#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x2a n ASN 3 N 0.00 1.99 -4.76 6.55 3.02 -1.26 -4.96 115.26 115.84 2x2a n ASN 3 Ca 0.00 1.11 -0.33 0.00 -0.03 0.00 0.00 54.58 55.33 2x2a n ASN 3 Cb 0.00 -1.26 0.07 0.00 -0.61 0.00 0.00 39.78 37.98 2x2a n ASN 3 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2x2a s PRO 4 N 0.43 2.54 -0.07 3.52 0.04 -1.25 -4.80 135.00 135.40 2x2a s PRO 4 Ca 0.81 1.46 0.05 0.00 0.04 0.00 0.00 61.00 63.36 2x2a s PRO 4 Cb -0.86 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 31.75 2x2a s PRO 4 CO 0.46 -1.47 -0.22 0.99 0.04 0.00 0.00 177.00 176.79 2x2a s THR 5 N -2.32 2.27 0.18 1.26 2.01 -1.26 -1.07 115.64 116.71 2x2a s THR 5 Ca 0.68 -0.98 0.06 0.00 0.31 0.00 0.00 61.69 61.76 2x2a s THR 5 Cb -0.22 -1.85 -0.05 0.00 0.01 0.00 0.00 72.50 70.39 2x2a s THR 5 CO 0.44 0.57 -0.12 0.68 -0.69 0.00 0.00 174.62 175.50 2x2a s VAL 6 N -0.11 1.44 0.08 3.82 -7.23 -0.69 -1.14 120.40 116.58 2x2a s VAL 6 Ca -0.05 -2.13 0.04 0.00 -1.81 0.00 0.00 61.98 58.03 2x2a s VAL 6 Cb -0.14 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.80 2x2a s VAL 6 CO 0.04 -0.66 -0.11 0.72 -0.31 0.00 0.00 175.10 174.79 2x2a s PHE 7 N -3.16 1.02 -0.10 2.82 -0.12 0.15 -0.73 117.98 117.86 2x2a s PHE 7 Ca 0.20 -0.56 0.04 0.00 -0.05 0.00 0.00 56.93 56.55 2x2a s PHE 7 Cb 0.01 -0.57 -0.00 0.00 -0.63 0.00 0.00 43.02 41.83 2x2a s PHE 7 CO 0.04 -0.00 -0.23 -0.06 -0.05 0.00 0.00 175.22 174.91 2x2a s PHE 8 N -1.86 2.58 -0.41 3.49 0.08 0.31 -1.96 117.98 120.20 2x2a s PHE 8 Ca -0.00 -1.05 -0.19 0.00 0.12 0.00 0.00 56.93 55.82 2x2a s PHE 8 Cb -0.07 -1.72 0.02 0.00 -0.57 0.00 0.00 43.02 40.68 2x2a s PHE 8 CO 0.01 -0.42 0.53 -0.51 -0.10 0.00 0.00 175.22 174.72 2x2a s ASP 9 N 0.36 6.26 -0.01 1.36 1.01 0.66 -0.76 116.67 125.56 2x2a s ASP 9 Ca -0.18 -0.42 -0.18 0.00 0.71 0.00 0.00 52.55 52.49 2x2a s ASP 9 Cb -0.18 -2.27 -0.06 0.00 1.01 0.00 0.00 42.92 41.43 2x2a s ASP 9 CO 0.08 -0.63 0.49 -0.63 0.21 0.00 0.00 175.17 174.70 2x2a s ILE 10 N 2.44 4.97 0.13 0.77 -1.09 -0.20 -0.29 121.20 127.93 2x2a s ILE 10 Ca 0.17 1.02 0.08 0.00 -2.23 0.00 0.00 60.65 59.70 2x2a s ILE 10 Cb -0.16 -3.82 -0.04 0.00 -1.58 0.00 0.00 42.46 36.87 2x2a s ILE 10 CO 0.16 0.49 -0.20 0.00 -1.23 0.00 0.00 174.94 174.15 2x2a s ALA 11 N -0.55 1.91 -0.24 9.38 0.00 -0.22 -0.66 121.76 131.39 2x2a s ALA 11 Ca 0.27 -1.35 0.02 0.00 0.00 0.00 0.00 51.96 50.90 2x2a s ALA 11 Cb -0.17 -0.23 0.05 0.00 0.00 0.00 0.00 23.12 22.77 2x2a s ALA 11 CO 0.15 0.33 -0.11 0.08 0.00 0.00 0.00 175.76 176.21 2x2a s VAL 12 N -1.46 1.98 -1.54 0.00 1.01 -0.25 -1.01 120.40 119.13 2x2a s VAL 12 Ca 0.10 -1.42 -0.11 0.00 0.00 0.00 0.00 61.98 60.55 2x2a s VAL 12 Cb -0.09 -2.08 0.08 0.00 0.00 0.00 0.00 36.38 34.30 2x2a s VAL 12 CO 0.05 0.04 0.81 0.47 0.00 0.00 0.00 175.10 176.47 2x2a n ASP 13 N 4.52 -3.25 0.00 3.32 8.00 0.25 -1.41 116.55 127.98 2x2a n ASP 13 Ca -0.14 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.47 2x2a n ASP 13 Cb 0.44 -3.46 0.00 0.00 -0.02 0.00 0.00 41.12 38.08 2x2a n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x2a n GLY 14 N -1.64 2.47 3.67 0.44 0.00 -1.26 -5.02 105.19 103.84 2x2a n GLY 14 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 2x2a n GLY 14 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x2a s GLU 15 N -0.05 4.13 0.22 1.61 2.56 -0.50 -4.97 118.70 121.70 2x2a s GLU 15 Ca 0.00 0.01 -0.32 0.00 0.00 0.00 0.00 54.97 54.66 2x2a s GLU 15 Cb 0.00 -3.54 -0.13 0.00 2.00 0.00 0.00 34.13 32.46 2x2a s GLU 15 CO 0.00 -0.00 1.50 -2.30 -0.56 0.00 0.00 175.26 173.89 2x2a n PRO 16 N 4.41 2.16 -0.14 4.30 -0.02 -1.26 -1.10 135.00 143.36 2x2a n PRO 16 Ca -0.11 0.77 -0.29 0.00 -2.02 0.00 0.00 63.50 61.86 2x2a n PRO 16 Cb 0.51 -2.49 -0.10 0.00 -0.02 0.00 0.00 33.50 31.40 2x2a n PRO 16 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2x2a n LEU 17 N 2.66 2.06 0.00 2.45 7.94 0.17 -4.87 117.00 127.41 2x2a n LEU 17 Ca 0.13 0.29 0.00 0.00 -1.11 0.00 0.00 56.01 55.32 2x2a n LEU 17 Cb 0.31 -0.83 0.00 0.00 0.53 0.00 0.00 43.42 43.43 2x2a n LEU 17 CO 0.63 0.62 0.00 0.61 -1.11 0.00 0.00 177.39 178.14 2x2a n GLY 18 N 1.36 -1.78 3.72 -3.96 0.00 -1.18 -5.03 105.19 98.32 2x2a n GLY 18 Ca -0.54 -1.23 -0.35 0.00 0.00 0.00 0.00 46.02 43.90 2x2a n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2x2a s ARG 19 N -1.90 3.66 -0.17 1.61 3.52 -1.26 -1.04 118.95 123.36 2x2a s ARG 19 Ca 0.00 -0.29 -0.04 0.00 -0.13 0.00 0.00 55.73 55.27 2x2a s ARG 19 Cb 0.00 -3.14 -0.02 0.00 -1.56 0.00 0.00 34.95 30.22 2x2a s ARG 19 CO 0.00 0.50 -0.03 0.08 -0.81 0.00 0.00 175.30 175.04 2x2a s VAL 20 N -0.26 3.86 -0.01 7.11 1.01 0.06 -4.26 120.40 127.91 2x2a s VAL 20 Ca 0.09 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.76 2x2a s VAL 20 Cb -0.12 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 2x2a s VAL 20 CO 0.01 0.47 -0.16 -0.44 0.00 0.00 0.00 175.10 174.98 2x2a s SER 21 N 0.65 3.88 -0.02 3.32 0.01 -0.26 -0.53 113.70 120.74 2x2a s SER 21 Ca -0.02 -0.31 0.06 0.00 1.31 0.00 0.00 55.95 56.99 2x2a s SER 21 Cb -0.14 -0.72 -0.01 0.00 0.21 0.00 0.00 66.02 65.36 2x2a s SER 21 CO 0.02 0.30 -0.19 -0.36 0.41 0.00 0.00 173.24 173.42 2x2a s PHE 22 N -0.81 1.79 -0.08 2.43 0.08 0.09 0.07 117.98 121.55 2x2a s PHE 22 Ca 0.13 -0.40 -0.20 0.00 0.12 0.00 0.00 56.93 56.58 2x2a s PHE 22 Cb -0.11 -1.17 -0.04 