#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x2c s VAL 2 N 0.00 0.34 0.17 1.12 1.01 -1.26 -5.13 120.40 116.66 2x2c s VAL 2 Ca 0.00 0.09 -0.32 0.00 0.00 0.00 0.00 61.98 61.75 2x2c s VAL 2 Cb 0.00 -0.47 -0.11 0.00 0.00 0.00 0.00 36.38 35.80 2x2c s VAL 2 CO 0.00 0.23 1.75 0.20 0.00 0.00 0.00 175.10 177.27 2x2c s ASN 3 N 1.61 6.41 0.96 3.32 0.01 -1.26 -4.94 114.94 121.04 2x2c s ASN 3 Ca -0.01 2.81 -0.11 0.00 -0.71 0.00 0.00 52.86 54.84 2x2c s ASN 3 Cb -0.13 -2.59 0.13 0.00 0.41 0.00 0.00 41.25 39.07 2x2c s ASN 3 CO -0.03 -0.97 0.90 -0.81 -1.51 0.00 0.00 177.10 174.67 2x2c n PRO 4 N 4.58 -0.62 -4.35 -0.60 -0.04 -1.26 -4.79 135.00 127.92 2x2c n PRO 4 Ca 0.16 -0.13 -0.26 0.00 -0.04 0.00 0.00 63.50 63.23 2x2c n PRO 4 Cb 0.36 -2.20 -0.17 0.00 -0.04 0.00 0.00 33.50 31.46 2x2c n PRO 4 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2x2c s THR 5 N -2.54 1.23 0.32 0.52 2.01 -1.25 -1.65 115.64 114.27 2x2c s THR 5 Ca 0.64 -0.48 0.09 0.00 0.31 0.00 0.00 61.69 62.25 2x2c s THR 5 Cb -0.22 -1.15 -0.05 0.00 0.01 0.00 0.00 72.50 71.09 2x2c s THR 5 CO 0.61 0.39 0.06 0.68 -0.69 0.00 0.00 174.62 175.67 2x2c s VAL 6 N 1.06 3.04 0.08 3.82 -7.23 -0.74 -1.00 120.40 119.44 2x2c s VAL 6 Ca -0.06 -1.85 0.06 0.00 -1.81 0.00 0.00 61.98 58.32 2x2c s VAL 6 Cb -0.15 -2.88 -0.03 0.00 0.56 0.00 0.00 36.38 33.88 2x2c s VAL 6 CO -0.01 -0.25 -0.16 0.72 -0.31 0.00 0.00 175.10 175.08 2x2c s PHE 7 N -2.42 1.39 -0.02 2.82 -0.12 0.20 -0.62 117.98 119.21 2x2c s PHE 7 Ca 0.35 -0.44 0.07 0.00 -0.05 0.00 0.00 56.93 56.86 2x2c s PHE 7 Cb -0.03 -0.78 -0.02 0.00 -0.63 0.00 0.00 43.02 41.57 2x2c s PHE 7 CO 0.21 0.10 -0.24 -0.06 -0.05 0.00 0.00 175.22 175.17 2x2c s PHE 8 N -1.22 2.21 -0.36 3.49 0.08 0.15 -1.70 117.98 120.64 2x2c s PHE 8 Ca 0.01 -0.45 -0.10 0.00 0.12 0.00 0.00 56.93 56.50 2x2c s PHE 8 Cb -0.10 -1.42 0.02 0.00 -0.57 0.00 0.00 43.02 40.95 2x2c s PHE 8 CO 0.03 -0.06 0.18 -0.51 -0.10 0.00 0.00 175.22 174.75 2x2c s ASP 9 N -0.50 5.62 -0.07 1.36 1.01 0.54 -0.23 116.67 124.40 2x2c s ASP 9 Ca 0.07 -0.93 -0.16 0.00 0.71 0.00 0.00 52.55 52.24 2x2c s ASP 9 Cb -0.10 -1.99 -0.05 0.00 1.01 0.00 0.00 42.92 41.79 2x2c s ASP 9 CO -0.00 -0.34 0.41 -0.63 0.21 0.00 0.00 175.17 174.82 2x2c s ILE 10 N 1.54 5.14 0.07 0.77 -1.09 0.56 -1.11 121.20 127.08 2x2c s ILE 10 Ca 0.02 0.82 0.07 0.00 -2.23 0.00 0.00 60.65 59.33 2x2c s ILE 10 Cb -0.19 -3.73 -0.04 0.00 -1.58 0.00 0.00 42.46 36.92 2x2c s ILE 10 CO 0.06 0.45 -0.16 0.00 -1.23 0.00 0.00 174.94 174.06 2x2c s ALA 11 N -0.15 2.72 -0.21 9.38 0.00 -0.35 -0.42 121.76 132.73 2x2c s ALA 11 Ca 0.23 -1.23 -0.02 0.00 0.00 0.00 0.00 51.96 50.94 2x2c s ALA 11 Cb -0.15 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.19 2x2c s ALA 11 CO 0.10 0.59 -0.10 0.08 0.00 0.00 0.00 175.76 176.44 2x2c s VAL 12 N -1.04 2.91 -1.21 0.00 1.01 0.05 -0.98 120.40 121.14 2x2c s VAL 12 Ca 0.17 -0.65 -0.13 0.00 0.00 0.00 0.00 61.98 61.37 2x2c s VAL 12 Cb -0.11 -2.30 0.02 0.00 0.00 0.00 0.00 36.38 33.99 2x2c s VAL 12 CO 0.08 0.46 0.24 0.47 0.00 0.00 0.00 175.10 176.36 2x2c n ASP 13 N 4.74 -0.98 0.00 3.32 8.00 -0.51 -1.22 116.55 129.89 2x2c n ASP 13 Ca -0.19 -1.11 0.00 0.00 0.71 0.00 0.00 54.79 54.20 2x2c n ASP 13 Cb 0.51 -1.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.25 2x2c n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x2c n GLY 14 N -2.19 2.25 3.61 0.44 0.00 -1.26 -5.02 105.19 103.03 2x2c n GLY 14 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 2x2c n GLY 14 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x2c s GLU 15 N -0.06 4.02 0.23 1.61 2.56 -0.36 -5.00 118.70 121.70 2x2c s GLU 15 Ca 0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 54.97 54.59 2x2c s GLU 15 Cb 0.00 -3.63 -0.11 0.00 2.00 0.00 0.00 34.13 32.39 2x2c s GLU 15 CO 0.00 -0.19 1.61 -2.14 -0.56 0.00 0.00 175.26 173.97 2x2c s PRO 16 N 1.80 4.16 -0.22 4.30 0.02 -1.26 -0.77 135.00 143.03 2x2c s PRO 16 Ca 0.12 2.50 -0.11 0.00 0.02 0.00 0.00 61.00 63.53 2x2c s PRO 16 Cb -0.16 -3.08 -0.09 0.00 0.02 0.00 0.00 34.50 31.19 2x2c s PRO 16 CO 0.09 -0.63 -0.29 -0.11 -0.33 0.00 0.00 177.00 175.74 2x2c n LEU 17 N 3.13 1.56 0.00 -5.54 7.94 0.44 -4.87 117.00 119.65 2x2c n LEU 17 Ca 0.11 0.27 0.00 0.00 -1.11 0.00 0.00 56.01 55.29 2x2c n LEU 17 Cb 0.37 -0.65 0.00 0.00 0.53 0.00 0.00 43.42 43.67 2x2c n LEU 17 CO 0.63 0.43 0.00 0.61 -1.11 0.00 0.00 177.39 177.95 2x2c n GLY 18 N 1.62 -0.77 3.39 -3.96 0.00 -1.13 -5.00 105.19 99.34 2x2c n GLY 18 Ca -0.42 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 44.34 2x2c n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2x2c s ARG 19 N -1.08 3.29 -0.10 1.61 3.52 -1.26 -0.33 118.95 124.60 2x2c s ARG 19 Ca 0.00 -0.68 -0.01 0.00 -0.13 0.00 0.00 55.73 54.91 2x2c s ARG 19 Cb 0.00 -2.61 -0.03 0.00 -1.56 0.00 0.00 34.95 30.75 2x2c s ARG 19 CO 0.00 0.27 -0.04 0.08 -0.81 0.00 0.00 175.30 174.79 2x2c s VAL 20 N 0.21 3.90 0.15 7.11 1.01 0.68 -4.22 120.40 129.25 2x2c s VAL 20 Ca -0.08 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.59 2x2c s VAL 20 Cb -0.15 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 2x2c s VAL 20 CO 0.05 0.57 -0.18 -0.94 0.00 0.00 0.00 175.10 174.61 2x2c s SER 21 N -0.50 2.54 -0.00 3.32 1.04 0.05 -0.68 113.70 119.47 2x2c s SER 21 Ca 0.08 -0.84 0.02 0.00 0.48 0.00 0.00 55.95 55.68 2x2c s SER 21 Cb -0.12 -0.14 -0.00 0.00 0.10 0.00 0.00 66.02 65.86 