#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r1d n PRO 6 N 0.00 0.51 -4.05 0.52 -0.04 -1.26 -5.04 135.00 125.65 1r1d n PRO 6 Ca 0.00 0.22 -0.09 0.00 -0.04 0.00 0.00 63.50 63.59 1r1d n PRO 6 Cb 0.00 -2.08 -0.11 0.00 -0.04 0.00 0.00 33.50 31.27 1r1d n PRO 6 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1r1d s LYS 7 N -3.03 0.49 0.63 0.54 -0.14 -1.26 -4.97 119.74 112.00 1r1d s LYS 7 Ca 0.72 -0.92 -0.17 0.00 -1.36 0.00 0.00 55.97 54.24 1r1d s LYS 7 Cb -0.36 0.07 -0.01 0.00 -1.68 0.00 0.00 37.83 35.85 1r1d s LYS 7 CO 0.52 -0.06 1.15 -1.25 -0.76 0.00 0.00 175.35 174.95 1r1d s PRO 8 N -2.60 2.84 0.27 -1.68 0.04 -1.26 -4.77 135.00 127.84 1r1d s PRO 8 Ca -0.04 1.61 0.06 0.00 0.04 0.00 0.00 61.00 62.66 1r1d s PRO 8 Cb -0.02 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 1r1d s PRO 8 CO -0.05 -1.26 -0.03 -0.59 0.04 0.00 0.00 177.00 175.11 1r1d s PHE 9 N -1.97 1.85 -0.36 0.56 -0.12 -0.58 -4.97 117.98 112.38 1r1d s PHE 9 Ca 0.72 -0.78 0.03 0.00 -0.05 0.00 0.00 56.93 56.85 1r1d s PHE 9 Cb -0.25 -1.08 0.16 0.00 -0.63 0.00 0.00 43.02 41.22 1r1d s PHE 9 CO 0.37 0.17 0.39 0.12 -0.05 0.00 0.00 175.22 176.22 1r1d s PHE 10 N -3.14 -0.42 -0.55 3.49 5.36 -1.26 -1.33 117.98 120.13 1r1d s PHE 10 Ca 0.30 -0.67 -0.23 0.00 -0.96 0.00 0.00 56.93 55.37 1r1d s PHE 10 Cb 0.05 -0.36 0.05 0.00 -0.34 0.00 0.00 43.02 42.41 1r1d s PHE 10 CO 0.11 -0.98 0.88 -0.06 -1.46 0.00 0.00 175.22 173.71 1r1d s PHE 11 N 1.57 2.83 0.04 10.12 0.08 0.34 -4.94 117.98 128.02 1r1d s PHE 11 Ca 0.16 -0.17 -0.28 0.00 0.12 0.00 0.00 56.93 56.76 1r1d s PHE 11 Cb -0.14 -3.99 -0.05 0.00 -0.57 0.00 0.00 43.02 38.27 1r1d s PHE 11 CO -0.07 -1.32 0.88 -2.00 -0.10 0.00 0.00 175.22 172.61 1r1d s GLU 12 N 3.70 4.57 0.00 0.44 2.12 -1.26 -0.62 118.70 127.65 1r1d s GLU 12 Ca 0.27 1.26 0.00 0.00 0.36 0.00 0.00 54.97 56.85 1r1d s GLU 12 Cb -0.14 -3.41 0.00 0.00 0.26 0.00 0.00 34.13 30.84 1r1d s GLU 12 CO 0.17 0.14 0.00 0.00 -0.54 0.00 0.00 175.26 175.03 1r1d n ALA 13 N 3.25 0.00 -0.92 6.30 0.00 -1.26 -4.92 120.51 122.96 1r1d n ALA 13 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.42 1r1d n ALA 13 Cb 0.50 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.01 1r1d n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r1d n GLY 14 N 0.00 -3.28 0.11 0.00 0.00 -0.05 -4.76 105.19 97.21 1r1d n GLY 14 Ca 0.00 -1.33 0.13 0.00 0.00 0.00 0.00 46.02 44.82 1r1d n GLY 14 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1r1d n GLU 15 N -2.50 0.27 -2.88 1.61 0.00 -1.26 -4.21 120.64 111.67 1r1d n GLU 15 Ca 0.03 0.22 -0.41 0.00 0.00 0.00 0.00 57.16 57.00 1r1d n GLU 15 Cb 0.11 -1.82 -0.04 0.00 0.00 0.00 0.00 31.44 29.70 1r1d n GLU 15 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1r1d s ARG 16 N -3.11 4.44 -0.00 3.44 0.52 -1.26 -4.69 118.95 118.29 1r1d s ARG 16 Ca 0.11 1.11 0.06 0.00 -0.52 0.00 0.00 55.73 56.49 1r1d s ARG 16 Cb 0.12 -3.49 -0.03 0.00 0.52 0.00 0.00 34.95 32.08 1r1d s ARG 16 CO 0.60 -0.09 -0.18 0.00 0.02 0.00 0.00 175.30 175.65 1r1d s ALA 17 N 1.26 2.53 -0.11 2.13 0.00 -1.23 -1.45 121.76 124.89 1r1d s ALA 17 Ca 0.43 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 51.29 1r1d s ALA 17 Cb -0.18 -0.77 0.02 0.00 0.00 0.00 0.00 23.12 22.18 1r1d s ALA 17 CO 0.20 0.56 -0.12 0.08 0.00 0.00 0.00 175.76 176.48 1r1d s VAL 18 N -0.80 1.28 -0.18 0.00 1.01 0.01 -0.88 120.40 120.84 1r1d s VAL 18 Ca 0.13 -0.48 -0.22 0.00 0.00 0.00 0.00 61.98 61.40 1r1d s VAL 18 Cb -0.10 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 1r1d s VAL 18 CO 0.02 0.40 0.70 -0.22 0.00 0.00 0.00 175.10 176.01 1r1d s LEU 19 N 1.32 4.16 -0.22 3.92 2.96 -0.17 -2.06 118.68 128.59 1r1d s LEU 19 Ca -0.01 0.96 -0.07 0.00 -0.22 0.00 0.00 54.13 54.80 1r1d s LEU 19 Cb -0.14 -3.01 -0.03 0.00 0.50 0.00 0.00 46.19 43.51 1r1d s LEU 19 CO -0.05 -0.31 0.05 -0.76 -1.32 0.00 0.00 176.35 173.96 1r1d s LEU 20 N 1.93 3.48 -0.16 -0.68 1.43 -0.10 -1.38 118.68 123.20 1r1d s LEU 20 Ca 0.32 -0.13 -0.01 0.00 -1.03 0.00 0.00 54.13 53.28 1r1d s LEU 20 Cb -0.16 -1.91 -0.01 0.00 0.03 0.00 0.00 46.19 44.14 1r1d s LEU 20 CO 0.11 0.04 -0.13 -0.76 0.23 0.00 0.00 176.35 175.85 1r1d s LEU 21 N 1.15 2.63 0.00 1.79 1.43 -0.19 -4.04 118.68 121.43 1r1d s LEU 21 Ca 0.04 -0.41 -0.09 0.00 -1.03 0.00 0.00 54.13 52.63 1r1d s LEU 21 Cb -0.14 -1.61 0.16 0.00 0.03 0.00 0.00 46.19 44.63 1r1d s LEU 21 CO 0.03 0.09 0.99 0.00 0.23 0.00 0.00 176.35 177.69 1r1d n HIS 22 N 4.02 -3.71 -3.29 0.29 1.44 -1.26 -0.97 115.22 111.73 1r1d n HIS 22 Ca -0.19 -1.08 -0.22 0.00 -2.01 0.00 0.00 57.72 54.22 1r1d n HIS 22 Cb 0.52 -0.75 0.05 0.00 0.12 0.00 0.00 29.99 29.92 1r1d n HIS 22 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1r1d s GLY 23 N -5.11 1.90 0.10 -1.39 0.00 -1.10 -2.63 107.32 99.10 1r1d s GLY 23 Ca 0.58 -1.90 -0.31 0.00 0.00 0.00 0.00 44.72 43.09 1r1d s GLY 23 CO 0.40 -1.78 1.71 -0.12 0.00 0.00 0.00 173.10 173.31 1r1d s PHE 24 N -2.73 2.39 0.00 1.90 5.36 -1.26 -1.23 117.98 122.41 1r1d s PHE 24 Ca 0.54 0.22 0.00 0.00 -0.96 0.00 0.00 56.93 56.73 1r1d s PHE 24 Cb -0.04 -4.04 0.00 0.00 -0.34 0.00 0.00 43.02 38.59 1r1d s PHE 24 CO 0.34 -4.20 0.00 0.25 -1.46 0.00 0.00 175.22 170.15 1r1d n THR 25 N 4.64 0.00 -2.48 0.12 -2.24 -1.26 -5.00 114.28 108.06 1r1d n THR 25 Ca 0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 1r1d n THR 25 Cb 0.39 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 1r1d n THR 25 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r1d n GLY 26 N -2.00 1.60 2.84 3.38 0.00 -0.37 -4.92 105.19 105.72 1r1d n GLY 26 Ca 0.00 -2.05 -0.07 0.00 0.00 0.00 0.00 46.02 43.90 1r1d n GLY 26 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1r1d n ASN 27 N -2.11 -1.74 0.24 1.61 0.23 -1.26 -4.38 115.26 107.85 1r1d n ASN 27 Ca 0.00 -2.20 0.18 0.00 -0.53 0.00 0.00 54.58 52.03 1r1d n ASN 27 Cb 0.00 2.90 0.86 0.00 -2.08 0.00 0.00 39.78 41.46 1r1d n ASN 27 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1r1d h SER 28 N 1.50 0.00 0.21 0.53 4.64 -1.86 -0.47 113.55 118.10 1r1d h SER 28 Ca -0.25 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.05 1r1d h SER 28 Cb 0.93 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.02 1r1d h SER 28 CO 0.32 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 176.21 1r1d h ALA 29 N 1.62 1.39 0.00 5.18 0.00 -1.96 -1.93 119.26 123.56 1r1d h ALA 29 Ca 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r1d h ALA 29 Cb 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1r1d h ALA 29 CO -0.00 0.09 0.00 -0.25 0.00 0.00 0.00 179.25 179.09 1r1d n ASP 30 N -3.74 0.68 -0.04 0.00 8.00 -0.18 -3.40 116.55 117.87 1r1d n ASP 30 Ca -0.02 0.62 0.01 0.00 0.71 0.00 0.00 54.79 56.10 1r1d n ASP 30 Cb 0.17 -0.78 0.02 0.00 -0.02 0.00 0.00 41.12 40.51 1r1d n ASP 30 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1r1d n VAL 31 N -2.20 0.72 0.26 2.53 0.24 -0.79 -4.73 118.33 114.35 1r1d n VAL 31 Ca 0.04 -0.76 0.00 0.00 -2.04 0.00 0.00 64.34 61.58 1r1d n VAL 31 Cb 0.32 0.57 0.00 0.00 -1.47 0.00 0.00 33.84 33.26 1r1d n VAL 31 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1r1d n ARG 32 N -0.42 0.26 0.00 7.34 0.63 -0.80 -1.68 116.66 121.99 1r1d n ARG 32 Ca 0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 1r1d n ARG 32 Cb 0.40 -1.21 0.00 0.00 0.45 0.00 0.00 32.46 32.10 1r1d n ARG 32 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1r1d n LEU 34 N 0.54 0.00 -0.08 6.15 7.94 -1.26 -0.14 117.00 130.15 1r1d n LEU 34 Ca 0.00 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.87 1r1d n LEU 34 Cb 0.09 0.00 0.19 0.00 0.53 0.00 0.00 43.42 44.23 1r1d n LEU 34 CO 0.00 0.00 0.88 1.23 -1.11 0.00 0.00 177.39 178.39 1r1d h GLY 35 N 0.00 0.77 1.15 -3.96 0.00 -1.75 -0.93 103.07 98.35 1r1d h GLY 35 Ca 0.00 -0.51 -0.15 0.00 0.00 0.00 0.00 47.33 46.67 1r1d h GLY 35 CO 0.00 0.47 -0.33 3.21 0.00 0.00 0.00 176.54 179.89 1r1d h ARG 36 N 0.67 0.94 -0.13 4.80 2.47 -0.82 -0.21 114.38 122.10 1r1d h ARG 36 Ca 0.13 -0.46 -0.01 0.00 -1.26 0.00 0.00 59.98 58.38 1r1d h ARG 36 Cb 0.44 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.76 