0.76 0.79 0.09 -0.33 -2.88 0.00 0.00 179.24 177.67 2x77 h GLU 118 N 0.47 0.00 -0.01 0.28 3.07 -1.92 -2.76 114.58 113.70 2x77 h GLU 118 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 2x77 h GLU 118 Cb 0.70 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 2x77 h GLU 118 CO 0.05 0.00 -0.22 1.28 -1.40 0.00 0.00 179.01 178.72 2x77 n LEU 119 N -3.17 1.89 -0.20 1.33 4.77 -0.96 -4.58 117.00 116.07 2x77 n LEU 119 Ca -0.02 -0.84 0.29 0.00 -0.03 0.00 0.00 56.01 55.40 2x77 n LEU 119 Cb 0.16 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 41.96 2x77 n LEU 119 CO 0.20 0.35 1.26 0.08 -1.33 0.00 0.00 177.39 177.95 2x77 h ARG 120 N 2.30 0.03 -0.03 3.23 0.11 -1.47 0.09 114.38 118.65 2x77 h ARG 120 Ca 0.00 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2x77 h ARG 120 Cb 0.60 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.67 2x77 h ARG 120 CO 0.00 0.02 -0.00 0.36 0.10 0.00 0.00 179.97 180.45 2x77 n LYS 121 N -4.28 2.12 -1.97 0.08 2.85 -1.26 -4.89 118.16 110.80 2x77 n LYS 121 Ca 0.19 -1.83 -0.41 0.00 -1.05 0.00 0.00 58.31 55.21 2x77 n LYS 121 Cb 0.97 -1.43 -0.02 0.00 -0.65 0.00 0.00 35.03 33.90 2x77 n LYS 121 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2x77 s SER 122 N -1.88 6.60 0.54 -5.58 0.01 0.02 -4.97 113.70 108.44 2x77 s SER 122 Ca 0.26 2.75 -0.21 0.00 1.31 0.00 0.00 55.95 60.07 2x77 s SER 122 Cb 0.19 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.73 2x77 s SER 122 CO 0.28 -0.73 1.22 -0.76 0.41 0.00 0.00 173.24 173.66 2x77 s LEU 123 N -0.80 3.80 -0.21 2.44 1.43 -1.11 -4.71 118.68 119.53 2x77 s LEU 123 Ca 0.58 2.41 0.02 0.00 -1.03 0.00 0.00 54.13 56.10 2x77 s LEU 123 Cb -0.43 -4.44 0.03 0.00 0.03 0.00 0.00 46.19 41.38 2x77 s LEU 123 CO 0.48 -1.36 -0.17 -0.22 0.23 0.00 0.00 176.35 175.30 2x77 s LEU 124 N -3.65 2.55 -0.23 1.79 2.96 -0.51 0.23 118.68 121.83 2x77 s LEU 124 Ca 0.72 -0.88 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 2x77 s LEU 124 Cb -0.31 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 44.86 2x77 s LEU 124 CO 0.35 -0.06 -0.02 -0.22 -1.32 0.00 0.00 176.35 175.09 2x77 s LEU 125 N 1.24 3.03 -0.16 -0.68 2.96 0.43 -1.77 118.68 123.72 2x77 s LEU 125 Ca 0.01 -0.36 -0.12 0.00 -0.22 0.00 0.00 54.13 53.44 2x77 s LEU 125 Cb -0.15 -1.78 -0.05 0.00 0.50 0.00 0.00 46.19 44.71 2x77 s LEU 125 CO -0.10 -0.03 0.25 -0.63 -1.32 0.00 0.00 176.35 174.52 2x77 s ILE 126 N 1.51 5.33 -0.43 6.68 1.01 0.44 0.24 121.20 135.99 2x77 s ILE 126 Ca 0.06 0.45 -0.14 0.00 0.00 0.00 0.00 60.65 61.02 2x77 s ILE 126 Cb -0.14 -3.58 0.04 0.00 0.01 0.00 0.00 42.46 38.79 2x77 s ILE 126 CO -0.02 0.43 0.32 -0.36 0.00 0.00 