2x2c s SER 21 CO 0.02 -0.05 -0.05 -0.36 0.98 0.00 0.00 173.24 173.78 2x2c s PHE 22 N -2.02 0.44 0.05 5.02 0.08 0.21 0.03 117.98 121.80 2x2c s PHE 22 Ca 0.14 -0.08 -0.22 0.00 0.12 0.00 0.00 56.93 56.89 2x2c s PHE 22 Cb -0.06 -0.29 -0.06 0.00 -0.57 0.00 0.00 43.02 42.04 2x2c s PHE 22 CO 0.06 -0.01 0.65 -2.00 -0.10 0.00 0.00 175.22 173.82 2x2c s GLU 23 N -0.09 4.36 -0.19 0.44 2.12 -0.05 -1.79 118.70 123.50 2x2c s GLU 23 Ca 0.02 0.86 -0.06 0.00 0.36 0.00 0.00 54.97 56.15 2x2c s GLU 23 Cb -0.02 -3.31 -0.03 0.00 0.26 0.00 0.00 34.13 31.03 2x2c s GLU 23 CO -0.00 0.45 0.03 -0.51 -0.54 0.00 0.00 175.26 174.69 2x2c s LEU 24 N -0.53 3.55 -1.50 2.70 1.43 -0.66 -1.13 118.68 122.54 2x2c s LEU 24 Ca 0.33 -0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 53.27 2x2c s LEU 24 Cb -0.20 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.13 2x2c s LEU 24 CO 0.20 0.13 2.53 0.49 0.23 0.00 0.00 176.35 179.94 2x2c n PHE 25 N 3.80 2.89 0.31 0.29 3.72 0.14 -4.18 117.46 124.43 2x2c n PHE 25 Ca -0.17 -3.00 0.19 0.00 -0.05 0.00 0.00 57.45 54.43 2x2c n PHE 25 Cb 0.52 -2.39 1.06 0.00 -0.94 0.00 0.00 39.48 37.73 2x2c n PHE 25 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2x2c h ALA 26 N 5.38 1.28 -0.00 4.37 0.00 -1.83 -0.68 119.26 127.77 2x2c h ALA 26 Ca 0.70 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.61 2x2c h ALA 26 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2x2c h ALA 26 CO 1.77 -0.07 -0.06 -0.40 0.00 0.00 0.00 179.25 180.50 2x2c n ASP 27 N -3.37 0.26 -0.01 0.00 5.75 -1.26 -2.94 116.55 114.98 2x2c n ASP 27 Ca -0.02 -0.46 -0.01 0.00 -0.01 0.00 0.00 54.79 54.29 2x2c n ASP 27 Cb 0.13 -0.15 -0.01 0.00 -1.03 0.00 0.00 41.12 40.07 2x2c n ASP 27 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2x2c n LYS 28 N -1.08 0.08 -3.34 0.11 4.76 -0.36 -4.91 118.16 113.43 2x2c n LYS 28 Ca 0.15 0.01 -0.26 0.00 -2.87 0.00 0.00 58.31 55.35 2x2c n LYS 28 Cb 0.25 -1.03 -0.08 0.00 -1.84 0.00 0.00 35.03 32.32 2x2c n LYS 28 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2x2c n VAL 29 N -2.54 -0.20 -0.08 -0.18 0.24 -0.64 -4.93 118.33 110.01 2x2c n VAL 29 Ca -0.03 -4.10 0.03 0.00 -2.04 0.00 0.00 64.34 58.21 2x2c n VAL 29 Cb 0.53 -1.91 0.37 0.00 -1.47 0.00 0.00 33.84 31.35 2x2c n VAL 29 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2x2c h PRO 30 N 4.58 0.68 -0.26 7.34 0.13 -1.71 -1.25 132.00 141.51 2x2c h PRO 30 Ca 0.15 -0.04 -0.15 0.00 -0.87 0.00 0.00 66.00 65.09 2x2c h PRO 30 Cb 0.85 -0.15 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 2x2c h PRO 30 CO 0.51 0.45 -0.43 -0.22 -0.23 0.00 0.00 178.00 178.08 2x2c h LYS 31 N 0.70 0.76 -0.14 0.86 3.64 -1.94 -0.49 116.57 119.96 2x2c h LYS 31 Ca 0.20 -0.46 -0.02 0.00 -1.27 0.00 0.00 60.65 59.10 2x2c h LYS 31 Cb -0.04 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2x2c h LYS 31 CO -0.05 1.09 0.00 1.15 -2.27 0.00 0.00 179.45 179.37 2x2c h THR 32 N 0.50 1.25 -0.41 1.00 2.02 -1.92 -2.10 112.91 113.25 2x2c h THR 32 Ca 0.02 -0.83 0.08 0.00 0.77 0.00 0.00 66.41 66.45 2x2c h THR 32 Cb 1.03 1.53 -0.07 0.00 -1.74 0.00 0.00 68.15 68.90 2x2c h THR 32 CO 0.10 0.24 -0.01 0.00 0.37 0.00 0.00 175.52 176.22 2x2c h ALA 33 N 0.76 0.37 -0.92 6.16 0.00 -1.24 -2.68 119.26 121.71 2x2c h ALA 33 Ca 0.04 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2x2c h ALA 33 Cb 0.37 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2x2c h ALA 33 CO 0.01 -0.40 0.57 1.49 0.00 0.00 0.00 179.25 180.93 2x2c h GLU 34 N 0.10 1.24 0.13 0.00 4.57 -1.03 -0.73 114.58 118.86 2x2c h GLU 34 Ca 0.20 -0.10 0.01 0.00 -1.18 0.00 0.00 59.36 58.29 2x2c h GLU 34 Cb 0.29 -0.27 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 2x2c h GLU 34 CO -0.35 0.85 -0.15 -0.97 -1.18 0.00 0.00 179.01 177.22 2x2c h ASN 35 N 1.27 -0.39 -0.51 1.04 -1.24 -1.07 -1.34 115.58 113.34 2x2c h ASN 35 Ca 0.33 0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.38 2x2c h ASN 35 Cb -0.08 0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.08 2x2c h ASN 35 CO -0.07 -0.22 0.32 0.15 -1.29 0.00 0.00 177.43 176.32 2x2c h PHE 36 N -0.31 0.66 -0.08 0.67 3.57 -1.29 -0.60 116.94 119.55 2x2c h PHE 36 Ca 0.01 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.53 2x2c h PHE 36 Cb 0.30 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2x2c h PHE 36 CO -0.14 0.44 -0.04 -0.09 -2.23 0.00 0.00 178.31 176.26 2x2c h ARG 37 N 0.68 -0.03 -0.03 1.11 2.43 -0.95 0.15 114.38 117.75 2x2c h ARG 37 Ca 0.18 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.23 2x2c h ARG 37 Cb -0.04 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 2x2c h ARG 37 CO -0.04 -0.02 -0.55 0.00 -1.51 0.00 0.00 179.97 177.86 2x2c h ALA 38 N 1.05 1.04 -0.02 2.80 0.00 -1.10 -0.16 119.26 122.87 2x2c h ALA 38 Ca 0.04 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 54.32 2x2c h ALA 38 Cb 0.09 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2x2c h ALA 38 CO -0.10 0.69 -0.63 -0.07 0.00 0.00 0.00 179.25 179.14 2x2c h LEU 39 N 0.06 0.08 -0.33 0.00 3.38 -0.76 -2.13 115.31 115.61 2x2c h LEU 39 Ca -0.00 -0.05 -0.19 0.00 0.09 0.00 0.00 57.88 57.73 2x2c h LEU 39 Cb 0.99 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2x2c h LEU 39 CO 0.08 0.68 -0.66 0.28 0.09 0.00 0.00 178.44 178.91 2x2c h SER 40 N 0.05 0.77 1.45 -0.43 0.02 -0.08 -1.36 113.55 113.97 2x2c h SER 40 Ca -0.01 -0.46 -0.06 0.00 -0.84 0.00 0.00 61.79 60.42 2x2c h SER 40 Cb 1.12 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 2x2c h SER 40 CO 0.09 1.23 -0.28 0.71 -1.14 0.00 0.00 176.83 177.43 2x2c h THR 41 N 0.49 0.53 0.00 -2.27 1.35 -0.98 -3.07 112.91 108.96 2x2c h THR 41 Ca -0.02 -1.