#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j91 s LYS 8 N 0.00 0.64 0.31 -1.46 1.02 -1.26 -4.27 119.74 114.72 1j91 s LYS 8 Ca 0.00 -0.75 -0.29 0.00 0.02 0.00 0.00 55.97 54.95 1j91 s LYS 8 Cb 0.00 -0.52 -0.12 0.00 -0.52 0.00 0.00 37.83 36.68 1j91 s LYS 8 CO 0.00 0.11 1.53 0.00 -0.92 0.00 0.00 175.35 176.07 1j91 n ALA 9 N 1.62 2.27 0.11 5.17 0.00 -1.26 -4.90 120.51 123.52 1j91 n ALA 9 Ca -0.21 0.37 -0.02 0.00 0.00 0.00 0.00 53.44 53.58 1j91 n ALA 9 Cb 0.55 -2.42 0.21 0.00 0.00 0.00 0.00 19.45 17.79 1j91 n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j91 h ARG 10 N 4.07 0.16 -5.45 0.00 3.08 -1.97 -3.41 114.38 110.85 1j91 h ARG 10 Ca -0.48 -0.09 -0.42 0.00 0.07 0.00 0.00 59.98 59.06 1j91 h ARG 10 Cb 1.24 0.01 -0.15 0.00 0.08 0.00 0.00 29.97 31.14 1j91 h ARG 10 CO 0.74 0.62 -0.74 0.14 -1.07 0.00 0.00 179.97 179.66 1j91 s VAL 11 N -3.95 1.56 -1.47 2.04 -7.23 -1.26 -4.84 120.40 105.25 1j91 s VAL 11 Ca -0.03 -2.09 -0.16 0.00 -1.81 0.00 0.00 61.98 57.88 1j91 s VAL 11 Cb 0.13 -1.92 0.14 0.00 0.56 0.00 0.00 36.38 35.29 1j91 s VAL 11 CO 0.77 -0.59 0.58 -1.22 -0.31 0.00 0.00 175.10 174.33 1j91 n TYR 12 N -0.17 -1.63 -0.15 2.82 4.01 -1.26 -4.86 117.16 115.91 1j91 n TYR 12 Ca -0.10 0.60 -0.11 0.00 -0.16 0.00 0.00 57.90 58.14 1j91 n TYR 12 Cb 0.60 -2.46 -0.01 0.00 -0.31 0.00 0.00 39.34 37.16 1j91 n TYR 12 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1j91 h ALA 13 N 0.93 0.61 -0.55 -0.72 0.00 -1.88 -3.25 119.26 114.39 1j91 h ALA 13 Ca -0.49 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1j91 h ALA 13 Cb 1.32 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1j91 h ALA 13 CO 0.67 0.48 0.00 -0.25 0.00 0.00 0.00 179.25 180.15 1j91 n ASP 14 N -4.30 3.39 -0.07 0.00 8.00 -1.26 -4.37 116.55 117.93 1j91 n ASP 14 Ca -0.00 -1.98 -0.14 0.00 0.71 0.00 0.00 54.79 53.37 1j91 n ASP 14 Cb 0.36 -0.36 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 1j91 n ASP 14 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1j91 h VAL 15 N 3.92 0.00 0.00 2.53 2.07 -1.92 -0.49 116.25 122.37 1j91 h VAL 15 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1j91 h VAL 15 Cb 0.89 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1j91 h VAL 15 CO 0.00 0.00 -0.07 0.78 0.02 0.00 0.00 177.57 178.30 1j91 h ASN 16 N -0.49 0.00 -0.31 0.57 2.35 -1.83 -2.57 115.58 113.30 1j91 h ASN 16 Ca 0.05 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.63 1j91 h ASN 16 Cb 0.64 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.01 1j91 h ASN 16 CO -0.52 0.07 -0.46 0.58 -1.65 0.00 0.00 177.43 175.45 1j91 h VAL 17 N 0.00 1.27 0.00 2.81 2.07 -1.44 -3.19 116.25 117.78 1j91 h VAL 17 Ca -0.00 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.88 1j91 h VAL 17 Cb 0.14 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1j91 h VAL 17 CO 0.01 0.54 0.00 0.25 0.02 0.00 0.00 177.57 178.39 1j91 h LEU 18 N 0.70 0.00-10.24 2.57 5.85 -0.89 -3.46 115.31 109.84 1j91 h LEU 18 Ca 0.04 0.00 -0.48 0.00 0.84 0.00 0.00 57.88 58.28 1j91 h LEU 18 Cb 1.06 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.10 1j91 h LEU 18 CO 0.11 0.00 -0.14 -0.13 -0.34 0.00 0.00 178.44 177.94 1j91 s ARG 19 N -3.15 3.50 0.78 1.25 0.52 -1.08 -5.06 118.95 115.71 1j91 s ARG 19 Ca 0.09 -0.23 -0.15 0.00 -0.52 0.00 0.00 55.73 54.93 1j91 s ARG 19 Cb 0.11 -2.62 0.02 0.00 0.52 0.00 0.00 34.95 32.99 1j91 s ARG 19 CO 0.57 0.10 0.81 -2.30 0.02 0.00 0.00 175.30 174.49 1j91 n PRO 20 N -1.81 0.22 -0.08 3.54 -0.02 -1.26 -4.91 135.00 130.68 1j91 n PRO 20 Ca -0.04 0.13 -0.07 0.00 -2.02 0.00 0.00 63.50 61.50 1j91 n PRO 20 Cb 0.56 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 1j91 n PRO 20 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1j91 h LYS 21 N -0.69 0.17 0.00 -0.52 3.64 -1.96 -2.24 116.57 114.98 1j91 h LYS 21 Ca -0.46 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1j91 h LYS 21 Cb 1.32 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1j91 h LYS 21 CO 0.43 0.11 0.00 1.05 -2.27 0.00 0.00 179.45 178.78 1j91 h GLU 22 N 0.18 0.00 0.14 1.90 4.11 -1.91 -2.05 114.58 116.95 1j91 h GLU 22 Ca 0.14 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.56 1j91 h GLU 22 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1j91 h GLU 22 CO -0.18 0.00 -0.07 -0.92 0.07 0.00 0.00 179.01 177.92 1j91 h TYR 23 N 0.00 -0.17 -0.01 2.06 3.20 -1.75 -3.20 116.97 117.09 1j91 h TYR 23 Ca 0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1j91 h TYR 23 Cb 0.04 0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.37 1j91 h TYR 23 CO 0.00 -0.07 -0.50 -2.67 -1.64 0.00 0.00 178.16 173.27 1j91 n TRP 24 N -5.15 0.00 -2.08 -3.82 4.27 -1.14 -4.73 117.44 104.79 1j91 n TRP 24 Ca -0.08 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.10 1j91 n TRP 24 Cb 0.11 -0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.06 1j91 n TRP 24 CO 0.00 0.00 0.00 -3.47 -2.29 0.00 0.00 177.69 171.93 1j91 n ASP 25 N -0.10 4.32 0.10 -0.67 2.03 -0.78 -4.69 116.55 116.75 1j91 n ASP 25 Ca 0.09 -2.88 0.01 0.00 0.52 0.00 0.00 54.79 52.53 1j91 n ASP 25 Cb 0.46 -1.69 0.32 0.00 -0.72 0.00 0.00 41.12 39.50 1j91 n ASP 25 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 1j91 h TYR 26 N 6.58 0.27 -0.63 -0.67 -0.00 -1.85 -2.27 116.97 118.41 1j91 h TYR 26 Ca 0.52 -0.05 -0.01 0.00 0.00 0.00 0.00 58.73 59.19 1j91 h TYR 26 Cb 0.73 -0.07 -0.03 0.00 0.00 0.00 0.00 36.73 37.36 1j91 h TYR 26 CO 1.44 0.47 0.35 0.93 -0.00 0.00 0.00 178.16 181.35 1j91 h GLU 27 N 0.23 0.87 -1.89 0.10 5.08 -1.88 -2.42 114.58 114.67 1j91 h GLU 27 Ca 0.04 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1j91 h GLU 27 Cb 0.55 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1j91 h GLU 27 CO 0.04 0.66 0.09 0.00 -1.00 0.00 0.00 179.01 178.80 1j91 n ALA 28 N -2.32 4.24 -2.44 3.43 0.00 -0.85 -4.83 120.51 117.74 1j91 n ALA 28 Ca 0.04 -0.37 -0.27 0.00 0.00 0.00 0.00 53.44 52.85 1j91 n ALA 28 Cb 0.08 -1.08 -0.15 0.00 0.00 0.00 0.00 19.45 18.31 1j91 n ALA 28 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1j91 s LEU 29 N -0.41 2.13 -0.28 0.00 2.96 -0.91 -5.00 118.68 117.17 1j91 s LEU 29 Ca 0.07 -0.50 -0.01 0.00 -0.22 0.00 0.00 54.13 53.47 1j91 s LEU 29 Cb 0.05 -1.06 0.04 0.00 0.50 0.00 0.00 46.19 45.73 1j91 s LEU 29 CO -0.00 0.20 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.32 1j91 s THR 30 N -0.72 2.91 -0.31 3.68 2.01 -1.26 -5.06 115.64 116.88 1j91 s THR 30 Ca 0.08 -1.27 -0.40 0.00 0.31 0.00 0.00 61.69 60.41 1j91 s THR 30 Cb -0.09 -2.61 -0.15 0.00 0.01 0.00 0.00 72.50 69.66 1j91 s THR 30 CO 0.01 0.00 1.83 0.52 -0.69 0.00 0.00 174.62 176.29 1j91 n VAL 31 N 4.63 0.27 -2.89 3.82 0.31 -1.26 -4.87 118.33 118.33 1j91 n VAL 31 Ca -0.14 -0.08 -0.44 0.00 -0.01 0.00 0.00 64.34 63.67 1j91 n VAL 31 Cb 0.45 -1.22 -0.01 0.00 -0.91 0.00 0.00 33.84 32.14 1j91 n VAL 31 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1j91 s GLN 32 N 4.05 3.81 1.25 5.55 -0.21 -1.26 -5.01 119.66 127.84 1j91 s GLN 32 Ca 1.01 -2.04 -0.21 0.00 0.02 0.00 0.00 55.36 54.14 1j91 s GLN 32 Cb -1.08 -5.04 0.32 0.00 1.00 0.00 0.00 33.01 28.21 1j91 s GLN 32 CO 0.64 -1.83 0.86 0.91 -2.12 0.00 0.00 175.29 173.76 1j91 n TRP 33 N 6.48 -3.71 -2.59 0.91 7.02 -1.26 -4.69 117.44 119.61 1j91 n TRP 33 Ca 0.31 -0.80 0.00 0.00 -1.02 0.00 0.00 57.50 55.99 1j91 n TRP 33 Cb 0.47 -1.09 0.00 0.00 -2.42 0.00 0.00 31.31 28.26 1j91 n TRP 33 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1j91 n GLY 34 N -4.81 4.79 3.37 6.99 0.00 0.04 -4.87 105.19 110.70 1j91 n GLY 34 Ca 0.13 -1.23 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 1j91 n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j91 s GLU 35 N 1.20 3.44 0.56 1.61 0.41 -1.26 -4.68 118.70 119.98 1j91 s GLU 35 Ca 0.00 -0.61 0.27 0.00 -0.41 0.00 0.00 54.97 54.22 1j91 s GLU 35 Cb 0.00 -3.22 1.63 0.00 -1.78 0.00 0.00 34.13 30.76 1j91 s GLU 35 CO 0.00 -0.24 2.18 0.37 -0.49 0.00 0.00 175.26 177.08 1j91 h GLN 36 N 8.19 0.00 0.00 1.61 4.15 -1.93 -2.14 115.11 124.99 1j91 h GLN 36 Ca -0.38 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.04 1j91 h GLN 36 Cb 1.16 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.85 1j91 h GLN 36 CO 0.59 0.04 0.00 -0.25 -1.93 0.00 0.00 178.83 177.28 1j91 n ASP 37 N -3.89 0.65 0.18 -0.69 10.43 -1.26 -2.19 116.55 119.77 1j91 n ASP 37 Ca -0.03 0.72 0.13 0.00 2.57 0.00 0.00 54.79 58.18 1j91 n ASP 37 Cb 0.13 -0.84 0.32 0.00 1.84 0.00 0.00 41.12 42.58 1j91 n ASP 37 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 1j91 h ASP 38 N 0.00 0.00 -3.59 -2.24 3.32 -1.79 -3.45 116.42 108.68 1j91 h ASP 38 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 1j91 h ASP 38 Cb 0.21 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 39.43 1j91 h ASP 38 CO 0.00 0.00 -0.84 -0.31 -1.72 0.00 0.00 179.24 176.37 1j91 s TYR 39 N -3.22 1.78 -0.11 4.55 2.02 -0.93 -1.71 117.35 119.73 1j91 s TYR 39 Ca 0.08 -0.62 0.03 0.00 -0.37 0.00 0.00 57.07 56.19 1j91 s TYR 39 Cb 0.08 -1.23 0.01 0.00 -0.40 0.00 0.00 41.96 40.42 1j91 s TYR 39 CO 0.61 -0.26 -0.22 -1.21 -1.57 0.00 0.00 175.55 172.90 1j91 s GLU 40 N 0.36 2.88 0.30 -0.62 2.02 -0.72 -4.97 118.70 117.95 1j91 s GLU 40 Ca -0.11 -0.81 -0.29 0.00 0.02 0.00 0.00 54.97 53.77 1j91 s GLU 40 Cb -0.15 -2.24 -0.11 0.00 0.10 0.00 0.00 34.13 31.73 1j91 s GLU 40 CO 0.04 0.09 1.47 0.08 0.02 0.00 0.00 175.26 176.96 1j91 s VAL 41 N 0.56 2.36 -0.05 2.63 1.01 -1.26 -2.36 120.40 123.28 1j91 s VAL 41 Ca -0.14 0.33 -0.01 0.00 0.00 0.00 0.00 61.98 62.15 1j91 s VAL 41 Cb -0.17 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 1j91 s VAL 41 CO 0.05 0.06 -0.06 0.52 0.00 0.00 0.00 175.10 175.67 1j91 n VAL 42 N 1.59 0.28 -3.58 2.92 0.31 -0.46 -4.94 118.33 114.46 1j91 n VAL 42 Ca 0.05 -0.09 -0.11 0.00 -0.01 0.00 0.00 64.34 64.18 1j91 n VAL 42 Cb 0.39 -1.21 -0.05 0.00 -0.91 0.00 0.00 33.84 32.06 1j91 n VAL 42 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1j91 s ARG 43 N -2.09 0.62 0.24 5.55 3.00 -1.09 -5.00 118.95 120.18 1j91 s ARG 43 Ca -0.07 0.21 -0.30 0.00 -1.00 0.00 0.00 55.73 54.57 1j91 s ARG 43 Cb 0.02 0.29 -0.09 0.00 0.00 0.00 0.00 34.95 35.18 1j91 s ARG 43 CO 0.10 -0.18 1.13 0.21 0.00 0.00 0.00 175.30 176.55 1j91 s LYS 44 N -0.95 4.59 0.00 5.12 2.20 -1.26 0.11 119.74 129.55 1j91 s LYS 44 Ca -0.02 1.81 0.00 0.00 -0.36 0.00 0.00 55.97 57.40 1j91 s LYS 44 Cb -0.01 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.10 1j91 s LYS 44 CO 0.01 0.11 0.50 1.33 -0.36 0.00 0.00 175.35 176.94 1j91 n VAL 45 N 1.70 0.22 -0.34 4.02 0.24 -0.45 -4.85 118.33 118.87 1j91 n VAL 45 Ca 0.01 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.03 1j91 n VAL 45 Cb 0.45 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.94 1j91 n VAL 45 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1j91 n GLY 46 N -0.11 -2.46 3.46 7.63 0.00 -1.10 -5.00 105.19 107.62 1j91 n GLY 46 Ca 0.00 -1.25 -0.10 0.00 0.00 0.00 0.00 46.02 44.67 1j91 n GLY 46 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1j91 s ARG 47 N -1.96 1.29 0.33 1.61 3.03 -1.26 -0.61 118.95 121.38 1j91 s ARG 47 Ca 0.00 -0.82 0.03 0.00 2.03 0.00 0.00 55.73 56.97 1j91 s ARG 47 Cb 0.00 0.51 -0.01 0.00 -1.03 0.00 0.00 34.95 34.42 1j91 s ARG 47 CO 0.00 -0.54 0.09 0.41 -1.13 0.00 0.00 175.30 174.14 1j91 n GLY 48 N -0.31 3.48 0.23 3.88 0.00 0.16 -4.90 105.19 107.73 1j91 n GLY 48 Ca -0.12 -2.11 0.11 0.00 0.00 0.00 0.00 