0.00 174.94 175.31 2x77 s PHE 127 N 0.26 3.25 -0.71 3.97 0.08 -0.31 -0.80 117.98 123.72 2x77 s PHE 127 Ca 0.15 -0.81 -0.27 0.00 0.12 0.00 0.00 56.93 56.12 2x77 s PHE 127 Cb -0.13 -2.78 0.01 0.00 -0.57 0.00 0.00 43.02 39.56 2x77 s PHE 127 CO 0.03 -0.68 1.46 0.00 -0.10 0.00 0.00 175.22 175.93 2x77 s ALA 128 N 1.64 2.57 0.53 5.36 0.00 -0.83 -1.16 121.76 129.87 2x77 s ALA 128 Ca 0.04 -1.19 0.09 0.00 0.00 0.00 0.00 51.96 50.90 2x77 s ALA 128 Cb -0.21 -4.28 0.06 0.00 0.00 0.00 0.00 23.12 18.68 2x77 s ALA 128 CO 0.08 -3.49 0.66 1.21 0.00 0.00 0.00 175.76 174.22 2x77 s ASN 129 N 5.08 5.12 -1.47 0.00 2.47 0.11 -0.81 114.94 125.43 2x77 s ASN 129 Ca 0.45 -0.83 -0.11 0.00 0.42 0.00 0.00 52.86 52.79 2x77 s ASN 129 Cb -0.09 0.08 0.06 0.00 -1.45 0.00 0.00 41.25 39.85 2x77 s ASN 129 CO 0.16 -1.15 0.89 0.29 -3.72 0.00 0.00 177.10 173.57 2x77 n LYS 130 N -2.04 -5.55 0.00 0.43 5.02 -0.89 -2.53 118.16 112.59 2x77 n LYS 130 Ca 0.11 0.67 0.08 0.00 -2.02 0.00 0.00 58.31 57.14 2x77 n LYS 130 Cb 0.62 -5.56 0.38 0.00 -0.02 0.00 0.00 35.03 30.45 2x77 n LYS 130 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2x77 n GLN 131 N -4.50 0.10 0.27 1.97 1.13 -0.31 -2.25 117.38 113.79 2x77 n GLN 131 Ca 0.01 0.18 0.14 0.00 -1.94 0.00 0.00 57.00 55.38 2x77 n GLN 131 Cb 0.55 -1.50 0.73 0.00 0.11 0.00 0.00 30.24 30.12 2x77 n GLN 131 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 2x77 h ASP 132 N 0.00 0.00 -3.94 1.08 3.04 -1.90 -3.46 116.42 111.25 2x77 h ASP 132 Ca 0.00 0.00 -0.50 0.00 -3.24 0.00 0.00 57.03 53.29 2x77 h ASP 132 Cb 0.23 0.00 0.04 0.00 -1.04 0.00 0.00 39.33 38.56 2x77 h ASP 132 CO 0.00 0.11 0.25 -0.76 -2.04 0.00 0.00 179.24 176.80 2x77 s LEU 133 N -6.96 3.52 -0.02 0.15 1.43 -0.95 -5.01 118.68 110.84 2x77 s LEU 133 Ca -0.02 1.21 -0.21 0.00 -1.03 0.00 0.00 54.13 54.08 2x77 s LEU 133 Cb 0.12 -4.18 -0.29 0.00 0.03 0.00 0.00 46.19 41.87 2x77 s LEU 133 CO 0.57 -0.65 0.98 -0.65 0.23 0.00 0.00 176.35 176.82 2x77 h PRO 134 N 0.27 0.36 -6.16 1.29 0.11 -1.89 -3.32 132.00 122.66 2x77 h PRO 134 Ca -0.46 -0.52 -0.52 0.00 0.11 0.00 0.00 66.00 64.60 2x77 h PRO 134 Cb 1.19 0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.44 2x77 h PRO 134 CO 0.62 1.21 1.25 0.16 -0.21 0.00 0.00 178.00 181.04 2x77 s ASP 135 N -6.95 5.65 -0.27 -2.05 1.47 -1.26 -4.91 116.67 108.36 2x77 s ASP 135 Ca -0.13 0.36 -0.06 0.00 1.18 0.00 0.00 52.55 53.90 2x77 s ASP 135 Cb 0.02 -2.54 0.13 0.00 -0.34 0.00 0.00 42.92 40.20 2x77 s ASP 135 CO 0.84 -2.07 0.54 0.00 0.68 0.00 0.00 175.17 175.16 2x77 s ALA 136 N 7.71 -1.73 0.66 2.11 0.00 -1.25 -4.08 121.76 125.18 2x77 s ALA 136 Ca 0.62 1.84 -0.14 0.00 