#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h66 s THR 3 N 0.00 3.47 -2.16 0.52 -1.32 -1.26 -4.96 115.64 109.93 2h66 s THR 3 Ca 0.00 0.56 0.26 0.00 -1.21 0.00 0.00 61.69 61.30 2h66 s THR 3 Cb 0.00 -3.10 0.26 0.00 -1.51 0.00 0.00 72.50 68.15 2h66 s THR 3 CO 0.00 -0.54 1.46 0.00 -2.21 0.00 0.00 174.62 173.33 2h66 n TYR 4 N -2.94 0.00 -1.99 9.09 4.11 -1.26 -4.87 117.16 119.30 2h66 n TYR 4 Ca 0.09 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.57 2h66 n TYR 4 Cb 0.53 -0.05 -0.03 0.00 -0.00 0.00 0.00 39.34 39.79 2h66 n TYR 4 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 2h66 s VAL 5 N -2.31 2.87 0.00 -3.48 1.01 -1.26 -0.67 120.40 116.56 2h66 s VAL 5 Ca 0.27 0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.83 2h66 s VAL 5 Cb 0.19 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 33.20 2h66 s VAL 5 CO 0.46 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.20 2h66 n GLY 6 N 3.73 0.74 0.94 4.51 0.00 0.20 -4.99 105.19 110.31 2h66 n GLY 6 Ca 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.09 2h66 n GLY 6 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h66 n LYS 7 N -2.42 0.85 -2.09 1.61 5.02 0.16 -4.87 118.16 116.42 2h66 n LYS 7 Ca 0.00 -0.96 -0.42 0.00 -2.02 0.00 0.00 58.31 54.91 2h66 n LYS 7 Cb 0.00 0.52 -0.03 0.00 -0.02 0.00 0.00 35.03 35.50 2h66 n LYS 7 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2h66 s GLU 8 N -2.43 4.27 0.11 1.97 2.02 -1.26 -0.01 118.70 123.36 2h66 s GLU 8 Ca 0.06 2.16 -0.36 0.00 0.02 0.00 0.00 54.97 56.85 2h66 s GLU 8 Cb 0.00 -3.37 -0.16 0.00 0.10 0.00 0.00 34.13 30.70 2h66 s GLU 8 CO 0.04 -0.56 1.43 0.00 0.02 0.00 0.00 175.26 176.20 2h66 n ALA 9 N 4.60 -0.06 -1.57 5.21 0.00 -0.48 -4.81 120.51 123.40 2h66 n ALA 9 Ca 0.13 0.49 -0.51 0.00 0.00 0.00 0.00 53.44 53.55 2h66 n ALA 9 Cb 0.42 -2.18 -0.05 0.00 0.00 0.00 0.00 19.45 17.63 2h66 n ALA 9 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2h66 n PRO 10 N 2.88 1.06 -1.77 0.00 -0.02 -1.26 -4.91 135.00 130.98 2h66 n PRO 10 Ca 0.18 0.38 -0.41 0.00 -2.02 0.00 0.00 63.50 61.63 2h66 n PRO 10 Cb 0.23 -1.92 -0.00 0.00 -0.02 0.00 0.00 33.50 31.79 2h66 n PRO 10 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2h66 n PHE 11 N 1.85 2.97 -3.89 6.00 -0.00 -1.26 -5.03 117.46 118.09 2h66 n PHE 11 Ca 0.17 0.42 -0.10 0.00 -0.00 0.00 0.00 57.45 57.93 2h66 n PHE 11 Cb 0.21 -2.54 -0.10 0.00 -0.00 0.00 0.00 39.48 37.06 2h66 n PHE 11 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.76 176.17 2h66 s PHE 12 N -0.95 0.10 -0.29 -5.13 -0.71 -1.26 -5.00 117.98 104.74 2h66 s PHE 12 Ca 0.55 -0.26 0.00 0.00 -1.04 0.00 0.00 56.93 56.18 2h66 s PHE 12 Cb -0.48 -0.08 0.14 0.00 -1.21 0.00 0.00 43.02 41.39 2h66 s PHE 12 CO 0.62 -0.31 0.33 0.21 -1.34 0.00 0.00 175.22 174.72 2h66 s LYS 13 N -1.77 0.35 0.18 1.99 2.36 -1.26 -1.28 119.74 120.30 2h66 s LYS 13 Ca -0.12 -0.05 0.08 0.00 -2.55 0.00 0.00 55.97 53.33 2h66 s LYS 13 Cb -0.06 -0.56 -0.04 0.00 -1.05 0.00 0.00 37.83 36.12 2h66 s LYS 13 CO -0.00 -1.02 -0.16 0.00 1.55 0.00 0.00 175.35 175.72 2h66 s ALA 14 N 2.42 1.95 0.50 3.13 0.00 0.38 -4.96 121.76 125.17 2h66 s ALA 14 Ca 0.09 -1.55 -0.20 0.00 0.00 0.00 0.00 51.96 50.30 2h66 s ALA 14 Cb -0.13 -0.12 -0.08 0.00 0.00 0.00 0.00 23.12 22.79 2h66 s ALA 14 CO -0.32 0.14 1.07 -1.21 0.00 0.00 0.00 175.76 175.44 2h66 s GLU 15 N -3.20 3.66 -0.03 0.00 2.02 -1.26 -0.91 118.70 118.99 2h66 s GLU 15 Ca 0.18 1.46 -0.07 0.00 0.02 0.00 0.00 54.97 56.57 2h66 s GLU 15 Cb -0.03 -2.08 0.01 0.00 0.10 0.00 0.00 34.13 32.12 2h66 s GLU 15 CO 0.06 -0.56 0.15 0.00 0.02 0.00 0.00 175.26 174.93 2h66 s ALA 16 N -1.89 -0.37 -0.47 5.21 0.00 0.22 -1.27 121.76 123.19 2h66 s ALA 16 Ca 0.69 0.17 -0.11 0.00 0.00 0.00 0.00 51.96 52.71 2h66 s ALA 16 Cb -0.19 -0.08 0.10 0.00 0.00 0.00 0.00 23.12 22.94 2h66 s ALA 16 CO 0.23 -0.14 0.35 0.08 0.00 0.00 0.00 175.76 176.27 2h66 s VAL 17 N -0.64 4.54 0.94 0.00 1.01 -0.26 -1.56 120.40 124.42 2h66 s VAL 17 Ca -0.07 -1.50 -0.12 0.00 0.00 0.00 0.00 61.98 60.29 2h66 s VAL 17 Cb -0.04 -3.86 0.15 0.00 0.00 0.00 0.00 36.38 32.63 2h66 s VAL 17 CO 0.01 -0.67 1.09 -0.36 0.00 0.00 0.00 175.10 175.16 2h66 s PHE 18 N 1.46 2.12 0.14 5.22 0.40 -1.03 -1.85 117.98 124.45 2h66 s PHE 18 Ca 0.04 1.27 -0.18 0.00 -0.60 0.00 0.00 56.93 57.46 2h66 s PHE 18 Cb -0.26 -3.18 -0.02 0.00 0.51 0.00 0.00 43.02 40.07 2h66 s PHE 18 CO 0.02 -2.66 1.80 0.78 0.70 0.00 0.00 175.22 175.86 2h66 h GLY 19 N -1.74 0.43 -7.39 4.36 0.00 -1.74 -3.25 103.07 93.74 2h66 h GLY 19 Ca -0.51 -0.16 -0.28 0.00 0.00 0.00 0.00 47.33 46.38 2h66 h GLY 19 CO 0.53 0.15 0.83 -0.35 0.00 0.00 0.00 176.54 177.71 2h66 s ASP 20 N -5.47 4.64 0.00 0.19 2.15 -1.26 -4.80 116.67 112.12 2h66 s ASP 20 Ca -0.13 0.11 0.00 0.00 0.43 0.00 0.00 52.55 52.96 2h66 s ASP 20 Cb 0.10 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.18 2h66 s ASP 20 CO 0.71 -3.05 0.00 0.59 -0.17 0.00 0.00 175.17 173.25 2h66 n ASN 21 N 15.57 0.00 -5.00 -0.34 3.02 -1.23 -4.77 115.26 122.51 2h66 n ASN 21 Ca 0.37 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.74 2h66 n ASN 21 Cb 0.48 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.67 2h66 n ASN 21 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2h66 s SER 22 N 0.07 5.59 -0.01 6.41 1.04 -1.26 -4.87 113.70 120.68 2h66 s SER 22 Ca 0.00 -0.28 -0.01 0.00 0.48 0.00 0.00 55.95 56.15 2h66 s SER 22 Cb 0.00 -0.79 -0.04 0.00 0.10 0.00 0.00 66.02 65.30 2h66 s SER 22 CO 0.00 -0.83 0.09 -0.36 0.98 0.00 0.00 173.24 173.12 2h66 s PHE 23 N -2.45 3.31 0.00 5.02 2.99 -1.26 -2.46 117.98 123.13 2h66 s PHE 23 Ca 0.55 0.23 0.00 0.00 0.00 0.00 0.00 56.93 57.70 2h66 s PHE 23 Cb -0.10 -1.75 0.00 0.00 0.00 0.00 0.00 43.02 41.17 2h66 s PHE 23 CO 0.34 0.56 0.00 0.41 -0.00 0.00 0.00 175.22 176.54 2h66 n GLY 