#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da1 n SER 2 N 0.00 0.99 -3.64 1.61 3.41 -1.26 -5.10 113.62 109.63 2da1 n SER 2 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 2da1 n SER 2 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 2da1 n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2da1 s SER 3 N -3.56 -0.90 0.00 4.04 1.04 -1.26 -5.10 113.70 107.96 2da1 s SER 3 Ca 0.00 1.41 0.00 0.00 0.48 0.00 0.00 55.95 57.84 2da1 s SER 3 Cb 0.00 1.44 0.00 0.00 0.10 0.00 0.00 66.02 67.56 2da1 s SER 3 CO 0.00 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.61 2da1 n GLY 4 N 4.33 2.22 3.13 7.32 0.00 -1.26 -5.18 105.19 115.76 2da1 n GLY 4 Ca -0.19 -0.66 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 2da1 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2da1 s SER 5 N 0.00 0.67 -0.23 1.61 1.04 -1.26 -5.08 113.70 110.44 2da1 s SER 5 Ca 0.00 -1.04 -0.13 0.00 0.48 0.00 0.00 55.95 55.26 2da1 s SER 5 Cb 0.00 0.18 -0.10 0.00 0.10 0.00 0.00 66.02 66.20 2da1 s SER 5 CO 0.00 -0.58 -0.32 -1.54 0.98 0.00 0.00 173.24 171.78 2da1 n SER 6 N 0.02 1.77 0.00 7.02 3.41 -1.26 -5.07 113.62 119.52 2da1 n SER 6 Ca -0.12 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2da1 n SER 6 Cb 0.61 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 2da1 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2da1 n GLY 7 N 1.48 2.21 3.70 5.00 0.00 -1.26 -4.92 105.19 111.40 2da1 n GLY 7 Ca -0.43 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 44.88 2da1 n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2da1 n LYS 8 N 12.07 -6.72 -4.04 1.61 4.76 -1.26 -4.99 118.16 119.59 2da1 n LYS 8 Ca 0.00 0.73 -0.08 0.00 -2.87 0.00 0.00 58.31 56.09 2da1 n LYS 8 Cb 0.00 -5.68 -0.10 0.00 -1.84 0.00 0.00 35.03 27.40 2da1 n LYS 8 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2da1 s ARG 9 N -6.29 0.51 0.76 1.97 0.52 -1.26 -5.16 118.95 110.00 2da1 s ARG 9 Ca 0.50 -0.98 -0.11 0.00 -0.52 0.00 0.00 55.73 54.61 2da1 s ARG 9 Cb -0.23 0.18 0.05 0.00 0.52 0.00 0.00 34.95 35.47 2da1 s ARG 9 CO 0.77 -0.09 1.09 -1.25 0.02 0.00 0.00 175.30 175.84 2da1 s PRO 10 N -3.01 2.31 -0.37 3.54 0.04 -1.26 -5.03 135.00 131.22 2da1 s PRO 10 Ca -0.02 1.19 -0.02 0.00 0.04 0.00 0.00 61.00 62.20 2da1 s PRO 10 Cb 0.01 -1.90 0.09 0.00 0.04 0.00 0.00 34.50 32.74 2da1 s PRO 10 CO -0.07 -1.60 0.14 1.03 0.04 0.00 0.00 177.00 176.54 2da1 s ARG 11 N -4.82 2.04 -1.14 4.56 0.52 -1.26 -5.04 118.95 113.82 2da1 s ARG 11 Ca 0.62 -1.69 -0.20 