1r1d h ARG 36 CO 0.02 1.12 0.05 0.35 0.56 0.00 0.00 179.97 182.08 1r1d h PHE 37 N 0.78 0.21 -0.22 3.04 3.57 -1.76 -1.04 116.94 121.52 1r1d h PHE 37 Ca 0.08 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 1r1d h PHE 37 Cb 0.92 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 1r1d h PHE 37 CO 0.06 0.29 -0.09 -0.07 -2.23 0.00 0.00 178.31 176.27 1r1d h LEU 38 N 0.06 0.33 -0.08 0.59 4.07 -1.09 -2.26 115.31 116.94 1r1d h LEU 38 Ca 0.04 -0.07 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1r1d h LEU 38 Cb 0.17 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 41.82 1r1d h LEU 38 CO -0.00 0.46 0.02 -0.08 -1.08 0.00 0.00 178.44 177.75 1r1d h GLU 39 N 0.33 0.12 -0.32 1.13 4.81 -0.65 0.50 114.58 120.50 1r1d h GLU 39 Ca 0.07 -0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.36 1r1d h GLU 39 Cb 0.37 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1r1d h GLU 39 CO 0.02 0.30 0.24 0.66 -0.73 0.00 0.00 179.01 179.50 1r1d h SER 40 N -0.08 0.00 -0.34 1.04 4.64 -0.78 0.44 113.55 118.47 1r1d h SER 40 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1r1d h SER 40 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1r1d h SER 40 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1r1d n LYS 41 N -4.37 1.88 -0.57 4.77 4.76 -0.89 -4.90 118.16 118.85 1r1d n LYS 41 Ca 0.05 -1.25 0.00 0.00 -2.87 0.00 0.00 58.31 54.24 1r1d n LYS 41 Cb 0.41 -1.32 0.00 0.00 -1.84 0.00 0.00 35.03 32.28 1r1d n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1r1d n GLY 42 N 0.98 0.72 3.64 0.72 0.00 0.15 -5.01 105.19 106.40 1r1d n GLY 42 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1r1d n GLY 42 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r1d s TYR 43 N -2.07 3.31 0.16 1.61 2.02 0.17 -0.88 117.35 121.67 1r1d s TYR 43 Ca 0.00 0.35 -0.30 0.00 -0.37 0.00 0.00 57.07 56.75 1r1d s TYR 43 Cb 0.00 -2.41 -0.07 0.00 -0.40 0.00 0.00 41.96 39.08 1r1d s TYR 43 CO 0.00 -0.04 0.97 -0.08 -1.57 0.00 0.00 175.55 174.83 1r1d s THR 44 N 1.41 4.29 0.11 -0.71 -1.32 -0.53 -3.04 115.64 115.85 1r1d s THR 44 Ca 0.12 2.03 0.10 0.00 -1.21 0.00 0.00 61.69 62.73 1r1d s THR 44 Cb -0.15 -4.30 -0.04 0.00 -1.51 0.00 0.00 72.50 66.51 1r1d s THR 44 CO 0.07 0.37 -0.24 0.00 -2.21 0.00 0.00 174.62 172.62 1r1d s HIS 46 N -1.09 0.26 -0.22 0.00 5.65 -0.88 -0.51 115.29 118.50 1r1d s HIS 46 Ca 0.10 0.05 0.00 0.00 0.25 0.00 0.00 55.06 55.47 1r1d s HIS 46 Cb -0.10 -0.43 0.06 0.00 -1.18 0.00 0.00 32.58 30.92 1r1d s HIS 46 CO 0.05 -0.15 -0.04 0.00 -0.65 0.00 0.00 174.74 173.95 1r1d s ALA 47 N 1.34 1.77 0.93 1.58 0.00 -0.44 -0.92 121.76 126.01 1r1d s ALA 47 Ca -0.05 -1.20 -0.09 0.00 0.00 0.00 0.00 51.96 50.61 1r1d s ALA 47 Cb -0.13 -1.37 0.14 0.00 0.00 0.00 0.00 23.12 21.77 1r1d s ALA 47 CO -0.03 -1.15 0.87 -0.35 0.00 0.00 0.00 175.76 175.10 1r1d n PRO 48 N 4.75 -0.70 -4.49 0.00 -0.04 -1.26 -1.52 135.00 131.73 1r1d n PRO 48 Ca -0.12 -1.49 -0.23 0.00 -0.04 0.00 0.00 63.50 61.62 1r1d n PRO 48 Cb 0.45 -0.85 -0.16 0.00 -0.04 0.00 0.00 33.50 32.90 1r1d n PRO 48 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1r1d s ILE 49 N -2.81 0.98 0.61 0.52 1.01 -1.26 -4.44 121.20 115.81 1r1d s ILE 49 Ca 0.50 -0.41 -0.16 0.00 0.00 0.00 0.00 60.65 60.58 1r1d s ILE 49 Cb -0.02 -0.90 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 1r1d s ILE 49 CO 0.35 0.31 1.09 -0.31 0.00 0.00 0.00 174.94 176.38 1r1d s TYR 50 N 0.55 2.79 0.46 3.97 2.02 -1.26 -4.95 117.35 120.94 1r1d s TYR 50 Ca -0.11 1.53 -0.24 0.00 -0.37 0.00 0.00 57.07 57.88 1r1d s TYR 50 Cb -0.14 -3.11 -0.07 0.00 -0.40 0.00 0.00 41.96 38.24 1r1d s TYR 50 CO 0.02 -1.41 1.37 0.21 -1.57 0.00 0.00 175.55 174.18 1r1d s LYS 51 N -3.98 3.62 0.00 -0.62 2.20 -1.26 -1.63 119.74 118.07 1r1d s LYS 51 Ca 0.66 2.29 0.00 0.00 -0.36 0.00 0.00 55.97 58.56 1r1d s LYS 51 Cb -0.19 -2.57 0.00 0.00 -1.51 0.00 0.00 37.83 33.56 1r1d s LYS 51 CO 0.37 -0.83 0.00 0.41 -0.36 0.00 0.00 175.35 174.95 1r1d n GLY 52 N 0.62 1.96 3.67 5.54 0.00 -1.26 -4.83 105.19 110.90 1r1d n GLY 52 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 1r1d n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1r1d s HIS 53 N -2.76 2.93 -0.76 1.61 3.76 -0.64 -3.64 115.29 115.77 1r1d s HIS 53 Ca 0.00 -0.08 0.00 0.00 -0.15 0.00 0.00 55.06 54.83 1r1d s HIS 53 Cb 0.00 -1.47 0.00 0.00 1.11 0.00 0.00 32.58 32.22 1r1d s HIS 53 CO 0.00 0.49 0.00 0.41 -0.85 0.00 0.00 174.74 174.79 1r1d n GLY 54 N 0.30 0.79 3.33 -2.22 0.00 -1.26 -4.77 105.19 101.37 1r1d n GLY 54 Ca -0.11 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 1r1d n GLY 54 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r1d s VAL 55 N -2.30 0.00 0.50 1.61 -7.23 -1.26 -4.68 120.40 107.04 1r1d s VAL 55 Ca 0.00 -1.81 -0.23 0.00 -1.81 0.00 0.00 61.98 58.14 1r1d s VAL 55 Cb 0.00 -2.43 -0.07 0.00 0.56 0.00 0.00 36.38 34.44 1r1d s VAL 55 CO 0.00 0.00 1.17 -2.65 -0.31 0.00 0.00 175.10 173.31 1r1d n PRO 56 N -0.35 1.50 -0.08 4.82 -0.02 -1.26 -4.84 135.00 134.77 1r1d n PRO 56 Ca 0.01 0.55 0.26 0.00 -2.02 0.00 0.00 63.50 62.30 1r1d n PRO 56 Cb 0.64 -2.32 0.72 0.00 -0.02 0.00 0.00 33.50 32.52 1r1d n PRO 56 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1r1d h PRO 57 N 1.42 0.00 -0.20 0.52 0.13 -1.92 -0.77 132.00 131.18 1r1d h PRO 57 Ca -0.48 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1r1d h PRO 57 Cb 1.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 1r1d h PRO 57 CO 0.56 0.00 0.13 0.93 -0.23 0.00 0.00 178.00 179.40 1r1d h GLU 58 N 0.00 0.25 0.00 0.86 3.07 -1.94 -0.84 114.58 115.97 1r1d h GLU 58 Ca 0.34 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1r1d h GLU 58 Cb 1.53 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.38 1r1d h GLU 58 CO -0.00 0.17 0.00 0.39 -1.40 0.00 0.00 179.01 178.16 1r1d n GLU 59 N -4.51 0.08 0.07 2.33 1.02 -0.29 -3.52 120.64 115.82 1r1d n GLU 59 Ca 0.00 0.09 -0.21 0.00 -0.02 0.00 0.00 57.16 57.03 1r1d n GLU 59 Cb 0.09 -1.60 -0.11 0.00 -0.02 0.00 0.00 31.44 29.79 1r1d n GLU 59 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1r1d h LEU 60 N 0.00 0.85 -1.00 -4.62 5.85 -1.21 -3.37 115.31 111.80 1r1d h LEU 60 Ca 0.00 -0.74 0.34 0.00 0.84 0.00 0.00 57.88 58.32 1r1d h LEU 60 Cb 0.55 -0.26 -0.15 0.00 0.37 0.00 0.00 40.66 41.16 1r1d h LEU 60 CO 0.00 1.55 0.57 0.58 -0.34 0.00 0.00 178.44 180.79 1r1d h VAL 61 N 0.31 0.25 -0.57 1.05 2.07 -1.60 -0.69 116.25 117.08 1r1d h VAL 61 Ca -0.16 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1r1d h VAL 61 Cb 1.82 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 1r1d h VAL 61 CO 0.22 0.05 0.00 1.41 0.02 0.00 0.00 177.57 179.27 1r1d n HIS 62 N -5.09 1.39 -4.28 1.57 8.25 -1.26 -4.42 115.22 111.38 1r1d n HIS 62 Ca 0.33 -0.54 -0.27 0.00 -0.26 0.00 0.00 57.72 56.98 1r1d n HIS 62 Cb 1.04 -0.25 -0.09 0.00 1.12 0.00 0.00 29.99 31.80 1r1d n HIS 62 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1r1d s THR 63 N -1.90 3.25 0.28 1.59 -4.23 -0.27 -5.05 115.64 109.32 1r1d s THR 63 Ca 0.46 -1.63 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1r1d s THR 63 Cb 0.30 -2.61 -0.00 0.00 1.34 0.00 0.00 72.50 71.53 1r1d s THR 63 CO 0.21 -0.11 0.36 0.61 -0.54 0.00 0.00 174.62 175.15 1r1d n GLY 64 N 0.03 2.49 0.42 3.99 0.00 -1.26 -4.77 105.19 106.08 1r1d n GLY 64 Ca -0.11 -1.64 0.24 0.00 0.00 0.00 0.00 46.02 44.51 1r1d n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1r1d h PRO 65 N 0.00 0.00 -0.16 1.61 0.13 -1.88 0.69 132.00 132.39 1r1d h PRO 65 Ca -0.22 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.88 1r1d h PRO 65 Cb 0.97 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.09 1r1d h PRO 65 CO 0.30 0.00 -0.06 -0.44 -0.23 0.00 0.00 178.00 177.57 1r1d h ASP 66 N 0.00 0.22 0.02 1.44 3.32 -1.96 0.36 116.42 119.83 1r1d h ASP 66 Ca 0.32 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.28 1r1d h ASP 66 Cb 1.29 -0.06 0.01 0.00 0.22 0.00 0.00 39.33 40.79 1r1d h ASP 66 CO -0.00 0.32 -0.22 0.44 -1.72 0.00 0.00 179.24 178.06 1r1d h ASP 67 N 0.24 0.15 -0.52 6.45 3.32 -1.28 -3.27 116.42 121.50 1r1d h ASP 67 Ca 0.05 -0.89 -0.01 