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.29 2x2c h THR 41 Cb 1.25 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 69.78 2x2c h THR 41 CO 0.13 0.28 0.00 0.61 -0.25 0.00 0.00 175.52 176.29 2x2c n GLY 42 N 0.86 0.78 0.24 5.82 0.00 -0.81 -4.91 105.19 107.18 2x2c n GLY 42 Ca 0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.20 2x2c n GLY 42 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2x2c h GLU 43 N 2.67 0.00 -0.01 1.61 4.11 -1.79 -0.52 114.58 120.65 2x2c h GLU 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2x2c h GLU 43 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2x2c h GLU 43 CO 0.00 0.00 -0.10 1.63 0.07 0.00 0.00 179.01 180.61 2x2c n LYS 44 N -2.88 0.86 -0.17 1.06 4.76 -1.26 -4.94 118.16 115.60 2x2c n LYS 44 Ca 0.01 -0.33 0.00 0.00 -2.87 0.00 0.00 58.31 55.12 2x2c n LYS 44 Cb 0.28 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 2x2c n LYS 44 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2x2c n GLY 45 N 1.24 0.83 3.70 0.72 0.00 -0.20 -5.06 105.19 106.42 2x2c n GLY 45 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 2x2c n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2x2c s PHE 46 N -2.08 -0.00 -5.00 1.61 -0.71 -1.25 -5.12 117.98 105.42 2x2c s PHE 46 Ca 0.00 -0.40 0.00 0.00 -1.04 0.00 0.00 56.93 55.49 2x2c s PHE 46 Cb 0.00 0.48 0.00 0.00 -1.21 0.00 0.00 43.02 42.29 2x2c s PHE 46 CO 0.00 -1.09 0.00 0.41 -1.34 0.00 0.00 175.22 173.20 2x2c n GLY 47 N -0.41 -0.15 0.28 1.99 0.00 -1.26 -4.35 105.19 101.28 2x2c n GLY 47 Ca -0.05 -1.61 0.15 0.00 0.00 0.00 0.00 46.02 44.51 2x2c n GLY 47 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2x2c h TYR 48 N 0.00 0.00 -2.61 1.61 0.05 -1.56 -3.44 116.97 111.01 2x2c h TYR 48 Ca 0.00 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.26 2x2c h TYR 48 Cb 0.00 0.00 0.04 0.00 1.01 0.00 0.00 36.73 37.78 2x2c h TYR 48 CO 0.00 0.09 1.05 0.21 -1.05 0.00 0.00 178.16 178.46 2x2c s LYS 49 N -4.09 4.15 0.00 4.88 2.20 -1.26 -1.04 119.74 124.57 2x2c s LYS 49 Ca -0.02 2.55 0.00 0.00 -0.36 0.00 0.00 55.97 58.13 2x2c s LYS 49 Cb 0.12 -3.42 0.00 0.00 -1.51 0.00 0.00 37.83 33.03 2x2c s LYS 49 CO 0.55 -0.79 0.00 0.41 -0.36 0.00 0.00 175.35 175.17 2x2c n GLY 50 N 4.10 3.08 3.73 5.54 0.00 0.11 -5.04 105.19 116.71 2x2c n GLY 50 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2x2c n GLY 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x2c s SER 51 N -1.19 3.68 0.34 1.61 1.04 -0.21 -4.67 113.70 114.30 2x2c s SER 51 Ca 0.00 1.58 0.10 0.00 0.48 0.00 0.00 55.95 58.11 2x2c s SER 51 Cb 0.00 -2.26 -0.06 0.00 0.10 0.00 0.00 66.02 63.80 2x2c s SER 51 CO 0.00 -2.52 -0.10 0.00 0.98 0.00 0.00 173.24 171.60 2x2c s PHE 53 N -2.59 3.04 -0.66 0.00 0.40 0.02 -4.19 117.98 114.00 2x2c s PHE 53 Ca 0.32 -0.31 0.25 0.00 -0.60 0.00 0.00 56.93 56.59 2x2c s PHE 53 Cb 0.01 -3.46 0.47 0.00 0.51 0.00 0.00 43.02 40.56 2x2c s PHE 53 CO 0.17 -0.97 1.45 1.12 0.70 0.00 0.00 175.22 177.68 2x2c h HIS 54 N 8.96 0.00 -2.95 0.36 2.07 -1.76 -3.43 115.15 118.40 2x2c h HIS 54 Ca -0.27 0.00 -0.40 0.00 -2.85 0.00 0.00 60.37 56.86 2x2c h HIS 54 Cb 1.09 0.00 -0.39 0.00 2.57 0.00 0.00 27.41 30.68 2x2c h HIS 54 CO 0.74 0.00 -0.71 0.50 -3.07 0.00 0.00 177.93 175.40 2x2c s ARG 55 N -3.15 0.07 -0.11 5.12 3.52 -1.16 -4.60 118.95 118.64 2x2c s ARG 55 Ca 0.07 0.10 0.02 0.00 -0.13 0.00 0.00 55.73 55.79 2x2c s ARG 55 Cb 0.13 -1.39 0.01 0.00 -1.56 0.00 0.00 34.95 32.14 2x2c s ARG 55 CO 0.69 -0.60 -0.17 0.42 -0.81 0.00 0.00 175.30 174.83 2x2c s ILE 56 N 2.20 1.61 -0.22 4.11 1.01 -0.51 -0.72 121.20 128.69 2x2c s ILE 56 Ca 0.04 -0.71 0.01 0.00 0.00 0.00 0.00 60.65 59.98 2x2c s ILE 56 Cb -0.15 -1.46 0.05 0.00 0.01 0.00 0.00 42.46 40.91 2x2c s ILE 56 CO -0.09 0.46 -0.08 -0.63 0.00 0.00 0.00 174.94 174.61 2x2c s ILE 57 N 0.94 1.60 0.18 2.92 1.01 -0.76 -1.94 121.20 125.15 2x2c s ILE 57 Ca -0.07 -1.13 -0.33 0.00 0.00 0.00 0.00 60.65 59.12 2x2c s ILE 57 Cb -0.15 -1.77 -0.14 0.00 0.01 0.00 0.00 42.46 40.41 2x2c s ILE 57 CO -0.01 0.03 1.50 -2.65 0.00 0.00 0.00 174.94 173.81 2x2c n PRO 58 N 4.67 2.04 -0.25 2.79 -0.02 -1.26 -1.29 135.00 141.68 2x2c n PRO 58 Ca -0.13 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2x2c n PRO 58 Cb 0.45 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 2x2c n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x2c n GLY 59 N 2.92 1.57 0.66 -1.23 0.00 -1.26 -4.84 105.19 103.00 2x2c n GLY 59 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2x2c n GLY 59 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2x2c n PHE 60 N -2.00 0.00 -3.56 1.61 7.35 -0.41 -4.44 117.46 116.01 2x2c n PHE 60 Ca 0.00 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.63 2x2c n PHE 60 Cb 0.00 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 39.81 2x2c n PHE 60 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2x2c s MET 61 N -0.68 0.59 -0.14 -4.13 0.23 -0.96 -0.83 119.30 113.38 2x2c s MET 61 Ca 0.00 -0.23 -0.02 0.00 -1.03 0.00 0.00 55.69 54.42 2x2c s MET 61 Cb 0.00 0.26 -0.02 0.00 -1.53 0.00 0.00 34.83 33.54 2x2c s MET 61 CO 0.00 -0.26 -0.08 0.00 -2.03 0.00 0.00 175.02 172.65 