46.02 43.90 1j91 n GLY 48 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j91 h LYS 49 N 0.00 0.00 -0.31 1.61 1.79 -2.03 -3.25 116.57 114.39 1j91 h LYS 49 Ca -0.26 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 57.97 1j91 h LYS 49 Cb 0.95 0.00 -0.36 0.00 -1.58 0.00 0.00 32.23 31.24 1j91 h LYS 49 CO 0.41 0.19 -0.98 0.66 -1.08 0.00 0.00 179.45 178.66 1j91 n TYR 50 N -3.43 0.99 -3.58 -1.35 4.02 -1.26 -5.08 117.16 107.46 1j91 n TYR 50 Ca -0.00 -1.59 0.02 0.00 -0.01 0.00 0.00 57.90 56.31 1j91 n TYR 50 Cb 0.38 -0.23 -0.00 0.00 -0.02 0.00 0.00 39.34 39.47 1j91 n TYR 50 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1j91 s SER 51 N -3.17 -0.03 0.08 7.72 1.04 -1.23 -1.90 113.70 116.22 1j91 s SER 51 Ca 0.34 -0.05 0.10 0.00 0.48 0.00 0.00 55.95 56.82 1j91 s SER 51 Cb 0.36 0.06 -0.03 0.00 0.10 0.00 0.00 66.02 66.51 1j91 s SER 51 CO -0.07 -0.12 -0.26 -1.61 0.98 0.00 0.00 173.24 172.17 1j91 s GLU 52 N -2.17 1.66 -0.06 4.02 2.02 -0.94 0.35 118.70 123.58 1j91 s GLU 52 Ca 0.14 -1.20 0.05 0.00 0.02 0.00 0.00 54.97 53.98 1j91 s GLU 52 Cb 0.06 -1.97 -0.00 0.00 0.10 0.00 0.00 34.13 32.32 1j91 s GLU 52 CO -0.05 0.49 -0.22 0.08 0.02 0.00 0.00 175.26 175.58 1j91 s VAL 53 N -0.92 1.83 0.15 2.63 1.01 0.22 -1.66 120.40 123.67 1j91 s VAL 53 Ca 0.13 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.25 1j91 s VAL 53 Cb -0.10 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1j91 s VAL 53 CO 0.04 0.51 -0.15 -0.36 0.00 0.00 0.00 175.10 175.14 1j91 s PHE 54 N 0.05 1.58 0.11 5.22 0.08 0.25 -1.34 117.98 123.93 1j91 s PHE 54 Ca -0.08 -0.54 -0.15 0.00 0.12 0.00 0.00 56.93 56.28 1j91 s PHE 54 Cb -0.14 -0.79 -0.07 0.00 -0.57 0.00 0.00 43.02 41.45 1j91 s PHE 54 CO 0.04 0.23 0.53 -2.00 -0.10 0.00 0.00 175.22 173.93 1j91 s GLU 55 N -2.95 4.00 0.23 0.44 2.12 0.12 -0.15 118.70 122.51 1j91 s GLU 55 Ca 0.14 0.51 -0.01 0.00 0.36 0.00 0.00 54.97 55.97 1j91 s GLU 55 Cb -0.04 -3.03 0.00 0.00 0.26 0.00 0.00 34.13 31.33 1j91 s GLU 55 CO 0.05 0.54 0.31 0.41 -0.54 0.00 0.00 175.26 176.03 1j91 n GLY 56 N 1.09 2.53 3.16 -1.50 0.00 -0.02 -1.35 105.19 109.11 1j91 n GLY 56 Ca -0.07 -1.57 -0.10 0.00 0.00 0.00 0.00 46.02 44.27 1j91 n GLY 56 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1j91 s ILE 57 N -2.71 0.67 -0.38 -0.61 -0.00 -1.00 -1.44 121.20 115.74 1j91 s ILE 57 Ca 0.20 -1.90 -0.14 0.00 -0.00 0.00 0.00 60.65 58.81 1j91 s ILE 57 Cb -0.00 -1.64 0.00 0.00 -0.00 0.00 0.00 42.46 40.82 1j91 s ILE 57 CO 0.15 -0.86 0.27 0.21 -0.00 0.00 0.00 174.94 174.70 1j91 s ASN 58 N -2.99 6.05 0.60 4.36 3.04 0.10 -1.75 114.94 124.34 1j91 s ASN 58 Ca 0.11 -0.70 0.30 0.00 0.04 0.00 0.00 52.86 52.61 1j91 s ASN 58 Cb 0.05 -2.14 1.81 0.00 -1.54 0.00 0.00 41.25 39.43 1j91 s ASN 58 CO -0.05 -0.35 2.21 -0.37 -3.04 0.00 0.00 177.10 175.50 1j91 h VAL 59 N 5.59 0.47 0.19 -5.21 -1.51 -1.64 1.32 116.25 115.45 1j91 h VAL 59 Ca -0.29 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.17 1j91 h VAL 59 Cb 1.14 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 1j91 h VAL 59 CO 0.68 0.00 -0.09 0.78 -1.23 0.00 0.00 177.57 177.71 1j91 h ASN 60 N 0.00 -0.21 -0.30 4.19 4.21 -1.93 -3.37 115.58 118.17 1j91 h ASN 60 Ca 0.03 -0.32 0.00 0.00 1.21 0.00 0.00 56.30 57.22 1j91 h ASN 60 Cb 0.17 0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.42 1j91 h ASN 60 CO -0.00 0.31 0.00 -0.46 -1.29 0.00 0.00 177.43 175.99 1j91 n ASN 61 N -4.96 2.78 -2.85 5.81 0.23 -1.13 -4.99 115.26 110.15 1j91 n ASN 61 Ca -0.08 -1.91 -0.19 0.00 -0.53 0.00 0.00 54.58 51.87 1j91 n ASN 61 Cb 0.26 -0.20 0.00 0.00 -2.08 0.00 0.00 39.78 37.77 1j91 n ASN 61 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1j91 n ASN 62 N 0.55 -4.61 -4.90 0.53 3.02 0.45 -4.97 115.26 105.34 1j91 n ASN 62 Ca 0.11 -0.12 -0.32 0.00 -0.03 0.00 0.00 54.58 54.22 1j91 n ASN 62 Cb 0.41 -3.82 -0.05 0.00 -0.61 0.00 0.00 39.78 35.71 1j91 n ASN 62 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1j91 s GLU 63 N -5.49 3.39 0.80 3.52 2.02 -1.21 -4.78 118.70 116.95 1j91 s GLU 63 Ca 0.19 -0.42 -0.11 0.00 0.02 0.00 0.00 54.97 54.65 1j91 s GLU 63 Cb -0.10 -3.03 0.07 0.00 0.10 0.00 0.00 34.13 31.17 1j91 s GLU 63 CO 0.24 0.63 1.09 0.15 0.02 0.00 0.00 175.26 177.38 1j91 s LYS 64 N -2.29 2.08 0.17 1.61 1.02 -1.26 0.00 119.74 121.08 1j91 s LYS 64 Ca 0.32 0.89 -0.24 0.00 0.02 0.00 0.00 55.97 56.96 1j91 s LYS 64 Cb -0.13 -1.90 0.06 0.00 -0.52 0.00 0.00 37.83 35.34 1j91 s LYS 64 CO 0.24 -1.69 0.91 0.00 -0.92 0.00 0.00 175.35 173.90 1j91 s ILE 66 N -3.40 3.48 -0.28 0.00 -1.09 0.06 -0.84 121.20 119.14 1j91 s ILE 66 Ca 0.12 -0.51 -0.04 0.00 -2.23 0.00 0.00 60.65 57.99 1j91 s ILE 66 Cb -0.02 -2.49 0.02 0.00 -1.58 0.00 0.00 42.46 38.39 1j91 s ILE 66 CO 0.03 0.51 0.01 -0.63 -1.23 0.00 0.00 174.94 173.63 1j91 s ILE 67 N 0.28 3.39 -0.39 2.92 1.01 0.78 -0.85 121.20 128.34 1j91 s ILE 67 Ca -0.06 -0.92 -0.11 0.00 0.00 0.00 0.00 60.65 59.56 1j91 s ILE 67 Cb -0.15 -2.76 0.04 0.00 0.01 0.00 0.00 42.46 39.60 1j91 s ILE 67 CO 0.04 0.11 0.23 -0.75 0.00 0.00 0.00 174.94 174.57 1j91 s LYS 68 N 1.40 2.79 -0.37 2.79 2.20 0.44 -0.58 119.74 128.41 1j91 s LYS 68 Ca 0.01 -1.17 -0.20 0.00 -0.36 0.00 0.00 55.97 54.24 1j91 s LYS 68 Cb -0.17 -3.78 0.01 0.00 -1.51 0.00 0.00 37.83 32.37 1j91 s LYS 68 CO -0.01 -0.78 0.61 0.42 -0.36 0.00 0.00 175.35 175.24 1j91 s ILE 69 N 1.54 4.90 0.27 5.43 1.01 -0.66 0.30 121.20 134.00 1j91 s ILE 69 Ca 0.02 0.44 -0.21 0.00 0.00 0.00 0.00 60.65 60.90 1j91 s ILE 69 Cb -0.20 -4.08 -0.09 0.00 0.01 0.00 0.00 42.46 38.10 1j91 s ILE 69 CO 0.06 -0.35 0.81 -0.76 0.00 0.00 0.00 174.94 174.69 1j91 s LEU 70 N 2.67 4.29 0.72 2.97 1.02 -1.24 -2.22 118.68 126.89 1j91 s LEU 70 Ca 0.23 1.55 -0.08 0.00 0.02 0.00 0.00 54.13 55.86 1j91 s LEU 70 Cb -0.15 -3.82 0.06 0.00 0.02 0.00 0.00 46.19 42.31 1j91 s LEU 70 CO 0.15 -0.04 1.04 -0.54 0.02 0.00 0.00 176.35 176.98 1j91 s LYS 71 N -2.16 2.20 0.64 1.70 -0.14 -0.80 -4.01 119.74 117.18 1j91 s LYS 71 Ca 0.47 -0.17 0.25 0.00 -1.36 0.00 0.00 55.97 55.16 1j91 s LYS 71 Cb -0.16 -2.13 1.30 0.00 -1.68 0.00 0.00 37.83 35.15 1j91 s LYS 71 CO 0.21 -1.28 1.74 -1.35 -0.76 0.00 0.00 175.35 173.91 1j91 h PRO 72 N -0.66 0.00 -0.57 -1.68 0.11 -1.98 -3.43 132.00 123.79 1j91 h PRO 72 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 1j91 h PRO 72 Cb 1.32 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 1j91 h PRO 72 CO 0.61 0.00 0.13 0.28 -0.21 0.00 0.00 178.00 178.81 1j91 n VAL 73 N -3.07 0.00 -0.60 3.15 0.31 -1.26 -4.45 118.33 112.41 1j91 n VAL 73 Ca 0.03 -0.06 0.04 0.00 -0.01 0.00 0.00 64.34 64.34 1j91 n VAL 73 Cb 0.62 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.55 1j91 n VAL 73 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1j91 n LYS 74 N 0.53 -0.53 -0.03 5.55 4.81 -1.26 -4.28 118.16 122.95 1j91 n LYS 74 Ca 0.01 0.35 -0.03 0.00 -0.87 0.00 0.00 58.31 57.77 1j91 n LYS 74 Cb 0.05 -0.64 -0.01 0.00 0.02 0.00 0.00 35.03 34.45 1j91 n LYS 74 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1j91 n LYS 75 N -1.17 0.18 0.15 1.64 4.81 -1.26 -4.26 118.16 118.24 1j91 n LYS 75 Ca 0.00 0.21 0.12 0.00 -0.87 0.00 0.00 58.31 57.77 1j91 n LYS 75 Cb 0.12 -0.96 0.53 0.00 0.02 0.00 0.00 35.03 34.74 1j91 n LYS 75 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 1j91 h LYS 76 N -0.37 0.00 -0.10 1.64 2.10 -1.98 -1.29 116.57 116.58 1j91 h LYS 76 Ca 0.00 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.47 1j91 h LYS 76 Cb 0.28 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.60 1j91 h LYS 76 CO 0.00 0.00 -0.69 -0.22 -2.00 0.00 0.00 179.45 176.54 1j91 h LYS 77 N 0.00 0.42 -0.47 0.07 3.64 -1.81 -0.76 116.57 117.65 1j91 h LYS 77 Ca 0.00 -0.32 -0.10 0.00 -1.27 0.00 0.00 60.65 58.95 1j91 h LYS 77 Cb 0.31 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1j91 h LYS 77 CO 0.00 0.95 -0.11 0.82 -2.27 0.00 0.00 179.45 178.84 1j91 h ILE 78 N 0.29 1.27 0.00 2.00 2.04 -1.44 -2.29 117.51 119.38 1j91 h ILE 78 Ca -0.02 -1.24 -0.07 0.00 1.00 0.00 0.00 64.86 64.52 1j91 h ILE 78 Cb 1.25 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 1j91 h ILE 78 CO 0.12 0.43 -0.35 0.11 0.00 0.00 0.00 178.15 178.45 1j91 h LYS 79 N 0.76 0.00 0.07 2.37 1.57 -1.25 -2.27 116.57 117.82 1j91 h LYS 79 Ca 0.12 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1j91 h LYS 79 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1j91 h LYS 79 CO 0.05 0.35 -0.03 -0.09 -0.57 0.00 0.00 179.45 179.16 1j91 h ARG 80 N 0.00 -0.09 -0.61 3.15 2.43 -0.86 -2.05 114.38 116.35 1j91 h ARG 80 Ca -0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1j91 h ARG 80 Cb 0.65 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 1j91 h ARG 80 CO 0.05 0.41 0.40 1.49 -1.51 0.00 0.00 179.97 180.81 1j91 h GLU 81 N -0.67 0.80 -0.35 0.20 4.81 -1.38 -0.72 114.58 117.28 1j91 h GLU 81 Ca -0.01 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1j91 h GLU 81 Cb 0.55 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1j91 h GLU 81 CO 0.02 0.54 0.20 0.82 -0.73 0.00 0.00 179.01 179.85 1j91 h ILE 82 N 0.82 1.14 -0.31 2.32 2.04 -1.48 0.22 117.51 122.27 1j91 h ILE 82 Ca 0.22 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1j91 h ILE 82 Cb -0.09 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1j91 h ILE 82 CO -0.05 0.14 0.20 0.50 0.00 0.00 0.00 178.15 178.94 1j91 h LYS 83 N 0.45 0.41 -0.55 2.37 1.63 -1.09 -0.04 116.57 119.74 1j91 h LYS 83 Ca 0.12 -0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 59.86 1j91 h LYS 83 Cb 0.05 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.57 1j91 h LYS 83 CO -0.02 0.28 0.22 0.82 -3.45 0.00 0.00 179.45 177.30 1j91 h ILE 84 N 0.41 1.22 -0.65 2.00 2.04 -1.00 -0.60 117.51 120.94 1j91 h ILE 84 Ca 0.11 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 1j91 h ILE 84 Cb -0.04 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 1j91 h ILE 84 CO -0.02 0.27 0.34 -0.07 0.00 0.00 0.00 178.15 178.67 1j91 h LEU 85 N 0.75 0.81 -0.57 1.44 3.38 -0.51 -1.70 115.31 118.91 1j91 h LEU 85 Ca 0.18 -0.07 -0.16 0.00 0.09 0.00 0.00 57.88 57.93 1j91 h LEU 85 Cb 0.21 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1j91 h LEU 85 CO -0.01 0.66 -0.64 1.56 0.09 0.00 0.00 178.44 180.10 1j91 h GLN 86 N 0.91 0.30 -0.05 1.13 4.20 -0.64 -1.12 115.11 119.85 1j91 h GLN 86 Ca 0.23 -0.22 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 1j91 h GLN 86 Cb 0.04 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1j91 h GLN 86 CO -0.04 0.84 -0.43 -0.91 -0.67 0.00 0.00 178.83 177.63 1j91 h ASN 87 N 0.21 0.11 -0.00 1.46 2.35 -0.56 -3.17 115.58 115.98 1j91 h ASN 87 Ca -0.01 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1j91 h ASN 87 Cb 1.17 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.51 1j91 h ASN 87 CO 0.10 0.53 -0.60 0.18 -1.65 0.00 0.00 177.43 175.99 1j91 n LEU 88 N -4.02 1.76 -4.57 1.61 4.77 -0.69 -4.99 117.00 110.87 1j91 n LEU 88 Ca -0.02 -0.68 -0.53 0.00 -0.03 0.00 0.00 56.01 54.75 1j91 n LEU 88 Cb 0.47 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 1j91 n LEU 88 CO 0.41 0.34 0.81 0.00 -1.33 0.00 0.00 177.39 177.61 1j91 n GLY 90 N 2.26 2.50 3.71 0.00 0.00 -1.26 -5.04 105.19 107.37 1j91 n GLY 90 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1j91 n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j91 s GLY 91 N -2.03 2.03 0.02 -0.02 0.00 0.16 -4.88 107.32 102.60 1j91 s GLY 91 Ca 0.00 