#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jyl s ARG 5 N 0.00 3.34 -0.19 0.38 1.70 -1.26 -5.08 118.95 117.83 1jyl s ARG 5 Ca 0.00 -0.23 -0.21 0.00 -0.47 0.00 0.00 55.73 54.82 1jyl s ARG 5 Cb 0.00 -3.07 -0.02 0.00 -0.57 0.00 0.00 34.95 31.29 1jyl s ARG 5 CO 0.00 0.72 0.65 0.08 -1.08 0.00 0.00 175.30 175.67 1jyl s VAL 6 N -0.88 5.01 0.34 4.99 1.01 -1.26 -4.89 120.40 124.72 1jyl s VAL 6 Ca 0.14 1.23 0.09 0.00 0.00 0.00 0.00 61.98 63.43 1jyl s VAL 6 Cb -0.12 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 1jyl s VAL 6 CO 0.03 0.11 0.02 -1.59 0.00 0.00 0.00 175.10 173.67 1jyl s LYS 7 N 1.90 2.11 -0.07 2.72 -2.85 -1.19 -4.51 119.74 117.85 1jyl s LYS 7 Ca 0.30 -1.72 0.03 0.00 -1.00 0.00 0.00 55.97 53.58 1jyl s LYS 7 Cb -0.16 -1.96 0.00 0.00 -2.06 0.00 0.00 37.83 33.66 1jyl s LYS 7 CO 0.11 0.15 -0.18 0.00 0.10 0.00 0.00 175.35 175.53 1jyl s ALA 8 N -2.50 1.64 -0.22 0.59 0.00 -0.31 -0.53 121.76 120.43 1jyl s ALA 8 Ca 0.35 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.58 1jyl s ALA 8 Cb -0.01 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 1jyl s ALA 8 CO 0.20 0.22 -0.01 0.42 0.00 0.00 0.00 175.76 176.59 1jyl s ILE 9 N 0.37 3.70 -0.22 0.00 1.01 0.17 0.02 121.20 126.24 1jyl s ILE 9 Ca -0.13 -0.38 -0.04 0.00 0.00 0.00 0.00 60.65 60.10 1jyl s ILE 9 Cb -0.15 -2.69 -0.00 0.00 0.01 0.00 0.00 42.46 39.62 1jyl s ILE 9 CO 0.05 0.40 -0.04 -0.63 0.00 0.00 0.00 174.94 174.72 1jyl s ILE 10 N 1.42 3.33 -0.46 2.92 1.01 0.97 -0.48 121.20 129.90 1jyl s ILE 10 Ca 0.05 -0.54 -0.28 0.00 0.00 0.00 0.00 60.65 59.88 1jyl s ILE 10 Cb -0.15 -2.53 0.03 0.00 0.01 0.00 0.00 42.46 39.82 1jyl s ILE 10 CO -0.01 0.40 1.07 -0.76 0.00 0.00 0.00 174.94 175.65 1jyl s LEU 11 N 1.47 3.76 -0.00 2.97 1.43 0.12 -1.21 118.68 127.22 1jyl s LEU 11 Ca 0.05 0.42 0.22 0.00 -1.03 0.00 0.00 54.13 53.80 1jyl s LEU 11 Cb -0.14 -3.45 0.37 0.00 0.03 0.00 0.00 46.19 43.00 1jyl s LEU 11 CO -0.03 -1.17 1.15 0.00 0.23 0.00 0.00 176.35 176.53 1jyl n ALA 12 N 7.58 2.34 0.04 4.21 0.00 -0.76 -1.21 120.51 132.71 1jyl n ALA 12 Ca 0.10 -2.19 -0.04 0.00 0.00 0.00 0.00 53.44 51.31 1jyl n ALA 12 Cb 0.49 -0.70 -0.09 0.00 0.00 0.00 0.00 19.45 19.14 1jyl n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jyl h ALA 13 N 0.87 0.63 -2.19 0.00 0.00 -1.77 -3.40 119.26 113.40 1jyl h ALA 13 Ca -0.19 -1.01 -0.54 0.00 0.00 0.00 0.00 54.91 53.16 1jyl h ALA 13 Cb 1.81 0.20 0.21 0.00 0.00 0.00 0.00 17.79 20.02 1jyl h ALA 13 CO 0.08 1.17 -0.76 0.41 0.00 0.00 0.00 179.25 180.16 1jyl n GLY 14 N 1.41 -2.37 0.15 0.00 0.00 -1.26 -1.89 105.19 101.24 1jyl n GLY 14 Ca -0.08 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.16 1jyl n GLY 14 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1jyl h LEU 15 N -1.25 0.37 -1.89 0.99 3.38 -1.95 -3.41 115.31 111.54 1jyl h LEU 15 Ca -0.44 -0.27 -0.27 0.00 0.09 0.00 0.00 57.88 57.00 1jyl h LEU 15 Cb 1.30 -0.11 0.15 0.00 0.09 0.00 0.00 40.66 42.09 1jyl h LEU 15 CO 0.34 1.03 -0.68 0.61 0.09 0.00 0.00 178.44 179.83 1jyl n GLY 16 N 0.71 -0.39 0.16 0.83 0.00 -1.26 -4.74 105.19 100.50 1jyl n GLY 16 Ca -0.04 0.12 0.02 0.00 0.00 0.00 0.00 46.02 46.12 1jyl n GLY 16 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1jyl h THR 17 N -1.47 1.22 0.00 2.61 1.35 -1.93 -2.99 112.91 111.69 1jyl h THR 17 Ca -0.51 -1.85 0.00 0.00 -0.55 0.00 0.00 66.41 63.50 1jyl h THR 17 Cb 1.29 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 1jyl h THR 17 CO 0.42 0.50 0.00 -1.14 -0.25 0.00 0.00 175.52 175.05 1jyl n ARG 18 N -3.71 0.03 -0.06 4.72 0.63 -1.26 -2.25 116.66 114.76 1jyl n ARG 18 Ca -0.01 0.31 0.07 0.00 -0.92 0.00 0.00 57.85 57.30 1jyl n ARG 18 Cb 0.56 -1.50 0.10 0.00 0.45 0.00 0.00 32.46 32.07 1jyl n ARG 18 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1jyl n LEU 19 N -1.46 2.47 -4.58 6.15 0.00 -1.13 -3.94 117.00 114.51 1jyl n LEU 19 Ca 0.03 -1.27 -0.33 0.00 0.00 0.00 0.00 56.01 54.44 1jyl n LEU 19 Cb 0.10 -0.08 0.12 0.00 0.00 0.00 0.00 43.42 43.56 1jyl n LEU 19 CO 0.08 0.51 0.41 0.54 0.00 0.00 0.00 177.39 178.94 1jyl n ARG 20 N 0.81 -0.00 0.00 1.96 3.00 -0.95 -2.03 116.66 119.44 1jyl n ARG 20 Ca 0.10 0.07 0.13 0.00 -0.01 0.00 0.00 57.85 58.14 1jyl n ARG 20 Cb 0.39 -2.17 0.61 0.00 0.00 0.00 0.00 32.46 31.29 1jyl n ARG 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1jyl n PRO 21 N -2.56 0.09 -0.23 5.56 -0.04 -1.26 -4.80 135.00 131.77 1jyl n PRO 21 Ca 0.11 0.03 0.21 0.00 -0.04 0.00 0.00 63.50 63.81 1jyl n PRO 21 Cb 0.51 -1.50 0.55 0.00 -0.04 0.00 0.00 33.50 33.02 1jyl n PRO 21 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1jyl h LEU 22 N 0.00 0.33 -3.59 1.53 -0.00 -1.82 0.84 115.31 112.60 1jyl h LEU 22 Ca 0.00 0.04 -0.25 0.00 -0.00 0.00 0.00 57.88 57.66 1jyl h LEU 22 Cb 0.42 -0.03 -0.15 0.00 -0.00 0.00 0.00 40.66 40.90 1jyl h LEU 22 CO 0.00 0.13 0.20 0.35 -0.00 0.00 0.00 178.44 179.12 1jyl n THR 23 N -4.47 2.78 -0.07 0.22 -2.24 -1.21 -4.44 114.28 104.84 1jyl n THR 23 Ca 0.19 -2.18 -0.13 0.00 -2.27 0.00 0.00 64.05 59.67 1jyl n THR 23 Cb 0.74 -0.36 -0.06 0.00 -2.10 0.00 0.00 70.33 68.55 1jyl n THR 23 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1jyl h GLU 24 N 1.46 0.45 -0.30 -0.78 4.57 -1.15 -3.34 114.58 115.49 1jyl h GLU 24 Ca 0.31 -0.22 -0.24 0.00 -1.18 0.00 0.00 59.36 58.04 1jyl h GLU 24 Cb 2.10 -0.00 -0.25 0.00 -0.16 0.00 0.00 28.75 30.43 1jyl h GLU 24 CO 0.63 0.77 -0.77 0.09 -1.18 0.00 0.00 179.01 178.55 1jyl n ASN 25 N -4.51 2.62 -3.67 1.04 3.02 -1.26 -5.00 115.26 107.50 1jyl n ASN 25 Ca -0.05 -3.30 -0.08 0.00 -0.03 0.00 0.00 54.58 51.12 1jyl n ASN 25 Cb 0.36 -0.43 -0.09 0.00 -0.61 0.00 0.00 39.78 39.02 1jyl n ASN 25 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1jyl s THR 26 N -3.24 -0.42 0.98 3.41 2.01 -1.25 -5.15 115.64 111.98 1jyl s THR 26 Ca 0.40 0.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.38 1jyl s THR 26 Cb 0.38 -0.75 0.18 0.00 0.01 0.00 0.00 72.50 72.32 1jyl s THR 26 CO -0.05 0.04 1.08 -2.84 -0.69 0.00 0.00 174.62 172.17 1jyl s PRO 27 N 2.15 0.56 0.11 4.92 0.02 -1.26 -4.35 135.00 137.15 1jyl s PRO 27 Ca -0.06 0.95 -0.19 0.00 0.02 0.00 0.00 61.00 61.72 1jyl s PRO 27 Cb -0.10 -1.72 -0.07 0.00 0.02 0.00 0.00 34.50 32.64 1jyl s PRO 27 CO -0.15 -2.75 1.70 -0.22 -0.33 0.00 0.00 177.00 175.25 1jyl h LYS 28 N -1.93 0.32 -0.81 5.54 3.64 -1.86 -2.93 116.57 118.55 1jyl h LYS 28 Ca -0.52 -0.04 0.19 0.00 -1.27 0.00 0.00 60.65 59.01 1jyl h LYS 28 Cb 1.30 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 33.00 1jyl h LYS 28 CO 0.51 0.30 0.55 0.00 -2.27 0.00 0.00 179.45 178.54 1jyl h ALA 29 N 1.00 2.33 -0.65 5.00 0.00 -1.88 -0.35 119.26 124.70 1jyl h ALA 29 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1jyl h ALA 29 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1jyl h ALA 29 CO -0.01 -0.57 0.00 1.28 0.00 0.00 0.00 179.25 179.95 1jyl n LEU 30 N -4.44 4.14 -4.77 0.00 4.77 -1.12 -0.39 117.00 115.18 1jyl n LEU 30 Ca 0.16 -2.08 -0.38 0.00 -0.03 0.00 0.00 56.01 53.68 1jyl n LEU 30 Cb 0.68 -0.52 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1jyl n LEU 30 CO 0.33 0.84 0.79 -0.69 -1.33 0.00 0.00 177.39 177.34 1jyl s VAL 31 N -1.47 3.45 -0.03 4.08 1.01 -0.14 -4.61 120.40 122.68 1jyl s VAL 31 Ca 0.47 1.24 0.02 0.00 0.00 0.00 0.00 61.98 63.71 1jyl s VAL 31 Cb 0.28 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 1jyl s VAL 31 CO 0.27 0.13 -0.07 -1.10 0.00 0.00 0.00 175.10 174.33 1jyl s GLN 32 N -2.15 2.65 -0.03 2.72 -0.21 -1.26 -1.14 119.66 120.23 1jyl s GLN 32 Ca 0.54 -0.63 0.04 0.00 0.02 0.00 0.00 55.36 55.32 1jyl s GLN 32 Cb -0.28 -2.54 -0.00 0.00 1.00 0.00 0.00 33.01 31.19 1jyl s GLN 32 CO 0.35 0.63 -0.14 0.54 -2.12 0.00 0.00 175.29 174.56 1jyl s VAL 33 N -0.90 1.15 -1.18 1.09 0.11 -0.60 -4.71 120.40 115.37 1jyl s VAL 33 Ca 0.15 -0.57 -0.05 0.00 -2.93 0.00 0.00 61.98 58.58 1jyl s VAL 33 Cb -0.11 -0.99 -0.02 0.00 -1.53 