0.00 0.00 0.00 51.96 54.27 2x77 s ALA 136 Cb -0.13 -1.73 -0.00 0.00 0.00 0.00 0.00 23.12 21.26 2x77 s ALA 136 CO 0.23 -1.01 1.09 0.00 0.00 0.00 0.00 175.76 176.07 2x77 s ALA 137 N 2.77 2.54 0.89 0.00 0.00 -0.19 -4.98 121.76 122.80 2x77 s ALA 137 Ca 0.03 0.42 -0.13 0.00 0.00 0.00 0.00 51.96 52.28 2x77 s ALA 137 Cb -0.13 -3.27 0.13 0.00 0.00 0.00 0.00 23.12 19.85 2x77 s ALA 137 CO -0.17 -1.20 1.19 -1.54 0.00 0.00 0.00 175.76 174.03 2x77 s SER 138 N -2.86 3.71 0.36 0.00 1.04 -1.26 -4.82 113.70 109.87 2x77 s SER 138 Ca 0.64 0.73 0.05 0.00 0.48 0.00 0.00 55.95 57.85 2x77 s SER 138 Cb -0.18 -1.15 0.71 0.00 0.10 0.00 0.00 66.02 65.51 2x77 s SER 138 CO 0.43 -2.40 1.99 -0.33 0.98 0.00 0.00 173.24 173.92 2x77 h GLU 139 N -1.40 0.75 0.00 4.02 5.08 -1.98 -0.22 114.58 120.83 2x77 h GLU 139 Ca -0.47 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 57.77 2x77 h GLU 139 Cb 1.31 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 2x77 h GLU 139 CO 0.57 0.50 -0.48 0.00 -1.00 0.00 0.00 179.01 178.60 2x77 h ALA 140 N 1.62 0.74 0.07 3.43 0.00 -1.98 0.58 119.26 123.72 2x77 h ALA 140 Ca 0.26 -0.35 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 2x77 h ALA 140 Cb 0.08 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.86 2x77 h ALA 140 CO -0.07 0.46 -0.83 1.49 0.00 0.00 0.00 179.25 180.30 2x77 h GLU 141 N 0.00 0.44 -0.18 0.00 4.81 -1.76 -2.35 114.58 115.54 2x77 h GLU 141 Ca -0.02 -0.57 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 2x77 h GLU 141 Cb 1.29 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.84 2x77 h GLU 141 CO 0.04 1.22 0.12 0.82 -0.73 0.00 0.00 179.01 180.48 2x77 h ILE 142 N -0.07 1.06 -0.88 2.32 1.08 -1.01 0.20 117.51 120.20 2x77 h ILE 142 Ca -0.12 -0.11 -0.02 0.00 -0.39 0.00 0.00 64.86 64.22 2x77 h ILE 142 Cb 1.57 0.80 -0.04 0.00 -3.07 0.00 0.00 36.82 36.08 2x77 h ILE 142 CO 0.16 0.05 0.48 0.00 -0.69 0.00 0.00 178.15 178.15 2x77 h ALA 143 N 1.06 1.19 0.04 1.87 0.00 -0.95 0.41 119.26 122.87 2x77 h ALA 143 Ca 0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2x77 h ALA 143 Cb -0.02 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.42 2x77 h ALA 143 CO -0.01 0.65 -0.02 1.49 0.00 0.00 0.00 179.25 181.36 2x77 h GLU 144 N 1.23 -0.05 -0.71 0.00 4.57 -1.28 0.16 114.58 118.50 2x77 h GLU 144 Ca 0.31 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.43 2x77 h GLU 144 Cb 0.03 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.60 2x77 h GLU 144 CO -0.05 0.10 0.21 0.37 -1.18 0.00 0.00 179.01 178.46 2x77 h GLN 145 N -0.19 1.11 -0.02 1.92 5.75 -0.12 -1.00 115.11 122.56 2x77 h GLN 145 Ca -0.01 -0.24 0.00 0.00 -0.15 