#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d29 s TYR 8 N 0.00 2.50 -0.01 1.61 5.04 -1.26 -4.87 117.35 120.36 3d29 s TYR 8 Ca 0.00 0.72 0.01 0.00 -2.44 0.00 0.00 57.07 55.36 3d29 s TYR 8 Cb 0.00 -3.73 0.02 0.00 0.35 0.00 0.00 41.96 38.60 3d29 s TYR 8 CO 0.00 -2.42 1.01 -0.40 -1.34 0.00 0.00 175.55 172.40 3d29 n ASP 9 N 7.13 0.14 -4.65 4.32 5.75 -1.26 -4.19 116.55 123.79 3d29 n ASP 9 Ca 0.16 -2.06 -0.44 0.00 -0.01 0.00 0.00 54.79 52.43 3d29 n ASP 9 Cb 0.45 -0.21 -0.02 0.00 -1.03 0.00 0.00 41.12 40.30 3d29 n ASP 9 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3d29 n ARG 10 N -0.08 1.79 -2.50 0.11 0.00 -1.26 -3.48 116.66 111.24 3d29 n ARG 10 Ca 0.01 0.63 -0.42 0.00 -0.00 0.00 0.00 57.85 58.07 3d29 n ARG 10 Cb 0.70 -2.16 -0.03 0.00 0.00 0.00 0.00 32.46 30.97 3d29 n ARG 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3d29 s ALA 11 N -0.72 2.89 -0.02 5.13 0.00 -1.26 -0.06 121.76 127.71 3d29 s ALA 11 Ca 0.61 -0.82 0.12 0.00 0.00 0.00 0.00 51.96 51.87 3d29 s ALA 11 Cb -0.65 -4.09 -0.22 0.00 0.00 0.00 0.00 23.12 18.16 3d29 s ALA 11 CO 0.57 -2.85 0.77 -0.07 0.00 0.00 0.00 175.76 174.18 3d29 h LEU 12 N 12.55 0.00 -8.32 0.00 3.38 -1.84 -3.43 115.31 117.65 3d29 h LEU 12 Ca -0.26 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.00 3d29 h LEU 12 Cb 1.07 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.57 3d29 h LEU 12 CO 1.19 0.97 -0.50 -0.44 0.09 0.00 0.00 178.44 179.76 3d29 s SER 13 N -6.16 5.74 0.17 -0.43 0.01 -1.26 -4.69 113.70 107.07 3d29 s SER 13 Ca -0.04 -1.11 -0.00 0.00 1.31 0.00 0.00 55.95 56.11 3d29 s SER 13 Cb 0.08 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.25 3d29 s SER 13 CO 0.82 -0.43 0.08 0.27 0.41 0.00 0.00 173.24 174.39 3d29 s ILE 14 N 1.53 0.20 0.25 1.44 -5.25 -1.26 -4.83 121.20 113.27 3d29 s ILE 14 Ca 0.02 -1.96 -0.28 0.00 -0.99 0.00 0.00 60.65 57.44 3d29 s ILE 14 Cb -0.20 -2.28 -0.09 0.00 2.95 0.00 0.00 42.46 42.84 3d29 s ILE 14 CO 0.06 -0.25 0.91 -0.36 -1.79 0.00 0.00 174.94 173.50 3d29 s PHE 15 N -4.00 3.90 0.33 1.37 0.08 -1.26 -4.19 117.98 114.20 3d29 s PHE 15 Ca 0.31 1.82 0.08 0.00 0.12 0.00 0.00 56.93 59.26 3d29 s PHE 15 Cb 0.07 -2.92 -0.03 0.00 -0.57 0.00 0.00 43.02 39.57 3d29 s PHE 15 CO 0.07 0.41 0.21 -1.54 -0.10 0.00 0.00 175.22 174.26 3d29 s SER 16 N -1.29 5.02 0.19 1.36 1.04 -0.16 -4.92 113.70 114.94 3d29 s SER 16 Ca 0.42 -0.60 -0.03 0.00 0.48 0.00 0.00 55.95 56.23 3d29 s SER 16 Cb -0.23 -0.90 0.36 0.00 0.10 0.00 0.00 66.02 65.34 3d29 s SER 16 CO 0.29 -0.28 1.01 -2.65 0.98 0.00 0.00 173.24 172.59 3d29 n PRO 17 N -1.24 -0.06 0.00 4.02 -0.02 -1.26 0.72 135.00 137.16 3d29 n PRO 17 Ca -0.03 1.00 0.09 0.00 -2.02 0.00 0.00 63.50 62.54 3d29 n PRO 17 Cb 0.60 -1.52 0.56 0.00 -0.02 0.00 0.00 33.50 33.12 3d29 n PRO 17 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3d29 n ASP 18 N -5.00 0.00 -0.06 2.55 5.75 -1.26 -4.88 116.55 113.65 3d29 n ASP 18 Ca 0.12 -1.38 0.00 0.00 -0.01 0.00 0.00 54.79 53.52 3d29 n ASP 18 Cb 0.38 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.47 3d29 n ASP 18 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d29 n GLY 19 N 0.77 0.64 3.62 6.12 0.00 0.22 -5.08 105.19 111.49 3d29 n GLY 19 Ca 0.14 -0.74 -0.28 0.00 0.00 0.00 0.00 46.02 45.14 3d29 n GLY 19 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3d29 s HIS 20 N -2.13 2.79 -0.65 1.61 3.76 -1.22 -4.83 115.29 114.62 3d29 s HIS 20 Ca 0.00 -0.15 -0.06 0.00 -0.15 0.00 0.00 55.06 54.70 3d29 s HIS 20 Cb 0.00 -1.39 0.17 0.00 1.11 0.00 0.00 32.58 32.47 3d29 s HIS 20 CO 0.00 0.49 0.50 0.42 -0.85 0.00 0.00 174.74 175.30 3d29 s ILE 21 N -1.55 4.17 0.29 0.60 -1.09 -1.26 -0.98 121.20 121.37 3d29 s ILE 21 Ca 0.25 -2.71 0.03 0.00 -2.23 0.00 0.00 60.65 56.00 3d29 s ILE 21 Cb -0.10 -3.68 0.29 0.00 -1.58 0.00 0.00 42.46 37.38 3d29 s ILE 21 CO 0.17 -0.90 1.80 -0.26 -1.23 0.00 0.00 174.94 174.52 3d29 h PHE 22 N 7.37 1.08 -0.32 3.97 0.04 -1.95 -1.22 116.94 125.91 3d29 h PHE 22 Ca -0.01 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 3d29 h PHE 22 Cb 0.99 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 38.79 3d29 h PHE 22 CO 0.77 0.32 0.12 1.96 -0.60 0.00 0.00 178.31 180.88 3d29 h GLN 23 N 0.85 0.44 -0.17 1.51 1.08 -1.88 0.33 115.11 117.27 3d29 h GLN 23 Ca 0.54 -0.05 -0.12 0.00 -1.45 0.00 0.00 58.65 57.56 3d29 h GLN 23 Cb 0.71 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 3d29 h GLN 23 CO -0.33 0.37 -0.38 0.28 -0.95 0.00 0.00 178.83 177.82 3d29 h VAL 24 N 0.44 1.34 -0.35 -0.54 2.07 -1.63 -1.98 116.25 115.60 3d29 h VAL 24 Ca 0.11 -1.63 -0.01 0.00 0.82 0.00 0.00 66.70 65.99 3d29 h VAL 24 Cb 0.10 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 3d29 h VAL 24 CO -0.01 0.50 0.16 -0.33 0.02 0.00 0.00 177.57 177.91 3d29 h GLU 25 N 0.20 0.51 0.00 1.57 5.08 -0.75 -1.51 114.58 119.69 3d29 h GLU 25 Ca 0.00 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3d29 h GLU 25 Cb 0.98 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 3d29 h GLU 25 CO 0.08 0.47 -0.04 1.88 -1.00 0.00 0.00 179.01 180.40 3d29 h TYR 26 N 0.43 0.00 -0.12 4.33 0.05 -0.36 -0.12 116.97 121.18 3d29 h TYR 26 Ca 0.12 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.78 3d29 h TYR 26 Cb 0.13 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 3d29 h TYR 26 CO -0.01 0.04 -0.44 0.00 -1.05 0.00 0.00 178.16 176.69 3d29 h ALA 27 N 1.96 1.03 -0.20 3.88 0.00 -0.48 -2.58 119.26 122.87 3d29 h ALA 27 Ca -0.00 -0.44 -0.15 0.00 0.00 0.00 0.00 54.91 54.32 3d29 h ALA 27 Cb 0.28 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3d29 h ALA 27 CO 0.01 0.62 -0.50 -0.07 0.00 0.00 0.00 179.25 179.30 3d29 h LEU 28 N 0.23 0.60 -1.71 0.00 3.38 -0.64 -2.66 115.31 114.51 3d29 h LEU 28 Ca 0.02 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.69 3d29 h LEU 28 Cb 0.88 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 3d29 h LEU 28 CO 0.07 1.00 0.21 -0.33 0.09 0.00 0.00 178.44 179.49 3d29 h GLU 29 N 0.43 0.38 -0.22 1.13 4.39 -1.08 0.21 114.58 119.83 3d29 h GLU 29 Ca 0.02 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 3d29 h GLU 29 Cb 1.03 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.58 3d29 h GLU 29 CO 0.10 0.25 -0.37 0.00 -1.16 0.00 0.00 179.01 177.82 3d29 h ALA 30 N 1.81 0.95 -0.33 3.43 0.00 -1.16 -2.54 119.26 121.41 3d29 h ALA 30 Ca 0.12 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.50 3d29 h ALA 30 Cb 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3d29 h ALA 30 CO -0.03 0.62 -0.26 0.28 0.00 0.00 0.00 179.25 179.86 3d29 h VAL 31 N 0.40 1.29 -0.60 0.00 2.07 -0.59 -2.91 116.25 115.91 3d29 h VAL 31 Ca 0.04 -1.41 0.05 0.00 0.82 0.00 0.00 66.70 66.19 3d29 h VAL 31 Cb 0.84 1.46 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 3d29 h VAL 31 CO 0.07 0.46 0.40 0.11 0.02 0.00 0.00 177.57 178.63 3d29 h LYS 32 N 0.53 0.62 0.00 1.57 1.57 -0.52 -0.65 116.57 119.69 3d29 h LYS 32 Ca 0.06 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3d29 h LYS 32 Cb 0.82 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.99 3d29 h LYS 32 CO 0.07 0.41 0.00 -2.13 -0.57 0.00 0.00 179.45 177.23 3d29 n ARG 33 N -4.47 0.26 -1.84 3.15 0.63 -0.97 -2.09 116.66 111.33 3d29 n ARG 33 Ca 0.08 0.27 -0.32 0.00 -0.92 0.00 0.00 57.85 56.95 3d29 n ARG 33 Cb 0.18 -1.83 0.03 0.00 0.45 0.00 0.00 32.46 31.29 3d29 n ARG 33 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 3d29 s GLY 34 N -3.59 1.97 0.58 5.14 0.00 -0.25 -4.72 107.32 106.45 3d29 s GLY 34 Ca 0.09 0.31 -0.20 0.00 0.00 0.00 0.00 44.72 44.93 3d29 s GLY 34 CO 0.56 0.63 1.12 -1.30 0.00 0.00 0.00 173.10 174.11 3d29 n THR 35 N -2.47 3.82 -2.09 0.90 -2.24 -1.26 -0.06 114.28 110.88 3d29 n THR 35 Ca 0.09 -0.50 -0.36 0.00 -2.27 0.00 0.00 64.05 61.00 3d29 n THR 35 Cb 0.53 -1.33 0.02 0.00 -2.10 0.00 0.00 70.33 67.45 3d29 n THR 35 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d29 s ALA 37 N -1.57 -0.40 0.01 0.00 0.00 0.23 -1.25 121.76 118.78 3d29 s ALA 37 Ca 0.72 0.49 -0.07 0.00 0.00 0.00 0.00 51.96 53.10 3d29 s ALA 37 Cb -0.30 -0.29 -0.00 0.00 0.00 0.00 0.00 23.12 22.53 3d29 s ALA 37 CO 0.34 -0.09 0.13 0.54 0.00 0.00 0.00 175.76 176.69 3d29 s VAL 38 N 0.18 0.10 -0.04 0.00 0.11 0.48 -0.28 120.40 120.95 3d29 s VAL 38 Ca -0.01 -0.81 -0.02 0.00 -2.93 0.00 0.00 61.98 58.22 3d29 s