24 N 1.21 3.00 3.08 4.36 0.00 -0.60 -4.99 105.19 111.25 2h66 n GLY 24 Ca -0.13 -0.59 -0.19 0.00 0.00 0.00 0.00 46.02 45.10 2h66 n GLY 24 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2h66 s GLU 25 N 1.50 0.86 0.16 1.61 2.02 -1.26 -0.61 118.70 122.98 2h66 s GLU 25 Ca 0.00 -0.52 0.10 0.00 0.02 0.00 0.00 54.97 54.57 2h66 s GLU 25 Cb 0.00 -0.83 -0.04 0.00 0.10 0.00 0.00 34.13 33.36 2h66 s GLU 25 CO 0.00 0.22 -0.24 0.08 0.02 0.00 0.00 175.26 175.34 2h66 s VAL 26 N -0.51 2.17 -0.20 2.63 1.01 -0.08 -4.91 120.40 120.50 2h66 s VAL 26 Ca 0.02 -1.88 -0.08 0.00 0.00 0.00 0.00 61.98 60.05 2h66 s VAL 26 Cb -0.06 -1.98 0.09 0.00 0.00 0.00 0.00 36.38 34.44 2h66 s VAL 26 CO 0.00 -0.08 0.44 0.21 0.00 0.00 0.00 175.10 175.67 2h66 s ASN 27 N -2.40 -0.36 0.30 3.32 3.84 -1.26 -0.47 114.94 117.90 2h66 s ASN 27 Ca 0.16 1.03 0.01 0.00 0.21 0.00 0.00 52.86 54.27 2h66 s ASN 27 Cb -0.08 1.33 0.55 0.00 -0.55 0.00 0.00 41.25 42.49 2h66 s ASN 27 CO 0.08 -0.23 1.88 0.25 -2.79 0.00 0.00 177.10 176.29 2h66 h LEU 28 N 7.99 0.91 -1.63 3.21 7.12 -1.59 -2.34 115.31 128.99 2h66 h LEU 28 Ca -0.19 0.02 0.01 0.00 0.13 0.00 0.00 57.88 57.86 2h66 h LEU 28 Cb 1.12 -0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 41.06 2h66 h LEU 28 CO 0.14 0.54 0.27 0.74 -0.13 0.00 0.00 178.44 180.01 2h66 h THR 29 N 1.01 1.07 0.00 1.05 2.02 -1.98 -2.03 112.91 114.06 2h66 h THR 29 Ca 0.43 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.44 2h66 h THR 29 Cb 0.33 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2h66 h THR 29 CO -0.19 0.09 0.07 0.00 0.37 0.00 0.00 175.52 175.86 2h66 n GLN 30 N -4.48 0.07 -0.01 6.66 10.64 -0.88 -1.98 117.38 127.40 2h66 n GLN 30 Ca 0.03 0.54 0.10 0.00 -1.83 0.00 0.00 57.00 55.84 2h66 n GLN 30 Cb 0.10 -1.80 -0.14 0.00 -0.86 0.00 0.00 30.24 27.54 2h66 n GLN 30 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2h66 n PHE 31 N -1.85 0.00 -1.68 2.61 3.01 -0.76 -4.83 117.46 113.96 2h66 n PHE 31 Ca -0.01 0.00 -0.49 0.00 1.01 0.00 0.00 57.45 57.97 2h66 n PHE 31 Cb 0.09 -0.34 -0.05 0.00 -0.01 0.00 0.00 39.48 39.17 2h66 n PHE 31 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2h66 n ILE 32 N -2.00 0.47 0.00 4.37 2.08 -0.84 -0.30 119.36 123.13 2h66 n ILE 32 Ca -0.02 -0.08 0.00 0.00 0.56 0.00 0.00 62.75 63.21 2h66 n ILE 32 Cb 0.46 -1.77 0.00 0.00 -0.75 0.00 0.00 39.64 37.59 2h66 n ILE 32 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2h66 n GLY 33 N 4.21 3.18 0.35 7.39 0.00 0.12 -4.84 105.19 115.61 2h66 n GLY 33 Ca 0.22 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.06 2h66 n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h66 n LYS 34 N -1.80 0.43 -4.30 1.61 4.76 0.58 -5.04 118.16 114.41 2h66 n LYS 34 Ca 0.00 0.18 -0.16 0.00 -2.87 0.00 0.00 58.31 55.47 2h66 n LYS 34 Cb 0.00 -1.23 -0.10 0.00 -1.84 0.00 0.00 35.03 31.86 2h66 n LYS 34 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2h66 s LYS 35 N -2.46 1.23 0.29 1.97 1.02 -0.63 -5.05 119.74 116.10 2h66 s LYS 35 Ca -0.27 -1.59 -0.16 0.00 0.02 0.00 0.00 55.97 53.97 2h66 s LYS 35 Cb 0.09 -0.61 -0.09 0.00 -0.52 0.00 0.00 37.83 36.71 2h66 s LYS 35 CO 0.35 -0.03 0.72 0.71 -0.92 0.00 0.00 175.35 176.18 2h66 s TYR 36 N -3.39 3.45 -0.16 3.18 2.02 -0.16 -4.03 117.35 118.26 2h66 s TYR 36 Ca 0.24 1.25 0.01 0.00 -0.37 0.00 0.00 57.07 58.20 2h66 s TYR 36 Cb 0.04 -2.54 0.01 0.00 -0.40 0.00 0.00 41.96 39.07 2h66 s TYR 36 CO 0.06 0.17 -0.19 0.08 -1.57 0.00 0.00 175.55 174.10 2h66 s VAL 37 N -1.84 2.27 -0.56 0.71 1.01 -0.87 0.48 120.40 121.59 2h66 s VAL 37 Ca 0.51 -0.90 -0.14 0.00 0.00 0.00 0.00 61.98 61.45 2h66 s VAL 37 Cb -0.12 -1.93 0.14 0.00 0.00 0.00 0.00 36.38 34.46 2h66 s VAL 37 CO 0.18 0.53 0.50 -0.22 0.00 0.00 0.00 175.10 176.10 2h66 s LEU 38 N 0.95 6.13 -0.20 3.92 0.20 -0.42 -0.92 118.68 128.34 2h66 s LEU 38 Ca -0.03 -1.95 -0.20 0.00 0.69 0.00 0.00 54.13 52.64 2h66 s LEU 38 Cb -0.15 -2.16 -0.03 0.00 -0.43 0.00 0.00 46.19 43.42 2h66 s LEU 38 CO -0.04 -0.78 0.57 -0.22 -0.29 0.00 0.00 176.35 175.59 2h66 s LEU 39 N 1.34 4.14 0.13 -0.68 0.20 -0.34 -1.46 118.68 122.02 2h66 s LEU 39 Ca 0.06 0.75 0.11 0.00 0.69 0.00 0.00 54.13 55.73 2h66 s LEU 39 Cb -0.27 -2.79 -0.04 0.00 -0.43 0.00 0.00 46.19 42.66 2h66 s LEU 39 CO 0.01 -0.23 -0.26 -0.72 -0.29 0.00 0.00 176.35 174.86 2h66 s TYR 40 N 1.79 2.34 -0.02 5.38 1.13 0.24 -0.29 117.35 127.92 2h66 s TYR 40 Ca 0.26 -0.37 0.07 0.00 -1.41 0.00 0.00 57.07 55.63 2h66 s TYR 40 Cb -0.16 -1.26 -0.02 0.00 -1.10 0.00 0.00 41.96 39.43 2h66 s TYR 40 CO 0.10 0.35 -0.24 -0.06 -2.51 0.00 0.00 175.55 173.19 2h66 s PHE 41 N -1.09 2.38 0.03 -3.49 0.40 -0.12 -0.77 117.98 115.33 2h66 s PHE 41 Ca 0.15 -0.40 -0.06 0.00 -0.60 0.00 0.00 56.93 56.02 2h66 s PHE 41 Cb -0.10 -1.51 -0.01 0.00 0.51 0.00 0.00 43.02 41.91 2h66 s PHE 41 CO 0.07 0.00 0.10 1.52 0.70 0.00 0.00 175.22 177.61 2h66 s TYR 42 N -0.64 0.16 0.06 0.36 1.13 -0.62 -1.73 117.35 116.07 2h66 s TYR 42 Ca 0.10 -0.41 -0.25 0.00 -1.41 0.00 0.00 57.07 55.11 2h66 s TYR 42 Cb -0.10 -0.12 -0.16 0.00 -1.10 0.00 0.00 41.96 40.47 2h66 s TYR 42 CO -0.01 -0.33 1.61 -1.35 -2.51 0.00 0.00 175.55 172.96 2h66 h PRO 43 N 3.88 -0.10 -1.88 -3.49 0.11 -1.79 -3.39 132.00 125.34 2h66 h PRO 43 Ca -0.32 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.78 2h66 h PRO 43 Cb 1.19 0.02 -0.21 0.00 0.11 0.00 0.00 31.00 32.11 2h66 h PRO 43 CO 0.47 0.04 0.27 -0.51 -0.21 0.00 0.00 178.00 178.07 2h66 s LEU 44 N -9.95 -0.60 0.67 2.35 1.43 -1.26 -4.34 118.68 106.98 2h66 s LEU 44 Ca -0.14 0.81 -0.11 0.00 -1.03 0.00 0.00 54.13 53.66 2h66 s LEU 44 Cb 0.05 2.33 -0.01 0.00 0.03 0.00 0.00 46.19 48.59 2h66 s LEU 44 CO 0.65 -0.45 1.05 -1.81 0.23 0.00 0.00 176.35 176.02 2h66 s ASP 45 N -0.76 5.64 -1.22 2.29 1.01 -1.26 -4.28 116.67 118.09 2h66 s ASP 45 Ca -0.06 1.57 