#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i22 n VAL 2 N 0.00 0.00 -1.61 0.00 0.24 -1.26 -5.11 118.33 110.59 3i22 n VAL 2 Ca 0.00 -0.96 -0.47 0.00 -2.04 0.00 0.00 64.34 60.87 3i22 n VAL 2 Cb 0.00 0.48 -0.05 0.00 -1.47 0.00 0.00 33.84 32.80 3i22 n VAL 2 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i22 n GLN 3 N -0.25 1.96 -0.09 7.34 10.64 -1.26 -4.86 117.38 130.87 3i22 n GLN 3 Ca 0.03 0.66 0.04 0.00 -1.83 0.00 0.00 57.00 55.90 3i22 n GLN 3 Cb 0.24 -2.77 0.12 0.00 -0.86 0.00 0.00 30.24 26.97 3i22 n GLN 3 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 3i22 n GLN 4 N 7.52 1.42 -3.52 2.61 7.27 -1.26 -4.73 117.38 126.69 3i22 n GLN 4 Ca 0.28 -0.65 -0.00 0.00 0.07 0.00 0.00 57.00 56.69 3i22 n GLN 4 Cb 0.32 -1.17 -0.05 0.00 2.41 0.00 0.00 30.24 31.76 3i22 n GLN 4 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 3i22 s ASN 5 N -1.06 -0.55 0.15 1.69 3.04 -1.26 -5.14 114.94 111.81 3i22 s ASN 5 Ca 0.14 0.80 -0.31 0.00 0.04 0.00 0.00 52.86 53.53 3i22 s ASN 5 Cb 0.07 1.45 -0.11 0.00 -1.54 0.00 0.00 41.25 41.12 3i22 s ASN 5 CO 0.10 -0.12 1.82 -0.75 -3.04 0.00 0.00 177.10 175.11 3i22 s LYS 6 N 1.91 4.13 1.15 0.43 2.20 -1.26 -4.98 119.74 123.32 3i22 s LYS 6 Ca -0.06 2.62 -0.13 0.00 -0.36 0.00 0.00 55.97 58.04 3i22 s LYS 6 Cb -0.05 -3.48 0.26 0.00 -1.51 0.00 0.00 37.83 33.06 3i22 s LYS 6 CO -0.16 -0.83 0.94 -2.30 -0.36 0.00 0.00 175.35 172.64 3i22 n PRO 7 N 5.30 -2.19 0.00 4.03 -0.02 -1.26 -5.05 135.00 135.81 3i22 n PRO 7 Ca 0.17 -0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.05 3i22 n PRO 7 Cb 0.37 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3i22 n PRO 7 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3i22 n THR 8 N -4.86 0.00 -0.03 3.45 -2.24 -1.26 -5.02 114.28 104.31 3i22 n THR 8 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 3i22 n THR 8 Cb 0.54 -0.98 -0.10 0.00 -2.10 0.00 0.00 70.33 67.69 3i22 n THR 8 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3i22 n ARG 9 N 0.00 1.17 -0.05 -0.78 1.85 -1.26 -4.18 116.66 113.41 3i22 n ARG 9 Ca 0.00 -0.07 -0.14 0.00 -1.00 0.00 0.00 57.85 56.64 3i22 n ARG 9 Cb 0.00 -1.32 -0.07 0.00 -1.05 0.00 0.00 32.46 30.02 3i22 n ARG 9 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3i22 h SER 10 N 0.00 0.53 0.88 2.89 0.87 -1.99 -1.56 113.55 115.16 3i22 h SER 10 Ca -0.17 -0.56 -0.03 0.00 -1.23 0.00 0.00 61.79 59.80 3i22 h SER 10 Cb 1.18 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 62.98 3i22 h SER 10 CO 0.01 0.99 -0.15 0.50 -0.53 0.00 0.00 176.83 177.66 3i22 h LYS 11 N 0.09 0.00 -0.06 2.24 1.63 -1.97 -0.30 116.57 118.20 3i22 h LYS 11 Ca 0.00 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.68 3i22 h LYS 11 Cb 0.91 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.53 3i22 h LYS 11 CO 0.07 0.15 -0.51 -0.09 -3.45 0.00 0.00 179.45 175.61 3i22 h ARG 12 N 0.00 0.16 0.12 1.90 2.43 -1.69 -1.79 114.38 115.50 3i22 h ARG 12 Ca -0.00 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3i22 