#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ig4 n ALA 2 N 0.00 1.76 0.10 3.04 0.00 -1.26 -4.80 120.51 119.36 1ig4 n ALA 2 Ca 0.00 -1.14 -0.13 0.00 0.00 0.00 0.00 53.44 52.16 1ig4 n ALA 2 Cb 0.00 -0.28 -0.08 0.00 0.00 0.00 0.00 19.45 19.09 1ig4 n ALA 2 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1ig4 h GLU 3 N 0.00 -0.21 0.00 0.00 4.57 -2.01 -3.44 114.58 113.50 1ig4 h GLU 3 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1ig4 h GLU 3 Cb 1.11 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 1ig4 h GLU 3 CO 0.00 -0.01 0.00 -0.25 -1.18 0.00 0.00 179.01 177.57 1ig4 n ASP 4 N -5.11 0.00 -4.55 1.04 8.00 -1.26 -4.95 116.55 109.71 1ig4 n ASP 4 Ca -0.09 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.00 1ig4 n ASP 4 Cb 0.17 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.24 1ig4 n ASP 4 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1ig4 s TRP 5 N 0.00 2.39 0.02 1.24 0.23 -1.24 -3.90 118.94 117.67 1ig4 s TRP 5 Ca 0.00 -0.42 -0.03 0.00 -2.03 0.00 0.00 56.10 53.63 1ig4 s TRP 5 Cb 0.00 -4.66 -0.04 0.00 0.03 0.00 0.00 33.47 28.80 1ig4 s TRP 5 CO 0.00 -2.01 0.21 -0.51 0.96 0.00 0.00 176.95 175.59 1ig4 s LEU 6 N 5.43 4.36 1.07 2.99 1.43 0.14 -4.79 118.68 129.32 1ig4 s LEU 6 Ca 0.41 0.36 -0.19 0.00 -1.03 0.00 0.00 54.13 53.68 1ig4 s LEU 6 Cb -0.04 -2.73 0.04 0.00 0.03 0.00 0.00 46.19 43.48 1ig4 s LEU 6 CO 0.03 0.23 -0.22 0.47 0.23 0.00 0.00 176.35 177.09 1ig4 n ASP 7 N 0.77 -2.59 -3.34 2.29 8.00 -1.26 0.50 116.55 120.91 1ig4 n ASP 7 Ca -0.09 -0.02 -0.23 0.00 0.71 0.00 0.00 54.79 55.16 1ig4 n ASP 7 Cb 0.52 -0.91 -0.09 0.00 -0.02 0.00 0.00 41.12 40.62 1ig4 n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ig4 n PRO 9 N 3.53 0.07 0.17 0.00 -0.04 -1.26 -3.15 135.00 134.31 1ig4 n PRO 9 Ca 0.19 0.20 0.12 0.00 -0.04 0.00 0.00 63.50 63.97 1ig4 n PRO 9 Cb 0.45 -1.50 0.61 0.00 -0.04 0.00 0.00 33.50 33.03 1ig4 n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ig4 h ALA 10 N 2.60 1.00 0.00 0.55 0.00 -1.88 -3.37 119.26 118.16 1ig4 h ALA 10 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ig4 h ALA 10 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ig4 h ALA 10 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1ig4 n LEU 11 N -2.30 0.15 0.00 0.00 4.77 -1.19 -4.53 117.00 113.90 1ig4 n LEU 11 Ca -0.01 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1ig4 n LEU 11 Cb 0.05 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1ig4 n LEU 11 CO 0.11 -0.56 0.00 0.61 -1.33 0.00 0.00 177.39 176.21 1ig4 n GLY 12 N 2.75 0.52 3.60 -0.72 0.00 -1.25 -5.09 105.19 105.00 1ig4 n GLY 12 Ca 0.00 -0.81 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 1ig4 n GLY 12 