0.00 0.00 0.71 0.00 0.00 52.55 54.77 2h66 s ASP 45 Cb -0.01 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.43 2h66 s ASP 45 CO 0.05 -1.27 0.00 0.49 0.21 0.00 0.00 175.17 174.65 2h66 n PHE 46 N -2.98 0.00 -1.78 4.23 3.01 -1.26 -4.98 117.46 113.70 2h66 n PHE 46 Ca 0.07 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.23 2h66 n PHE 46 Cb 0.54 -2.19 0.07 0.00 -0.01 0.00 0.00 39.48 37.89 2h66 n PHE 46 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2h66 s THR 47 N -2.38 2.89 -0.62 4.37 2.01 -1.26 -5.00 115.64 115.65 2h66 s THR 47 Ca 0.00 0.29 0.25 0.00 0.31 0.00 0.00 61.69 62.54 2h66 s THR 47 Cb 0.00 -3.21 0.27 0.00 0.01 0.00 0.00 72.50 69.58 2h66 s THR 47 CO 0.00 -0.38 1.67 -0.26 -0.69 0.00 0.00 174.62 174.96 2h66 h PHE 48 N -0.93 0.00 -2.91 4.92 0.04 -1.96 -3.43 116.94 112.68 2h66 h PHE 48 Ca -0.46 0.00 -0.56 0.00 2.80 0.00 0.00 57.97 59.75 2h66 h PHE 48 Cb 1.28 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.41 2h66 h PHE 48 CO 0.43 0.00 0.87 0.08 -0.60 0.00 0.00 178.31 179.09 2h66 s VAL 49 N -3.15 4.09 0.40 -0.55 1.01 -1.26 -5.00 120.40 115.94 2h66 s VAL 49 Ca 0.09 1.37 -0.25 0.00 0.00 0.00 0.00 61.98 63.19 2h66 s VAL 49 Cb 0.10 -3.88 -0.08 0.00 0.00 0.00 0.00 36.38 32.52 2h66 s VAL 49 CO 0.63 -0.08 1.15 0.00 0.00 0.00 0.00 175.10 176.81 2h66 n PRO 51 N 0.04 1.37 0.15 0.00 -0.04 -1.26 -4.57 135.00 130.68 2h66 n PRO 51 Ca 0.04 -0.72 0.15 0.00 -0.04 0.00 0.00 63.50 62.93 2h66 n PRO 51 Cb 0.47 -1.28 0.72 0.00 -0.04 0.00 0.00 33.50 33.36 2h66 n PRO 51 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2h66 h SER 52 N 1.12 0.00 0.25 3.54 4.64 -1.98 -1.37 113.55 119.75 2h66 h SER 52 Ca 0.14 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 2h66 h SER 52 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2h66 h SER 52 CO 0.34 0.00 -0.12 -0.08 -0.87 0.00 0.00 176.83 176.10 2h66 h GLU 53 N 0.00 -0.33 -0.08 4.77 4.57 -1.97 0.18 114.58 121.72 2h66 h GLU 53 Ca 0.12 0.02 -0.09 0.00 -1.18 0.00 0.00 59.36 58.23 2h66 h GLU 53 Cb 0.51 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 2h66 h GLU 53 CO -0.00 -0.09 -0.38 -0.84 -1.18 0.00 0.00 179.01 176.52 2h66 h ILE 54 N -0.54 1.29 0.93 2.32 -0.00 -1.65 -1.19 117.51 118.68 2h66 h ILE 54 Ca -0.03 -1.40 -0.04 0.00 -0.00 0.00 0.00 64.86 63.38 2h66 h ILE 54 Cb 0.40 1.66 0.01 0.00 -0.00 0.00 0.00 36.82 38.88 2h66 h ILE 54 CO 0.06 0.41 -0.48 0.40 -0.00 0.00 0.00 178.15 178.54 2h66 h ILE 55 N 0.14 0.03 -0.95 0.16 1.08 -1.33 -2.24 117.51 114.39 2h66 h ILE 55 Ca 0.01 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.63 2h66 h ILE 55 Cb 0.74 0.03 -0.08 0.00 -3.07 0.00 0.00 36.82 34.43 2h66 h ILE 55 CO 0.06 0.00 0.60 0.00 -0.69 0.00 0.00 178.15 178.12 2h66 h ALA 56 N -1.25 1.70 -0.34 1.87 0.00 -0.43 0.11 119.26 120.92 2h66 h ALA 56 Ca -0.13 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 2h66 h ALA 56 Cb 1.00 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2h66 h ALA 56 CO 0.19 0.04 -0.28 -0.07 0.00 0.00 0.00 179.25 179.13 2h66 h LEU 57 N 0.82 0.72 -0.13 0.00 3.38 -1.20 -2.81 115.31 116.08 2h66 h LEU 57 Ca 0.48 -0.27 -0.23 0.00 0.09 0.00 0.00 57.88 57.95 2h66 h LEU 57 Cb 0.66 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2h66 h LEU 57 CO -0.25 0.96 -0.99 -0.78 0.09 0.00 0.00 178.44 177.46 2h66 h ASP 58 N 0.60 0.42 -1.00 -0.43 1.82 -0.24 -2.94 116.42 114.66 2h66 h ASP 58 Ca 0.08 -0.37 0.08 0.00 -0.39 0.00 0.00 57.03 56.42 2h66 h ASP 58 Cb 0.78 -0.13 -0.07 0.00 0.68 0.00 0.00 39.33 40.58 2h66 h ASP 58 CO 0.06 1.19 0.64 0.50 -1.61 0.00 0.00 179.24 180.03 2h66 h LYS 59 N 0.16 1.11 -0.64 0.28 3.64 -0.95 -1.90 116.57 118.27 2h66 h LYS 59 Ca -0.08 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2h66 h LYS 59 Cb 1.65 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 33.22 2h66 h LYS 59 CO 0.16 0.73 0.00 0.00 -2.27 0.00 0.00 179.45 178.08 2h66 n ALA 60 N -2.36 2.77 0.10 5.00 0.00 -1.07 -4.60 120.51 120.35 2h66 n ALA 60 Ca 0.16 -0.54 0.14 0.00 0.00 0.00 0.00 53.44 53.20 2h66 n ALA 60 Cb 0.22 -1.02 0.65 0.00 0.00 0.00 0.00 19.45 19.30 2h66 n ALA 60 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2h66 h LEU 61 N 1.32 0.03 -0.31 0.00 7.12 -1.28 -2.03 115.31 120.16 2h66 h LEU 61 Ca 0.00 0.00 -0.20 0.00 0.13 0.00 0.00 57.88 57.81 2h66 h LEU 61 Cb 0.73 -0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.86 2h66 h LEU 61 CO 0.10 0.02 -0.72 0.44 -0.13 0.00 0.00 178.44 178.15 2h66 h ASP 62 N 0.04 0.71 -0.99 1.25 3.32 -1.85 -2.58 116.42 116.33 2h66 h ASP 62 Ca 0.15 -0.45 0.17 0.00 0.02 0.00 0.00 57.03 56.92 2h66 h ASP 62 Cb 0.55 -0.21 -0.09 0.00 0.22 0.00 0.00 39.33 39.79 2h66 h ASP 62 CO -0.01 1.22 0.62 0.00 -1.72 0.00 0.00 179.24 179.35 2h66 h ALA 63 N 0.77 1.70 0.00 3.45 0.00 -1.73 -0.03 119.26 123.42 2h66 h ALA 63 Ca -0.03 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2h66 h ALA 63 Cb 1.32 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2h66 h ALA 63 CO 0.14 -0.03 -0.30 0.74 0.00 0.00 0.00 179.25 179.80 2h66 h PHE 64 N 0.78 0.00 0.04 0.00 -1.00 -1.40 -3.09 116.94 112.28 2h66 h PHE 64 Ca 0.54 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 61.08 2h66 h PHE 64 Cb 0.81 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.37 2h66 h PHE 64 CO -0.00 0.30 -1.03 0.45 -1.61 0.00 0.00 178.31 176.42 2h66 h HIS 65 N 0.00 0.52 -0.66 -0.55 3.86 -0.77 0.13 115.15 117.68 2h66 h HIS 65 Ca -0.00 -0.31 -0.01 0.00 -1.16 0.00 0.00 60.37 58.88 2h66 h HIS 65 Cb 0.95 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 29.34 2h66 h HIS 65 CO 0.00 1.16 0.37 0.93 0.86 0.00 0.00 177.93 181.26 2h66 h GLU 66 N 0.16 0.91 -0.29 2.45 5.08 -0.99 -2.11 114.58 119.78 2h66 h GLU 66 Ca -0.09 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2h66 h GLU 66 Cb 1.70 