0.00 0.00 58.65 58.25 2x77 h GLN 145 Cb 0.17 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 28.56 2x77 h GLN 145 CO 0.01 0.95 0.00 1.28 -2.65 0.00 0.00 178.83 178.42 2x77 n LEU 146 N -4.25 0.96 -3.98 -2.39 4.77 0.14 -4.74 117.00 107.52 2x77 n LEU 146 Ca 0.06 -0.33 -0.30 0.00 -0.03 0.00 0.00 56.01 55.41 2x77 n LEU 146 Cb 0.23 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.30 2x77 n LEU 146 CO 0.42 0.16 -0.24 0.61 -1.33 0.00 0.00 177.39 177.01 2x77 n GLY 147 N 1.10 -0.41 0.12 -0.72 0.00 -0.26 -4.85 105.19 100.17 2x77 n GLY 147 Ca 0.20 0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.56 2x77 n GLY 147 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2x77 h VAL 148 N -1.93 0.04 0.00 1.61 2.07 -1.02 -3.37 116.25 113.65 2x77 h VAL 148 Ca -0.65 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 65.79 2x77 h VAL 148 Cb 1.38 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.73 2x77 h VAL 148 CO 0.60 0.02 0.00 -0.24 0.02 0.00 0.00 177.57 177.97 2x77 n SER 149 N -2.73 0.00 -0.28 0.57 2.88 -1.25 -0.60 113.62 112.22 2x77 n SER 149 Ca -0.00 -1.46 0.05 0.00 -1.33 0.00 0.00 58.87 56.12 2x77 n SER 149 Cb 0.57 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.09 2x77 n SER 149 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2x77 n SER 150 N -0.57 1.12 -4.52 -3.46 3.41 -1.26 -4.99 113.62 103.35 2x77 n SER 150 Ca 0.03 -2.48 -0.43 0.00 -0.26 0.00 0.00 58.87 55.73 2x77 n SER 150 Cb 0.01 -0.30 -0.07 0.00 -0.26 0.00 0.00 64.21 63.60 2x77 n SER 150 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2x77 s ILE 151 N -1.34 4.88 -0.02 -1.33 1.01 0.23 -4.89 121.20 119.74 2x77 s ILE 151 Ca 0.15 0.14 0.03 0.00 0.00 0.00 0.00 60.65 60.98 2x77 s ILE 151 Cb 0.13 -4.15 0.05 0.00 0.01 0.00 0.00 42.46 38.50 2x77 s ILE 151 CO 0.01 -0.51 1.01 0.23 0.00 0.00 0.00 174.94 175.69 2x77 n MET 152 N 6.11 0.26 -0.13 2.79 2.81 -1.26 -4.71 117.12 122.99 2x77 n MET 152 Ca -0.02 -1.28 0.07 0.00 -1.81 0.00 0.00 57.70 54.66 2x77 n MET 152 Cb 0.48 -0.69 0.13 0.00 -0.71 0.00 0.00 33.22 32.43 2x77 n MET 152 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2x77 n ASN 153 N -0.27 2.59 -3.50 7.83 6.94 -1.26 -5.03 115.26 122.56 2x77 n ASN 153 Ca 0.03 -2.71 -0.13 0.00 -0.02 0.00 0.00 54.58 51.75 2x77 n ASN 153 Cb 0.68 -0.33 -0.04 0.00 -2.36 0.00 0.00 39.78 37.73 2x77 n ASN 153 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 2x77 s ARG 154 N -2.24 0.99 -0.30 -3.83 3.52 -1.26 -5.00 118.95 110.83 2x77 s ARG 154 Ca 0.25 -0.06 -0.19 0.00 -0.13 0.00 0.00 55.73 55.60 2x77 s ARG 154 Cb 0.21 0.46 -0.01 0.00 -1.56 0.00 0.00 34.95 34.04 2x77 s ARG 154 CO 