2x2c s GLN 63 N 0.33 3.09 0.00 0.00 0.74 0.11 -0.38 119.66 123.55 2x2c s GLN 63 Ca -0.07 -0.85 0.00 0.00 0.05 0.00 0.00 55.36 54.49 2x2c s GLN 63 Cb -0.15 -2.36 0.00 0.00 1.10 0.00 0.00 33.01 31.60 2x2c s GLN 63 CO 0.04 0.15 0.00 0.41 -0.55 0.00 0.00 175.29 175.35 2x2c n GLY 64 N 3.61 4.31 0.14 2.59 0.00 -0.52 -2.30 105.19 113.01 2x2c n GLY 64 Ca -0.19 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.80 2x2c n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x2c n GLY 65 N 0.00 0.20 3.43 -0.02 0.00 -1.26 -0.81 105.19 106.74 2x2c n GLY 65 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2x2c n GLY 65 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2x2c n ASP 66 N 0.00 5.03 0.02 1.61 -0.08 -1.26 -4.04 116.55 117.83 2x2c n ASP 66 Ca 0.00 -2.96 0.13 0.00 -1.51 0.00 0.00 54.79 50.45 2x2c n ASP 66 Cb 0.00 -1.64 0.43 0.00 2.34 0.00 0.00 41.12 42.24 2x2c n ASP 66 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 2x2c n PHE 67 N 6.65 0.15 -0.08 -0.67 1.16 -1.26 -1.69 117.46 121.72 2x2c n PHE 67 Ca 0.43 0.04 -0.11 0.00 -1.87 0.00 0.00 57.45 55.94 2x2c n PHE 67 Cb 0.43 -0.47 -0.15 0.00 -1.61 0.00 0.00 39.48 37.68 2x2c n PHE 67 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 2x2c n THR 68 N -1.64 1.47 -0.02 1.97 -2.24 -1.26 -4.73 114.28 107.84 2x2c n THR 68 Ca 0.06 -0.81 0.00 0.00 -2.27 0.00 0.00 64.05 61.03 2x2c n THR 68 Cb 0.36 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 2x2c n THR 68 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2x2c n ARG 69 N -2.89 5.25 -1.56 -0.78 5.12 -1.25 -4.90 116.66 115.66 2x2c n ARG 69 Ca -0.30 -0.06 -0.19 0.00 -1.93 0.00 0.00 57.85 55.37 2x2c n ARG 69 Cb 1.12 -0.51 -0.08 0.00 -1.16 0.00 0.00 32.46 31.83 2x2c n ARG 69 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2x2c n HIS 70 N -0.77 -0.03 -1.26 -1.55 8.25 -0.68 -4.76 115.22 114.41 2x2c n HIS 70 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2x2c n HIS 70 Cb 0.00 -3.35 0.00 0.00 1.12 0.00 0.00 29.99 27.77 2x2c n HIS 70 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2x2c n ASN 71 N -1.28 0.00 0.00 0.41 0.23 -1.26 -4.77 115.26 108.59 2x2c n ASN 71 Ca -0.19 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.86 2x2c n ASN 71 Cb 0.66 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.36 2x2c n ASN 71 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x2c n GLY 72 N 0.00 1.13 0.78 4.83 0.00 -1.26 -4.94 105.19 105.72 2x2c n GLY 72 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2x2c n GLY 72 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2x2c n THR 73 N -1.74 0.00 -0.73 2.61 -2.24 -1.26 -4.98 114.28 105.94 2x2c n THR 73 Ca 0.00 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 2x2c n THR 73 Cb 0.00 1.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.61 2x2c n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x2c n GLY 74 N 1.37 5.14 0.70 3.38 0.00 -1.26 -4.97 105.19 109.55 2x2c n GLY 74 Ca 0.12 -1.68 0.07 0.00 0.00 0.00 0.00 46.02 44.53 2x2c n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x2c n GLY 75 N 5.00 -3.07 3.13 -0.02 0.00 -1.26 -4.78 105.19 104.18 2x2c n GLY 75 Ca 0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 2x2c n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x2c s LYS 76 N -3.83 0.58 0.60 1.61 -2.85 -1.26 -4.67 119.74 109.92 2x2c s LYS 76 Ca 0.00 -0.60 -0.04 0.00 -1.00 0.00 0.00 55.97 54.33 2x2c s LYS 76 Cb 0.00 0.24 0.03 0.00 -2.06 0.00 0.00 37.83 36.03 2x2c s LYS 76 CO 0.00 -0.15 0.89 -1.54 0.10 0.00 0.00 175.35 174.65 2x2c s SER 77 N -1.86 5.35 0.01 0.03 1.04 -0.78 -3.96 113.70 113.54 2x2c s SER 77 Ca -0.08 0.49 0.16 0.00 0.48 0.00 0.00 55.95 57.00 2x2c s SER 77 Cb -0.03 -1.40 0.68 0.00 0.10 0.00 0.00 66.02 65.37 2x2c s SER 77 CO -0.02 -1.19 1.51 2.30 0.98 0.00 0.00 173.24 176.82 2x2c n ILE 78 N -2.59 0.92 0.71 -1.02 -5.35 -1.26 -2.62 119.36 108.14 2x2c n ILE 78 Ca 0.06 0.23 0.11 0.00 -0.27 0.00 0.00 62.75 62.88 2x2c n ILE 78 Cb 0.59 -0.97 0.13 0.00 -1.74 0.00 0.00 39.64 37.65 2x2c n ILE 78 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2x2c n TYR 79 N -1.53 0.17 0.00 4.28 4.01 -1.26 -5.07 117.16 117.76 2x2c n TYR 79 Ca 0.04 -0.09 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 2x2c n TYR 79 Cb 0.19 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 2x2c n TYR 79 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2x2c n GLY 80 N 1.32 0.52 0.30 2.72 0.00 -1.08 -4.90 105.19 104.07 2x2c n GLY 80 Ca 0.15 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.97 2x2c n GLY 80 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2x2c h GLU 81 N 8.61 0.65 -3.83 1.61 4.11 -1.94 -2.06 114.58 121.73 2x2c h GLU 81 Ca 0.00 -0.10 -0.09 0.00 0.07 0.00 0.00 59.36 59.24 2x2c h GLU 81 Cb 0.00 -0.11 -0.13 0.00 0.50 0.00 0.00 28.75 29.00 2x2c h GLU 81 CO 0.00 0.56 -0.33 -1.59 0.07 0.00 0.00 179.01 177.72 2x2c s LYS 82 N -5.25 1.01 0.21 1.06 -2.85 -1.26 -4.16 119.74 108.50 2x2c s LYS 82 Ca -0.09 -1.05 -0.02 0.00 -1.00 0.00 0.00 55.97 53.81 2x2c s LYS 82 Cb 0.16 0.36 -0.04 0.00 -2.06 0.00 0.00 37.83 36.26 2x2c s LYS 82 CO 0.77 -0.35 0.16 -0.59 0.10 0.00 0.00 175.35 175.44 2x2c s PHE 83 N -3.91 1.10 0.56 1.78 -0.71 -0.08 -4.93 117.98 111.80 2x2c s PHE 83 Ca 0.11 -1.33 -0.13 0.00 -1.04 0.00 0.00 56.93 54.54 2x2c s PHE 83 Cb 0.04 -0.50 -0.06 0.00 -1.21 0.00 0.00 43.02 41.30 2x2c s PHE 83 