0.00 0.00 36.38 33.72 1jyl s VAL 33 CO 0.04 0.34 0.86 0.59 -3.33 0.00 0.00 175.10 173.61 1jyl n ASN 34 N 3.13 -3.62 -4.17 3.54 5.03 -1.26 -2.48 115.26 115.44 1jyl n ASN 34 Ca -0.18 -0.76 -0.29 0.00 0.87 0.00 0.00 54.58 54.23 1jyl n ASN 34 Cb 0.54 -4.62 -0.09 0.00 -1.02 0.00 0.00 39.78 34.58 1jyl n ASN 34 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1jyl n GLN 35 N -3.90 -0.93 -3.63 3.52 1.13 -1.26 -4.94 117.38 107.36 1jyl n GLN 35 Ca -0.20 0.09 -0.11 0.00 -1.94 0.00 0.00 57.00 54.83 1jyl n GLN 35 Cb 0.65 -3.34 -0.07 0.00 0.11 0.00 0.00 30.24 27.58 1jyl n GLN 35 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1jyl s LYS 36 N -6.99 0.78 0.27 -1.09 2.20 -1.03 -5.09 119.74 108.78 1jyl s LYS 36 Ca 0.05 1.05 -0.31 0.00 -0.36 0.00 0.00 55.97 56.41 1jyl s LYS 36 Cb -0.03 0.31 -0.12 0.00 -1.51 0.00 0.00 37.83 36.48 1jyl s LYS 36 CO 0.92 -0.11 1.55 -2.30 -0.36 0.00 0.00 175.35 175.05 1jyl n PRO 37 N 3.21 2.51 -0.23 4.03 -0.02 -1.26 -1.56 135.00 141.69 1jyl n PRO 37 Ca -0.16 0.89 0.03 0.00 -2.02 0.00 0.00 63.50 62.25 1jyl n PRO 37 Cb 0.56 -2.65 0.14 0.00 -0.02 0.00 0.00 33.50 31.54 1jyl n PRO 37 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1jyl h LEU 38 N 4.82 -0.10 -1.81 2.45 5.85 -0.88 -0.32 115.31 125.32 1jyl h LEU 38 Ca -0.46 0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 1jyl h LEU 38 Cb 1.24 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.49 1jyl h LEU 38 CO 0.80 -0.06 -0.15 -0.29 -0.34 0.00 0.00 178.44 178.40 1jyl h ILE 39 N 0.21 0.66 -0.28 4.05 2.10 -0.97 -3.04 117.51 120.24 1jyl h ILE 39 Ca 0.37 -0.61 -0.04 0.00 1.08 0.00 0.00 64.86 65.66 1jyl h ILE 39 Cb 0.61 1.38 -0.01 0.00 -1.09 0.00 0.00 36.82 37.71 1jyl h ILE 39 CO -0.51 0.14 0.03 -0.33 -1.08 0.00 0.00 178.15 176.41 1jyl h GLU 40 N 0.00 0.47 -0.73 2.19 5.08 -1.33 -1.72 114.58 118.54 1jyl h GLU 40 Ca -0.00 -0.13 0.12 0.00 -1.00 0.00 0.00 59.36 58.35 1jyl h GLU 40 Cb 0.37 -0.05 -0.09 0.00 0.50 0.00 0.00 28.75 29.48 1jyl h GLU 40 CO 0.02 0.59 0.31 1.88 -1.00 0.00 0.00 179.01 180.81 1jyl h TYR 41 N 0.27 0.54 0.00 4.33 -1.99 -1.53 0.92 116.97 119.52 1jyl h TYR 41 Ca 0.08 0.03 -0.13 0.00 2.00 0.00 0.00 58.73 60.71 1jyl h TYR 41 Cb 0.36 -0.13 -0.02 0.00 2.00 0.00 0.00 36.73 38.94 1jyl h TYR 41 CO 0.03 0.11 -0.64 1.96 -0.00 0.00 0.00 178.16 179.62 1jyl h GLN 42 N 0.49 0.00 -0.06 4.88 4.20 -1.60 -1.40 115.11 121.63 1jyl h GLN 42 Ca 0.39 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 59.02 1jyl h GLN 42 Cb 0.53 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1jyl h GLN 42 CO -0.36 0.64 -0.28 0.82 -0.67 0.00 0.00 178.83 178.99 1jyl h ILE 43 N 0.00 1.44 -0.27 2.54 2.04 -0.32 -1.44 117.51 121.51 1jyl h ILE 43 Ca -0.01 -1.71 -0.08 0.00 1.00 0.00 0.00 64.86 64.07 1jyl h ILE 43 Cb 1.23 2.37 -0.01 0.00 -0.74 0.00 0.00 36.82 39.66 1jyl h ILE 43 CO 0.08 0.48 -0.16 -0.33 0.00 0.00 0.00 178.15 178.22 1jyl h GLU 44 N -0.23 0.47 -0.09 2.37 5.08 -0.88 -0.25 114.58 121.05 1jyl h GLU 44 Ca -0.02 -0.15 -0.13 0.00 -1.00 0.00 0.00 59.36 58.06 1jyl h GLU 44 Cb 0.93 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 1jyl h GLU 44 CO 0.06 0.63 -0.52 0.74 -1.00 0.00 0.00 179.01 178.91 1jyl h PHE 45 N 0.43 0.32 -0.05 4.33 0.05 -1.23 -1.15 116.94 119.64 1jyl h PHE 45 Ca 0.08 -0.11 -0.22 0.00 3.82 0.00 0.00 57.97 61.54 1jyl h PHE 45 Cb 0.54 -0.06 0.00 0.00 2.00 0.00 0.00 35.95 38.43 1jyl h PHE 45 CO 0.02 0.73 -0.86 -0.07 -0.18 0.00 0.00 178.31 177.95 1jyl h LEU 46 N 0.20 0.64 0.03 1.54 3.38 -0.60 -3.07 115.31 117.42 1jyl h LEU 46 Ca 0.01 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 1jyl h LEU 46 Cb 0.99 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1jyl h LEU 46 CO 0.08 1.24 -0.01 0.11 0.09 0.00 0.00 178.44 179.95 1jyl h LYS 47 N 0.32 -0.04 -0.03 1.13 1.57 -1.01 0.28 116.57 118.79 1jyl h LYS 47 Ca -0.07 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1jyl h LYS 47 Cb 1.48 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.79 1jyl h LYS 47 CO 0.16 0.51 0.33 1.05 -0.57 0.00 0.00 179.45 180.93 1jyl h GLU 48 N -0.62 0.00 -0.48 3.15 4.11 -1.29 1.15 114.58 120.61 1jyl h GLU 48 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.40 1jyl h GLU 48 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1jyl h GLU 48 CO 0.01 0.00 0.02 1.63 0.07 0.00 0.00 179.01 180.74 1jyl n LYS 49 N -2.97 4.07 -1.76 1.06 4.76 -1.13 -4.95 118.16 117.24 1jyl n LYS 49 Ca -0.01 -3.05 -0.10 0.00 -2.87 0.00 0.00 58.31 52.27 1jyl n LYS 49 Cb 0.39 -2.11 -0.02 0.00 -1.84 0.00 0.00 35.03 31.44 1jyl n LYS 49 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1jyl n GLY 50 N 0.13 0.54 3.10 0.72 0.00 0.40 -4.44 105.19 105.64 1jyl n GLY 50 Ca 0.27 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 1jyl n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jyl s ILE 51 N -2.45 3.50 -1.28 -0.61 1.01 0.96 -4.88 121.20 117.45 1jyl s ILE 51 Ca 0.00 -2.62 0.14 0.00 0.00 0.00 0.00 60.65 58.17 1jyl s ILE 51 Cb 0.00 -3.33 -0.00 0.00 0.01 0.00 0.00 42.46 39.13 1jyl s ILE 51 CO 0.00 -0.80 0.78 0.59 0.00 0.00 0.00 174.94 175.51 1jyl n ASN 52 N 3.91 1.49 -4.16 3.58 3.02 -1.26 -3.19 115.26 118.65 1jyl n ASN 52 Ca 0.04 -1.25 -0.43 0.00 -0.03 0.00 0.00 54.58 52.91 1jyl n ASN 52 Cb 0.39 0.45 0.00 0.00 -0.61 0.00 0.00 39.78 40.02 1jyl n ASN 52 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1jyl n ASP 53 N -0.14 4.63 -4.33 6.41 -0.08 -1.26 -4.86 116.55 116.92 1jyl n ASP 53 Ca 0.06 -2.93 -0.39 0.00 -1.51 0.00 0.00 54.79 50.02 1jyl n ASP 53 Cb 0.29 -1.65 -0.12 0.00 2.34 0.00 0.00 41.12 41.98 1jyl n ASP 53 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1jyl s ILE 54 N 2.91 4.12 -0.26 5.18 1.01 -1.26 -1.17 121.20 131.74 1jyl s ILE 54 Ca 0.48 -0.90 -0.10 0.00 0.00 0.00 0.00 60.65 60.12 1jyl s ILE 54 Cb 0.07 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.23 1jyl s ILE 54 CO -0.00 -0.12 0.17 -0.63 0.00 0.00 0.00 174.94 174.35 1jyl s ILE 55 N 1.49 5.27 -0.26 2.92 1.01 0.10 -0.90 121.20 130.83 1jyl s ILE 55 Ca 0.01 0.15 -0.06 0.00 0.00 0.00 0.00 60.65 60.75 1jyl s ILE 55 Cb -0.19 -3.48 -0.01 0.00 0.01 0.00 0.00 42.46 38.80 1jyl s ILE 55 CO 0.04 0.31 0.03 -0.63 0.00 0.00 0.00 174.94 174.69 1jyl s ILE 56 N 1.36 3.82 -0.24 2.92 1.01 -0.26 -0.02 121.20 129.79 1jyl s ILE 56 Ca 0.07 -0.51 -0.24 0.00 0.00 0.00 0.00 60.65 59.96 1jyl s ILE 56 Cb -0.15 -2.86 -0.01 0.00 0.01 0.00 0.00 42.46 39.46 1jyl s ILE 56 CO 0.07 0.26 0.82 -0.63 0.00 0.00 0.00 174.94 175.46 1jyl s ILE 57 N 1.51 4.85 0.43 2.92 -1.09 -0.35 -0.86 121.20 128.61 1jyl s ILE 57 Ca 0.04 1.55 0.06 0.00 -2.23 0.00 0.00 60.65 60.08 1jyl s ILE 57 Cb -0.16 -4.11 -0.05 0.00 -1.58 0.00 0.00 42.46 36.56 1jyl s ILE 57 CO 0.01 -0.06 0.10 0.68 -1.23 0.00 0.00 174.94 174.43 1jyl s VAL 58 N 2.79 1.97 0.00 2.92 -7.23 0.14 -1.84 120.40 119.16 1jyl s VAL 58 Ca 0.35 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 1jyl s VAL 58 Cb -0.15 -2.83 0.00 0.00 0.56 0.00 0.00 36.38 33.96 1jyl s VAL 58 CO 0.08 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.48 1jyl n GLY 59 N -1.16 -1.73 3.57 2.32 0.00 -1.26 -1.24 105.19 105.70 1jyl n GLY 59 Ca -0.05 0.73 -0.53 0.00 0.00 0.00 0.00 46.02 46.17 1jyl n GLY 59 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1jyl n TYR 60 N 0.00 1.88 -2.54 1.61 4.19 -0.79 -0.61 117.16 120.90 1jyl n TYR 60 Ca 0.00 0.33 -0.19 0.00 3.31 0.00 0.00 57.90 61.35 1jyl n TYR 60 Cb 0.00 -2.52 0.00 0.00 0.49 0.00 0.00 39.34 37.31 1jyl n TYR 60 CO 0.00 0.00 0.00 1.28 0.91 0.00 0.00 176.86 179.05 1jyl n LEU 61 N 7.65 -2.09 -0.37 2.98 4.77 -1.26 -4.67 117.00 124.02 1jyl n LEU 61 Ca 0.33 -0.09 0.33 0.00 -0.03 0.00 0.00 56.01 56.55 1jyl n LEU 61 Cb 0.20 -2.72 0.67 0.00 -2.33 0.00 0.00 43.42 39.23 1jyl n LEU 61 CO 0.78 -0.07 1.29 0.07 -1.33 0.00 0.00 177.39 178.13 1jyl h LYS 62 N -0.39 0.13 -0.16 3.23 2.10 -1.25 -1.22 116.57 119.02 1jyl h LYS 