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ig4 s PRO 13 N -1.87 3.48 0.00 1.61 0.04 -1.26 -3.26 135.00 133.74 1ig4 s PRO 13 Ca 0.00 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.01 1ig4 s PRO 13 Cb 0.00 -4.08 0.00 0.00 0.04 0.00 0.00 34.50 30.46 1ig4 s PRO 13 CO 0.00 -1.69 0.00 0.41 0.04 0.00 0.00 177.00 175.76 1ig4 n GLY 14 N 5.18 4.02 3.77 0.56 0.00 -1.26 -4.82 105.19 112.64 1ig4 n GLY 14 Ca 0.17 -0.61 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 1ig4 n GLY 14 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ig4 s TRP 15 N 0.00 2.89 0.06 1.61 0.52 -1.20 -4.07 118.94 118.74 1ig4 s TRP 15 Ca 0.00 1.37 0.04 0.00 0.02 0.00 0.00 56.10 57.53 1ig4 s TRP 15 Cb 0.00 -3.75 -0.03 0.00 -1.15 0.00 0.00 33.47 28.55 1ig4 s TRP 15 CO 0.00 -2.15 -0.12 0.15 0.02 0.00 0.00 176.95 174.85 1ig4 s LYS 16 N -1.98 0.75 0.00 4.98 -0.14 -1.04 -2.58 119.74 119.73 1ig4 s LYS 16 Ca 0.52 -0.85 0.07 0.00 -1.36 0.00 0.00 55.97 54.34 1ig4 s LYS 16 Cb -0.41 -0.70 -0.03 0.00 -1.68 0.00 0.00 37.83 35.02 1ig4 s LYS 16 CO 0.54 0.15 -0.21 0.50 -0.76 0.00 0.00 175.35 175.58 1ig4 s ARG 17 N -1.57 2.15 -0.02 1.68 3.52 0.18 -1.60 118.95 123.29 1ig4 s ARG 17 Ca -0.03 -0.92 0.01 0.00 -0.13 0.00 0.00 55.73 54.65 1ig4 s ARG 17 Cb -0.09 -2.16 0.02 0.00 -1.56 0.00 0.00 34.95 31.15 1ig4 s ARG 17 CO 0.02 0.56 -0.01 0.50 -0.81 0.00 0.00 175.30 175.56 1ig4 s ARG 18 N -1.01 0.32 -0.14 5.12 3.52 0.71 0.27 118.95 127.74 1ig4 s ARG 18 Ca 0.12 0.02 -0.08 0.00 -0.13 0.00 0.00 55.73 55.66 1ig4 s ARG 18 Cb -0.10 -0.44 -0.04 0.00 -1.56 0.00 0.00 34.95 32.80 1ig4 s ARG 18 CO 0.02 -0.08 0.16 -1.21 -0.81 0.00 0.00 175.30 173.37 1ig4 s GLU 19 N 0.75 3.69 -0.33 5.12 2.02 -1.26 0.25 118.70 128.94 1ig4 s GLU 19 Ca -0.08 -0.12 0.04 0.00 0.02 0.00 0.00 54.97 54.83 1ig4 s GLU 19 Cb -0.11 -3.26 0.10 0.00 0.10 0.00 0.00 34.13 30.96 1ig4 s GLU 19 CO -0.01 0.63 0.04 0.08 0.02 0.00 0.00 175.26 176.02 1ig4 s VAL 20 N -0.61 2.21 -0.07 2.63 1.01 0.19 -4.78 120.40 120.98 1ig4 s VAL 20 Ca 0.14 -2.26 -0.01 0.00 0.00 0.00 0.00 61.98 59.85 1ig4 s VAL 20 Cb -0.12 -2.62 -0.00 0.00 0.00 0.00 0.00 36.38 33.64 1ig4 s VAL 20 CO 0.03 -0.56 2.27 0.33 0.00 0.00 0.00 175.10 177.16 1ig4 n PHE 21 N 4.29 0.31 -1.06 5.22 7.35 -1.26 0.40 117.46 132.71 1ig4 n PHE 21 Ca 0.02 -1.26 0.10 0.00 -0.76 0.00 0.00 57.45 55.55 1ig4 n PHE 21 Cb 0.42 -0.76 -0.05 0.00 0.35 0.00 0.00 39.48 39.44 1ig4 n PHE 21 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1ig4 n ARG 22 N 1.44 -1.92 0.00 -4.13 5.12 -0.22 -4.13 116.66 112.82 1ig4 n ARG 22 Ca 0.13 1.52 0.00 0.00 -1.93 0.00 0.00 57.85 57.57 1ig4 n ARG 22 Cb 0.58 -2.47 0.00 0.00 -1.16 0.00 0.00 32.46 29.41 1ig4 n ARG 22 