0.00 -0.52 0.00 0.00 55.73 53.93 2da1 s ARG 11 Cb -0.17 -3.44 0.07 0.00 0.52 0.00 0.00 34.95 31.92 2da1 s ARG 11 CO 0.54 -0.95 1.54 0.99 0.02 0.00 0.00 175.30 177.45 2da1 s THR 12 N 1.14 4.12 0.26 0.02 2.01 -1.26 -4.98 115.64 116.96 2da1 s THR 12 Ca 0.05 -1.39 -0.30 0.00 0.31 0.00 0.00 61.69 60.36 2da1 s THR 12 Cb -0.22 -5.09 -0.11 0.00 0.01 0.00 0.00 72.50 67.10 2da1 s THR 12 CO -0.04 -1.93 1.52 -0.60 -0.69 0.00 0.00 174.62 172.89 2da1 s ARG 13 N 4.31 4.20 0.36 4.92 3.52 -1.26 -4.96 118.95 130.04 2da1 s ARG 13 Ca 0.48 2.44 -0.27 0.00 -0.13 0.00 0.00 55.73 58.25 2da1 s ARG 13 Cb 0.01 -3.07 -0.09 0.00 -1.56 0.00 0.00 34.95 30.24 2da1 s ARG 13 CO -0.02 -0.53 1.20 0.42 -0.81 0.00 0.00 175.30 175.56 2da1 s ILE 14 N 0.08 3.07 0.81 4.11 1.01 -1.26 -5.04 121.20 123.98 2da1 s ILE 14 Ca 0.62 0.98 -0.05 0.00 0.00 0.00 0.00 60.65 62.19 2da1 s ILE 14 Cb -0.45 -3.59 0.16 0.00 0.01 0.00 0.00 42.46 38.60 2da1 s ILE 14 CO 0.44 0.16 1.12 0.42 0.00 0.00 0.00 174.94 177.08 2da1 s THR 15 N -1.28 2.04 -0.04 2.92 -4.23 -1.26 -4.87 115.64 108.92 2da1 s THR 15 Ca 0.52 -0.42 -0.26 0.00 -1.18 0.00 0.00 61.69 60.35 2da1 s THR 15 Cb -0.34 -2.62 -0.21 0.00 1.34 0.00 0.00 72.50 70.67 2da1 s THR 15 CO 0.43 0.00 1.20 0.44 -0.54 0.00 0.00 174.62 176.16 2da1 h ASP 16 N -0.93 0.01 -0.14 3.99 5.19 -1.98 0.15 116.42 122.71 2da1 h ASP 16 Ca -0.38 -0.55 0.04 0.00 -0.62 0.00 0.00 57.03 55.52 2da1 h ASP 16 Cb 1.25 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.75 2da1 h ASP 16 CO 0.37 0.56 0.16 0.44 -3.12 0.00 0.00 179.24 177.65 2da1 h ASP 17 N -0.55 0.00 0.11 6.45 3.32 -2.00 0.27 116.42 124.02 2da1 h ASP 17 Ca 0.00 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.70 2da1 h ASP 17 Cb 0.56 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 2da1 h ASP 17 CO 0.00 0.00 -1.93 0.00 -1.72 0.00 0.00 179.24 175.59 2da1 n GLN 18 N -3.78 0.74 0.15 3.56 6.02 -1.16 -4.20 117.38 118.71 2da1 n GLN 18 Ca 0.01 0.29 -0.14 0.00 -0.01 0.00 0.00 57.00 57.15 2da1 n GLN 18 Cb 0.27 -1.71 -0.08 0.00 1.02 0.00 0.00 30.24 29.74 2da1 n GLN 18 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2da1 h LEU 19 N -0.03 -0.29 -1.17 1.08 5.85 0.04 -2.78 115.31 118.02 2da1 h LEU 19 Ca -0.42 -0.09 0.41 0.00 0.84 0.00 0.00 57.88 58.62 2da1 h LEU 19 Cb 1.97 0.07 -0.15 0.00 0.37 0.00 0.00 40.66 42.92 2da1 h LEU 19 CO 0.06 -0.09 0.68 0.08 -0.34 0.00 0.00 178.44 178.83 2da1 h ARG 20 N -0.48 0.10 -0.58 1.25 0.11 -1.17 1.02 114.38 114.63 2da1 h ARG 20 Ca -0.03 -0.01 -0.04 0.00 0.10 0.00 0.00 59.98 60.00 2da1 h ARG 20 Cb 0.36 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 31.39 2da1 h ARG 20 CO 0.06 0.07 0.19 0.28 0.10 0.00 0.00 179.97 180.67 2da1 h VAL 21 N 0.11 1.24 -0.09 0.08 2.07 -1.66 0.19 116.25 118.18 2da1 h VAL 21 Ca 0.81 -0.79 -0.16 0.00 0.82 0.00 0.00 66.70 67.38 2da1 h VAL 21 Cb 2.26 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 2da1 h VAL 21 CO -0.59 0.30 -0.62 -0.07 0.02 0.00 0.00 177.57 176.61 2da1 h LEU 22 N 0.82 0.38 0.08 2.57 3.38 0.99 -3.20 115.31 120.33 2da1 h LEU 22 Ca 0.19 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2da1 h LEU 22 Cb 0.27 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2da1 h LEU 22 CO -0.01 0.90 -0.04 0.03 0.09 0.00 0.00 178.44 179.42 2da1 h ARG 23 N 0.24 -0.10 -0.89 1.13 2.47 -0.65 -2.76 114.38 113.82 2da1 h ARG 23 Ca -0.01 0.01 0.22 0.00 -1.26 0.00 0.00 59.98 58.94 2da1 h ARG 23 Cb 1.14 0.02 -0.16 0.00 -1.65 0.00 0.00 29.97 29.32 2da1 h ARG 23 CO 0.10 0.43 -0.03 1.96 0.56 0.00 0.00 179.97 182.98 2da1 h GLN 24 N -0.72 0.04 -0.45 0.04 1.08 -0.70 0.39 115.11 114.79 2da1 h GLN 24 Ca -0.01 -0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.11 2da1 h GLN 24 Cb 0.57 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.98 2da1 h GLN 24 CO 0.02 0.03 -0.03 1.88 -0.95 0.00 0.00 178.83 179.77 2da1 h TYR 25 N 0.04 0.91 -0.99 2.96 -1.99 -1.61 -3.13 116.97 113.16 2da1 h TYR 25 Ca 0.50 -0.17 0.21 0.00 2.00 0.00 0.00 58.73 61.27 2da1 h TYR 25 Cb 0.93 -0.23 -0.19 0.00 2.00 0.00 0.00 36.73 39.24 2da1 h TYR 25 CO -0.52 0.89 -0.22 0.35 -0.00 0.00 0.00 178.16 178.66 2da1 h PHE 26 N 0.67 -0.48 0.61 4.88 3.57 0.08 0.27 116.94 126.55 2da1 h PHE 26 Ca 0.12 0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 2da1 h PHE 26 Cb 0.55 0.37 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 2da1 h PHE 26 CO 0.04 -0.43 -0.39 0.22 -2.23 0.00 0.00 178.31 175.52 2da1 h ASP 27 N 0.00 -0.99 0.05 0.41 1.82 -1.46 -3.11 116.42 113.14 2da1 h ASP 27 Ca 0.49 0.06 0.03 0.00 -0.39 0.00 0.00 57.03 57.21 2da1 h ASP 27 Cb 0.77 0.30 -0.05 0.00 0.68 0.00 0.00 39.33 41.03 2da1 h ASP 27 CO -1.01 -0.60 -0.37 0.40 -1.61 0.00 0.00 179.24 176.05 2da1 h ILE 28 N -0.95 0.23 -3.43 2.25 5.03 -0.93 -3.42 117.51 116.29 2da1 h ILE 28 Ca -0.07 0.00 -0.36 0.00 -0.12 0.00 0.00 64.86 64.30 2da1 h ILE 28 Cb 0.78 0.23 -0.35 0.00 -3.03 0.00 0.00 36.82 34.45 2da1 h ILE 28 CO 0.07 0.00 -0.75 0.54 -0.68 0.00 0.00 178.15 177.33 2da1 s ASN 