0.00 -0.57 0.00 0.00 43.02 41.14 2x2a s PHE 22 CO 0.03 -0.08 0.57 -2.00 -0.10 0.00 0.00 175.22 173.64 2x2a s GLU 23 N -0.32 4.36 -0.16 0.44 2.12 -0.25 -1.70 118.70 123.20 2x2a s GLU 23 Ca 0.04 0.63 -0.06 0.00 0.36 0.00 0.00 54.97 55.94 2x2a s GLU 23 Cb -0.09 -3.42 -0.04 0.00 0.26 0.00 0.00 34.13 30.84 2x2a s GLU 23 CO 0.00 0.17 0.04 -0.51 -0.54 0.00 0.00 175.26 174.42 2x2a s LEU 24 N 0.53 3.74 -1.30 2.70 1.43 -0.24 -1.20 118.68 124.34 2x2a s LEU 24 Ca 0.30 0.09 -0.08 0.00 -1.03 0.00 0.00 54.13 53.41 2x2a s LEU 24 Cb -0.16 -1.92 0.15 0.00 0.03 0.00 0.00 46.19 44.28 2x2a s LEU 24 CO 0.14 0.22 2.04 0.49 0.23 0.00 0.00 176.35 179.47 2x2a n PHE 25 N 3.19 2.82 0.28 0.29 3.72 0.59 -3.79 117.46 124.57 2x2a n PHE 25 Ca -0.17 -2.80 0.15 0.00 -0.05 0.00 0.00 57.45 54.57 2x2a n PHE 25 Cb 0.53 -1.93 0.85 0.00 -0.94 0.00 0.00 39.48 37.99 2x2a n PHE 25 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2x2a h ALA 26 N 5.42 1.38 0.00 4.37 0.00 -1.83 0.13 119.26 128.72 2x2a h ALA 26 Ca 0.49 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 2x2a h ALA 26 Cb 0.53 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2x2a h ALA 26 CO 1.60 0.07 -0.11 0.38 0.00 0.00 0.00 179.25 181.18 2x2a h ASP 27 N 0.00 0.00 0.00 0.00 2.03 -1.96 -2.95 116.42 113.53 2x2a h ASP 27 Ca -0.00 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.16 2x2a h ASP 27 Cb 0.15 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.63 2x2a h ASP 27 CO 0.01 0.11 -1.52 0.29 -1.03 0.00 0.00 179.24 177.09 2x2a n LYS 28 N -3.42 1.54 -3.20 4.15 4.76 -0.70 -4.87 118.16 116.44 2x2a n LYS 28 Ca -0.01 0.02 -0.23 0.00 -2.87 0.00 0.00 58.31 55.23 2x2a n LYS 28 Cb 0.27 -1.19 -0.06 0.00 -1.84 0.00 0.00 35.03 32.22 2x2a n LYS 28 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2x2a n VAL 29 N -2.52 0.32 -0.35 -0.18 0.24 -0.05 -4.94 118.33 110.85 2x2a n VAL 29 Ca -0.14 -4.54 -0.03 0.00 -2.04 0.00 0.00 64.34 57.59 2x2a n VAL 29 Cb 0.71 -1.37 0.10 0.00 -1.47 0.00 0.00 33.84 31.81 2x2a n VAL 29 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2x2a h PRO 30 N 3.59 1.22 -0.48 7.34 0.13 -1.72 -0.27 132.00 141.81 2x2a h PRO 30 Ca 0.10 -0.07 -0.10 0.00 -0.87 0.00 0.00 66.00 65.06 2x2a h PRO 30 Cb 0.84 -0.27 -0.02 0.00 0.13 0.00 0.00 31.00 31.68 2x2a h PRO 30 CO 0.57 0.81 -0.09 0.87 -0.23 0.00 0.00 178.00 179.92 2x2a h LYS 31 N 1.25 0.91 -0.13 0.86 1.57 -1.94 -0.28 116.57 118.81 2x2a h LYS 31 Ca 0.34 -0.34 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 2x2a h LYS 31 Cb -0.13 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.12 2x2a h LYS 31 CO -0.08 0.99 -0.21 1.15 -0.57 0.00 0.00 179.45 180.73 2x2a h THR 32 N 0.76 1.37 -0.30 -0.16 2.02 -1.92 -2.03 112.91 112.66 2x2a h THR 32 Ca 0.13 -1.45 0.04 0.00 0.77 0.00 0.00 66.41 65.89 2x2a h THR 32 Cb 0.63 2.01 -0.04 0.00 -1.74 0.00 0.00 68.15 69.02 2x2a h THR 32 CO 0.04 0.43 0.05 0.00 0.37 0.00 0.00 175.52 176.41 2x2a h ALA 33 N 0.55 0.31 -0.57 6.16 0.00 -1.03 -2.73 119.26 121.96 2x2a h ALA 33 Ca 0.01 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.02 2x2a h ALA 33 Cb 0.78 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 2x2a h ALA 33 CO 0.05 -0.36 0.32 1.49 0.00 0.00 0.00 179.25 180.75 2x2a h GLU 34 N 0.16 0.60 -0.04 0.00 4.57 -0.91 -0.24 114.58 118.71 2x2a h GLU 34 Ca 0.14 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.32 2x2a h GLU 34 Cb 0.15 -0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 28.56 2x2a h GLU 34 CO -0.19 0.40 -0.25 -0.97 -1.18 0.00 0.00 179.01 176.82 2x2a h ASN 35 N 0.62 -0.76 -0.73 1.04 -1.24 -1.17 -0.38 115.58 112.96 2x2a h ASN 35 Ca 0.24 0.11 -0.02 0.00 0.71 0.00 0.00 56.30 57.34 2x2a h ASN 35 Cb 0.09 0.32 -0.03 0.00 0.73 0.00 0.00 38.32 39.43 2x2a h ASN 35 CO -0.14 -0.31 0.37 0.15 -1.29 0.00 0.00 177.43 176.21 2x2a h PHE 36 N -0.37 1.03 0.11 0.67 3.57 -1.20 -0.14 116.94 120.61 2x2a h PHE 36 Ca 0.07 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.55 2x2a h PHE 36 Cb 0.47 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 2x2a h PHE 36 CO -0.31 0.75 -0.20 -0.09 -2.23 0.00 0.00 178.31 176.24 2x2a h ARG 37 N 1.02 -0.36 -0.44 1.11 2.43 -0.84 -0.72 114.38 116.57 2x2a h ARG 37 Ca 0.25 0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 59.32 2x2a h ARG 37 Cb 0.09 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 2x2a h ARG 37 CO -0.04 -0.24 -0.22 0.00 -1.51 0.00 0.00 179.97 177.96 2x2a h ALA 38 N 0.44 0.77 -0.13 2.80 0.00 -0.84 -1.52 119.26 120.78 2x2a h ALA 38 Ca 0.03 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 2x2a h ALA 38 Cb 0.39 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2x2a h ALA 38 CO -0.11 0.66 -0.09 -0.07 0.00 0.00 0.00 179.25 179.64 2x2a h LEU 39 N 0.77 0.19 -0.43 0.00 3.38 -0.90 -1.27 115.31 117.05 2x2a h LEU 39 Ca 0.10 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 2x2a h LEU 39 Cb 0.77 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 2x2a h LEU 39 CO 0.06 0.31 -0.78 0.28 0.09 0.00 0.00 178.44 178.40 2x2a h SER 40 N 0.19 0.08 1.32 -0.43 0.02 -0.52 -0.91 113.55 113.30 2x2a h SER 40 Ca 0.04 -0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 2x2a h SER 40 Cb 0.29 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 2x2a h SER 40 CO 0.02 0.83 -0.69 0.71 -1.14 0.00 0.00 176.83 176.55 2x2a h THR 41 N 0.04 0.12 -0.01 -2.27 