0.00 0.02 0.00 0.00 57.03 56.20 1r1d h ASP 67 Cb 0.26 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 1r1d h ASP 67 CO 0.01 1.03 0.29 -0.50 -1.72 0.00 0.00 179.24 178.35 1r1d h TRP 68 N -0.70 0.74 -0.64 4.55 6.55 -1.26 -2.12 115.95 123.08 1r1d h TRP 68 Ca -0.03 -0.01 0.01 0.00 0.95 0.00 0.00 58.89 59.80 1r1d h TRP 68 Cb 1.08 -0.24 -0.03 0.00 -0.86 0.00 0.00 29.16 29.11 1r1d h TRP 68 CO 0.22 0.53 0.42 2.35 -1.05 0.00 0.00 178.44 180.91 1r1d h TRP 69 N 0.76 0.79 -0.44 0.49 -0.00 -1.03 -0.45 115.95 116.07 1r1d h TRP 69 Ca 0.19 0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 59.09 1r1d h TRP 69 Cb 0.04 -0.27 -0.02 0.00 -0.00 0.00 0.00 29.16 28.91 1r1d h TRP 69 CO 0.00 0.49 0.21 1.96 -0.00 0.00 0.00 178.44 181.11 1r1d h GLN 70 N 0.85 0.64 -0.78 2.65 1.08 -1.44 -2.21 115.11 115.90 1r1d h GLN 70 Ca 0.24 -0.09 -0.02 0.00 -1.45 0.00 0.00 58.65 57.32 1r1d h GLN 70 Cb -0.08 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.20 1r1d h GLN 70 CO -0.05 0.55 0.42 -0.44 -0.95 0.00 0.00 178.83 178.35 1r1d h ASP 71 N 0.57 0.98 0.00 1.46 3.32 -1.12 0.12 116.42 121.75 1r1d h ASP 71 Ca 0.15 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1r1d h ASP 71 Cb 0.12 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.42 1r1d h ASP 71 CO -0.02 0.79 0.00 0.52 -1.72 0.00 0.00 179.24 178.81 1r1d n VAL 72 N -4.35 0.00 0.00 -1.35 0.31 -0.28 -1.26 118.33 111.41 1r1d n VAL 72 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 1r1d n VAL 72 Cb 0.10 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.88 1r1d n VAL 72 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1r1d n ASN 74 N 0.27 0.00 -0.19 4.52 3.02 0.43 -1.78 115.26 121.53 1r1d n ASN 74 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.45 1r1d n ASN 74 Cb 0.05 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.23 1r1d n ASN 74 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1r1d h GLY 75 N 0.00 1.09 0.83 7.41 0.00 -1.40 0.40 103.07 111.40 1r1d h GLY 75 Ca 0.00 -0.87 -0.03 0.00 0.00 0.00 0.00 47.33 46.43 1r1d h GLY 75 CO 0.00 0.79 0.01 -1.82 0.00 0.00 0.00 176.54 175.53 1r1d h TYR 76 N 0.88 0.39 -0.58 5.60 3.20 -1.62 -2.85 116.97 122.00 1r1d h TYR 76 Ca 0.14 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 1r1d h TYR 76 Cb 0.65 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 1r1d h TYR 76 CO 0.05 0.54 0.24 1.96 -1.64 0.00 0.00 178.16 179.30 1r1d h GLN 77 N 0.14 0.84 -0.17 1.82 1.08 -1.78 -1.96 115.11 115.07 1r1d h GLN 77 Ca 0.06 -0.12 0.03 0.00 -1.45 0.00 0.00 58.65 57.17 1r1d h GLN 77 Cb 0.37 -0.15 -0.06 0.00 -0.05 0.00 0.00 27.48 27.59 1r1d h GLN 77 CO 0.01 0.68 -0.53 0.35 -0.95 0.00 0.00 178.83 178.39 1r1d h PHE 78 N 0.83 -1.58 -0.64 2.96 3.57 0.02 0.15 116.94 122.26 1r1d h PHE 78 Ca 0.20 0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.83 1r1d h PHE 78 Cb 0.15 0.71 -0.06 0.00 2.79 0.00 0.00 35.95 39.55 1r1d h PHE 78 CO 0.01 -0.52 0.33 -0.07 -2.23 0.00 0.00 178.31 175.83 1r1d h LEU 79 N -0.54 0.46 0.21 0.59 3.38 -1.31 -1.86 115.31 116.24 1r1d h LEU 79 Ca 0.04 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1r1d h LEU 79 Cb 0.64 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1r1d h LEU 79 CO -0.45 0.29 -0.13 0.11 0.09 0.00 0.00 178.44 178.35 1r1d h LYS 80 N 0.60 -0.32 -0.14 1.13 1.79 -0.56 -2.00 116.57 117.07 1r1d h LYS 80 Ca 0.29 0.02 0.04 0.00 -2.18 0.00 0.00 60.65 58.83 1r1d h LYS 80 Cb 0.23 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 1r1d h LYS 80 CO -0.21 -0.21 0.13 -0.91 -1.08 0.00 0.00 179.45 177.17 1r1d h ASN 81 N -0.33 0.00 0.12 0.86 2.35 -0.48 0.44 115.58 118.54 1r1d h ASN 81 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1r1d h ASN 81 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 1r1d h ASN 81 CO 0.02 0.00 0.00 1.17 -1.65 0.00 0.00 177.43 176.97 1r1d n LYS 82 N -4.03 0.71 -0.00 0.81 3.00 -0.72 -4.88 118.16 113.04 1r1d n LYS 82 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 1r1d n LYS 82 Cb 0.25 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.78 1r1d n LYS 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1r1d n GLY 83 N 0.69 0.16 3.62 3.14 0.00 0.15 -5.05 105.19 107.91 1r1d n GLY 83 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1r1d n GLY 83 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r1d s TYR 84 N -2.05 2.18 0.02 1.61 1.51 -0.94 -4.93 117.35 114.75 1r1d s TYR 84 Ca 0.00 0.61 -0.23 0.00 -1.01 0.00 0.00 57.07 56.45 1r1d s TYR 84 Cb 0.00 -4.02 -0.16 0.00 -0.11 0.00 0.00 41.96 37.67 1r1d s TYR 84 CO 0.00 -2.68 1.33 0.93 -1.11 0.00 0.00 175.55 174.03 1r1d h GLU 85 N 10.77 0.20 -5.51 -0.62 4.39 -1.89 -3.39 114.58 118.55 1r1d h GLU 85 Ca -0.32 -0.10 -0.66 0.00 0.34 0.00 0.00 59.36 58.62 1r1d h GLU 85 Cb 1.14 0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 29.53 1r1d h GLU 85 CO 1.02 0.61 -0.77 0.15 -1.16 0.00 0.00 179.01 178.85 1r1d s LYS 86 N -4.38 3.20 -0.04 2.33 1.02 -1.26 -5.09 119.74 115.52 1r1d s LYS 86 Ca -0.15 -0.70 0.03 0.00 0.02 0.00 0.00 55.97 55.18 1r1d s LYS 86 Cb 0.04 -2.56 0.00 0.00 -0.52 0.00 0.00 37.83 34.79 1r1d s LYS 86 CO 0.72 0.29 -0.14 0.42 -0.92 0.00 0.00 175.35 175.72 1r1d s ILE 87 N 0.15 1.18 0.39 2.17 1.01 -1.26 -3.47 121.20 121.38 1r1d s ILE 87 Ca -0.07 -0.57 0.08 0.00 0.00 0.00 0.00 60.65 60.09 1r1d s ILE 87 Cb -0.15 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.27 1r1d s ILE 87 CO 0.05 0.35 0.40 0.00 0.00 0.00 0.00 174.94 175.74 1r1d s ALA 88 N 0.21 4.12 -0.11 9.38 0.00 -0.06 -0.42 121.76 134.89 1r1d s ALA 88 Ca -0.06 -1.77 -0.07 0.00 0.00 0.00 0.00 51.96 50.06 1r1d s ALA 88 Cb -0.12 -1.21 0.04 0.00 0.00 0.00 0.00 23.12 21.84 1r1d s ALA 88 CO 0.02 -0.17 0.27 0.54 0.00 0.00 0.00 175.76 176.42 1r1d s VAL 89 N -2.40 -0.02 -0.08 0.00 0.11 -0.59 -1.00 120.40 116.43 1r1d s VAL 89 Ca 0.48 0.07 0.03 0.00 -2.93 0.00 0.00 61.98 59.63 1r1d s VAL 89 Cb -0.05 -0.40 0.01 0.00 -1.53 0.00 0.00 36.38 34.41 1r1d s VAL 89 CO 0.29 0.03 -0.16 0.00 -3.33 0.00 0.00 175.10 171.93 1r1d s ALA 90 N 0.76 1.58 0.01 1.54 0.00 -0.48 -0.53 121.76 124.64 1r1d s ALA 90 Ca -0.05 -0.62 0.05 0.00 0.00 0.00 0.00 51.96 51.34 1r1d s ALA 90 Cb -0.06 -0.67 -0.02 0.00 0.00 0.00 0.00 23.12 22.38 1r1d s ALA 90 CO -0.05 0.16 -0.16 0.20 0.00 0.00 0.00 175.76 175.91 1r1d s GLY 91 N 0.59 0.81 -0.23 0.00 0.00 0.02 -1.03 107.32 107.47 1r1d s GLY 91 Ca -0.15 -0.76 -0.09 0.00 0.00 0.00 0.00 44.72 43.72 1r1d s GLY 91 CO 0.05 -0.67 0.11 -2.27 0.00 0.00 0.00 173.10 170.32 1r1d s LEU 92 N -0.68 3.85 0.00 0.66 2.96 -0.14 -3.18 118.68 122.14 1r1d s LEU 92 Ca 0.05 0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 1r1d s LEU 92 Cb -0.07 -2.02 0.00 0.00 0.50 0.00 0.00 46.19 44.60 1r1d s LEU 92 CO 0.00 0.06 0.00 -0.24 -1.32 0.00 0.00 176.35 174.85 1r1d n SER 93 N 4.32 0.00 0.16 3.68 2.88 -1.25 -0.61 113.62 122.81 1r1d n SER 93 Ca -0.16 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.56 1r1d n SER 93 Cb 0.52 0.00 0.79 0.00 -0.75 0.00 0.00 64.21 64.77 1r1d n SER 93 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1r1d h LEU 94 N 0.00 0.00 -1.50 2.46 5.85 -1.84 0.44 115.31 120.73 1r1d h LEU 94 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1r1d h LEU 94 Cb 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1r1d h LEU 94 CO 0.00 0.00 0.27 1.23 -0.34 0.00 0.00 178.44 179.60 1r1d h GLY 95 N 0.00 0.65 1.45 3.75 0.00 -0.61 -1.08 103.07 107.23 1r1d h GLY 95 Ca 0.12 -0.26 -0.10 0.00 0.00 0.00 0.00 47.33 47.09 1r1d h GLY 95 CO -0.00 0.25 -0.21 -1.33 0.00 0.00 0.00 176.54 175.25 1r1d h GLY 96 N 0.67 0.69 0.98 4.60 0.00 -0.07 0.15 103.07 110.09 1r1d h GLY 96 Ca 0.17 -0.56 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 1r1d h GLY 96 CO -0.03 0.51 0.14 -2.08 0.00 0.00 0.00 176.54 175.08 1r1d h VAL 97 N 0.57 1.24 -0.06 4.60 2.07 -1.13 -1.85 116.25 121.68 1r1d h VAL 97 Ca 0.09 -0.82 -0.07 0.00 0.82 0.00 0.00 66.70 66.72 1r1d h VAL 97 Cb 0.67 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1r1d h VAL 97 CO 0.05 0.30 -0.31 -0.26 0.02 0.00 0.00 177.57 177.37 1r1d h PHE 98 N 0.71 0.12 -0.53 1.57 0.04 -0.94 -2.39 116.94 115.51 1r1d h PHE 98 Ca 0.16 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.82 1r1d h PHE 98 Cb 0.30 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.41 1r1d h PHE 98 CO 0.02 0.41 -0.03 0.77 -0.60 0.00 0.00 178.31 178.88 1r1d h SER 99 N 0.10 0.94 -0.28 2.17 0.02 -0.51 0.15 113.55 116.14 1r1d h SER 99 Ca 0.01 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 60.63 1r1d h SER 99 Cb 0.60 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 1r1d h SER 99 CO 0.04 1.04 0.12 -0.07 -1.14 0.00 0.00 176.83 176.82 1r1d h LEU 100 N 0.83 0.38 -0.25 5.07 3.38 -1.16 0.87 115.31 124.42 1r1d h LEU 100 Ca 0.15 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1r1d h LEU 100 Cb 0.57 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1r1d h LEU 100 CO 0.03 0.42 0.14 0.50 0.09 0.00 0.00 178.44 179.62 1r1d h LYS 101 N 0.31 0.35 -0.81 1.13 3.64 -1.20 -1.41 116.57 118.58 1r1d h LYS 101 Ca 0.09 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1r1d h LYS 101 Cb 0.15 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.85 1r1d h LYS 101 CO -0.01 0.30 0.53 1.25 -2.27 0.00 0.00 179.45 179.25 1r1d h LEU 102 N 0.30 0.86 -1.89 5.20 5.85 -0.54 -1.33 115.31 123.76 1r1d h LEU 102 Ca 0.09 -0.01 0.16 0.00 0.84 0.00 0.00 57.88 58.96 1r1d h LEU 102 Cb 0.05 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1r1d h LEU 102 CO -0.02 0.59 0.43 1.23 -0.34 0.00 0.00 178.44 180.33 1r1d h GLY 103 N 1.00 0.19 -1.78 3.75 0.00 0.30 0.11 103.07 106.63 1r1d h GLY 103 Ca 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1r1d h GLY 103 CO -0.10 0.02 0.00 1.58 0.00 0.00 0.00 176.54 178.04 1r1d n TYR 104 N -4.40 0.79 -0.08 5.60 0.18 -0.55 -4.61 117.16 114.10 1r1d n TYR 104 Ca 0.11 -0.60 -0.15 0.00 1.88 0.00 0.00 57.90 59.15 1r1d n TYR 104 Cb 0.60 -0.13 -0.06 0.00 -0.38 0.00 0.00 39.34 39.38 1r1d n TYR 104 CO 0.00 0.00 0.00 2.41 -2.08 0.00 0.00 176.86 177.19 1r1d n THR 105 N 0.50 0.85 -4.31 -3.48 -1.04 -0.09 -5.05 114.28 101.66 1r1d n THR 105 Ca 0.17 -0.26 -0.16 0.00 -2.04 0.00 0.00 64.05 61.76 1r1d n THR 105 Cb 0.63 -1.47 -0.10 0.00 -1.82 0.00 0.00 70.33 67.57 1r1d n THR 105 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1r1d s VAL 106 N -2.29 1.18 0.03 12.58 -7.23 -0.54 -5.10 120.40 119.04 1r1d s VAL 106 Ca -0.21 -2.06 -0.34 0.00 -1.81 0.00 0.00 61.98 57.56 1r1d s VAL 106 Cb 0.07 -2.16 -0.13 0.00 0.56 0.00 0.00 36.38 34.73 1r1d s VAL 106 CO 0.30 -0.49 1.75 -2.65 -0.31 0.00 0.00 175.10 173.70 1r1d n PRO 107 N -0.35 2.21 -4.14 4.82 -0.02 -1.26 -4.60 135.00 131.65 1r1d n PRO 107 Ca -0.07 0.81 -0.19 0.00 -2.02 0.00 0.00 63.50 62.03 1r1d n PRO 107 Cb 0.62 -2.62 -0.16 0.00 -0.02 0.00 0.00 33.50 31.32 1r1d n PRO 107 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1r1d s ILE 108 N 2.67 0.47 0.08 4.25 -1.09 -1.26 -4.64 121.20 121.67 1r1d s ILE 108 Ca 0.86 -0.11 -0.16 0.00 -2.23 0.00 0.00 60.65 59.01 1r1d s ILE 108 Cb -0.67 -0.49 -0.14 0.00 -1.58 0.00 0.00 42.46 39.58 1r1d s ILE 108 CO 0.45 0.20 1.32 -0.08 -1.23 0.00 0.00 174.94 175.59 1r1d h GLU 109 N 7.00 0.65 -2.37 2.79 4.57 -1.10 -3.46 114.58 122.67 1r1d h GLU 109 Ca -0.38 -0.46 -0.03 0.00 -1.18 0.00 0.00 59.36 57.32 1r1d h GLU 109 Cb 1.15 0.07 -0.16 0.00 -0.16 0.00 0.00 28.75 29.65 1r1d h GLU 109 CO 0.48 1.08 0.23 0.20 -1.18 0.00 0.00 179.01 179.82 1r1d s GLY 110 N -3.87 -0.57 -0.06 1.92 0.00 -1.26 -4.32 107.32 99.16 1r1d s GLY 110 Ca -0.12 1.03 0.05 0.00 0.00 0.00 0.00 44.72 45.68 1r1d s GLY 110 CO 0.85 0.63 -0.20 -0.42 0.00 0.00 0.00 173.10 173.96 1r1d s ILE 111 N -2.25 1.68 -0.17 0.90 1.01 0.13 -1.54 121.20 120.96 1r1d s ILE 111 Ca -0.05 -0.84 0.00 0.00 0.00 0.00 0.00 60.65 59.76 1r1d s ILE 111 Cb -0.00 -1.45 0.04 0.00 0.01 0.00 0.00 42.46 41.05 1r1d s ILE 111 CO -0.00 0.48 -0.10 -0.69 0.00 0.00 0.00 174.94 174.62 1r1d s VAL 112 N 0.11 1.48 0.00 2.92 1.01 0.31 -0.45 120.40 125.78 1r1d s VAL 112 Ca -0.08 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1r1d s VAL 112 Cb -0.14 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.72 1r1d s VAL 112 CO 0.04 0.26 0.00 0.35 0.00 0.00 0.00 175.10 175.75 1r1d n THR 113 N 4.76 0.00 0.00 3.92 -2.24 -0.69 -0.80 114.28 119.22 1r1d n THR 113 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1r1d n THR 113 Cb 0.48 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 1r1d n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r1d s ALA 116 N 0.00 3.36 0.95 0.00 0.00 -1.26 -3.77 121.76 121.04 1r1d s ALA 116 Ca 0.00 0.81 -0.14 0.00 0.00 0.00 0.00 51.96 52.63 1r1d s ALA 116 Cb 0.00 -3.37 0.16 0.00 0.00 0.00 0.00 23.12 19.91 1r1d s ALA 116 CO 0.00 -0.26 1.19 -1.25 0.00 0.00 0.00 175.76 175.43 1r1d s PRO 117 N 0.03 0.83 0.00 0.00 0.04 -1.26 -4.62 135.00 130.01 1r1d s PRO 117 Ca 0.52 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.60 1r1d s PRO 117 Cb -0.29 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1r1d s PRO 117 CO 0.33 -2.36 0.00 0.66 0.04 0.00 0.00 177.00 175.67 1r1d n TYR 119 N -3.83 0.00 -3.23 0.56 4.02 -1.26 -4.87 117.16 108.55 1r1d n TYR 119 Ca 0.10 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.59 1r1d n TYR 119 Cb 0.60 -0.09 -0.08 0.00 -0.02 0.00 0.00 39.34 39.75 1r1d n TYR 119 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1r1d s ILE 120 N -1.75 5.06 0.39 -0.72 1.01 -1.26 -5.00 121.20 118.93 1r1d s ILE 120 Ca 0.00 0.85 -0.06 0.00 0.00 0.00 0.00 60.65 61.43 1r1d s ILE 120 Cb 0.00 -3.84 -0.05 0.00 0.01 0.00 0.00 42.46 38.58 1r1d s ILE 120 CO 0.00 0.06 0.69 -0.54 0.00 0.00 0.00 174.94 175.15 1r1d s LYS 121 N 2.33 3.64 0.66 2.79 1.02 -1.26 -5.07 119.74 123.85 1r1d s LYS 121 Ca 0.21 0.18 -0.13 0.00 0.02 0.00 0.00 55.97 56.26 1r1d s LYS 121 Cb -0.16 -2.48 -0.00 0.00 -0.52 0.00 0.00 37.83 34.67 1r1d s LYS 121 CO 0.09 0.00 1.06 -1.54 -0.92 0.00 0.00 175.35 174.05 1r1d s SER 122 N -3.53 5.46 0.25 2.83 1.04 -1.26 -4.94 113.70 113.54 1r1d s SER 122 Ca 0.47 1.71 -0.06 0.00 0.48 0.00 0.00 55.95 58.54 1r1d s SER 122 Cb -0.10 -2.51 0.26 0.00 0.10 0.00 0.00 66.02 63.77 1r1d s SER 122 CO 0.35 -1.39 1.92 -0.33 0.98 0.00 0.00 173.24 174.77 1r1d h GLU 123 N -0.33 1.25 -0.17 4.02 5.08 -1.97 -2.57 114.58 119.89 1r1d h GLU 123 Ca -0.45 -0.08 0.04 0.00 -1.00 0.00 0.00 59.36 57.88 1r1d h GLU 123 Cb 1.22 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 30.14 1r1d h GLU 123 CO 0.57 0.83 -0.11 0.93 -1.00 0.00 0.00 179.01 180.23 1r1d h GLU 124 N 1.29 -0.10 -1.05 2.33 3.07 -2.02 0.36 114.58 118.47 1r1d h GLU 124 Ca 0.36 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 1r1d h GLU 124 Cb -0.12 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 1r1d h GLU 124 CO -0.09 -0.07 0.00 2.41 -1.40 0.00 0.00 179.01 179.86 1r1d n THR 125 N -5.26 0.07 0.00 1.13 -1.04 -0.97 -1.51 114.28 106.71 1r1d n THR 125 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1r1d n THR 125 Cb 0.18 -0.33 0.00 0.00 -1.82 0.00 0.00 70.33 68.36 1r1d n THR 125 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1r1d n TYR 127 N 0.69 0.00 -0.25 -1.42 9.36 0.12 -1.90 117.16 123.77 1r1d n TYR 127 Ca 0.00 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.20 1r1d n TYR 127 Cb 0.05 0.00 0.10 0.00 -0.63 0.00 0.00 39.34 38.86 1r1d n TYR 127 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1r1d h GLU 128 N 0.00 0.75 -0.85 2.98 5.08 -1.51 0.13 114.58 121.17 1r1d h GLU 128 Ca 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1r1d h GLU 128 Cb 0.00 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.04 1r1d h GLU 128 CO 0.00 0.50 0.47 0.78 -1.00 0.00 0.00 179.01 179.76 1r1d h GLY 129 N 0.77 1.26 1.33 -3.84 0.00 -1.65 -1.32 103.07 99.61 1r1d h GLY 129 Ca 0.31 -0.56 -0.07 0.00 0.00 0.00 0.00 47.33 47.00 1r1d h GLY 129 CO -0.16 0.54 0.03 -2.08 0.00 0.00 0.00 176.54 174.87 1r1d h VAL 130 N 1.18 1.24 -0.55 4.60 2.07 -1.40 -1.21 116.25 122.18 1r1d h VAL 130 Ca 0.30 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 1r1d h VAL 130 Cb 0.02 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1r1d h VAL 130 CO -0.05 0.35 0.22 -0.07 0.02 