VAL 38 Cb -0.02 -0.57 0.03 0.00 -1.53 0.00 0.00 36.38 34.28 3d29 s VAL 38 CO -0.00 -0.44 0.09 -0.83 -3.33 0.00 0.00 175.10 170.58 3d29 s GLY 39 N -1.62 0.00 -0.03 6.54 0.00 0.68 -0.60 107.32 112.30 3d29 s GLY 39 Ca -0.12 0.41 0.02 0.00 0.00 0.00 0.00 44.72 45.04 3d29 s GLY 39 CO -0.00 0.64 -0.09 -1.34 0.00 0.00 0.00 173.10 172.31 3d29 s VAL 40 N 0.78 0.78 -0.21 1.40 -7.23 -0.56 -0.75 120.40 114.60 3d29 s VAL 40 Ca -0.06 -0.34 -0.10 0.00 -1.81 0.00 0.00 61.98 59.67 3d29 s VAL 40 Cb -0.08 -0.70 -0.05 0.00 0.56 0.00 0.00 36.38 36.10 3d29 s VAL 40 CO -0.03 0.25 0.13 -1.59 -0.31 0.00 0.00 175.10 173.54 3d29 s LYS 41 N 0.30 4.08 0.00 4.82 -2.85 -0.29 -1.15 119.74 124.64 3d29 s LYS 41 Ca -0.05 -0.28 0.00 0.00 -1.00 0.00 0.00 55.97 54.65 3d29 s LYS 41 Cb -0.10 -3.42 0.00 0.00 -2.06 0.00 0.00 37.83 32.25 3d29 s LYS 41 CO 0.01 0.18 0.00 0.41 0.10 0.00 0.00 175.35 176.05 3d29 n GLY 42 N 3.88 0.94 0.02 0.59 0.00 0.10 -4.61 105.19 106.10 3d29 n GLY 42 Ca -0.16 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.33 3d29 n GLY 42 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3d29 n LYS 43 N 0.00 0.26 -1.21 1.61 4.81 -1.20 -4.46 118.16 117.97 3d29 n LYS 43 Ca 0.00 -0.04 -0.01 0.00 -0.87 0.00 0.00 58.31 57.39 3d29 n LYS 43 Cb 0.00 -1.55 -0.02 0.00 0.02 0.00 0.00 35.03 33.48 3d29 n LYS 43 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 3d29 n ASN 44 N -1.86 0.05 -3.70 3.14 6.94 -1.26 -4.78 115.26 113.80 3d29 n ASN 44 Ca 0.02 -1.97 0.02 0.00 -0.02 0.00 0.00 54.58 52.63 3d29 n ASN 44 Cb 0.42 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.82 3d29 n ASN 44 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3d29 s VAL 46 N -2.21 -0.00 0.03 0.00 1.01 -0.91 0.00 120.40 118.33 3d29 s VAL 46 Ca 0.22 0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.27 3d29 s VAL 46 Cb 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 36.38 36.22 3d29 s VAL 46 CO -0.02 0.00 -0.21 -0.69 0.00 0.00 0.00 175.10 174.18 3d29 s VAL 47 N 0.07 1.67 -0.08 2.92 1.01 -0.30 -1.56 120.40 124.12 3d29 s VAL 47 Ca -0.00 -1.12 0.03 0.00 0.00 0.00 0.00 61.98 60.89 3d29 s VAL 47 Cb -0.01 -1.43 0.01 0.00 0.00 0.00 0.00 36.38 34.95 3d29 s VAL 47 CO 0.00 0.28 -0.17 -0.76 0.00 0.00 0.00 175.10 174.45 3d29 s LEU 48 N -0.99 1.81 0.01 3.92 1.43 -0.80 -1.50 118.68 122.57 3d29 s LEU 48 Ca 0.08 -0.40 0.05 0.00 -1.03 0.00 0.00 54.13 52.82 3d29 s LEU 48 Cb -0.09 -1.06 -0.02 0.00 0.03 0.00 0.00 46.19 45.06 3d29 s LEU 48 CO 0.01 0.08 -0.16 -0.83 0.23 0.00 0.00 176.35 175.68 3d29 s GLY 49 N 0.57 0.83 0.06 -3.19 0.00 0.23 -1.36 107.32 104.46 3d29 s GLY 49 Ca -0.16 -0.78 0.03 0.00 0.00 0.00 0.00 44.72 43.81 3d29 s GLY 49 CO 0.05 -0.71 -0.10 0.00 0.00 0.00 0.00 173.10 172.35 3d29 s GLU 51 N -2.01 3.51 -0.20 0.00 -1.05 -0.38 -2.59 118.70 115.98 3d29 s GLU 51 Ca -0.03 -0.33 -0.05 0.00 -0.15 0.00 0.00 54.97 54.41 3d29 s GLU 51 Cb -0.08 -2.94 -0.03 0.00 -0.44 0.00 0.00 34.13 30.65 3d29 s GLU 51 CO 0.00 0.52 -0.00 1.03 0.95 0.00 0.00 175.26 177.77 3d29 s ARG 52 N -2.75 3.63 1.25 -4.83 0.52 0.69 -4.61 118.95 112.86 3d29 s ARG 52 Ca 0.37 -0.51 -0.19 0.00 -0.52 0.00 0.00 55.73 54.88 3d29 s ARG 52 Cb -0.12 -3.07 0.28 0.00 0.52 0.00 0.00 34.95 32.56 3d29 s ARG 52 CO 0.27 0.04 0.63 -2.13 0.02 0.00 0.00 175.30 174.13 3d29 n ARG 53 N 4.16 -3.42 -0.38 3.54 0.63 -1.26 -4.79 116.66 115.14 3d29 n ARG 53 Ca -0.17 -1.01 0.00 0.00 -0.92 0.00 0.00 57.85 55.75 3d29 n ARG 53 Cb 0.52 -1.79 0.00 0.00 0.45 0.00 0.00 32.46 31.64 3d29 n ARG 53 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 3d29 n SER 54 N -3.83 0.00 0.27 6.15 7.64 -1.26 -4.89 113.62 117.70 3d29 n SER 54 Ca 0.08 -1.44 0.17 0.00 1.01 0.00 0.00 58.87 58.69 3d29 n SER 54 Cb 0.51 -0.09 0.91 0.00 -1.01 0.00 0.00 64.21 64.54 3d29 n SER 54 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 3d29 h THR 55 N 5.39 0.43 -2.53 0.44 2.02 -2.07 -3.40 112.91 113.20 3d29 h THR 55 Ca 0.00 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 3d29 h THR 55 Cb 1.17 0.92 -0.25 0.00 -1.74 0.00 0.00 68.15 68.26 3d29 h THR 55 CO 0.00 0.00 -0.20 -0.76 0.37 0.00 0.00 175.52 174.93 3d29 s LEU 56 N -7.43 -0.11 -0.10 2.58 2.01 -1.26 -5.15 118.68 109.21 3d29 s LEU 56 Ca -0.05 1.01 -0.02 0.00 0.01 0.00 0.00 54.13 55.08 3d29 s LEU 56 Cb 0.15 1.60 0.04 0.00 0.01 0.00 0.00 46.19 47.99 3d29 s LEU 56 CO 0.52 -0.19 0.01 -0.75 1.01 0.00 0.00 176.35 176.96 3d29 s LYS 57 N 1.00 0.61 0.00 1.70 2.36 -1.26 -4.82 119.74 119.33 3d29 s LYS 57 Ca -0.06 -0.02 0.00 0.00 -2.55 0.00 0.00 55.97 53.34 3d29 s LYS 57 Cb -0.06 -1.27 0.00 0.00 -1.05 0.00 0.00 37.83 35.45 3d29 s LYS 57 CO -0.09 -0.39 0.00 -0.11 1.55 0.00 0.00 175.35 176.31 3d29 n LEU 58 N 5.13 0.00 -4.89 5.43 7.94 -1.26 -5.16 117.00 124.19 3d29 n LEU 58 Ca -0.08 0.00 -0.30 0.00 -1.11 0.00 0.00 56.01 54.53 3d29 n LEU 58 Cb 0.49 0.00 0.05 0.00 0.53 0.00 0.00 43.42 44.49 3d29 n LEU 58 CO 0.11 0.00 0.73 -1.10 -1.11 0.00 0.00 177.39 176.02 3d29 s GLN 59 N 0.00 2.76 -0.67 1.96 -0.21 -1.26 -5.02 119.66 117.21 3d29 s GLN 59 Ca 0.00 0.36 -0.11 0.00 0.02 0.00 0.00 55.36 55.64 3d29 s GLN 59 Cb 0.00 -2.04 0.17 0.00 1.00 0.00 0.00 33.01 32.14 3d29 s GLN 59 CO 0.00 -1.06 0.57 0.34 -2.12 0.00 0.00 175.29 173.02 3d29 s ASP 60 N -4.38 6.12 0.39 5.90 3.68 -1.26 -4.92 116.67 122.19 3d29 s ASP 60 Ca 0.58 -2.47 0.20 0.00 2.13 0.00 0.00 52.55 52.99 3d29 s ASP 60 Cb -0.11 -2.08 1.09 0.00 -1.45 0.00 0.00 42.92 40.37 3d29 s ASP 60 CO 0.51 -0.58 1.57 0.71 0.13 0.00 0.00 175.17 177.50 3d29 h THR 61 N 5.30 0.00 0.07 1.71 1.35 -1.95 -2.02 112.91 117.37 3d29 h THR 61 Ca -0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.82 3d29 h THR 61 Cb 1.03 0.45 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 3d29 h THR 61 CO 0.80 0.00 -0.04 0.03 -0.25 0.00 0.00 175.52 176.06 3d29 h ARG 62 N 0.00 -0.10 0.01 4.72 3.08 -2.03 -3.36 114.38 116.70 3d29 h ARG 62 Ca 0.00 0.01 -0.29 0.00 0.07 0.00 0.00 59.98 59.77 3d29 h ARG 62 Cb 0.37 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.39 3d29 h ARG 62 CO 0.00 0.31 -1.68 -0.84 -1.07 0.00 0.00 179.97 176.69 3d29 h ILE 62 N -0.53 0.88 -2.28 2.04 3.07 -1.89 -3.47 117.51 115.33 3d29 h ILE 62 Ca -0.01 -2.72 -0.57 0.00 1.55 0.00 0.00 64.86 63.11 3d29 h ILE 62 Cb 0.45 2.45 0.04 0.00 -0.27 0.00 0.00 36.82 39.48 3d29 h ILE 62 CO 0.02 0.53 1.05 0.41 -1.05 0.00 0.00 178.15 179.11 3d29 n THR 63 N -3.09 0.39 -1.60 0.16 -1.04 -0.80 -4.86 114.28 103.44 3d29 n THR 63 Ca -0.17 -0.07 -0.50 0.00 -2.04 0.00 0.00 64.05 61.27 3d29 n THR 63 Cb 1.05 -1.94 -0.05 0.00 -1.82 0.00 0.00 70.33 67.57 3d29 n THR 63 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3d29 n PRO 64 N 5.65 1.33 -1.68 -2.82 -0.04 -1.26 -4.93 135.00 131.25 3d29 n PRO 64 Ca 0.19 0.48 -0.30 0.00 -0.04 0.00 0.00 63.50 63.84 3d29 n PRO 64 Cb 0.33 -2.10 0.18 0.00 -0.04 0.00 0.00 33.50 31.86 3d29 n PRO 64 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3d29 s SER 65 N 0.41 2.90 0.00 3.54 1.04 -1.26 -5.01 113.70 115.33 3d29 s SER 65 Ca 0.80 0.54 0.22 0.00 0.48 0.00 0.00 55.95 57.99 3d29 s SER 65 Cb -0.88 -0.78 -0.20 0.00 0.10 0.00 0.00 66.02 64.27 3d29 s SER 65 CO 0.47 -2.89 0.78 1.17 0.98 0.00 0.00 173.24 173.75 3d29 n LYS 66 N -3.92 0.31 -3.74 4.02 3.00 -1.26 -4.83 118.16 111.74 3d29 n LYS 66 Ca 0.12 -0.07 -0.37 0.00 -0.00 0.00 0.00 58.31 57.99 3d29 n LYS 66 Cb 0.60 -1.53 -0.12 0.00 0.00 0.00 0.00 35.03 33.97 3d29 n LYS 66 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3d29 s VAL 67 N -3.24 4.23 -0.04 3.15 1.01 -1.26 -4.05 120.40 120.21 3d29 s VAL 67 Ca 0.01 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.61 3d29 s VAL 67 Cb 0.15 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 3d29 s VAL 67 CO 0.87 0.20 -0.06 -0.44 0.00 0.00 0.00 175.10 175.66 3d29 s SER 68 N 1.57 4.68 -0.17 3.32 0.01 0.15 -4.92 113.70 118.35 3d29 s SER 68 Ca 0.05 -0.06 -0.22 0.00 1.31 0.00 0.00 55.95 57.03 3d29 s SER 68 Cb -0.16 -1.15 -0.03 0.00 0.21 0.00 0.00 66.02 64.89 3d29 s SER 68 CO 0.04 0.33 0.67 -0.54 0.41 0.00 0.00 173.24 174.14 3d29 s LYS 69 N -1.06 4.27 -0.08 12.44 1.02 -1.26 0.93 119.74 135.99 3d29 s LYS 69 Ca 0.14 0.72 -0.06 0.00 0.02 0.00 0.00 55.97 56.79 3d29 s LYS 69 Cb -0.11 -3.55 -0.27 0.00 -0.52 0.00 0.00 37.83 33.38 3d29 s LYS 69 CO 0.04 -0.19 0.51 