1.35 -1.07 -2.91 112.91 108.16 2x2a h THR 41 Ca -0.02 -1.20 -0.01 0.00 -0.55 0.00 0.00 66.41 64.64 2x2a h THR 41 Cb 1.38 1.78 -0.00 0.00 -1.73 0.00 0.00 68.15 69.58 2x2a h THR 41 CO 0.11 0.07 -0.00 0.61 -0.25 0.00 0.00 175.52 176.05 2x2a n GLY 42 N 1.18 0.41 0.19 5.82 0.00 -0.50 -4.94 105.19 107.36 2x2a n GLY 42 Ca 0.00 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.11 2x2a n GLY 42 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2x2a h GLU 43 N 0.74 0.00 -0.01 1.61 4.11 -1.80 -0.54 114.58 118.70 2x2a h GLU 43 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2x2a h GLU 43 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2x2a h GLU 43 CO 0.01 0.00 -0.15 1.63 0.07 0.00 0.00 179.01 180.57 2x2a n LYS 44 N -2.51 0.85 0.00 1.06 4.76 -1.26 -4.92 118.16 116.14 2x2a n LYS 44 Ca 0.01 -0.39 0.00 0.00 -2.87 0.00 0.00 58.31 55.06 2x2a n LYS 44 Cb 0.19 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.89 2x2a n LYS 44 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2x2a n GLY 45 N 1.28 0.61 3.40 0.72 0.00 -0.21 -5.05 105.19 105.94 2x2a n GLY 45 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 2x2a n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2x2a s PHE 46 N -2.00 -0.02 -5.00 1.61 -0.12 -1.25 -5.12 117.98 106.08 2x2a s PHE 46 Ca 0.00 -0.32 0.00 0.00 -0.05 0.00 0.00 56.93 56.56 2x2a s PHE 46 Cb 0.00 0.23 0.00 0.00 -0.63 0.00 0.00 43.02 42.62 2x2a s PHE 46 CO 0.00 -0.79 0.00 0.41 -0.05 0.00 0.00 175.22 174.79 2x2a n GLY 47 N -0.26 -0.04 0.21 1.99 0.00 -1.26 -4.39 105.19 101.44 2x2a n GLY 47 Ca -0.12 -1.27 0.13 0.00 0.00 0.00 0.00 46.02 44.77 2x2a n GLY 47 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2x2a h TYR 48 N 0.00 0.00 -2.29 1.61 0.05 -1.48 -3.45 116.97 111.40 2x2a h TYR 48 Ca 0.00 0.00 -0.58 0.00 0.05 0.00 0.00 58.73 58.20 2x2a h TYR 48 Cb 0.00 0.00 0.05 0.00 1.01 0.00 0.00 36.73 37.79 2x2a h TYR 48 CO 0.00 0.00 0.92 1.17 -1.05 0.00 0.00 178.16 179.20 2x2a n LYS 49 N -2.97 2.31 -0.28 4.88 4.81 -1.26 -1.43 118.16 124.22 2x2a n LYS 49 Ca 0.04 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.31 2x2a n LYS 49 Cb 0.47 -2.65 0.00 0.00 0.02 0.00 0.00 35.03 32.88 2x2a n LYS 49 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2x2a n GLY 50 N 3.77 1.47 3.80 3.14 0.00 0.72 -5.05 105.19 113.04 2x2a n GLY 50 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2x2a n GLY 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x2a s SER 51 N -3.17 3.37 0.27 1.61 1.04 -0.51 -4.73 113.70 111.56 2x2a s SER 51 Ca 0.00 0.85 0.08 0.00 0.48 0.00 0.00 55.95 57.36 2x2a s SER 51 Cb 0.00 -1.34 -0.05 0.00 0.10 0.00 0.00 66.02 64.73 2x2a s SER 51 CO 0.00 -2.63 -0.10 0.00 0.98 0.00 0.00 173.24 171.49 2x2a s PHE 53 N -2.90 2.87 -0.78 0.00 0.40 -0.21 -3.99 117.98 113.36 2x2a s PHE 53 Ca 0.28 -0.51 0.24 0.00 -0.60 0.00 0.00 56.93 56.34 2x2a s PHE 53 Cb 0.01 -3.97 0.37 0.00 0.51 0.00 0.00 43.02 39.94 2x2a s PHE 53 CO 0.11 -1.33 1.32 -2.39 0.70 0.00 0.00 175.22 173.62 2x2a n HIS 54 N 6.94 0.28 -3.49 0.36 1.44 -0.94 -4.66 115.22 115.15 2x2a n HIS 54 Ca -0.05 0.08 -0.26 0.00 -2.01 0.00 0.00 57.72 55.49 2x2a n HIS 54 Cb 0.45 -0.46 -0.13 0.00 0.12 0.00 0.00 29.99 29.97 2x2a n HIS 54 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 2x2a s ARG 55 N -3.10 0.28 -0.21 -1.40 3.52 -1.12 -4.55 118.95 112.35 2x2a s ARG 55 Ca 0.08 -0.55 -0.01 0.00 -0.13 0.00 0.00 55.73 55.12 2x2a s ARG 55 Cb 0.15 -1.04 0.01 0.00 -1.56 0.00 0.00 34.95 32.51 2x2a s ARG 55 CO 0.72 -1.05 -0.11 0.42 -0.81 0.00 0.00 175.30 174.48 2x2a s ILE 56 N 2.02 2.73 -0.30 4.11 1.01 -0.42 -0.20 121.20 130.15 2x2a s ILE 56 Ca 0.10 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 59.97 2x2a s ILE 56 Cb -0.16 -2.26 0.08 0.00 0.01 0.00 0.00 42.46 40.13 2x2a s ILE 56 CO -0.31 0.40 -0.00 -0.63 0.00 0.00 0.00 174.94 174.40 2x2a s ILE 57 N 1.36 2.01 0.27 2.92 1.01 -0.22 -1.80 121.20 126.76 2x2a s ILE 57 Ca 0.04 -1.92 -0.30 0.00 0.00 0.00 0.00 60.65 58.46 2x2a s ILE 57 Cb -0.14 -2.36 -0.13 0.00 0.01 0.00 0.00 42.46 39.84 2x2a s ILE 57 CO -0.07 -0.39 1.47 -2.65 0.00 0.00 0.00 174.94 173.30 2x2a n PRO 58 N 4.41 2.32 -0.99 2.79 -0.02 -1.26 -1.55 135.00 140.70 2x2a n PRO 58 Ca -0.03 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2x2a n PRO 58 Cb 0.42 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 2x2a n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x2a n GLY 59 N 1.99 0.67 0.07 -1.23 0.00 -1.26 -4.82 105.19 100.61 2x2a n GLY 59 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2x2a n GLY 59 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2x2a n PHE 60 N -2.55 0.00 -3.71 1.61 7.35 -0.59 -4.54 117.46 115.03 2x2a n PHE 60 Ca 0.00 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.63 2x2a n PHE 60 Cb 0.02 0.01 -0.02 0.00 0.35 0.00 0.00 39.48 39.84 2x2a n PHE 60 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2x2a s MET 61 N -0.05 1.32 -0.24 -4.13 0.23 -0.82 -0.95 119.30 114.67 2x2a s MET 61 Ca 0.00 -0.68 -0.02 0.00 -1.03 0.00 0.00 55.69 53.96 2x2a s MET 61 Cb 0.00 0.48 0.02 0.00 -1.53 0.00 0.00 34.83 33.80 2x2a s MET 61 CO 0.00 -0.60 -0.06 0.00 -2.03 0.00 0.00 175.02 172.33 2x2a s GLN 63 N 1.38 3.48 0.00 0.00 0.74 0.72 -0.85 119.66 125.13 2x2a s GLN 63 Ca 0.02 -0.39 0.00 0.00 0.05 0.00 0.00 55.36 55.04 2x2a s GLN 63 