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1ig4 n LYS 23 N -3.64 1.28 -3.65 5.56 4.76 -1.26 -4.69 118.16 116.52 1ig4 n LYS 23 Ca -0.04 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1ig4 n LYS 23 Cb 0.48 -0.76 0.00 0.00 -1.84 0.00 0.00 35.03 32.91 1ig4 n LYS 23 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1ig4 n SER 24 N -1.56 0.00 0.00 4.39 7.64 -1.26 -4.94 113.62 117.88 1ig4 n SER 24 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ig4 n SER 24 Cb 0.26 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 1ig4 n SER 24 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ig4 n GLY 25 N 0.00 1.89 0.00 0.23 0.00 -1.26 -4.03 105.19 102.02 1ig4 n GLY 25 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1ig4 n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ig4 n ALA 26 N 0.00 0.00 1.97 4.61 0.00 -1.26 -4.90 120.51 120.94 1ig4 n ALA 26 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 1ig4 n ALA 26 Cb 0.00 0.00 0.94 0.00 0.00 0.00 0.00 19.45 20.39 1ig4 n ALA 26 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ig4 n THR 27 N -0.83 0.00 -1.50 0.00 -2.24 -1.26 -4.91 114.28 103.54 1ig4 n THR 27 Ca 0.00 -0.00 -0.53 0.00 -2.27 0.00 0.00 64.05 61.25 1ig4 n THR 27 Cb 0.00 -0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 67.69 1ig4 n THR 27 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ig4 n GLY 29 N 1.81 1.20 3.87 0.00 0.00 -1.26 -4.98 105.19 105.83 1ig4 n GLY 29 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1ig4 n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ig4 s ARG 30 N -0.60 3.87 -0.38 1.61 0.52 -0.98 -4.89 118.95 118.09 1ig4 s ARG 30 Ca 0.00 0.43 -0.02 0.00 -0.52 0.00 0.00 55.73 55.63 1ig4 s ARG 30 Cb 0.00 -2.54 0.10 0.00 0.52 0.00 0.00 34.95 33.03 1ig4 s ARG 30 CO 0.00 0.21 0.15 -1.54 0.02 0.00 0.00 175.30 174.14 1ig4 s SER 31 N -2.45 5.12 -0.24 0.23 1.04 -1.25 -1.06 113.70 115.09 1ig4 s SER 31 Ca 0.50 -1.94 -0.11 0.00 0.48 0.00 0.00 55.95 54.88 1ig4 s SER 31 Cb -0.11 -1.78 -0.05 0.00 0.10 0.00 0.00 66.02 64.19 1ig4 s SER 31 CO 0.21 -0.47 0.17 -1.81 0.98 0.00 0.00 173.24 172.32 1ig4 s ASP 32 N 1.59 6.13 -0.22 7.02 1.11 0.16 -4.81 116.67 127.64 1ig4 s ASP 32 Ca 0.07 0.12 -0.11 0.00 0.18 0.00 0.00 52.55 52.81 1ig4 s ASP 32 Cb -0.22 -2.11 -0.05 0.00 1.07 0.00 0.00 42.92 41.61 1ig4 s ASP 32 CO -0.04 0.05 0.20 -0.89 1.18 0.00 0.00 175.17 175.67 1ig4 s THR 33 N 1.10 5.34 0.23 -1.27 2.01 -1.26 0.53 115.64 122.32 1ig4 s THR 33 Ca 0.08 0.28 0.08 0.00 0.31 0.00 0.00 61.69 62.45 1ig4 s THR 33 Cb -0.14 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 1ig4 s THR 33 CO 0.05 0.35 0.04 -0.31 -0.69 0.00 0.00 174.62 174.06 1ig4 s TYR 34 N 0.97 2.84 