0.82 -0.92 0.00 0.00 175.35 175.61 3d29 h ILE 70 N 5.09 0.76 -3.06 2.17 1.08 -1.45 -3.48 117.51 118.62 3d29 h ILE 70 Ca -0.33 -2.45 -0.16 0.00 -0.39 0.00 0.00 64.86 61.53 3d29 h ILE 70 Cb 1.15 2.59 -0.04 0.00 -3.07 0.00 0.00 36.82 37.45 3d29 h ILE 70 CO 0.78 0.85 -0.11 -0.67 -0.69 0.00 0.00 178.15 178.31 3d29 n ASP 71 N -3.47 -0.55 0.02 1.72 4.64 -1.17 -4.55 116.55 113.20 3d29 n ASP 71 Ca -0.28 -1.93 0.10 0.00 -1.38 0.00 0.00 54.79 51.31 3d29 n ASP 71 Cb 1.06 1.07 0.44 0.00 -1.04 0.00 0.00 41.12 42.65 3d29 n ASP 71 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 3d29 n SER 72 N -2.04 0.09 0.00 1.67 3.41 -1.26 -3.30 113.62 112.19 3d29 n SER 72 Ca 0.01 0.52 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 3d29 n SER 72 Cb 0.28 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 3d29 n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d29 n HIS 73 N -1.60 0.00 -3.82 7.33 1.44 -1.26 -4.26 115.22 113.05 3d29 n HIS 73 Ca 0.05 -0.39 -0.13 0.00 -2.01 0.00 0.00 57.72 55.24 3d29 n HIS 73 Cb 0.25 -0.04 -0.13 0.00 0.12 0.00 0.00 29.99 30.19 3d29 n HIS 73 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 3d29 s VAL 74 N -0.77 -0.01 0.21 0.61 1.01 -1.21 -2.67 120.40 117.57 3d29 s VAL 74 Ca 0.00 0.05 0.06 0.00 0.00 0.00 0.00 61.98 62.09 3d29 s VAL 74 Cb 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 36.38 36.17 3d29 s VAL 74 CO 0.00 0.02 -0.10 0.68 0.00 0.00 0.00 175.10 175.70 3d29 s VAL 75 N 0.33 1.50 -0.02 2.92 -7.23 0.16 -1.10 120.40 116.95 3d29 s VAL 75 Ca -0.02 -2.14 -0.00 0.00 -1.81 0.00 0.00 61.98 58.01 3d29 s VAL 75 Cb -0.03 -2.13 0.02 0.00 0.56 0.00 0.00 36.38 34.79 3d29 s VAL 75 CO -0.01 -0.53 0.03 -0.22 -0.31 0.00 0.00 175.10 174.06 3d29 s LEU 76 N -3.31 1.40 0.32 1.32 0.20 0.27 -1.27 118.68 117.60 3d29 s LEU 76 Ca 0.24 0.04 0.06 0.00 0.69 0.00 0.00 54.13 55.16 3d29 s LEU 76 Cb 0.02 -0.01 -0.06 0.00 -0.43 0.00 0.00 46.19 45.70 3d29 s LEU 76 CO 0.07 -0.08 -0.01 -0.94 -0.29 0.00 0.00 176.35 175.10 3d29 s SER 77 N 0.67 2.92 0.30 3.68 1.04 -0.05 0.33 113.70 122.58 3d29 s SER 77 Ca -0.06 -1.29 -0.16 0.00 0.48 0.00 0.00 55.95 54.93 3d29 s SER 77 Cb -0.08 -0.20 0.02 0.00 0.10 0.00 0.00 66.02 65.86 3d29 s SER 77 CO -0.02 -0.44 0.65 0.72 0.98 0.00 0.00 173.24 175.13 3d29 s PHE 78 N -3.02 0.13 -0.02 5.02 -0.12 -1.26 -0.60 117.98 118.11 3d29 s PHE 78 Ca 0.33 -0.59 -0.00 0.00 -0.05 0.00 0.00 56.93 56.61 3d29 s PHE 78 Cb 0.06 0.53 0.03 0.00 -0.63 0.00 0.00 43.02 43.01 3d29 s PHE 78 CO 0.15 -1.24 0.04 -1.12 -0.05 0.00 0.00 175.22 172.99 3d29 s SER 79 N -3.01 0.04 0.00 1.98 0.01 -0.78 -4.79 113.70 107.15 3d29 s SER 79 Ca 0.17 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.49 3d29 s SER 79 Cb -0.04 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.17 3d29 s SER 79 CO 0.10 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.25 3d29 n GLY 80 N 3.96 0.69 3.69 3.44 0.00 -1.26 -2.21 105.19 113.50 3d29 n GLY 80 Ca -0.25 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.47 3d29 n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d29 s LEU 81 N 0.00 4.37 0.06 0.99 1.43 -0.06 -4.79 118.68 120.69 3d29 s LEU 81 Ca 0.00 2.53 -0.22 0.00 -1.03 0.00 0.00 54.13 55.41 3d29 s LEU 81 Cb 0.00 -3.56 -0.13 0.00 0.03 0.00 0.00 46.19 42.53 3d29 s LEU 81 CO 0.00 -0.92 1.55 0.78 0.23 0.00 0.00 176.35 177.99 3d29 h ASN 82 N 8.60 0.18 -0.66 2.29 -0.26 -1.97 -2.72 115.58 121.05 3d29 h ASN 82 Ca -0.43 -0.23 0.10 0.00 -0.56 0.00 0.00 56.30 55.18 3d29 h ASN 82 Cb 1.20 -0.05 -0.07 0.00 -1.06 0.00 0.00 38.32 38.34 3d29 h ASN 82 CO 0.94 0.36 0.27 0.00 -1.06 0.00 0.00 177.43 177.94 3d29 h ALA 83 N 0.83 0.88 -0.85 -0.83 0.00 -1.99 -1.66 119.26 115.63 3d29 h ALA 83 Ca 0.04 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3d29 h ALA 83 Cb 0.25 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 3d29 h ALA 83 CO 0.00 -0.15 0.48 -0.44 0.00 0.00 0.00 179.25 179.14 3d29 h ASP 84 N 0.47 1.05 -0.52 0.00 3.45 -1.92 -2.86 116.42 116.09 3d29 h ASP 84 Ca 0.33 -0.08 -0.01 0.00 0.43 0.00 0.00 57.03 57.70 3d29 h ASP 84 Cb 0.41 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 38.88 3d29 h ASP 84 CO -0.31 0.83 0.29 0.77 -1.57 0.00 0.00 179.24 179.25 3d29 h SER 85 N 1.18 0.67 -0.67 6.45 4.64 -0.99 -2.69 113.55 122.15 3d29 h SER 85 Ca 0.30 -0.05 0.08 0.00 -0.47 0.00 0.00 61.79 61.65 3d29 h SER 85 Cb 0.00 -0.17 -0.06 0.00 -0.31 0.00 0.00 62.40 61.86 3d29 h SER 85 CO -0.05 0.55 0.34 0.03 -0.87 0.00 0.00 176.83 176.83 3d29 h ARG 86 N 0.76 0.58 -0.23 4.77 3.08 -1.30 -0.39 114.38 121.65 3d29 h ARG 86 Ca 0.19 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.22 3d29 h ARG 86 Cb 0.04 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 3d29 h ARG 86 CO -0.03 0.39 0.12 0.82 -1.07 0.00 0.00 179.97 180.19 3d29 h ILE 87 N 0.60 1.00 -0.75 2.04 1.08 -1.57 -0.21 117.51 119.69 3d29 h ILE 87 Ca 0.32 -0.08 -0.05 0.00 -0.39 0.00 0.00 64.86 64.66 3d29 h ILE 87 Cb 0.29 0.73 -0.03 0.00 -3.07 0.00 0.00 36.82 34.74 3d29 h ILE 87 CO -0.24 0.05 0.27 -0.07 -0.69 0.00 0.00 178.15 177.47 3d29 h LEU 88 N 0.25 1.06 -0.59 1.44 3.38 -1.37 -2.15 115.31 117.32 3d29 h LEU 88 Ca 0.10 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 3d29 h LEU 88 Cb 0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3d29 h LEU 88 CO -0.07 0.96 -0.07 0.40 0.09 0.00 0.00 178.44 179.76 3d29 h ILE 89 N 1.10 1.27 -0.13 1.22 2.04 -0.76 -1.47 117.51 120.77 3d29 h ILE 89 Ca 0.25 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 3d29 h ILE 89 Cb 0.25 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 3d29 h ILE 89 CO -0.02 0.44 0.04 -0.08 0.00 0.00 0.00 178.15 178.53 3d29 h GLU 90 N 0.94 0.20 -0.61 2.37 4.57 -0.91 -0.98 114.58 120.17 3d29 h GLU 90 Ca 0.15 -0.05 0.03 0.00 -1.18 0.00 0.00 59.36 58.32 3d29 h GLU 90 Cb 0.63 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.15 3d29 h GLU 90 CO 0.04 0.35 0.37 0.87 -1.18 0.00 0.00 179.01 179.47 3d29 h LYS 91 N 0.01 0.71 -0.63 1.92 1.57 -1.30 -0.70 116.57 118.15 3d29 h LYS 91 Ca 0.04 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3d29 h LYS 91 Cb 0.24 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 3d29 h LYS 91 CO -0.00 0.47 0.31 0.00 -0.57 0.00 0.00 179.45 179.66 3d29 h ALA 92 N 1.27 0.81 -0.52 3.86 0.00 -1.10 -0.38 119.26 123.19 3d29 h ALA 92 Ca 0.25 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3d29 h ALA 92 Cb 0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3d29 h ALA 92 CO -0.10 0.36 0.27 0.00 0.00 0.00 0.00 179.25 179.78 3d29 h ARG 93 N 0.86 0.74 -0.33 0.00 3.08 -0.64 -0.20 114.38 117.90 3d29 h ARG 93 Ca 0.22 -0.10 0.02 0.00 0.07 0.00 0.00 59.98 60.19 3d29 h ARG 93 Cb 0.10 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3d29 h ARG 93 CO -0.03 0.59 0.18 0.28 -1.07 0.00 0.00 179.97 179.92 3d29 h VAL 94 N 0.70 1.02 -0.53 2.04 2.07 -0.80 -2.27 116.25 118.48 3d29 h VAL 94 Ca 0.18 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.54 3d29 h VAL 94 Cb 0.08 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 3d29 h VAL 94 CO -0.03 0.07 0.18 -0.08 0.02 0.00 0.00 177.57 177.73 3d29 h GLU 95 N 0.37 0.78 -0.84 1.57 4.57 -0.71 -1.80 114.58 118.51 3d29 h GLU 95 Ca 0.13 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 3d29 h GLU 95 Cb 0.02 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.44 3d29 h GLU 95 CO -0.07 0.66 0.45 0.00 -1.18 0.00 0.00 179.01 178.87 3d29 h ALA 96 N 1.44 1.08 -0.29 2.92 0.00 -0.50 0.69 119.26 124.60 3d29 h ALA 96 Ca 0.18 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 3d29 h ALA 96 Cb 0.20 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3d29 h ALA 96 CO -0.01 0.60 -0.49 1.96 0.00 0.00 0.00 179.25 181.31 3d29 h GLN 97 N 1.18 0.85 -0.45 0.00 1.08 -1.06 -2.61 115.11 114.09 3d29 h GLN 97 Ca 0.30 -0.52 -0.02 0.00 -1.45 0.00 0.00 58.65 56.95 3d29 h GLN 97 Cb 0.05 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 3d29 h GLN 97 CO -0.05 1.15 0.19 1.03 -0.95 0.00 0.00 178.83 180.21 3d29 h SER 98 N 0.62 0.62 -0.96 1.46 0.87 -1.05 -2.06 113.55 113.06 3d29 h SER 98 Ca 0.02 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 3d29 h SER 98 Cb 1.09 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 62.84 3d29 h SER 98 CO 0.11 0.61 0.62 -0.74 -0.53 0.00 0.00 176.83 176.90 