0.71 -0.32 0.00 0.00 0.00 0.00 44.72 45.10 1j91 s GLY 91 CO 0.00 1.11 1.86 -1.05 0.00 0.00 0.00 173.10 175.02 1j91 n PRO 92 N -3.37 2.49 -2.22 2.90 -0.02 -1.26 -2.60 135.00 130.92 1j91 n PRO 92 Ca 0.12 0.91 -0.18 0.00 -2.02 0.00 0.00 63.50 62.33 1j91 n PRO 92 Cb 0.51 -2.78 -0.02 0.00 -0.02 0.00 0.00 33.50 31.18 1j91 n PRO 92 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1j91 n ASN 93 N 6.29 -5.13 -4.72 2.55 3.02 -1.26 -3.74 115.26 112.26 1j91 n ASN 93 Ca 0.20 0.14 -0.35 0.00 -0.03 0.00 0.00 54.58 54.54 1j91 n ASN 93 Cb 0.34 -4.36 -0.08 0.00 -0.61 0.00 0.00 39.78 35.07 1j91 n ASN 93 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1j91 s ILE 94 N -2.82 5.32 0.27 2.41 -1.09 -1.07 -1.52 121.20 122.70 1j91 s ILE 94 Ca 0.00 0.16 -0.30 0.00 -2.23 0.00 0.00 60.65 58.27 1j91 s ILE 94 Cb 0.00 -3.42 -0.13 0.00 -1.58 0.00 0.00 42.46 37.33 1j91 s ILE 94 CO 0.00 0.45 1.44 0.55 -1.23 0.00 0.00 174.94 176.15 1j91 n VAL 95 N 3.45 1.12 -3.04 2.92 3.14 -1.12 -4.77 118.33 120.03 1j91 n VAL 95 Ca -0.16 -0.28 -0.41 0.00 -2.96 0.00 0.00 64.34 60.53 1j91 n VAL 95 Cb 0.52 -1.60 -0.06 0.00 -1.06 0.00 0.00 33.84 31.64 1j91 n VAL 95 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 1j91 s LYS 96 N -0.64 4.14 -0.39 1.45 2.20 -1.26 -4.88 119.74 120.35 1j91 s LYS 96 Ca 0.65 0.68 -0.26 0.00 -0.36 0.00 0.00 55.97 56.68 1j91 s LYS 96 Cb -0.60 -3.64 0.02 0.00 -1.51 0.00 0.00 37.83 32.10 1j91 s LYS 96 CO 0.51 -0.42 0.96 -1.17 -0.36 0.00 0.00 175.35 174.86 1j91 s LEU 97 N 2.54 3.96 -0.06 5.43 2.96 -1.26 -1.47 118.68 130.77 1j91 s LEU 97 Ca 0.29 0.51 -0.05 0.00 -0.22 0.00 0.00 54.13 54.66 1j91 s LEU 97 Cb -0.15 -3.30 -0.27 0.00 0.50 0.00 0.00 46.19 42.97 1j91 s LEU 97 CO 0.08 -0.94 0.60 -0.07 -1.32 0.00 0.00 176.35 174.71 1j91 h LEU 98 N 10.29 0.41 -7.42 -0.68 3.38 0.41 -3.48 115.31 118.22 1j91 h LEU 98 Ca -0.23 -0.73 0.03 0.00 0.09 0.00 0.00 57.88 57.03 1j91 h LEU 98 Cb 1.07 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.60 1j91 h LEU 98 CO 1.01 1.63 0.24 -0.62 0.09 0.00 0.00 178.44 180.79 1j91 s ASP 99 N -6.98 -0.43 -0.20 -0.43 -1.08 -0.92 -5.01 116.67 101.62 1j91 s ASP 99 Ca -0.15 -0.26 -0.01 0.00 -0.52 0.00 0.00 52.55 51.61 1j91 s ASP 99 Cb 0.06 0.64 0.06 0.00 -1.46 0.00 0.00 42.92 42.22 1j91 s ASP 99 CO 0.82 -1.11 -0.01 -0.63 0.52 0.00 0.00 175.17 174.76 1j91 s ILE 100 N -3.78 0.99 0.45 4.11 1.01 -1.26 -0.96 121.20 121.76 1j91 s ILE 100 Ca 0.05 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 59.92 1j91 s ILE 100 Cb -0.03 -1.36 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 1j91 s ILE 100 CO -0.04 -0.12 0.03 0.68 0.00 0.00 0.00 174.94 175.49 1j91 s VAL 101 N 1.65 1.22 -0.29 2.92 -7.23 -0.88 -0.78 120.40 117.01 1j91 s VAL 101 Ca -0.03 -2.00 -0.19 0.00 -1.81 0.00 0.00 61.98 57.96 1j91 s VAL 101 Cb -0.17 -2.42 0.17 0.00 0.56 0.00 0.00 36.38 34.51 1j91 s VAL 101 CO -0.07 0.00 1.13 0.00 -0.31 0.00 0.00 175.10 175.85 1j91 s ARG 102 N -3.81 0.26 0.70 4.82 1.70 -1.26 -3.99 118.95 117.37 1j91 s ARG 102 Ca 0.18 0.40 -0.15 0.00 -0.47 0.00 0.00 55.73 55.69 1j91 s ARG 102 Cb 0.04 0.08 0.02 0.00 -0.57 0.00 0.00 34.95 34.52 1j91 s ARG 102 CO 0.09 -0.05 1.18 0.34 -1.08 0.00 0.00 175.30 175.79 1j91 s ASP 103 N 0.91 4.52 -0.16 -2.89 2.15 -1.26 -4.72 116.67 115.22 1j91 s ASP 103 Ca -0.05 2.26 -0.29 0.00 0.43 0.00 0.00 52.55 54.90 1j91 s ASP 103 Cb -0.04 -2.58 -0.34 0.00 -0.30 0.00 0.00 42.92 39.67 1j91 s ASP 103 CO -0.12 -2.04 1.66 1.67 -0.17 0.00 0.00 175.17 176.17 1j91 n GLN 104 N -2.55 0.25 0.00 4.34 7.27 -1.26 -2.09 117.38 123.33 1j91 n GLN 104 Ca 0.13 -1.16 0.00 0.00 0.07 0.00 0.00 57.00 56.03 1j91 n GLN 104 Cb 0.51 -2.61 0.00 0.00 2.41 0.00 0.00 30.24 30.54 1j91 n GLN 104 CO 0.00 0.00 0.00 -2.39 0.07 0.00 0.00 177.06 174.74 1j91 n HIS 105 N 9.11 0.00 -3.50 3.69 1.44 -1.26 -5.08 115.22 119.62 1j91 n HIS 105 Ca 0.47 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.76 1j91 n HIS 105 Cb 0.42 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.44 1j91 n HIS 105 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1j91 s SER 106 N 0.00 5.90 0.34 4.39 0.01 -0.89 -4.88 113.70 118.57 1j91 s SER 106 Ca 0.00 -1.35 0.24 0.00 1.31 0.00 0.00 55.95 56.15 1j91 s SER 106 Cb 0.00 -2.09 1.24 0.00 0.21 0.00 0.00 66.02 65.39 1j91 s SER 106 CO 0.00 -0.57 1.74 0.50 0.41 0.00 0.00 173.24 175.32 1j91 h LYS 107 N 8.58 0.00 0.00 12.44 3.11 -1.98 -3.38 116.57 135.34 1j91 h LYS 107 Ca -0.26 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.58 1j91 h LYS 107 Cb 1.10 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.33 1j91 h LYS 107 CO 0.80 0.00 -0.01 2.41 -2.81 0.00 0.00 179.45 179.85 1j91 n THR 108 N -2.35 0.00 -0.33 1.00 -1.04 -1.26 -5.04 114.28 105.26 1j91 n THR 108 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1j91 n THR 108 Cb 0.09 -0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.57 1j91 n THR 108 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1j91 n PRO 109 N -1.56 0.00 0.00 -2.82 -0.02 -1.26 -4.71 135.00 124.64 1j91 n PRO 109 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1j91 n PRO 109 Cb 0.00 -0.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 1j91 n PRO 109 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1j91 n SER 110 N 2.12 0.00 -4.73 2.55 7.64 -1.19 -3.68 113.62 116.33 1j91 n SER 110 Ca 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.53 1j91 n SER 110 Cb 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.12 1j91 n SER 110 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1j91 s LEU 111 N 0.00 3.92 -0.29 -3.43 1.43 0.15 -2.07 118.68 118.39 1j91 s LEU 111 Ca 0.00 0.22 -0.05 0.00 -1.03 0.00 0.00 54.13 53.27 1j91 s LEU 111 Cb 0.00 -1.95 0.02 0.00 0.03 0.00 0.00 46.19 44.29 1j91 s LEU 111 CO 0.00 0.31 0.04 -0.63 0.23 0.00 0.00 176.35 176.31 1j91 s ILE 112 N -0.47 3.59 0.22 -0.59 -1.09 -0.13 -0.42 121.20 122.32 1j91 s ILE 112 Ca 0.10 -0.90 0.08 0.00 -2.23 0.00 0.00 60.65 57.70 1j91 s ILE 112 Cb -0.12 -2.90 -0.04 0.00 -1.58 0.00 0.00 42.46 37.82 1j91 s ILE 112 CO 0.02 0.05 0.02 -0.36 -1.23 0.00 0.00 174.94 173.44 1j91 s PHE 113 N 1.42 2.81 0.72 3.97 0.08 -0.03 0.11 117.98 127.05 1j91 s PHE 113 Ca 0.01 -0.17 -0.16 0.00 0.12 0.00 0.00 56.93 56.72 1j91 s PHE 113 Cb -0.18 -1.30 -0.02 0.00 -0.57 0.00 0.00 43.02 40.95 1j91 s PHE 113 CO 0.01 0.56 0.67 -0.85 -0.10 0.00 0.00 175.22 175.51 1j91 n GLU 114 N -0.57 0.37 -2.39 0.44 0.28 -0.54 -0.76 120.64 117.46 1j91 n GLU 114 Ca -0.08 0.17 -0.41 0.00 -0.16 0.00 0.00 57.16 56.68 1j91 n GLU 114 Cb 0.57 -1.95 -0.04 0.00 1.43 0.00 0.00 31.44 31.45 1j91 n GLU 114 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 1j91 s TYR 115 N -1.88 3.45 -0.02 -1.84 5.04 -1.26 -3.98 117.35 116.85 1j91 s TYR 115 Ca 0.68 1.58 0.00 0.00 -2.44 0.00 0.00 57.07 56.89 1j91 s TYR 115 Cb -0.35 -3.39 0.03 0.00 0.35 0.00 0.00 41.96 38.60 1j91 s TYR 115 CO 0.55 -0.94 0.01 0.08 -1.34 0.00 0.00 175.55 173.91 1j91 s VAL 116 N -0.86 0.09 -0.35 3.14 1.01 -1.26 -4.98 120.40 117.19 1j91 s VAL 116 Ca 0.47 0.12 -0.29 0.00 0.00 0.00 0.00 61.98 62.28 1j91 s VAL 116 Cb -0.33 -0.19 -0.01 0.00 0.00 0.00 0.00 36.38 35.85 1j91 s VAL 116 CO 0.42 0.12 1.61 0.20 0.00 0.00 0.00 175.10 177.44 1j91 s ASN 117 N 0.94 6.15 -0.68 3.32 -0.87 -1.26 -4.92 114.94 117.62 1j91 s ASN 117 Ca -0.09 1.14 -0.26 0.00 -1.57 0.00 0.00 52.86 52.08 1j91 s ASN 117 Cb -0.12 -2.53 -0.05 0.00 -0.02 0.00 0.00 41.25 38.53 1j91 s ASN 117 CO -0.02 -1.53 2.02 0.54 -2.57 0.00 0.00 177.10 175.54 1j91 s ASN 118 N 4.91 4.98 -0.27 -1.22 4.22 -1.26 -4.74 114.94 121.57 1j91 s ASN 118 Ca 0.71 0.18 -0.08 0.00 -2.14 0.00 0.00 52.86 51.52 1j91 s ASN 118 Cb -0.19 -2.53 -0.02 0.00 1.28 0.00 0.00 41.25 39.79 1j91 s ASN 118 CO 0.33 -2.68 0.10 -0.89 -2.04 0.00 0.00 177.10 171.92 1j91 s THR 119 N 10.32 4.45 -0.23 0.54 2.01 -1.26 -5.04 115.64 126.42 1j91 s THR 119 Ca 0.75 -0.25 -0.31 0.00 0.31 0.00 0.00 61.69 62.19 1j91 s THR 119 Cb -0.12 -3.15 -0.07 0.00 0.01 0.00 0.00 72.50 69.17 1j91 s THR 119 CO 0.15 0.24 2.18 -0.67 -0.69 0.00 0.00 174.62 175.83 1j91 n ASP 120 N 4.95 3.00 -0.12 3.53 -0.08 -1.26 -4.82 116.55 121.74 1j91 n ASP 120 Ca -0.15 0.35 0.09 0.00 -1.51 0.00 0.00 54.79 53.57 1j91 n ASP 120 Cb 0.51 -1.46 0.43 0.00 2.34 0.00 0.00 41.12 42.94 1j91 n ASP 120 CO 0.00 0.00 0.00 2.19 0.12 0.00 0.00 177.20 179.51 1j91 h PHE 121 N 13.72 0.58 -0.15 -0.67 -0.00 -1.96 0.14 116.94 128.60 1j91 h PHE 121 Ca -0.38 0.02 0.04 0.00 -0.00 0.00 0.00 57.97 57.65 1j91 h PHE 121 Cb 1.27 -0.19 -0.01 0.00 -0.00 0.00 0.00 35.95 37.02 1j91 h PHE 121 CO 0.94 0.29 0.13 0.87 -0.00 0.00 0.00 178.31 180.54 1j91 h LYS 122 N 0.56 0.00 0.16 6.09 1.57 -1.99 -0.27 116.57 122.69 1j91 h LYS 122 Ca 0.29 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.74 1j91 h LYS 122 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1j91 h LYS 122 CO -0.09 0.00 -1.65 0.28 -0.57 0.00 0.00 179.45 177.42 1j91 h VAL 123 N 0.00 0.96 0.11 0.50 2.07 -1.13 -3.40 116.25 115.36 1j91 h VAL 123 Ca 0.07 -2.47 -0.01 0.00 0.82 0.00 0.00 66.70 65.11 1j91 h VAL 123 Cb 0.33 2.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1j91 h VAL 123 CO -0.00 0.81 -0.05 0.25 0.02 0.00 0.00 177.57 178.60 1j91 h LEU 124 N -0.02 -0.13 -0.98 2.57 5.85 -0.86 -3.38 115.31 118.37 1j91 h LEU 124 Ca -0.33 -0.43 0.33 0.00 0.84 0.00 0.00 57.88 58.29 1j91 h LEU 124 Cb 1.99 0.03 -0.17 0.00 0.37 0.00 0.00 40.66 42.88 1j91 h LEU 124 CO 0.14 0.50 0.34 1.88 -0.34 0.00 0.00 178.44 180.96 1j91 h TYR 125 N -0.89 0.51 0.00 1.25 -1.99 -1.30 0.35 116.97 114.90 1j91 h TYR 125 Ca -0.02 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.77 1j91 h TYR 125 Cb 0.54 -0.06 0.00 0.00 2.00 0.00 0.00 36.73 39.21 1j91 h TYR 125 CO 0.11 -0.38 0.00 -2.30 -0.00 0.00 0.00 178.16 175.59 1j91 n PRO 126 N -5.29 0.16 0.00 4.88 -0.02 -1.26 -2.18 135.00 131.29 1j91 n PRO 126 Ca 0.30 0.47 0.11 0.00 -2.02 0.00 0.00 63.50 62.36 1j91 n PRO 126 Cb 0.99 -1.85 0.01 0.00 -0.02 0.00 0.00 33.50 32.63 1j91 n PRO 126 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1j91 n THR 127 N -2.15 0.00 -2.06 3.45 -2.24 0.12 -4.98 114.28 106.43 1j91 n THR 127 Ca 0.01 -0.14 -0.39 0.00 -2.27 0.00 0.00 64.05 61.26 1j91 n THR 127 Cb 0.17 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 1j91 n THR 127 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1j91 s LEU 128 N -2.69 4.13 0.48 3.22 1.43 -0.93 -5.04 118.68 119.29 1j91 s LEU 128 Ca 0.15 2.60 0.08 0.00 -1.03 0.00 0.00 54.13 55.93 1j91 s LEU 128 Cb 0.17 -4.01 0.02 0.00 0.03 0.00 0.00 46.19 42.40 1j91 s LEU 128 CO 0.67 -0.96 0.49 0.42 0.23 0.00 0.00 176.35 177.21 1j91 s THR 129 N -1.32 2.35 0.20 5.49 -4.23 -1.26 -4.94 115.64 111.93 1j91 s THR 129 Ca 0.60 -1.27 -0.11 0.00 -1.18 0.00 0.00 61.69 59.73 1j91 s THR 129 Cb -0.37 -2.61 0.11 0.00 1.34 0.00 0.00 72.50 70.97 1j91 s THR 129 CO 0.46 0.00 1.79 -0.78 -0.54 0.00 0.00 174.62 175.55 1j91 h ASP 130 N 0.74 0.41 -0.47 3.99 -0.00 -1.92 -1.59 116.42 117.58 1j91 h ASP 130 Ca -0.38 0.04 -0.07 0.00 -0.00 0.00 0.00 57.03 56.62 1j91 h ASP 130 Cb 1.28 -0.04 -0.02 0.00 -0.00 0.00 0.00 39.33 40.56 1j91 h ASP 130 CO 0.52 0.27 0.03 0.22 -0.00 0.00 0.00 179.24 180.28 1j91 h TYR 131 N 0.55 0.87 0.13 0.28 3.20 -1.95 -2.91 116.97 117.15 1j91 h TYR 131 Ca 0.27 -0.14 0.02 0.00 3.14 0.00 0.00 58.73 62.01 1j91 h TYR 131 Cb 0.20 