62 Ca -0.46 -0.01 0.05 0.00 -2.00 0.00 0.00 60.65 58.23 1jyl h LYS 62 Cb 1.33 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 32.63 1jyl h LYS 62 CO 0.53 0.09 0.19 1.05 -2.00 0.00 0.00 179.45 179.30 1jyl h GLU 63 N 0.14 0.00 0.00 0.07 9.09 -1.90 -0.89 114.58 121.08 1jyl h GLU 63 Ca 0.64 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.05 1jyl h GLU 63 Cb 2.19 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 29.29 1jyl h GLU 63 CO -0.16 0.00 0.00 1.04 0.05 0.00 0.00 179.01 179.94 1jyl n GLN 64 N -3.75 0.49 -0.05 1.06 6.02 -0.46 -3.16 117.38 117.53 1jyl n GLN 64 Ca 0.01 0.04 -0.01 0.00 -0.01 0.00 0.00 57.00 57.03 1jyl n GLN 64 Cb 0.31 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 29.91 1jyl n GLN 64 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1jyl n PHE 65 N -1.18 0.13 -0.32 1.08 3.72 -0.34 -4.59 117.46 115.97 1jyl n PHE 65 Ca 0.14 0.04 0.30 0.00 -0.05 0.00 0.00 57.45 57.88 1jyl n PHE 65 Cb 0.15 -0.83 0.56 0.00 -0.94 0.00 0.00 39.48 38.41 1jyl n PHE 65 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1jyl n ASP 66 N -2.59 0.31 0.17 4.37 8.00 -1.19 -0.73 116.55 124.90 1jyl n ASP 66 Ca -0.19 1.63 0.12 0.00 0.71 0.00 0.00 54.79 57.06 1jyl n ASP 66 Cb 0.90 -0.78 0.63 0.00 -0.02 0.00 0.00 41.12 41.85 1jyl n ASP 66 CO 0.00 0.00 0.00 0.10 -0.39 0.00 0.00 177.20 176.91 1jyl h TYR 67 N 0.00 0.00 0.00 1.24 -0.00 -1.83 -2.46 116.97 113.93 1jyl h TYR 67 Ca 0.82 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 59.51 1jyl h TYR 67 Cb 2.13 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 38.86 1jyl h TYR 67 CO -0.05 0.00 -0.16 -0.07 -0.00 0.00 0.00 178.16 177.89 1jyl h LEU 68 N 0.00 0.00 0.05 0.10 3.38 -1.27 -2.01 115.31 115.56 1jyl h LEU 68 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1jyl h LEU 68 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1jyl h LEU 68 CO 0.00 0.16 -0.02 0.11 0.09 0.00 0.00 178.44 178.77 1jyl h LYS 69 N 0.00 -0.06 -0.26 1.13 1.57 -1.61 0.08 116.57 117.42 1jyl h LYS 69 Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1jyl h LYS 69 Cb 0.99 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.31 1jyl h LYS 69 CO 0.02 0.18 -0.00 1.49 -0.57 0.00 0.00 179.45 180.57 1jyl h GLU 70 N -0.30 0.46 -0.20 3.15 4.57 -1.69 0.79 114.58 121.36 1jyl h GLU 70 Ca -0.01 -0.15 -0.12 0.00 -1.18 0.00 0.00 59.36 57.91 1jyl h GLU 70 Cb 0.27 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1jyl h GLU 70 CO 0.01 0.63 -0.32 -0.22 -1.18 0.00 0.00 179.01 177.92 1jyl h LYS 71 N 0.23 0.57 -0.00 1.92 3.64 -1.35 -3.38 116.57 118.21 1jyl h LYS 71 Ca 0.07 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1jyl h LYS 71 Cb 0.43 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1jyl h LYS 71 CO 0.01 0.96 -0.00 0.66 -2.27 0.00 0.00 179.45 178.81 1jyl n TYR 72 N -4.31 0.00 -2.79 1.91 4.02 -0.02 -5.02 117.16 110.95 1jyl n TYR 72 Ca -0.06 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.76 1jyl n TYR 72 Cb 0.49 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.84 1jyl n TYR 72 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1jyl n GLY 73 N 0.88 0.38 3.89 2.72 0.00 0.27 -5.01 105.19 108.32 1jyl n GLY 73 Ca 0.00 -0.34 -0.31 0.00 0.00 0.00 0.00 46.02 45.37 1jyl n GLY 73 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1jyl s VAL 74 N -3.11 5.01 -0.34 1.61 -7.23 -1.20 -4.74 120.40 110.38 1jyl s VAL 74 Ca 0.16 0.27 -0.13 0.00 -1.81 0.00 0.00 61.98 60.46 1jyl s VAL 74 Cb -0.07 -3.65 -0.02 0.00 0.56 0.00 0.00 36.38 33.21 1jyl s VAL 74 CO 0.25 -0.12 0.25 -0.60 -0.31 0.00 0.00 175.10 174.57 1jyl s ARG 75 N -2.98 3.48 0.21 4.82 3.52 -0.08 -4.36 118.95 123.55 1jyl s ARG 75 Ca 0.45 -0.64 -0.17 0.00 -0.13 0.00 0.00 55.73 55.24 1jyl s ARG 75 Cb -0.11 -3.81 -0.08 0.00 -1.56 0.00 0.00 34.95 29.39 1jyl s ARG 75 CO 0.24 -0.46 0.66 -0.51 -0.81 0.00 0.00 175.30 174.43 1jyl s LEU 76 N 1.74 4.30 -0.03 -0.88 1.43 -1.26 -1.10 118.68 122.89 1jyl s LEU 76 Ca 0.06 1.28 0.00 0.00 -1.03 0.00 0.00 54.13 54.45 1jyl s LEU 76 Cb -0.17 -3.55 0.02 0.00 0.03 0.00 0.00 46.19 42.52 1jyl s LEU 76 CO 0.11 0.02 -0.00 -0.69 0.23 0.00 0.00 176.35 176.02 1jyl s VAL 77 N -1.57 0.18 -0.21 -1.59 1.01 -0.04 -4.91 120.40 113.26 1jyl s VAL 77 Ca 0.43 0.07 -0.18 0.00 0.00 0.00 0.00 61.98 62.29 1jyl s VAL 77 Cb -0.15 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 1jyl s VAL 77 CO 0.20 0.14 0.51 0.12 0.00 0.00 0.00 175.10 176.06 1jyl s PHE 78 N 0.91 3.35 -0.43 5.22 2.19 -1.26 0.25 117.98 128.21 1jyl s PHE 78 Ca -0.09 0.73 -0.13 0.00 0.33 0.00 0.00 56.93 57.77 1jyl s PHE 78 Cb -0.13 -2.67 0.05 0.00 -1.31 0.00 0.00 43.02 38.97 1jyl s PHE 78 CO -0.02 -0.13 0.31 1.21 1.83 0.00 0.00 175.22 178.43 1jyl s ASN 79 N 1.21 5.95 0.34 6.13 3.84 -0.37 -4.95 114.94 127.10 1jyl s ASN 79 Ca 0.23 -1.21 0.16 0.00 0.21 0.00 0.00 52.86 52.24 1jyl s ASN 79 Cb -0.15 -2.10 0.58 0.00 -0.55 0.00 0.00 41.25 39.02 1jyl s ASN 79 CO 0.09 -0.53 1.70 -2.24 -2.79 0.00 0.00 177.10 173.33 1jyl h ASP 80 N 8.59 0.00 -0.63 -4.21 2.03 -1.96 -3.13 116.42 117.11 1jyl h ASP 80 Ca -0.26 0.00 -0.40 0.00 -0.73 0.00 0.00 57.03 55.64 1jyl h ASP 80 Cb 1.10 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 39.44 1jyl h ASP 80 CO 0.78 0.45 0.49 0.29 -1.03 0.00 0.00 179.24 180.22 1jyl n LYS 81 N -3.66 2.01 0.22 4.15 4.76 -1.26 -4.57 118.16 119.81 1jyl n LYS 81 Ca -0.01 -1.92 0.15 0.00 -2.87 0.00 0.00 58.31 53.66 1jyl n LYS 81 Cb 0.53 -1.77 0.49 0.00 -1.84 0.00 0.00 35.03 32.44 1jyl n LYS 81 CO 0.00 0.00 0.00 0.10 -1.37 0.00 0.00 177.40 176.13 1jyl h TYR 82 N 1.72 0.00 0.00 2.13 -0.00 -1.85 -2.53 116.97 116.45 1jyl h TYR 82 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.08 1jyl h TYR 82 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.60 1jyl h TYR 82 CO 0.97 0.00 -1.14 0.00 -0.00 0.00 0.00 178.16 177.99 1jyl n ALA 83 N -2.00 2.99 -0.04 0.10 0.00 -1.26 -4.60 120.51 115.69 1jyl n ALA 83 Ca 0.02 -0.33 -0.15 0.00 0.00 0.00 0.00 53.44 52.99 1jyl n ALA 83 Cb 0.36 -0.45 -0.13 0.00 0.00 0.00 0.00 19.45 19.24 1jyl n ALA 83 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1jyl h ASP 84 N 0.00 0.10 -0.32 0.00 5.19 -1.85 -3.48 116.42 116.06 1jyl h ASP 84 Ca 0.00 -0.92 -0.65 0.00 -0.62 0.00 0.00 57.03 54.84 1jyl h ASP 84 Cb 0.46 -0.03 -0.10 0.00 0.18 0.00 0.00 39.33 39.84 1jyl h ASP 84 CO 0.00 1.01 -0.42 -0.31 -3.12 0.00 0.00 179.24 176.40 1jyl s TYR 85 N -2.54 1.68 0.44 4.55 2.02 -0.96 -4.90 117.35 117.65 1jyl s TYR 85 Ca -0.18 -0.94 0.01 0.00 -0.37 0.00 0.00 57.07 55.60 1jyl s TYR 85 Cb -0.02 -1.72 -0.00 0.00 -0.40 0.00 0.00 41.96 39.82 1jyl s TYR 85 CO 0.72 -0.10 0.66 1.21 -1.57 0.00 0.00 175.55 176.47 1jyl s ASN 86 N -4.07 5.82 0.00 2.29 2.47 0.18 -4.78 114.94 116.85 1jyl s ASN 86 Ca 0.15 0.23 0.00 0.00 0.42 0.00 0.00 52.86 53.66 1jyl s ASN 86 Cb -0.01 -1.48 0.00 0.00 -1.45 0.00 0.00 41.25 38.32 1jyl s ASN 86 CO 0.09 -0.70 0.24 -0.46 -3.72 0.00 0.00 177.10 172.56 1jyl n ASN 87 N -2.05 0.00 0.13 -4.21 0.23 -1.26 -2.22 115.26 105.88 1jyl n ASN 87 Ca 0.02 0.00 -0.13 0.00 -0.53 0.00 0.00 54.58 53.93 1jyl n ASN 87 Cb 0.58 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.21 1jyl n ASN 87 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 1jyl h PHE 88 N 0.00 -0.29 -0.95 -2.53 3.04 -1.65 -2.62 116.94 111.94 1jyl h PHE 88 Ca 0.00 -0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.00 1jyl h PHE 88 Cb 0.00 0.10 -0.06 0.00 2.56 0.00 0.00 35.95 38.55 1jyl h PHE 88 CO 0.00 -0.18 0.61 -0.92 -2.02 0.00 0.00 178.31 175.81 1jyl h TYR 89 N -0.28 1.14 -0.68 0.41 3.20 -1.69 -0.81 116.97 118.25 1jyl h TYR 89 Ca -0.01 0.03 0.11 0.00 3.14 0.00 0.00 58.73 61.99 1jyl h TYR 89 Cb 0.24 -0.38 -0.08 0.00 1.54 0.00 0.00 36.73 38.05 1jyl h TYR 89 CO -0.09 0.62 0.29 0.77 -1.64 0.00 0.00 178.16 178.11 1jyl h SER 90 N 1.14 0.32 1.08 -2.11 0.02 -1.65 -0.20 113.55 112.16 1jyl h SER 90 Ca 0.40 