0.00 0.00 177.57 178.04 1r1d h LEU 131 N 0.77 0.76 -0.61 2.57 3.38 -0.14 -1.10 115.31 120.94 1r1d h LEU 131 Ca 0.15 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1r1d h LEU 131 Cb 0.42 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1r1d h LEU 131 CO 0.02 0.72 0.31 -0.33 0.09 0.00 0.00 178.44 179.25 1r1d h GLU 132 N 0.75 0.87 -0.40 1.13 5.08 -0.97 -1.25 114.58 119.80 1r1d h GLU 132 Ca 0.18 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1r1d h GLU 132 Cb 0.20 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 1r1d h GLU 132 CO -0.02 0.68 0.21 -0.92 -1.00 0.00 0.00 179.01 177.97 1r1d h TYR 133 N 0.83 0.38 -0.10 4.33 3.20 -0.82 -0.72 116.97 124.08 1r1d h TYR 133 Ca 0.21 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 1r1d h TYR 133 Cb 0.09 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.24 1r1d h TYR 133 CO -0.00 0.21 0.04 0.00 -1.64 0.00 0.00 178.16 176.76 1r1d h ALA 134 N 1.20 0.13 -0.75 1.82 0.00 -0.93 -1.45 119.26 119.28 1r1d h ALA 134 Ca 0.17 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1r1d h ALA 134 Cb 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1r1d h ALA 134 CO -0.11 -0.28 0.33 -0.09 0.00 0.00 0.00 179.25 179.09 1r1d h ARG 135 N -0.01 1.09 -0.45 0.00 2.43 -1.12 -1.53 114.38 114.79 1r1d h ARG 135 Ca 0.03 -0.17 -0.10 0.00 -0.81 0.00 0.00 59.98 58.92 1r1d h ARG 135 Cb 0.18 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1r1d h ARG 135 CO -0.00 0.87 -0.13 1.49 -1.51 0.00 0.00 179.97 180.68 1r1d h GLU 136 N 1.08 0.85 -0.18 0.20 4.22 -1.04 -1.84 114.58 117.86 1r1d h GLU 136 Ca 0.26 -0.30 -0.01 0.00 0.08 0.00 0.00 59.36 59.38 1r1d h GLU 136 Cb 0.16 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1r1d h GLU 136 CO -0.03 0.93 0.06 -0.92 -2.18 0.00 0.00 179.01 176.88 1r1d h TYR 137 N 0.76 0.29 -0.06 0.92 3.20 -0.82 -1.42 116.97 119.84 1r1d h TYR 137 Ca 0.12 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 1r1d h TYR 137 Cb 0.65 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 1r1d h TYR 137 CO 0.04 0.38 -0.12 0.87 -1.64 0.00 0.00 178.16 177.68 1r1d h LYS 138 N 0.13 0.09 -0.21 1.82 1.57 -1.15 -0.79 116.57 118.03 1r1d h LYS 138 Ca 0.06 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1r1d h LYS 138 Cb 0.22 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1r1d h LYS 138 CO -0.00 0.22 -0.08 -0.22 -0.57 0.00 0.00 179.45 178.80 1r1d h LYS 139 N 0.09 0.42 0.00 3.15 3.64 -1.02 -2.57 116.57 120.28 1r1d h LYS 139 Ca 0.02 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1r1d h LYS 139 Cb 0.28 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1r1d h LYS 139 CO 0.02 0.69 -0.04 0.00 -2.27 0.00 0.00 179.45 177.84 1r1d h ARG 140 N 0.13 0.00 0.00 1.90 3.08 -0.31 -0.05 114.38 119.14 1r1d h ARG 140 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1r1d h ARG 140 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.60 1r1d h ARG 140 CO 0.03 0.04 0.00 0.93 -1.07 0.00 0.00 179.97 179.90 1r1d h GLU 141 N 0.00 0.00 0.00 0.04 5.08 -0.76 -3.46 114.58 115.48 1r1d h GLU 141 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1r1d h GLU 141 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1r1d h GLU 141 CO 0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.43 1r1d n GLY 142 N 0.34 0.13 3.53 -3.84 0.00 -0.03 -5.06 105.19 100.26 1r1d n GLY 142 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1r1d n GLY 142 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r1d n LYS 143 N -1.89 0.23 -2.63 1.61 5.02 -1.17 -4.98 118.16 114.35 1r1d n LYS 143 Ca 0.00 0.13 -0.28 0.00 -2.02 0.00 0.00 58.31 56.14 1r1d n LYS 143 Cb 0.00 -2.03 -0.01 0.00 -0.02 0.00 0.00 35.03 32.97 1r1d n LYS 143 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1r1d s SER 144 N -1.71 6.31 0.44 4.39 1.04 -1.26 -4.75 113.70 118.16 1r1d s SER 144 Ca 0.67 0.99 0.26 0.00 0.48 0.00 0.00 55.95 58.35 1r1d s SER 144 Cb -0.32 -2.27 1.29 0.00 0.10 0.00 0.00 66.02 64.82 1r1d s SER 144 CO 0.56 -0.56 1.74 -0.08 0.98 0.00 0.00 173.24 175.88 1r1d h GLU 145 N 0.38 0.22 0.04 4.02 4.57 -1.99 0.16 114.58 121.98 1r1d h GLU 145 Ca -0.47 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 57.70 1r1d h GLU 145 Cb 1.20 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 1r1d h GLU 145 CO 0.62 0.15 -0.02 1.49 -1.18 0.00 0.00 179.01 180.07 1r1d h GLU 146 N 0.23 -0.05 -0.50 1.92 4.57 -2.00 -2.16 114.58 116.60 1r1d h GLU 146 Ca 0.65 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.74 1r1d h GLU 146 Cb 1.98 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 30.56 1r1d h GLU 146 CO -0.26 0.39 -0.05 0.37 -1.18 0.00 0.00 179.01 178.29 1r1d h GLN 147 N -0.50 0.91 -0.07 1.92 4.15 -1.47 -2.54 115.11 117.51 1r1d h GLN 147 Ca -0.00 -0.31 0.04 0.00 0.77 0.00 0.00 58.65 59.14 1r1d h GLN 147 Cb 0.46 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 28.03 1r1d h GLN 147 CO 0.01 0.96 -0.26 0.82 -1.93 0.00 0.00 178.83 178.43 1r1d h ILE 148 N 0.77 0.40 -0.27 2.39 1.08 -0.81 -0.16 117.51 120.92 1r1d h ILE 148 Ca 0.14 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.67 1r1d h ILE 148 Cb 0.58 0.40 -0.06 0.00 -3.07 0.00 0.00 36.82 34.68 1r1d h ILE 148 CO 0.03 0.00 -0.13 -0.08 -0.69 0.00 0.00 178.15 177.28 1r1d h GLU 149 N -0.36 -0.09 -0.93 2.37 4.57 -1.27 -1.97 114.58 116.91 1r1d h GLU 149 Ca 0.08 0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1r1d h GLU 149 Cb 0.48 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.04 1r1d h GLU 149 CO -0.27 -0.06 0.56 0.37 -1.18 0.00 0.00 179.01 178.43 1r1d h GLN 150 N -0.09 1.25 -1.44 1.92 4.15 -1.03 -1.40 115.11 118.47 1r1d h GLN 150 Ca 0.14 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1r1d h GLN 150 Cb 0.31 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 27.73 1r1d h GLN 150 CO -0.33 0.87 0.00 0.39 -1.93 0.00 0.00 178.83 177.83 1r1d n GLU 151 N -4.36 0.64 0.00 1.69 1.02 -0.11 -2.23 120.64 117.29 1r1d n GLU 151 Ca 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1r1d n GLU 151 Cb 0.06 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 1r1d n GLU 151 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1r1d n GLU 153 N 0.80 0.00 -0.06 3.49 -0.58 -0.53 -0.28 120.64 123.48 1r1d n GLU 153 Ca 0.00 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.62 1r1d n GLU 153 Cb 0.32 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.13 1r1d n GLU 153 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1r1d h ARG 154 N 0.00 0.36 -0.80 3.49 2.43 -1.71 -3.05 114.38 115.11 1r1d h ARG 154 Ca 0.00 -0.15 0.19 0.00 -0.81 0.00 0.00 59.98 59.20 1r1d h ARG 154 Cb 0.00 -0.01 -0.12 0.00 -0.42 0.00 0.00 29.97 29.41 1r1d h ARG 154 CO 0.00 0.66 0.20 0.35 -1.51 0.00 0.00 179.97 179.66 1r1d h PHE 155 N 0.06 0.30 0.00 2.20 3.57 -0.92 0.19 116.94 122.33 1r1d h PHE 155 Ca 0.04 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1r1d h PHE 155 Cb 0.54 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.27 1r1d h PHE 155 CO 0.06 -0.13 0.00 1.63 -2.23 0.00 0.00 178.31 177.64 1r1d n LYS 156 N -5.18 0.19 0.29 1.11 5.02 -1.15 -2.56 118.16 115.87 1r1d n LYS 156 Ca 0.17 0.44 0.18 0.00 -2.02 0.00 0.00 58.31 57.07 1r1d n LYS 156 Cb 0.54 -1.88 0.84 0.00 -0.02 0.00 0.00 35.03 34.52 1r1d n LYS 156 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1r1d h GLN 157 N 0.00 0.00 -4.44 1.97 4.20 -0.94 -3.38 115.11 112.52 1r1d h GLN 157 Ca 0.00 0.00 -0.70 0.00 0.06 0.00 0.00 58.65 58.01 1r1d h GLN 157 Cb 0.34 0.00 -0.34 0.00 0.30 0.00 0.00 27.48 27.79 1r1d h GLN 157 CO 0.00 0.03 -0.52 0.99 -0.67 0.00 0.00 178.83 178.66 1r1d s THR 158 N -3.89 3.46 0.00 -0.54 2.01 -1.06 -5.16 115.64 110.46 1r1d s THR 158 Ca -0.01 -2.02 0.00 0.00 0.31 0.00 0.00 61.69 59.96 1r1d s THR 158 Cb 0.11 -3.35 0.00 0.00 0.01 0.00 0.00 72.50 69.26 1r1d s THR 158 CO 0.51 -0.71 0.00 -2.65 -0.69 0.00 0.00 174.62 171.08 1r1d n PRO 159 N 4.63 0.00 0.00 4.92 -0.02 -1.26 -5.05 135.00 138.23 1r1d n PRO 159 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 1r1d n PRO 159 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.89 1r1d n