CO -0.06 -0.68 1.00 -1.83 -1.34 0.00 0.00 175.22 172.31 2x2c s GLU 84 N -4.13 3.75 -0.31 1.99 1.03 -1.26 -1.92 118.70 117.85 2x2c s GLU 84 Ca 0.38 0.81 -0.28 0.00 0.03 0.00 0.00 54.97 55.91 2x2c s GLU 84 Cb 0.06 -2.12 -0.03 0.00 -0.80 0.00 0.00 34.13 31.24 2x2c s GLU 84 CO 0.12 -0.42 1.93 -0.51 -1.33 0.00 0.00 175.26 175.05 2x2c s ASP 85 N -3.68 5.71 0.08 0.83 1.01 -1.26 -4.84 116.67 114.53 2x2c s ASP 85 Ca 0.56 1.42 -0.31 0.00 0.71 0.00 0.00 52.55 54.93 2x2c s ASP 85 Cb -0.10 -2.52 -0.18 0.00 1.01 0.00 0.00 42.92 41.13 2x2c s ASP 85 CO 0.43 -1.83 1.65 -0.08 0.21 0.00 0.00 175.17 175.55 2x2c h GLU 86 N 13.71 -0.71 -2.26 8.23 4.81 -2.00 -3.48 114.58 132.88 2x2c h GLU 86 Ca -0.35 0.05 0.20 0.00 -0.13 0.00 0.00 59.36 59.13 2x2c h GLU 86 Cb 1.19 0.16 -0.07 0.00 0.63 0.00 0.00 28.75 30.66 2x2c h GLU 86 CO 1.02 -0.47 0.59 0.54 -0.73 0.00 0.00 179.01 179.96 2x2c s ASN 87 N -4.55 -0.08 -0.23 1.04 2.20 -1.26 -5.07 114.94 106.99 2x2c s ASN 87 Ca -0.17 -0.46 0.10 0.00 -0.94 0.00 0.00 52.86 51.40 2x2c s ASN 87 Cb 0.04 0.43 0.43 0.00 -2.00 0.00 0.00 41.25 40.15 2x2c s ASN 87 CO 0.63 -0.82 1.22 0.49 -2.94 0.00 0.00 177.10 175.68 2x2c n PHE 88 N -0.57 0.61 -0.06 1.54 3.72 -1.26 -4.67 117.46 116.77 2x2c n PHE 88 Ca -0.05 -1.66 -0.09 0.00 -0.05 0.00 0.00 57.45 55.60 2x2c n PHE 88 Cb 0.60 -0.27 -0.02 0.00 -0.94 0.00 0.00 39.48 38.85 2x2c n PHE 88 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2x2c h ILE 89 N 1.25 0.97 -3.35 4.37 2.04 -1.93 -3.43 117.51 117.43 2x2c h ILE 89 Ca 0.08 -0.08 -0.56 0.00 1.00 0.00 0.00 64.86 65.31 2x2c h ILE 89 Cb 1.12 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.89 2x2c h ILE 89 CO 0.17 0.04 0.05 -0.76 0.00 0.00 0.00 178.15 177.65 2x2c s LEU 90 N -10.25 4.55 0.35 1.44 1.43 -1.26 -5.08 118.68 109.86 2x2c s LEU 90 Ca -0.13 1.40 0.07 0.00 -1.03 0.00 0.00 54.13 54.44 2x2c s LEU 90 Cb 0.10 -3.05 -0.02 0.00 0.03 0.00 0.00 46.19 43.25 2x2c s LEU 90 CO 0.70 0.24 0.34 -0.54 0.23 0.00 0.00 176.35 177.31 2x2c s LYS 91 N -1.06 2.76 -0.99 1.70 -0.14 -1.26 -4.36 119.74 116.39 2x2c s LYS 91 Ca 0.32 -1.28 -0.21 0.00 -1.36 0.00 0.00 55.97 53.44 2x2c s LYS 91 Cb -0.21 -2.52 0.09 0.00 -1.68 0.00 0.00 37.83 33.51 2x2c s LYS 91 CO 0.22 0.04 1.30 -1.01 -0.76 0.00 0.00 175.35 175.14 2x2c s HIS 92 N -2.31 2.83 -0.75 3.18 3.76 -1.26 -4.84 115.29 115.91 2x2c s HIS 92 Ca 0.43 -1.14 0.24 0.00 -0.15 0.00 0.00 55.06 54.44 2x2c s HIS 92 Cb -0.06 -4.49 0.25 0.00 1.11 0.00 0.00 32.58 29.38 2x2c s HIS 92 CO 0.28 -1.71 1.21 0.25 -0.85 0.00 0.00 174.74 173.92 2x2c n THR 93 N 6.17 0.17 -2.23 1.30 -2.24 -1.26 -3.45 114.28 112.74 2x2c n THR 93 Ca 0.29 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2x2c n THR 93 Cb 0.50 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 2x2c n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x2c n GLY 94 N 1.40 -1.91 3.72 3.38 0.00 -1.26 -4.68 105.19 105.85 2x2c n GLY 94 Ca 0.03 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.49 2x2c n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2x2c s PRO 95 N -1.82 2.23 0.00 1.61 0.04 -1.25 -2.95 135.00 132.86 2x2c s PRO 95 Ca 0.00 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.85 2x2c s PRO 95 Cb 0.00 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.70 2x2c s PRO 95 CO 0.00 -1.78 0.00 0.41 0.04 0.00 0.00 177.00 175.67 2x2c n GLY 96 N 0.49 3.11 3.73 0.56 0.00 -0.48 -4.90 105.19 107.69 2x2c n GLY 96 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2x2c n GLY 96 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x2c s ILE 97 N -2.01 2.43 -0.24 -0.61 -1.09 -1.15 -0.96 121.20 117.56 2x2c s ILE 97 Ca 0.00 0.33 -0.09 0.00 -2.23 0.00 0.00 60.65 58.66 2x2c s ILE 97 Cb 0.00 -3.21 -0.04 0.00 -1.58 0.00 0.00 42.46 37.63 2x2c s ILE 97 CO 0.00 0.04 0.12 -0.22 -1.23 0.00 0.00 174.94 173.65 2x2c s LEU 98 N 0.55 3.83 0.04 2.97 2.96 -0.18 -0.32 118.68 128.54 2x2c s LEU 98 Ca 0.67 -0.03 -0.04 0.00 -0.22 0.00 0.00 54.13 54.52 2x2c s LEU 98 Cb -0.45 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.19 2x2c s LEU 98 CO 0.37 0.02 0.05 -0.55 -1.32 0.00 0.00 176.35 174.92 2x2c s SER 99 N 1.32 0.27 0.05 3.68 0.15 -0.59 -1.25 113.70 117.35 2x2c s SER 99 Ca 0.06 -0.68 -0.30 0.00 0.70 0.00 0.00 55.95 55.73 2x2c s SER 99 Cb -0.15 0.21 -0.05 0.00 -1.71 0.00 0.00 66.02 64.33 2x2c s SER 99 CO 0.06 -0.53 1.09 -0.04 1.20 0.00 0.00 173.24 175.02 2x2c s MET 100 N -2.97 4.51 0.58 5.44 -1.94 -0.43 -0.57 119.30 123.92 2x2c s MET 100 Ca -0.02 1.62 -0.16 0.00 -1.71 0.00 0.00 55.69 55.42 2x2c s MET 100 Cb 0.01 -3.38 -0.04 0.00 2.01 0.00 0.00 34.83 33.43 2x2c s MET 100 CO -0.06 -0.12 1.05 0.00 -0.01 0.00 0.00 175.02 175.88 2x2c s ALA 101 N 0.84 2.78 0.30 3.03 0.00 -0.80 -4.51 121.76 123.40 2x2c s ALA 101 Ca 0.55 0.37 -0.03 0.00 0.00 0.00 0.00 51.96 52.85 2x2c s ALA 101 Cb -0.26 -3.22 0.01 0.00 0.00 0.00 0.00 23.12 19.65 2x2c s ALA 101 CO 0.29 -0.73 0.44 0.27 0.00 0.00 0.00 175.76 176.03 2x2c n ASN 102 N -1.96 -1.23 -2.65 0.00 0.23 -1.26 -4.55 115.26 103.84 2x2c n ASN 102 Ca 0.08 -2.57 -0.23 0.00 -0.53 0.00 0.00 54.58 51.34 2x2c n ASN 102 Cb 0.53 2.25 -0.00 0.00 -2.08 0.00 0.00 39.78 40.48 2x2c n ASN 102 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2x2c n ALA 103 N -1.05 4.46 0.00 -2.53 0.00 -1.26 -5.07 120.51 115.06 2x2c n ALA 103 Ca -0.12 -4.11 0.00 0.00 0.00 0.00 0.00 53.44 49.22 2x2c n ALA 103 