h ARG 12 Cb 0.62 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 3i22 h ARG 12 CO 0.02 0.63 -0.06 0.78 -1.51 0.00 0.00 179.97 179.84 3i22 h GLY 13 N 1.43 -0.17 0.07 2.80 0.00 -0.07 -2.90 103.07 104.23 3i22 h GLY 13 Ca 0.00 0.06 0.12 0.00 0.00 0.00 0.00 47.33 47.52 3i22 h GLY 13 CO 0.07 -0.06 0.07 -0.33 0.00 0.00 0.00 176.54 176.30 3i22 h MET 14 N -0.61 0.19 0.00 4.80 2.86 -1.10 0.19 114.93 121.26 3i22 h MET 14 Ca -0.02 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3i22 h MET 14 Cb 0.48 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.10 3i22 h MET 14 CO 0.03 0.12 0.00 -0.09 1.06 0.00 0.00 176.91 178.03 3i22 h ARG 15 N 0.19 0.00 0.00 1.72 2.43 -1.39 -2.54 114.38 114.80 3i22 h ARG 15 Ca 0.32 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 3i22 h ARG 15 Cb 0.50 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3i22 h ARG 15 CO -0.46 0.00 -1.06 0.54 -1.51 0.00 0.00 179.97 177.48 3i22 n ARG 16 N -2.91 0.92 -0.31 0.20 1.74 0.46 -4.60 116.66 112.16 3i22 n ARG 16 Ca -0.01 -0.03 0.17 0.00 -0.77 0.00 0.00 57.85 57.20 3i22 n ARG 16 Cb 0.17 -1.37 0.35 0.00 -1.02 0.00 0.00 32.46 30.58 3i22 n ARG 16 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3i22 h SER 17 N 0.00 0.10 0.19 0.55 4.64 -0.48 0.82 113.55 119.37 3i22 h SER 17 Ca 0.00 0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3i22 h SER 17 Cb 0.51 0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 3i22 h SER 17 CO 0.00 -0.18 0.00 1.41 -0.87 0.00 0.00 176.83 177.19 3i22 n HIS 18 N -5.21 0.00 0.62 4.77 8.25 -1.26 -2.80 115.22 119.59 3i22 n HIS 18 Ca 0.25 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.74 3i22 n HIS 18 Cb 0.79 -0.13 0.14 0.00 1.12 0.00 0.00 29.99 31.91 3i22 n HIS 18 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3i22 n ASP 19 N -1.13 2.24 -4.73 0.41 10.43 0.29 -4.87 116.55 119.19 3i22 n ASP 19 Ca 0.15 -2.21 -0.42 0.00 2.57 0.00 0.00 54.79 54.88 3i22 n ASP 19 Cb 0.13 -0.42 -0.03 0.00 1.84 0.00 0.00 41.12 42.64 3i22 n ASP 19 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3i22 s ALA 20 N -1.64 3.59 0.69 2.24 0.00 -1.12 -5.02 121.76 120.50 3i22 s ALA 20 Ca 0.19 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.36 3i22 s ALA 20 Cb 0.13 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.72 3i22 s ALA 20 CO 0.08 -0.64 0.00 1.28 0.00 0.00 0.00 175.76 176.48 3i22 n LEU 21 N 2.88 0.00 -3.63 0.00 4.77 -1.26 -5.10 117.00 114.66 3i22 n LEU 21 Ca 0.08 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.94 3i22 n LEU 21 Cb 0.41 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.45 3i22 n LEU 21 CO 0.59 0.00 0.18 0.28 -1.33 0.00 0.00 177.39 177.11 3i22 s THR 22 N 0.00 0.06 0.41 -5.08 -1.32 -1.26 -5.17 115.64 103.27 3i22 s THR 22 Ca 0.00 -0.48 -0.06 0.00 -1.21 0.00 0.00 61.69 59.94 3i22 s THR 22 Cb 0.00 -1.06 0.09 0.00 -1.51 0.00 0.00 72.50 70.02 3i22 s THR 22 CO 0.00 -0.27 0.56 0.00 -2.21 0.00 0.00 174.62 172.70 3i22 n ALA 23 N 0.11 -0.57 -0.01 11.08 0.00 -1.26 -5.02 120.51 124.83 3i22 n ALA 23 Ca -0.17 -0.76 0.04 0.00 0.00 0.00 0.00 53.44 52.55 3i22 n ALA 23 Cb 0.62 -0.02 -0.08 0.00 0.00 0.00 0.00 19.45 19.97 3i22 n ALA 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3i22 n VAL 24 N -2.70 0.08 -2.92 0.00 0.31 -1.26 -5.06 118.33 106.78 3i22 n VAL 24 Ca 0.07 -0.26 -0.12 0.00 -0.01 0.00 0.00 64.34 64.02 3i22 n VAL 24 Cb 0.25 0.14 0.06 0.00 -0.91 0.00 0.00 33.84 33.37 3i22 n VAL 24 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3i22 n THR 25 N -1.92 -5.72 -1.26 2.52 -1.04 -1.26 -4.84 114.28 100.75 3i22 n THR 25 Ca -0.04 -0.68 0.15 0.00 -2.04 0.00 0.00 64.05 61.44 3i22 n THR 25 Cb 0.34 -4.97 -0.05 0.00 -1.82 0.00 0.00 70.33 63.83 3i22 n THR 25 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 3i22 n SER 26 N -2.67 -6.98 -4.18 8.00 7.64 -1.26 -4.98 113.62 109.18 3i22 n SER 26 Ca -0.13 0.79 -0.13 0.00 1.01 0.00 0.00 58.87 60.41 3i22 n SER 26 Cb 0.61 -4.03 -0.11 0.00 -1.01 0.00 0.00 64.21 59.67 3i22 n SER 26 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3i22 s LEU 27 N -6.33 2.44 0.00 -3.43 2.01 -1.26 -4.84 118.68 107.27 3i22 s LEU 27 Ca 0.00 -0.87 -0.01 0.00 0.01 0.00 0.00 54.13 53.26 3i22 s LEU 27 Cb 0.00 -0.25 0.04 0.00 0.01 0.00 0.00 46.19 45.99 3i22 s LEU 27 CO 0.00 -0.31 0.27 -1.54 1.01 0.00 0.00 176.35 175.78 3i22 n SER 28 N 0.35 0.28 -3.69 2.29 3.41 -0.71 -4.77 113.62 110.79 3i22 n SER 28 Ca -0.15 -1.26 -0.10 0.00 -0.26 0.00 0.00 58.87 57.11 3i22 n SER 28 Cb 0.59 -0.18 -0.10 0.00 -0.26 0.00 0.00 64.21 64.25 3i22 n SER 28 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3i22 s VAL 29 N -0.82 -0.02 0.26 -3.33 0.11 -1.26 -1.40 120.40 113.94 3i22 s VAL 29 Ca 0.17 0.07 -0.31 0.00 -2.93 0.00 0.00 61.98 58.99 3i22 s VAL 29 Cb -0.01 -0.69 -0.13 0.00 -1.53 0.00 0.00 36.38 34.03 3i22 s VAL 29 CO 0.12 0.03 1.46 -0.67 -3.33 0.00 0.00 175.10 172.71 3i22 n ASP 30 N 4.23 3.11 -0.16 3.54 4.64 -1.26 -4.85 116.55 125.80 3i22 n ASP 30 Ca -0.22 1.15 0.17 0.00 -1.38 0.00 0.00 54.79 54.51 3i22 n ASP 30 Cb 0.56 -1.48 0.54 0.00 -1.04 0.00 0.00 41.12 39.69 3i22 n ASP 30 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 3i22 h LYS 31 N 4.30 0.34 0.00 -0.67 1.57 -1.94 -3.23 116.57 116.94 3i22 h LYS 31 Ca -0.46 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 3i22 h LYS 31 Cb 1.26 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.49 3i22 h LYS 31 CO 0.76 0.22 0.00 2.41 -0.57 0.00 0.00 179.45 182.27 3i22 n THR 32 N -4.46 0.00 0.00 -0.16 -1.04 -1.26 -4.84 114.28 102.52 3i22 n THR 32 Ca 0.15 1.03 0.00 0.00 -2.04 0.00 0.00 64.05 63.19 3i22 n THR 32 Cb 0.59 -1.