PRO 159 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1r1d n LYS 161 N 0.00 0.00 -0.09 -0.52 5.02 -1.26 -4.96 118.16 116.35 1r1d n LYS 161 Ca 0.00 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.40 1r1d n LYS 161 Cb 0.00 0.00 0.34 0.00 -0.02 0.00 0.00 35.03 35.35 1r1d n LYS 161 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1r1d n THR 162 N 0.00 0.23 0.14 -0.18 -2.24 -1.26 -4.10 114.28 106.87 1r1d n THR 162 Ca 0.00 -0.43 -0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1r1d n THR 162 Cb 0.12 0.60 0.26 0.00 -2.10 0.00 0.00 70.33 69.20 1r1d n THR 162 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1r1d h LEU 163 N 2.89 0.10 -0.94 3.22 3.38 -1.94 -2.12 115.31 119.89 1r1d h LEU 163 Ca 0.00 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1r1d h LEU 163 Cb 0.63 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1r1d h LEU 163 CO 0.00 0.54 -0.12 0.11 0.09 0.00 0.00 178.44 179.06 1r1d h LYS 164 N 0.08 0.64 0.00 1.13 1.57 -2.00 -1.73 116.57 116.26 1r1d h LYS 164 Ca 0.00 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.50 1r1d h LYS 164 Cb 0.83 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 1r1d h LYS 164 CO 0.06 0.74 -0.40 0.00 -0.57 0.00 0.00 179.45 179.29 1r1d h ALA 165 N 1.29 1.13 -0.17 3.86 0.00 -1.74 -1.52 119.26 122.10 1r1d h ALA 165 Ca 0.10 -0.36 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 1r1d h ALA 165 Cb 0.54 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1r1d h ALA 165 CO 0.03 0.50 -0.62 1.25 0.00 0.00 0.00 179.25 180.41 1r1d h LEU 166 N 0.00 0.68 -0.78 0.00 5.85 -0.70 -0.95 115.31 119.41 1r1d h LEU 166 Ca -0.00 -0.39 -0.06 0.00 0.84 0.00 0.00 57.88 58.26 1r1d h LEU 166 Cb 0.81 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 1r1d h LEU 166 CO 0.05 1.14 0.22 1.56 -0.34 0.00 0.00 178.44 181.07 1r1d h GLN 167 N 0.45 1.13 -0.49 1.25 4.20 -0.96 -2.69 115.11 118.00 1r1d h GLN 167 Ca -0.01 -0.25 -0.05 0.00 0.06 0.00 0.00 58.65 58.41 1r1d h GLN 167 Cb 1.19 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.78 1r1d h GLN 167 CO 0.12 0.97 0.10 0.93 -0.67 0.00 0.00 178.83 180.27 1r1d h GLU 168 N 1.08 0.76 0.28 1.46 5.08 -0.89 -1.77 114.58 120.57 1r1d h GLU 168 Ca 0.23 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1r1d h GLU 168 Cb 0.32 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1r1d h GLU 168 CO -0.01 0.70 -0.13 1.25 -1.00 0.00 0.00 179.01 179.82 1r1d h LEU 169 N 0.73 -0.32 -0.38 1.33 5.85 -0.87 0.57 115.31 122.23 1r1d h LEU 169 Ca 0.16 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1r1d h LEU 169 Cb 0.30 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 1r1d h LEU 169 CO 0.00 -0.08 0.17 0.40 -0.34 0.00 0.00 178.44 178.59 1r1d h ILE 170 N -0.55 0.95 -0.67 4.05 1.08 -1.42 -0.86 117.51 120.09 1r1d h ILE 170 Ca -0.04 -0.12 -0.03 0.00 -0.39 0.00 0.00 64.86 64.28 1r1d h ILE 170 Cb 0.40 0.57 -0.03 0.00 -3.07 0.00 0.00 36.82 34.69 1r1d h ILE 170 CO 0.06 0.06 0.31 0.00 -0.69 0.00 0.00 178.15 177.89 1r1d h ALA 171 N 1.21 0.86 -0.22 1.87 0.00 -1.25 -0.17 119.26 121.56 1r1d h ALA 171 Ca 0.16 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1r1d h ALA 171 Cb 0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1r1d h ALA 171 CO -0.13 0.44 0.04 0.22 0.00 0.00 0.00 179.25 179.82 1r1d h ASP 172 N 0.93 0.35 -0.54 0.00 3.58 -0.44 -0.03 116.42 120.27 1r1d h ASP 172 Ca 0.23 -0.25 -0.05 0.00 0.42 0.00 0.00 57.03 57.37 1r1d h ASP 172 Cb 0.14 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 1r1d h ASP 172 CO -0.03 0.51 0.14 0.58 -2.88 0.00 0.00 179.24 177.57 1r1d h VAL 173 N 0.17 1.24 -0.92 2.25 2.07 -1.12 -1.83 116.25 118.12 1r1d h VAL 173 Ca 0.07 -0.85 0.03 0.00 0.82 0.00 0.00 66.70 66.77 1r1d h VAL 173 Cb 0.31 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 1r1d h VAL 173 CO 0.00 0.31 0.60 -0.09 0.02 0.00 0.00 177.57 178.41 1r1d h ARG 174 N 0.76 1.12 0.00 1.57 2.43 -0.78 -0.29 114.38 119.18 1r1d h ARG 174 Ca 0.17 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1r1d h ARG 174 Cb 0.33 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1r1d h ARG 174 CO 0.00 0.74 0.00 0.00 -1.51 0.00 0.00 179.97 179.20 1r1d h ALA 175 N 1.38 1.00 -0.24 2.80 0.00 -0.60 -3.17 119.26 120.42 1r1d h ALA 175 Ca 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1r1d h ALA 175 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1r1d h ALA 175 CO -0.12 0.00 -0.01 0.72 0.00 0.00 0.00 179.25 179.84 1r1d n HIS 176 N -2.99 0.85 0.25 0.00 8.25 -0.18 -4.62 115.22 116.78 1r1d n HIS 176 Ca 0.00 -0.98 0.09 0.00 -0.26 0.00 0.00 57.72 56.57 1r1d n HIS 176 Cb 0.27 -0.32 0.64 0.00 1.12 0.00 0.00 29.99 31.71 1r1d n HIS 176 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1r1d h LEU 177 N 1.48 0.00 0.00 2.41 3.38 -1.38 -0.60 115.31 120.60 1r1d h LEU 177 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1r1d h LEU 177 Cb 1.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.17 1r1d h LEU 177 CO 0.22 0.08 0.00 -0.90 0.09 0.00 0.00 178.44 177.93 1r1d n ASP 178 N -4.23 0.00 0.02 -0.43 5.75 -1.23 -1.51 116.55 114.92 1r1d n ASP 178 Ca -0.03 -0.28 0.12 0.00 -0.01 0.00 0.00 54.79 54.59 1r1d n ASP 178 Cb 0.16 -0.11 0.15 0.00 -1.03 0.00 0.00 41.12 40.29 1r1d n ASP 178 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1r1d n LEU 179 N -1.11 0.61 -4.69 -2.12 4.77 -0.23 -4.47 117.00 109.75 1r1d n LEU 179 Ca 0.10 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.66 1r1d n LEU 179 Cb 0.08 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 40.97 1r1d n LEU 179 CO 0.10 0.08 0.85 -0.69 -1.33 0.00 0.00 177.39 176.39 1r1d s VAL 180 N -3.08 4.59 0.00 4.08 1.01 -0.57 -4.71 120.40 121.72 1r1d s VAL 180 Ca 0.08 1.88 0.00 0.00 0.00 0.00 0.00 61.98 63.94 1r1d s VAL 180 Cb 0.16 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1r1d s VAL 180 CO 0.74 0.01 0.00 -1.22 0.00 0.00 0.00 175.10 174.63 1r1d n TYR 181 N 5.04 0.00 -2.01 5.22 4.01 -1.26 -1.10 117.16 127.06 1r1d n TYR 181 Ca 0.09 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.46 1r1d n TYR 181 Cb 0.48 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.53 1r1d n TYR 181 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r1d s ALA 182 N -1.43 2.77 0.07 -0.72 0.00 -1.26 -4.13 121.76 117.06 1r1d s ALA 182 Ca 0.00 1.10 -0.37 0.00 0.00 0.00 0.00 51.96 52.69 1r1d s ALA 182 Cb 0.00 -3.47 -0.16 0.00 0.00 0.00 0.00 23.12 19.49 1r1d s ALA 182 CO 0.00 -1.07 1.40 -2.30 0.00 0.00 0.00 175.76 173.79 1r1d n PRO 183 N -1.05 1.28 -4.48 0.00 -0.02 -1.26 -4.71 135.00 124.75 1r1d n PRO 183 Ca 0.11 0.46 -0.21 0.00 -2.02 0.00 0.00 63.50 61.84 1r1d n PRO 183 Cb 0.48 -2.13 -0.15 0.00 -0.02 0.00 0.00 33.50 31.68 1r1d n PRO 183 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1r1d s THR 184 N 0.77 0.90 -0.27 3.45 2.01 -0.63 0.20 115.64 122.08 1r1d s THR 184 Ca 0.85 -0.46 0.03 0.00 0.31 0.00 0.00 61.69 62.42 1r1d s THR 184 Cb -0.93 -0.77 0.06 0.00 0.01 0.00 0.00 72.50 70.88 1r1d s THR 184 CO 0.47 0.26 -0.10 0.12 -0.69 0.00 0.00 174.62 174.69 1r1d s PHE 185 N -0.06 3.28 -0.32 4.92 5.36 0.41 -0.57 117.98 131.00 1r1d s PHE 185 Ca 0.01 -2.31 -0.20 0.00 -0.96 0.00 0.00 56.93 53.47 1r1d s PHE 185 Cb -0.07 -1.97 -0.01 0.00 -0.34 0.00 0.00 43.02 40.63 1r1d s PHE 185 CO 0.00 -0.88 0.61 0.08 -1.46 0.00 0.00 175.22 173.57 1r1d s VAL 186 N 1.11 4.95 -0.12 3.12 1.01 0.57 -1.71 120.40 129.32 1r1d s VAL 186 Ca -0.08 0.74 -0.03 0.00 0.00 0.00 0.00 61.98 62.60 1r1d s VAL 186 Cb -0.20 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 1r1d s VAL 186 CO -0.05 -0.17 0.00 -0.69 0.00 0.00 0.00 175.10 174.20 1r1d s VAL 187 N 2.58 4.31 -0.19 2.92 1.01 0.12 -0.93 120.40 130.22 1r1d s VAL 187 Ca 0.24 -0.23 -0.15 0.00 0.00 0.00 0.00 61.98 61.84 1r1d s VAL 187 Cb -0.15 -2.86 0.05 0.00 0.00 0.00 0.00 36.38 33.43 1r1d s VAL 187 CO 0.12 0.55 0.49 -1.58 0.00 0.00 0.00 175.10 174.68 1r1d s GLN 188 N -0.32 0.54 -0.11 2.72 2.00 -0.80 -0.42 119.66 123.26 1r1d s GLN 188 Ca 0.07 0.77 -0.30 0.00 -2.00 0.00 0.00 55.36 53.90 1r1d s GLN 188 Cb -0.12 0.18 -0.02 0.00 0.80 0.00 0.00 