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.76 2h66 h GLU 66 CO 0.17 0.66 0.00 0.54 -1.00 0.00 0.00 179.01 179.38 2h66 n ARG 67 N -4.38 1.91 -2.61 2.33 5.12 -1.19 -4.93 116.66 112.90 2h66 n ARG 67 Ca 0.07 -1.39 -0.16 0.00 -1.93 0.00 0.00 57.85 54.43 2h66 n ARG 67 Cb 0.09 -1.38 0.01 0.00 -1.16 0.00 0.00 32.46 30.02 2h66 n ARG 67 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2h66 n ASN 68 N 0.62 -4.80 -4.49 0.55 4.05 -0.79 -4.84 115.26 105.55 2h66 n ASN 68 Ca 0.16 -0.13 -0.36 0.00 0.45 0.00 0.00 54.58 54.69 2h66 n ASN 68 Cb 0.37 -3.77 -0.12 0.00 1.23 0.00 0.00 39.78 37.50 2h66 n ASN 68 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 2h66 s VAL 69 N -2.91 4.46 -0.27 3.44 -7.23 0.46 -0.99 120.40 117.36 2h66 s VAL 69 Ca 0.14 -0.13 -0.29 0.00 -1.81 0.00 0.00 61.98 59.89 2h66 s VAL 69 Cb -0.06 -3.07 0.01 0.00 0.56 0.00 0.00 36.38 33.81 2h66 s VAL 69 CO 0.17 0.36 1.17 -0.70 -0.31 0.00 0.00 175.10 175.78 2h66 s GLU 70 N 1.37 4.09 -0.05 4.82 2.56 0.18 -4.33 118.70 127.34 2h66 s GLU 70 Ca 0.05 1.29 -0.28 0.00 0.00 0.00 0.00 54.97 56.03 2h66 s GLU 70 Cb -0.15 -3.76 -0.03 0.00 2.00 0.00 0.00 34.13 32.19 2h66 s GLU 70 CO 0.04 -0.87 0.91 -1.17 -0.56 0.00 0.00 175.26 173.61 2h66 s LEU 71 N 3.73 4.32 -0.07 2.70 0.20 -1.26 -1.30 118.68 127.00 2h66 s LEU 71 Ca 0.50 1.49 -0.01 0.00 0.69 0.00 0.00 54.13 56.81 2h66 s LEU 71 Cb -0.16 -3.44 0.03 0.00 -0.43 0.00 0.00 46.19 42.19 2h66 s LEU 71 CO 0.16 -0.28 -0.02 -0.76 -0.29 0.00 0.00 176.35 175.16 2h66 s LEU 72 N 1.26 0.82 0.02 -0.68 1.43 -0.54 -3.98 118.68 117.00 2h66 s LEU 72 Ca 0.47 -0.12 -0.07 0.00 -1.03 0.00 0.00 54.13 53.38 2h66 s LEU 72 Cb -0.19 -0.49 -0.05 0.00 0.03 0.00 0.00 46.19 45.49 2h66 s LEU 72 CO 0.23 -0.16 0.29 -0.83 0.23 0.00 0.00 176.35 176.11 2h66 s GLY 73 N 1.72 2.27 -0.04 -3.19 0.00 -0.92 -0.59 107.32 106.57 2h66 s GLY 73 Ca 0.02 -0.53 -0.05 0.00 0.00 0.00 0.00 44.72 44.15 2h66 s GLY 73 CO -0.04 -0.33 0.14 0.00 0.00 0.00 0.00 173.10 172.86 2h66 s SER 75 N -0.27 -0.10 0.00 0.00 0.15 -1.22 -1.59 113.70 110.67 2h66 s SER 75 Ca -0.04 -0.48 0.30 0.00 0.70 0.00 0.00 55.95 56.43 2h66 s SER 75 Cb -0.03 0.43 1.49 0.00 -1.71 0.00 0.00 66.02 66.21 2h66 s SER 75 CO 0.00 -0.83 2.02 1.33 1.20 0.00 0.00 173.24 176.96 2h66 n VAL 76 N -0.18 0.00 -0.71 4.45 0.24 -1.26 -0.51 118.33 120.36 2h66 n VAL 76 Ca -0.15 -0.02 -0.31 0.00 -2.04 0.00 0.00 64.34 61.82 2h66 n VAL 76 Cb 0.63 -0.36 0.17 0.00 -1.47 0.00 0.00 33.84 32.81 2h66 n VAL 76 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2h66 s ASP 77 N -2.43 2.91 0.72 -1.34 1.01 -1.26 -3.82 116.67 112.45 2h66 s ASP 77 Ca 0.32 2.16 -0.11 0.00 0.71 0.00 0.00 52.55 55.63 2h66 s ASP 77 Cb 0.21 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 41.59 2h66 s ASP 77 CO 0.45 -3.11 1.08 -0.94 0.21 0.00 0.00 175.17 172.86 2h66 s SER 78 N -2.69 5.31 0.52 0.27 1.04 -1.26 -3.84 113.70 113.04 2h66 s SER 78 Ca 0.67 1.29 0.24 0.00 0.48 0.00 0.00 55.95 58.63 2h66 s SER 78 Cb -0.23 -2.12 1.36 0.00 0.10 0.00 0.00 66.02 65.13 2h66 s SER 78 CO 0.58 -1.45 1.98 0.07 0.98 0.00 0.00 173.24 175.40 2h66 h LYS 79 N -0.73 0.05 -0.23 4.02 2.10 -1.93 -2.55 116.57 117.31 2h66 h LYS 79 Ca -0.45 -0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.01 2h66 h LYS 79 Cb 1.24 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2h66 h LYS 79 CO 0.61 0.04 -0.59 1.88 -2.00 0.00 0.00 179.45 179.39 2h66 h TYR 80 N 0.05 0.97 -0.51 0.07 -1.99 -1.99 -1.72 116.97 111.86 2h66 h TYR 80 Ca 0.28 -0.36 -0.05 0.00 2.00 0.00 0.00 58.73 60.60 2h66 h TYR 80 Cb 1.04 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 39.57 2h66 h TYR 80 CO -0.00 1.17 0.11 1.15 -0.00 0.00 0.00 178.16 180.58 2h66 h THR 81 N 0.57 1.22 0.35 -2.88 2.02 -1.87 -0.07 112.91 112.25 2h66 h THR 81 Ca 0.00 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.34 2h66 h THR 81 Cb 1.19 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 2h66 h THR 81 CO 0.12 0.30 -0.17 0.45 0.37 0.00 0.00 175.52 176.60 2h66 h HIS 82 N 0.76 -0.44 -0.48 3.16 3.86 -1.22 -0.79 115.15 120.01 2h66 h HIS 82 Ca 0.17 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.43 2h66 h HIS 82 Cb 0.31 0.15 -0.06 0.00 1.06 0.00 0.00 27.41 28.87 2h66 h HIS 82 CO 0.02 -0.26 0.17 1.25 0.86 0.00 0.00 177.93 179.97 2h66 h LEU 83 N -0.50 0.17 -1.33 2.43 5.85 -1.22 -1.11 115.31 119.60 2h66 h LEU 83 Ca -0.05 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2h66 h LEU 83 Cb 0.38 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2h66 h LEU 83 CO 0.08 0.12 0.20 0.00 -0.34 0.00 0.00 178.44 178.50 2h66 h ALA 84 N 1.32 1.48 -0.29 1.25 0.00 -0.82 -1.36 119.26 120.85 2h66 h ALA 84 Ca 0.23 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2h66 h ALA 84 Cb 0.24 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2h66 h ALA 84 CO -0.24 0.41 -0.05 2.35 0.00 0.00 0.00 179.25 181.71 2h66 h TRP 85 N 0.66 0.61 -0.88 0.00 7.01 -0.45 -2.55 115.95 120.34 2h66 h TRP 85 Ca 0.16 -0.13 0.08 0.00 2.11 0.00 0.00 58.89 61.11 2h66 h TRP 85 Cb 0.11 -0.15 -0.07 0.00 -2.10 0.00 0.00 29.16 26.95 2h66 h TRP 85 CO 0.01 0.73 0.54 0.87 -2.79 0.00 0.00 178.44 177.80 2h66 h LYS 86 N 0.31 0.92 -0.17 2.65 1.57 -0.67 -1.83 116.57 119.36 2h66 h LYS 86 Ca 0.08 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2h66 h LYS 86 Cb 0.53 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2h66 h LYS 86 CO 0.03 0.61 0.00 1.63 -0.57 0.00 0.00 179.45 181.15 2h66 n LYS 87 N -4.64 1.24 -4.01 3.15 5.02 -0.56 -3.21 118.16 115.15 2h66 n LYS 87 Ca 0.14 -0.33 -0.35 0.00 -2.02 0.00 0.00 58.31 55.75 2h66 n LYS 87 Cb 0.22 -1.12 -0.09 0.00 -0.02 0.00 0.00 35.03 34.02 2h66 n LYS 87 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2h66 s THR 88 N -1.82 4.81 0.61 -0.18 2.01 -0.71 -5.04 115.64 115.33 2h66 s THR 88 Ca 