0.01 4.92 1.51 0.14 -4.61 117.35 123.13 1ig4 s TYR 34 Ca 0.10 -0.17 -0.00 0.00 -1.01 0.00 0.00 57.07 55.99 1ig4 s TYR 34 Cb -0.13 -1.30 -0.01 0.00 -0.11 0.00 0.00 41.96 40.40 1ig4 s TYR 34 CO 0.04 0.56 -0.01 0.71 -1.11 0.00 0.00 175.55 175.75 1ig4 s TYR 35 N -2.08 0.14 0.04 2.71 1.51 -0.56 -0.21 117.35 118.90 1ig4 s TYR 35 Ca 0.30 -0.28 0.02 0.00 -1.01 0.00 0.00 57.07 56.11 1ig4 s TYR 35 Cb -0.08 -0.10 -0.04 0.00 -0.11 0.00 0.00 41.96 41.63 1ig4 s TYR 35 CO 0.21 -0.11 0.02 -1.14 -1.11 0.00 0.00 175.55 173.41 1ig4 s GLN 36 N -0.83 2.76 0.78 -0.62 0.74 -0.63 -0.75 119.66 121.12 1ig4 s GLN 36 Ca -0.09 -0.68 -0.11 0.00 0.05 0.00 0.00 55.36 54.53 1ig4 s GLN 36 Cb -0.06 -2.66 0.18 0.00 1.10 0.00 0.00 33.01 31.57 1ig4 s GLN 36 CO -0.00 0.59 0.40 -1.13 -0.55 0.00 0.00 175.29 174.60 1ig4 n SER 37 N 0.97 -2.82 0.00 6.67 3.41 0.14 -2.50 113.62 119.49 1ig4 n SER 37 Ca -0.12 -0.41 0.13 0.00 -0.26 0.00 0.00 58.87 58.21 1ig4 n SER 37 Cb 0.52 -0.56 0.42 0.00 -0.26 0.00 0.00 64.21 64.34 1ig4 n SER 37 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1ig4 n PRO 38 N -2.63 0.02 -0.37 4.33 -0.04 -1.26 -3.41 135.00 131.64 1ig4 n PRO 38 Ca 0.06 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 1ig4 n PRO 38 Cb 0.28 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 1ig4 n PRO 38 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1ig4 n THR 39 N -1.54 0.00 0.00 0.52 5.66 -1.26 -4.25 114.28 113.41 1ig4 n THR 39 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1ig4 n THR 39 Cb 0.34 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.12 1ig4 n THR 39 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ig4 n GLY 40 N 0.00 0.67 0.00 1.09 0.00 -1.26 -5.17 105.19 100.52 1ig4 n GLY 40 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1ig4 n GLY 40 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ig4 n ASP 41 N 0.00 0.00 -4.66 1.61 2.03 -1.26 -4.88 116.55 109.38 1ig4 n ASP 41 Ca 0.00 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.88 1ig4 n ASP 41 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1ig4 n ASP 41 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 1ig4 s ARG 42 N 0.00 4.28 0.15 -0.67 6.06 -1.26 0.25 118.95 127.76 1ig4 s ARG 42 Ca 0.00 1.38 0.11 0.00 -2.50 0.00 0.00 55.73 54.71 1ig4 s ARG 42 Cb 0.00 -3.63 -0.04 0.00 0.06 0.00 0.00 34.95 31.34 1ig4 s ARG 42 CO 0.00 -0.59 -0.24 0.42 -2.50 0.00 0.00 175.30 172.39 1ig4 s ILE 43 N 3.05 2.39 0.00 4.11 -1.09 0.07 -4.94 121.20 124.79 1ig4 s ILE 43 Ca 0.45 -1.82 0.00 0.00 -2.23 0.00 0.00 60.65 57.05 1ig4 s ILE 43 Cb -0.16 -2.10 0.00 0.00 -1.58 0.00 0.00 42.46 38.63 1ig4 s ILE 43 CO 0.08 0.01 0.00 0.54 -1.23 0.00 0.00 174.94 174.34 1ig4 n