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 1j91 h TYR 131 CO -0.10 0.83 -0.26 -0.44 -1.64 0.00 0.00 178.16 176.55 1j91 h ASP 132 N 0.66 -0.72 -0.67 -2.11 3.32 -1.78 -0.95 116.42 114.17 1j91 h ASP 132 Ca 0.14 0.08 0.12 0.00 0.02 0.00 0.00 57.03 57.39 1j91 h ASP 132 Cb 0.46 0.27 -0.08 0.00 0.22 0.00 0.00 39.33 40.20 1j91 h ASP 132 CO 0.02 -0.35 0.23 0.40 -1.72 0.00 0.00 179.24 177.83 1j91 h ILE 133 N -0.47 0.69 -0.56 0.35 2.04 -1.33 0.22 117.51 118.45 1j91 h ILE 133 Ca 0.03 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1j91 h ILE 133 Cb 0.49 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 1j91 h ILE 133 CO -0.14 0.07 0.30 0.03 0.00 0.00 0.00 178.15 178.42 1j91 h ARG 134 N 0.39 0.78 0.16 2.37 3.08 -1.25 -1.32 114.38 118.58 1j91 h ARG 134 Ca 0.35 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 1j91 h ARG 134 Cb 0.50 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1j91 h ARG 134 CO -0.37 0.60 -0.07 -0.92 -1.07 0.00 0.00 179.97 178.14 1j91 h TYR 135 N 0.75 -0.19 -0.43 3.04 3.20 0.15 -2.18 116.97 121.31 1j91 h TYR 135 Ca 0.20 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.94 1j91 h TYR 135 Cb 0.05 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1j91 h TYR 135 CO -0.01 0.03 -0.22 1.88 -1.64 0.00 0.00 178.16 178.20 1j91 h TYR 136 N -0.39 0.98 -0.62 -3.82 0.05 -0.61 -1.21 116.97 111.34 1j91 h TYR 136 Ca -0.02 -0.23 -0.09 0.00 0.05 0.00 0.00 58.73 58.44 1j91 h TYR 136 Cb 0.31 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.80 1j91 h TYR 136 CO -0.01 0.99 0.05 0.82 -1.05 0.00 0.00 178.16 178.96 1j91 h ILE 137 N 0.75 1.26 -0.69 -2.88 1.08 -1.29 -0.23 117.51 115.52 1j91 h ILE 137 Ca 0.10 -1.09 -0.00 0.00 -0.39 0.00 0.00 64.86 63.48 1j91 h ILE 137 Cb 0.75 0.74 -0.03 0.00 -3.07 0.00 0.00 36.82 35.21 1j91 h ILE 137 CO 0.06 0.40 0.43 0.22 -0.69 0.00 0.00 178.15 178.57 1j91 h TYR 138 N 0.98 0.89 -0.86 1.37 3.20 -1.21 0.84 116.97 122.18 1j91 h TYR 138 Ca 0.18 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 1j91 h TYR 138 Cb 0.50 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.44 1j91 h TYR 138 CO 0.04 0.59 0.41 0.93 -1.64 0.00 0.00 178.16 178.49 1j91 h GLU 139 N 0.94 1.23 -0.23 1.82 4.39 -0.67 -2.38 114.58 119.68 1j91 h GLU 139 Ca 0.25 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.66 1j91 h GLU 139 Cb -0.06 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.36 1j91 h GLU 139 CO -0.05 0.95 -0.33 1.25 -1.16 0.00 0.00 179.01 179.67 1j91 h LEU 140 N 1.22 0.49 -1.75 1.33 5.85 -0.34 -2.59 115.31 119.52 1j91 h LEU 140 Ca 0.29 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1j91 h LEU 140 Cb 0.12 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1j91 h LEU 140 CO -0.04 0.79 0.09 -0.07 -0.34 0.00 0.00 178.44 178.87 1j91 h LEU 141 N 0.41 0.23 -0.45 2.25 3.38 -0.35 -1.71 115.31 119.05 1j91 h LEU 141 Ca 0.05 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1j91 h LEU 141 Cb 0.77 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 1j91 h LEU 141 CO 0.06 0.20 -0.05 0.11 0.09 0.00 0.00 178.44 178.85 1j91 h LYS 142 N 0.26 0.83 -0.40 1.13 1.57 -1.11 -1.49 116.57 117.37 1j91 h LYS 142 Ca 0.07 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 58.50 1j91 h LYS 142 Cb 0.03 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1j91 h LYS 142 CO -0.01 0.91 0.04 0.00 -0.57 0.00 0.00 179.45 179.83 1j91 h ALA 143 N 0.89 0.54 -0.35 3.86 0.00 -1.27 -2.11 119.26 120.82 1j91 h ALA 143 Ca 0.12 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 1j91 h ALA 143 Cb 0.57 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1j91 h ALA 143 CO 0.03 0.28 -0.40 -0.07 0.00 0.00 0.00 179.25 179.09 1j91 h LEU 144 N 0.53 0.96 -0.81 0.00 3.38 -1.35 -0.50 115.31 117.51 1j91 h LEU 144 Ca 0.12 -0.48 -0.09 0.00 0.09 0.00 0.00 57.88 57.52 1j91 h LEU 144 Cb 0.41 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1j91 h LEU 144 CO 0.01 1.24 -0.04 -0.78 0.09 0.00 0.00 178.44 178.96 1j91 h ASP 145 N 0.69 0.83 0.68 -0.43 3.58 -1.27 0.30 116.42 120.79 1j91 h ASP 145 Ca 0.05 -0.23 -0.03 0.00 0.42 0.00 0.00 57.03 57.24 1j91 h ASP 145 Cb 0.99 -0.22 0.01 0.00 1.72 0.00 0.00 39.33 41.83 1j91 h ASP 145 CO 0.10 0.91 -0.33 0.22 -2.88 0.00 0.00 179.24 177.27 1j91 h TYR 146 N 0.78 -0.84 -1.00 0.28 3.20 -1.22 0.58 116.97 118.74 1j91 h TYR 146 Ca 0.14 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.03 1j91 h TYR 146 Cb 0.53 0.28 -0.06 0.00 1.54 0.00 0.00 36.73 39.02 1j91 h TYR 146 CO 0.03 -0.49 0.65 0.00 -1.64 0.00 0.00 178.16 176.71 1j91 h HIS 148 N 1.25 0.76 0.00 0.00 3.86 -0.82 0.12 115.15 120.32 1j91 h HIS 148 Ca 0.40 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.52 1j91 h HIS 148 Cb 0.02 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 28.28 1j91 h HIS 148 CO -0.00 0.69 -0.03 0.66 0.86 0.00 0.00 177.93 180.12 1j91 h SER 149 N 0.61 0.00 -0.45 2.45 4.64 0.14 0.40 113.55 121.33 1j91 h SER 149 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1j91 h SER 149 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1j91 h SER 149 CO 0.00 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 1j91 n GLN 150 N -3.64 2.79 -2.30 4.77 1.13 -0.31 -4.92 117.38 114.90 1j91 n GLN 150 Ca -0.03 -1.93 -0.12 0.00 -1.94 0.00 0.00 57.00 52.98 1j91 n GLN 150 Cb 0.12 -1.66 -0.00 0.00 0.11 0.00 0.00 30.24 28.81 1j91 n GLN 150 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1j91 n GLY 151 N 0.92 -0.09 3.16 1.08 0.00 0.14 -4.87 105.19 105.53 1j91 n GLY 151 Ca 0.18 -0.38 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 1j91 n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j91 s ILE 152 N -2.63 1.60 -0.15 -0.61 1.01 0.35 -1.14 121.20 119.63 1j91 s ILE 152 Ca 0.03 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 59.82 1j91 s ILE 152 Cb -0.01 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 1j91 s ILE 152 CO 0.03 0.46 0.07 -0.04 0.00 0.00 0.00 174.94 175.46 1j91 s MET 153 N 0.13 3.70 -0.10 2.79 -1.94 -0.07 -2.97 119.30 120.84 1j91 s MET 153 Ca -0.08 -0.30 -0.28 0.00 -1.71 0.00 0.00 55.69 53.33 1j91 s MET 153 Cb -0.13 -3.15 -0.24 0.00 2.01 0.00 0.00 34.83 33.31 1j91 s MET 153 CO 0.04 0.47 0.93 1.25 -0.01 0.00 0.00 175.02 177.70 1j91 h HIS 154 N 6.03 0.04 -0.01 -0.03 2.76 -1.91 -1.21 115.15 120.81 1j91 h HIS 154 Ca -0.44 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 57.71 1j91 h HIS 154 Cb 1.18 -0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.14 1j91 h HIS 154 CO 0.62 0.86 -0.00 0.54 -1.30 0.00 0.00 177.93 178.65 1j91 n ARG 155 N -4.66 -1.13 -2.76 5.26 1.74 -1.26 -2.52 116.66 111.33 1j91 n ARG 155 Ca -0.10 0.29 -0.01 0.00 -0.77 0.00 0.00 57.85 57.26 1j91 n ARG 155 Cb 0.43 -4.15 0.08 0.00 -1.02 0.00 0.00 32.46 27.80 1j91 n ARG 155 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1j91 n ASP 156 N -0.55 0.27 -4.67 0.55 2.03 -1.26 -1.31 116.55 111.61 1j91 n ASP 156 Ca -0.00 -2.14 -0.42 0.00 0.52 0.00 0.00 54.79 52.74 1j91 n ASP 156 Cb 0.28 0.02 -0.03 0.00 -0.72 0.00 0.00 41.12 40.68 1j91 n ASP 156 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1j91 s VAL 157 N -2.12 3.95 0.08 5.18 1.01 -1.26 -4.76 120.40 122.47 1j91 s VAL 157 Ca 0.20 1.21 -0.26 0.00 0.00 0.00 0.00 61.98 63.13 1j91 s VAL 157 Cb 0.38 -3.78 0.08 0.00 0.00 0.00 0.00 36.38 33.06 1j91 s VAL 157 CO -0.07 -0.07 0.79 -1.59 0.00 0.00 0.00 175.10 174.15 1j91 s LYS 158 N 3.22 1.05 0.26 2.72 -2.85 -1.26 -4.81 119.74 118.07 1j91 s LYS 158 Ca 0.62 -0.42 -0.07 0.00 -1.00 0.00 0.00 55.97 55.11 1j91 s LYS 158 Cb -0.28 0.46 0.48 0.00 -2.06 0.00 0.00 37.83 36.43 1j91 s LYS 158 CO 0.22 -0.46 1.60 -1.35 0.10 0.00 0.00 175.35 175.46 1j91 h PRO 159 N 2.00 0.03 -0.33 1.78 0.11 -1.93 0.04 132.00 133.70 1j91 h PRO 159 Ca -0.26 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.85 1j91 h PRO 159 Cb 1.26 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 1j91 h PRO 159 CO 0.33 0.02 0.22 1.25 -0.21 0.00 0.00 178.00 179.61 1j91 h HIS 160 N 0.04 0.41 -0.07 0.65 -0.00 -1.97 -1.67 115.15 112.54 1j91 h HIS 160 Ca 0.45 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.83 1j91 h HIS 160 Cb 0.79 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 28.06 1j91 h HIS 160 CO -0.56 0.26 0.00 0.09 -0.00 0.00 0.00 177.93 177.72 1j91 n ASN 161 N -4.49 1.18 -4.06 3.26 3.02 -0.03 -4.34 115.26 109.81 1j91 n ASN 161 Ca 0.02 -1.52 -0.34 0.00 -0.03 0.00 0.00 54.58 52.71 1j91 n ASN 161 Cb 0.07 -0.04 -0.08 0.00 -0.61 0.00 0.00 39.78 39.11 1j91 n ASN 161 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1j91 s VAL 162 N -1.91 3.93 -0.05 2.41 1.01 -0.63 -0.57 120.40 124.59 1j91 s VAL 162 Ca 0.35 -3.81 -0.30 0.00 0.00 0.00 0.00 61.98 58.22 1j91 s VAL 162 Cb 0.18 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1j91 s VAL 162 CO 0.29 -1.03 1.32 -0.04 0.00 0.00 0.00 175.10 175.64 1j91 s MET 163 N -1.16 4.29 -0.17 2.72 -1.94 0.09 -4.86 119.30 118.27 1j91 s MET 163 Ca 0.25 1.83 0.01 0.00 -1.71 0.00 0.00 55.69 56.07 1j91 s MET 163 Cb -0.09 -3.62 0.02 0.00 2.01 0.00 0.00 34.83 33.16 1j91 s MET 163 CO -0.12 -0.56 -0.17 0.42 -0.01 0.00 0.00 175.02 174.58 1j91 s ILE 164 N 2.57 1.87 -0.76 2.53 1.01 -1.26 -0.28 121.20 126.88 1j91 s ILE 164 Ca 0.60 -0.87 -0.14 0.00 0.00 0.00 0.00 60.65 60.24 1j91 s ILE 164 Cb -0.28 -1.74 0.20 0.00 0.01 0.00 0.00 42.46 40.66 1j91 s ILE 164 CO 0.23 0.47 0.71 -0.62 0.00 0.00 0.00 174.94 175.73 1j91 s ASP 165 N 1.36 6.63 0.24 3.58 -1.08 0.34 -4.68 116.67 123.05 1j91 s ASP 165 Ca 0.04 -2.49 -0.05 0.00 -0.52 0.00 0.00 52.55 49.53 1j91 s ASP 165 Cb -0.13 -2.21 0.34 0.00 -1.46 0.00 0.00 42.92 39.46 1j91 s ASP 165 CO -0.12 -0.64 1.83 -0.74 0.52 0.00 0.00 175.17 176.03 1j91 h HIS 166 N 8.02 0.92 -0.94 -5.34 -0.00 -1.95 0.20 115.15 116.06 1j91 h HIS 166 Ca 0.02 0.03 0.13 0.00 -0.00 0.00 0.00 60.37 60.55 1j91 h HIS 166 Cb 1.05 -0.29 -0.09 0.00 -0.00 0.00 0.00 27.41 28.08 1j91 h HIS 166 CO 0.97 0.44 0.55 1.49 -0.00 0.00 0.00 177.93 181.38 1j91 h GLU 167 N 0.89 0.81 -0.36 5.26 4.81 -1.96 -1.74 114.58 122.29 1j91 h GLU 167 Ca 0.37 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 1j91 h GLU 167 Cb 0.23 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1j91 h GLU 167 CO -0.20 0.54 0.00 1.28 -0.73 0.00 0.00 179.01 179.90 1j91 n LEU 168 N -4.73 3.29 -4.02 1.64 4.77 -0.74 -4.96 117.00 112.26 1j91 n LEU 168 Ca 0.18 -1.52 -0.32 0.00 -0.03 0.00 0.00 56.01 54.32 1j91 n LEU 168 Cb 0.40 -0.23 0.01 0.00 -2.33 0.00 0.00 43.42 41.26 1j91 n LEU 168 CO 0.25 0.72 0.06 -1.14 -1.33 0.00 0.00 177.39 175.94 1j91 n ARG 169 N 1.32 -4.71 -4.46 3.23 3.00 0.60 -4.95 116.66 110.69 1j91 n ARG 169 Ca 0.17 0.52 -0.34 0.00 -0.00 0.00 0.00 57.85 58.20 1j91 n ARG 169 Cb 0.56 -5.35 -0.11 0.00 0.00 0.00 0.00 32.46 27.55 1j91 n ARG 169 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1j91 s LYS 170 N -6.73 3.32 -0.04 -0.14 2.20 -0.62 -4.98 119.74 112.75 1j91 s LYS 170 Ca 0.69 -0.51 0.06 0.00 -0.36 0.00 0.00 55.97 55.85 1j91 s LYS 170 Cb -0.36 -2.81 -0.01 0.00 -1.51 0.00 0.00 37.83 33.14 1j91 s LYS 170 CO 0.86 0.43 -0.22 -1.17 -0.36 0.00 0.00 175.35 174.89 1j91 s LEU 171 N -0.16 2.02 -0.05 5.43 0.20 -1.26 -0.50 118.68 124.36 1j91 s LEU 171 Ca 0.03 -0.43 -0.00 0.00 0.69 0.00 0.00 54.13 54.41 1j91 s LEU 171 Cb -0.13 -1.20 0.03 0.00 -0.43 0.00 0.00 46.19 44.46 1j91 s LEU 171 CO 0.02 0.24 -0.01 -0.13 -0.29 0.00 0.00 176.35 176.19 1j91 s ARG 172 N -0.26 