Cb 0.49 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 19.26 2x2c n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x2c n GLY 104 N -0.30 -2.45 3.78 0.00 0.00 -1.26 -4.87 105.19 100.09 2x2c n GLY 104 Ca 0.31 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 2x2c n GLY 104 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2x2c s PRO 105 N -0.33 4.06 -1.30 1.61 0.02 -1.26 -3.07 135.00 134.73 2x2c s PRO 105 Ca 0.00 2.59 -0.07 0.00 0.02 0.00 0.00 61.00 63.54 2x2c s PRO 105 Cb 0.00 -2.94 0.01 0.00 0.02 0.00 0.00 34.50 31.59 2x2c s PRO 105 CO 0.00 -0.57 0.87 0.09 -0.33 0.00 0.00 177.00 177.05 2x2c n ASN 106 N 0.39 -5.88 -1.47 2.53 3.02 -1.26 -4.92 115.26 107.68 2x2c n ASN 106 Ca 0.01 -0.40 -0.02 0.00 -0.03 0.00 0.00 54.58 54.14 2x2c n ASN 106 Cb 0.39 -4.57 0.10 0.00 -0.61 0.00 0.00 39.78 35.08 2x2c n ASN 106 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2x2c n THR 107 N -4.63 1.60 -1.82 3.41 -2.24 -1.17 -4.51 114.28 104.92 2x2c n THR 107 Ca -0.04 -2.86 -0.42 0.00 -2.27 0.00 0.00 64.05 58.46 2x2c n THR 107 Cb 0.58 0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 2x2c n THR 107 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2x2c s ASN 108 N -3.10 6.46 0.00 3.42 0.01 -0.81 -4.29 114.94 116.63 2x2c s ASN 108 Ca 0.38 2.80 0.00 0.00 -0.71 0.00 0.00 52.86 55.33 2x2c s ASN 108 Cb 0.38 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 39.43 2x2c s ASN 108 CO -0.07 -0.89 0.00 0.61 -1.51 0.00 0.00 177.10 175.24 2x2c n GLY 109 N 3.32 1.42 0.00 0.66 0.00 -1.26 -0.90 105.19 108.42 2x2c n GLY 109 Ca 0.13 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.16 2x2c n GLY 109 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2x2c n SER 110 N 0.00 3.05 -4.77 1.61 3.41 -1.25 -3.60 113.62 112.07 2x2c n SER 110 Ca 0.00 -0.13 -0.39 0.00 -0.26 0.00 0.00 58.87 58.09 2x2c n SER 110 Cb 0.00 1.19 -0.03 0.00 -0.26 0.00 0.00 64.21 65.11 2x2c n SER 110 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2x2c s GLN 111 N -2.19 4.31 0.25 4.33 -0.21 -1.26 -4.51 119.66 120.38 2x2c s GLN 111 Ca -0.01 1.76 -0.08 0.00 0.02 0.00 0.00 55.36 57.05 2x2c s GLN 111 Cb 0.04 -2.84 -0.01 0.00 1.00 0.00 0.00 33.01 31.19 2x2c s GLN 111 CO 0.22 -0.08 0.39 -0.59 -2.12 0.00 0.00 175.29 173.11 2x2c s PHE 112 N -1.37 0.66 0.04 0.91 -0.71 0.01 -1.91 117.98 115.61 2x2c s PHE 112 Ca 0.52 -0.97 0.02 0.00 -1.04 0.00 0.00 56.93 55.46 2x2c s PHE 112 Cb -0.29 -0.04 -0.02 0.00 -1.21 0.00 0.00 43.02 41.45 2x2c s PHE 112 CO 0.37 -0.92 -0.07 -0.59 -1.34 0.00 0.00 175.22 172.68 2x2c s PHE 113 N -3.93 0.61 -0.28 3.49 -0.71 0.27 -1.44 117.98 115.98 2x2c s PHE 113 Ca 0.28 -0.54 -0.05 0.00 -1.04 0.00 0.00 56.93 55.58 2x2c s PHE 113 Cb 0.01 -0.37 0.02 0.00 -1.21 0.00 0.00 43.02 41.47 2x2c s PHE 113 CO 0.11 -0.11 0.04 0.42 -1.34 0.00 0.00 175.22 174.34 2x2c s ILE 114 N -1.57 3.60 0.45 -4.49 1.01 0.49 -1.54 121.20 119.15 2x2c s ILE 114 Ca -0.09 -0.83 -0.23 0.00 0.00 0.00 0.00 60.65 59.50 2x2c s ILE 114 Cb -0.09 -2.86 -0.08 0.00 0.01 0.00 0.00 42.46 39.44 2x2c s ILE 114 CO -0.00 0.10 1.12 0.00 0.00 0.00 0.00 174.94 176.15 2x2c n THR 116 N -0.48 1.75 -3.44 0.00 -2.24 -0.01 -1.39 114.28 108.47 2x2c n THR 116 Ca 0.07 -1.79 -0.13 0.00 -2.27 0.00 0.00 64.05 59.93 2x2c n THR 116 Cb 0.49 -0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 2x2c n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x2c s ALA 117 N -2.33 -1.62 0.07 6.98 0.00 -1.23 -4.65 121.76 118.99 2x2c s ALA 117 Ca 0.28 0.64 -0.34 0.00 0.00 0.00 0.00 51.96 52.54 2x2c s ALA 117 Cb 0.23 0.71 -0.13 0.00 0.00 0.00 0.00 23.12 23.93 2x2c s ALA 117 CO 0.06 -0.69 1.65 1.17 0.00 0.00 0.00 175.76 177.95 2x2c n LYS 118 N -0.13 2.06 -3.12 0.00 4.81 -1.26 -3.91 118.16 116.61 2x2c n LYS 118 Ca -0.17 0.75 -0.25 0.00 -0.87 0.00 0.00 58.31 57.76 2x2c n LYS 118 Cb 0.63 -2.53 -0.05 0.00 0.02 0.00 0.00 35.03 33.10 2x2c n LYS 118 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2x2c n THR 119 N 3.88 1.95 0.25 3.15 -2.24 -1.22 -4.90 114.28 115.15 2x2c n THR 119 Ca 0.19 -5.17 0.13 0.00 -2.27 0.00 0.00 64.05 56.93 2x2c n THR 119 Cb 0.28 -1.40 0.79 0.00 -2.10 0.00 0.00 70.33 67.89 2x2c n THR 119 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2x2c h GLU 120 N 3.36 0.00 0.00 -0.78 4.81 -1.93 -2.42 114.58 117.63 2x2c h GLU 120 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2x2c h GLU 120 Cb 0.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.04 2x2c h GLU 120 CO 0.73 0.00 0.00 -2.67 -0.73 0.00 0.00 179.01 176.34 2x2c n TRP 121 N -4.14 0.45 0.88 0.92 2.14 -1.26 -2.15 117.44 114.29 2x2c n TRP 121 Ca -0.02 0.18 0.12 0.00 2.07 0.00 0.00 57.50 59.85 2x2c n TRP 121 Cb 0.15 -0.79 0.14 0.00 -0.81 0.00 0.00 31.31 29.99 2x2c n TRP 121 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2x2c n LEU 122 N -1.92 0.62 -4.66 5.67 4.77 -0.91 -4.96 117.00 115.62 2x2c n LEU 122 Ca 0.02 -0.07 -0.45 0.00 -0.03 0.00 0.00 56.01 55.48 2x2c n LEU 122 Cb 0.18 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 2x2c n LEU 122 CO 0.16 0.12 0.99 0.47 -1.33 0.00 0.00 177.39 177.79 2x2c n ASP 123 N -1.64 2.59 0.00 -1.43 8.00 -0.91 -2.61 116.55 120.55 2x2c n ASP 123 Ca 0.04 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.68 2x2c n ASP 123 Cb 0.36 -1.