0.06 -0.03 -0.17 0.00 0.31 0.00 0.00 61.69 61.87 2h66 s THR 88 Cb 0.03 -3.16 -0.02 0.00 0.01 0.00 0.00 72.50 69.36 2h66 s THR 88 CO 0.04 0.47 1.12 -2.16 -0.69 0.00 0.00 174.62 173.41 2h66 s PRO 89 N 0.25 3.01 0.40 4.92 0.04 -1.26 -3.01 135.00 139.35 2h66 s PRO 89 Ca 0.04 1.51 0.10 0.00 0.04 0.00 0.00 61.00 62.68 2h66 s PRO 89 Cb -0.12 -1.97 0.85 0.00 0.04 0.00 0.00 34.50 33.30 2h66 s PRO 89 CO 0.00 -1.10 1.97 -0.07 0.04 0.00 0.00 177.00 177.84 2h66 h LEU 90 N 0.53 0.25 -1.76 -3.56 4.07 -1.93 -1.20 115.31 111.70 2h66 h LEU 90 Ca -0.48 -0.04 0.18 0.00 0.08 0.00 0.00 57.88 57.62 2h66 h LEU 90 Cb 1.26 -0.06 -0.04 0.00 1.08 0.00 0.00 40.66 42.89 2h66 h LEU 90 CO 0.55 0.34 0.51 0.00 -1.08 0.00 0.00 178.44 178.76 2h66 h ALA 91 N 1.70 2.37 -0.85 1.53 0.00 -1.92 -0.68 119.26 121.41 2h66 h ALA 91 Ca 0.06 -0.01 -0.41 0.00 0.00 0.00 0.00 54.91 54.55 2h66 h ALA 91 Cb 0.26 -0.00 -0.24 0.00 0.00 0.00 0.00 17.79 17.80 2h66 h ALA 91 CO 0.01 -0.58 0.47 1.63 0.00 0.00 0.00 179.25 180.78 2h66 n LYS 92 N -4.42 2.46 -1.17 0.00 5.02 -0.56 -4.94 118.16 114.55 2h66 n LYS 92 Ca 0.15 -3.05 -0.06 0.00 -2.02 0.00 0.00 58.31 53.33 2h66 n LYS 92 Cb 0.66 -2.13 -0.02 0.00 -0.02 0.00 0.00 35.03 33.52 2h66 n LYS 92 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2h66 n GLY 93 N -0.96 0.82 4.00 0.72 0.00 -0.26 -4.91 105.19 104.59 2h66 n GLY 93 Ca 0.52 -0.80 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 2h66 n GLY 93 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h66 s GLY 94 N -2.94 1.76 0.00 -0.02 0.00 -0.57 -4.74 107.32 100.81 2h66 s GLY 94 Ca 0.00 -1.79 0.15 0.00 0.00 0.00 0.00 44.72 43.08 2h66 s GLY 94 CO 0.00 -1.26 0.85 0.29 0.00 0.00 0.00 173.10 172.98 2h66 n ILE 95 N -2.69 0.00 -1.22 0.90 -5.35 -1.08 -3.87 119.36 106.06 2h66 n ILE 95 Ca 0.15 -0.38 0.10 0.00 -0.27 0.00 0.00 62.75 62.35 2h66 n ILE 95 Cb 0.61 1.21 -0.03 0.00 -1.74 0.00 0.00 39.64 39.69 2h66 n ILE 95 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2h66 n GLY 96 N 1.06 -1.99 3.55 3.28 0.00 -1.16 -4.34 105.19 105.58 2h66 n GLY 96 Ca 0.07 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.35 2h66 n GLY 96 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2h66 s ASN 97 N -4.89 6.84 0.53 1.61 3.04 -1.24 -4.46 114.94 116.36 2h66 s ASN 97 Ca 0.00 -2.42 -0.20 0.00 0.04 0.00 0.00 52.86 50.29 2h66 s ASN 97 Cb 0.00 -2.53 -0.07 0.00 -1.54 0.00 0.00 41.25 37.11 2h66 s ASN 97 CO 0.00 -1.12 1.10 0.27 -3.04 0.00 0.00 177.10 174.31 2h66 s ILE 98 N 3.71 3.37 -0.74 -5.21 -4.36 -1.26 -4.96 121.20 111.74 2h66 s ILE 98 Ca 0.50 0.85 0.23 0.00 -0.26 0.00 0.00 60.65 61.97 2h66 s ILE 98 Cb 0.02 -3.34 -0.07 0.00 1.25 0.00 0.00 42.46 40.32 2h66 s ILE 98 CO 0.03 -0.19 1.16 2.29 0.24 0.00 0.00 174.94 178.48 2h66 n LYS 99 N -1.21 0.19 -2.83 0.37 -0.00 -1.26 -4.47 118.16 108.95 2h66 n LYS 99 Ca 0.11 0.01 -0.27 0.00 -0.00 0.00 0.00 58.31 58.17 2h66 n LYS 99 Cb 0.51 -1.58 -0.00 0.00 -0.00 0.00 0.00 35.03 33.96 2h66 n LYS 99 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.40 174.02 2h66 s HIS 100 N -3.13 3.55 0.09 5.58 -3.43 -1.26 -3.57 115.29 113.11 2h66 s HIS 100 Ca 0.06 0.70 -0.22 0.00 -0.80 0.00 0.00 55.06 54.80 2h66 s HIS 100 Cb 0.15 -2.20 -0.07 0.00 -1.43 0.00 0.00 32.58 29.03 2h66 s HIS 100 CO 0.77 -0.17 0.66 -0.08 -2.00 0.00 0.00 174.74 173.91 2h66 s THR 101 N -2.63 4.64 -0.18 -5.38 -1.32 -1.26 -4.28 115.64 105.24 2h66 s THR 101 Ca 0.46 1.42 -0.05 0.00 -1.21 0.00 0.00 61.69 62.30 2h66 s THR 101 Cb -0.10 -4.00 -0.03 0.00 -1.51 0.00 0.00 72.50 66.85 2h66 s THR 101 CO 0.42 0.50 0.01 -0.76 -2.21 0.00 0.00 174.62 172.59 2h66 s LEU 102 N -0.87 3.43 0.17 9.08 1.43 -0.77 -2.16 118.68 128.99 2h66 s LEU 102 Ca 0.32 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 53.32 2h66 s LEU 102 Cb -0.21 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 2h66 s LEU 102 CO 0.21 0.13 0.36 -0.76 0.23 0.00 0.00 176.35 176.52 2h66 s LEU 103 N 0.64 4.26 -0.20 1.79 1.43 0.29 -1.10 118.68 125.78 2h66 s LEU 103 Ca 0.00 0.41 -0.03 0.00 -1.03 0.00 0.00 54.13 53.48 2h66 s LEU 103 Cb -0.14 -3.16 -0.01 0.00 0.03 0.00 0.00 46.19 42.92 2h66 s LEU 103 CO 0.02 0.01 -0.07 -0.55 0.23 0.00 0.00 176.35 175.98 2h66 s SER 104 N -2.94 4.14 -0.84 2.29 0.15 -0.40 -3.38 113.70 112.71 2h66 s SER 104 Ca 0.38 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.64 2h66 s SER 104 Cb -0.11 -1.69 0.34 0.00 -1.71 0.00 0.00 66.02 62.85 2h66 s SER 104 CO 0.28 0.02 1.65 -0.67 1.20 0.00 0.00 173.24 175.71 2h66 n ASP 105 N 4.54 6.62 -0.17 5.45 4.64 0.34 -4.23 116.55 133.74 2h66 n ASP 105 Ca -0.18 -3.73 0.17 0.00 -1.38 0.00 0.00 54.79 49.67 2h66 n ASP 105 Cb 0.51 -0.96 0.53 0.00 -1.04 0.00 0.00 41.12 40.16 2h66 n ASP 105 CO 0.00 0.00 0.00 -0.29 -0.82 0.00 0.00 177.20 176.09 2h66 h ILE 106 N 2.34 0.76 -0.01 5.18 6.09 -1.75 0.39 117.51 130.50 2h66 h ILE 106 Ca 0.45 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 63.81 2h66 h ILE 106 Cb 0.34 0.36 0.00 0.00 0.47 0.00 0.00 36.82 37.99 2h66 h ILE 106 CO 1.15 0.07 -0.17 0.35 -3.07 0.00 0.00 178.15 176.47 2h66 n THR 107 N -4.47 0.00 -0.85 2.19 -2.24 -1.26 -4.91 114.28 102.75 2h66 n THR 107 Ca 0.15 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2h66 n THR 107 Cb 0.59 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2h66 n THR 107 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2h66 n LYS 108 N -0.54 -0.85 0.13 -0.78 5.02 0.14 -4.89 118.16 116.38 2h66 n LYS 108 Ca 0.14 0.21 -0.02 0.00 -2.02 0.00 0.00 58.31 56.63 2h66 n LYS 108 Cb 0.33 -4.26 0.17 0.00 -0.02 0.00 0.00 35.03 31.25 2h66 n LYS 108 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2h66 h SER 109 N 0.00 0.06 -0.18 4.39 4.64 -1.91 -2.54 113.55 118.00 2h66 h SER 109 Ca 0.00 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 