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 3i22 n THR 32 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 3i22 n SER 33 N -0.72 0.00 -1.07 8.00 7.64 -1.22 -5.05 113.62 121.21 3i22 n SER 33 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 3i22 n SER 33 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 3i22 n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i22 n GLY 34 N 5.00 0.68 3.74 0.23 0.00 -1.26 -4.84 105.19 108.75 3i22 n GLY 34 Ca 0.00 -0.23 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 3i22 n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i22 s GLU 35 N 0.00 4.33 -0.55 1.61 2.02 -1.26 -5.00 118.70 119.85 3i22 s GLU 35 Ca 0.09 0.65 -0.26 0.00 0.02 0.00 0.00 54.97 55.47 3i22 s GLU 35 Cb 0.11 -3.39 0.04 0.00 0.10 0.00 0.00 34.13 30.98 3i22 s GLU 35 CO -0.05 0.24 1.04 -1.59 0.02 0.00 0.00 175.26 174.92 3i22 s LYS 36 N 0.27 3.42 0.10 1.61 -2.85 -1.26 -4.08 119.74 116.95 3i22 s LYS 36 Ca 0.30 -0.02 0.10 0.00 -1.00 0.00 0.00 55.97 55.35 3i22 s LYS 36 Cb -0.17 -4.03 -0.04 0.00 -2.06 0.00 0.00 37.83 31.54 3i22 s LYS 36 CO 0.15 -1.54 -0.26 -3.38 0.10 0.00 0.00 175.35 170.42 3i22 s HIS 37 N 4.32 2.34 0.30 1.78 -3.43 -0.50 -4.89 115.29 115.21 3i22 s HIS 37 Ca 0.36 -0.38 -0.27 0.00 -0.80 0.00 0.00 55.06 53.97 3i22 s HIS 37 Cb -0.10 -1.31 -0.14 0.00 -1.43 0.00 0.00 32.58 29.60 3i22 s HIS 37 CO 0.22 0.27 0.82 1.28 -2.00 0.00 0.00 174.74 175.34 3i22 n LEU 38 N 1.19 0.85 -4.76 5.38 4.77 -1.26 -1.73 117.00 121.44 3i22 n LEU 38 Ca -0.17 1.11 -0.41 0.00 -0.03 0.00 0.00 56.01 56.51 3i22 n LEU 38 Cb 0.53 -1.19 -0.03 0.00 -2.33 0.00 0.00 43.42 40.40 3i22 n LEU 38 CO 0.23 -2.02 0.90 -0.60 -1.33 0.00 0.00 177.39 174.58 3i22 s ARG 39 N -1.47 4.48 -0.24 3.23 3.52 -1.26 -3.44 118.95 123.78 3i22 s ARG 39 Ca 0.61 2.02 -0.00 0.00 -0.13 0.00 0.00 55.73 58.22 3i22 s ARG 39 Cb -0.72 -3.14 0.00 0.00 -1.56 0.00 0.00 34.95 29.53 3i22 s ARG 39 CO 0.59 -0.03 0.02 0.72 -0.81 0.00 0.00 175.30 175.79 3i22 n HIS 40 N 1.25 -0.17 -3.65 5.12 8.25 -1.26 -5.04 115.22 119.71 3i22 n HIS 40 Ca 0.00 0.02 -0.07 0.00 -0.26 0.00 0.00 57.72 57.41 3i22 n HIS 40 Cb 0.43 -1.43 0.01 0.00 1.12 0.00 0.00 29.99 30.12 3i22 n HIS 40 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 3i22 n HIS 41 N -3.84 -1.65 -3.57 4.41 1.44 -1.22 -5.16 115.22 105.62 3i22 n HIS 41 Ca -0.03 -1.35 -0.37 0.00 -2.01 0.00 0.00 57.72 53.96 3i22 n HIS 41 Cb 0.52 0.54 -0.07 0.00 0.12 0.00 0.00 29.99 31.10 3i22 n HIS 41 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3i22 s ILE 42 N -2.50 5.26 1.14 0.61 -1.09 -1.26 -4.87 121.20 118.49 3i22 s ILE 42 Ca 0.14 0.59 -0.17 0.00 -2.23 0.00 0.00 60.65 58.97 3i22 s ILE 42 Cb -0.02 -3.62 0.26 0.00 -1.58 0.00 0.00 42.46 37.49 3i22 s ILE 42 CO 0.10 0.47 1.11 0.42 -1.23 0.00 0.00 174.94 175.81 3i22 s THR 43 N -0.15 1.73 -0.25 2.92 -4.23 -1.01 -4.93 115.64 109.73 3i22 s THR 43 Ca 0.18 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 60.98 3i22 s THR 43 Cb -0.14 -2.49 0.34 0.00 1.34 0.00 0.00 72.50 71.55 3i22 s THR 43 CO 0.07 0.00 1.81 0.00 -0.54 0.00 0.00 174.62 175.96 3i22 h ALA 44 N -2.38 1.00 -0.33 3.99 0.00 -1.92 -2.99 119.26 116.63 3i22 h ALA 44 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3i22 h ALA 44 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3i22 h ALA 44 CO 0.42 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.42 