0.04 -0.37 0.57 0.99 -0.81 0.00 0.00 175.30 175.72 2x77 s THR 155 N -2.23 5.00 0.04 4.11 2.01 -1.26 -5.02 115.64 118.29 2x77 s THR 155 Ca -0.03 0.77 -0.02 0.00 0.31 0.00 0.00 61.69 62.72 2x77 s THR 155 Cb -0.01 -3.93 -0.03 0.00 0.01 0.00 0.00 72.50 68.54 2x77 s THR 155 CO -0.01 -0.08 0.01 -1.66 -0.69 0.00 0.00 174.62 172.19 2x77 s TRP 156 N 2.47 0.36 0.17 4.92 1.48 -1.26 -1.42 118.94 125.66 2x77 s TRP 156 Ca 0.23 -0.79 -0.12 0.00 -1.06 0.00 0.00 56.10 54.36 2x77 s TRP 156 Cb -0.15 -0.27 0.01 0.00 -1.16 0.00 0.00 33.47 31.90 2x77 s TRP 156 CO 0.11 -0.34 0.37 -0.08 -4.06 0.00 0.00 176.95 172.95 2x77 s THR 157 N -3.04 0.06 -0.04 0.66 -1.32 -0.73 -5.00 115.64 106.22 2x77 s THR 157 Ca -0.01 -1.11 0.03 0.00 -1.21 0.00 0.00 61.69 59.39 2x77 s THR 157 Cb 0.02 -1.66 -0.03 0.00 -1.51 0.00 0.00 72.50 69.31 2x77 s THR 157 CO -0.07 -0.27 -0.12 -0.63 -2.21 0.00 0.00 174.62 171.33 2x77 s ILE 158 N -3.92 3.25 -0.05 5.08 1.01 -1.26 -0.42 121.20 124.90 2x77 s ILE 158 Ca 0.12 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 60.06 2x77 s ILE 158 Cb 0.02 -2.31 0.02 0.00 0.01 0.00 0.00 42.46 40.20 2x77 s ILE 158 CO -0.03 0.55 -0.03 -0.69 0.00 0.00 0.00 174.94 174.74 2x77 s VAL 159 N -0.80 0.46 0.21 2.92 1.01 0.02 -4.94 120.40 119.28 2x77 s VAL 159 Ca 0.13 -0.05 -0.31 0.00 0.00 0.00 0.00 61.98 61.74 2x77 s VAL 159 Cb -0.11 -0.52 -0.10 0.00 0.00 0.00 0.00 36.38 35.65 2x77 s VAL 159 CO 0.02 0.22 1.55 -0.54 0.00 0.00 0.00 175.10 176.35 2x77 s LYS 160 N 1.11 4.21 0.19 2.72 1.02 -1.26 -1.96 119.74 125.77 2x77 s LYS 160 Ca -0.08 2.40 -0.05 0.00 0.02 0.00 0.00 55.97 58.26 2x77 s LYS 160 Cb -0.14 -3.11 -0.03 0.00 -0.52 0.00 0.00 37.83 34.03 2x77 s LYS 160 CO -0.01 -0.58 0.23 -1.54 -0.92 0.00 0.00 175.35 172.54 2x77 s SER 161 N 0.84 0.09 -0.30 2.83 1.04 0.01 -3.92 113.70 114.29 2x77 s SER 161 Ca 0.67 -1.15 -0.13 0.00 0.48 0.00 0.00 55.95 55.81 2x77 s SER 161 Cb -0.44 0.43 0.16 0.00 0.10 0.00 0.00 66.02 66.26 2x77 s SER 161 CO 0.37 -0.91 0.88 -0.55 0.98 0.00 0.00 173.24 174.01 2x77 s SER 162 N -3.07 -0.77 0.45 7.02 0.15 -0.68 -1.16 113.70 115.64 2x77 s SER 162 Ca 0.29 1.02 0.30 0.00 0.70 0.00 0.00 55.95 58.26 2x77 s SER 162 Cb 0.04 1.86 1.25 0.00 -1.71 0.00 0.00 66.02 67.47 2x77 s SER 162 CO 0.08 -0.15 1.89 0.28 1.20 0.00 0.00 173.24 176.54 2x77 h SER 163 N 7.68 0.00 0.22 5.45 0.02 -1.92 0.46 113.55 125.46 2x77 h SER 163 Ca -0.16 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.53 2x77 h SER 163 Cb 1.11 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.67 2x77 h SER 163 CO 0.09 0.00 -1.06 0.11 -1.14 0.00 0.00 176.83 174.82 2x77 h LYS 164 N 0.00 0.53 0.04 