0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 61.32 1jyl h SER 90 Cb 0.09 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 1jyl h SER 90 CO -0.15 0.17 -0.49 0.25 -1.14 0.00 0.00 176.83 175.47 1jyl h LEU 91 N 0.49 0.00 -0.88 5.07 5.85 -1.14 -3.15 115.31 121.54 1jyl h LEU 91 Ca 0.35 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.07 1jyl h LEU 91 Cb 0.44 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 1jyl h LEU 91 CO -0.32 0.49 0.53 0.22 -0.34 0.00 0.00 178.44 179.02 1jyl h TYR 92 N 0.00 1.16 -0.89 1.25 3.20 0.39 -1.32 116.97 120.76 1jyl h TYR 92 Ca -0.00 -0.00 0.21 0.00 3.14 0.00 0.00 58.73 62.07 1jyl h TYR 92 Cb 1.16 -0.38 -0.06 0.00 1.54 0.00 0.00 36.73 38.99 1jyl h TYR 92 CO 0.00 0.77 0.60 -0.07 -1.64 0.00 0.00 178.16 177.82 1jyl h LEU 93 N 1.21 0.34 -3.12 2.82 3.38 -1.31 -0.81 115.31 117.82 1jyl h LEU 93 Ca 0.31 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.24 1jyl h LEU 93 Cb -0.05 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 40.58 1jyl h LEU 93 CO -0.06 0.13 -0.60 1.33 0.09 0.00 0.00 178.44 179.33 1jyl n VAL 94 N -4.48 2.01 0.06 1.22 0.24 -1.02 -4.85 118.33 111.50 1jyl n VAL 94 Ca 0.19 -3.12 0.03 0.00 -2.04 0.00 0.00 64.34 59.39 1jyl n VAL 94 Cb 0.74 -0.19 0.15 0.00 -1.47 0.00 0.00 33.84 33.06 1jyl n VAL 94 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1jyl n LYS 95 N -0.90 0.04 0.00 7.34 2.85 -0.31 -1.58 118.16 125.59 1jyl n LYS 95 Ca 0.20 0.44 0.08 0.00 -1.05 0.00 0.00 58.31 57.98 1jyl n LYS 95 Cb 0.77 -1.78 0.02 0.00 -0.65 0.00 0.00 35.03 33.40 1jyl n LYS 95 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1jyl n GLU 96 N -1.62 1.56 -0.08 -1.58 4.71 -1.26 -4.18 120.64 118.18 1jyl n GLU 96 Ca -0.00 -1.05 0.12 0.00 -0.01 0.00 0.00 57.16 56.21 1jyl n GLU 96 Cb 0.17 -1.28 0.31 0.00 -1.01 0.00 0.00 31.44 29.63 1jyl n GLU 96 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1jyl n GLU 97 N 0.26 2.02 -0.06 3.49 -0.58 -0.62 -4.48 120.64 120.69 1jyl n GLU 97 Ca 0.08 -1.52 -0.10 0.00 -0.42 0.00 0.00 57.16 55.20 1jyl n GLU 97 Cb 0.36 -1.45 -0.03 0.00 -0.57 0.00 0.00 31.44 29.75 1jyl n GLU 97 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1jyl h LEU 98 N 3.24 0.26 -9.18 -4.62 5.85 -1.73 -3.42 115.31 105.72 1jyl h LEU 98 Ca 0.00 -0.02 -0.70 0.00 0.84 0.00 0.00 57.88 58.00 1jyl h LEU 98 Cb 0.70 -0.07 0.07 0.00 0.37 0.00 0.00 40.66 41.74 1jyl h LEU 98 CO 0.00 0.20 0.14 0.00 -0.34 0.00 0.00 178.44 178.44 1jyl n ALA 99 N -2.16 -1.97 -4.12 1.25 0.00 -1.26 -1.75 120.51 110.50 1jyl n ALA 99 Ca -0.03 0.51 -0.28 0.00 0.00 0.00 0.00 53.44 53.64 1jyl n ALA 99 Cb 0.03 -1.90 -0.06 0.00 0.00 0.00 0.00 19.45 17.53 1jyl n ALA 99 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jyl n ASN 100 N 1.96 0.13 -4.01 0.00 4.13 0.39 -4.81 115.26 113.05 1jyl n ASN 100 Ca 0.18 -1.12 -0.09 0.00 1.68 0.00 0.00 54.58 55.22 1jyl n ASN 100 Cb 0.18 -2.42 -0.11 0.00 -1.54 0.00 0.00 39.78 35.90 1jyl n ASN 100 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1jyl s SER 101 N -4.34 0.34 0.03 6.41 1.04 -0.72 -3.15 113.70 113.31 1jyl s SER 101 Ca 0.03 -0.62 -0.22 0.00 0.48 0.00 0.00 55.95 55.62 1jyl s SER 101 Cb -0.02 0.12 -0.06 0.00 0.10 0.00 0.00 66.02 66.16 1jyl s SER 101 CO 0.94 -0.36 0.66 -0.31 0.98 0.00 0.00 173.24 175.15 1jyl s TYR 102 N -2.02 3.72 -0.17 5.02 2.02 0.31 -2.01 117.35 124.24 1jyl s TYR 102 Ca -0.10 1.32 -0.04 0.00 -0.37 0.00 0.00 57.07 57.88 1jyl s TYR 102 Cb -0.06 -2.68 -0.02 0.00 -0.40 0.00 0.00 41.96 38.79 1jyl s TYR 102 CO -0.03 0.35 -0.04 0.08 -1.57 0.00 0.00 175.55 174.34 1jyl s VAL 103 N -0.26 3.80 -0.04 0.71 1.01 -0.64 0.43 120.40 125.41 1jyl s VAL 103 Ca 0.34 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.95 1jyl s VAL 103 Cb -0.19 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.52 1jyl s VAL 103 CO 0.20 0.48 -0.08 -0.63 0.00 0.00 0.00 175.10 175.07 1jyl s ILE 104 N 0.55 0.73 -0.49 2.22 1.01 0.37 -1.97 121.20 123.62 1jyl s ILE 104 Ca -0.03 -0.30 -0.27 0.00 0.00 0.00 0.00 60.65 60.05 1jyl s ILE 104 Cb -0.14 -0.68 0.03 0.00 0.01 0.00 0.00 42.46 41.67 1jyl s ILE 104 CO 0.03 0.25 1.04 -1.81 0.00 0.00 0.00 174.94 174.45 1jyl s ASP 105 N 0.46 6.53 0.61 3.58 1.01 -0.60 0.16 116.67 128.42 1jyl s ASP 105 Ca -0.07 0.22 0.28 0.00 0.71 0.00 0.00 52.55 53.69 1jyl s ASP 105 Cb -0.11 -2.50 1.47 0.00 1.01 0.00 0.00 42.92 42.79 1jyl s ASP 105 CO 0.01 -1.20 1.88 0.00 0.21 0.00 0.00 175.17 176.07 1jyl h ALA 106 N 9.22 2.02 0.00 5.23 0.00 -1.49 -3.13 119.26 131.10 1jyl h ALA 106 Ca -0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1jyl h ALA 106 Cb 1.07 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1jyl h ALA 106 CO 1.09 -0.66 0.00 -0.40 0.00 0.00 0.00 179.25 179.28 1jyl n ASP 107 N -3.52 5.02 -4.16 0.00 3.85 -1.26 -4.57 116.55 111.91 1jyl n ASP 107 Ca 0.06 -2.33 -0.23 0.00 -0.71 0.00 0.00 54.79 51.58 1jyl n ASP 107 Cb 0.63 -1.06 -0.15 0.00 -1.35 0.00 0.00 41.12 39.20 1jyl n ASP 107 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.20 176.39 1jyl s ASN 108 N 1.96 1.90 -0.24 -1.12 0.01 -1.19 -2.27 114.94 114.00 1jyl s ASN 108 Ca 0.00 -0.37 -0.10 0.00 -0.71 0.00 0.00 52.86 51.69 1jyl s ASN 108 Cb 0.00 -0.18 -0.05 0.00 0.41 0.00 0.00 41.25 41.43 1jyl s ASN 108 CO 0.00 0.15 0.15 -0.47 -1.51 0.00 0.00 177.10 175.41 1jyl s TYR 109 N -0.56 3.28 -0.28 2.20 6.14 0.38 -4.85 117.35 123.65 1jyl s TYR 109 Ca 0.05 0.14 -0.10 0.00 0.64 0.00 0.00 57.07 57.80 1jyl s TYR 109 Cb -0.07 -2.26 -0.04 0.00 0.42 0.00 0.00 41.96 40.01 1jyl s TYR 109 CO 0.00 0.01 0.16 -0.51 0.64 0.00 0.00 175.55 175.86 1jyl s LEU 110 N 1.12 3.92 0.18 6.97 1.43 -1.26 0.02 118.68 131.06 1jyl s LEU 110 Ca 0.07 -0.13 -0.00 0.00 -1.03 0.00 0.00 54.13 53.04 1jyl s LEU 110 Cb -0.14 -2.06 0.05 0.00 0.03 0.00 0.00 46.19 44.07 1jyl s LEU 110 CO 0.05 -0.07 1.42 -0.26 0.23 0.00 0.00 176.35 177.72 1jyl h PHE 111 N 8.35 0.48 -3.84 0.29 0.04 0.59 -3.46 116.94 119.39 1jyl h PHE 111 Ca -0.35 -0.22 -0.14 0.00 2.80 0.00 0.00 57.97 60.05 1jyl h PHE 111 Cb 1.18 -0.07 -0.19 0.00 2.20 0.00 0.00 35.95 39.07 1jyl h PHE 111 CO 0.72 0.99 -0.58 -1.59 -0.60 0.00 0.00 178.31 177.24 1jyl s LYS 112 N -3.52 0.49 -0.82 1.51 -2.85 -1.25 -5.01 119.74 108.30 1jyl s LYS 112 Ca -0.05 -0.69 -0.24 0.00 -1.00 0.00 0.00 55.97 53.99 1jyl s LYS 112 Cb 0.10 0.19 0.05 0.00 -2.06 0.00 0.00 37.83 36.11 1jyl s LYS 112 CO 0.84 -0.11 1.27 1.21 0.10 0.00 0.00 175.35 178.65 1jyl s ASN 113 N -1.87 6.30 -0.07 0.03 3.84 -1.26 -4.84 114.94 117.06 1jyl s ASN 113 Ca -0.09 -0.95 0.13 0.00 0.21 0.00 0.00 52.86 52.16 1jyl s ASN 113 Cb -0.04 -2.53 0.51 0.00 -0.55 0.00 0.00 41.25 38.64 1jyl s ASN 113 CO -0.03 -1.62 1.37 1.15 -2.79 0.00 0.00 177.10 175.18 1jyl n MET 114 N 8.75 2.87 -2.83 0.43 0.00 -1.26 -4.95 117.12 120.13 1jyl n MET 114 Ca 0.12 -2.00 -0.35 0.00 0.00 0.00 0.00 57.70 55.48 1jyl n MET 114 Cb 0.49 -1.69 -0.07 0.00 0.00 0.00 0.00 33.22 31.96 1jyl n MET 114 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1jyl s PHE 115 N -1.72 3.51 -0.17 3.17 0.08 -1.26 -5.07 117.98 116.52 1jyl s PHE 115 Ca 0.36 1.66 -0.09 0.00 0.12 0.00 0.00 56.93 58.98 1jyl s PHE 115 Cb 0.23 -2.86 0.06 0.00 -0.57 0.00 0.00 43.02 39.88 1jyl s PHE 115 CO 0.18 0.07 0.40 1.03 -0.10 0.00 0.00 175.22 176.80 1jyl s ARG 116 N -2.58 0.37 0.00 0.44 0.52 -1.26 -4.98 118.95 111.46 1jyl s ARG 116 Ca 0.55 0.81 0.22 0.00 -0.52 0.00 0.00 55.73 56.79 1jyl s ARG 116 Cb -0.14 0.01 1.16 0.00 0.52 0.00 0.00 34.95 36.51 1jyl s ARG 116 CO 0.19 -0.17 1.77 0.27 0.02 0.00 0.00 175.30 177.38 1jyl n ASN 117 N 4.42 0.52 -0.15 0.23 0.23 -1.26 -3.14 115.26 116.11 1jyl n ASN 117 Ca -0.21 -1.42 0.12 0.00 -0.53 0.00 0.00 54.58 52.54 1jyl n ASN 117 Cb 0.54 -0.02 0.24 0.00 -2.08 0.00 0.00 39.78 38.45 1jyl n ASN 117 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1jyl n ASP 118 N -0.48 0.91 -4.37 0.53 5.68 -1.26 -4.82 116.55 112.73 1jyl n