3d29 h HIS 99 N 0.59 1.23 -0.44 2.24 -0.00 -0.85 -0.15 115.15 117.77 3d29 h HIS 99 Ca 0.15 0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.52 3d29 h HIS 99 Cb 0.18 -0.41 -0.02 0.00 -0.00 0.00 0.00 27.41 27.16 3d29 h HIS 99 CO 0.00 0.79 0.18 0.00 -0.00 0.00 0.00 177.93 178.90 3d29 h ARG 100 N 1.31 0.62 -0.01 5.26 3.08 -1.13 -0.02 114.38 123.48 3d29 h ARG 100 Ca 0.35 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 3d29 h ARG 100 Cb -0.12 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.81 3d29 h ARG 100 CO -0.07 0.51 -0.02 1.25 -1.07 0.00 0.00 179.97 180.56 3d29 h LEU 101 N 0.62 0.03 0.16 3.04 5.85 -0.53 -1.84 115.31 122.64 3d29 h LEU 101 Ca 0.15 -0.63 -0.23 0.00 0.84 0.00 0.00 57.88 58.02 3d29 h LEU 101 Cb 0.11 -0.01 0.03 0.00 0.37 0.00 0.00 40.66 41.16 3d29 h LEU 101 CO -0.02 0.65 -0.98 0.71 -0.34 0.00 0.00 178.44 178.46 3d29 h THR 102 N -0.59 1.45 -0.00 1.05 1.35 -0.98 -3.34 112.91 111.85 3d29 h THR 102 Ca -0.00 -2.56 0.00 0.00 -0.55 0.00 0.00 66.41 63.30 3d29 h THR 102 Cb 0.65 3.13 0.00 0.00 -1.73 0.00 0.00 68.15 70.20 3d29 h THR 102 CO 0.00 0.74 -0.44 0.18 -0.25 0.00 0.00 175.52 175.75 3d29 n LEU 103 N -4.02 0.67 -3.74 3.87 7.99 -0.03 -4.96 117.00 116.78 3d29 n LEU 103 Ca -0.14 -0.09 -0.24 0.00 -0.01 0.00 0.00 56.01 55.53 3d29 n LEU 103 Cb 0.89 -0.21 0.04 0.00 -0.11 0.00 0.00 43.42 44.04 3d29 n LEU 103 CO 0.52 0.15 0.03 -0.62 -1.51 0.00 0.00 177.39 175.96 3d29 n GLU 104 N -1.25 -5.55 -3.64 3.23 1.02 -0.69 -4.97 120.64 108.78 3d29 n GLU 104 Ca 0.07 0.65 -0.06 0.00 -0.02 0.00 0.00 57.16 57.80 3d29 n GLU 104 Cb 0.34 -5.40 -0.07 0.00 -0.02 0.00 0.00 31.44 26.29 3d29 n GLU 104 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3d29 s ASP 105 N -3.93 -0.38 0.75 1.62 3.68 -1.23 -5.05 116.67 112.14 3d29 s ASP 105 Ca 0.27 0.69 -0.13 0.00 2.13 0.00 0.00 52.55 55.52 3d29 s ASP 105 Cb -0.13 0.82 0.05 0.00 -1.45 0.00 0.00 42.92 42.21 3d29 s ASP 105 CO 0.80 -0.12 1.13 -2.16 0.13 0.00 0.00 175.17 174.95 3d29 s PRO 106 N 0.47 2.24 0.70 4.34 0.04 -1.26 -3.74 135.00 137.80 3d29 s PRO 106 Ca 0.01 1.40 -0.16 0.00 0.04 0.00 0.00 61.00 62.29 3d29 s PRO 106 Cb -0.05 -1.88 0.02 0.00 0.04 0.00 0.00 34.50 32.64 3d29 s PRO 106 CO -0.10 -1.68 1.23 0.14 0.04 0.00 0.00 177.00 176.62 3d29 s VAL 107 N -2.52 2.26 0.34 -0.36 -7.23 -1.26 -4.75 120.40 106.88 3d29 s VAL 107 Ca 0.66 0.14 -0.06 0.00 -1.81 0.00 0.00 61.98 60.91 3d29 s VAL 107 Cb -0.21 -2.81 -0.05 0.00 0.56 0.00 0.00 36.38 33.87 3d29 s VAL 107 CO 0.49 -0.06 0.63 0.42 -0.31 0.00 0.00 175.10 176.28 3d29 s THR 108 N -1.82 4.95 0.36 5.32 -4.23 -1.26 -4.57 115.64 114.38 3d29 s THR 108 Ca 0.76 0.20 0.03 0.00 -1.18 0.00 0.00 61.69 61.50 3d29 s THR 108 Cb -0.31 -3.75 0.27 0.00 1.34 0.00 0.00 72.50 70.04 3d29 s THR 108 CO 0.43 -0.43 2.02 0.58 -0.54 0.00 0.00 174.62 176.68 3d29 h VAL 109 N 1.16 1.15 -0.26 2.29 2.07 -1.93 -1.25 116.25 119.48 3d29 h VAL 109 Ca -0.48 -0.28 -0.12 0.00 0.82 0.00 0.00 66.70 66.64 3d29 h VAL 109 Cb 1.19 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 3d29 h VAL 109 CO 0.65 0.15 -0.35 -0.08 0.02 0.00 0.00 177.57 177.96 3d29 h GLU 110 N 0.82 0.57 -0.02 1.57 4.22 -1.97 -1.21 114.58 118.55 3d29 h GLU 110 Ca 0.23 -0.26 -0.01 0.00 0.08 0.00 0.00 59.36 59.40 3d29 h GLU 110 Cb -0.08 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 3d29 h GLU 110 CO -0.05 0.84 -0.01 -0.92 -2.18 0.00 0.00 179.01 176.68 3d29 h TYR 111 N 0.48 0.06 -0.59 0.92 3.20 -1.76 -0.35 116.97 118.94 3d29 h TYR 111 Ca 0.05 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.93 3d29 h TYR 111 Cb 0.83 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.05 3d29 h TYR 111 CO 0.03 0.47 0.39 1.25 -1.64 0.00 0.00 178.16 178.66 3d29 h LEU 112 N -0.37 0.62 -0.14 2.82 7.12 -1.23 -0.61 115.31 123.52 3d29 h LEU 112 Ca 0.01 -0.01 -0.04 0.00 0.13 0.00 0.00 57.88 57.96 3d29 h LEU 112 Cb 0.46 -0.15 -0.00 0.00 -0.53 0.00 0.00 40.66 40.43 3d29 h LEU 112 CO 0.00 0.44 -0.07 0.74 -0.13 0.00 0.00 178.44 179.42 3d29 h THR 113 N 0.73 1.31 -0.75 1.05 2.02 -1.08 -2.19 112.91 114.00 3d29 h THR 113 Ca 0.23 -1.10 0.03 0.00 0.77 0.00 0.00 66.41 66.34 3d29 h THR 113 Cb 0.02 1.74 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 3d29 h THR 113 CO -0.06 0.32 0.50 -0.09 0.37 0.00 0.00 175.52 176.56 3d29 h ARG 114 N -0.04 0.90 0.21 6.66 2.43 -0.43 -0.56 114.38 123.55 3d29 h ARG 114 Ca 0.03 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3d29 h ARG 114 Cb 0.53 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 3d29 h ARG 114 CO 0.02 0.59 -0.10 -0.92 -1.51 0.00 0.00 179.97 178.05 3d29 h TYR 115 N 0.92 -0.26 -0.64 2.20 3.20 -0.94 -1.50 116.97 119.95 3d29 h TYR 115 Ca 0.30 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.22 3d29 h TYR 115 Cb 0.05 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 3d29 h TYR 115 CO -0.00 0.02 0.35 0.28 -1.64 0.00 0.00 178.16 177.17 3d29 h VAL 116 N -0.55 0.97 -0.65 1.81 2.07 -1.07 -1.72 116.25 117.11 3d29 h VAL 116 Ca -0.03 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 3d29 h VAL 116 Cb 0.41 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 3d29 h VAL 116 CO 0.05 0.12 0.32 0.00 0.02 0.00 0.00 177.57 178.07 3d29 h ALA 117 N 1.33 1.33 -0.61 1.67 0.00 -1.05 -2.22 119.26 119.71 3d29 h ALA 117 Ca 0.29 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3d29 h ALA 117 Cb 0.17 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3d29 h ALA 117 CO -0.18 0.52 0.24 0.78 0.00 0.00 0.00 179.25 180.62 3d29 h GLY 118 N 0.99 0.98 0.91 0.00 0.00 -0.41 -0.43 103.07 105.11 3d29 h GLY 118 Ca 0.23 -0.54 0.02 0.00 0.00 0.00 0.00 47.33 47.04 3d29 h GLY 118 CO -0.03 0.51 0.45 -2.08 0.00 0.00 0.00 176.54 175.38 3d29 h VAL 119 N 0.85 1.12 -0.47 4.60 2.07 -0.87 0.90 116.25 124.45 3d29 h VAL 119 Ca 0.20 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 3d29 h VAL 119 Cb 0.21 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 3d29 h VAL 119 CO -0.02 0.16 0.07 1.56 0.02 0.00 0.00 177.57 179.36 3d29 h GLN 120 N 0.89 0.78 -0.36 1.57 4.20 -0.96 -2.52 115.11 118.70 3d29 h GLN 120 Ca 0.28 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 3d29 h GLN 120 Cb -0.02 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 3d29 h GLN 120 CO -0.09 0.80 0.22 0.37 -0.67 0.00 0.00 178.83 179.45 3d29 h GLN 121 N 0.64 0.49 -0.93 1.46 -0.00 -0.49 -2.10 115.11 114.19 3d29 h GLN 121 Ca 0.14 -0.05 0.12 0.00 -0.00 0.00 0.00 58.65 58.87 3d29 h GLN 121 Cb 0.40 -0.10 -0.07 0.00 0.00 0.00 0.00 27.48 27.70 3d29 h GLN 121 CO 0.01 0.38 0.59 -0.09 0.00 0.00 0.00 178.83 179.72 3d29 h ARG 122 N 0.47 0.81 0.00 1.69 2.43 -0.72 0.24 114.38 119.30 3d29 h ARG 122 Ca 0.13 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 3d29 h ARG 122 Cb 0.01 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 3d29 h ARG 122 CO -0.02 0.54 0.00 0.66 -1.51 0.00 0.00 179.97 179.64 3d29 n TYR 123 N -4.57 0.00 0.58 2.20 4.02 -0.80 -2.33 117.16 116.26 3d29 n TYR 123 Ca 0.17 0.00 0.06 0.00 -0.01 0.00 0.00 57.90 58.12 3d29 n TYR 123 Cb 0.39 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.67 3d29 n TYR 123 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 3d29 n THR 124 N -0.62 0.00 -2.76 -0.72 -2.24 0.84 -3.35 114.28 105.43 3d29 n THR 124 Ca 0.05 -0.27 -0.03 0.00 -2.27 0.00 0.00 64.05 61.52 3d29 n THR 124 Cb 0.02 1.06 0.06 0.00 -2.10 0.00 0.00 70.33 69.37 3d29 n THR 124 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d29 n GLN 125 N -0.84 1.48 -4.63 -0.78 10.64 -0.98 -4.67 117.38 117.61 3d29 n GLN 125 Ca 0.04 -3.04 -0.23 0.00 -1.83 0.00 0.00 57.00 51.93 3d29 n GLN 125 Cb 0.23 -1.15 -0.16 0.00 -0.86 0.00 0.00 30.24 28.30 3d29 n GLN 125 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 3d29 s SER 126 N -3.11 1.71 0.48 2.61 0.01 -1.14 -5.04 113.70 109.22 3d29 s SER 126 Ca 0.24 -0.27 -0.22 0.00 1.31 0.00 0.00 55.95 57.01 3d29 s SER 126 Cb 0.38 -0.46 -0.07 0.00 0.21 0.00 0.00 66.02 66.09 3d29 s SER 126 CO -0.03 0.11 1.19 -0.83 0.41 0.00 0.00 173.24 174.09 3d29 s GLY 127 N 0.10 2.78 0.00 3.44 0.00 -1.26 -3.74 107.32 108.63 3d29 s GLY 127 Ca -0.03 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.66 3d29 s GLY 127 CO 0.01 1.43 0.00 0.61 0.00 0.00 0.00 173.10 175.15 3d29 n GLY 128 N 0.45 0.51 3.09 0.20 0.00 0.91 -4.71 105.19 105.65 3d29 n GLY 128 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 3d29 n GLY 128 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d29 s VAL 129 N -2.19 0.52 0.21 1.61 -7.23 -1.25 -4.92 120.40 107.16 3d29 s VAL 129 Ca 0.00 -1.37 0.06 0.00 -1.81 0.00 0.00 61.98 58.86 3d29 s VAL 129 Cb 0.00 -0.