3.45 1.57 -1.96 -3.31 116.57 116.90 2x77 h LYS 164 Ca 0.00 -0.62 -0.00 0.00 -1.87 0.00 0.00 60.65 58.16 2x77 h LYS 164 Cb 0.44 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.94 2x77 h LYS 164 CO 0.00 1.24 -0.02 1.15 -0.57 0.00 0.00 179.45 181.25 2x77 h THR 165 N 0.28 1.06 0.00 -0.16 2.02 -1.98 -3.48 112.91 110.65 2x77 h THR 165 Ca -0.12 -1.63 0.00 0.00 0.77 0.00 0.00 66.41 65.43 2x77 h THR 165 Cb 1.72 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 70.07 2x77 h THR 165 CO 0.19 0.34 0.00 0.61 0.37 0.00 0.00 175.52 177.03 2x77 n GLY 166 N 1.33 0.29 3.77 2.16 0.00 0.16 -5.08 105.19 107.81 2x77 n GLY 166 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 2x77 n GLY 166 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2x77 s ASP 167 N -2.19 5.85 0.00 1.61 2.15 -1.15 -3.08 116.67 119.86 2x77 s ASP 167 Ca 0.00 2.91 0.00 0.00 0.43 0.00 0.00 52.55 55.89 2x77 s ASP 167 Cb 0.00 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 2x77 s ASP 167 CO 0.00 -1.19 0.00 0.61 -0.17 0.00 0.00 175.17 174.42 2x77 n GLY 168 N 0.59 2.96 0.19 2.66 0.00 -1.25 -1.68 105.19 108.65 2x77 n GLY 168 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 2x77 n GLY 168 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2x77 h LEU 169 N 0.00 0.64 -0.11 0.99 3.38 -1.82 0.16 115.31 118.54 2x77 h LEU 169 Ca 0.00 -0.46 -0.24 0.00 0.09 0.00 0.00 57.88 57.27 2x77 h LEU 169 Cb 0.00 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.58 2x77 h LEU 169 CO 0.00 0.97 -0.91 0.58 0.09 0.00 0.00 178.44 179.17 2x77 h VAL 170 N 0.32 1.30 -0.29 1.22 2.07 -1.90 -1.17 116.25 117.79 2x77 h VAL 170 Ca 0.04 -2.15 0.04 0.00 0.82 0.00 0.00 66.70 65.45 2x77 h VAL 170 Cb 0.78 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 32.72 2x77 h VAL 170 CO 0.06 0.67 0.05 -0.08 0.02 0.00 0.00 177.57 178.29 2x77 h GLU 171 N 0.43 0.15 -0.87 1.57 4.81 -1.91 0.37 114.58 119.13 2x77 h GLU 171 Ca -0.09 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 2x77 h GLU 171 Cb 1.54 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.85 2x77 h GLU 171 CO 0.18 0.10 0.47 0.78 -0.73 0.00 0.00 179.01 179.81 2x77 h GLY 172 N 0.15 1.30 2.00 1.92 0.00 -0.60 0.35 103.07 108.19 2x77 h GLY 172 Ca 0.13 -0.59 -0.09 0.00 0.00 0.00 0.00 47.33 46.79 2x77 h GLY 172 CO -0.18 0.57 -0.41 -0.33 0.00 0.00 0.00 176.54 176.19 2x77 h MET 173 N 1.22 0.00 -0.11 4.80 2.86 -0.56 -2.30 114.93 120.84 2x77 h MET 173 Ca 0.31 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.89 2x77 h MET 173 Cb 0.03 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 2x77 h MET 173 CO -0.05 0.41 -0.14 0.22 1.06 0.00 0.00 176.91 