Cb -0.16 -2.97 0.00 0.00 1.10 0.00 0.00 33.01 30.98 2x2a s GLN 63 CO -0.04 0.47 0.00 0.41 -0.55 0.00 0.00 175.29 175.58 2x2a n GLY 64 N 2.87 3.96 0.72 2.59 0.00 -0.52 -2.20 105.19 112.61 2x2a n GLY 64 Ca -0.18 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.80 2x2a n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x2a n GLY 65 N 0.00 0.68 3.48 -0.02 0.00 -1.26 -1.69 105.19 106.38 2x2a n GLY 65 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2x2a n GLY 65 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2x2a s ASP 66 N -2.80 6.95 0.00 1.61 -1.08 -1.26 -3.88 116.67 116.20 2x2a s ASP 66 Ca 0.00 -2.72 0.30 0.00 -0.52 0.00 0.00 52.55 49.61 2x2a s ASP 66 Cb 0.00 -2.44 1.39 0.00 -1.46 0.00 0.00 42.92 40.42 2x2a s ASP 66 CO 0.00 -0.89 1.95 2.22 0.52 0.00 0.00 175.17 178.98 2x2a n PHE 67 N 6.33 0.00 -0.11 -5.34 1.16 -1.26 -1.45 117.46 116.79 2x2a n PHE 67 Ca 0.37 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.82 2x2a n PHE 67 Cb 0.44 -0.14 -0.14 0.00 -1.61 0.00 0.00 39.48 38.04 2x2a n PHE 67 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 2x2a n THR 68 N -0.89 1.40 -0.08 1.97 -2.24 -1.26 -4.76 114.28 108.42 2x2a n THR 68 Ca 0.17 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2x2a n THR 68 Cb 0.24 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 2x2a n THR 68 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2x2a n ARG 69 N -2.94 3.43 -2.03 -0.78 5.12 -1.25 -4.94 116.66 113.26 2x2a n ARG 69 Ca -0.37 -0.08 -0.20 0.00 -1.93 0.00 0.00 57.85 55.26 2x2a n ARG 69 Cb 1.08 -0.46 -0.05 0.00 -1.16 0.00 0.00 32.46 31.88 2x2a n ARG 69 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2x2a n HIS 70 N -0.51 -0.57 -1.45 -1.55 8.25 -0.53 -4.77 115.22 114.09 2x2a n HIS 70 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2x2a n HIS 70 Cb 0.02 -3.70 0.00 0.00 1.12 0.00 0.00 29.99 27.43 2x2a n HIS 70 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2x2a n ASN 71 N -1.69 0.00 0.00 0.41 0.23 -1.26 -4.81 115.26 108.14 2x2a n ASN 71 Ca -0.23 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.82 2x2a n ASN 71 Cb 0.68 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.38 2x2a n ASN 71 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x2a n GLY 72 N 0.00 1.23 0.01 4.83 0.00 -1.26 -4.94 105.19 105.07 2x2a n GLY 72 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2x2a n GLY 72 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2x2a n THR 73 N -1.63 0.08 -2.10 2.61 -2.24 -1.26 -4.95 114.28 104.78 2x2a n THR 73 Ca 0.00 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2x2a n THR 73 Cb 0.00 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.25 2x2a n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x2a n GLY 74 N 1.47 5.33 0.00 3.38 0.00 -1.26 -4.98 105.19 109.12 2x2a n GLY 74 Ca 0.05 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.30 2x2a n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x2a n GLY 75 N 4.54 1.79 3.44 -0.02 0.00 -1.26 -4.79 105.19 108.89 2x2a n GLY 75 Ca 0.00 -1.92 -0.15 0.00 0.00 0.00 0.00 46.02 43.95 2x2a n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x2a s LYS 76 N -2.68 1.09 0.75 1.61 -2.85 -1.26 -4.73 119.74 111.67 2x2a s LYS 76 Ca 0.00 -0.10 -0.03 0.00 -1.00 0.00 0.00 55.97 54.83 2x2a s LYS 76 Cb 0.00 0.50 0.13 0.00 -2.06 0.00 0.00 37.83 36.40 2x2a s LYS 76 CO 0.00 -0.39 1.03 -1.54 0.10 0.00 0.00 175.35 174.55 2x2a s SER 77 N -1.84 4.25 0.02 0.03 1.04 -0.35 -3.89 113.70 112.95 2x2a s SER 77 Ca -0.06 -0.18 0.25 0.00 0.48 0.00 0.00 55.95 56.43 2x2a s SER 77 Cb -0.01 -0.20 1.05 0.00 0.10 0.00 0.00 66.02 66.97 2x2a s SER 77 CO 0.00 -1.93 1.79 2.30 0.98 0.00 0.00 173.24 176.39 2x2a n ILE 78 N -2.95 0.31 0.92 -1.02 -5.35 -1.26 -3.22 119.36 106.79 2x2a n ILE 78 Ca 0.14 0.06 0.12 0.00 -0.27 0.00 0.00 62.75 62.80 2x2a n ILE 78 Cb 0.60 -0.65 0.15 0.00 -1.74 0.00 0.00 39.64 38.00 2x2a n ILE 78 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2x2a n TYR 79 N -1.55 0.09 0.00 4.28 4.01 -1.26 -5.09 117.16 117.64 2x2a n TYR 79 Ca 0.06 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 2x2a n TYR 79 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 2x2a n TYR 79 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2x2a n GLY 80 N 1.36 1.01 0.28 2.72 0.00 -1.20 -4.86 105.19 104.51 2x2a n GLY 80 Ca 0.15 -2.08 0.05 0.00 0.00 0.00 0.00 46.02 44.14 2x2a n GLY 80 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2x2a h GLU 81 N 0.00 0.51 -3.91 1.61 4.22 -1.93 -0.92 114.58 114.16 2x2a h GLU 81 Ca 0.00 -0.03 -0.10 0.00 0.08 0.00 0.00 59.36 59.31 2x2a h GLU 81 Cb 0.00 -0.12 -0.14 0.00 0.50 0.00 0.00 28.75 29.00 2x2a h GLU 81 CO 0.00 0.34 -0.41 -1.59 -2.18 0.00 0.00 179.01 175.17 2x2a s LYS 82 N -6.02 0.90 0.07 1.92 -2.85 -1.26 -3.87 119.74 108.63 2x2a s LYS 82 Ca -0.12 -1.07 -0.06 0.00 -1.00 0.00 0.00 55.97 53.71 2x2a s LYS 82 Cb 0.20 0.33 -0.01 0.00 -2.06 0.00 0.00 37.83 36.29 2x2a s LYS 82 CO 0.77 -0.29 0.12 -0.59 0.10 0.00 0.00 175.35 175.46 2x2a s PHE 83 N -3.91 0.25 0.63 1.78 -0.71 0.04 -4.93 117.98 111.13 2x2a s PHE 83 Ca 0.09 -0.68 -0.17 0.00 -1.04 0.00 0.00 56.93 55.14 2x2a s PHE 83 Cb 0.05 -0.15 -0.01 0.00 -1.21 0.00 0.00 43.02 41.69 2x2a s PHE 83 CO -0.07 -0.47 1.15 -1.21 -1.34 0.00 0.00 175.22 173.28 2x2a s GLU 84 N -3.62 2.85 -0.02 