33.01 33.85 1r1d s GLN 188 CO 0.02 -0.10 1.17 0.00 -0.50 0.00 0.00 175.29 175.88 1r1d s ALA 189 N 0.73 3.55 0.34 1.58 0.00 -1.26 -0.67 121.76 126.02 1r1d s ALA 189 Ca -0.04 0.49 0.03 0.00 0.00 0.00 0.00 51.96 52.44 1r1d s ALA 189 Cb -0.05 -3.53 0.63 0.00 0.00 0.00 0.00 23.12 20.16 1r1d s ALA 189 CO -0.05 -0.88 1.98 -0.09 0.00 0.00 0.00 175.76 176.72 1r1d h ARG 190 N 7.59 0.86 -1.78 0.00 9.65 -1.37 -3.04 114.38 126.30 1r1d h ARG 190 Ca -0.30 -0.05 -0.67 0.00 -1.10 0.00 0.00 59.98 57.86 1r1d h ARG 190 Cb 1.13 -0.19 -0.35 0.00 -1.39 0.00 0.00 29.97 29.16 1r1d h ARG 190 CO 0.91 0.57 0.06 0.72 2.80 0.00 0.00 179.97 185.03 1r1d n HIS 191 N -4.45 3.25 -1.94 2.20 8.25 -1.26 -4.87 115.22 116.39 1r1d n HIS 191 Ca 0.09 -2.82 -0.42 0.00 -0.26 0.00 0.00 57.72 54.31 1r1d n HIS 191 Cb 0.12 -0.59 -0.03 0.00 1.12 0.00 0.00 29.99 30.61 1r1d n HIS 191 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1r1d s ASP 192 N -2.47 6.60 -0.40 0.41 -1.08 -1.15 -4.74 116.67 113.83 1r1d s ASP 192 Ca 0.49 2.58 0.03 0.00 -0.52 0.00 0.00 52.55 55.13 1r1d s ASP 192 Cb 0.40 -2.59 0.56 0.00 -1.46 0.00 0.00 42.92 39.83 1r1d s ASP 192 CO -0.28 -0.83 1.80 -1.84 0.52 0.00 0.00 175.17 174.54 1r1d n GLU 193 N 4.34 2.09 -0.98 4.34 0.00 -1.26 -4.72 120.64 124.44 1r1d n GLU 193 Ca 0.14 -2.58 -0.38 0.00 0.00 0.00 0.00 57.16 54.35 1r1d n GLU 193 Cb 0.39 -2.01 0.04 0.00 0.00 0.00 0.00 31.44 29.86 1r1d n GLU 193 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 1r1d n ILE 195 N -0.88 0.00 -2.46 3.84 -5.35 -1.26 -5.09 119.36 108.17 1r1d n ILE 195 Ca 0.51 -0.12 -0.43 0.00 -0.27 0.00 0.00 62.75 62.44 1r1d n ILE 195 Cb 1.44 -0.04 -0.02 0.00 -1.74 0.00 0.00 39.64 39.28 1r1d n ILE 195 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1r1d s ASN 196 N -1.05 6.70 0.66 7.28 3.84 -1.26 -4.88 114.94 126.22 1r1d s ASN 196 Ca 0.38 1.13 0.43 0.00 0.21 0.00 0.00 52.86 55.01 1r1d s ASN 196 Cb 0.03 -2.54 2.35 0.00 -0.55 0.00 0.00 41.25 40.54 1r1d s ASN 196 CO 0.70 -1.07 2.32 1.55 -2.79 0.00 0.00 177.10 177.81 1r1d h PRO 197 N 9.15 0.00 0.00 0.43 0.13 -1.87 -0.77 132.00 139.06 1r1d h PRO 197 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1r1d h PRO 197 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1r1d h PRO 197 CO 1.04 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 175.34 1r1d n ASP 198 N -3.04 0.61 -0.27 1.44 2.03 -1.26 -1.56 116.55 114.51 1r1d n ASP 198 Ca -0.03 0.74 0.17 0.00 0.52 0.00 0.00 54.79 56.19 1r1d n ASP 198 Cb 0.09 -0.84 0.45 0.00 -0.72 0.00 0.00 41.12 40.11 1r1d n ASP 198 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1r1d h SER 199 N 0.00 0.52 -0.59 1.67 0.02 -1.45 -0.47 113.55 113.25 1r1d h SER 199 Ca 0.00 0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 1r1d h SER 199 Cb 0.11 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 1r1d h SER 199 CO 0.00 0.21 0.24 0.00 -1.14 0.00 0.00 176.83 176.14 1r1d h ALA 200 N 1.61 1.26 -0.22 3.77 0.00 -1.52 -2.09 119.26 122.06 1r1d h ALA 200 Ca 0.49 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 1r1d h ALA 200 Cb 1.05 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1r1d h ALA 200 CO -0.22 0.55 -0.37 -0.91 0.00 0.00 0.00 179.25 178.29 1r1d h ASN 201 N 0.90 0.52 -0.28 0.00 2.35 -1.27 -1.41 115.58 116.38 1r1d h ASN 201 Ca 0.21 -0.22 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1r1d h ASN 201 Cb 0.18 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1r1d h ASN 201 CO -0.02 0.84 0.02 0.40 -1.65 0.00 0.00 177.43 177.02 1r1d h ILE 202 N 0.41 1.25 0.39 2.81 2.04 -1.27 -0.32 117.51 122.82 1r1d h ILE 202 Ca 0.04 -0.87 -0.02 0.00 1.00 0.00 0.00 64.86 65.01 1r1d h ILE 202 Cb 0.84 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1r1d h ILE 202 CO 0.07 0.28 -0.19 0.40 0.00 0.00 0.00 178.15 178.71 1r1d h ILE 203 N 0.28 0.62 -0.61 -0.67 2.04 -1.32 -1.01 117.51 116.85 1r1d h ILE 203 Ca 0.08 -0.23 0.06 0.00 1.00 0.00 0.00 64.86 65.77 1r1d h ILE 203 Cb 0.39 0.74 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 1r1d h ILE 203 CO 0.01 0.05 0.31 0.22 0.00 0.00 0.00 178.15 178.73 1r1d h TYR 204 N -0.65 0.56 0.01 1.37 3.20 -1.25 -2.49 116.97 117.73 1r1d h TYR 204 Ca -0.05 0.02 -0.20 0.00 3.14 0.00 0.00 58.73 61.64 1r1d h TYR 204 Cb 0.47 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 1r1d h TYR 204 CO -0.02 0.25 -0.95 -0.91 -1.64 0.00 0.00 178.16 174.89 1r1d h ASN 205 N 0.57 0.09 0.99 -2.11 2.35 -1.03 -3.37 115.58 113.07 1r1d h ASN 205 Ca 0.28 -0.09 -0.07 0.00 -0.55 0.00 0.00 56.30 55.88 1r1d h ASN 205 Cb 0.22 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1r1d h ASN 205 CO -0.20 0.98 -1.06 -0.33 -1.65 0.00 0.00 177.43 175.17 1r1d h GLU 206 N 0.03 0.00 -7.28 0.81 4.39 -1.06 -3.47 114.58 107.99 1r1d h GLU 206 Ca -0.03 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 59.16 1r1d h GLU 206 Cb 1.64 0.00 0.13 0.00 -0.10 0.00 0.00 28.75 30.42 1r1d h GLU 206 CO 0.13 0.13 0.32 0.96 -1.16 0.00 0.00 179.01 179.40 1r1d s ILE 207 N -3.17 3.15 -1.61 3.13 -4.36 -0.95 -3.47 121.20 113.92 1r1d s ILE 207 Ca -0.01 0.41 0.23 0.00 -0.26 0.00 0.00 60.65 61.02 1r1d s ILE 207 Cb 0.09 -2.86 -0.05 0.00 1.25 0.00 0.00 42.46 40.89 1r1d s ILE 207 CO 0.79 -0.46 1.09 -0.62 0.24 0.00 0.00 174.94 175.98 1r1d n GLU 208 N -3.36 0.70 -1.71 0.37 -0.58 -0.26 -4.92 120.64 110.88 1r1d n GLU 208 Ca 0.10 -0.56 -0.63 0.00 -0.42 0.00 0.00 57.16 55.64 1r1d n GLU 208 Cb 0.53 -1.49 -0.09 0.00 -0.57 0.00 0.00 31.44 29.82 1r1d n GLU 208 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1r1d n SER 209 N -0.66 1.46 0.23 1.62 7.64 -0.84 -4.85 113.62 118.22 1r1d n SER 209 Ca 0.08 1.15 0.07 0.00 1.01 0.00 0.00 58.87 61.18 1r1d n SER 209 Cb 0.40 -0.98 0.55 0.00 -1.01 0.00 0.00 64.21 63.18 1r1d n SER 209 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1r1d h PRO 210 N 5.45 0.00 -4.56 1.43 0.11 -1.91 -3.35 132.00 129.17 1r1d h PRO 210 Ca -0.46 0.00 -0.70 0.00 0.11 0.00 0.00 66.00 64.96 1r1d h PRO 210 Cb 1.36 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 32.16 1r1d h PRO 210 CO 0.93 0.19 -0.56 0.08 -0.21 0.00 0.00 178.00 178.43 1r1d s VAL 211 N -4.46 3.58 -0.00 3.15 1.01 -1.26 -5.06 120.40 117.35 1r1d s VAL 211 Ca -0.03 -1.59 0.00 0.00 0.00 0.00 0.00 61.98 60.36 1r1d s VAL 211 Cb 0.15 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.30 1r1d s VAL 211 CO 0.67 -0.44 -0.01 -1.59 0.00 0.00 0.00 175.10 173.72 1r1d s LYS 212 N 1.29 0.10 0.07 2.72 -2.85 -1.26 -1.61 119.74 118.20 1r1d s LYS 212 Ca 0.02 -0.03 0.02 0.00 -1.00 0.00 0.00 55.97 54.99 1r1d s LYS 212 Cb -0.22 -0.12 -0.03 0.00 -2.06 0.00 0.00 37.83 35.40 1r1d s LYS 212 CO -0.01 0.01 -0.07 -0.65 0.10 0.00 0.00 175.35 174.73 1r1d s GLN 213 N 0.06 0.66 -0.02 1.78 -1.52 0.27 -4.98 119.66 115.91 1r1d s GLN 213 Ca -0.00 -1.02 -0.01 0.00 -1.95 0.00 0.00 55.36 52.37 1r1d s GLN 213 Cb -0.02 -0.23 0.01 0.00 -0.22 0.00 0.00 33.01 32.55 1r1d s GLN 213 CO -0.00 0.01 0.05 -1.50 -0.25 0.00 0.00 175.29 173.60 1r1d s ILE 214 N -2.44 -0.01 -0.01 1.08 2.07 -1.26 -0.31 121.20 120.31 1r1d s ILE 214 Ca 0.00 0.04 0.00 0.00 -1.41 0.00 0.00 60.65 59.29 1r1d s ILE 214 Cb -0.03 -0.08 0.01 0.00 0.13 0.00 0.00 42.46 42.49 1r1d s ILE 214 CO -0.02 0.02 -0.00 -0.75 -1.91 0.00 0.00 174.94 172.27 1r1d s LYS 215 N 0.24 0.14 -0.12 3.50 2.20 -0.10 -4.94 119.74 120.66 1r1d s LYS 215 Ca -0.02 0.03 -0.06 0.00 -0.36 0.00 0.00 55.97 55.57 1r1d s LYS 215 Cb -0.03 -0.25 -0.04 0.00 -1.51 0.00 0.00 37.83 36.00 1r1d s LYS 215 CO -0.01 -0.06 0.09 -1.58 -0.36 0.00 0.00 175.35 173.44 1r1d s TRP 216 N 0.50 3.42 -0.25 4.03 0.52 -1.26 -1.91 118.94 123.99 1r1d s TRP 216 Ca -0.04 0.37 -0.04 0.00 0.02 0.00 0.00 56.10 56.41 1r1d s TRP 216 Cb -0.07 -1.92 0.00 0.00 -1.15 0.00 0.00 33.47 30.33 1r1d s TRP 216 CO -0.01 0.57 -0.01 0.71 0.02 0.00 0.00 176.95 178.23 1r1d s TYR 217 N -0.76 3.05 -0.53 -1.98 2.02 0.16 -4.92 117.35 114.39 1r1d s TYR 217 Ca 0.13 -1.09 0.25 0.00 -0.37 0.00 0.00 57.07 55.99 1r1d s TYR 217 Cb -0.12 -2.14 0.67 0.00 -0.40 0.00 0.00 41.96 39.98 1r1d s TYR 217 CO 0.03 -0.60 1.72 0.93 -1.57 0.00 0.00 