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.07 2x2c n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x2c n GLY 124 N 2.25 0.71 0.00 0.44 0.00 -1.26 -5.11 105.19 102.23 2x2c n GLY 124 Ca 0.13 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2x2c n GLY 124 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2x2c n HIS 126 N -2.88 0.00 -2.21 1.61 8.25 -1.07 -5.02 115.22 113.90 2x2c n HIS 126 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 2x2c n HIS 126 Cb 0.17 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.25 2x2c n HIS 126 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2x2c s VAL 127 N 0.00 3.82 0.07 1.59 1.01 -1.26 -4.85 120.40 120.77 2x2c s VAL 127 Ca 0.00 0.91 -0.24 0.00 0.00 0.00 0.00 61.98 62.64 2x2c s VAL 127 Cb 0.00 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 2x2c s VAL 127 CO 0.00 -0.40 0.74 -0.69 0.00 0.00 0.00 175.10 174.76 2x2c s VAL 128 N 5.13 4.67 0.00 2.92 1.01 -1.26 -1.32 120.40 131.55 2x2c s VAL 128 Ca 0.67 1.59 0.00 0.00 0.00 0.00 0.00 61.98 64.24 2x2c s VAL 128 Cb -0.21 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.07 2x2c s VAL 128 CO 0.28 0.41 0.12 2.22 0.00 0.00 0.00 175.10 178.13 2x2c n PHE 129 N 2.48 0.00 -3.82 5.22 -1.74 -0.38 -4.71 117.46 114.52 2x2c n PHE 129 Ca -0.04 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.85 2x2c n PHE 129 Cb 0.50 0.02 0.01 0.00 1.52 0.00 0.00 39.48 41.53 2x2c n PHE 129 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2x2c n GLY 130 N 0.00 0.64 3.52 4.97 0.00 -1.11 0.25 105.19 113.46 2x2c n GLY 130 Ca 0.00 -0.96 -0.16 0.00 0.00 0.00 0.00 46.02 44.90 2x2c n GLY 130 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2x2c s LYS 131 N -2.01 0.92 0.20 1.61 2.20 -0.28 -1.01 119.74 121.37 2x2c s LYS 131 Ca 0.12 0.49 -0.32 0.00 -0.36 0.00 0.00 55.97 55.90 2x2c s LYS 131 Cb -0.01 0.44 -0.13 0.00 -1.51 0.00 0.00 37.83 36.62 2x2c s LYS 131 CO 0.01 -0.22 1.61 0.28 -0.36 0.00 0.00 175.35 176.66 2x2c n VAL 132 N 1.66 0.24 -0.09 4.02 0.31 -0.14 -0.87 118.33 123.46 2x2c n VAL 132 Ca -0.17 -0.06 -0.12 0.00 -0.01 0.00 0.00 64.34 63.98 2x2c n VAL 132 Cb 0.56 -1.73 -0.05 0.00 -0.91 0.00 0.00 33.84 31.71 2x2c n VAL 132 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2x2c n LYS 133 N 3.28 0.51 -4.09 5.55 5.02 0.10 -4.77 118.16 123.75 2x2c n LYS 133 Ca 0.15 0.46 -0.08 0.00 -2.02 0.00 0.00 58.31 56.81 2x2c n LYS 133 Cb 0.32 -1.64 -0.10 0.00 -0.02 0.00 0.00 35.03 33.59 2x2c n LYS 133 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2x2c s GLU 134 N -2.42 0.62 0.00 1.97 2.02 -1.17 -4.87 118.70 114.85 2x2c s GLU 134 Ca -0.23 -1.17 0.00 0.00 0.02 0.00 0.00 54.97 53.59 2x2c s GLU 134 Cb 0.05 0.10 0.00 0.00 0.10 0.00 0.00 34.13 34.38 2x2c s GLU 134 CO 0.38 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.99 2x2c n GLY 135 N 0.26 0.55 0.38 -1.39 0.00 -1.26 -0.77 105.19 102.96 2x2c n GLY 135 Ca -0.15 -0.60 0.20 0.00 0.00 0.00 0.00 46.02 45.47 2x2c n GLY 135 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2x2c h MET 136 N 0.49 0.00 0.00 1.61 4.05 -1.89 0.19 114.93 119.38 2x2c h MET 136 Ca 0.00 0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.37 2x2c h MET 136 Cb 0.00 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 2x2c h MET 136 CO 0.00 0.00 -0.24 -0.91 0.23 0.00 0.00 176.91 175.99 2x2c h ASN 137 N 0.00 0.00 -0.05 1.39 4.21 -1.96 -0.76 115.58 118.41 2x2c h ASN 137 Ca 0.23 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 57.57 2x2c h ASN 137 Cb 0.97 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.17 2x2c h ASN 137 CO -0.00 0.24 -0.57 0.40 -1.29 0.00 0.00 177.43 176.22 2x2c h ILE 138 N 0.00 1.31 -0.19 2.81 1.08 -0.97 -1.84 117.51 119.71 2x2c h ILE 138 Ca -0.00 -1.80 -0.06 0.00 -0.39 0.00 0.00 64.86 62.61 2x2c h ILE 138 Cb 0.47 1.76 -0.00 0.00 -3.07 0.00 0.00 36.82 35.97 2x2c h ILE 138 CO 0.03 0.57 -0.12 0.58 -0.69 0.00 0.00 178.15 178.52 2x2c h VAL 139 N 0.49 1.32 -0.57 1.67 2.07 -0.91 -0.49 116.25 119.82 2x2c h VAL 139 Ca 0.01 -1.21 0.08 0.00 0.82 0.00 0.00 66.70 66.40 2x2c h VAL 139 Cb 1.13 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 32.56 2x2c h VAL 139 CO 0.11 0.36 0.38 -0.33 0.02 0.00 0.00 177.57 178.12 2x2c h GLU 140 N 0.10 0.44 -0.13 1.57 5.08 -1.19 0.79 114.58 121.24 2x2c h GLU 140 Ca 0.04 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 2x2c h GLU 140 Cb 0.62 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 2x2c h GLU 140 CO 0.03 0.29 -0.18 0.00 -1.00 0.00 0.00 179.01 178.15 2x2c h ALA 141 N 1.70 0.19 -0.74 3.43 0.00 -0.69 -2.92 119.26 120.23 2x2c h ALA 141 Ca 0.26 -0.35 0.15 0.00 0.00 0.00 0.00 54.91 54.97 2x2c h ALA 141 Cb 0.43 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.07 2x2c h ALA 141 CO -0.07 0.11 0.24 0.52 0.00 0.00 0.00 179.25 180.04 2x2c h MET 142 N -0.06 0.33 -0.17 0.00 2.86 -0.30 -2.48 114.93 115.12 2x2c h MET 142 Ca 0.01 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 2x2c h MET 142 Cb 0.74 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 2x2c h MET 142 CO 0.04 0.22 0.12 1.49 1.06 0.00 0.00 176.91 179.84 2x2c h GLU 143 N 0.34 0.00 0.00 1.72 4.81 -0.68 0.16 114.58 120.94 2x2c h GLU 143 Ca 0.42 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.65 2x2c h GLU 143 Cb 0.69 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.07 2x2c h GLU 143 CO -0.46 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 177.82 2x2c h ARG 144 N 0.00 0.00 -0.18 1.92 3.08 -1.43 -2.64 114.38 115.12 2x2c h ARG 