2h66 h SER 109 Cb 0.42 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 2h66 h SER 109 CO 0.00 0.64 0.02 0.40 -0.87 0.00 0.00 176.83 177.03 2h66 h ILE 110 N 0.04 1.23 -0.65 0.95 2.04 -1.90 0.55 117.51 119.77 2h66 h ILE 110 Ca -0.01 -0.75 0.06 0.00 1.00 0.00 0.00 64.86 65.16 2h66 h ILE 110 Cb 1.07 1.37 -0.05 0.00 -0.74 0.00 0.00 36.82 38.47 2h66 h ILE 110 CO 0.08 0.23 0.36 0.28 0.00 0.00 0.00 178.15 179.10 2h66 h SER 111 N 0.09 0.53 -0.07 1.72 0.02 -1.90 -1.49 113.55 112.45 2h66 h SER 111 Ca 0.06 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2h66 h SER 111 Cb 0.33 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 2h66 h SER 111 CO 0.00 0.35 0.04 0.11 -1.14 0.00 0.00 176.83 176.19 2h66 h LYS 112 N 0.66 0.10 -0.89 3.45 1.57 -1.29 -0.82 116.57 119.35 2h66 h LYS 112 Ca 0.29 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 59.16 2h66 h LYS 112 Cb 0.17 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.40 2h66 h LYS 112 CO -0.18 0.16 0.58 -0.44 -0.57 0.00 0.00 179.45 179.00 2h66 h ASP 113 N 0.02 0.79 -0.26 0.86 3.32 -0.58 -0.56 116.42 120.02 2h66 h ASP 113 Ca 0.03 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2h66 h ASP 113 Cb 0.09 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2h66 h ASP 113 CO -0.00 0.46 0.00 -1.22 -1.72 0.00 0.00 179.24 176.76 2h66 n TYR 114 N -4.53 0.34 -3.75 4.55 4.02 -0.59 -4.87 117.16 112.32 2h66 n TYR 114 Ca 0.15 -0.17 -0.27 0.00 -0.01 0.00 0.00 57.90 57.61 2h66 n TYR 114 Cb 0.32 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.69 2h66 n TYR 114 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2h66 n ASN 115 N 0.37 -5.16 -0.11 7.72 5.03 -0.22 -4.92 115.26 117.96 2h66 n ASN 115 Ca 0.13 -0.68 0.04 0.00 0.87 0.00 0.00 54.58 54.94 2h66 n ASN 115 Cb 0.29 -4.43 0.06 0.00 -1.02 0.00 0.00 39.78 34.68 2h66 n ASN 115 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 2h66 n VAL 116 N -4.78 1.06 -2.90 2.41 0.24 -0.36 -5.03 118.33 108.98 2h66 n VAL 116 Ca -0.00 -1.22 -0.41 0.00 -2.04 0.00 0.00 64.34 60.67 2h66 n VAL 116 Cb 0.55 0.26 -0.04 0.00 -1.47 0.00 0.00 33.84 33.15 2h66 n VAL 116 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2h66 s LEU 117 N -1.46 4.37 -0.20 1.34 0.20 -1.22 0.10 118.68 121.80 2h66 s LEU 117 Ca 0.13 1.43 -0.07 0.00 0.69 0.00 0.00 54.13 56.31 2h66 s LEU 117 Cb 0.11 -3.31 -0.04 0.00 -0.43 0.00 0.00 46.19 42.53 2h66 s LEU 117 CO 0.01 -0.15 0.05 0.12 -0.29 0.00 0.00 176.35 176.10 2h66 s PHE 118 N 0.70 3.17 -1.65 5.38 2.19 0.88 -4.66 117.98 123.99 2h66 s PHE 118 Ca 0.43 -0.12 -0.13 0.00 0.33 0.00 0.00 56.93 57.45 2h66 s PHE 118 Cb -0.20 -2.12 0.11 0.00 -1.31 0.00 0.00 43.02 39.51 2h66 s PHE 118 CO 0.23 -0.03 0.55 -0.25 1.83 0.00 0.00 175.22 177.54 2h66 n ASP 119 N 3.99 -1.69 -2.09 6.13 10.43 -1.26 -1.85 116.55 130.21 2h66 n ASP 119 Ca -0.16 -1.10 -0.11 0.00 2.57 0.00 0.00 54.79 55.98 2h66 n ASP 119 Cb 0.52 -2.42 -0.02 0.00 1.84 0.00 0.00 41.12 41.04 2h66 n ASP 119 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 2h66 n ASP 120 N -2.73 -3.45 0.00 -2.24 10.43 -1.26 -4.77 116.55 112.53 2h66 n ASP 120 Ca -0.07 0.24 0.00 0.00 2.57 0.00 0.00 54.79 57.53 2h66 n ASP 120 Cb 0.56 -3.04 0.00 0.00 1.84 0.00 0.00 41.12 40.48 2h66 n ASP 120 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 2h66 n SER 121 N -1.31 0.07 -4.26 -2.24 7.64 -0.77 -5.14 113.62 107.61 2h66 n SER 121 Ca -0.13 0.01 -0.14 0.00 1.01 0.00 0.00 58.87 59.63 2h66 n SER 121 Cb 0.53 -0.02 -0.10 0.00 -1.01 0.00 0.00 64.21 63.61 2h66 n SER 121 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2h66 s VAL 122 N -1.07 0.46 0.21 0.44 -7.23 -1.21 -4.94 120.40 107.07 2h66 s VAL 122 Ca 0.00 -1.98 -0.00 0.00 -1.81 0.00 0.00 61.98 58.19 2h66 s VAL 122 Cb 0.00 -2.38 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 2h66 s VAL 122 CO 0.00 -0.21 0.39 -0.94 -0.31 0.00 0.00 175.10 174.03 2h66 s SER 123 N -3.21 6.37 0.94 4.85 1.04 -1.26 -0.08 113.70 122.34 2h66 s SER 123 Ca 0.32 0.37 -0.13 0.00 0.48 0.00 0.00 55.95 56.98 2h66 s SER 123 Cb 0.07 -1.99 0.15 0.00 0.10 0.00 0.00 66.02 64.35 2h66 s SER 123 CO 0.09 -0.06 1.16 -0.76 0.98 0.00 0.00 173.24 174.65 2h66 s LEU 124 N -3.44 2.01 0.03 2.42 1.43 0.11 -3.54 118.68 117.71 2h66 s LEU 124 Ca 0.38 0.84 -0.30 0.00 -1.03 0.00 0.00 54.13 54.02 2h66 s LEU 124 Cb -0.11 -3.09 -0.04 0.00 0.03 0.00 0.00 46.19 42.98 2h66 s LEU 124 CO 0.29 -2.67 1.05 -0.13 0.23 0.00 0.00 176.35 175.12 2h66 s ARG 125 N -5.39 4.54 -0.08 1.70 0.52 -1.09 -3.96 118.95 115.19 2h66 s ARG 125 Ca 0.65 1.53 -0.19 0.00 -0.52 0.00 0.00 55.73 57.21 2h66 s ARG 125 Cb -0.13 -3.41 0.04 0.00 0.52 0.00 0.00 34.95 31.97 2h66 s ARG 125 CO 0.53 -0.08 0.45 0.00 0.02 0.00 0.00 175.30 176.21 2h66 s ALA 126 N 0.89 -1.13 -0.05 2.13 0.00 -0.71 -0.89 121.76 122.00 2h66 s ALA 126 Ca 0.53 0.88 0.03 0.00 0.00 0.00 0.00 51.96 53.40 2h66 s ALA 126 Cb -0.24 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.66 2h66 s ALA 126 CO 0.29 -0.27 -0.12 -0.06 0.00 0.00 0.00 175.76 175.60 2h66 s PHE 127 N -0.77 1.32 -0.11 0.00 0.40 -0.10 -0.94 117.98 117.78 2h66 s PHE 127 Ca -0.08 -0.42 -0.01 0.00 -0.60 0.00 0.00 56.93 55.82 2h66 s PHE 127 Cb -0.03 -0.95 0.03 0.00 0.51 0.00 0.00 43.02 42.57 2h66 s PHE 127 CO 0.04 -0.20 -0.07 0.08 0.70 0.00 0.00 175.22 175.78 2h66 s VAL 128 N 0.42 0.97 -0.36 -0.44 1.01 0.60 -1.07 120.40 121.54 2h66 s VAL 128 Ca -0.09 -0.25 -0.12 0.00 0.00 0.00 0.00 61.98 61.52 2h66 s VAL 128 Cb -0.13 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.26 2h66 s VAL 128 CO 0.02 0.36 0.22 -0.22 0.00 0.00 0.00 175.10 175.48 2h66 s LEU 129 N 1.73 4.59 -0.17 3.92 2.96 -0.58 -1.20 118.68 129.93 2h66 s LEU 129 Ca 0.05 -0.72 -0.09 0.00 -0.22 0.00 0.00 54.13 53.15 2h66 s LEU 129 Cb -0.13 -2.07 -0.05 0.00 0.50 0.00 0.00 46.19 44.45 2h66 s LEU 129 CO -0.08 -0.31 0.13 -0.63 -1.32 0.00 0.00 176.35 174.14 2h66 s ILE 130 N 1.63 5.44 0.76 6.68 1.01 -0.09 -0.90 121.20 135.73 2h66 s ILE 130 Ca 0.04 0.20 -0.15 0.00 0.00 0.00 0.00 60.65 60.74 2h66 s ILE 130 Cb -0.18 -3.45 0.03 0.00 0.01 0.00 0.00 42.46 38.88 2h66 s ILE 130 CO 0.08 0.50 1.06 0.47 0.00 0.00 0.00 174.94 177.05 2h66 n ASP 131 N 3.01 0.73 0.25 3.58 9.92 0.13 -2.06 116.55 132.13 2h66 n ASP 131 Ca -0.17 0.64 0.17 0.00 -0.53 0.00 0.00 54.79 54.89 2h66 n ASP 131 Cb 0.53 -1.45 0.77 0.00 -0.64 0.00 0.00 41.12 40.33 2h66 n ASP 131 CO 0.00 0.00 0.00 0.24 0.13 0.00 0.00 177.20 177.57 2h66 h MET 132 N -0.48 0.00 -0.64 -1.24 2.86 -1.89 0.23 114.93 113.77 2h66 h MET 132 Ca -0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 2h66 h MET 132 Cb 1.