3i22 n ASP 45 N -2.83 3.18 0.00 0.00 9.92 -1.26 -4.80 116.55 120.76 3i22 n ASP 45 Ca 0.02 -1.92 0.00 0.00 -0.53 0.00 0.00 54.79 52.36 3i22 n ASP 45 Cb 0.36 -0.21 0.00 0.00 -0.64 0.00 0.00 41.12 40.63 3i22 n ASP 45 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3i22 n GLY 46 N 1.23 0.71 3.94 0.44 0.00 -1.13 -4.54 105.19 105.84 3i22 n GLY 46 Ca 0.16 -0.12 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 3i22 n GLY 46 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i22 s TYR 47 N -2.00 3.39 0.00 1.61 1.51 -1.26 -2.04 117.35 118.56 3i22 s TYR 47 Ca 0.00 0.41 0.00 0.00 -1.01 0.00 0.00 57.07 56.47 3i22 s TYR 47 Cb 0.00 -2.18 0.00 0.00 -0.11 0.00 0.00 41.96 39.67 3i22 s TYR 47 CO 0.00 -0.19 0.00 0.98 -1.11 0.00 0.00 175.55 175.23 3i22 n TYR 48 N -2.04 -0.47 -2.94 2.71 -0.00 -0.95 -2.40 117.16 111.08 3i22 n TYR 48 Ca -0.01 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.80 3i22 n TYR 48 Cb 0.57 0.23 -0.02 0.00 -0.00 0.00 0.00 39.34 40.12 3i22 n TYR 48 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.86 175.88 3i22 s ARG 49 N -0.46 1.01 -1.72 2.98 1.70 -1.26 -4.24 118.95 116.96 3i22 s ARG 49 Ca 0.00 -1.26 0.00 0.00 -0.47 0.00 0.00 55.73 54.00 3i22 s ARG 49 Cb 0.00 -0.37 0.00 0.00 -0.57 0.00 0.00 34.95 34.01 3i22 s ARG 49 CO 0.00 -1.33 0.00 0.41 -1.08 0.00 0.00 175.30 173.30 3i22 n GLY 50 N 3.03 1.62 2.96 3.88 0.00 -1.26 -4.97 105.19 110.45 3i22 n GLY 50 Ca 0.20 -0.22 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 3i22 n GLY 50 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i22 s ARG 51 N -3.36 0.91 -0.18 1.61 0.52 -1.26 -5.04 118.95 112.15 3i22 s ARG 51 Ca 0.00 -0.23 0.00 0.00 -0.52 0.00 0.00 55.73 54.99 3i22 s ARG 51 Cb 0.00 -0.86 0.04 0.00 0.52 0.00 0.00 34.95 34.65 3i22 s ARG 51 CO 0.00 0.03 -0.09 0.21 0.02 0.00 0.00 175.30 175.47 3i22 s LYS 52 N 0.46 1.87 0.00 3.54 2.36 -1.26 -2.23 119.74 124.48 3i22 s LYS 52 Ca -0.07 -0.67 0.00 0.00 -2.55 0.00 0.00 55.97 52.68 3i22 s LYS 52 Cb -0.11 -2.20 0.00 0.00 -1.05 0.00 0.00 37.83 34.47 3i22 s LYS 52 CO 0.01 -0.39 0.00 1.33 1.55 0.00 0.00 175.35 177.85 3i22 n VAL 53 N 4.77 0.00 0.00 4.02 0.24 -0.87 -5.04 118.33 121.45 3i22 n VAL 53 Ca -0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 3i22 n VAL 53 Cb 0.48 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.85 3i22 n VAL 53 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 3i22 n ILE 54 N 0.00 0.00 0.00 1.34 -5.35 -1.26 -4.98 119.36 109.11 3i22 n ILE 54 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 3i22 n ILE 54 Cb 0.00 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 37.90 3i22 n ILE 54 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3i22 n ALA 55 N -1.37 0.00 0.07 -1.28 0.00 -1.26 -5.06 120.51 111.61 3i22 n ALA 55 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 3i22 n ALA 55 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 3i22 n ALA 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13