178.41 2x77 h ASP 174 N 0.00 0.31 -0.90 1.22 3.58 0.46 -0.00 116.42 121.08 2x77 h ASP 174 Ca -0.00 -0.52 0.15 0.00 0.42 0.00 0.00 57.03 57.08 2x77 h ASP 174 Cb 1.13 -0.09 -0.16 0.00 1.72 0.00 0.00 39.33 41.94 2x77 h ASP 174 CO 0.05 0.76 -0.34 -0.25 -2.88 0.00 0.00 179.24 176.58 2x77 h TRP 175 N -0.14 -0.92 -0.24 0.28 7.01 -0.92 -0.16 115.95 120.85 2x77 h TRP 175 Ca 0.01 0.09 -0.03 0.00 2.11 0.00 0.00 58.89 61.07 2x77 h TRP 175 Cb 0.69 0.54 -0.01 0.00 -2.10 0.00 0.00 29.16 28.28 2x77 h TRP 175 CO 0.10 -0.40 0.02 -0.07 -2.79 0.00 0.00 178.44 175.30 2x77 h LEU 176 N -0.03 0.39 0.14 0.65 3.38 -1.18 -0.96 115.31 117.70 2x77 h LEU 176 Ca 0.35 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2x77 h LEU 176 Cb 0.61 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2x77 h LEU 176 CO -0.92 0.57 -0.13 0.58 0.09 0.00 0.00 178.44 178.63 2x77 h VAL 177 N 0.20 0.70 -0.18 1.22 2.07 -0.70 0.93 116.25 120.49 2x77 h VAL 177 Ca 0.07 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.51 2x77 h VAL 177 Cb 0.36 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2x77 h VAL 177 CO 0.01 0.00 -0.23 -0.33 0.02 0.00 0.00 177.57 177.03 2x77 h GLU 178 N -0.30 0.32 -0.32 1.57 4.39 -0.95 -1.10 114.58 118.19 2x77 h GLU 178 Ca 0.00 -0.11 -0.11 0.00 0.34 0.00 0.00 59.36 59.49 2x77 h GLU 178 Cb 0.28 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2x77 h GLU 178 CO -0.03 0.54 -0.25 0.00 -1.16 0.00 0.00 179.01 178.11 2x77 h ARG 179 N 0.29 0.64 -0.20 2.33 2.47 -0.97 -1.81 114.38 117.12 2x77 h ARG 179 Ca 0.05 -0.26 -0.01 0.00 -1.26 0.00 0.00 59.98 58.50 2x77 h ARG 179 Cb 0.58 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.86 2x77 h ARG 179 CO 0.04 0.83 0.07 -0.07 0.56 0.00 0.00 179.97 181.40 2x77 h LEU 180 N 0.56 0.29 -0.26 3.04 3.38 -0.18 0.11 115.31 122.25 2x77 h LEU 180 Ca 0.08 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2x77 h LEU 180 Cb 0.73 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 2x77 h LEU 180 CO 0.06 0.41 0.17 0.03 0.09 0.00 0.00 178.44 179.19 2x77 h ARG 181 N 0.16 0.35 -0.54 1.13 3.08 -1.22 -2.70 114.38 114.64 2x77 h ARG 181 Ca 0.07 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.15 2x77 h ARG 181 Cb 0.22 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.14 2x77 h ARG 181 CO -0.00 0.26 0.25 1.49 -1.07 0.00 0.00 179.97 180.90 2x77 h GLU 182 N 0.34 0.47 0.00 0.04 4.81 -1.22 -3.52 114.58 115.50 2x77 h GLU 182 Ca 0.10 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2x77 h GLU 182 Cb -0.01 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.27 2x77 h GLU 182 CO -0.02 0.31 0.00 1.04 -0.73 0.00 0.00 179.01 179.61