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.98 2h66 h MET 132 CO 0.47 0.00 0.00 0.09 1.06 0.00 0.00 176.91 178.53 2h66 n ASN 133 N -3.15 4.30 -2.05 1.22 3.02 -1.26 -0.70 115.26 116.64 2h66 n ASN 133 Ca 0.01 -2.48 -0.19 0.00 -0.03 0.00 0.00 54.58 51.89 2h66 n ASN 133 Cb 0.48 -0.56 -0.02 0.00 -0.61 0.00 0.00 39.78 39.07 2h66 n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2h66 n GLY 134 N 0.88 -0.00 3.80 7.41 0.00 0.81 -4.98 105.19 113.11 2h66 n GLY 134 Ca 0.22 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 2h66 n GLY 134 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h66 s ILE 135 N -2.91 5.25 -0.11 -0.61 -1.09 -1.26 -1.38 121.20 119.09 2h66 s ILE 135 Ca 0.00 0.59 -0.29 0.00 -2.23 0.00 0.00 60.65 58.73 2h66 s ILE 135 Cb 0.00 -3.62 -0.01 0.00 -1.58 0.00 0.00 42.46 37.25 2h66 s ILE 135 CO 0.00 0.50 0.97 -0.69 -1.23 0.00 0.00 174.94 174.49 2h66 s VAL 136 N -0.38 4.81 -0.03 2.92 1.01 0.98 0.22 120.40 129.93 2h66 s VAL 136 Ca 0.19 1.96 0.14 0.00 0.00 0.00 0.00 61.98 64.27 2h66 s VAL 136 Cb -0.14 -4.28 -0.21 0.00 0.00 0.00 0.00 36.38 31.75 2h66 s VAL 136 CO 0.07 0.02 0.27 0.00 0.00 0.00 0.00 175.10 175.47 2h66 n GLN 137 N 4.97 0.57 -3.68 2.72 1.13 -0.07 -0.63 117.38 122.38 2h66 n GLN 137 Ca 0.08 -0.11 -0.11 0.00 -1.94 0.00 0.00 57.00 54.92 2h66 n GLN 137 Cb 0.49 -1.33 -0.09 0.00 0.11 0.00 0.00 30.24 29.42 2h66 n GLN 137 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 2h66 s HIS 138 N -2.89 -0.69 -0.04 1.08 5.04 -1.23 -4.89 115.29 111.67 2h66 s HIS 138 Ca -0.05 1.51 0.02 0.00 -1.54 0.00 0.00 55.06 54.99 2h66 s HIS 138 Cb 0.08 0.32 0.02 0.00 0.04 0.00 0.00 32.58 33.04 2h66 s HIS 138 CO 0.57 -0.36 -0.07 -1.17 -2.34 0.00 0.00 174.74 171.37 2h66 s LEU 139 N 1.04 1.51 -0.03 8.88 2.96 -1.26 -1.52 118.68 130.26 2h66 s LEU 139 Ca -0.06 -0.18 0.04 0.00 -0.22 0.00 0.00 54.13 53.71 2h66 s LEU 139 Cb -0.06 -0.55 -0.01 0.00 0.50 0.00 0.00 46.19 46.07 2h66 s LEU 139 CO -0.09 -0.01 -0.16 -0.22 -1.32 0.00 0.00 176.35 174.55 2h66 s LEU 140 N 0.68 1.93 -0.03 -0.68 2.96 -0.23 -4.97 118.68 118.35 2h66 s LEU 140 Ca -0.11 -0.32 0.02 0.00 -0.22 0.00 0.00 54.13 53.50 2h66 s LEU 140 Cb -0.13 -0.90 0.00 0.00 0.50 0.00 0.00 46.19 45.66 2h66 s LEU 140 CO 0.01 0.16 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.43 2h66 s VAL 141 N -0.06 0.71 -0.05 1.68 1.01 -1.26 -0.93 120.40 121.50 2h66 s VAL 141 Ca -0.01 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.68 2h66 s VAL 141 Cb -0.10 -0.64 0.01 0.00 0.00 0.00 0.00 36.38 35.66 2h66 s VAL 141 CO 0.01 0.23 -0.10 0.20 0.00 0.00 0.00 175.10 175.43 2h66 s ASN 142 N 0.24 1.52 0.38 3.32 0.01 -0.07 -5.00 114.94 115.34 2h66 s ASN 142 Ca -0.04 -0.25 0.25 0.00 -0.71 0.00 0.00 52.86 52.12 2h66 s ASN 142 Cb -0.09 -0.62 0.59 0.00 0.41 0.00 0.00 41.25 41.55 2h66 s ASN 142 CO 0.00 0.03 1.70 -1.13 -1.51 0.00 0.00 177.10 176.19 2h66 h ASN 143 N 6.81 0.00 -3.60 -1.22 -1.24 -1.99 -2.87 115.58 111.47 2h66 h ASN 143 Ca -0.33 0.00 -0.46 0.00 0.71 0.00 0.00 56.30 56.22 2h66 h ASN 143 Cb 1.18 0.00 -0.17 0.00 0.73 0.00 0.00 38.32 40.06 2h66 h ASN 143 CO 0.48 0.00 -0.76 -0.76 -1.29 0.00 0.00 177.43 175.10 2h66 s LEU 144 N -5.69 2.47 -1.09 0.34 1.43 -1.26 -4.93 118.68 109.96 2h66 s LEU 144 Ca 0.07 -0.90 -0.10 0.00 -1.03 0.00 0.00 54.13 52.17 2h66 s LEU 144 Cb 0.08 -0.68 -0.07 0.00 0.03 0.00 0.00 46.19 45.54 2h66 s LEU 144 CO 0.63 -0.12 2.27 0.00 0.23 0.00 0.00 176.35 179.36 2h66 n ALA 145 N 0.13 5.18 -2.94 4.21 0.00 -1.26 -4.86 120.51 120.97 2h66 n ALA 145 Ca -0.12 -2.64 -0.24 0.00 0.00 0.00 0.00 53.44 50.44 2h66 n ALA 145 Cb 0.58 -3.21 -0.03 0.00 0.00 0.00 0.00 19.45 16.80 2h66 n ALA 145 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2h66 s ILE 146 N 3.36 5.29 0.00 0.00 -0.00 -1.26 -5.11 121.20 123.48 2h66 s ILE 146 Ca 0.49 -0.77 0.00 0.00 -0.00 0.00 0.00 60.65 60.37 2h66 s ILE 146 Cb 0.13 -3.79 0.00 0.00 -0.00 0.00 0.00 42.46 38.80 2h66 s ILE 146 CO -0.02 -0.20 0.00 0.61 -0.00 0.00 0.00 174.94 175.33 2h66 n GLY 147 N -0.90 -1.23 3.15 6.27 0.00 -1.26 -5.09 105.19 106.13 2h66 n GLY 147 Ca -0.08 -1.63 0.04 0.00 0.00 0.00 0.00 46.02 44.36 2h66 n GLY 147 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2h66 s ARG 148 N -2.25 0.54 0.57 1.61 3.00 -1.26 -5.15 118.95 116.01 2h66 s ARG 148 Ca 0.00 0.93 -0.19 0.00 -1.00 0.00 0.00 55.73 55.47 2h66 s ARG 148 Cb 0.00 0.52 -0.05 0.00 0.00 0.00 0.00 34.95 35.42 2h66 s ARG 148 CO 0.00 -0.60 1.16 -1.54 0.00 0.00 0.00 175.30 174.32 2h66 s SER 149 N 2.87 5.46 0.48 -2.12 1.04 -1.26 -4.91 113.70 115.26 2h66 s SER 149 Ca 0.19 2.26 0.27 0.00 0.48 0.00 0.00 55.95 59.15 2h66 s SER 149 Cb -0.14 -2.59 1.09 0.00 0.10 0.00 0.00 66.02 64.48 2h66 s SER 149 CO -0.20 -1.40 1.89 1.62 0.98 0.00 0.00 173.24 176.12 2h66 h VAL 150 N 1.01 0.38 0.03 5.02 3.04 -1.98 -2.74 116.25 121.01 2h66 h VAL 150 Ca -0.50 -0.89 -0.00 0.00 -1.01 0.00 0.00 66.70 64.30 2h66 h VAL 150 Cb 1.28 1.66 0.00 0.00 -2.01 0.00 0.00 31.29 32.22 2h66 h VAL 150 CO 0.56 0.14 -0.01 0.44 -1.01 0.00 0.00 177.57 177.69 2h66 h ASP 151 N 0.00 -0.03 -0.75 3.17 3.32 -1.99 0.45 116.42 120.59 2h66 h ASP 151 Ca -0.00 -0.19 0.11 0.00 0.02 0.00 0.00 57.03 56.96 2h66 h ASP 151 Cb 0.65 0.01 -0.08 0.00 0.22 0.00 0.00 39.33 40.13 2h66 h ASP 151 CO 0.02 0.17 0.38 -0.33 -1.72 0.00 0.00 179.24 177.76 2h66 h GLU 152 N -0.24 0.60 -0.25 3.56 5.08 -1.87 0.05 114.58 121.50 2h66 h GLU 152 Ca -0.00 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 2h66 h GLU 152 Cb 0.22 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2h66 h GLU 152 CO 0.01 0.39 -0.12 0.82 -1.00 0.00 0.00 179.01 179.11 2h66 h ILE 153 N 0.61 1.30 -0.80 3.13 2.04 -1.40 -1.50 117.51 120.90 2h66 h ILE 153 Ca 0.38 -1.