0.52 -0.40 1.98 1.81 0.62 -4.56 118.95 118.66 1j91 s ARG 172 Ca 0.01 0.07 -0.23 0.00 -1.72 0.00 0.00 55.73 53.86 1j91 s ARG 172 Cb -0.11 -0.76 0.01 0.00 -0.45 0.00 0.00 34.95 33.64 1j91 s ARG 172 CO 0.02 -0.20 0.77 -1.17 -0.68 0.00 0.00 175.30 174.03 1j91 s LEU 173 N 1.45 4.19 0.00 2.53 2.96 -0.57 -0.73 118.68 128.51 1j91 s LEU 173 Ca -0.03 0.15 0.05 0.00 -0.22 0.00 0.00 54.13 54.08 1j91 s LEU 173 Cb -0.13 -2.98 0.05 0.00 0.50 0.00 0.00 46.19 43.63 1j91 s LEU 173 CO -0.03 -0.79 0.40 2.30 -1.32 0.00 0.00 176.35 176.91 1j91 n ILE 174 N 5.91 0.00 -3.16 6.68 -5.35 0.26 -2.80 119.36 120.90 1j91 n ILE 174 Ca 0.02 -1.31 -0.13 0.00 -0.27 0.00 0.00 62.75 61.07 1j91 n ILE 174 Cb 0.48 -0.47 0.01 0.00 -1.74 0.00 0.00 39.64 37.92 1j91 n ILE 174 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1j91 n ASP 175 N -2.27 -6.69 -1.75 7.28 -0.08 -1.26 -4.88 116.55 106.90 1j91 n ASP 175 Ca 0.05 0.43 -0.04 0.00 -1.51 0.00 0.00 54.79 53.72 1j91 n ASP 175 Cb 0.39 -2.77 0.25 0.00 2.34 0.00 0.00 41.12 41.32 1j91 n ASP 175 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11 1j91 n TRP 176 N 0.52 1.96 0.30 -0.67 7.02 -1.26 -4.48 117.44 120.83 1j91 n TRP 176 Ca -0.01 -0.97 0.19 0.00 -1.02 0.00 0.00 57.50 55.69 1j91 n TRP 176 Cb 0.46 -0.58 0.85 0.00 -2.42 0.00 0.00 31.31 29.63 1j91 n TRP 176 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 1j91 h GLY 177 N 3.19 0.00 -0.88 6.99 0.00 -1.91 -2.71 103.07 107.74 1j91 h GLY 177 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1j91 h GLY 177 CO 0.58 0.00 -0.23 1.04 0.00 0.00 0.00 176.54 177.93 1j91 n LEU 178 N -3.07 1.81 -4.74 3.11 4.77 -1.26 -4.90 117.00 112.72 1j91 n LEU 178 Ca -0.01 -0.83 -0.34 0.00 -0.03 0.00 0.00 56.01 54.80 1j91 n LEU 178 Cb 0.23 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.39 1j91 n LEU 178 CO 0.25 0.34 0.80 0.00 -1.33 0.00 0.00 177.39 177.44 1j91 s ALA 179 N -1.72 2.28 0.11 -1.18 0.00 -1.02 -4.69 121.76 115.54 1j91 s ALA 179 Ca 0.15 0.84 -0.12 0.00 0.00 0.00 0.00 51.96 52.83 1j91 s ALA 179 Cb 0.13 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.83 1j91 s ALA 179 CO 0.34 -1.61 0.29 -1.21 0.00 0.00 0.00 175.76 173.58 1j91 s GLU 180 N -3.82 0.98 0.12 0.00 0.41 -0.46 -4.90 118.70 111.03 1j91 s GLU 180 Ca 0.73 -0.87 -0.25 0.00 -0.41 0.00 0.00 54.97 54.17 1j91 s GLU 180 Cb -0.28 0.40 -0.07 0.00 -1.78 0.00 0.00 34.13 32.41 1j91 s GLU 180 CO 0.42 -0.35 0.78 -0.06 -0.49 0.00 0.00 175.26 175.56 1j91 s PHE 181 N -3.85 3.84 0.05 1.61 0.40 -1.26 -0.89 117.98 117.88 1j91 s PHE 181 Ca 0.05 1.58 -0.24 0.00 -0.60 0.00 0.00 56.93 57.72 1j91 s PHE 181 Cb 0.03 -2.80 -0.06 0.00 0.51 0.00 0.00 43.02 40.71 1j91 s PHE 181 CO -0.10 0.41 0.75 -0.47 0.70 0.00 0.00 175.22 176.51 1j91 s TYR 182 N -0.69 3.74 -0.05 0.36 5.04 -0.29 -4.91 117.35 120.55 1j91 s TYR 182 Ca 0.37 1.45 -0.01 0.00 -2.44 0.00 0.00 57.07 56.44 1j91 s TYR 182 Cb -0.22 -2.79 0.03 0.00 0.35 0.00 0.00 41.96 39.33 1j91 s TYR 182 CO 0.25 0.30 0.03 -1.01 -1.34 0.00 0.00 175.55 173.78 1j91 s HIS 183 N -0.15 0.31 0.03 4.97 3.76 -1.26 -4.59 115.29 118.36 1j91 s HIS 183 Ca 0.37 0.07 -0.37 0.00 -0.15 0.00 0.00 55.06 54.98 1j91 s HIS 183 Cb -0.20 -0.57 -0.16 0.00 1.11 0.00 0.00 32.58 32.75 1j91 s HIS 183 CO 0.23 -0.22 1.47 -2.30 -0.85 0.00 0.00 174.74 173.06 1j91 n PRO 184 N 5.02 1.34 -0.80 8.40 -0.02 -1.26 -1.49 135.00 146.18 1j91 n PRO 184 Ca -0.09 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1j91 n PRO 184 Cb 0.50 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1j91 n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j91 n GLY 185 N 3.02 1.04 3.77 -1.23 0.00 -1.26 -5.00 105.19 105.52 1j91 n GLY 185 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 1j91 n GLY 185 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1j91 s LYS 186 N -0.15 3.96 -0.39 1.61 2.20 -0.56 -4.93 119.74 121.49 1j91 s LYS 186 Ca 0.00 1.69 -0.14 0.00 -0.36 0.00 0.00 55.97 57.17 1j91 s LYS 186 Cb 0.00 -2.51 0.02 0.00 -1.51 0.00 0.00 37.83 33.83 1j91 s LYS 186 CO 0.00 -0.36 0.27 -1.21 -0.36 0.00 0.00 175.35 173.69 1j91 s GLU 187 N -2.55 2.99 0.46 4.03 2.02 -1.26 -4.12 118.70 120.28 1j91 s GLU 187 Ca 0.60 -0.99 -0.01 0.00 0.02 0.00 0.00 54.97 54.59 1j91 s GLU 187 Cb -0.27 -3.89 -0.01 0.00 0.10 0.00 0.00 34.13 30.06 1j91 s GLU 187 CO 0.33 -0.70 0.70 0.71 0.02 0.00 0.00 175.26 176.32 1j91 s TYR 188 N 1.65 3.30 0.24 1.61 2.02 -0.56 -4.97 117.35 120.64 1j91 s TYR 188 Ca 0.04 0.37 -0.30 0.00 -0.37 0.00 0.00 57.07 56.81 1j91 s TYR 188 Cb -0.19 -2.32 -0.09 0.00 -0.40 0.00 0.00 41.96 38.97 1j91 s TYR 188 CO 0.09 -0.35 1.05 1.21 -1.57 0.00 0.00 175.55 175.98 1j91 s ASN 189 N -4.19 7.37 0.02 2.29 2.47 -1.26 -4.75 114.94 116.89 1j91 s ASN 189 Ca 0.48 2.13 0.25 0.00 0.42 0.00 0.00 52.86 56.14 1j91 s ASN 189 Cb -0.10 -2.62 0.54 0.00 -1.45 0.00 0.00 41.25 37.63 1j91 s ASN 189 CO 0.39 -0.08 1.44 1.33 -3.72 0.00 0.00 177.10 176.46 1j91 n VAL 190 N 1.63 0.07 -1.57 -5.21 0.24 -1.26 -4.54 118.33 107.69 1j91 n VAL 190 Ca -0.00 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.34 61.83 1j91 n VAL 190 Cb 0.46 0.10 -0.01 0.00 -1.47 0.00 0.00 33.84 32.92 1j91 n VAL 190 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1j91 n ARG 191 N -1.63 3.14 -4.35 7.34 3.00 -1.26 -4.84 116.66 118.06 1j91 n ARG 191 Ca 0.05 -2.44 -0.18 0.00 -0.01 0.00 0.00 57.85 55.27 1j91 n ARG 191 Cb 0.36 -3.10 -0.10 0.00 0.00 0.00 0.00 32.46 29.61 1j91 n ARG 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1j91 s VAL 192 N 2.85 0.92 0.18 1.55 -7.23 -1.26 -5.10 120.40 112.30 1j91 s VAL 192 Ca 0.55 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.71 1j91 s VAL 192 Cb 0.15 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.56 1j91 s VAL 192 CO -0.08 -0.15 0.00 0.00 -0.31 0.00 0.00 175.10 174.56 1j91 n ALA 193 N -0.49 -1.95 -2.90 1.32 0.00 -0.43 -4.84 120.51 111.22 1j91 n ALA 193 Ca -0.03 0.24 -0.33 0.00 0.00 0.00 0.00 53.44 53.32 1j91 n ALA 193 Cb 0.65 -0.67 -0.05 0.00 0.00 0.00 0.00 19.45 19.38 1j91 n ALA 193 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1j91 s SER 194 N -4.74 6.32 0.26 0.00 0.01 -1.26 -4.97 113.70 109.32 1j91 s SER 194 Ca 0.00 0.32 -0.12 0.00 1.31 0.00 0.00 55.95 57.46 1j91 s SER 194 Cb 0.00 -1.97 0.36 0.00 0.21 0.00 0.00 66.02 64.63 1j91 s SER 194 CO 0.00 0.25 1.55 -1.14 0.41 0.00 0.00 173.24 174.32 1j91 n ARG 195 N 0.90 -0.15 0.18 12.44 0.63 -1.26 -0.71 116.66 128.68 1j91 n ARG 195 Ca -0.10 1.55 0.14 0.00 -0.92 0.00 0.00 57.85 58.51 1j91 n ARG 195 Cb 0.52 -2.31 0.61 0.00 0.45 0.00 0.00 32.46 31.74 1j91 n ARG 195 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 1j91 h TYR 196 N 0.00 0.00 -0.21 -0.14 0.05 -1.92 -2.85 116.97 111.90 1j91 h TYR 196 Ca 0.42 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.20 1j91 h TYR 196 Cb 0.67 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.41 1j91 h TYR 196 CO -0.82 0.00 0.00 1.19 -1.05 0.00 0.00 178.16 177.48 1j91 n PHE 197 N -2.48 0.40 -2.48 4.88 3.72 0.11 -4.60 117.46 117.01 1j91 n PHE 197 Ca 0.01 -0.63 -0.42 0.00 -0.05 0.00 0.00 57.45 56.36 1j91 n PHE 197 Cb 0.19 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 38.59 1j91 n PHE 197 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1j91 s LYS 198 N -1.57 4.44 0.82 -1.08 1.02 -0.97 -4.29 119.74 118.10 1j91 s LYS 198 Ca 0.22 1.69 -0.11 0.00 0.02 0.00 0.00 55.97 57.79 1j91 s LYS 198 Cb 0.15 -3.41 0.08 0.00 -0.52 0.00 0.00 37.83 34.13 1j91 s LYS 198 CO 0.09 -0.26 1.09 0.20 -0.92 0.00 0.00 175.35 175.55 1j91 s GLY 199 N 1.14 1.63 0.44 -3.33 0.00 -1.26 -4.90 107.32 101.04 1j91 s GLY 199 Ca 0.57 -0.10 0.15 0.00 0.00 0.00 0.00 44.72 45.34 1j91 s GLY 199 CO 0.27 0.33 1.98 -2.55 0.00 0.00 0.00 173.10 173.13 1j91 h PRO 200 N -1.19 0.36 -0.74 2.90 0.11 -1.92 -2.14 132.00 129.37 1j91 h PRO 200 Ca -0.47 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.66 1j91 h PRO 200 Cb 1.26 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1j91 h PRO 200 CO 0.57 0.24 0.49 1.05 -0.21 0.00 0.00 178.00 180.14 1j91 h GLU 201 N 0.37 0.84 0.00 1.05 9.09 -1.88 -0.49 114.58 123.56 1j91 h GLU 201 Ca 0.28 -0.05 -0.08 0.00 0.05 0.00 0.00 59.36 59.56 1j91 h GLU 201 Cb 0.60 -0.19 -0.01 0.00 -1.65 0.00 0.00 28.75 27.50 1j91 h GLU 201 CO -0.07 0.56 -0.38 -0.07 0.05 0.00 0.00 179.01 179.09 1j91 h LEU 202 N 0.86 0.00 0.00 3.06 3.38 -1.62 0.77 115.31 121.76 1j91 h LEU 202 Ca 0.30 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.16 1j91 h LEU 202 Cb 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1j91 h LEU 202 CO -0.09 0.38 -0.79 -0.07 0.09 0.00 0.00 178.44 177.96 1j91 h LEU 203 N 0.00 0.00 -3.03 1.67 3.38 -1.03 -3.28 115.31 113.02 1j91 h LEU 203 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1j91 h LEU 203 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1j91 h LEU 203 CO 0.05 0.48 0.00 1.33 0.09 0.00 0.00 178.44 180.39 1j91 n VAL 204 N -3.09 1.51 -3.07 1.22 0.24 -0.33 -4.97 118.33 109.83 1j91 n VAL 204 Ca -0.02 -1.29 -0.18 0.00 -2.04 0.00 0.00 64.34 60.82 1j91 n VAL 204 Cb 0.75 0.22 0.04 0.00 -1.47 0.00 0.00 33.84 33.39 1j91 n VAL 204 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1j91 n ASP 205 N 0.35 -5.28 -4.45 -1.34 10.43 -0.89 -4.95 116.55 110.42 1j91 n ASP 205 Ca 0.17 -0.31 -0.43 0.00 2.57 0.00 0.00 54.79 56.79 1j91 n ASP 205 Cb 0.64 -4.03 -0.04 0.00 1.84 0.00 0.00 41.12 39.54 1j91 n ASP 205 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 1j91 s LEU 206 N -5.60 4.44 0.18 0.64 0.20 0.26 -4.89 118.68 113.92 1j91 s LEU 206 Ca 0.33 -1.01 0.09 0.00 0.69 0.00 0.00 54.13 54.24 1j91 s LEU 206 Cb -0.15 -2.42 -0.02 0.00 -0.43 0.00 0.00 46.19 43.18 1j91 s LEU 206 CO 0.41 -1.42 1.39 1.56 -0.29 0.00 0.00 176.35 178.00 1j91 h GLN 207 N 9.54 0.00 -2.85 1.98 4.20 -1.86 -3.38 115.11 122.75 1j91 h GLN 207 Ca -0.29 0.00 -0.72 0.00 0.06 0.00 0.00 58.65 57.70 1j91 h GLN 207 Cb 1.07 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.76 1j91 h GLN 207 CO 1.18 0.82 2.76 -0.40 -0.67 0.00 0.00 178.83 182.52 1j91 n ASP 208 N -3.43 7.77 -4.61 1.46 5.75 -1.26 -1.49 116.55 120.75 1j91 n ASP 208 Ca 0.00 -2.99 -0.24 0.00 -0.01 0.00 0.00 54.79 51.55 1j91 n ASP 208 Cb 0.83 -1.43 0.12 0.00 -1.03 0.00 0.00 41.12 39.61 1j91 n ASP 208 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 1j91 s TYR 209 N -0.04 1.22 0.00 2.11 -0.85 -1.26 -4.72 117.35 113.82 1j91 s TYR 209 Ca 0.56 -0.38 0.00 0.00 -0.52 0.00 0.00 57.07 56.73 1j91 s TYR 209 Cb 0.17 -3.01 0.00 0.00 0.38 0.00 0.00 41.96 39.50 1j91 s TYR 209 CO -0.08 -1.90 0.00 -0.40 -1.52 0.00 0.00 175.55 171.66 1j91 n ASP 210 N -2.93 0.00 -0.22 -0.18 5.68 -1.26 -4.96 116.55 112.69 1j91 n ASP 210 Ca 0.17 0.00 0.24 0.00 -0.50 0.00 0.00 54.79 54.70 1j91 n ASP 210 Cb 0.61 0.00 0.62 0.00 -1.14 0.00 0.00 41.12 41.21 1j91 n ASP 210 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 1j91 h TYR 211 N 0.00 0.28 0.00 2.11 0.05 -1.94 -0.48 116.97 117.00 1j91 h TYR 211 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1j91 h TYR 211 Cb 0.00 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 37.66 1j91 h TYR 211 CO 0.00 0.06 0.18 0.66 -1.05 0.00 0.00 178.16 178.01 1j91 h SER 212 N 0.20 0.00 -0.88 3.88 4.64 -1.95 -0.32 113.55 119.11 1j91 h SER 212 Ca 0.46 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.77 1j91 h SER 212 Cb 1.47 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.52 