144 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2x2c h ARG 144 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2x2c h ARG 144 CO -0.00 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.09 2x2c n PHE 145 N -2.55 0.22 -1.77 3.04 3.72 0.05 -4.89 117.46 115.28 2x2c n PHE 145 Ca 0.02 -0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 2x2c n PHE 145 Cb 0.28 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 2x2c n PHE 145 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2x2c n GLY 146 N 1.20 0.59 3.82 1.37 0.00 -1.00 -0.95 105.19 110.23 2x2c n GLY 146 Ca 0.17 -1.90 -0.06 0.00 0.00 0.00 0.00 46.02 44.23 2x2c n GLY 146 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x2c s SER 147 N -1.00 -0.13 0.33 1.61 1.04 -0.82 -4.78 113.70 109.94 2x2c s SER 147 Ca 0.00 -0.72 0.09 0.00 0.48 0.00 0.00 55.95 55.80 2x2c s SER 147 Cb 0.00 0.68 0.86 0.00 0.10 0.00 0.00 66.02 67.66 2x2c s SER 147 CO 0.00 -1.30 1.76 0.03 0.98 0.00 0.00 173.24 174.71 2x2c h ARG 148 N 2.00 0.62 -0.01 4.02 2.47 -1.91 -0.40 114.38 121.17 2x2c h ARG 148 Ca -0.25 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.43 2x2c h ARG 148 Cb 1.24 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 29.42 2x2c h ARG 148 CO 0.30 0.41 -0.42 0.27 0.56 0.00 0.00 179.97 181.09 2x2c n ASN 149 N -4.79 1.22 0.00 7.04 0.23 -1.26 -4.94 115.26 112.76 2x2c n ASN 149 Ca 0.25 -0.98 0.00 0.00 -0.53 0.00 0.00 54.58 53.32 2x2c n ASN 149 Cb 0.68 0.32 0.00 0.00 -2.08 0.00 0.00 39.78 38.71 2x2c n ASN 149 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x2c n GLY 150 N 1.40 0.97 3.78 4.83 0.00 -0.16 -4.95 105.19 111.05 2x2c n GLY 150 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2x2c n GLY 150 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2x2c s LYS 151 N -0.87 4.11 -0.07 1.61 2.20 -1.26 -1.42 119.74 124.04 2x2c s LYS 151 Ca 0.00 2.57 -0.03 0.00 -0.36 0.00 0.00 55.97 58.15 2x2c s LYS 151 Cb 0.00 -2.97 -0.04 0.00 -1.51 0.00 0.00 37.83 33.31 2x2c s LYS 151 CO 0.00 -0.54 0.07 0.95 -0.36 0.00 0.00 175.35 175.47 2x2c s THR 152 N -1.05 4.80 -0.81 3.43 -4.23 -1.26 -3.14 115.64 113.38 2x2c s THR 152 Ca 0.53 -0.17 0.27 0.00 -1.18 0.00 0.00 61.69 61.14 2x2c s THR 152 Cb -0.47 -3.10 0.23 0.00 1.34 0.00 0.00 72.50 70.51 2x2c s THR 152 CO 0.62 0.52 1.75 -1.54 -0.54 0.00 0.00 174.62 175.44 2x2c n SER 153 N 1.77 0.56 -4.03 3.99 3.41 -0.13 -4.84 113.62 114.35 2x2c n SER 153 Ca -0.17 0.47 -0.08 0.00 -0.26 0.00 0.00 58.87 58.83 2x2c n SER 153 Cb 0.54 -0.56 -0.10 0.00 -0.26 0.00 0.00 64.21 63.82 2x2c n SER 153 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2x2c s LYS 154 N -3.07 0.47 -0.57 4.33 -0.14 -1.26 -5.11 119.74 114.38 2x2c s LYS 154 Ca 0.11 -0.92 -0.28 0.00 -1.36 0.00 0.00 55.97 53.52 2x2c s LYS 154 Cb 0.15 0.16 0.03 0.00 -1.68 0.00 0.00 37.83 36.49 2x2c s LYS 154 CO 0.60 -0.08 1.25 0.21 -0.76 0.00 0.00 175.35 176.56 2x2c s LYS 155 N -2.72 3.47 -0.39 1.68 2.20 -1.26 -4.87 119.74 117.85 2x2c s LYS 155 Ca -0.04 0.31 -0.21 0.00 -0.36 0.00 0.00 55.97 55.67 2x2c s LYS 155 Cb -0.01 -4.04 0.01 0.00 -1.51 0.00 0.00 37.83 32.28 2x2c s LYS 155 CO -0.06 -1.74 0.67 0.42 -0.36 0.00 0.00 175.35 174.28 2x2c s ILE 156 N 5.22 4.83 0.10 5.43 -1.09 -1.26 -1.42 121.20 133.01 2x2c s ILE 156 Ca 0.45 0.48 0.10 0.00 -2.23 0.00 0.00 60.65 59.45 2x2c s ILE 156 Cb -0.08 -4.15 -0.04 0.00 -1.58 0.00 0.00 42.46 36.61 2x2c s ILE 156 CO 0.25 -0.44 -0.23 -0.89 -1.23 0.00 0.00 174.94 172.40 2x2c s THR 157 N 2.83 2.48 -0.99 2.92 2.01 -0.15 -0.80 115.64 123.94 2x2c s THR 157 Ca 0.25 -1.55 -0.15 0.00 0.31 0.00 0.00 61.69 60.55 2x2c s THR 157 Cb -0.14 -2.09 0.18 0.00 0.01 0.00 0.00 72.50 70.47 2x2c s THR 157 CO 0.17 0.17 1.10 -0.63 -0.69 0.00 0.00 174.62 174.74 2x2c s ILE 158 N -1.03 5.19 0.25 1.82 1.01 -0.19 -1.21 121.20 127.06 2x2c s ILE 158 Ca 0.15 -2.29 -0.06 0.00 0.00 0.00 0.00 60.65 58.45 2x2c s ILE 158 Cb -0.10 -4.71 0.26 0.00 0.01 0.00 0.00 42.46 37.92 2x2c s ILE 158 CO 0.06 -1.37 1.93 0.00 0.00 0.00 0.00 174.94 175.57 2x2c h ALA 159 N 7.90 1.28 -2.59 9.38 0.00 -1.42 0.32 119.26 134.13 2x2c h ALA 159 Ca 0.18 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2x2c h ALA 159 Cb 0.97 -0.40 -0.15 0.00 0.00 0.00 0.00 17.79 18.21 2x2c h ALA 159 CO 1.04 0.66 -0.24 0.34 0.00 0.00 0.00 179.25 181.05 2x2c s ASP 160 N -6.13 -0.08 0.21 0.00 2.15 -1.22 -4.34 116.67 107.25 2x2c s ASP 160 Ca -0.13 -0.36 -0.20 0.00 0.43 0.00 0.00 52.55 52.29 2x2c s ASP 160 Cb 0.18 0.38 0.04 0.00 -0.30 0.00 0.00 42.92 43.22 2x2c s ASP 160 CO 0.82 -0.71 0.61 0.00 -0.17 0.00 0.00 175.17 175.72 2x2c n GLY 162 N -0.39 -1.40 3.69 0.00 0.00 -0.69 -4.66 105.19 101.74 2x2c n GLY 162 Ca -0.10 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.55 2x2c n GLY 162 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2x2c s GLN 163 N -1.08 3.98 -0.06 1.61 0.74 -1.26 -0.63 119.66 122.97 2x2c s GLN 163 Ca 0.00 -0.29 0.11 0.00 0.05 0.00 0.00 55.36 55.23 2x2c s GLN 163 Cb 0.00 -3.27 -0.23 0.00 1.10 0.00 0.00 33.01 30.61 2x2c s GLN 163 CO 0.00 0.33 0.62 1.28 -0.55 0.00 0.00 175.29 176.97 2x2c n LEU 164 N 3.37 1.00 0.00 3.68 4.77 -0.17 -4.92 117.00 124.73 2x2c n LEU 164 Ca -0.17 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2x2c n LEU 164 Cb 0.52 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2x2c n LEU 164 CO 0.35 0.43 0.00 1.21 -1.33 0.00 0.00 177.39 178.06