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.04 2h66 h ILE 153 Cb 0.44 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 38.04 2h66 h ILE 153 CO -0.30 0.37 0.47 -0.07 0.00 0.00 0.00 178.15 178.62 2h66 h LEU 154 N 0.24 0.97 -1.09 1.44 4.07 -0.64 -2.16 115.31 118.13 2h66 h LEU 154 Ca 0.06 -0.07 -0.05 0.00 0.08 0.00 0.00 57.88 57.89 2h66 h LEU 154 Cb 0.62 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.09 2h66 h LEU 154 CO 0.04 0.76 0.08 -0.09 -1.08 0.00 0.00 178.44 178.14 2h66 h ARG 155 N 1.09 0.72 -0.43 1.13 2.43 -0.81 -1.78 114.38 116.74 2h66 h ARG 155 Ca 0.28 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 59.17 2h66 h ARG 155 Cb -0.02 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 2h66 h ARG 155 CO -0.05 0.68 -0.25 0.82 -1.51 0.00 0.00 179.97 179.66 2h66 h ILE 156 N 0.69 1.27 -0.40 1.20 2.04 -0.92 -1.78 117.51 119.61 2h66 h ILE 156 Ca 0.15 -1.41 -0.15 0.00 1.00 0.00 0.00 64.86 64.46 2h66 h ILE 156 Cb 0.31 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 2h66 h ILE 156 CO 0.00 0.48 -0.32 0.40 0.00 0.00 0.00 178.15 178.70 2h66 h ILE 157 N 0.77 1.27 0.56 -0.67 2.04 -1.23 -1.81 117.51 118.44 2h66 h ILE 157 Ca 0.09 -1.49 -0.02 0.00 1.00 0.00 0.00 64.86 64.44 2h66 h ILE 157 Cb 0.81 1.33 -0.00 0.00 -0.74 0.00 0.00 36.82 38.22 2h66 h ILE 157 CO 0.07 0.50 -0.33 0.44 0.00 0.00 0.00 178.15 178.84 2h66 h ASP 158 N 0.76 -0.81 -1.01 1.72 3.32 -1.26 -1.31 116.42 117.84 2h66 h ASP 158 Ca 0.07 0.04 0.23 0.00 0.02 0.00 0.00 57.03 57.39 2h66 h ASP 158 Cb 0.91 0.23 -0.11 0.00 0.22 0.00 0.00 39.33 40.59 2h66 h ASP 158 CO 0.08 -0.52 0.62 0.00 -1.72 0.00 0.00 179.24 177.71 2h66 h ALA 159 N -0.44 1.89 -0.13 3.45 0.00 -1.26 0.57 119.26 123.34 2h66 h ALA 159 Ca -0.07 0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.71 2h66 h ALA 159 Cb 0.67 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.44 2h66 h ALA 159 CO 0.08 -0.29 -0.77 0.82 0.00 0.00 0.00 179.25 179.09 2h66 h ILE 160 N 0.59 1.30 -0.19 0.00 2.04 -1.09 0.79 117.51 120.95 2h66 h ILE 160 Ca 0.60 -2.02 -0.19 0.00 1.00 0.00 0.00 64.86 64.25 2h66 h ILE 160 Cb 1.17 2.01 0.00 0.00 -0.74 0.00 0.00 36.82 39.26 2h66 h ILE 160 CO -0.37 0.63 -0.65 1.56 0.00 0.00 0.00 178.15 179.32 2h66 h GLN 161 N 0.48 0.71 -0.63 2.37 4.20 0.10 -2.47 115.11 119.88 2h66 h GLN 161 Ca -0.05 -0.51 -0.07 0.00 0.06 0.00 0.00 58.65 58.09 2h66 h GLN 161 Cb 1.39 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 29.23 2h66 h GLN 161 CO 0.15 1.13 0.14 0.45 -0.67 0.00 0.00 178.83 180.03 2h66 h HIS 162 N 0.52 1.08 0.00 2.96 3.86 0.12 -2.75 115.15 120.94 2h66 h HIS 162 Ca -0.01 -0.14 -0.03 0.00 -1.16 0.00 0.00 60.37 59.03 2h66 h HIS 162 Cb 1.25 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 29.41 2h66 h HIS 162 CO 0.07 0.90 -0.14 1.25 0.86 0.00 0.00 177.93 180.87 2h66 h HIS 163 N 0.94 0.00 0.00 2.45 -0.00 -0.63 0.76 115.15 118.67 2h66 h HIS 163 Ca 0.20 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.45 2h66 h HIS 163 Cb 0.38 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.78 2h66 h HIS 163 CO 0.03 0.14 -0.55 0.93 -0.00 0.00 0.00 177.93 178.48 2h66 h GLU 164 N 0.00 0.00 0.07 5.26 5.08 -1.14 -3.29 114.58 120.57 2h66 h GLU 164 Ca -0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 2h66 h GLU 164 Cb 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2h66 h GLU 164 CO 0.02 0.55 -1.14 0.87 -1.00 0.00 0.00 179.01 178.30 2h66 h LYS 165 N 0.00 0.15 -5.88 2.33 1.57 -1.30 -3.48 116.57 109.97 2h66 h LYS 165 Ca -0.01 -0.26 -0.57 0.00 -1.87 0.00 0.00 60.65 57.94 2h66 h LYS 165 Cb 1.00 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.33 2h66 h LYS 165 CO 0.07 1.13 -0.43 0.71 -0.57 0.00 0.00 179.45 180.35 2h66 s TYR 166 N -2.41 2.30 0.00 -1.35 1.51 0.18 -5.13 117.35 112.45 2h66 s TYR 166 Ca -0.21 -0.67 0.00 0.00 -1.01 0.00 0.00 57.07 55.17 2h66 s TYR 166 Cb 0.03 -1.95 0.00 0.00 -0.11 0.00 0.00 41.96 39.94 2h66 s TYR 166 CO 0.72 -0.02 0.00 0.41 -1.11 0.00 0.00 175.55 175.55 2h66 n GLY 167 N -1.42 1.15 3.78 0.71 0.00 -1.26 -4.29 105.19 103.86 2h66 n GLY 167 Ca -0.02 -1.48 -0.33 0.00 0.00 0.00 0.00 46.02 44.18 2h66 n GLY 167 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2h66 s ASP 168 N -1.00 5.31 -0.36 1.61 -4.77 -1.26 -4.59 116.67 111.60 2h66 s ASP 168 Ca 0.00 1.96 -0.14 0.00 -3.30 0.00 0.00 52.55 51.06 2h66 s ASP 168 Cb 0.00 -2.55 -0.00 0.00 -1.09 0.00 0.00 42.92 39.28 2h66 s ASP 168 CO 0.00 -1.49 0.31 -0.69 0.70 0.00 0.00 175.17 174.00 2h66 s VAL 169 N -2.35 5.22 0.10 2.11 1.01 -1.26 -5.03 120.40 120.21 2h66 s VAL 169 Ca 0.66 -0.24 -0.34 0.00 0.00 0.00 0.00 61.98 62.07 2h66 s VAL 169 Cb -0.19 -3.83 -0.13 0.00 0.00 0.00 0.00 36.38 32.23 2h66 s VAL 169 CO 0.40 -0.14 1.57 0.00 0.00 0.00 0.00 175.10 176.93 2h66 s PRO 171 N -5.84 3.88 0.00 0.00 0.04 -1.26 -5.32 135.00 126.50 2h66 s PRO 171 Ca -0.17 0.78 0.00 0.00 0.04 0.00 0.00 61.00 61.65 2h66 s PRO 171 Cb 0.06 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2h66 s PRO 171 CO 0.62 -0.20 0.13 0.00 0.04 0.00 0.00 177.00 177.59