1.99 2.02 -1.26 -2.11 118.70 118.55 2x2a s GLU 84 Ca 0.03 1.59 -0.30 0.00 0.02 0.00 0.00 54.97 56.32 2x2a s GLU 84 Cb 0.04 -1.94 -0.08 0.00 0.10 0.00 0.00 34.13 32.26 2x2a s GLU 84 CO -0.09 -1.25 2.00 -0.51 0.02 0.00 0.00 175.26 175.43 2x2a s ASP 85 N -2.10 6.25 -0.04 -0.19 1.01 -1.26 -4.83 116.67 115.50 2x2a s ASP 85 Ca 0.72 2.48 -0.25 0.00 0.71 0.00 0.00 52.55 56.21 2x2a s ASP 85 Cb -0.25 -2.53 -0.19 0.00 1.01 0.00 0.00 42.92 40.96 2x2a s ASP 85 CO 0.37 -1.24 1.08 -0.08 0.21 0.00 0.00 175.17 175.51 2x2a h GLU 86 N 11.48 -0.09 -2.25 8.23 4.81 -2.00 -3.48 114.58 131.29 2x2a h GLU 86 Ca -0.47 0.01 0.19 0.00 -0.13 0.00 0.00 59.36 58.95 2x2a h GLU 86 Cb 1.23 0.02 -0.09 0.00 0.63 0.00 0.00 28.75 30.54 2x2a h GLU 86 CO 0.95 0.44 0.52 0.54 -0.73 0.00 0.00 179.01 180.72 2x2a s ASN 87 N -5.66 -0.18 -0.28 1.04 2.20 -1.26 -5.05 114.94 105.74 2x2a s ASN 87 Ca -0.15 -0.34 0.07 0.00 -0.94 0.00 0.00 52.86 51.50 2x2a s ASN 87 Cb 0.01 0.45 0.46 0.00 -2.00 0.00 0.00 41.25 40.16 2x2a s ASN 87 CO 0.61 -0.82 1.19 0.49 -2.94 0.00 0.00 177.10 175.63 2x2a n PHE 88 N -0.45 2.48 0.02 1.54 3.72 -1.26 -4.73 117.46 118.79 2x2a n PHE 88 Ca -0.06 -2.15 -0.11 0.00 -0.05 0.00 0.00 57.45 55.07 2x2a n PHE 88 Cb 0.61 -0.33 -0.06 0.00 -0.94 0.00 0.00 39.48 38.76 2x2a n PHE 88 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2x2a h ILE 89 N 2.08 0.99 -3.37 4.37 2.04 -1.94 -3.45 117.51 118.23 2x2a h ILE 89 Ca 0.33 -0.01 -0.55 0.00 1.00 0.00 0.00 64.86 65.63 2x2a h ILE 89 Cb 1.49 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 38.48 2x2a h ILE 89 CO 0.68 0.01 -0.03 -0.76 0.00 0.00 0.00 178.15 178.05 2x2a s LEU 90 N -10.20 4.37 0.26 1.44 1.43 -1.26 -5.09 118.68 109.63 2x2a s LEU 90 Ca -0.13 1.19 0.07 0.00 -1.03 0.00 0.00 54.13 54.23 2x2a s LEU 90 Cb 0.07 -3.29 -0.03 0.00 0.03 0.00 0.00 46.19 42.96 2x2a s LEU 90 CO 0.67 0.11 0.24 -0.54 0.23 0.00 0.00 176.35 177.05 2x2a s LYS 91 N -1.83 3.00 -1.24 1.70 1.02 -1.26 -4.41 119.74 116.71 2x2a s LYS 91 Ca 0.38 -1.03 -0.18 0.00 0.02 0.00 0.00 55.97 55.16 2x2a s LYS 91 Cb -0.16 -2.61 0.09 0.00 -0.52 0.00 0.00 37.83 34.62 2x2a s LYS 91 CO 0.20 0.37 1.62 -1.01 -0.92 0.00 0.00 175.35 175.61 2x2a s HIS 92 N -2.12 2.91 -0.69 3.18 3.76 -1.26 -4.82 115.29 116.25 2x2a s HIS 92 Ca 0.34 -1.63 0.24 0.00 -0.15 0.00 0.00 55.06 53.86 2x2a s HIS 92 Cb -0.08 -4.65 0.41 0.00 1.11 0.00 0.00 32.58 29.37 2x2a s HIS 92 CO 0.26 -1.73 1.37 0.25 -0.85 0.00 0.00 174.74 174.04 2x2a n THR 93 N 6.06 0.33 -1.73 1.30 -2.24 -1.26 -3.23 114.28 113.50 2x2a n THR 93 Ca 0.44 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 2x2a n THR 93 Cb 0.46 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 2x2a n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x2a n GLY 94 N 1.35 -1.68 3.68 3.38 0.00 -1.26 -4.61 105.19 106.05 2x2a n GLY 94 Ca 0.04 -1.10 -0.40 0.00 0.00 0.00 0.00 46.02 44.56 2x2a n GLY 94 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2x2a n PRO 95 N -0.26 1.63 0.00 1.61 -0.02 -1.25 -2.99 135.00 133.72 2x2a n PRO 95 Ca 0.00 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2x2a n PRO 95 Cb 0.00 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.17 2x2a n PRO 95 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x2a n GLY 96 N 0.95 1.30 3.76 -1.23 0.00 0.48 -4.93 105.19 105.50 2x2a n GLY 96 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2x2a n GLY 96 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x2a s ILE 97 N -2.31 2.83 -0.20 -0.61 -1.09 -1.16 -0.61 121.20 118.05 2x2a s ILE 97 Ca 0.00 0.76 -0.05 0.00 -2.23 0.00 0.00 60.65 59.13 2x2a s ILE 97 Cb 0.00 -3.48 -0.03 0.00 -1.58 0.00 0.00 42.46 37.37 2x2a s ILE 97 CO 0.00 0.15 0.01 -0.22 -1.23 0.00 0.00 174.94 173.65 2x2a s LEU 98 N -1.05 3.31 0.03 2.97 2.96 -0.18 -0.81 118.68 125.93 2x2a s LEU 98 Ca 0.53 -0.17 -0.06 0.00 -0.22 0.00 0.00 54.13 54.22 2x2a s LEU 98 Cb -0.39 -1.84 -0.01 0.00 0.50 0.00 0.00 46.19 44.45 2x2a s LEU 98 CO 0.47 0.08 0.10 -0.55 -1.32 0.00 0.00 176.35 175.13 2x2a s SER 99 N 0.91 0.16 0.03 3.68 0.15 -0.72 -1.17 113.70 116.73 2x2a s SER 99 Ca 0.01 -0.50 -0.25 0.00 0.70 0.00 0.00 55.95 55.91 2x2a s SER 99 Cb -0.14 0.22 -0.05 0.00 -1.71 0.00 0.00 66.02 64.34 2x2a s SER 99 CO 0.02 -0.49 0.76 -0.04 1.20 0.00 0.00 173.24 174.69 2x2a s MET 100 N -2.48 4.49 0.50 5.44 -1.94 -0.36 -0.72 119.30 124.22 2x2a s MET 100 Ca -0.06 1.05 -0.20 0.00 -1.71 0.00 0.00 55.69 54.76 2x2a s MET 100 Cb -0.02 -3.38 -0.08 0.00 2.01 0.00 0.00 34.83 33.37 2x2a s MET 100 CO -0.04 0.24 1.07 0.00 -0.01 0.00 0.00 175.02 176.28 2x2a s ALA 101 N 0.12 2.83 0.18 3.03 0.00 -0.72 -4.29 121.76 122.91 2x2a s ALA 101 Ca 0.39 0.69 -0.24 0.00 0.00 0.00 0.00 51.96 52.80 2x2a s ALA 101 Cb -0.20 -3.29 0.05 0.00 0.00 0.00 0.00 23.12 19.68 2x2a s ALA 101 CO 0.22 -0.46 0.81 0.54 0.00 0.00 0.00 175.76 176.87 2x2a s ASN 102 N -1.87 -0.29 -0.15 0.00 2.20 -1.26 -4.53 114.94 109.04 2x2a s ASN 102 Ca 0.68 -0.38 0.14 0.00 -0.94 0.00 0.00 52.86 52.37 2x2a s ASN 102 Cb -0.19 0.58 0.38 0.00 -2.00 0.00 0.00 41.25 40.02 2x2a s ASN 102 CO 0.23 -1.05 1.19 0.00 -2.94 0.00 0.00 177.10 174.53 2x2a n ALA 103 N -0.43 3.14 0.00 3.54 0.00 -1.26 -5.06 120.51 120.44 2x2a n ALA 103 Ca -0.07 -2.93 0.00 0.00 0.00 0.00 0.00 53.44 50.43 2x2a n ALA 103 Cb 0.61 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.63 