ARG 44 N 0.64 2.59 -0.03 2.79 1.74 -1.26 -1.50 116.66 121.63 1ig4 n ARG 44 Ca -0.16 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 1ig4 n ARG 44 Cb 0.54 -0.73 0.00 0.00 -1.02 0.00 0.00 32.46 31.25 1ig4 n ARG 44 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1ig4 n SER 45 N -0.91 0.00 0.01 0.55 7.64 -1.26 -4.47 113.62 115.18 1ig4 n SER 45 Ca 0.00 -0.02 -0.18 0.00 1.01 0.00 0.00 58.87 59.68 1ig4 n SER 45 Cb 0.00 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.08 1ig4 n SER 45 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1ig4 h LYS 46 N 0.00 0.37 0.79 1.43 3.64 -1.95 -2.55 116.57 118.29 1ig4 h LYS 46 Ca 0.00 -0.43 -0.04 0.00 -1.27 0.00 0.00 60.65 58.92 1ig4 h LYS 46 Cb 0.00 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1ig4 h LYS 46 CO 0.00 1.11 -0.43 0.28 -2.27 0.00 0.00 179.45 178.14 1ig4 h VAL 47 N -0.18 0.12 -1.01 2.00 2.07 -1.97 0.55 116.25 117.84 1ig4 h VAL 47 Ca -0.08 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.66 1ig4 h VAL 47 Cb 1.34 0.12 -0.11 0.00 -1.52 0.00 0.00 31.29 31.12 1ig4 h VAL 47 CO 0.12 0.00 0.62 -0.08 0.02 0.00 0.00 177.57 178.24 1ig4 h GLU 48 N -1.13 0.59 -0.49 1.57 4.81 -1.97 0.65 114.58 118.62 1ig4 h GLU 48 Ca -0.10 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.01 1ig4 h GLU 48 Cb 0.89 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.12 1ig4 h GLU 48 CO 0.14 0.39 -0.00 1.25 -0.73 0.00 0.00 179.01 180.06 1ig4 h LEU 49 N 0.61 0.84 -1.06 1.64 5.85 -0.93 -1.58 115.31 120.68 1ig4 h LEU 49 Ca 0.60 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1ig4 h LEU 49 Cb 1.15 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.95 1ig4 h LEU 49 CO -0.39 0.94 0.00 0.74 -0.34 0.00 0.00 178.44 179.40 1ig4 h THR 50 N 0.72 0.00 0.09 1.05 2.02 0.56 -2.83 112.91 114.51 1ig4 h THR 50 Ca 0.14 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.15 1ig4 h THR 50 Cb 0.51 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1ig4 h THR 50 CO 0.03 0.00 -0.04 0.03 0.37 0.00 0.00 175.52 175.90 1ig4 h ARG 51 N 0.00 -0.11 -0.01 6.66 3.08 0.18 -3.03 114.38 121.15 1ig4 h ARG 51 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1ig4 h ARG 51 Cb 0.24 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 1ig4 h ARG 51 CO 0.00 -0.06 0.02 -0.92 -1.07 0.00 0.00 179.97 177.94 1ig4 h TYR 52 N -1.03 0.00 -0.13 3.04 3.20 -1.51 0.11 116.97 120.65 1ig4 h TYR 52 Ca -0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1ig4 h TYR 52 Cb 0.10 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.37 1ig4 h TYR 52 CO 0.00 0.00 0.00 1.28 -1.64 0.00 0.00 178.16 177.80 1ig4 n LEU 53 N -3.62 1.50 0.00 2.82 4.77 -1.07 -5.03 117.00 116.37 1ig4 n LEU 53 Ca -0.03 