ASP 118 Ca 0.17 -0.71 -0.49 0.00 -0.50 0.00 0.00 54.79 53.26 1jyl n ASP 118 Cb 0.16 0.31 -0.03 0.00 -1.14 0.00 0.00 41.12 40.41 1jyl n ASP 118 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1jyl n LEU 119 N -1.02 -1.13 0.00 -2.12 7.99 -1.19 -4.88 117.00 114.65 1jyl n LEU 119 Ca 0.08 1.12 0.00 0.00 -0.01 0.00 0.00 56.01 57.21 1jyl n LEU 119 Cb 0.35 -0.94 0.00 0.00 -0.11 0.00 0.00 43.42 42.72 1jyl n LEU 119 CO 0.32 -2.87 0.04 0.35 -1.51 0.00 0.00 177.39 173.72 1jyl n THR 120 N 0.13 0.00 -3.77 -5.08 -2.24 -1.26 -5.08 114.28 96.98 1jyl n THR 120 Ca 0.18 -0.50 -0.10 0.00 -2.27 0.00 0.00 64.05 61.36 1jyl n THR 120 Cb 0.23 1.00 -0.05 0.00 -2.10 0.00 0.00 70.33 69.41 1jyl n THR 120 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jyl s ARG 121 N -0.83 1.20 -0.05 -0.78 1.70 -1.26 -4.95 118.95 113.98 1jyl s ARG 121 Ca 0.00 -0.91 -0.32 0.00 -0.47 0.00 0.00 55.73 54.04 1jyl s ARG 121 Cb 0.00 0.46 -0.10 0.00 -0.57 0.00 0.00 34.95 34.74 1jyl s ARG 121 CO 0.00 -0.47 1.97 0.43 -1.08 0.00 0.00 175.30 176.15 1jyl n SER 122 N -0.26 3.75 -4.27 -2.89 7.64 -1.26 -4.66 113.62 111.67 1jyl n SER 122 Ca -0.11 0.84 -0.24 0.00 1.01 0.00 0.00 58.87 60.37 1jyl n SER 122 Cb 0.63 -1.46 -0.13 0.00 -1.01 0.00 0.00 64.21 62.24 1jyl n SER 122 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1jyl s THR 123 N 4.81 1.68 -0.21 0.44 2.01 0.20 -0.50 115.64 124.06 1jyl s THR 123 Ca 0.92 -1.47 0.02 0.00 0.31 0.00 0.00 61.69 61.47 1jyl s THR 123 Cb -0.54 -1.51 0.03 0.00 0.01 0.00 0.00 72.50 70.49 1jyl s THR 123 CO 0.45 -0.02 -0.16 -0.31 -0.69 0.00 0.00 174.62 173.89 1jyl s TYR 124 N -1.10 2.97 -1.01 4.92 2.02 0.19 -1.43 117.35 123.92 1jyl s TYR 124 Ca 0.06 -1.90 -0.19 0.00 -0.37 0.00 0.00 57.07 54.68 1jyl s TYR 124 Cb -0.10 -1.93 0.12 0.00 -0.40 0.00 0.00 41.96 39.65 1jyl s TYR 124 CO 0.04 -0.83 1.27 -0.06 -1.57 0.00 0.00 175.55 174.40 1jyl s PHE 125 N 1.22 3.02 -0.06 2.71 2.99 -0.85 -1.18 117.98 125.83 1jyl s PHE 125 Ca -0.00 -1.38 -0.25 0.00 0.00 0.00 0.00 56.93 55.30 1jyl s PHE 125 Cb -0.16 -4.40 -0.03 0.00 0.00 0.00 0.00 43.02 38.42 1jyl s PHE 125 CO -0.10 -1.59 0.76 0.45 -0.00 0.00 0.00 175.22 174.74 1jyl s SER 126 N 3.85 7.06 0.15 1.36 0.15 -0.89 -4.27 113.70 121.11 1jyl s SER 126 Ca 0.38 1.28 0.04 0.00 0.70 0.00 0.00 55.95 58.36 1jyl s SER 126 Cb -0.03 -2.45 -0.04 0.00 -1.71 0.00 0.00 66.02 61.80 1jyl s SER 126 CO -0.07 -0.16 0.13 0.68 1.20 0.00 0.00 173.24 175.02 1jyl s VAL 127 N 0.92 4.53 -0.29 4.45 -7.23 -1.25 0.03 120.40 121.56 1jyl s VAL 127 Ca 0.40 -1.00 -0.12 0.00 -1.81 0.00 0.00 61.98 59.46 1jyl s VAL 127 Cb -0.18 -3.29 -0.04 0.00 0.56 0.00 0.00 36.38 33.43 1jyl s VAL 127 CO 0.20 -0.06 0.23 -0.47 -0.31 0.00 0.00 175.10 174.69 1jyl s TYR 128 N -1.67 3.22 -0.44 2.82 6.14 -1.26 -2.09 117.35 124.07 1jyl s TYR 128 Ca 0.31 0.13 -0.18 0.00 0.64 0.00 0.00 57.07 57.97 1jyl s TYR 128 Cb -0.11 -2.44 0.03 0.00 0.42 0.00 0.00 41.96 39.87 1jyl s TYR 128 CO 0.23 -0.20 0.48 0.50 0.64 0.00 0.00 175.55 177.20 1jyl s ARG 129 N 1.82 3.09 0.29 4.97 3.52 0.21 -4.90 118.95 127.96 1jyl s ARG 129 Ca 0.08 -0.84 0.09 0.00 -0.13 0.00 0.00 55.73 54.94 1jyl s ARG 129 Cb -0.16 -4.01 0.42 0.00 -1.56 0.00 0.00 34.95 29.64 1jyl s ARG 129 CO 0.11 -0.95 1.66 1.49 -0.81 0.00 0.00 175.30 176.80 1jyl h GLU 130 N 8.79 0.07 0.00 5.12 4.22 -1.93 -0.10 114.58 130.75 1jyl h GLU 130 Ca -0.27 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.13 1jyl h GLU 130 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1jyl h GLU 130 CO 0.84 0.60 0.00 -0.40 -2.18 0.00 0.00 179.01 177.87 1jyl n ASP 131 N -3.90 0.00 -3.18 1.04 3.85 -1.26 -4.76 116.55 108.34 1jyl n ASP 131 Ca -0.02 0.00 0.02 0.00 -0.71 0.00 0.00 54.79 54.08 1jyl n ASP 131 Cb 0.56 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.31 1jyl n ASP 131 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jyl s THR 133 N 2.79 0.94 -0.38 0.00 -1.32 -1.01 -4.65 115.64 112.01 1jyl s THR 133 Ca 0.14 -2.00 -0.22 0.00 -1.21 0.00 0.00 61.69 58.40 1jyl s THR 133 Cb -0.12 -2.63 0.01 0.00 -1.51 0.00 0.00 72.50 68.25 1jyl s THR 133 CO -0.24 0.00 0.75 0.21 -2.21 0.00 0.00 174.62 173.13 1jyl s ASN 134 N -3.51 6.50 0.32 8.08 2.47 -1.25 -1.31 114.94 126.23 1jyl s ASN 134 Ca 0.32 0.22 0.04 0.00 0.42 0.00 0.00 52.86 53.86 1jyl s ASN 134 Cb 0.07 -2.38 -0.01 0.00 -1.45 0.00 0.00 41.25 37.47 1jyl s ASN 134 CO 0.15 -0.73 0.33 -0.62 -3.72 0.00 0.00 177.10 172.51 1jyl n GLU 135 N 6.38 0.48 -3.38 0.43 -0.58 0.11 -4.92 120.64 119.15 1jyl n GLU 135 Ca 0.02 -2.94 -0.39 0.00 -0.42 0.00 0.00 57.16 53.43 1jyl n GLU 135 Cb 0.48 2.55 -0.09 0.00 -0.57 0.00 0.00 31.44 33.81 1jyl n GLU 135 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1jyl s TRP 136 N -3.18 3.27 -0.06 -0.32 0.52 -1.26 -0.88 118.94 117.03 1jyl s TRP 136 Ca 0.34 0.47 -0.01 0.00 0.02 0.00 0.00 56.10 56.92 1jyl s TRP 136 Cb 0.01 -2.58 -0.03 0.00 -1.15 0.00 0.00 33.47 29.72 1jyl s TRP 136 CO 0.24 -0.19 0.02 -0.06 0.02 0.00 0.00 176.95 176.98 1jyl s PHE 137 N 1.94 3.17 -0.17 -1.98 0.08 0.12 -2.05 117.98 119.09 1jyl s PHE 137 Ca 0.16 0.18 -0.17 0.00 0.12 0.00 0.00 56.93 57.22 1jyl s PHE 137 Cb -0.16 -1.76 -0.04 0.00 -0.57 0.00 0.00 43.02 40.50 1jyl s PHE 137 CO 0.09 0.49 0.45 -0.51 -0.10 0.00 0.00 175.22 175.64 1jyl s LEU 138 N -1.14 4.20 -0.45 -0.37 1.43 0.30 -0.96 118.68 121.69 1jyl s LEU 138 Ca 0.16 0.66 -0.08 0.00 -1.03 0.00 0.00 54.13 53.85 1jyl s LEU 138 Cb -0.11 -2.62 0.11 0.00 0.03 0.00 0.00 46.19 43.60 1jyl s LEU 138 CO 0.05 -0.06 0.30 -0.69 0.23 0.00 0.00 176.35 176.19 1jyl s VAL 139 N 1.08 3.98 0.10 -1.59 1.01 0.20 -4.70 120.40 120.48 1jyl s VAL 139 Ca 0.23 -1.82 0.03 0.00 0.00 0.00 0.00 61.98 60.41 1jyl s VAL 139 Cb -0.15 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1jyl s VAL 139 CO 0.09 -0.73 -0.08 -0.72 0.00 0.00 0.00 175.10 173.66 1jyl s TYR 140 N 1.31 0.94 0.00 5.22 -0.85 -1.26 0.24 117.35 122.95 1jyl s TYR 140 Ca 0.06 -0.78 0.00 0.00 -0.52 0.00 0.00 57.07 55.83 1jyl s TYR 140 Cb -0.25 -0.53 0.00 0.00 0.38 0.00 0.00 41.96 41.56 1jyl s TYR 140 CO -0.01 -0.08 0.00 0.41 -1.52 0.00 0.00 175.55 174.35 1jyl n GLY 141 N 0.30 1.49 0.00 5.49 0.00 -1.24 -4.92 105.19 106.31 1jyl n GLY 141 Ca -0.14 -1.65 0.12 0.00 0.00 0.00 0.00 46.02 44.35 1jyl n GLY 141 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jyl n ASP 142 N 0.00 0.44 -0.44 1.61 9.92 -1.26 -3.21 116.55 123.60 1jyl n ASP 142 Ca 0.00 -0.15 0.13 0.00 -0.53 0.00 0.00 54.79 54.24 1jyl n ASP 142 Cb 0.00 0.15 0.29 0.00 -0.64 0.00 0.00 41.12 40.92 1jyl n ASP 142 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1jyl n ASP 143 N -1.51 1.60 -0.05 -2.24 5.68 -1.26 -4.92 116.55 113.85 1jyl n ASP 143 Ca 0.06 -1.31 -0.01 0.00 -0.50 0.00 0.00 54.79 53.03 1jyl n ASP 143 Cb 0.34 0.17 -0.00 0.00 -1.14 0.00 0.00 41.12 40.48 1jyl n ASP 143 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 1jyl n TYR 144 N -0.08 0.00 -2.67 2.11 0.53 -1.20 -4.91 117.16 110.93 1jyl n TYR 144 Ca 0.13 0.00 -0.41 0.00 -1.02 0.00 0.00 57.90 56.60 1jyl n TYR 144 Cb 0.41 -1.59 -0.04 0.00 -1.03 0.00 0.00 39.34 37.08 1jyl n TYR 144 CO 0.00 0.00 0.00 0.21 -1.02 0.00 0.00 176.86 176.05 1jyl s LYS 145 N -1.62 4.67 -0.18 -0.72 2.47 -1.26 -0.73 119.74 122.37 1jyl s LYS 145 Ca 0.00 1.52 -0.29 0.00 -1.56 0.00 0.00 55.97 55.64 1jyl s LYS 145 Cb 0.00 -3.35 -0.01 0.00 -1.46 0.00 0.00 37.83 33.01 1jyl s LYS 145 CO 0.00 0.17 1.25 0.08 0.16 0.00 0.00 175.35 177.01 1jyl s VAL 146 N -0.03 4.30 -0.09 4.02 1.01 0.20 -3.60 120.40 126.21 1jyl s VAL 146 Ca 0.48 1.56 0.00 0.00 0.00 0.00 0.00 61.98 64.02 1jyl s VAL 146 Cb -0.25 -4.04 -0.25 0.00 0.00 0.00 0.00 36.38 31.84 1jyl s VAL 146 CO 0.31 -0.17 0.49 0.00 0.00 0.00 0.00 175.10 175.73 1jyl n GLN 147 N 6.66 0.71 -3.62 2.72 1.13 0.14 -4.65 117.38 120.48 1jyl n GLN 147 Ca 0.14 0.28 -0.09 0.00 -1.94 0.00 0.00 57.00 55.39 1jyl n GLN 147 Cb 0.45 -1.75 -0.02 0.00 0.11 0.00 0.00 30.24 29.04 1jyl n GLN 147 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1jyl s ASP 148 N -6.70 -0.39 -0.04 1.08 2.15 -0.52 -4.81 116.67 107.43 1jyl s ASP 148 Ca -0.16 -0.25 0.02 0.00 0.43 0.00 0.00 52.55 52.59 1jyl s ASP 148 Cb 0.07 0.60 0.02 0.00 -0.30 0.00 0.00 42.92 43.30 1jyl s ASP 148 CO 0.79 -1.03 -0.07 -0.63 -0.17 0.00 0.00 175.17 174.06 1jyl s ILE 149 N -3.66 0.67 -0.04 4.11 1.01 -1.25 0.62 121.20 122.66 1jyl s ILE 149 Ca 0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.47 1jyl s ILE 149 Cb -0.03 -0.65 0.03 0.00 0.01 0.00 0.00 42.46 41.83 1jyl s ILE 149 CO -0.04 0.24 0.10 0.27 0.00 0.00 0.00 174.94 175.51 1jyl s ILE 150 N 0.69 -0.05 0.18 2.92 -4.36 -0.14 -4.91 121.20 115.54 1jyl s ILE 150 Ca -0.10 0.17 -0.30 0.00 -0.26 0.00 0.00 60.65 60.16 1jyl s ILE 150 Cb -0.13 -0.17 -0.08 0.00 1.25 0.00 0.00 42.46 43.33 1jyl s ILE 150 CO 0.01 0.07 0.96 -0.69 0.24 0.00 0.00 174.94 175.53 1jyl s VAL 151 N 1.00 4.23 -0.01 8.37 1.01 -1.26 0.14 120.40 133.88 1jyl s VAL 151 Ca -0.08 2.05 -0.30 0.00 0.00 0.00 0.00 61.98 63.65 1jyl s VAL 151 Cb -0.11 -4.31 0.12 0.00 0.00 0.00 0.00 36.38 32.08 1jyl s VAL 151 CO -0.04 0.41 1.24 -0.62 0.00 0.00 0.00 175.10 176.09 1jyl s ASP 152 N -0.64 -0.08 -0.32 3.32 -1.08 -0.06 -4.94 116.67 112.87 1jyl s ASP 152 Ca 0.44 -0.15 -0.05 0.00 -0.52 0.00 0.00 52.55 52.27 1jyl s ASP 152 Cb -0.25 0.20 0.04 0.00 -1.46 0.00 0.00 42.92 41.45 1jyl s ASP 152 CO 0.31 -0.36 0.06 -0.55 0.52 0.00 0.00 175.17 175.15 1jyl s SER 153 N -2.90 5.13 0.00 -0.34 0.15 -1.26 0.04 113.70 114.53 1jyl s SER 153 Ca 0.13 -1.16 0.00 0.00 0.70 0.00 0.00 55.95 55.63 1jyl s SER 153 Cb 0.04 -1.81 0.00 0.00 -1.71 0.00 0.00 66.02 62.54 1jyl s SER 153 CO -0.03 -0.29 0.00 2.29 1.20 0.00 0.00 173.24 176.41 1jyl n LYS 154 N 4.74 0.00 -4.37 5.44 2.85 -0.43 -4.84 118.16 121.55 1jyl n LYS 154 Ca -0.13 0.00 -0.25 0.00 -1.05 0.00 0.00 58.31 56.88 1jyl n LYS 154 Cb 0.44 0.00 -0.12 0.00 -0.65 0.00 0.00 35.03 34.71 1jyl n LYS 154 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1jyl s ALA 155 N -1.00 2.26 0.00 0.58 0.00 -1.23 -2.39 121.76 119.98 1jyl s ALA 155 Ca 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 51.96 50.44 1jyl s ALA 155 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.84 1jyl s ALA 155 CO 0.00 0.38 0.00 0.41 0.00 0.00 0.00 175.76 176.55 1jyl n GLY 156 N 0.46 0.83 3.66 0.00 0.00 -0.05 -4.96 105.19 105.12 1jyl n GLY 156 Ca -0.14 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.70 1jyl n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1jyl s ARG 157 N -2.00 4.16 0.39 1.61 1.81 -1.26 0.66 118.95 124.32 1jyl s ARG 157 Ca 0.00 0.34 0.08 0.00 -1.72 0.00 0.00 55.73 54.43 1jyl s ARG 157 Cb 0.00 -3.57 -0.05 0.00 -0.45 0.00 0.00 34.95 30.88 1jyl s ARG 157 CO 0.00 -0.16 0.14 0.96 -0.68 0.00 0.00 175.30 175.57 1jyl s ILE 158 N 1.67 2.50 -0.36 1.52 -4.36 -0.89 -0.54 121.20 120.74 1jyl s ILE 158 Ca 0.22 -1.74 -0.29 0.00 -0.26 0.00 0.00 60.65 58.58 1jyl s ILE 158 Cb -0.15 -2.96 -0.00 0.00 1.25 0.00 0.00 42.46 40.60 1jyl s ILE 158 CO 0.09 -0.07 1.53 -0.76 0.24 0.00 0.00 174.94 175.97 1jyl s LEU 159 N -3.86 3.61 0.00 0.37 1.02 -0.87 -3.97 118.68 114.98 1jyl s LEU 159 Ca 0.39 1.06 0.24 0.00 0.02 0.00 0.00 54.13 55.84 1jyl s LEU 159 Cb 0.02 -3.54 0.40 0.00 0.02 0.00 0.00 46.19 43.09 1jyl s LEU 159 CO 0.22 -1.47 1.39 -1.20 0.02 0.00 0.00 176.35 175.31 1jyl n SER 160 N 9.09 3.40 0.00 2.29 7.64 -1.26 -4.86 113.62 129.92 1jyl n SER 160 Ca 0.18 -2.00 0.00 0.00 1.01 0.00 0.00 58.87 58.07 1jyl n SER 160 Cb 0.47 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 1jyl n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jyl n GLY 161 N 1.49 1.05 3.19 0.23 0.00 -1.26 -4.93 105.19 104.96 1jyl n GLY 161 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 1jyl n GLY 161 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jyl s VAL 162 N -2.00 -0.48 0.27 1.61 1.01 -1.26 -1.56 120.40 117.99 1jyl s VAL 162 Ca 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.13 1jyl s VAL 162 Cb 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.78 1jyl s VAL 162 CO 0.00 0.08 0.35 -0.94 0.00 0.00 0.00 175.10 174.59 1jyl s SER 163 N 2.34 0.50 -0.04 3.32 1.04 -0.83 -2.01 113.70 118.01 1jyl s SER 163 Ca -0.02 -1.34 -0.02 0.00 0.48 0.00 0.00 55.95 55.05 1jyl s SER 163 Cb -0.11 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.57 1jyl s SER 163 CO -0.11 -1.09 0.08 0.12 0.98 0.00 0.00 173.24 173.22 1jyl s PHE 164 N -3.70 -0.08 -0.19 5.02 5.36 -0.51 -1.62 117.98 122.26 1jyl s PHE 164 Ca 0.32 0.26 0.01 0.00 -0.96 0.00 0.00 56.93 56.56 1jyl s PHE 164 Cb 0.02 -0.05 0.03 0.00 -0.34 0.00 0.00 43.02 42.68 1jyl s PHE 164 CO 0.16 -0.08 -0.14 -1.58 -1.46 0.00 0.00 175.22 172.12 1jyl s TRP 165 N 0.54 2.52 0.80 10.12 0.52 -0.85 -0.63 118.94 131.95 1jyl s TRP 165 Ca -0.04 -1.57 -0.11 0.00 0.02 0.00 0.00 56.10 54.39 1jyl s TRP 165 Cb -0.06 -1.72 0.07 0.00 -1.15 0.00 0.00 33.47 30.61 1jyl s TRP 165 CO -0.02 -0.75 1.10 0.16 0.02 0.00 0.00 176.95 177.46 1jyl s ASP 166 N 1.37 4.49 0.17 2.95 1.47 -1.26 0.15 116.67 126.01 1jyl s ASP 166 Ca 0.01 1.29 -0.18 0.00 1.18 0.00 0.00 52.55 54.85 1jyl s ASP 166 Cb -0.15 -2.02 0.11 0.00 -0.34 0.00 0.00 42.92 40.52 1jyl s ASP 166 CO -0.10 -1.97 1.64 0.00 0.68 0.00 0.00 175.17 175.42 1jyl h ALA 167 N -1.09 0.14 -0.44 2.11 0.00 -1.91 0.12 119.26 118.19 1jyl h ALA 167 Ca -0.47 0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 1jyl h ALA 167 Cb 1.27 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 1jyl h ALA 167 CO 0.59 -0.54 -0.01 -1.00 0.00 0.00 0.00 179.25 178.30 1jyl h PRO 168 N -0.10 0.73 -0.05 0.00 0.13 -2.00 -1.55 132.00 129.16 1jyl h PRO 168 Ca 0.20 -0.19 -0.09 0.00 -0.87 0.00 0.00 66.00 65.06 1jyl h PRO 168 Cb 0.42 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.46 1jyl h PRO 168 CO -0.49 0.75 -0.31 1.15 -0.23 0.00 0.00 178.00 178.87 1jyl h THR 169 N 0.68 1.45 -0.94 1.56 2.02 -1.89 -2.95 112.91 112.85 1jyl h THR 169 Ca 0.14 -1.79 0.17 0.00 0.77 0.00 0.00 66.41 65.70 1jyl h THR 169 Cb 0.43 2.44 -0.08 0.00 -1.74 0.00 0.00 68.15 69.21 1jyl h THR 169 CO 0.02 0.51 0.60 0.00 0.37 0.00 0.00 175.52 177.02 1jyl h ALA 170 N 0.38 1.85 -0.57 6.16 0.00 -0.65 0.13 119.26 126.57 1jyl h ALA 170 Ca -0.03 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1jyl h ALA 170 Cb 0.99 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1jyl h ALA 170 CO 0.06 -0.15 0.21 1.49 0.00 0.00 0.00 179.25 180.86 1jyl h GLU 171 N 0.67 0.87 -0.50 0.00 4.81 -1.25 0.08 114.58 119.26 1jyl h GLU 171 Ca 0.50 -0.17 -0.09 0.00 -0.13 0.00 0.00 59.36 59.47 1jyl h GLU 171 Cb 0.88 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.10 1jyl h GLU 171 CO -0.26 0.77 -0.06 0.87 -0.73 0.00 0.00 179.01 179.59 1jyl h LYS 172 N 0.79 0.89 0.18 1.92 1.57 -0.63 -2.96 116.57 118.32 1jyl h LYS 172 Ca 0.19 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1jyl h LYS 172 Cb 0.24 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1jyl h LYS 172 CO -0.01 0.92 -0.09 0.82 -0.57 0.00 0.00 179.45 180.53 1jyl h ILE 173 N 0.81 0.93 -0.82 1.86 2.04 -0.80 -2.98 117.51 118.55 1jyl h ILE 173 Ca 0.14 -0.62 0.21 0.00 1.00 0.00 0.00 64.86 65.59 1jyl h ILE 173 Cb 0.57 1.30 -0.05 0.00 -0.74 0.00 0.00 36.82 37.90 1jyl h ILE 173 CO 0.03 0.14 0.57 0.58 0.00 0.00 0.00 178.15 179.47 1jyl h VAL 174 N -0.55 0.66 0.00 1.67 2.07 -0.98 0.45 116.25 119.57 1jyl h VAL 174 Ca -0.02 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1jyl h VAL 174 Cb 0.42 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1jyl h VAL 174 CO 0.04 0.04 -0.08 0.77 0.02 0.00 0.00 177.57 178.36 1jyl h SER 175 N 0.21 0.00 0.57 0.57 4.64 -1.36 -1.77 113.55 116.41 1jyl h SER 175 Ca 0.41 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.45 1jyl h SER 175 Cb 1.28 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.33 