2x2a n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x2a n GLY 104 N -0.86 2.91 3.72 0.00 0.00 -1.26 -5.08 105.19 104.63 2x2a n GLY 104 Ca 0.16 -1.18 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 2x2a n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2x2a n PRO 105 N -1.29 2.40 -3.53 1.61 -0.04 -1.26 -3.35 135.00 129.54 2x2a n PRO 105 Ca 0.00 0.85 -0.21 0.00 -0.04 0.00 0.00 63.50 64.10 2x2a n PRO 105 Cb 0.00 -2.54 0.08 0.00 -0.04 0.00 0.00 33.50 31.00 2x2a n PRO 105 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2x2a n ASN 106 N 1.46 -3.83 -0.93 3.54 5.03 -1.26 -4.92 115.26 114.35 2x2a n ASN 106 Ca 0.07 -0.61 0.05 0.00 0.87 0.00 0.00 54.58 54.96 2x2a n ASN 106 Cb 0.36 -4.98 0.13 0.00 -1.02 0.00 0.00 39.78 34.27 2x2a n ASN 106 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 2x2a n THR 107 N -4.51 1.28 -2.06 3.41 -2.24 -1.21 -4.51 114.28 104.43 2x2a n THR 107 Ca -0.16 -2.25 -0.41 0.00 -2.27 0.00 0.00 64.05 58.96 2x2a n THR 107 Cb 0.62 0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 69.09 2x2a n THR 107 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2x2a s ASN 108 N -2.68 6.70 0.00 3.42 0.01 -0.90 -4.72 114.94 116.77 2x2a s ASN 108 Ca 0.35 2.72 0.00 0.00 -0.71 0.00 0.00 52.86 55.22 2x2a s ASN 108 Cb 0.36 -2.65 0.00 0.00 0.41 0.00 0.00 41.25 39.38 2x2a s ASN 108 CO -0.10 -0.61 0.00 0.61 -1.51 0.00 0.00 177.10 175.49 2x2a n GLY 109 N 1.08 2.12 0.00 0.66 0.00 -1.26 -0.78 105.19 107.00 2x2a n GLY 109 Ca 0.02 -0.19 0.02 0.00 0.00 0.00 0.00 46.02 45.87 2x2a n GLY 109 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2x2a n SER 110 N 0.00 3.78 -4.77 1.61 3.41 -1.25 -3.81 113.62 112.59 2x2a n SER 110 Ca 0.00 -0.03 -0.39 0.00 -0.26 0.00 0.00 58.87 58.19 2x2a n SER 110 Cb 0.00 1.19 -0.02 0.00 -0.26 0.00 0.00 64.21 65.12 2x2a n SER 110 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2x2a s GLN 111 N -2.25 4.04 0.19 4.33 -0.21 -1.25 -4.59 119.66 119.91 2x2a s GLN 111 Ca -0.01 1.94 -0.06 0.00 0.02 0.00 0.00 55.36 57.24 2x2a s GLN 111 Cb 0.03 -2.72 -0.02 0.00 1.00 0.00 0.00 33.01 31.30 2x2a s GLN 111 CO 0.18 -0.36 0.25 -0.59 -2.12 0.00 0.00 175.29 172.66 2x2a s PHE 112 N -1.36 0.68 0.04 0.91 -0.12 -0.68 -1.76 117.98 115.69 2x2a s PHE 112 Ca 0.57 -1.00 -0.00 0.00 -0.05 0.00 0.00 56.93 56.44 2x2a s PHE 112 Cb -0.33 -0.20 -0.03 0.00 -0.63 0.00 0.00 43.02 41.83 2x2a s PHE 112 CO 0.42 -0.74 -0.04 -0.59 -0.05 0.00 0.00 175.22 174.23 2x2a s PHE 113 N -4.05 0.46 -0.27 3.49 -0.71 0.10 -1.44 117.98 115.57 2x2a s PHE 113 Ca 0.26 -0.82 -0.04 0.00 -1.04 0.00 0.00 56.93 55.28 2x2a s PHE 113 Cb 0.04 -0.33 0.02 0.00 -1.21 0.00 0.00 43.02 41.54 2x2a s PHE 113 CO 0.06 -0.27 0.01 0.42 -1.34 0.00 0.00 175.22 174.09 2x2a s ILE 114 N -2.83 3.41 0.38 -4.49 1.01 -0.03 -1.76 121.20 116.88 2x2a s ILE 114 Ca -0.02 -0.86 -0.26 0.00 0.00 0.00 0.00 60.65 59.51 2x2a s ILE 114 Cb 0.00 -2.74 -0.09 0.00 0.01 0.00 0.00 42.46 39.64 2x2a s ILE 114 CO -0.06 0.14 1.18 0.00 0.00 0.00 0.00 174.94 176.21 2x2a n THR 116 N 0.30 1.14 -3.78 0.00 -2.24 -0.12 -0.39 114.28 109.19 2x2a n THR 116 Ca 0.03 -1.11 -0.08 0.00 -2.27 0.00 0.00 64.05 60.62 2x2a n THR 116 Cb 0.46 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 69.08 2x2a n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x2a s ALA 117 N -1.21 -1.24 0.15 6.98 0.00 -1.24 -4.56 121.76 120.63 2x2a s ALA 117 Ca 0.21 -0.18 -0.30 0.00 0.00 0.00 0.00 51.96 51.69 2x2a s ALA 117 Cb 0.12 0.87 -0.08 0.00 0.00 0.00 0.00 23.12 24.03 2x2a s ALA 117 CO 0.12 -0.97 1.30 0.21 0.00 0.00 0.00 175.76 176.42 2x2a s LYS 118 N -3.89 4.39 -0.54 0.00 2.20 -1.26 -3.83 119.74 116.81 2x2a s LYS 118 Ca 0.09 1.99 0.07 0.00 -0.36 0.00 0.00 55.97 57.77 2x2a s LYS 118 Cb -0.05 -3.24 0.29 0.00 -1.51 0.00 0.00 37.83 33.32 2x2a s LYS 118 CO 0.03 -0.29 0.75 0.25 -0.36 0.00 0.00 175.35 175.73 2x2a n THR 119 N 3.23 1.59 0.10 3.43 -2.24 -1.20 -4.92 114.28 114.26 2x2a n THR 119 Ca 0.08 -4.99 0.06 0.00 -2.27 0.00 0.00 64.05 56.93 2x2a n THR 119 Cb 0.43 -1.64 0.51 0.00 -2.10 0.00 0.00 70.33 67.54 2x2a n THR 119 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2x2a h LYS 120 N 3.66 0.32 0.00 -0.78 3.11 -1.94 -1.98 116.57 118.97 2x2a h LYS 120 Ca 0.14 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.96 2x2a h LYS 120 Cb 0.71 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.86 2x2a h LYS 120 CO 0.71 0.21 0.00 -2.67 -2.81 0.00 0.00 179.45 174.89 2x2a n TRP 121 N -4.50 0.46 1.21 1.91 2.14 -1.26 -1.57 117.44 115.83 2x2a n TRP 121 Ca 0.01 0.21 0.13 0.00 2.07 0.00 0.00 57.50 59.92 2x2a n TRP 121 Cb 0.08 -0.83 0.43 0.00 -0.81 0.00 0.00 31.31 30.18 2x2a n TRP 121 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2x2a n LEU 122 N -1.94 0.67 -4.72 5.67 4.77 -0.74 -4.90 117.00 115.81 2x2a n LEU 122 Ca 0.01 -0.07 -0.42 0.00 -0.03 0.00 0.00 56.01 55.50 2x2a n LEU 122 Cb 0.12 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 40.99 2x2a n LEU 122 CO 0.12 0.13 1.14 -1.81 -1.33 0.00 0.00 177.39 175.64 2x2a s ASP 123 N -2.65 6.69 0.00 -1.43 1.01 -0.61 -1.95 116.67 117.74 2x2a s ASP 123 Ca 0.22 2.51 0.00 0.00 0.71 0.00 0.00 52.55 55.99 2x2a s ASP 123 Cb 0.19 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2x2a s ASP 123 CO 0.55 -0.73 0.00 0.61 0.21 0.00 0.00 175.17 175.81 2x2a n GLY 124 N 3.38 