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 1ig4 n LEU 53 Cb 0.10 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1ig4 n LEU 53 CO 0.25 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1ig4 n GLY 54 N 1.11 -0.21 0.24 -0.72 0.00 0.39 -4.20 105.19 101.80 1ig4 n GLY 54 Ca 0.16 -1.59 0.13 0.00 0.00 0.00 0.00 46.02 44.72 1ig4 n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ig4 h PRO 55 N 0.00 0.00 -0.47 1.61 0.13 -1.80 -2.85 132.00 128.62 1ig4 h PRO 55 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1ig4 h PRO 55 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1ig4 h PRO 55 CO 0.00 0.11 0.00 0.00 -0.23 0.00 0.00 178.00 177.88 1ig4 n ALA 56 N -2.15 2.61 -3.29 -0.56 0.00 -1.26 -4.41 120.51 111.45 1ig4 n ALA 56 Ca 0.01 -0.73 -0.27 0.00 0.00 0.00 0.00 53.44 52.45 1ig4 n ALA 56 Cb 0.41 -0.99 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 1ig4 n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ig4 s ASP 58 N -2.62 0.86 -0.33 0.00 1.01 -1.26 -4.80 116.67 109.53 1ig4 s ASP 58 Ca 0.42 1.40 0.17 0.00 0.71 0.00 0.00 52.55 55.25 1ig4 s ASP 58 Cb 0.18 -2.17 0.45 0.00 1.01 0.00 0.00 42.92 42.40 1ig4 s ASP 58 CO -0.05 -4.26 0.95 0.18 0.21 0.00 0.00 175.17 172.21 1ig4 n LEU 59 N -4.94 1.61 0.25 1.23 4.77 -1.26 -4.90 117.00 113.76 1ig4 n LEU 59 Ca 0.03 -3.83 0.18 0.00 -0.03 0.00 0.00 56.01 52.36 1ig4 n LEU 59 Cb 0.55 0.39 0.89 0.00 -2.33 0.00 0.00 43.42 42.92 1ig4 n LEU 59 CO 0.57 1.62 1.15 0.74 -1.33 0.00 0.00 177.39 180.14 1ig4 h THR 60 N 2.93 0.25 -0.53 -5.08 2.02 -2.01 0.24 112.91 110.72 1ig4 h THR 60 Ca -0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.11 1ig4 h THR 60 Cb 1.16 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 1ig4 h THR 60 CO 0.52 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.59 1ig4 n LEU 61 N -3.41 4.35 -4.36 2.58 4.77 -1.26 -4.84 117.00 114.83 1ig4 n LEU 61 Ca 0.00 -2.20 -0.38 0.00 -0.03 0.00 0.00 56.01 53.41 1ig4 n LEU 61 Cb 0.33 -0.57 -0.12 0.00 -2.33 0.00 0.00 43.42 40.72 1ig4 n LEU 61 CO 0.22 0.65 -0.26 0.12 -1.33 0.00 0.00 177.39 176.80 1ig4 s PHE 62 N -2.01 3.16 -0.03 -1.77 2.19 0.83 -2.98 117.98 117.37 1ig4 s PHE 62 Ca 0.44 -0.92 -0.30 0.00 0.33 0.00 0.00 56.93 56.48 1ig4 s PHE 62 Cb 0.30 -2.28 -0.02 0.00 -1.31 0.00 0.00 43.02 39.70 1ig4 s PHE 62 CO 0.18 -0.56 0.99 -0.51 1.83 0.00 0.00 175.22 177.15 1ig4 s ASP 63 N 1.52 7.33 0.02 6.13 1.11 -1.14 -4.92 116.67 126.72 1ig4 s ASP 63 Ca 0.03 1.62 -0.27 0.00 0.18 0.00 0.00 52.55 54.11 1ig4 s ASP 63 Cb -0.17 -2.57 -0.16 0.00 1.07 0.00 0.00 42.92 41.09 1ig4 s ASP 63 CO 0.03 -0.32 1.25 0.15 1.18 0.00 0.00 175.17 177.46 1ig4 h PHE 64 N 6.90 -0.68 -0.14 4.23 3.57 -1.97 1.11 116.94 129.96 