1j91 h SER 212 CO -0.10 0.00 0.52 0.25 -0.87 0.00 0.00 176.83 176.63 1j91 h LEU 213 N 0.00 1.08 -1.65 5.97 5.85 -1.45 -2.03 115.31 123.08 1j91 h LEU 213 Ca 0.00 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 1j91 h LEU 213 Cb 0.35 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1j91 h LEU 213 CO 0.00 0.84 -0.17 0.44 -0.34 0.00 0.00 178.44 179.21 1j91 h ASP 214 N 1.23 0.00 1.25 1.25 3.32 -1.25 -2.75 116.42 119.47 1j91 h ASP 214 Ca 0.32 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.27 1j91 h ASP 214 Cb -0.03 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1j91 h ASP 214 CO -0.06 0.17 -0.47 0.24 -1.72 0.00 0.00 179.24 177.40 1j91 h MET 215 N 0.00 0.00 -0.09 3.56 2.86 -1.47 -1.66 114.93 118.13 1j91 h MET 215 Ca -0.00 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.40 1j91 h MET 215 Cb 0.47 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.15 1j91 h MET 215 CO 0.02 0.47 -0.89 2.35 1.06 0.00 0.00 176.91 179.92 1j91 h TRP 216 N 0.00 1.07 -0.59 -0.22 2.91 -1.33 -1.02 115.95 116.76 1j91 h TRP 216 Ca -0.00 -0.52 -0.02 0.00 1.13 0.00 0.00 58.89 59.48 1j91 h TRP 216 Cb 1.22 -0.15 -0.03 0.00 -0.51 0.00 0.00 29.16 29.70 1j91 h TRP 216 CO 0.00 1.35 0.29 0.77 -1.03 0.00 0.00 178.44 179.82 1j91 h SER 217 N 0.49 0.77 -0.64 2.65 0.02 -1.43 -0.19 113.55 115.22 1j91 h SER 217 Ca -0.08 -0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 60.68 1j91 h SER 217 Cb 1.53 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.84 1j91 h SER 217 CO 0.18 0.68 0.19 0.25 -1.14 0.00 0.00 176.83 177.00 1j91 h LEU 218 N 0.81 0.95 -0.98 5.07 5.85 -1.28 -2.06 115.31 123.66 1j91 h LEU 218 Ca 0.20 -0.21 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1j91 h LEU 218 Cb 0.11 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 1j91 h LEU 218 CO -0.03 0.91 0.65 1.23 -0.34 0.00 0.00 178.44 180.86 1j91 h GLY 219 N 0.93 1.39 1.18 3.75 0.00 -0.50 0.12 103.07 109.94 1j91 h GLY 219 Ca 0.21 -0.51 -0.07 0.00 0.00 0.00 0.00 47.33 46.95 1j91 h GLY 219 CO -0.00 0.49 0.09 0.00 0.00 0.00 0.00 176.54 177.12 1j91 h MET 221 N 0.95 0.71 -0.19 0.00 2.07 -0.67 -1.36 114.93 116.43 1j91 h MET 221 Ca 0.19 -0.16 -0.01 0.00 -2.07 0.00 0.00 59.70 57.65 1j91 h MET 221 Cb 0.42 -0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 30.05 1j91 h MET 221 CO 0.01 0.70 0.08 0.35 1.07 0.00 0.00 176.91 179.13 1j91 h PHE 222 N 0.59 0.28 -0.82 -0.22 3.57 -0.54 -0.08 116.94 119.71 1j91 h PHE 222 Ca 0.14 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.67 1j91 h PHE 222 Cb 0.30 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 38.90 1j91 h PHE 222 CO 0.02 0.32 0.51 0.00 -2.23 0.00 0.00 178.31 176.92 1j91 h ALA 223 N 0.94 1.10 -0.79 2.41 0.00 -1.15 -0.58 119.26 121.19 1j91 h ALA 223 Ca 0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1j91 h ALA 223 Cb 0.15 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1j91 h ALA 223 CO -0.01 0.27 0.30 0.78 0.00 0.00 0.00 179.25 180.59 1j91 h GLY 224 N 0.95 1.28 0.40 0.00 0.00 -0.77 -1.79 103.07 103.14 1j91 h GLY 224 Ca 0.35 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 1j91 h GLY 224 CO -0.15 0.67 -0.07 -0.33 0.00 0.00 0.00 176.54 176.66 1j91 h MET 225 N 1.16 -0.18 0.00 4.80 2.07 -0.34 -2.06 114.93 120.38 1j91 h MET 225 Ca 0.26 0.01 -0.04 0.00 -2.07 0.00 0.00 59.70 57.86 1j91 h MET 225 Cb 0.25 0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 30.01 1j91 h MET 225 CO -0.02 0.28 -0.21 -0.84 1.07 0.00 0.00 176.91 177.19 1j91 h ILE 226 N -0.78 0.64 -0.03 -1.22 3.07 -1.16 -2.93 117.51 115.10 1j91 h ILE 226 Ca -0.02 -0.93 0.00 0.00 1.55 0.00 0.00 64.86 65.46 1j91 h ILE 226 Cb 0.54 1.60 0.00 0.00 -0.27 0.00 0.00 36.82 38.69 1j91 h ILE 226 CO 0.03 0.20 0.00 0.49 -1.05 0.00 0.00 178.15 177.82 1j91 n PHE 227 N -3.56 0.01 -3.78 0.16 3.72 -0.68 -4.49 117.46 108.84 1j91 n PHE 227 Ca -0.01 -0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.13 1j91 n PHE 227 Cb 0.35 -0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.93 1j91 n PHE 227 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1j91 n ARG 228 N 1.27 -5.72 -3.67 -1.08 5.12 -0.85 -4.78 116.66 106.95 1j91 n ARG 228 Ca 0.13 0.65 -0.28 0.00 -1.93 0.00 0.00 57.85 56.42 1j91 n ARG 228 Cb 0.57 -5.46 -0.11 0.00 -1.16 0.00 0.00 32.46 26.29 1j91 n ARG 228 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1j91 s LYS 229 N -6.31 1.68 0.00 5.56 2.20 -0.83 -5.05 119.74 116.98 1j91 s LYS 229 Ca 0.41 -2.67 0.00 0.00 -0.36 0.00 0.00 55.97 53.35 1j91 s LYS 229 Cb -0.20 -2.47 0.00 0.00 -1.51 0.00 0.00 37.83 33.65 1j91 s LYS 229 CO 0.81 -1.31 0.00 -0.85 -0.36 0.00 0.00 175.35 173.64 1j91 n GLU 230 N 2.54 0.00 -2.17 4.03 0.00 -1.26 -2.08 120.64 121.70 1j91 n GLU 230 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.95 1j91 n GLU 230 Cb 0.40 -0.01 -0.02 0.00 0.00 0.00 0.00 31.44 31.81 1j91 n GLU 230 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.13 174.99 1j91 s PRO 231 N 0.00 3.62 0.11 3.44 0.02 -1.26 -4.57 135.00 136.36 1j91 s PRO 231 Ca 0.00 1.38 -0.19 0.00 0.02 0.00 0.00 61.00 62.21 1j91 s PRO 231 Cb 0.00 -4.06 -0.06 0.00 0.02 0.00 0.00 34.50 30.40 1j91 s PRO 231 CO 0.00 -1.51 1.68 0.35 -0.33 0.00 0.00 177.00 177.20 1j91 h PHE 232 N 11.20 0.37 -3.45 6.54 3.57 -1.66 -3.33 116.94 130.18 1j91 h PHE 232 Ca -0.31 -0.02 -0.73 0.00 3.53 0.00 0.00 57.97 60.44 1j91 h PHE 232 Cb 1.14 -0.12 -0.30 0.00 2.79 0.00 0.00 35.95 39.46 1j91 h PHE 232 CO 0.94 0.36 -0.30 -0.06 -2.23 0.00 0.00 178.31 177.01 1j91 s PHE 233 N -5.70 3.49 -0.92 0.41 0.08 -1.26 -5.03 117.98 109.04 1j91 s PHE 233 Ca -0.13 -2.11 -0.13 0.00 0.12 0.00 0.00 56.93 54.68 1j91 s PHE 233 Cb 0.08 -3.48 0.22 0.00 -0.57 0.00 0.00 43.02 39.27 1j91 s PHE 233 CO 0.72 -0.96 0.92 -0.47 -0.10 0.00 0.00 175.22 175.33 1j91 s TYR 234 N 0.79 3.81 0.29 0.36 5.04 -1.25 -4.54 117.35 121.86 1j91 s TYR 234 Ca 0.11 -2.11 -0.01 0.00 -2.44 0.00 0.00 57.07 52.61 1j91 s TYR 234 Cb -0.22 -3.89 -0.04 0.00 0.35 0.00 0.00 41.96 38.16 1j91 s TYR 234 CO -0.03 -1.05 0.51 0.20 -1.34 0.00 0.00 175.55 173.84 1j91 s GLY 235 N 2.13 1.61 0.19 8.97 0.00 -1.26 -4.97 107.32 113.98 1j91 s GLY 235 Ca 0.24 -0.78 0.22 0.00 0.00 0.00 0.00 44.72 44.40 1j91 s GLY 235 CO -0.08 -0.71 1.01 1.42 0.00 0.00 0.00 173.10 174.74 1j91 n HIS 236 N -1.24 0.95 -3.81 1.90 -0.00 -1.26 -4.86 115.22 106.89 1j91 n HIS 236 Ca -0.04 0.28 -0.09 0.00 -0.00 0.00 0.00 57.72 57.87 1j91 n HIS 236 Cb 0.55 -0.96 0.02 0.00 -0.00 0.00 0.00 29.99 29.60 1j91 n HIS 236 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.34 176.50 1j91 s ASP 237 N -5.37 0.01 0.27 0.41 1.47 -1.26 -5.02 116.67 107.18 1j91 s ASP 237 Ca -0.01 -1.14 -0.02 0.00 1.18 0.00 0.00 52.55 52.57 1j91 s ASP 237 Cb 0.10 0.85 0.44 0.00 -0.34 0.00 0.00 42.92 43.97 1j91 s ASP 237 CO 0.80 -1.68 1.86 0.78 0.68 0.00 0.00 175.17 177.61 1j91 h ASN 238 N 2.00 0.98 -0.23 2.11 2.35 -1.96 -0.62 115.58 120.20 1j91 h ASN 238 Ca -0.32 0.02 -0.14 0.00 -0.55 0.00 0.00 56.30 55.32 1j91 h ASN 238 Cb 1.25 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 39.44 1j91 h ASN 238 CO 0.40 0.60 -0.39 0.45 -1.65 0.00 0.00 177.43 176.83 1j91 h HIS 239 N 1.10 0.85 0.00 1.19 3.86 -1.97 -3.06 115.15 117.12 1j91 h HIS 239 Ca 0.45 -0.29 -0.04 0.00 -1.16 0.00 0.00 60.37 59.32 1j91 h HIS 239 Cb 0.27 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 1j91 h HIS 239 CO -0.01 1.06 -0.18 0.22 0.86 0.00 0.00 177.93 179.88 1j91 h ASP 240 N 0.39 0.00 -0.37 2.45 3.58 -1.89 -2.66 116.42 117.92 1j91 h ASP 240 Ca 0.02 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.44 1j91 h ASP 240 Cb 0.99 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.02 1j91 h ASP 240 CO 0.09 0.18 0.14 -0.61 -2.88 0.00 0.00 179.24 176.16 1j91 h GLN 241 N 0.00 0.56 -0.50 0.28 5.75 -1.01 -1.43 115.11 118.75 1j91 h GLN 241 Ca -0.00 -0.11 -0.07 0.00 -0.15 0.00 0.00 58.65 58.32 1j91 h GLN 241 Cb 0.55 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.99 1j91 h GLN 241 CO 0.02 0.55 0.02 1.25 -2.65 0.00 0.00 178.83 178.02 1j91 h LEU 242 N 0.45 0.80 0.10 -2.39 5.85 -1.47 -1.90 115.31 116.75 1j91 h LEU 242 Ca 0.12 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1j91 h LEU 242 Cb 0.21 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 1j91 h LEU 242 CO -0.01 0.85 -0.07 0.58 -0.34 0.00 0.00 178.44 179.45 1j91 h VAL 243 N 0.78 0.84 -0.98 1.05 2.07 -1.29 -0.24 116.25 118.47 1j91 h VAL 243 Ca 0.15 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.76 1j91 h VAL 243 Cb 0.45 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 30.98 1j91 h VAL 243 CO 0.02 0.00 0.62 0.11 0.02 0.00 0.00 177.57 178.34 1j91 h LYS 244 N -0.18 1.04 -0.08 1.57 1.79 -0.99 -1.10 116.57 118.61 1j91 h LYS 244 Ca -0.00 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.40 1j91 h LYS 244 Cb 0.16 -0.23 -0.00 0.00 -1.58 0.00 0.00 32.23 30.57 1j91 h LYS 244 CO -0.00 0.69 0.02 0.82 -1.08 0.00 0.00 179.45 179.90 1j91 h ILE 245 N 1.07 1.19 -0.42 1.86 2.04 -0.94 -3.02 117.51 119.29 1j91 h ILE 245 Ca 0.45 -0.57 0.07 0.00 1.00 0.00 0.00 64.86 65.81 1j91 h ILE 245 Cb 0.31 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1j91 h ILE 245 CO -0.21 0.16 0.28 0.00 0.00 0.00 0.00 178.15 178.38 1j91 h ALA 246 N 0.82 2.02 0.00 1.87 0.00 -0.03 -1.16 119.26 122.78 1j91 h ALA 246 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1j91 h ALA 246 Cb 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1j91 h ALA 246 CO -0.00 -0.11 0.00 0.87 0.00 0.00 0.00 179.25 180.01 1j91 h LYS 247 N 0.29 0.00 0.00 0.00 1.57 -1.10 0.11 116.57 117.44 1j91 h LYS 247 Ca 0.19 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.76 1j91 h LYS 247 Cb 0.37 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 1j91 h LYS 247 CO -0.04 0.00 -1.59 0.28 -0.57 0.00 0.00 179.45 177.53 1j91 n VAL 248 N -2.34 1.24 0.31 0.50 0.31 -0.51 -4.44 118.33 113.41 1j91 n VAL 248 Ca 0.01 -0.09 0.14 0.00 -0.01 0.00 0.00 64.34 64.39 1j91 n VAL 248 Cb 0.18 -1.92 0.42 0.00 -0.91 0.00 0.00 33.84 31.61 1j91 n VAL 248 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1j91 h LEU 249 N -0.73 0.00 0.00 7.52 3.38 -1.43 0.32 115.31 124.37 1j91 h LEU 249 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1j91 h LEU 249 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1j91 h LEU 249 CO -0.19 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.95 1j91 n GLY 250 N 0.63 0.79 0.15 0.83 0.00 0.39 -4.45 105.19 103.51 1j91 n GLY 250 Ca 0.03 -1.65 0.05 0.00 0.00 0.00 0.00 46.02 44.45 1j91 n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j91 h THR 251 N 0.00 0.47 -0.69 2.61 1.03 -1.30 -3.30 112.91 111.73 1j91 h THR 251 Ca 0.00 -1.72 -0.02 0.00 -0.01 0.00 0.00 66.41 64.66 1j91 h THR 251 Cb 0.00 2.11 -0.03 0.00 -1.07 0.00 0.00 68.15 69.16 1j91 h THR 251 CO 0.00 0.27 0.34 0.44 -0.01 0.00 0.00 175.52 176.55 1j91 h ASP 252 N 0.00 0.88 0.52 0.00 3.45 -1.89 -0.80 116.42 118.59 1j91 h ASP 252 Ca -0.03 -0.09 -0.14 0.00 0.43 0.00 0.00 57.03 57.20 1j91 h ASP 252 Cb 1.28 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 39.81 1j91 h ASP 252 CO 0.04 0.74 -0.62 1.23 -1.57 0.00 0.00 179.24 179.05 1j91 h GLY 253 N 1.04 0.10 0.77 2.75 0.00 -1.83 -2.39 103.07 103.51 1j91 h GLY 253 Ca 0.24 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1j91 h GLY 253 CO -0.03 0.12 0.01 -2.00 0.00 0.00 0.00 176.54 174.64 1j91 h