175.55 176.06 1r1d h GLU 218 N 8.12 0.00 0.00 -0.62 4.39 -1.96 -0.59 114.58 123.93 1r1d h GLU 218 Ca -0.36 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.24 1r1d h GLU 218 Cb 1.14 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.77 1r1d h GLU 218 CO 0.59 0.00 -1.78 1.04 -1.16 0.00 0.00 179.01 177.71 1r1d n GLN 219 N -2.67 0.99 -1.40 2.33 1.13 -1.26 -4.77 117.38 111.73 1r1d n GLN 219 Ca 0.04 -0.08 -0.31 0.00 -1.94 0.00 0.00 57.00 54.71 1r1d n GLN 219 Cb 0.45 -1.35 0.07 0.00 0.11 0.00 0.00 30.24 29.52 1r1d n GLN 219 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1r1d s SER 220 N -4.09 4.88 0.21 1.08 0.15 -1.26 -4.91 113.70 109.76 1r1d s SER 220 Ca -0.06 1.71 0.03 0.00 0.70 0.00 0.00 55.95 58.33 1r1d s SER 220 Cb 0.07 -2.49 0.03 0.00 -1.71 0.00 0.00 66.02 61.92 1r1d s SER 220 CO 0.59 -1.78 0.23 0.61 1.20 0.00 0.00 173.24 174.10 1r1d n GLY 221 N -1.58 2.35 0.30 9.45 0.00 -1.26 -4.49 105.19 109.96 1r1d n GLY 221 Ca 0.08 -2.19 -0.08 0.00 0.00 0.00 0.00 46.02 43.84 1r1d n GLY 221 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1r1d h HIS 222 N 0.25 -0.73 0.00 1.61 2.76 -1.93 -3.16 115.15 113.95 1r1d h HIS 222 Ca -0.11 0.05 -0.70 0.00 -2.20 0.00 0.00 60.37 57.41 1r1d h HIS 222 Cb 0.46 0.37 -0.03 0.00 1.55 0.00 0.00 27.41 29.76 1r1d h HIS 222 CO 0.00 -0.34 3.19 0.28 -1.30 0.00 0.00 177.93 179.76 1r1d n VAL 223 N -5.40 3.49 0.05 5.26 0.31 -1.26 -4.76 118.33 116.02 1r1d n VAL 223 Ca 0.00 -2.88 0.20 0.00 -0.01 0.00 0.00 64.34 61.65 1r1d n VAL 223 Cb 0.31 -2.60 0.72 0.00 -0.91 0.00 0.00 33.84 31.37 1r1d n VAL 223 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 1r1d h ILE 224 N 3.89 0.62 0.00 2.52 2.10 -1.96 -1.05 117.51 123.62 1r1d h ILE 224 Ca 0.60 0.00 -0.02 0.00 1.08 0.00 0.00 64.86 66.52 1r1d h ILE 224 Cb 0.59 0.73 -0.00 0.00 -1.09 0.00 0.00 36.82 37.05 1r1d h ILE 224 CO 1.88 0.00 -0.09 0.71 -1.08 0.00 0.00 178.15 179.57 1r1d h THR 225 N 0.00 0.32 -0.14 2.19 1.35 -1.86 -3.03 112.91 111.74 1r1d h THR 225 Ca 0.22 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1r1d h THR 225 Cb 0.95 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 1r1d h THR 225 CO -0.00 0.09 0.00 0.18 -0.25 0.00 0.00 175.52 175.54 1r1d n LEU 226 N -3.35 2.29 0.00 3.87 4.77 -0.41 -4.79 117.00 119.38 1r1d n LEU 226 Ca -0.01 -1.41 -0.23 0.00 -0.03 0.00 0.00 56.01 54.34 1r1d n LEU 226 Cb 0.28 -0.09 0.11 0.00 -2.33 0.00 0.00 43.42 41.39 1r1d n LEU 226 CO 0.29 0.51 0.54 -0.67 -1.33 0.00 0.00 177.39 176.72 1r1d n ASP 227 N 0.55 1.49 0.05 -1.43 -0.08 -1.14 -4.98 116.55 111.00 1r1d n ASP 227 Ca 0.08 -2.22 0.04 0.00 -1.51 0.00 0.00 54.79 51.18 1r1d n ASP 227 Cb 0.33 -0.63 0.19 0.00 2.34 0.00 0.00 41.12 43.35 1r1d n ASP 227 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1r1d n GLN 228 N -2.79 0.04 -0.40 -0.67 10.64 -1.26 -2.32 117.38 120.63 1r1d n GLN 228 Ca 0.17 0.54 0.08 0.00 -1.83 0.00 0.00 57.00 55.96 1r1d n GLN 228 Cb 0.60 -1.65 0.24 0.00 -0.86 0.00 0.00 30.24 28.58 1r1d n GLN 228 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1r1d n GLU 229 N -1.74 3.09 -0.08 2.61 1.02 -1.26 -4.68 120.64 119.61 1r1d n GLU 229 Ca -0.00 -2.61 0.12 0.00 -0.02 0.00 0.00 57.16 54.64 1r1d n GLU 229 Cb 0.01 -1.69 0.50 0.00 -0.02 0.00 0.00 31.44 30.25 1r1d n GLU 229 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1r1d h LYS 230 N 2.22 0.39 -0.49 3.49 2.10 -1.64 -0.92 116.57 121.72 1r1d h LYS 230 Ca 0.00 -0.02 -0.11 0.00 -2.00 0.00 0.00 60.65 58.51 1r1d h LYS 230 Cb 1.24 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 32.47 1r1d h LYS 230 CO 0.17 0.26 -0.13 -0.44 -2.00 0.00 0.00 179.45 177.30 1r1d h ASP 231 N 0.40 0.96 -0.45 7.07 3.32 -1.87 0.78 116.42 126.64 1r1d h ASP 231 Ca 0.27 -0.37 -0.09 0.00 0.02 0.00 0.00 57.03 56.86 1r1d h ASP 231 Cb 0.54 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1r1d h ASP 231 CO -0.07 1.11 -0.07 -0.61 -1.72 0.00 0.00 179.24 177.87 1r1d h GLN 232 N 0.80 0.84 -0.20 3.56 5.75 -1.71 -1.89 115.11 122.27 1r1d h GLN 232 Ca 0.12 -0.31 0.05 0.00 -0.15 0.00 0.00 58.65 58.36 1r1d h GLN 232 Cb 0.69 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.14 1r1d h GLN 232 CO 0.05 0.93 -0.10 1.25 -2.65 0.00 0.00 178.83 178.31 1r1d h LEU 233 N 0.68 -0.34 -0.38 -2.39 5.85 -0.91 0.87 115.31 118.69 1r1d h LEU 233 Ca 0.12 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.98 1r1d h LEU 233 Cb 0.60 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.77 1r1d h LEU 233 CO 0.04 -0.14 0.07 0.45 -0.34 0.00 0.00 178.44 178.52 1r1d h HIS 234 N -0.08 0.11 -0.65 1.25 3.86 -0.67 0.10 115.15 119.07 1r1d h HIS 234 Ca 0.11 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1r1d h HIS 234 Cb 0.25 0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.69 1r1d h HIS 234 CO -0.26 0.01 0.39 0.93 0.86 0.00 0.00 177.93 179.86 1r1d h GLU 235 N 0.19 0.88 -0.46 2.45 4.39 -0.66 -0.80 114.58 120.58 1r1d h GLU 235 Ca 0.18 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.75 1r1d h GLU 235 Cb 0.21 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1r1d h GLU 235 CO -0.24 0.63 0.11 -0.44 -1.16 0.00 0.00 179.01 177.91 1r1d h ASP 236 N 0.88 0.70 -0.55 1.42 3.32 -0.19 0.06 116.42 122.05 1r1d h ASP 236 Ca 0.23 -0.24 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1r1d h ASP 236 Cb -0.02 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1r1d h ASP 236 CO -0.04 0.75 0.01 0.40 -1.72 0.00 0.00 179.24 178.64 1r1d h ILE 237 N 0.61 1.26 0.01 0.35 2.04 -0.85 -0.49 117.51 120.45 1r1d h ILE 237 Ca 0.14 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1r1d h ILE 237 Cb 0.33 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1r1d h ILE 237 CO 0.00 0.40 -0.03 0.22 0.00 0.00 0.00 178.15 178.74 1r1d h TYR 238 N 0.85 -0.07 -0.97 1.37 3.20 -0.93 0.62 116.97 121.04 1r1d h TYR 238 Ca 0.16 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.06 1r1d h TYR 238 Cb 0.53 0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.77 1r1d h TYR 238 CO 0.04 -0.05 0.64 0.00 -1.64 0.00 0.00 178.16 177.15 1r1d h ALA 239 N 0.93 1.28 -0.09 1.82 0.00 -0.82 0.02 119.26 122.39 1r1d h ALA 239 Ca 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1r1d h ALA 239 Cb 0.07 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1r1d h ALA 239 CO -0.02 0.53 0.04 0.35 0.00 0.00 0.00 179.25 180.14 1r1d h PHE 240 N 1.24 0.14 -0.67 0.00 3.57 -0.63 -2.32 116.94 118.27 1r1d h PHE 240 Ca 0.38 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.90 1r1d h PHE 240 Cb -0.02 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 1r1d h PHE 240 CO -0.01 0.26 0.42 -0.07 -2.23 0.00 0.00 178.31 176.68 1r1d h LEU 241 N -0.01 0.70 -2.39 0.59 3.38 -0.37 -1.94 115.31 115.26 1r1d h LEU 241 Ca 0.03 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1r1d h LEU 241 Cb 0.17 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1r1d h LEU 241 CO -0.00 0.49 -0.03 -0.33 0.09 0.00 0.00 178.44 178.65 1r1d h GLU 242 N 0.83 0.00 -0.00 1.13 4.39 -0.86 -2.06 114.58 118.02 1r1d h GLU 242 Ca 0.27 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.97 1r1d h GLU 242 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1r1d h GLU 242 CO -0.10 0.03 -0.04 -1.13 -1.16 0.00 0.00 179.01 176.62 1r1d n SER 243 N -3.63 0.11 -4.88 1.42 3.41 -0.73 -4.87 113.62 104.45 1r1d n SER 243 Ca -0.03 -0.18 -0.30 0.00 -0.26 0.00 0.00 58.87 58.11 1r1d n SER 243 Cb 0.13 -0.25 -0.01 0.00 -0.26 0.00 0.00 64.21 63.82 1r1d n SER 243 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1r1d s LEU 244 N -2.60 3.49 0.05 1.04 1.43 -0.78 -5.01 118.68 116.30 1r1d s LEU 244 Ca 0.27 1.27 -0.23 0.00 -1.03 0.00 0.00 54.13 54.41 1r1d s LEU 244 Cb 0.20 -4.25 -0.15 0.00 0.03 0.00 0.00 46.19 42.02 1r1d s LEU 244 CO 0.48 -0.68 1.52 0.44 0.23 0.00 0.00 176.35 178.34 1r1d h ASP 245 N 0.25 0.13 0.00 2.29 3.32 -1.89 -3.51 116.42 117.00 1r1d h ASP 245 Ca -0.46 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.34 1r1d h ASP 245 Cb 1.19 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1r1d h ASP 245 CO 0.62 0.35 0.00 0.79 -1.72 0.00 0.00 179.24 179.28