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.95 3d29 s VAL 129 CO 0.00 -0.58 0.21 0.00 -0.31 0.00 0.00 175.10 174.42 3d29 s ARG 130 N -2.41 3.06 0.83 4.82 1.70 -1.26 -4.61 118.95 121.08 3d29 s ARG 130 Ca -0.03 -0.90 -0.10 0.00 -0.47 0.00 0.00 55.73 54.23 3d29 s ARG 130 Cb -0.04 -2.69 0.09 0.00 -0.57 0.00 0.00 34.95 31.74 3d29 s ARG 130 CO -0.02 0.45 1.11 -2.14 -1.08 0.00 0.00 175.30 173.62 3d29 s PRO 131 N -3.56 1.77 0.02 3.89 0.02 -1.21 -4.91 135.00 131.02 3d29 s PRO 131 Ca 0.33 1.32 -0.30 0.00 0.02 0.00 0.00 61.00 62.37 3d29 s PRO 131 Cb -0.09 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 3d29 s PRO 131 CO 0.25 -2.04 1.14 -0.06 -0.33 0.00 0.00 177.00 175.96 3d29 s PHE 132 N -2.80 3.46 -1.17 6.54 0.40 -1.26 -4.91 117.98 118.24 3d29 s PHE 132 Ca 0.63 1.40 -0.08 0.00 -0.60 0.00 0.00 56.93 58.29 3d29 s PHE 132 Cb -0.19 -3.33 -0.05 0.00 0.51 0.00 0.00 43.02 39.95 3d29 s PHE 132 CO 0.57 -0.92 2.91 0.41 0.70 0.00 0.00 175.22 178.89 3d29 n GLY 133 N 3.15 4.30 3.10 4.36 0.00 -1.26 -4.47 105.19 114.38 3d29 n GLY 133 Ca 0.08 -1.63 -0.12 0.00 0.00 0.00 0.00 46.02 44.35 3d29 n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d29 s VAL 134 N 0.71 0.02 -0.02 1.61 1.01 -1.26 -0.88 120.40 121.59 3d29 s VAL 134 Ca 0.64 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 62.55 3d29 s VAL 134 Cb 0.22 -0.34 -0.01 0.00 0.00 0.00 0.00 36.38 36.25 3d29 s VAL 134 CO -0.07 -0.07 -0.20 -0.44 0.00 0.00 0.00 175.10 174.31 3d29 s SER 135 N -0.19 2.37 0.35 3.32 0.01 -0.94 -3.17 113.70 115.45 3d29 s SER 135 Ca -0.03 -0.37 0.08 0.00 1.31 0.00 0.00 55.95 56.94 3d29 s SER 135 Cb -0.03 -0.32 -0.07 0.00 0.21 0.00 0.00 66.02 65.81 3d29 s SER 135 CO 0.01 0.24 -0.06 0.42 0.41 0.00 0.00 173.24 174.25 3d29 s THR 136 N -0.40 2.03 -0.13 1.44 -4.23 0.25 -1.87 115.64 112.74 3d29 s THR 136 Ca 0.06 -2.14 -0.01 0.00 -1.18 0.00 0.00 61.69 58.42 3d29 s THR 136 Cb -0.08 -2.69 0.03 0.00 1.34 0.00 0.00 72.50 71.10 3d29 s THR 136 CO -0.00 -0.17 -0.06 -0.76 -0.54 0.00 0.00 174.62 173.09 3d29 s LEU 137 N -3.59 1.22 -0.11 4.79 1.43 0.23 -1.31 118.68 121.33 3d29 s LEU 137 Ca 0.33 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 53.06 3d29 s LEU 137 Cb 0.05 -0.80 -0.01 0.00 0.03 0.00 0.00 46.19 45.46 3d29 s LEU 137 CO 0.16 -0.15 -0.19 -0.63 0.23 0.00 0.00 176.35 175.77 3d29 s ILE 138 N 1.73 2.55 0.03 -0.59 1.01 0.06 -0.87 121.20 125.12 3d29 s ILE 138 Ca 0.04 -0.85 -0.10 0.00 0.00 0.00 0.00 60.65 59.75 3d29 s ILE 138 Cb -0.13 -2.02 0.01 0.00 0.01 0.00 0.00 42.46 40.32 3d29 s ILE 138 CO -0.08 0.54 0.19 0.00 0.00 0.00 0.00 174.94 175.60 3d29 s ALA 139 N 0.32 -0.40 0.00 9.38 0.00 -0.40 -0.52 121.76 130.14 3d29 s ALA 139 Ca -0.14 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 51.63 3d29 s ALA 139 Cb -0.17 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.17 3d29 s ALA 139 CO 0.07 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.93 3d29 n GLY 140 N 0.93 -0.51 2.96 0.00 0.00 -0.84 -0.67 105.19 107.05 3d29 n GLY 140 Ca -0.20 -0.96 -0.25 0.00 0.00 0.00 0.00 46.02 44.61 3d29 n GLY 140 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d29 s PHE 141 N -3.02 1.41 0.95 1.61 0.08 -1.09 -1.50 117.98 116.42 3d29 s PHE 141 Ca 0.00 -0.60 -0.12 0.00 0.12 0.00 0.00 56.93 56.33 3d29 s PHE 141 Cb 0.00 -1.11 0.07 0.00 -0.57 0.00 0.00 43.02 41.41 3d29 s PHE 141 CO 0.00 -0.37 0.56 -0.25 -0.10 0.00 0.00 175.22 175.06 3d29 n ASP 142 N 4.32 -1.56 -4.71 1.36 8.00 -1.26 -4.82 116.55 117.88 3d29 n ASP 142 Ca -0.19 0.33 -0.43 0.00 0.71 0.00 0.00 54.79 55.21 3d29 n ASP 142 Cb 0.51 -1.26 -0.03 0.00 -0.02 0.00 0.00 41.12 40.32 3d29 n ASP 142 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3d29 n PRO 143 N -2.31 2.57 -2.91 -0.24 -0.02 -1.26 -2.14 135.00 128.69 3d29 n PRO 143 Ca 0.08 0.92 -0.21 0.00 -2.02 0.00 0.00 63.50 62.27 3d29 n PRO 143 Cb 0.53 -2.73 0.02 0.00 -0.02 0.00 0.00 33.50 31.30 3d29 n PRO 143 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3d29 n ARG 14 N 3.50 -3.73 -4.14 -0.52 1.74 -1.26 -4.98 116.66 107.27 3d29 n ARG 14 Ca 0.15 0.81 -0.16 0.00 -0.77 0.00 0.00 57.85 57.89 3d29 n ARG 14 Cb 0.33 -5.58 -0.12 0.00 -1.02 0.00 0.00 32.46 26.07 3d29 n ARG 14 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3d29 s ASP 144 N -2.51 1.12 0.00 0.55 3.68 -0.91 -5.05 116.67 113.55 3d29 s ASP 144 Ca 0.23 -0.49 0.10 0.00 2.13 0.00 0.00 52.55 54.52 3d29 s ASP 144 Cb -0.11 -0.02 0.02 0.00 -1.45 0.00 0.00 42.92 41.36 3d29 s ASP 144 CO 0.29 -0.11 0.66 -0.90 0.13 0.00 0.00 175.17 175.24 3d29 n ASP 14 N 1.68 1.33 -4.65 -0.34 3.85 -1.26 -4.46 116.55 112.69 3d29 n ASP 14 Ca -0.20 -1.17 -0.43 0.00 -0.71 0.00 0.00 54.79 52.28 3d29 n ASP 14 Cb 0.55 0.36 -0.02 0.00 -1.35 0.00 0.00 41.12 40.66 3d29 n ASP 14 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 3d29 s GLU 145 N -1.21 4.16 0.47 0.11 2.12 -1.26 -4.78 118.70 118.32 3d29 s GLU 145 Ca 0.09 1.48 -0.24 0.00 0.36 0.00 0.00 54.97 56.66 3d29 s GLU 145 Cb 0.08 -3.76 -0.07 0.00 0.26 0.00 0.00 34.13 30.63 3d29 s GLU 145 CO 0.21 -0.79 1.38 -1.25 -0.54 0.00 0.00 175.26 174.27 3d29 s PRO 146 N 3.59 3.60 -0.06 4.30 0.04 -1.26 -4.61 135.00 140.59 3d29 s PRO 146 Ca 0.52 2.30 0.05 0.00 0.04 0.00 0.00 61.00 63.90 3d29 s PRO 146 Cb -0.19 -2.56 -0.00 0.00 0.04 0.00 0.00 34.50 31.79 3d29 s PRO 146 CO 0.15 -0.85 -0.20 0.15 0.04 0.00 0.00 177.00 176.29 3d29 s LYS 147 N -2.54 2.22 -0.07 4.56 -0.14 -0.56 -5.02 119.74 118.18 3d29 s LYS 147 Ca 0.63 -0.72 -0.03 0.00 -1.36 0.00 0.00 55.97 54.49 3d29 s LYS 147 Cb -0.41 -1.84 0.04 0.00 -1.68 0.00 0.00 37.83 33.94 3d29 s LYS 147 CO 0.52 0.25 0.15 -1.17 -0.76 0.00 0.00 175.35 174.33 3d29 s LEU 148 N 0.11 0.35 0.13 3.17 2.96 -1.26 -1.99 118.68 122.14 3d29 s LEU 148 Ca -0.08 0.31 0.02 0.00 -0.22 0.00 0.00 54.13 54.16 3d29 s LEU 148 Cb -0.14 0.31 -0.04 0.00 0.50 0.00 0.00 46.19 46.82 3d29 s LEU 148 CO 0.04 -0.19 -0.06 -0.31 -1.32 0.00 0.00 176.35 174.51 3d29 s TYR 149 N 1.70 1.04 -0.00 5.38 2.02 0.32 -1.82 117.35 126.00 3d29 s TYR 149 Ca -0.03 -0.91 0.02 0.00 -0.37 0.00 0.00 57.07 55.78 3d29 s TYR 149 Cb -0.12 -0.58 -0.01 0.00 -0.40 0.00 0.00 41.96 40.85 3d29 s TYR 149 CO -0.06 -0.11 -0.05 -1.14 -1.57 0.00 0.00 175.55 172.62 3d29 s GLN 150 N -3.83 0.40 0.09 -0.62 0.74 -0.42 -0.76 119.66 115.26 3d29 s GLN 150 Ca 0.16 -0.22 0.06 0.00 0.05 0.00 0.00 55.36 55.41 3d29 s GLN 150 Cb 0.05 -0.37 -0.03 0.00 1.10 0.00 0.00 33.01 33.75 3d29 s GLN 150 CO -0.02 0.10 -0.16 0.95 -0.55 0.00 0.00 175.29 175.62 3d29 s THR 151 N -0.21 1.30 0.24 -0.34 -4.23 -0.43 -2.44 115.64 109.53 3d29 s THR 151 Ca 0.01 -1.47 0.02 0.00 -1.18 0.00 0.00 61.69 59.06 3d29 s THR 151 Cb -0.03 -1.31 -0.05 0.00 1.34 0.00 0.00 72.50 72.46 3d29 s THR 151 CO -0.00 -0.24 0.05 -1.83 -0.54 0.00 0.00 174.62 172.05 3d29 s GLU 152 N -2.04 1.34 0.33 3.99 -1.05 -1.01 -0.58 118.70 119.67 3d29 s GLU 152 Ca 0.03 -1.70 0.08 0.00 -0.15 0.00 0.00 54.97 53.23 3d29 s GLU 152 Cb -0.09 -0.37 0.94 0.00 -0.44 0.00 0.00 34.13 34.18 3d29 s GLU 152 CO 0.03 -0.21 1.59 -1.35 0.95 0.00 0.00 175.26 176.27 3d29 h PRO 153 N 2.46 0.05 -0.67 -4.83 0.11 -1.77 0.29 132.00 127.64 3d29 h PRO 153 Ca -0.38 -0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.88 3d29 h PRO 153 Cb 1.23 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 3d29 h PRO 153 CO 0.63 0.03 0.46 0.66 -0.21 0.00 0.00 178.00 179.57 3d29 h SER 154 N 0.05 0.23 0.00 -2.05 4.64 -1.89 -3.39 113.55 111.14 3d29 h SER 154 Ca 0.67 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 62.01 3d29 h SER 154 Cb 1.54 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.60 3d29 h SER 154 CO -0.83 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 175.86 3d29 n GLY 155 N -1.57 0.93 3.83 -0.77 0.00 0.09 -4.25 105.19 103.45 3d29 n GLY 155 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 3d29 n GLY 155 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d29 s ILE 156 N -2.00 4.69 0.17 -0.61 1.01 -1.26 -4.58 121.20 118.63 3d29 s ILE 156 Ca 0.00 1.05 -0.07 0.00 0.00 0.00 0.00 60.65 61.63 3d29 s ILE 156 Cb 0.00 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.68 3d29 s ILE 156 CO 0.00 0.14 0.25 -0.72 0.00 0.00 0.00 174.94 174.61 3d29 s TYR 157 N -1.59 0.57 -0.07 3.97 1.13 -1.26 -2.40 117.35 117.70 3d29 s TYR 157 Ca 0.43 -0.92 -0.32 0.00 -1.41 0.00 0.00 57.07 54.86 3d29 s TYR 157 Cb -0.15 -0.17 0.12 0.00 -1.10 0.00 0.00 41.96 40.67 3d29 s TYR 157 CO 0.20 -0.71 1.19 -1.54 -2.51 0.00 0.00 175.55 172.18 3d29 s SER 158 N -3.01 -0.13 0.11 -0.18 1.04 -1.02 -4.99 113.70 105.53 3d29 s SER 158 Ca 0.22 -0.09 -0.02 0.00 0.48 0.00 0.00 55.95 56.53 3d29 s SER 158 Cb 0.04 0.20 -0.05 0.00 0.10 0.00 0.00 66.02 66.32 3d29 s SER 158 CO 0.03 -0.36 0.30 -0.94 0.98 0.00 0.00 173.24 173.25 3d29 s SER 159 N -2.61 6.42 0.05 7.02 1.04 -1.26 -1.30 113.70 123.06 3d29 s SER 159 Ca 0.11 0.42 0.02 0.00 0.48 0.00 0.00 55.95 56.98 3d29 s SER 159 Cb 0.01 -2.02 -0.03 0.00 0.10 0.00 0.00 66.02 64.09 3d29 s SER 159 CO -0.04 0.09 -0.07 0.26 0.98 0.00 0.00 173.24 174.46 3d29 s TRP 160 N -1.62 0.69 0.20 5.02 0.52 -0.76 -4.98 118.94 118.01 3d29 s TRP 160 Ca 0.38 -0.60 0.04 0.00 0.02 0.00 0.00 56.10 55.94 3d29 s TRP 160 Cb -0.12 -0.41 0.10 0.00 -1.15 0.00 0.00 33.47 31.88 3d29 s TRP 160 CO 0.27 -0.11 1.45 0.77 0.02 0.00 0.00 176.95 179.35 3d29 h SER 161 N 4.17 0.22 -3.94 2.95 0.02 -1.93 -3.41 113.55 111.63 3d29 h SER 161 Ca -0.35 -0.16 0.03 0.00 -0.84 0.00 0.00 61.79 60.47 3d29 h SER 161 Cb 1.19 -0.06 -0.23 0.00 0.14 0.00 0.00 62.40 63.44 3d29 h SER 161 CO 0.46 0.90 0.38 0.00 -1.14 0.00 0.00 176.83 177.43 3d29 s ALA 162 N -3.39 -1.89 0.18 3.77 0.00 -1.26 -1.14 121.76 118.03 3d29 s ALA 162 Ca -0.03 1.72 -0.21 0.00 0.00 0.00 0.00 51.96 53.43 3d29 s ALA 162 Cb 0.11 -0.92 0.05 0.00 0.00 0.00 0.00 23.12 22.37 3d29 s ALA 162 CO 0.81 -0.30 0.59 -1.14 0.00 0.00 0.00 175.76 175.72 3d29 s GLN 163 N -0.40 1.35 0.01 0.00 2.00 0.07 -5.00 119.66 117.69 3d29 s GLN 163 Ca -0.01 -0.61 -0.07 0.00 -2.00 0.00 0.00 55.36 52.66 3d29 s GLN 163 Cb -0.03 0.57 -0.00 0.00 0.80 0.00 0.00 33.01 34.36 3d29 s GLN 163 CO 0.00 -0.59 0.13 -0.08 -0.50 0.00 0.00 175.29 174.26 3d29 s THR 164 N -3.79 0.10 0.11 -0.34 -1.32 -1.26 -0.23 115.64 108.90 3d29 s THR 164 Ca 0.04 -0.80 -0.05 0.00 -1.21 0.00 0.00 61.69 59.67 3d29 s THR 164 Cb -0.01 -0.57 -0.02 0.00 -1.51 0.00 0.00 72.50 70.38 3d29 s THR 164 CO -0.09 -0.44 0.12 0.27 -2.21 0.00 0.00 174.62 172.27 3d29 s ILE 165 N -1.76 0.13 0.00 5.08 -4.36 0.62 -4.95 121.20 115.96 3d29 s ILE 165 Ca -0.12 -1.60 0.00 0.00 -0.26 0.00 0.00 60.65 58.67 3d29 s ILE 165 Cb -0.06 -1.72 0.00 0.00 1.25 0.00 0.00 42.46 41.93 3d29 s ILE 165 CO -0.00 -0.58 0.00 0.61 0.24 0.00 0.00 174.94 175.20 3d29 n GLY 166 N -0.07 -1.40 3.77 6.27 0.00 -1.26 -0.60 105.19 111.90 3d29 n GLY 166 Ca -0.10 -2.09 -0.41 0.00 0.00 0.00 0.00 46.02 43.42 3d29 n GLY 166 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3d29 s ARG 167 N 0.00 4.31 -1.81 1.61 1.70 0.91 -2.34 118.95 123.33 3d29 s ARG 167 Ca 0.00 2.28 0.00 0.00 -0.47 0.00 0.00 55.73 57.54 3d29 s ARG 167 Cb 0.00 -3.07 0.00 0.00 -0.57 0.00 0.00 34.95 31.31 3d29 s ARG 167 CO 0.00 -0.28 0.00 0.09 -1.08 0.00 0.00 175.30 174.03 3d29 n ASN 168 N 1.07 -5.21 0.29 -2.89 5.03 -1.26 -4.38 115.26 107.91 3d29 n ASN 168 Ca 0.01 0.42 0.18 0.00 0.87 0.00 0.00 54.58 56.06 3d29 n ASN 168 Cb 0.41 -4.21 0.82 0.00 -1.02 0.00 0.00 39.78 35.79 3d29 n ASN 168 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 3d29 h SER 169 N 0.00 0.00 -0.25 6.41 4.64 -1.76 -1.84 113.55 120.74 3d29 h SER 169 Ca -0.35 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.94 3d29 h SER 169 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 3d29 h SER 169 CO 0.51 0.03 0.05 0.50 -0.87 0.00 0.00 176.83 177.06 3d29 h LYS 170 N 0.00 0.41 0.63 4.77 1.63 -1.87 -1.69 116.57 120.45 3d29 h LYS 170 Ca -0.00 -0.10 -0.03 0.00 -0.85 0.00 0.00 60.65 59.67 3d29 h LYS 170 Cb 0.36 -0.05 0.01 0.00 -0.60 0.00 0.00 32.23 31.95 3d29 h LYS 170 CO 0.00 0.52 -0.30 1.15 -3.45 0.00 0.00 179.45 177.37 3d29 h THR 171 N 0.23 0.00 -0.33 1.00 2.02 -1.74 -2.89 112.91 111.21 3d29 h THR 171 Ca 0.08 -0.03 0.10 0.00 0.77 0.00 0.00 66.41 67.32 3d29 h THR 171 Cb 0.30 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 3d29 h THR 171 CO 0.00 0.00 0.35 1.62 0.37 0.00 0.00 175.52 177.86 3d29 h VAL 172 N -0.88 0.43 -0.14 3.16 3.04 -1.50 -0.75 116.25 119.62 3d29 h VAL 172 Ca -0.09 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.52 3d29 h VAL 172 Cb 0.65 0.73 0.00 0.00 -2.01 0.00 0.00 31.29 30.65 3d29 h VAL 172 CO 0.14 0.00 -0.25 -0.09 -1.01 0.00 0.00 177.57 176.37 3d29 h ARG 173 N 0.00 0.41 -0.27 4.17 2.43 -1.21 -2.13 114.38 117.77 3d29 h ARG 173 Ca 0.16 -0.26 0.06 0.00 -0.81 0.00 0.00 59.98 59.13 3d29 h ARG 173 Cb 0.85 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.36 3d29 h ARG 173 CO -0.00 0.85 -0.17 0.93 -1.51 0.00 0.00 179.97 180.07 3d29 h GLU 174 N 0.01 -0.14 -0.62 0.20 3.07 -0.94 0.44 114.58 116.60 3d29 h GLU 174 Ca 0.01 0.01 0.13 0.00 -0.50 0.00 0.00 59.36 59.01 3d29 h GLU 174 Cb 0.83 0.03 -0.10 0.00 -0.84 0.00 0.00 28.75 28.67 3d29 h GLU 174 CO 0.06 -0.09 0.02 0.35 -1.40 0.00 0.00 179.01 177.95 3d29 h PHE 175 N -0.14 0.00 -0.23 4.33 3.57 -1.34 -1.39 116.94 121.74 3d29 h PHE 175 Ca 0.15 0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.55 3d29 h PHE 175 Cb 0.36 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 3d29 h PHE 175 CO -0.35 -0.15 -0.45 -0.07 -2.23 0.00 0.00 178.31 175.06 3d29 h LEU 176 N 0.14 0.62 -1.38 0.59 3.38 -0.37 -2.53 115.31 115.76 3d29 h LEU 176 Ca 0.33 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 3d29 h LEU 176 Cb 0.53 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3d29 h LEU 176 CO -0.51 0.98 -0.19 -0.33 0.09 0.00 0.00 178.44 178.48 3d29 h GLU 177 N 0.46 0.18 -0.65 1.13 5.08 0.82 -0.30 114.58 121.30 3d29 h GLU 177 Ca 0.03 -0.05 -0.42 0.00 -1.00 0.00 0.00 59.36 57.93 3d29 h GLU 177 Cb 0.97 -0.02 -0.25 0.00 0.50 0.00 0.00 28.75 29.95 3d29 h GLU 177 CO 0.09 0.37 -0.04 0.36 -1.00 0.00 0.00 179.01 178.79 3d29 n LYS 178 N -4.24 2.54 0.00 2.33 2.85 -0.68 -4.38 118.16 116.58 3d29 n LYS 178 Ca -0.01 -3.48 0.00 0.00 -1.05 0.00 0.00 58.31 53.77 3d29 n LYS 178 Cb 0.30 -2.07 0.00 0.00 -0.65 0.00 0.00 35.03 32.60 3d29 n LYS 178 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3d29 n ASN 179 N -0.97 0.00 -4.18 -5.58 3.02 -0.96 -4.98 115.26 101.60 3d29 n ASN 179 Ca 0.45 -0.64 -0.32 0.00 -0.03 0.00 0.00 54.58 54.03 3d29 n ASN 179 Cb 0.98 0.00 -0.17 0.00 -0.61 0.00 0.00 39.78 39.98 3d29 n ASN 179 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3d29 s TYR 180 N 0.00 2.65 -0.26 3.10 6.14 -0.15 -4.99 117.35 123.84 3d29 s TYR 180 Ca 0.00 -1.28 -0.03 0.00 0.64 0.00 0.00 57.07 56.40 3d29 s TYR 180 Cb 0.00 -1.79 0.02 0.00 0.42 0.00 0.00 41.96 40.61 3d29 s TYR 180 CO 0.00 -0.57 -0.02 0.34 0.64 0.00 0.00 175.55 175.93 3d29 s ASP 18 N 0.71 4.52 0.39 4.32 3.68 -1.26 -4.88 116.67 124.14 3d29 s ASP 18 Ca -0.10 -0.81 0.07 0.00 2.13 0.00 0.00 52.55 53.85 3d29 s ASP 18 Cb -0.16 -1.72 0.79 0.00 -1.45 0.00 0.00 42.92 40.38 3d29 s ASP 18 CO 0.00 -0.14 1.98 0.03 0.13 0.00 0.00 175.17 177.18 3d29 h ARG 18 N 8.07 0.45 -0.20 4.34 3.08 -1.99 -2.25 114.38 125.88 3d29 h ARG 18 Ca -0.33 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 59.71 3d29 h ARG 18 Cb 1.11 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 31.03 3d29 h ARG 18 CO 0.58 0.40 -0.14 0.87 -1.07 0.00 0.00 179.97 180.61 3d29 h LYS 18 N 0.45 -0.13 -3.00 0.04 1.79 -2.05 -3.33 116.57 110.34 3d29 h LYS 18 Ca 0.11 0.01 -0.61 0.00 -2.18 0.00 0.00 60.65 57.98 3d29 h LYS 18 Cb 0.14 0.03 -0.40 0.00 -1.58 0.00 0.00 32.23 30.41 3d29 h LYS 18 CO -0.01 -0.08 -0.73 -2.00 -1.08 0.00 0.00 179.45 175.55 3d29 s GLU 18 N -6.16 1.45 0.50 3.15 2.12 -0.88 -5.12 118.70 113.76 3d29 s GLU 18 Ca -0.14 -2.21 -0.21 0.00 0.36 0.00 0.00 54.97 52.77 3d29 s GLU 18 Cb 0.11 -2.48 -0.07 0.00 0.26 0.00 0.00 34.13 31.95 3d29 s GLU 18 CO 0.68 -1.18 1.09 -2.14 -0.54 0.00 0.00 175.26 173.17 3d29 s PRO 182 N 0.09 3.64 -0.57 4.30 0.02 -1.01 -4.47 135.00 137.00 3d29 s PRO 182 Ca 0.19 1.53 -0.06 0.00 0.02 0.00 0.00 61.00 62.69 3d29 s PRO 182 Cb -0.20 -2.13 -0.19 0.00 0.02 0.00 0.00 34.50 31.99 3d29 s PRO 182 CO -0.03 -0.59 1.66 -2.30 -0.33 0.00 0.00 177.00 175.41 3d29 n PRO 183 N -0.97 0.01 0.00 5.54 -0.02 -1.26 -4.44 135.00 133.86 3d29 n PRO 183 Ca 0.10 -0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 3d29 n PRO 183 Cb 0.51 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.92 3d29 n PRO 183 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d29 n ALA 184 N 5.43 1.13 -2.66 3.55 0.00 -1.26 -3.21 120.51 123.49 3d29 n ALA 184 Ca 0.38 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.62 3d29 n ALA 184 Cb 0.30 -0.85 -0.13 0.00 0.00 0.00 0.00 19.45 18.78 3d29 n ALA 184 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3d29 s THR 185 N -2.17 1.09 0.23 0.00 2.01 -1.26 -4.75 115.64 110.78 3d29 s THR 185 Ca 0.00 -1.00 -0.07 0.00 0.31 0.00 0.00 61.69 60.93 3d29 s THR 185 Cb 0.00 -0.99 0.20 0.00 0.01 0.00 0.00 72.50 71.72 3d29 s THR 185 CO 0.00 -0.01 1.87 0.58 -0.69 0.00 0.00 174.62 176.37 3d29 h VAL 186 N 4.51 1.10 0.10 3.82 2.07 -1.95 0.21 116.25 126.11 3d29 h VAL 186 Ca -0.38 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 3d29 h VAL 186 Cb 1.18 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 3d29 h VAL 186 CO 0.44 0.18 -0.05 -0.08 0.02 0.00 0.00 177.57 178.08 3d29 h GLU 187 N 1.01 -0.13 0.00 1.57 4.81 -1.95 -1.16 114.58 118.73 3d29 h GLU 187 Ca 0.34 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 3d29 h GLU 187 Cb 0.06 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.47 3d29 h GLU 187 CO -0.13 0.17 0.00 1.05 -0.73 0.00 0.00 179.01 179.36 3d29 h GLU 188 N -0.43 0.00 0.18 1.92 4.11 -1.86 -1.49 114.58 117.02 3d29 h GLU 188 Ca -0.01 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.10 3d29 h GLU 188 Cb 0.36 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.64 3d29 h GLU 188 CO 0.02 0.00 -1.36 0.00 0.07 0.00 0.00 179.01 177.74 3d29 h VAL 190 N 0.22 0.90 0.11 0.00 2.07 -0.73 -2.86 116.25 115.96 3d29 h VAL 190 Ca -0.22 -1.51 -0.01 0.00 0.82 0.00 0.00 66.70 65.78 3d29 h VAL 190 Cb 2.04 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.73 3d29 h VAL 190 CO 0.26 0.37 -0.05 0.50 0.02 0.00 0.00 177.57 178.66 3d29 h LYS 191 N 0.00 -0.15 -0.68 1.57 3.64 -1.31 -1.37 116.57 118.28 3d29 h LYS 191 Ca -0.00 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.50 3d29 h LYS 191 Cb 0.89 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.70 3d29 h LYS 191 CO 0.05 0.29 0.45 1.25 -2.27 0.00 0.00 179.45 179.22 3d29 h LEU 192 N -0.65 0.42 -0.13 5.20 5.85 -1.50 0.19 115.31 124.70 3d29 h LEU 192 Ca -0.02 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 3d29 h LEU 192 Cb 0.50 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 3d29 h LEU 192 CO 0.03 0.24 -0.16 0.74 -0.34 0.00 0.00 178.44 178.95 3d29 h THR 193 N 0.46 1.36 -0.13 1.05 2.02 -1.39 -1.61 112.91 114.67 3d29 h THR 193 Ca 0.32 -1.36 -0.09 0.00 0.77 0.00 0.00 66.41 66.05 3d29 h THR 193 Cb 0.62 1.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.97 3d29 h THR 193 CO -0.10 0.40 -0.30 0.58 0.37 0.00 0.00 175.52 176.47 3d29 h VAL 194 N -0.06 1.26 -0.02 3.16 2.07 -0.35 -2.36 116.25 119.95 3d29 h VAL 194 Ca 0.02 -1.25 -0.00 0.00 0.82 0.00 0.00 66.70 66.29 3d29 h VAL 194 Cb 0.71 1.50 -0.00 0.00 -1.52 0.00 0.00 31.29 31.98 3d29 h VAL 194 CO 0.04 0.38 0.00 0.03 0.02 0.00 0.00 177.57 178.04 3d29 h ARG 195 N 0.22 0.02 -0.09 1.57 3.08 -0.58 -1.64 114.38 116.96 3d29 h ARG 195 Ca 0.03 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.10 3d29 h ARG 195 Cb 0.65 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 3d29 h ARG 195 CO 0.05 0.24 0.07 0.66 -1.07 0.00 0.00 179.97 179.92 3d29 h SER 196 N -0.20 0.00 0.63 7.04 4.64 -1.07 -2.16 113.55 122.44 3d29 h SER 196 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 3d29 h SER 196 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 3d29 h SER 196 CO 0.00 0.00 -1.32 -0.07 -0.87 0.00 0.00 176.83 174.57 3d29 h LEU 197 N 0.00 0.30 -2.12 5.97 3.38 -1.22 -3.29 115.31 118.33 3d29 h LEU 197 Ca 0.04 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 3d29 h LEU 197 Cb 0.18 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3d29 h LEU 197 CO -0.00 1.29 -0.08 -0.07 0.09 0.00 0.00 178.44 179.68 3d29 h LEU 198 N 0.05 0.00 -2.74 1.67 3.38 -0.63 0.60 115.31 117.64 3d29 h LEU 198 Ca -0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 3d29 h LEU 198 Cb 1.95 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.70 3d29 h LEU 198 CO 0.17 0.08 -0.00 -0.33 0.09 0.00 0.00 178.44 178.44 3d29 h GLU 199 N 0.00 0.00 0.00 1.13 4.39 -1.58 -3.24 114.58 115.28 3d29 h GLU 199 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3d29 h GLU 199 Cb 0.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 3d29 h GLU 199 CO 0.01 0.00 -0.58 0.28 -1.16 0.00 0.00 179.01 177.57 3d29 n VAL 200 N -3.38 0.00 0.20 3.13 0.31 -0.31 -4.80 118.33 113.48 3d29 n VAL 200 Ca -0.03 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.34 3d29 n VAL 200 Cb 0.08 -0.23 0.41 0.00 -0.91 0.00 0.00 33.84 33.19 3d29 n VAL 200 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3d29 h VAL 201 N 0.00 1.13 -5.41 2.52 2.07 0.09 -3.48 116.25 113.16 3d29 h VAL 201 Ca 0.00 -1.19 -0.03 0.00 0.82 0.00 0.00 66.70 66.30 3d29 h VAL 201 Cb 0.35 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 3d29 h VAL 201 CO 0.00 0.33 -0.84 0.00 0.02 0.00 0.00 177.57 177.08 3d29 n GLN 202 N -3.99 -2.69 -2.76 1.57 1.13 -1.22 -4.44 117.38 104.98 3d29 n GLN 202 Ca -0.02 2.27 0.00 0.00 -1.94 0.00 0.00 57.00 57.31 3d29 n GLN 202 Cb 0.39 -4.84 0.00 0.00 0.11 0.00 0.00 30.24 25.90 3d29 n GLN 202 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 3d29 n THR 203 N 0.34 -1.54 -3.02 5.09 -1.04 -1.26 -4.98 114.28 107.86 3d29 n THR 203 Ca 0.04 0.34 -0.14 0.00 -2.04 0.00 0.00 64.05 62.25 3d29 n THR 203 Cb 0.26 -2.47 -0.03 0.00 -1.82 0.00 0.00 70.33 66.27 3d29 n THR 203 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3d29 n GLY 206 N 1.40 0.72 0.31 3.41 0.00 -1.26 -4.98 105.19 104.79 3d29 n GLY 206 Ca 0.00 -0.36 -0.06 0.00 0.00 0.00 0.00 46.02 45.60 3d29 n GLY 206 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d29 h ALA 207 N 5.05 0.96 -0.12 4.61 0.00 -1.93 -1.09 119.26 126.74 3d29 h ALA 207 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3d29 h ALA 207 Cb 1.01 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3d29 h ALA 207 CO 0.21 0.51 0.00 0.36 0.00 0.00 0.00 179.25 180.32 3d29 n LYS 208 N -4.41 1.63 -0.19 0.00 -0.00 -1.26 -3.37 118.16 110.55 3d29 n LYS 208 Ca 0.06 -0.93 0.07 0.00 -0.00 0.00 0.00 58.31 57.51 3d29 n LYS 208 Cb 0.12 -1.40 0.18 0.00 -0.00 0.00 0.00 35.03 33.93 3d29 n LYS 208 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3d29 n ASN 209 N 0.15 3.04 -3.87 -5.58 3.02 -0.46 -4.85 115.26 106.71 3d29 n ASN 209 Ca 0.17 -1.93 -0.27 0.00 -0.03 0.00 0.00 54.58 52.52 3d29 n ASN 209 Cb 0.30 -0.25 -0.17 0.00 -0.61 0.00 0.00 39.78 39.06 3d29 n ASN 209 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3d29 s ILE 210 N -1.04 0.92 -0.11 2.41 -1.09 -0.93 -0.22 121.20 121.14 3d29 s ILE 210 Ca 0.28 -0.35 0.04 0.00 -2.23 0.00 0.00 60.65 58.39 3d29 s ILE 210 Cb 0.15 -1.04 0.00 0.00 -1.58 0.00 0.00 42.46 39.99 3d29 s ILE 210 CO 0.20 0.24 -0.23 -1.83 -1.23 0.00 0.00 174.94 172.09 3d29 s GLU 211 N 1.73 3.00 0.08 2.79 -1.05 -1.07 -4.94 118.70 119.25 3d29 s GLU 211 Ca 0.03 -0.86 0.07 0.00 -0.15 0.00 0.00 54.97 54.06 3d29 s GLU 211 Cb -0.14 -2.31 -0.04 0.00 -0.44 0.00 0.00 34.13 31.21 3d29 s GLU 211 CO -0.08 0.13 -0.15 0.42 0.95 0.00 0.00 175.26 176.54 3d29 s ILE 212 N 0.46 3.06 -0.04 1.83 1.09 -1.26 -2.19 121.20 124.15 3d29 s ILE 212 Ca -0.16 -1.27 0.01 0.00 -1.10 0.00 0.00 60.65 58.13 3d29 s ILE 212 Cb -0.17 -2.37 0.02 0.00 -1.06 0.00 0.00 42.46 38.88 3d29 s ILE 212 CO 0.06 0.20 -0.02 -0.89 -0.10 0.00 0.00 174.94 174.19 3d29 s THR 213 N -1.08 0.38 -0.14 2.92 2.01 -0.47 -1.58 115.64 117.68 3d29 s THR 213 Ca 0.18 -0.02 -0.04 0.00 0.31 0.00 0.00 61.69 62.11 3d29 s THR 213 Cb -0.11 -0.44 -0.03 0.00 0.01 0.00 0.00 72.50 71.93 3d29 s THR 213 CO 0.09 0.19 0.01 -0.69 -0.69 0.00 0.00 174.62 173.54 3d29 s VAL 214 N 1.03 4.32 -0.14 3.82 1.01 0.72 -1.90 120.40 129.27 3d29 s VAL 214 Ca -0.10 