LEU 254 N 0.07 0.15 -0.72 3.11 5.85 -1.42 -1.65 115.31 120.70 1j91 h LEU 254 Ca -0.01 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.37 1j91 h LEU 254 Cb 1.11 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 1j91 h LEU 254 CO 0.09 0.39 0.20 0.78 -0.34 0.00 0.00 178.44 179.55 1j91 h ASN 255 N -0.09 1.07 -0.63 1.25 2.35 -1.14 0.37 115.58 118.76 1j91 h ASN 255 Ca 0.03 -0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.53 1j91 h ASN 255 Cb 0.30 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 1j91 h ASN 255 CO 0.00 1.01 0.32 0.58 -1.65 0.00 0.00 177.43 177.69 1j91 h VAL 256 N 1.08 1.21 0.08 2.81 2.07 -1.42 0.22 116.25 122.30 1j91 h VAL 256 Ca 0.23 -0.59 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 1j91 h VAL 256 Cb 0.34 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1j91 h VAL 256 CO -0.00 0.24 -0.04 0.22 0.02 0.00 0.00 177.57 178.02 1j91 h TYR 257 N 0.87 -0.10 -0.42 1.57 3.20 -0.75 0.95 116.97 122.30 1j91 h TYR 257 Ca 0.22 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 1j91 h TYR 257 Cb 0.10 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 1j91 h TYR 257 CO -0.00 0.14 0.15 -0.07 -1.64 0.00 0.00 178.16 176.74 1j91 h LEU 258 N -0.32 0.54 -0.26 2.82 3.38 -0.11 -2.23 115.31 119.12 1j91 h LEU 258 Ca -0.01 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1j91 h LEU 258 Cb 0.28 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1j91 h LEU 258 CO 0.02 0.50 -0.07 -1.13 0.09 0.00 0.00 178.44 177.85 1j91 h ASN 259 N 0.59 0.51 -0.06 -0.43 -0.00 -0.35 0.31 115.58 116.15 1j91 h ASN 259 Ca 0.14 -0.37 0.03 0.00 -0.00 0.00 0.00 56.30 56.10 1j91 h ASN 259 Cb 0.14 -0.14 -0.03 0.00 -0.00 0.00 0.00 38.32 38.29 1j91 h ASN 259 CO -0.01 0.77 -0.11 0.50 -0.00 0.00 0.00 177.43 178.57 1j91 h LYS 260 N 0.25 -0.15 -0.77 6.67 3.64 -0.36 -2.39 116.57 123.45 1j91 h LYS 260 Ca 0.06 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1j91 h LYS 260 Cb 0.55 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1j91 h LYS 260 CO 0.03 -0.10 0.00 0.66 -2.27 0.00 0.00 179.45 177.77 1j91 n TYR 261 N -5.24 0.73 -4.06 1.91 4.01 -0.88 -4.91 117.16 108.72 1j91 n TYR 261 Ca -0.04 -0.26 -0.27 0.00 -0.16 0.00 0.00 57.90 57.16 1j91 n TYR 261 Cb 0.17 -0.22 -0.04 0.00 -0.31 0.00 0.00 39.34 38.93 1j91 n TYR 261 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1j91 n ARG 262 N 0.24 -2.70 -4.65 -0.72 1.74 -0.75 -4.95 116.66 104.87 1j91 n ARG 262 Ca 0.10 0.32 -0.34 0.00 -0.77 0.00 0.00 57.85 57.17 1j91 n ARG 262 Cb 0.56 -4.32 -0.11 0.00 -1.02 0.00 0.00 32.46 27.56 1j91 n ARG 262 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1j91 s ILE 263 N -4.03 3.64 -0.18 0.55 1.01 0.10 -5.03 121.20 117.27 1j91 s ILE 263 Ca 0.04 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.19 1j91 s ILE 263 Cb -0.02 -2.48 0.03 0.00 0.01 0.00 0.00 42.46 40.00 1j91 s ILE 263 CO 0.92 0.59 -0.12 -1.61 0.00 0.00 0.00 174.94 174.72 1j91 s GLU 264 N -0.81 2.19 0.76 2.79 2.02 -1.26 -4.55 118.70 119.84 1j91 s GLU 264 Ca 0.12 -0.75 -0.12 0.00 0.02 0.00 0.00 54.97 54.24 1j91 s GLU 264 Cb -0.11 -2.32 0.06 0.00 0.10 0.00 0.00 34.13 31.85 1j91 s GLU 264 CO 0.01 -0.35 1.12 -0.51 0.02 0.00 0.00 175.26 175.55 1j91 s LEU 265 N 1.42 3.12 0.10 1.80 1.43 -1.26 -4.95 118.68 120.33 1j91 s LEU 265 Ca 0.01 1.98 -0.31 0.00 -1.03 0.00 0.00 54.13 54.78 1j91 s LEU 265 Cb -0.15 -4.54 -0.08 0.00 0.03 0.00 0.00 46.19 41.45 1j91 s LEU 265 CO -0.09 -2.13 1.52 -0.62 0.23 0.00 0.00 176.35 175.25 1j91 s ASP 266 N -2.95 6.70 0.50 2.29 3.68 -1.26 -4.77 116.67 120.85 1j91 s ASP 266 Ca 0.65 2.42 0.40 0.00 2.13 0.00 0.00 52.55 58.15 1j91 s ASP 266 Cb -0.20 -2.58 1.59 0.00 -1.45 0.00 0.00 42.92 40.29 1j91 s ASP 266 CO 0.52 -0.78 1.60 -0.65 0.13 0.00 0.00 175.17 175.99 1j91 h PRO 267 N 7.40 0.02 0.00 4.34 0.11 -1.99 0.84 132.00 142.72 1j91 h PRO 267 Ca -0.42 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.52 1j91 h PRO 267 Cb 1.20 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 1j91 h PRO 267 CO 0.90 0.01 -0.80 -0.56 -0.21 0.00 0.00 178.00 177.35 1j91 h GLN 268 N 0.02 0.00 0.15 1.05 3.07 -2.00 -2.72 115.11 114.68 1j91 h GLN 268 Ca 0.88 0.00 -0.30 0.00 0.09 0.00 0.00 58.65 59.32 1j91 h GLN 268 Cb 3.16 0.00 0.02 0.00 0.08 0.00 0.00 27.48 30.75 1j91 h GLN 268 CO -0.23 0.80 -1.28 1.25 0.09 0.00 0.00 178.83 179.46 1j91 h LEU 269 N 0.00 0.75 -0.47 0.06 5.85 0.27 -2.49 115.31 119.28 1j91 h LEU 269 Ca -0.01 -0.73 0.00 0.00 0.84 0.00 0.00 57.88 57.99 1j91 h LEU 269 Cb 1.45 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 1j91 h LEU 269 CO 0.10 1.55 0.30 -0.08 -0.34 0.00 0.00 178.44 179.97 1j91 h GLU 270 N 0.20 0.63 -0.44 1.25 4.81 -1.16 0.10 114.58 119.97 1j91 h GLU 270 Ca -0.18 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 58.92 1j91 h GLU 270 Cb 1.96 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 31.18 1j91 h GLU 270 CO 0.23 0.44 -0.06 0.00 -0.73 0.00 0.00 179.01 178.89 1j91 h ALA 271 N 1.15 1.08 -0.41 2.92 0.00 -1.55 -0.93 119.26 121.53 1j91 h ALA 271 Ca 0.17 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1j91 h ALA 271 Cb -0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1j91 h ALA 271 CO -0.03 0.57 -0.09 1.25 0.00 0.00 0.00 179.25 180.94 1j91 h LEU 272 N 0.69 0.70 -0.12 0.00 5.85 -0.91 -2.93 115.31 118.58 1j91 h LEU 272 Ca 0.13 -0.19 -0.24 0.00 0.84 0.00 0.00 57.88 58.41 1j91 h LEU 272 Cb 0.51 -0.19 0.01 0.00 0.37 0.00 0.00 40.66 41.36 1j91 h LEU 272 CO 0.03 0.83 -0.89 0.58 -0.34 0.00 0.00 178.44 178.64 1j91 h VAL 273 N 0.65 1.29 0.00 1.05 2.07 -0.70 -3.48 116.25 117.14 1j91 h VAL 273 Ca 0.12 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.51 1j91 h VAL 273 Cb 0.54 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 1j91 h VAL 273 CO 0.03 0.66 0.00 0.61 0.02 0.00 0.00 177.57 178.89 1j91 n GLY 274 N 0.86 1.30 3.07 2.17 0.00 -0.38 -4.74 105.19 107.46 1j91 n GLY 274 Ca -0.09 -0.64 -0.24 0.00 0.00 0.00 0.00 46.02 45.05 1j91 n GLY 274 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j91 s ARG 275 N 0.00 1.55 -0.02 1.61 0.52 -1.26 -4.95 118.95 116.41 1j91 s ARG 275 Ca 0.00 -0.47 -0.13 0.00 -0.52 0.00 0.00 55.73 54.61 1j91 s ARG 275 Cb 0.00 -1.34 0.02 0.00 0.52 0.00 0.00 34.95 34.15 1j91 s ARG 275 CO 0.00 0.14 0.27 -1.01 0.02 0.00 0.00 175.30 174.73 1j91 s HIS 276 N 0.27 -0.14 0.37 -0.53 3.76 -1.26 -4.98 115.29 112.78 1j91 s HIS 276 Ca -0.07 0.21 -0.11 0.00 -0.15 0.00 0.00 55.06 54.94 1j91 s HIS 276 Cb -0.12 0.07 -0.07 0.00 1.11 0.00 0.00 32.58 33.57 1j91 s HIS 276 CO 0.02 -0.36 0.73 -1.12 -0.85 0.00 0.00 174.74 173.17 1j91 s SER 277 N -1.26 6.57 0.07 1.40 0.01 -1.26 -1.28 113.70 117.95 1j91 s SER 277 Ca -0.13 1.12 -0.31 0.00 1.31 0.00 0.00 55.95 57.94 1j91 s SER 277 Cb -0.06 -2.31 -0.07 0.00 0.21 0.00 0.00 66.02 63.79 1j91 s SER 277 CO 0.03 -0.33 1.48 -0.60 0.41 0.00 0.00 173.24 174.24 1j91 s ARG 278 N -3.59 4.27 -0.41 12.44 3.52 -1.26 -4.24 118.95 129.68 1j91 s ARG 278 Ca 0.51 2.13 -0.17 0.00 -0.13 0.00 0.00 55.73 58.07 1j91 s ARG 278 Cb -0.10 -3.43 0.02 0.00 -1.56 0.00 0.00 34.95 29.87 1j91 s ARG 278 CO 0.28 -0.58 0.45 0.21 -0.81 0.00 0.00 175.30 174.85 1j91 s LYS 279 N 1.92 3.20 0.31 5.12 2.20 0.10 -4.94 119.74 127.65 1j91 s LYS 279 Ca 0.67 -0.65 -0.28 0.00 -0.36 0.00 0.00 55.97 55.35 1j91 s LYS 279 Cb -0.37 -3.94 -0.13 0.00 -1.51 0.00 0.00 37.83 31.88 1j91 s LYS 279 CO 0.30 -0.81 1.09 -0.35 -0.36 0.00 0.00 175.35 175.21 1j91 n PRO 280 N 5.64 1.58 -0.07 4.03 -0.04 -1.26 -4.81 135.00 140.06 1j91 n PRO 280 Ca -0.07 0.55 0.18 0.00 -0.04 0.00 0.00 63.50 64.12 1j91 n PRO 280 Cb 0.48 -1.99 0.60 0.00 -0.04 0.00 0.00 33.50 32.55 1j91 n PRO 280 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1j91 h TRP 281 N 2.13 0.23 -0.20 0.54 4.06 -1.96 -1.73 115.95 119.02 1j91 h TRP 281 Ca -0.42 0.01 0.06 0.00 2.06 0.00 0.00 58.89 60.60 1j91 h TRP 281 Cb 1.32 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 29.40 1j91 h TRP 281 CO 0.48 0.09 0.15 -0.07 -3.56 0.00 0.00 178.44 175.54 1j91 h LEU 282 N 0.20 0.00 -0.07 -4.49 4.07 -1.99 -2.08 115.31 110.94 1j91 h LEU 282 Ca 0.30 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.26 1j91 h LEU 282 Cb 0.91 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.65 1j91 h LEU 282 CO -0.05 0.00 0.00 0.29 -1.08 0.00 0.00 178.44 177.60 1j91 n LYS 283 N -4.36 0.01 0.00 1.13 5.02 -0.65 -1.13 118.16 118.18 1j91 n LYS 283 Ca 0.02 0.44 0.12 0.00 -2.02 0.00 0.00 58.31 56.87 1j91 n LYS 283 Cb 0.29 -1.53 0.15 0.00 -0.02 0.00 0.00 35.03 33.93 1j91 n LYS 283 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1j91 n PHE 284 N -1.54 0.00 -2.48 2.13 3.72 -0.78 -4.92 117.46 113.58 1j91 n PHE 284 Ca 0.01 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.03 1j91 n PHE 284 Cb 0.05 -0.13 -0.04 0.00 -0.94 0.00 0.00 39.48 38.42 1j91 n PHE 284 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 1j91 s MET 285 N -2.82 4.29 0.24 -1.08 1.75 -0.29 -4.94 119.30 116.45 1j91 s MET 285 Ca 0.14 1.65 -0.06 0.00 -1.25 0.00 0.00 55.69 56.17 1j91 s MET 285 Cb 0.18 -2.76 0.02 0.00 2.84 0.00 0.00 34.83 35.11 1j91 s MET 285 CO 0.69 -0.06 0.42 0.27 -0.65 0.00 0.00 175.02 175.69 1j91 n ASN 286 N 0.34 -1.20 0.01 1.11 0.23 -1.26 -5.01 115.26 109.48 1j91 n ASN 286 Ca 0.03 -2.07 0.01 0.00 -0.53 0.00 0.00 54.58 52.02 1j91 n ASN 286 Cb 0.48 2.07 0.34 0.00 -2.08 0.00 0.00 39.78 40.58 1j91 n ASN 286 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1j91 h ALA 287 N 1.93 1.48 -0.26 -2.53 0.00 -2.00 -0.66 119.26 117.22 1j91 h ALA 287 Ca -0.19 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 1j91 h ALA 287 Cb 0.76 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1j91 h ALA 287 CO 0.25 0.38 -0.60 0.22 0.00 0.00 0.00 179.25 179.51 1j91 h ASP 288 N 0.50 0.95 -0.01 0.00 3.58 -1.98 -3.34 116.42 116.12 1j91 h ASP 288 Ca 0.12 -0.53 0.00 0.00 0.42 0.00 0.00 57.03 57.03 1j91 h ASP 288 Cb 0.21 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 40.99 1j91 h ASP 288 CO -0.00 1.33 -0.33 -0.46 -2.88 0.00 0.00 179.24 176.90 1j91 n ASN 289 N -3.99 1.81 -0.30 2.28 0.23 -1.19 -4.69 115.26 109.41 1j91 n ASN 289 Ca -0.05 -1.41 0.14 0.00 -0.53 0.00 0.00 54.58 52.73 1j91 n ASN 289 Cb 0.65 0.42 0.30 0.00 -2.08 0.00 0.00 39.78 39.07 1j91 n ASN 289 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 1j91 h GLN 290 N 2.13 0.15 0.00 -3.83 -0.00 -1.23 0.12 115.11 112.44 1j91 h GLN 290 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1j91 h GLN 290 Cb 0.62 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 28.06 1j91 h GLN 290 CO 0.00 0.10 0.00 -2.39 0.00 0.00 0.00 178.83 176.54 1j91 n HIS 291 N -5.29 0.15 0.58 3.99 1.44 -1.26 -2.15 115.22 112.68 1j91 n HIS 291 Ca 0.22 0.06 0.10 0.00 -2.01 0.00 0.00 57.72 56.09 1j91 n HIS 291 Cb 0.71 -0.60 -0.13 0.00 0.12 0.00 0.00 29.99 30.09 1j91 n HIS 291 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1j91 n LEU 292 N -1.64 0.59 -4.87 2.39 4.77 0.42 -4.53 117.00 114.12 1j91 n LEU 292 Ca 0.02 -0.31 -0.36 0.00 -0.03 0.00 0.00 56.01 55.34 1j91 n LEU 292 Cb 0.12 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.15 1j91 n LEU 292 CO 0.10 0.15 -0.00 -0.69 -1.33 0.00 0.00 177.39 175.62 1j91 s VAL 293 N -3.10 5.21 0.24 4.08 1.01 -0.92 -4.90 120.40 122.03 1j91 s VAL 293 Ca 0.02 0.38 -0.16 0.00 0.00 0.00 0.00 61.98 62.22 1j91 s VAL 293 Cb 0.14 