1ig4 h PHE 64 Ca -0.38 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.12 1ig4 h PHE 64 Cb 1.20 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 40.14 1ig4 h PHE 64 CO 0.69 -0.35 0.02 -0.22 -2.23 0.00 0.00 178.31 176.22 1ig4 h LYS 65 N -0.99 0.07 0.07 1.11 1.63 -1.95 -3.17 116.57 113.34 1ig4 h LYS 65 Ca -0.07 -0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.72 1ig4 h LYS 65 Cb 0.63 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.25 1ig4 h LYS 65 CO 0.12 0.05 -0.04 1.96 -3.45 0.00 0.00 179.45 178.09 1ig4 h GLN 66 N 0.07 -0.10 -1.26 1.90 1.08 -1.97 -3.49 115.11 111.35 1ig4 h GLN 66 Ca 0.06 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1ig4 h GLN 66 Cb 0.06 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1ig4 h GLN 66 CO -0.09 0.44 0.00 0.41 -0.95 0.00 0.00 178.83 178.64 1ig4 n GLY 67 N 0.56 0.74 3.18 3.46 0.00 0.38 -5.01 105.19 108.51 1ig4 n GLY 67 Ca -0.08 -0.52 -0.10 0.00 0.00 0.00 0.00 46.02 45.31 1ig4 n GLY 67 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ig4 s ILE 68 N -2.82 0.11 -1.08 -0.61 -4.36 -1.25 -4.14 121.20 107.06 1ig4 s ILE 68 Ca 0.00 -0.93 -0.16 0.00 -0.26 0.00 0.00 60.65 59.31 1ig4 s ILE 68 Cb 0.00 -0.96 0.16 0.00 1.25 0.00 0.00 42.46 42.91 1ig4 s ILE 68 CO 0.00 -0.51 1.28 -0.76 0.24 0.00 0.00 174.94 175.19 1ig4 s LEU 69 N -2.17 5.14 0.58 0.37 1.43 -1.26 -2.88 118.68 119.89 1ig4 s LEU 69 Ca -0.04 -2.61 0.32 0.00 -1.03 0.00 0.00 54.13 50.76 1ig4 s LEU 69 Cb -0.00 -2.39 1.38 0.00 0.03 0.00 0.00 46.19 45.21 1ig4 s LEU 69 CO -0.05 -0.86 1.72 0.00 0.23 0.00 0.00 176.35 177.40 1ig4 s TYR 71 N -4.68 2.63 0.23 0.00 1.51 -1.26 -5.00 117.35 110.78 1ig4 s TYR 71 Ca -0.04 -1.10 0.06 0.00 -1.01 0.00 0.00 57.07 54.98 1ig4 s TYR 71 Cb 0.18 -1.77 0.23 0.00 -0.11 0.00 0.00 41.96 40.49 1ig4 s TYR 71 CO 0.62 -0.46 1.54 -1.00 -1.11 0.00 0.00 175.55 175.14 1ig4 h PRO 72 N 6.94 0.16 -2.92 -1.71 0.13 -1.98 -3.49 132.00 129.14 1ig4 h PRO 72 Ca -0.25 -0.12 0.32 0.00 -0.87 0.00 0.00 66.00 65.08 1ig4 h PRO 72 Cb 1.22 0.02 -0.11 0.00 0.13 0.00 0.00 31.00 32.26 1ig4 h PRO 72 CO 0.51 0.76 -0.66 0.00 -0.23 0.00 0.00 178.00 178.38 1ig4 n ALA 73 N -2.45 -3.52 -0.01 -0.56 0.00 -1.26 -4.56 120.51 108.16 1ig4 n ALA 73 Ca -0.02 0.52 -0.12 0.00 0.00 0.00 0.00 53.44 53.82 1ig4 n ALA 73 Cb 0.65 -1.26 -0.10 0.00 0.00 0.00 0.00 19.45 18.74 1ig4 n ALA 73 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ig4 h PRO 74 N -1.27 -0.07 0.00 0.00 0.13 -2.07 -3.56 132.00 125.15 1ig4 h PRO 74 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1ig4 h PRO 74 Cb 1.31 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1ig4 h PRO 74 CO 0.03 0.52 0.00 1.63 -0.23 0.00 0.00 178.00 179.95