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.69 3d29 s VAL 214 Cb -0.14 -2.89 0.01 0.00 0.00 0.00 0.00 36.38 33.36 3d29 s VAL 214 CO -0.01 0.52 -0.21 0.54 0.00 0.00 0.00 175.10 175.94 3d29 s VAL 215 N -0.03 2.16 0.32 2.92 0.11 -0.60 -1.87 120.40 123.41 3d29 s VAL 215 Ca 0.03 -0.95 0.10 0.00 -2.93 0.00 0.00 61.98 58.23 3d29 s VAL 215 Cb -0.13 -1.87 -0.05 0.00 -1.53 0.00 0.00 36.38 32.80 3d29 s VAL 215 CO 0.02 0.55 -0.04 -0.54 -3.33 0.00 0.00 175.10 171.76 3d29 s LYS 216 N 0.76 2.00 0.62 1.54 1.02 0.11 -2.13 119.74 123.67 3d29 s LYS 216 Ca -0.08 -1.75 -0.19 0.00 0.02 0.00 0.00 55.97 53.97 3d29 s LYS 216 Cb -0.16 -1.89 -0.02 0.00 -0.52 0.00 0.00 37.83 35.24 3d29 s LYS 216 CO -0.01 0.19 1.25 -2.30 -0.92 0.00 0.00 175.35 173.56 3d29 n PRO 217 N -0.87 1.17 -2.60 -1.68 -0.02 -1.26 -2.87 135.00 126.86 3d29 n PRO 217 Ca -0.05 0.45 -0.08 0.00 -2.02 0.00 0.00 63.50 61.80 3d29 n PRO 217 Cb 0.62 -2.48 0.04 0.00 -0.02 0.00 0.00 33.50 31.66 3d29 n PRO 217 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3d29 n ASP 218 N -1.56 -3.01 -3.91 2.55 10.43 -1.26 -4.08 116.55 115.71 3d29 n ASP 218 Ca 0.15 -0.34 -0.25 0.00 2.57 0.00 0.00 54.79 56.92 3d29 n ASP 218 Cb 0.47 -2.91 -0.01 0.00 1.84 0.00 0.00 41.12 40.51 3d29 n ASP 218 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 3d29 n SER 219 N -2.22 -0.63 -4.13 -2.24 7.64 -1.26 -4.94 113.62 105.84 3d29 n SER 219 Ca -0.10 -0.97 -0.37 0.00 1.01 0.00 0.00 58.87 58.43 3d29 n SER 219 Cb 0.58 -3.25 -0.10 0.00 -1.01 0.00 0.00 64.21 60.44 3d29 n SER 219 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3d29 s ASP 220 N -4.32 5.38 -0.06 6.43 3.68 -1.14 -4.88 116.67 121.77 3d29 s ASP 220 Ca 0.04 -2.53 0.04 0.00 2.13 0.00 0.00 52.55 52.23 3d29 s ASP 220 Cb -0.02 -1.88 0.00 0.00 -1.45 0.00 0.00 42.92 39.57 3d29 s ASP 220 CO 0.87 -0.46 -0.17 -0.63 0.13 0.00 0.00 175.17 174.91 3d29 s ILE 221 N 0.42 1.46 -0.17 4.11 1.01 -1.26 0.07 121.20 126.84 3d29 s ILE 221 Ca 0.13 -0.71 -0.22 0.00 0.00 0.00 0.00 60.65 59.85 3d29 s ILE 221 Cb -0.21 -1.27 0.06 0.00 0.01 0.00 0.00 42.46 41.05 3d29 s ILE 221 CO -0.04 0.42 0.59 0.54 0.00 0.00 0.00 174.94 176.45 3d29 s VAL 222 N 0.22 0.01 -0.19 2.92 0.11 -0.78 -5.02 120.40 117.67 3d29 s VAL 222 Ca -0.08 -0.05 -0.07 0.00 -2.93 0.00 0.00 61.98 58.85 3d29 s VAL 222 Cb -0.13 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.83 3d29 s VAL 222 CO 0.03 -0.03 0.05 0.00 -3.33 0.00 0.00 175.10 171.82 3d29 s ALA 223 N -0.15 3.30 0.78 1.54 0.00 -1.26 -0.20 121.76 125.77 3d29 s ALA 223 Ca -0.04 -0.80 -0.11 0.00 0.00 0.00 0.00 51.96 51.01 3d29 s ALA 223 Cb -0.03 -1.87 0.06 0.00 0.00 0.00 0.00 23.12 21.28 3d29 s ALA 223 CO 0.03 0.11 1.11 -0.51 0.00 0.00 0.00 175.76 176.50 3d29 s LEU 224 N 0.52 3.07 0.38 0.00 1.02 -0.61 -4.99 118.68 118.07 3d29 s LEU 224 Ca 0.02 1.96 0.05 0.00 0.02 0.00 0.00 54.13 56.18 3d29 s LEU 224 Cb -0.13 -4.54 -0.00 0.00 0.02 0.00 0.00 46.19 41.54 3d29 s LEU 224 CO 0.01 -2.20 0.54 -0.94 0.02 0.00 0.00 176.35 173.79 3d29 s SER 225 N -3.03 5.87 0.32 2.29 1.04 -1.26 -4.65 113.70 114.28 3d29 s SER 225 Ca 0.64 -0.08 0.10 0.00 0.48 0.00 0.00 55.95 57.08 3d29 s SER 225 Cb -0.20 -1.23 0.93 0.00 0.10 0.00 0.00 66.02 65.62 3d29 s SER 225 CO 0.53 -0.57 1.68 0.28 0.98 0.00 0.00 173.24 176.15 3d29 h SER 226 N 0.71 0.44 0.74 7.02 0.02 -1.92 -1.61 113.55 118.94 3d29 h SER 226 Ca -0.45 0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 60.64 3d29 h SER 226 Cb 1.26 0.14 0.01 0.00 0.14 0.00 0.00 62.40 63.94 3d29 h SER 226 CO 0.53 -0.07 -0.35 -0.33 -1.14 0.00 0.00 176.83 175.47 3d29 h GLU 227 N 0.37 -0.95 -1.03 3.45 3.07 -1.95 1.08 114.58 118.62 3d29 h GLU 227 Ca 0.66 0.06 0.26 0.00 -0.50 0.00 0.00 59.36 59.84 3d29 h GLU 227 Cb 1.39 0.22 -0.11 0.00 -0.84 0.00 0.00 28.75 29.41 3d29 h GLU 227 CO -0.58 -0.62 0.63 0.93 -1.40 0.00 0.00 179.01 177.98 3d29 h GLU 228 N -1.19 0.48 0.05 2.33 5.08 -1.80 0.24 114.58 119.78 3d29 h GLU 228 Ca -0.10 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3d29 h GLU 228 Cb 0.78 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.92 3d29 h GLU 228 CO 0.17 0.32 -0.03 0.82 -1.00 0.00 0.00 179.01 179.29 3d29 h ILE 229 N 0.50 1.23 -1.04 3.13 2.04 -1.13 -3.16 117.51 119.08 3d29 h ILE 229 Ca 0.62 -1.57 0.27 0.00 1.00 0.00 0.00 64.86 65.18 3d29 h ILE 229 Cb 1.36 2.18 -0.11 0.00 -0.74 0.00 0.00 36.82 39.51 3d29 h ILE 229 CO -0.39 0.36 0.65 -1.13 0.00 0.00 0.00 178.15 177.64 3d29 h ASN 230 N -0.85 0.51 -0.36 1.72 -1.24 0.27 0.29 115.58 115.92 3d29 h ASN 230 Ca -0.01 0.10 -0.00 0.00 0.71 0.00 0.00 56.30 57.10 3d29 h ASN 230 Cb 0.65 0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.70 3d29 h ASN 230 CO 0.01 0.08 0.21 1.56 -1.29 0.00 0.00 177.43 178.00 3d29 h GLN 231 N 0.44 0.49 -0.55 6.67 4.20 -0.62 -0.49 115.11 125.25 3d29 h GLN 231 Ca 0.62 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.29 3d29 h GLN 231 Cb 1.46 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 29.11 3d29 h GLN 231 CO -0.37 0.37 0.36 1.88 -0.67 0.00 0.00 178.83 180.40 3d29 h TYR 232 N 0.46 0.69 -0.62 2.96 -1.99 -0.44 -1.19 116.97 116.85 3d29 h TYR 232 Ca 0.13 0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.93 3d29 h TYR 232 Cb 0.01 -0.23 -0.05 0.00 2.00 0.00 0.00 36.73 38.46 3d29 h TYR 232 CO -0.04 0.44 0.34 0.28 -0.00 0.00 0.00 178.16 179.18 3d29 h VAL 233 N 0.74 0.96 0.74 -2.88 2.07 -0.92 -2.38 116.25 114.59 3d29 h VAL 233 Ca 0.20 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 3d29 h VAL 233 Cb -0.08 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 29.97 3d29 h VAL 233 CO -0.04 0.11 -0.42 0.74 0.02 0.00 0.00 177.57 177.98 3d29 h THR 234 N 0.63 0.14 0.00 2.57 2.02 -0.41 -2.05 112.91 115.81 3d29 h THR 234 Ca 0.28 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.46 3d29 h THR 234 Cb 0.17 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 3d29 h THR 234 CO -0.17 0.00 0.10 -0.61 0.37 0.00 0.00 175.52 175.21 3d29 h GLN 235 N -1.09 0.00 0.04 6.66 4.15 -1.11 -2.31 115.11 121.45 3d29 h GLN 235 Ca -0.10 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.00 3d29 h GLN 235 Cb 0.86 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.51 3d29 h GLN 235 CO 0.12 0.00 -1.85 -0.89 -1.93 0.00 0.00 178.83 174.28 3d29 n ILE 236 N -2.71 1.65 0.35 2.39 5.41 -0.91 -3.47 119.36 122.07 3d29 n ILE 236 Ca -0.02 -0.75 0.15 0.00 1.00 0.00 0.00 62.75 63.12 3d29 n ILE 236 Cb 0.15 -1.24 0.57 0.00 -0.71 0.00 0.00 39.64 38.42 3d29 n ILE 236 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3d29 h GLU 237 N 0.02 0.00 0.16 0.38 5.08 -0.80 -2.24 114.58 117.18 3d29 h GLU 237 Ca -0.35 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 57.71 3d29 h GLU 237 Cb 2.03 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.29 3d29 h GLU 237 CO 0.08 0.00 -1.43 1.96 -1.00 0.00 0.00 179.01 178.62 3d29 h GLN 238 N 0.00 0.34 -0.89 2.33 4.20 -1.65 -2.81 115.11 116.63 3d29 h GLN 238 Ca 0.00 -0.58 0.15 0.00 0.06 0.00 0.00 58.65 58.28 3d29 h GLN 238 Cb 0.47 0.21 -0.09 0.00 0.30 0.00 0.00 27.48 28.37 3d29 h GLN 238 CO 0.00 1.25 0.49 0.93 -0.67 0.00 0.00 178.83 180.82 3d29 h GLU 239 N 0.09 0.68 0.48 1.46 4.39 -1.43 0.42 114.58 120.66 3d29 h GLU 239 Ca -0.21 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.42 3d29 h GLU 239 Cb 2.04 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.55 3d29 h GLU 239 CO 0.21 0.45 -0.23 0.87 -1.16 0.00 0.00 179.01 179.14 3d29 h LYS 240 N 0.70 -0.62 -0.71 2.33 1.57 -1.58 -3.29 116.57 114.98 3d29 h LYS 240 Ca 0.48 0.04 0.07 0.00 -1.87 0.00 0.00 60.65 59.37 3d29 h LYS 240 Cb 0.65 0.14 -0.04 0.00 0.08 0.00 0.00 32.23 33.06 3d29 h LYS 240 CO -0.35 -0.33 0.46 1.96 -0.57 0.00 0.00 179.45 180.63 3d29 h GLN 241 N -1.05 0.69 -2.13 3.15 4.20 -1.17 -2.69 115.11 116.10 3d29 h GLN 241 Ca -0.07 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 3d29 h GLN 241 Cb 0.58 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 3d29 h GLN 241 CO 0.11 0.46 0.00 0.39 -0.67 0.00 0.00 178.83 179.11 3d29 n GLU 242 N -4.48 0.73 0.00 1.46 1.02 0.14 -5.09 120.64 114.42 3d29 n GLU 242 Ca 0.10 -0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 3d29 n GLU 242 Cb 0.25 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 3d29 n GLU 242 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25