1jyl h SER 175 CO -0.09 0.08 -1.57 -0.26 -0.87 0.00 0.00 176.83 174.13 1jyl h PHE 176 N 0.00 0.06 -0.31 4.77 0.05 -0.11 -3.24 116.94 118.16 1jyl h PHE 176 Ca -0.00 -0.05 -0.01 0.00 3.82 0.00 0.00 57.97 61.73 1jyl h PHE 176 Cb 0.57 -0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.50 1jyl h PHE 176 CO 0.00 1.07 0.16 0.82 -0.18 0.00 0.00 178.31 180.18 1jyl h ILE 177 N 0.01 1.15 0.70 -0.55 2.04 -0.68 0.13 117.51 120.31 1jyl h ILE 177 Ca -0.23 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.17 1jyl h ILE 177 Cb 1.97 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 1jyl h ILE 177 CO 0.10 0.16 -0.36 0.44 0.00 0.00 0.00 178.15 178.49 1jyl h ASP 178 N 0.37 -0.85 -0.50 1.72 3.45 -1.47 0.23 116.42 119.37 1jyl h ASP 178 Ca 0.11 0.04 0.09 0.00 0.43 0.00 0.00 57.03 57.69 1jyl h ASP 178 Cb 0.11 0.23 -0.08 0.00 -0.56 0.00 0.00 39.33 39.03 1jyl h ASP 178 CO -0.01 -0.59 0.06 0.11 -1.57 0.00 0.00 179.24 177.24 1jyl h LYS 179 N -0.96 0.18 -0.32 3.56 1.57 -1.57 0.29 116.57 119.32 1jyl h LYS 179 Ca -0.09 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.72 1jyl h LYS 179 Cb 0.75 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.98 1jyl h LYS 179 CO 0.14 0.12 0.07 0.00 -0.57 0.00 0.00 179.45 179.21 1jyl h ALA 180 N 1.42 0.34 0.26 3.86 0.00 -0.76 0.47 119.26 124.85 1jyl h ALA 180 Ca 0.25 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1jyl h ALA 180 Cb 0.36 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1jyl h ALA 180 CO -0.37 -0.34 -0.13 -0.92 0.00 0.00 0.00 179.25 177.50 1jyl h TYR 181 N 0.19 -0.33 0.00 0.00 3.20 0.26 -2.82 116.97 117.47 1jyl h TYR 181 Ca 0.15 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.99 1jyl h TYR 181 Cb 0.15 0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.53 1jyl h TYR 181 CO -0.17 -0.07 -0.07 -0.39 -1.64 0.00 0.00 178.16 175.82 1jyl h VAL 182 N -0.56 0.44 -0.24 1.81 -1.51 -0.29 -0.17 116.25 115.74 1jyl h VAL 182 Ca -0.04 -0.36 -0.01 0.00 -1.23 0.00 0.00 66.70 65.07 1jyl h VAL 182 Cb 0.41 1.24 -0.01 0.00 -2.13 0.00 0.00 31.29 30.80 1jyl h VAL 182 CO 0.06 0.07 0.09 0.77 -1.23 0.00 0.00 177.57 177.33 1jyl h SER 183 N 0.00 0.29 0.00 4.19 4.64 0.21 -3.46 113.55 119.42 1jyl h SER 183 Ca -0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1jyl h SER 183 Cb 0.24 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1jyl h SER 183 CO 0.01 0.27 0.00 0.61 -0.87 0.00 0.00 176.83 176.85 1jyl n GLY 184 N -1.32 0.67 2.77 -0.77 0.00 -0.08 -5.00 105.19 101.46 1jyl n GLY 184 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1jyl n GLY 184 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jyl s GLU 185 N -0.33 1.63 0.00 1.61 2.02 -1.23 -4.77 118.70 117.63 1jyl s GLU 185 Ca 0.00 -2.40 0.00 0.00 0.02 0.00 0.00 54.97 52.59 1jyl s GLU 185 Cb 0.00 -2.68 0.00 0.00 0.10 0.00 0.00 34.13 31.55 1jyl s GLU 185 CO 0.00 -1.19 0.00 1.97 0.02 0.00 0.00 175.26 176.06 1jyl n PHE 186 N 3.10 0.00 -0.15 1.61 -1.74 -1.26 -4.85 117.46 114.17 1jyl n PHE 186 Ca 0.12 0.00 -0.04 0.00 -0.56 0.00 0.00 57.45 56.97 1jyl n PHE 186 Cb 0.35 0.01 -0.04 0.00 1.52 0.00 0.00 39.48 41.33 1jyl n PHE 186 CO 0.00 0.00 0.00 0.28 -0.56 0.00 0.00 176.76 176.48 1jyl n VAL 187 N 0.00 -0.25 1.61 1.97 0.31 -1.26 -0.59 118.33 120.12 1jyl n VAL 187 Ca 0.00 1.61 0.15 0.00 -0.01 0.00 0.00 64.34 66.09 1jyl n VAL 187 Cb 0.10 -2.07 0.81 0.00 -0.91 0.00 0.00 33.84 31.77 1jyl n VAL 187 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1jyl n ASP 188 N -3.79 0.00 -4.73 4.52 5.75 -1.26 0.48 116.55 117.52 1jyl n ASP 188 Ca 0.01 -0.47 -0.41 0.00 -0.01 0.00 0.00 54.79 53.90 1jyl n ASP 188 Cb 0.09 -0.17 -0.03 0.00 -1.03 0.00 0.00 41.12 39.98 1jyl n ASP 188 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1jyl s LEU 189 N -2.34 4.42 0.37 -2.12 1.43 0.24 -4.74 118.68 115.95 1jyl s LEU 189 Ca 0.35 2.18 -0.24 0.00 -1.03 0.00 0.00 54.13 55.39 1jyl s LEU 189 Cb 0.20 -3.60 -0.10 0.00 0.03 0.00 0.00 46.19 42.73 1jyl s LEU 189 CO 0.41 -0.42 0.99 -0.31 0.23 0.00 0.00 176.35 177.25 1jyl s TYR 190 N 0.33 3.46 0.41 0.29 1.51 -1.26 -2.00 117.35 120.09 1jyl s TYR 190 Ca 0.55 1.70 0.14 0.00 -1.01 0.00 0.00 57.07 58.45 1jyl s TYR 190 Cb -0.32 -2.99 1.00 0.00 -0.11 0.00 0.00 41.96 39.54 1jyl s TYR 190 CO 0.34 -0.17 1.90 0.11 -1.11 0.00 0.00 175.55 176.62 1jyl h TRP 191 N 2.69 0.57 0.00 2.71 5.08 -1.83 0.17 115.95 125.35 1jyl h TRP 191 Ca -0.48 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.51 1jyl h TRP 191 Cb 1.20 -0.18 0.00 0.00 -3.00 0.00 0.00 29.16 27.18 1jyl h TRP 191 CO 0.60 0.21 0.19 -0.44 -1.28 0.00 0.00 178.44 177.72 1jyl h ASP 192 N 0.48 0.00 0.63 0.11 5.19 -1.93 -0.82 116.42 120.08 1jyl h ASP 192 Ca 0.40 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.77 1jyl h ASP 192 Cb 0.86 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.37 1jyl h ASP 192 CO -0.15 0.00 -0.18 0.78 -3.12 0.00 0.00 179.24 176.57 1jyl h ASN 193 N 0.00 0.00 -0.64 6.45 4.21 -1.02 -2.20 115.58 122.38 1jyl h ASN 193 Ca 0.00 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.50 1jyl h ASN 193 Cb 0.39 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.56 1jyl h ASN 193 CO 0.00 0.18 0.36 0.24 -1.29 0.00 0.00 177.43 176.93 1jyl h MET 194 N 0.00 0.89 0.17 0.81 2.86 -1.31 -0.76 114.93 117.58 1jyl h MET 194 Ca -0.00 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1jyl h MET 194 Cb 0.55 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.03 1jyl h MET 194 CO 0.02 0.66 -0.08 0.28 1.06 0.00 0.00 176.91 178.86 1jyl h VAL 195 N 0.88 0.26 -0.74 -2.22 2.07 -1.67 -3.13 116.25 111.70 1jyl h VAL 195 Ca 0.23 -0.98 0.17 0.00 0.82 0.00 0.00 66.70 66.94 1jyl h VAL 195 Cb 0.02 0.46 -0.12 0.00 -1.52 0.00 0.00 31.29 30.14 1jyl h VAL 195 CO -0.04 0.08 0.13 0.50 0.02 0.00 0.00 177.57 178.26 1jyl h LYS 196 N -1.03 0.21 -0.08 1.57 3.64 -1.42 0.82 116.57 120.28 1jyl h LYS 196 Ca -0.02 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1jyl h LYS 196 Cb 0.30 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1jyl h LYS 196 CO 0.04 0.14 0.00 -0.25 -2.27 0.00 0.00 179.45 177.10 1jyl n ASP 197 N -5.21 0.72 -0.23 4.20 8.00 -0.30 -3.60 116.55 120.13 1jyl n ASP 197 Ca 0.14 -1.60 0.00 0.00 0.71 0.00 0.00 54.79 54.04 1jyl n ASP 197 Cb 0.47 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 1jyl n ASP 197 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1jyl n ASN 198 N -0.28 0.00 -0.11 -2.24 3.02 0.46 -4.88 115.26 111.22 1jyl n ASN 198 Ca 0.14 -1.46 0.27 0.00 -0.03 0.00 0.00 54.58 53.49 1jyl n ASN 198 Cb 0.17 -0.09 0.72 0.00 -0.61 0.00 0.00 39.78 39.97 1jyl n ASN 198 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1jyl h ILE 199 N 4.86 0.47 -0.36 2.41 6.09 0.45 -0.66 117.51 130.76 1jyl h ILE 199 Ca 0.00 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.46 1jyl h ILE 199 Cb 1.18 0.55 -0.02 0.00 0.47 0.00 0.00 36.82 39.00 1jyl h ILE 199 CO 0.00 0.00 0.09 0.11 -3.07 0.00 0.00 178.15 175.28 1jyl h LYS 200 N 0.00 0.53 -0.01 2.19 6.56 -1.87 -2.63 116.57 121.34 1jyl h LYS 200 Ca 0.37 -0.09 0.00 0.00 -1.06 0.00 0.00 60.65 59.87 1jyl h LYS 200 Cb 1.62 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 33.19 1jyl h LYS 200 CO -0.00 0.50 -0.15 0.39 -2.06 0.00 0.00 179.45 178.12 1jyl n GLU 201 N -4.34 1.26 -4.35 3.15 1.02 -0.26 -4.92 120.64 112.19 1jyl n GLU 201 Ca 0.02 -0.77 -0.27 0.00 -0.02 0.00 0.00 57.16 56.11 1jyl n GLU 201 Cb 0.19 -1.48 -0.11 0.00 -0.02 0.00 0.00 31.44 30.02 1jyl n GLU 201 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1jyl s LEU 202 N -2.28 2.68 -0.34 -4.62 1.43 -0.99 -5.08 118.68 109.48 1jyl s LEU 202 Ca 0.30 -0.70 -0.02 0.00 -1.03 0.00 0.00 54.13 52.67 1jyl s LEU 202 Cb 0.20 -1.42 0.07 0.00 0.03 0.00 0.00 46.19 45.07 1jyl s LEU 202 CO 0.44 0.12 0.08 -1.81 0.23 0.00 0.00 176.35 175.41 1jyl s ASP 203 N -2.63 5.05 0.08 2.29 1.01 -1.26 -4.92 116.67 116.29 