0.71 2.53 0.21 0.00 -1.26 -5.11 105.19 105.66 2x2a n GLY 124 Ca 0.12 -0.71 -0.39 0.00 0.00 0.00 0.00 46.02 45.04 2x2a n GLY 124 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2x2a n HIS 126 N -3.24 -0.01 -2.46 1.61 8.25 -0.82 -5.03 115.22 113.51 2x2a n HIS 126 Ca 0.00 0.74 -0.43 0.00 -0.26 0.00 0.00 57.72 57.77 2x2a n HIS 126 Cb 0.33 -1.48 -0.02 0.00 1.12 0.00 0.00 29.99 29.94 2x2a n HIS 126 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2x2a s VAL 127 N -0.43 4.15 0.15 1.59 1.01 -1.26 -4.84 120.40 120.78 2x2a s VAL 127 Ca 0.55 1.27 -0.30 0.00 0.00 0.00 0.00 61.98 63.50 2x2a s VAL 127 Cb -0.79 -4.27 -0.07 0.00 0.00 0.00 0.00 36.38 31.25 2x2a s VAL 127 CO 0.42 -0.61 0.98 -0.69 0.00 0.00 0.00 175.10 175.19 2x2a s VAL 128 N 4.50 4.29 0.00 2.92 1.01 -1.26 -1.23 120.40 130.63 2x2a s VAL 128 Ca 0.55 1.99 0.00 0.00 0.00 0.00 0.00 61.98 64.52 2x2a s VAL 128 Cb -0.14 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.97 2x2a s VAL 128 CO 0.25 0.35 0.00 2.22 0.00 0.00 0.00 175.10 177.92 2x2a n PHE 129 N 2.42 0.00 -3.73 5.22 1.16 -0.32 -4.68 117.46 117.52 2x2a n PHE 129 Ca 0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 57.45 55.58 2x2a n PHE 129 Cb 0.48 0.01 0.01 0.00 -1.61 0.00 0.00 39.48 38.37 2x2a n PHE 129 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2x2a n GLY 130 N 0.00 0.84 3.41 4.97 0.00 -1.12 -0.30 105.19 112.98 2x2a n GLY 130 Ca 0.00 -1.04 -0.15 0.00 0.00 0.00 0.00 46.02 44.83 2x2a n GLY 130 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2x2a s LYS 131 N -2.03 0.82 0.21 1.61 2.20 -0.35 -1.01 119.74 121.20 2x2a s LYS 131 Ca 0.14 0.23 -0.32 0.00 -0.36 0.00 0.00 55.97 55.66 2x2a s LYS 131 Cb -0.01 0.38 -0.12 0.00 -1.51 0.00 0.00 37.83 36.57 2x2a s LYS 131 CO 0.03 -0.22 1.73 0.28 -0.36 0.00 0.00 175.35 176.81 2x2a n VAL 132 N 1.49 0.01 -0.12 4.02 0.31 0.22 -1.09 118.33 123.17 2x2a n VAL 132 Ca -0.19 -0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 63.99 2x2a n VAL 132 Cb 0.56 -1.99 -0.13 0.00 -0.91 0.00 0.00 33.84 31.38 2x2a n VAL 132 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2x2a n LYS 133 N 3.96 0.68 -3.78 5.55 4.81 0.11 -4.83 118.16 124.65 2x2a n LYS 133 Ca 0.16 0.09 -0.13 0.00 -0.87 0.00 0.00 58.31 57.57 2x2a n LYS 133 Cb 0.35 -1.51 -0.10 0.00 0.02 0.00 0.00 35.03 33.79 2x2a n LYS 133 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2x2a s GLU 134 N -2.50 0.48 0.00 1.64 2.56 -1.13 -4.95 118.70 114.80 2x2a s GLU 134 Ca -0.26 0.08 0.00 0.00 0.00 0.00 0.00 54.97 54.79 2x2a s GLU 134 Cb 0.08 0.22 0.00 0.00 2.00 0.00 0.00 34.13 36.43 2x2a s GLU 134 CO 0.66 -0.10 0.00 0.41 -0.56 0.00 0.00 175.26 175.67 2x2a n GLY 135 N 2.12 0.62 0.39 -1.50 0.00 -1.26 -1.10 105.19 104.46 2x2a n GLY 135 Ca -0.17 -0.74 0.19 0.00 0.00 0.00 0.00 46.02 45.30 2x2a n GLY 135 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2x2a h MET 136 N 0.00 0.22 0.00 1.61 -1.53 -1.92 -0.59 114.93 112.71 2x2a h MET 136 Ca 0.00 -0.01 -0.01 0.00 -3.44 0.00 0.00 59.70 56.24 2x2a h MET 136 Cb 0.11 -0.05 -0.00 0.00 -0.55 0.00 0.00 31.60 31.11 2x2a h MET 136 CO 0.00 0.14 -0.03 -2.95 0.14 0.00 0.00 176.91 174.22 2x2a h ASN 137 N 0.22 0.00 -0.24 1.39 -1.07 -1.96 -0.34 115.58 113.57 2x2a h ASN 137 Ca 0.34 0.00 -0.07 0.00 0.07 0.00 0.00 56.30 56.64 2x2a h ASN 137 Cb 1.02 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.27 2x2a h ASN 137 CO -0.07 0.03 -0.12 0.40 0.07 0.00 0.00 177.43 177.73 2x2a h ILE 138 N 0.00 1.30 -0.61 6.14 1.08 -1.46 -1.40 117.51 122.56 2x2a h ILE 138 Ca -0.00 -1.20 -0.04 0.00 -0.39 0.00 0.00 64.86 63.23 2x2a h ILE 138 Cb 0.05 1.57 -0.03 0.00 -3.07 0.00 0.00 36.82 35.34 2x2a h ILE 138 CO 0.00 0.37 0.24 0.58 -0.69 0.00 0.00 178.15 178.66 2x2a h VAL 139 N 0.23 1.23 -0.67 1.67 2.07 -1.05 0.66 116.25 120.39 2x2a h VAL 139 Ca 0.05 -0.73 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 2x2a h VAL 139 Cb 0.63 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 2x2a h VAL 139 CO 0.04 0.28 0.35 -0.33 0.02 0.00 0.00 177.57 177.93 2x2a h GLU 140 N 0.85 0.94 -0.44 1.57 5.08 -1.04 -0.75 114.58 120.79 2x2a h GLU 140 Ca 0.20 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2x2a h GLU 140 Cb 0.21 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2x2a h GLU 140 CO -0.02 0.71 0.08 0.00 -1.00 0.00 0.00 179.01 178.79 2x2a h ALA 141 N 1.43 0.59 -0.86 3.43 0.00 -0.57 -2.96 119.26 120.33 2x2a h ALA 141 Ca 0.24 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2x2a h ALA 141 Cb 0.06 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 2x2a h ALA 141 CO -0.03 0.30 0.54 0.52 0.00 0.00 0.00 179.25 180.57 2x2a h MET 142 N 0.59 0.98 -0.25 0.00 2.86 -0.40 -2.71 114.93 115.99 2x2a h MET 142 Ca 0.14 -0.06 0.02 0.00 -2.06 0.00 0.00 59.70 57.74 2x2a h MET 142 Cb 0.36 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 2x2a h MET 142 CO 0.01 0.65 0.17 1.49 1.06 0.00 0.00 176.91 180.28 2x2a h GLU 143 N 1.01 0.27 0.00 1.72 4.81 -0.97 -1.59 114.58 119.82 2x2a h GLU 143 Ca 0.36 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 2x2a h GLU 143 Cb 0.12 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2x2a h GLU 143 CO -0.15 0.18 0.00 0.00 -0.73 0.00 0.00 179.01 178.30 2x2a h ARG 144 N 0.27 0.00 -0.01 1.92 3.08 -1.49 -2.49 114.38 115.67 2x2a h ARG 144 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2x2a