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.93 1j91 s VAL 293 CO 0.84 0.41 0.55 -0.94 0.00 0.00 0.00 175.10 175.95 1j91 s SER 294 N -1.53 -0.17 0.21 3.32 1.04 -1.26 -4.99 113.70 110.33 1j91 s SER 294 Ca 0.27 -0.76 -0.09 0.00 0.48 0.00 0.00 55.95 55.85 1j91 s SER 294 Cb -0.14 0.62 0.16 0.00 0.10 0.00 0.00 66.02 66.76 1j91 s SER 294 CO 0.15 -1.17 1.82 -0.65 0.98 0.00 0.00 173.24 174.36 1j91 h PRO 295 N 2.18 1.11 -0.33 4.02 0.11 -2.00 -2.38 132.00 134.71 1j91 h PRO 295 Ca -0.25 -0.14 -0.12 0.00 0.11 0.00 0.00 66.00 65.60 1j91 h PRO 295 Cb 1.25 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1j91 h PRO 295 CO 0.33 0.84 -0.30 1.05 -0.21 0.00 0.00 178.00 179.71 1j91 h GLU 296 N 1.09 0.69 -0.63 1.05 9.09 -1.99 -1.57 114.58 122.32 1j91 h GLU 296 Ca 0.27 -0.31 -0.01 0.00 0.05 0.00 0.00 59.36 59.36 1j91 h GLU 296 Cb 0.07 -0.02 -0.03 0.00 -1.65 0.00 0.00 28.75 27.12 1j91 h GLU 296 CO -0.04 0.90 0.34 0.00 0.05 0.00 0.00 179.01 180.26 1j91 h ALA 297 N 1.08 0.81 -0.40 1.06 0.00 -1.88 -0.01 119.26 119.91 1j91 h ALA 297 Ca 0.07 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1j91 h ALA 297 Cb 0.80 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1j91 h ALA 297 CO 0.07 0.33 0.15 0.82 0.00 0.00 0.00 179.25 180.62 1j91 h ILE 298 N 0.86 1.20 -0.50 0.00 1.08 -1.26 -1.44 117.51 117.45 1j91 h ILE 298 Ca 0.22 -0.64 -0.01 0.00 -0.39 0.00 0.00 64.86 64.04 1j91 h ILE 298 Cb 0.06 0.87 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 1j91 h ILE 298 CO -0.03 0.23 0.28 -0.78 -0.69 0.00 0.00 178.15 177.15 1j91 h ASP 299 N 0.51 0.63 0.39 1.72 3.58 -1.00 -0.78 116.42 121.47 1j91 h ASP 299 Ca 0.13 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.47 1j91 h ASP 299 Cb 0.21 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.11 1j91 h ASP 299 CO -0.01 0.54 -0.21 0.15 -2.88 0.00 0.00 179.24 176.83 1j91 h PHE 300 N 0.67 -0.54 -0.79 0.28 3.57 -0.84 -2.46 116.94 116.83 1j91 h PHE 300 Ca 0.18 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.78 1j91 h PHE 300 Cb 0.05 0.18 -0.08 0.00 2.79 0.00 0.00 35.95 38.89 1j91 h PHE 300 CO -0.02 -0.33 0.40 1.25 -2.23 0.00 0.00 178.31 177.38 1j91 h LEU 301 N -0.56 0.50 -1.96 0.59 5.85 -1.13 -0.99 115.31 117.61 1j91 h LEU 301 Ca -0.05 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1j91 h LEU 301 Cb 0.44 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 1j91 h LEU 301 CO 0.07 0.25 -0.03 -0.78 -0.34 0.00 0.00 178.44 177.61 1j91 h ASP 302 N 0.63 0.00 -0.00 1.25 3.58 -0.84 -1.14 116.42 119.90 1j91 h ASP 302 Ca 0.41 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.86 1j91 h ASP 302 Cb 0.50 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 1j91 h ASP 302 CO -0.31 0.03 -0.01 0.29 -2.88 0.00 0.00 179.24 176.36 1j91 n LYS 303 N -4.48 1.53 -0.11 0.28 5.02 -0.39 -4.12 118.16 115.88 1j91 n LYS 303 Ca -0.03 -0.80 -0.22 0.00 -2.02 0.00 0.00 58.31 55.25 1j91 n LYS 303 Cb 0.12 -1.48 -0.09 0.00 -0.02 0.00 0.00 35.03 33.56 1j91 n LYS 303 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1j91 n LEU 304 N -0.04 1.97 -4.04 -0.35 4.77 -0.50 -1.95 117.00 116.86 1j91 n LEU 304 Ca 0.20 0.17 -0.43 0.00 -0.03 0.00 0.00 56.01 55.92 1j91 n LEU 304 Cb 0.32 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1j91 n LEU 304 CO 0.17 0.58 2.03 0.18 -1.33 0.00 0.00 177.39 179.01 1j91 n LEU 305 N -3.77 6.20 -4.43 2.23 4.77 -0.79 -4.55 117.00 116.65 1j91 n LEU 305 Ca -0.43 -4.39 -0.33 0.00 -0.03 0.00 0.00 56.01 50.83 1j91 n LEU 305 Cb 0.84 -1.59 -0.14 0.00 -2.33 0.00 0.00 43.42 40.21 1j91 n LEU 305 CO 0.07 1.03 -0.45 -0.13 -1.33 0.00 0.00 177.39 176.58 1j91 s ARG 306 N 1.80 2.90 0.13 3.23 1.81 -1.26 -4.96 118.95 122.60 1j91 s ARG 306 Ca 0.44 -0.69 -0.27 0.00 -1.72 0.00 0.00 55.73 53.49 1j91 s ARG 306 Cb 0.07 -2.49 -0.04 0.00 -0.45 0.00 0.00 34.95 32.04 1j91 s ARG 306 CO -0.01 0.44 1.61 1.88 -0.68 0.00 0.00 175.30 178.54 1j91 h TYR 307 N 5.95 -0.93 -2.83 -0.53 0.05 -1.92 -3.38 116.97 113.38 1j91 h TYR 307 Ca -0.37 0.04 -0.58 0.00 0.05 0.00 0.00 58.73 57.87 1j91 h TYR 307 Cb 1.18 0.42 -0.03 0.00 1.01 0.00 0.00 36.73 39.31 1j91 h TYR 307 CO 0.50 -0.42 1.22 0.34 -1.05 0.00 0.00 178.16 178.75 1j91 s ASP 308 N -4.88 6.02 0.53 3.88 -1.08 -1.26 -4.75 116.67 115.14 1j91 s ASP 308 Ca -0.15 1.19 0.23 0.00 -0.52 0.00 0.00 52.55 53.30 1j91 s ASP 308 Cb 0.10 -2.53 1.38 0.00 -1.46 0.00 0.00 42.92 40.40 1j91 s ASP 308 CO 0.65 -1.62 2.05 1.12 0.52 0.00 0.00 175.17 177.89 1j91 h HIS 309 N 12.24 0.00 0.00 -5.34 2.07 -1.96 -0.68 115.15 121.48 1j91 h HIS 309 Ca -0.32 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.20 1j91 h HIS 309 Cb 1.15 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.13 1j91 h HIS 309 CO 0.96 0.00 0.00 1.96 -3.07 0.00 0.00 177.93 177.78 1j91 h GLN 310 N 0.00 0.00 0.00 5.12 4.20 -1.94 -3.02 115.11 119.47 1j91 h GLN 310 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1j91 h GLN 310 Cb 0.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.46 1j91 h GLN 310 CO -0.00 0.00 -0.96 0.39 -0.67 0.00 0.00 178.83 177.58 1j91 n GLU 311 N -2.62 0.48 -2.23 1.46 1.02 -0.26 -4.95 120.64 113.54 1j91 n GLU 311 Ca 0.01 0.08 -0.35 0.00 -0.02 0.00 0.00 57.16 56.87 1j91 n GLU 311 Cb 0.24 -1.74 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1j91 n GLU 311 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1j91 s ARG 312 N -3.30 3.39 0.42 3.49 0.52 -1.14 -4.95 118.95 117.37 1j91 s ARG 312 Ca 0.01 1.66 -0.26 0.00 -0.52 0.00 0.00 55.73 56.63 1j91 s ARG 312 Cb 0.11 -2.07 -0.08 0.00 0.52 0.00 0.00 34.95 33.43 1j91 s ARG 312 CO 0.78 -0.83 1.32 -0.51 0.02 0.00 0.00 175.30 176.08 1j91 s LEU 313 N -3.69 4.18 0.95 2.53 1.43 -0.82 -5.01 118.68 118.24 1j91 s LEU 313 Ca 0.72 2.69 -0.14 0.00 -1.03 0.00 0.00 54.13 56.36 1j91 s LEU 313 Cb -0.25 -3.93 0.17 0.00 0.03 0.00 0.00 46.19 42.20 1j91 s LEU 313 CO 0.29 -0.92 1.20 0.42 0.23 0.00 0.00 176.35 177.56 1j91 s THR 314 N -1.26 1.94 0.12 5.49 -4.23 -1.26 -4.85 115.64 111.60 1j91 s THR 314 Ca 0.58 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.95 1j91 s THR 314 Cb -0.39 -2.84 -0.03 0.00 1.34 0.00 0.00 72.50 70.58 1j91 s THR 314 CO 0.49 0.00 1.53 0.00 -0.54 0.00 0.00 174.62 176.10 1j91 h ALA 315 N -1.60 0.54 -0.19 3.99 0.00 -1.93 -2.21 119.26 117.85 1j91 h ALA 315 Ca -0.47 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.13 1j91 h ALA 315 Cb 1.30 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1j91 h ALA 315 CO 0.52 0.40 0.12 1.25 0.00 0.00 0.00 179.25 181.54 1j91 h LEU 316 N 0.56 0.23 -0.75 0.00 5.85 -1.93 -2.75 115.31 116.52 1j91 h LEU 316 Ca 0.10 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1j91 h LEU 316 Cb 0.62 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 1j91 h LEU 316 CO 0.04 0.21 0.49 -0.33 -0.34 0.00 0.00 178.44 178.51 1j91 h GLU 317 N 0.24 0.94 -0.93 1.25 5.08 -1.92 -2.40 114.58 116.84 1j91 h GLU 317 Ca 0.07 -0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.50 1j91 h GLU 317 Cb 0.02 -0.21 -0.07 0.00 0.50 0.00 0.00 28.75 28.98 1j91 h GLU 317 CO -0.01 0.62 0.59 0.00 -1.00 0.00 0.00 179.01 179.21 1j91 h ALA 318 N 1.30 1.70 0.00 3.43 0.00 -1.13 -1.95 119.26 122.60 1j91 h ALA 318 Ca 0.29 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1j91 h ALA 318 Cb -0.04 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1j91 h ALA 318 CO -0.09 0.07 -0.02 0.52 0.00 0.00 0.00 179.25 179.73 1j91 h MET 319 N 0.82 0.00 -0.28 0.00 2.86 -1.15 -2.10 114.93 115.09 1j91 h MET 319 Ca 0.46 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.10 1j91 h MET 319 Cb 0.59 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1j91 h MET 319 CO -0.22 0.02 0.00 0.25 1.06 0.00 0.00 176.91 178.02 1j91 n THR 320 N -3.41 0.35 -2.02 2.22 -2.24 -0.73 -4.82 114.28 103.63 1j91 n THR 320 Ca -0.02 -0.62 -0.39 0.00 -2.27 0.00 0.00 64.05 60.75 1j91 n THR 320 Cb 0.13 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 1j91 n THR 320 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1j91 s HIS 321 N -1.65 2.70 0.55 4.78 2.46 -0.79 -4.88 115.29 118.47 1j91 s HIS 321 Ca 0.36 1.42 0.31 0.00 0.47 0.00 0.00 55.06 57.62 1j91 s HIS 321 Cb 0.21 -3.65 1.47 0.00 -0.13 0.00 0.00 32.58 30.48 1j91 s HIS 321 CO 0.30 -2.19 1.87 -1.35 -2.47 0.00 0.00 174.74 170.91 1j91 h PRO 322 N 2.29 0.00 -0.45 2.88 0.11 -1.92 -1.90 132.00 133.00 1j91 h PRO 322 Ca -0.50 0.00 0.11 0.00 0.11 0.00 0.00 66.00 65.72 1j91 h PRO 322 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 1j91 h PRO 322 CO 0.61 0.00 0.31 -0.92 -0.21 0.00 0.00 178.00 177.79 1j91 h TYR 323 N 0.00 0.14 -0.65 0.65 3.20 -1.90 -0.89 116.97 117.52 1j91 h TYR 323 Ca 0.39 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.26 1j91 h TYR 323 Cb 1.65 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.87 1j91 h TYR 323 CO 0.00 0.07 0.00 1.19 -1.64 0.00 0.00 178.16 177.78 1j91 n PHE 324 N -4.44 1.42 -0.18 -3.82 3.72 -0.72 -4.67 117.46 108.77 1j91 n PHE 324 Ca 0.07 -0.61 -0.01 0.00 -0.05 0.00 0.00 57.45 56.85 1j91 n PHE 324 Cb 0.43 -0.22 0.09 0.00 -0.94 0.00 0.00 39.48 38.84 1j91 n PHE 324 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1j91 h GLN 325 N 4.05 0.37 0.39 -1.08 3.07 -1.26 -3.05 115.11 117.59 1j91 h GLN 325 Ca 0.00 -0.02 -0.02 0.00 0.09 0.00 0.00 58.65 58.70 1j91 h GLN 325 Cb 1.41 -0.08 0.00 0.00 0.08 0.00 0.00 27.48 28.89 1j91 h GLN 325 CO 0.21 0.24 -0.19 -0.56 0.09 0.00 0.00 178.83 178.63 1j91 h GLN 326 N 0.38 -0.51 0.00 0.06 -0.00 -1.83 -3.38 115.11 109.84 1j91 h GLN 326 Ca 0.28 0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.96 1j91 h GLN 326 Cb 0.32 0.12 0.00 0.00 -0.00 0.00 0.00 27.48 27.92 1j91 h GLN 326 CO -0.28 -0.27 0.00 0.28 -0.00 0.00 0.00 178.83 178.56 1j91 n VAL 327 N -5.27 0.00 0.00 1.86 0.31 -1.16 -3.95 118.33 110.13 1j91 n VAL 327 Ca -0.11 1.12 0.00 0.00 -0.01 0.00 0.00 64.34 65.34 1j91 n VAL 327 Cb 0.25 -1.64 0.00 0.00 -0.91 0.00 0.00 33.84 31.54 1j91 n VAL 327 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1j91 n ARG 328 N -1.44 0.00 -0.12 5.55 0.63 -1.21 -1.82 116.66 118.25 1j91 n ARG 328 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 1j91 n ARG 328 Cb 0.00 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.88 1j91 n ARG 328 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1j91 h ALA 329 N 0.00 0.54 -0.69 5.13 0.00 -1.85 -3.32 119.26 119.07 1j91 h ALA 329 Ca 0.00 -0.44 0.27 0.00 0.00 0.00 0.00 54.91 54.74 1j91 h ALA 329 Cb 0.00 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.57 1j91 h ALA 329 CO 0.00 0.62 0.40 0.00 0.00 0.00 0.00 179.25 180.27 1j91 n ALA 330 N -2.53 0.70 -0.95 0.00 0.00 -0.75 -0.88 120.51 116.09 1j91 n ALA 330 Ca -0.03 0.61 -0.17 0.00 0.00 0.00 0.00 53.44 53.85 1j91 n ALA 330 Cb 0.53 -0.64 0.02 0.00 0.00 0.00 0.00 19.45 19.36 1j91 n ALA 330 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1j91 n GLU 331 N -4.26 1.85 0.00 0.00 4.71 -1.24 -4.61 120.64 117.08 1j91 n GLU 331 Ca 0.24 -1.59 0.00 0.00 -0.01 0.00 0.00 57.16 55.80 1j91 n GLU 331 Cb 0.85 -1.66 0.00 0.00 -1.01 0.00 0.00 31.44 29.62 1j91 n GLU 331 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 1j91 n ASN 332 N 0.48 0.00 -0.92 1.62 5.15 -0.06 -5.16 115.26 116.37 1j91 n ASN 332 Ca 0.31 0.00 0.11 0.00 -0.60 0.00 0.00 54.58 54.41 1j91 n ASN 332 Cb 0.58 0.00 0.10 0.00 -0.53 0.00 0.00 39.78 39.92 1j91 n ASN 332 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42