1jyl s ASP 203 Ca 0.22 -1.53 0.08 0.00 0.71 0.00 0.00 52.55 52.02 1jyl s ASP 203 Cb -0.09 -1.76 -0.03 0.00 1.01 0.00 0.00 42.92 42.05 1jyl s ASP 203 CO 0.12 -0.36 -0.21 -0.69 0.21 0.00 0.00 175.17 174.24 1jyl s VAL 204 N 1.22 1.68 0.19 -1.27 1.01 -1.26 -4.53 120.40 117.43 1jyl s VAL 204 Ca -0.00 -1.43 0.09 0.00 0.00 0.00 0.00 61.98 60.64 1jyl s VAL 204 Cb -0.21 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 1jyl s VAL 204 CO -0.02 0.01 -0.19 -0.31 0.00 0.00 0.00 175.10 174.59 1jyl s TYR 205 N -1.06 1.94 0.17 5.22 1.51 0.34 0.58 117.35 126.05 1jyl s TYR 205 Ca 0.06 -0.45 0.04 0.00 -1.01 0.00 0.00 57.07 55.71 1jyl s TYR 205 Cb -0.10 -0.93 -0.03 0.00 -0.11 0.00 0.00 41.96 40.78 1jyl s TYR 205 CO 0.03 0.41 0.28 0.08 -1.11 0.00 0.00 175.55 175.24 1jyl s VAL 206 N -2.20 5.16 -0.36 0.71 1.01 0.09 -0.64 120.40 124.18 1jyl s VAL 206 Ca 0.19 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1jyl s VAL 206 Cb -0.05 -3.69 0.14 0.00 0.00 0.00 0.00 36.38 32.77 1jyl s VAL 206 CO 0.08 -0.15 0.21 -0.70 0.00 0.00 0.00 175.10 174.54 1jyl s GLU 207 N -3.40 0.61 0.13 2.72 2.56 -0.33 -4.82 118.70 116.18 1jyl s GLU 207 Ca 0.34 -1.38 -0.31 0.00 0.00 0.00 0.00 54.97 53.62 1jyl s GLU 207 Cb -0.10 -1.39 -0.11 0.00 2.00 0.00 0.00 34.13 34.53 1jyl s GLU 207 CO 0.28 -1.20 1.81 -1.21 -0.56 0.00 0.00 175.26 174.38 1jyl s GLU 208 N 1.02 4.14 0.50 4.30 2.02 -1.26 -2.10 118.70 127.32 1jyl s GLU 208 Ca 0.18 2.60 0.06 0.00 0.02 0.00 0.00 54.97 57.83 1jyl s GLU 208 Cb -0.23 -3.52 0.04 0.00 0.10 0.00 0.00 34.13 30.52 1jyl s GLU 208 CO 0.01 -0.83 0.69 -1.17 0.02 0.00 0.00 175.26 173.98 1jyl s LEU 209 N 2.52 3.42 0.17 1.80 2.96 0.10 -4.92 118.68 124.73 1jyl s LEU 209 Ca 0.80 -0.40 -0.08 0.00 -0.22 0.00 0.00 54.13 54.23 1jyl s LEU 209 Cb -0.46 -2.48 -0.01 0.00 0.50 0.00 0.00 46.19 43.74 1jyl s LEU 209 CO 0.36 -1.04 0.28 -0.70 -1.32 0.00 0.00 176.35 173.93 1jyl s GLU 210 N -4.56 1.19 2.86 1.98 2.56 -1.26 -4.66 118.70 116.81 1jyl s GLU 210 Ca 0.58 -1.22 0.00 0.00 0.00 0.00 0.00 54.97 54.32 1jyl s GLU 210 Cb -0.09 0.37 0.00 0.00 2.00 0.00 0.00 34.13 36.41 1jyl s GLU 210 CO 0.36 -0.44 0.00 0.41 -0.56 0.00 0.00 175.26 175.04 1jyl n GLY 211 N -0.23 0.93 3.60 -1.50 0.00 -1.26 -4.22 105.19 102.51 1jyl n GLY 211 Ca -0.06 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.76 1jyl n GLY 211 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jyl s ASN 212 N -4.00 6.55 0.18 1.61 0.01 -1.26 -4.81 114.94 113.22 1jyl s ASN 212 Ca 0.00 0.43 0.00 0.00 -0.71 0.00 0.00 52.86 52.58 1jyl s ASN 212 Cb 0.00 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 39.11 1jyl s ASN 212 CO 0.00 -1.33 0.00 -1.54 -1.51 0.00 0.00 177.10 172.72 1jyl n SER 213 N 8.13 0.42 -4.03 -1.22 3.41 -1.26 -4.46 113.62 114.61 1jyl n SER 213 Ca 0.12 0.29 -0.31 0.00 -0.26 0.00 0.00 58.87 58.71 1jyl n SER 213 Cb 0.49 0.04 -0.15 0.00 -0.26 0.00 0.00 64.21 64.32 1jyl n SER 213 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1jyl s ILE 214 N -1.91 1.95 -0.22 -1.33 1.01 -1.26 0.11 121.20 119.56 1jyl s ILE 214 Ca 0.00 -1.44 -0.06 0.00 0.00 0.00 0.00 60.65 59.16 1jyl s ILE 214 Cb 0.00 -2.08 -0.02 0.00 0.01 0.00 0.00 42.46 40.37 1jyl s ILE 214 CO 0.00 0.00 0.01 -0.47 0.00 0.00 0.00 174.94 174.49 1jyl s TYR 215 N 1.21 3.04 -0.05 3.97 5.04 0.10 -4.94 117.35 125.73 1jyl s TYR 215 Ca -0.07 -0.54 -0.19 0.00 -2.44 0.00 0.00 57.07 53.84 1jyl s TYR 215 Cb -0.19 -2.14 -0.05 0.00 0.35 0.00 0.00 41.96 39.93 1jyl s TYR 215 CO -0.06 -0.34 0.53 -2.00 -1.34 0.00 0.00 175.55 172.34 1jyl s GLU 216 N 1.29 4.27 -0.40 4.97 2.12 -1.26 -0.47 118.70 129.21 1jyl s GLU 216 Ca 0.04 0.59 -0.02 0.00 0.36 0.00 0.00 54.97 55.94 1jyl s GLU 216 Cb -0.15 -3.36 0.11 0.00 0.26 0.00 0.00 34.13 30.99 1jyl s GLU 216 CO 0.01 0.33 0.19 0.42 -0.54 0.00 0.00 175.26 175.67 1jyl s ILE 217 N 0.00 3.22 -1.09 -3.70 1.01 -0.96 -4.88 121.20 114.80 1jyl s ILE 217 Ca 0.28 -2.05 0.10 0.00 0.00 0.00 0.00 60.65 58.98 1jyl s ILE 217 Cb -0.17 -3.21 0.04 0.00 0.01 0.00 0.00 42.46 39.14 1jyl s ILE 217 CO 0.14 -0.67 0.73 0.47 0.00 0.00 0.00 174.94 175.61 1jyl n ASP 218 N 4.58 1.54 -3.53 3.58 10.43 -1.26 -4.91 116.55 126.98 1jyl n ASP 218 Ca -0.02 -1.27 -0.16 0.00 2.57 0.00 0.00 54.79 55.91 1jyl n ASP 218 Cb 0.41 0.22 -0.06 0.00 1.84 0.00 0.00 41.12 43.54 1jyl n ASP 218 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1jyl s SER 219 N -1.07 -0.59 0.63 -2.24 1.04 -1.26 -4.33 113.70 105.88 1jyl s SER 219 Ca 0.10 0.62 0.22 0.00 0.48 0.00 0.00 55.95 57.37 1jyl s SER 219 Cb 0.08 0.49 1.01 0.00 0.10 0.00 0.00 66.02 67.70 1jyl s SER 219 CO 0.18 -0.56 1.52 0.58 0.98 0.00 0.00 173.24 175.94 1jyl h VAL 220 N 2.86 0.09 -0.02 5.02 2.07 -1.83 0.27 116.25 124.71 1jyl h VAL 220 Ca -0.25 0.00 -0.22 0.00 0.82 0.00 0.00 66.70 67.05 1jyl h VAL 220 Cb 1.15 0.31 0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1jyl h VAL 220 CO 0.37 0.00 -0.84 -0.61 0.02 0.00 0.00 177.57 176.51 1jyl h GLN 221 N 0.00 0.60 0.01 1.57 5.75 -1.95 -1.21 115.11 119.89 1jyl h GLN 221 Ca 0.20 -0.62 -0.00 0.00 -0.15 0.00 0.00 58.65 58.08 1jyl h GLN 221 Cb 1.78 0.17 0.00 0.00 1.07 0.00 0.00 27.48 30.50 1jyl h GLN 221 CO -0.00 1.23 -0.01 -0.44 -2.65 0.00 0.00 178.83 176.96 1jyl h ASP 222 N 0.22 -0.02 -0.93 -0.69 3.32 -0.84 0.27 116.42 117.76 1jyl h ASP 222 Ca -0.10 -0.08 0.18 0.00 0.02 0.00 0.00 57.03 57.06 1jyl h ASP 222 Cb 1.51 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.99 1jyl h ASP 222 CO 0.17 0.07 0.60 0.22 -1.72 0.00 0.00 179.24 178.57 1jyl h TYR 223 N -0.10 0.76 -0.27 4.55 3.20 -1.41 0.25 116.97 123.96 1jyl h TYR 223 Ca -0.00 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.76 1jyl h TYR 223 Cb 0.09 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 1jyl h TYR 223 CO -0.05 0.22 -0.39 0.00 -1.64 0.00 0.00 178.16 176.30 1jyl h ARG 224 N 0.59 0.62 0.11 1.82 2.47 0.18 -2.42 114.38 117.75 1jyl h ARG 224 Ca 0.49 -0.31 -0.01 0.00 -1.26 0.00 0.00 59.98 58.90 1jyl h ARG 224 Cb 0.96 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.28 1jyl h ARG 224 CO -0.23 0.90 -0.05 0.87 0.56 0.00 0.00 179.97 182.02 1jyl h LYS 225 N 0.51 -0.14 -1.75 0.04 1.57 0.27 -3.08 116.57 114.00 1jyl h LYS 225 Ca 0.05 0.01 0.52 0.00 -1.87 0.00 0.00 60.65 59.35 1jyl h LYS 225 Cb 0.90 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 33.15 1jyl h LYS 225 CO 0.08 -0.09 1.24 1.25 -0.57 0.00 0.00 179.45 181.36 1jyl h LEU 226 N -0.24 0.04 0.51 2.94 5.85 -1.03 0.74 115.31 124.12 1jyl h LEU 226 Ca -0.01 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 1jyl h LEU 226 Cb 0.11 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1jyl h LEU 226 CO 0.02 -0.03 -0.45 -0.08 -0.34 0.00 0.00 178.44 177.57 1jyl h GLU 227 N 0.01 -0.90 -0.41 1.25 4.81 -1.38 -2.37 114.58 115.59 1jyl h GLU 227 Ca 0.86 0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 60.13 1jyl h GLU 227 Cb 3.35 0.21 -0.02 0.00 0.63 0.00 0.00 28.75 32.91 1jyl h GLU 227 CO -0.08 -0.60 0.18 1.05 -0.73 0.00 0.00 179.01 178.83 1jyl h GLU 228 N -0.94 0.60 -1.06 1.92 -0.00 0.53 -2.19 114.58 113.44 1jyl h GLU 228 Ca -0.07 -0.10 0.29 0.00 -0.00 0.00 0.00 59.36 59.48 1jyl h GLU 228 Cb 0.80 -0.10 -0.11 0.00 -0.00 0.00 0.00 28.75 29.34 1jyl h GLU 228 CO -0.02 0.55 0.67 0.82 -0.00 0.00 0.00 179.01 181.03 1jyl h ILE 229 N 0.52 0.46 0.00 -1.06 2.04 -1.17 1.81 117.51 120.11 1jyl h ILE 229 Ca 0.14 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1jyl h ILE 229 Cb 0.16 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.29 1jyl h ILE 229 CO -0.01 0.07 -0.02 0.18 0.00 0.00 0.00 178.15 178.36 1jyl n LEU 230 N -4.71 0.75 0.00 1.44 4.77 -0.87 -5.09 117.00 113.29 1jyl n LEU 230 Ca 0.27 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.81 1jyl n LEU 230 Cb 0.92 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1jyl n LEU 230 CO 0.22 -0.16 0.00 2.29 -1.33 0.00 0.00 177.39 178.41