h ARG 144 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2x2a h ARG 144 CO -0.02 0.00 -0.10 1.19 -1.07 0.00 0.00 179.97 179.97 2x2a n PHE 145 N -2.60 0.00 -2.33 3.04 3.72 -0.60 -4.92 117.46 113.77 2x2a n PHE 145 Ca -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2x2a n PHE 145 Cb 0.16 -0.10 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 2x2a n PHE 145 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2x2a n GLY 146 N 1.23 0.98 3.81 1.37 0.00 -0.94 -0.67 105.19 110.97 2x2a n GLY 146 Ca 0.16 -1.98 -0.09 0.00 0.00 0.00 0.00 46.02 44.11 2x2a n GLY 146 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x2a s SER 147 N -1.00 -0.02 0.39 1.61 1.04 -0.74 -4.82 113.70 110.16 2x2a s SER 147 Ca 0.00 -1.05 0.08 0.00 0.48 0.00 0.00 55.95 55.45 2x2a s SER 147 Cb 0.00 0.82 0.83 0.00 0.10 0.00 0.00 66.02 67.77 2x2a s SER 147 CO 0.00 -1.61 2.00 0.03 0.98 0.00 0.00 173.24 174.63 2x2a h ARG 148 N 2.01 0.61 -0.01 4.02 2.47 -1.90 -0.93 114.38 120.64 2x2a h ARG 148 Ca -0.30 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.39 2x2a h ARG 148 Cb 1.25 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 29.43 2x2a h ARG 148 CO 0.37 0.40 -0.16 0.27 0.56 0.00 0.00 179.97 181.41 2x2a n ASN 149 N -4.47 1.66 0.00 7.04 6.94 -1.26 -4.96 115.26 120.21 2x2a n ASN 149 Ca 0.08 -1.37 0.00 0.00 -0.02 0.00 0.00 54.58 53.27 2x2a n ASN 149 Cb 0.20 0.12 0.00 0.00 -2.36 0.00 0.00 39.78 37.74 2x2a n ASN 149 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2x2a n GLY 150 N 1.30 0.08 3.73 4.83 0.00 -0.35 -4.88 105.19 109.89 2x2a n GLY 150 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2x2a n GLY 150 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2x2a s LYS 151 N -0.97 4.16 0.16 1.61 2.20 -1.26 -1.31 119.74 124.34 2x2a s LYS 151 Ca 0.00 2.51 -0.04 0.00 -0.36 0.00 0.00 55.97 58.08 2x2a s LYS 151 Cb 0.00 -3.09 -0.05 0.00 -1.51 0.00 0.00 37.83 33.18 2x2a s LYS 151 CO 0.00 -0.66 0.39 0.95 -0.36 0.00 0.00 175.35 175.68 2x2a s THR 152 N 0.78 5.16 -0.96 3.43 -4.23 -1.26 -3.10 115.64 115.46 2x2a s THR 152 Ca 0.69 -0.04 0.24 0.00 -1.18 0.00 0.00 61.69 61.40 2x2a s THR 152 Cb -0.47 -3.65 -0.08 0.00 1.34 0.00 0.00 72.50 69.64 2x2a s THR 152 CO 0.37 -0.03 1.22 -1.54 -0.54 0.00 0.00 174.62 174.09 2x2a n SER 153 N -0.13 0.67 -4.07 3.99 3.41 0.15 -4.83 113.62 112.82 2x2a n SER 153 Ca -0.03 -0.49 -0.11 0.00 -0.26 0.00 0.00 58.87 57.99 2x2a n SER 153 Cb 0.52 0.54 -0.11 0.00 -0.26 0.00 0.00 64.21 64.90 2x2a n SER 153 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2x2a s LYS 154 N -3.02 0.55 -0.17 4.33 1.02 -1.26 -5.13 119.74 116.06 2x2a s LYS 154 Ca 0.09 -0.91 -0.29 0.00 0.02 0.00 0.00 55.97 54.88 2x2a s LYS 154 Cb 0.17 -0.11 -0.00 0.00 -0.52 0.00 0.00 37.83 37.37 2x2a s LYS 154 CO 0.76 -0.01 1.12 0.15 -0.92 0.00 0.00 175.35 176.45 2x2a s LYS 155 N -2.38 4.28 -0.29 1.68 1.02 -1.26 -4.88 119.74 117.92 2x2a s LYS 155 Ca -0.04 1.49 -0.06 0.00 0.02 0.00 0.00 55.97 57.38 2x2a s LYS 155 Cb -0.04 -3.66 0.01 0.00 -0.52 0.00 0.00 37.83 33.62 2x2a s LYS 155 CO -0.03 -0.59 0.06 0.42 -0.92 0.00 0.00 175.35 174.29 2x2a s ILE 156 N 3.03 3.83 0.19 2.17 -1.09 -1.26 -0.58 121.20 127.49 2x2a s ILE 156 Ca 0.49 -0.71 0.09 0.00 -2.23 0.00 0.00 60.65 58.29 2x2a s ILE 156 Cb -0.19 -2.96 -0.04 0.00 -1.58 0.00 0.00 42.46 37.69 2x2a s ILE 156 CO 0.12 0.11 -0.17 0.42 -1.23 0.00 0.00 174.94 174.19 2x2a s THR 157 N 1.48 1.88 -0.94 2.92 -4.23 -0.18 -1.05 115.64 115.52 2x2a s THR 157 Ca 0.02 -2.06 -0.17 0.00 -1.18 0.00 0.00 61.69 58.30 2x2a s THR 157 Cb -0.17 -1.96 0.15 0.00 1.34 0.00 0.00 72.50 71.86 2x2a s THR 157 CO 0.02 -0.40 1.10 -0.63 -0.54 0.00 0.00 174.62 174.16 2x2a s ILE 158 N -2.35 4.92 0.30 2.99 1.01 -0.01 -1.06 121.20 127.01 2x2a s ILE 158 Ca 0.19 -1.85 0.03 0.00 0.00 0.00 0.00 60.65 59.02 2x2a s ILE 158 Cb -0.04 -4.74 0.12 0.00 0.01 0.00 0.00 42.46 37.80 2x2a s ILE 158 CO 0.08 -1.44 1.80 0.00 0.00 0.00 0.00 174.94 175.38 2x2a h ALA 159 N 8.47 1.23 -2.65 9.38 0.00 -0.95 0.20 119.26 134.94 2x2a h ALA 159 Ca 0.16 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 2x2a h ALA 159 Cb 1.01 -0.14 -0.14 0.00 0.00 0.00 0.00 17.79 18.52 2x2a h ALA 159 CO 1.06 0.50 -0.15 0.34 0.00 0.00 0.00 179.25 181.01 2x2a s ASP 160 N -6.76 -0.17 0.18 0.00 2.15 -1.17 -4.47 116.67 106.43 2x2a s ASP 160 Ca -0.08 -0.31 -0.22 0.00 0.43 0.00 0.00 52.55 52.37 2x2a s ASP 160 Cb 0.15 0.43 0.06 0.00 -0.30 0.00 0.00 42.92 43.25 2x2a s ASP 160 CO 0.78 -0.77 0.61 0.00 -0.17 0.00 0.00 175.17 175.62 2x2a n GLY 162 N -0.39 -1.03 3.57 0.00 0.00 -0.83 -4.67 105.19 101.85 2x2a n GLY 162 Ca -0.14 -0.88 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 2x2a n GLY 162 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2x2a s GLN 163 N -0.65 2.87 -0.09 1.61 0.74 -1.26 -0.68 119.66 122.20 2x2a s GLN 163 Ca 0.00 -0.54 -0.05 0.00 0.05 0.00 0.00 55.36 54.81 2x2a s GLN 163 Cb 0.00 -2.63 -0.04 0.00 1.10 0.00 0.00 33.01 31.44 2x2a s GLN 163 CO 0.00 0.61 0.12 -0.51 -0.55 0.00 0.00 175.29 174.96 2x2a s LEU 164 N -0.66 4.25 0.00 3.68 1.43 -0.29 -4.94 118.68 122.16 2x2a s LEU 164 Ca 0.10 0.39 0.00 0.00 -1.03 0.00 0.00 54.13 53.59 2x2a s LEU 164 Cb -0.11 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 43.98 2x2a s LEU 164 CO 0.02 0.38 0.00 -0.62 0.23 0.00 0.00 176.35 176.35