29 N -4.79 0.72 0.00 1.72 4.22 0.72 -5.07 114.94 112.46 2da1 s ASN 29 Ca -0.16 -0.02 0.00 0.00 -2.14 0.00 0.00 52.86 50.54 2da1 s ASN 29 Cb 0.08 -0.25 0.00 0.00 1.28 0.00 0.00 41.25 42.36 2da1 s ASN 29 CO 0.64 -0.13 0.92 0.59 -2.04 0.00 0.00 177.10 177.07 2da1 n ASN 30 N 4.46 0.00 -4.72 3.54 5.03 -1.18 -3.90 115.26 118.48 2da1 n ASN 30 Ca -0.20 0.92 -0.35 0.00 0.87 0.00 0.00 54.58 55.82 2da1 n ASN 30 Cb 0.50 -0.42 -0.09 0.00 -1.02 0.00 0.00 39.78 38.76 2da1 n ASN 30 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2da1 s SER 31 N -2.99 5.44 0.88 6.41 1.04 -1.26 -4.61 113.70 118.61 2da1 s SER 31 Ca 0.00 0.17 -0.11 0.00 0.48 0.00 0.00 55.95 56.49 2da1 s SER 31 Cb 0.00 -1.56 0.12 0.00 0.10 0.00 0.00 66.02 64.68 2da1 s SER 31 CO 0.00 0.36 1.09 -2.16 0.98 0.00 0.00 173.24 173.51 2da1 s PRO 32 N -1.10 1.41 0.17 4.02 0.04 -1.26 -5.07 135.00 133.21 2da1 s PRO 32 Ca 0.16 0.87 0.07 0.00 0.04 0.00 0.00 61.00 62.14 2da1 s PRO 32 Cb -0.12 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 2da1 s PRO 32 CO 0.05 -2.15 -0.01 -1.54 0.04 0.00 0.00 177.00 173.39 2da1 s SER 33 N -3.42 4.75 0.58 6.66 1.04 -1.26 -4.85 113.70 117.19 2da1 s SER 33 Ca 0.63 -0.40 0.39 0.00 0.48 0.00 0.00 55.95 57.06 2da1 s SER 33 Cb -0.18 -1.00 1.35 0.00 0.10 0.00 0.00 66.02 66.29 2da1 s SER 33 CO 0.57 0.09 1.44 -0.62 0.98 0.00 0.00 173.24 175.70 2da1 n GLU 34 N -0.07 0.01 0.07 4.02 1.02 -1.26 0.21 120.64 124.63 2da1 n GLU 34 Ca -0.10 1.05 -0.21 0.00 -0.02 0.00 0.00 57.16 57.89 2da1 n GLU 34 Cb 0.55 -2.52 -0.13 0.00 -0.02 0.00 0.00 31.44 29.32 2da1 n GLU 34 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2da1 h GLU 35 N 0.00 0.51 -0.01 3.49 4.39 -2.00 -3.25 114.58 117.70 2da1 h GLU 35 Ca 0.73 -0.69 -0.06 0.00 0.34 0.00 0.00 59.36 59.69 2da1 h GLU 35 Cb 3.40 0.23 0.00 0.00 -0.10 0.00 0.00 28.75 32.29 2da1 h GLU 35 CO -0.01 1.30 -0.21 1.96 -1.16 0.00 0.00 179.01 180.89 2da1 h GLN 36 N 0.05 0.17 -0.73 2.33 4.20 0.22 -2.24 115.11 119.11 2da1 h GLN 36 Ca -0.16 -0.16 0.21 0.00 0.06 0.00 0.00 58.65 58.60 2da1 h GLN 36 Cb 1.75 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 29.54 2da1 h GLN 36 CO 0.20 0.87 0.70 0.82 -0.67 0.00 0.00 178.83 180.75 2da1 h ILE 37 N -0.47 0.31 0.04 2.54 2.04 -0.76 0.26 117.51 121.47 2da1 h ILE 37 Ca -0.02 0.00 -0.26 0.00 1.00 0.00 0.00 64.86 65.57 2da1 h ILE 37 Cb 0.93 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 2da1 h ILE 37 CO 0.04 0.00 -1.42 0.50 0.00 0.00 0.00 178.15 177.27 2da1 h LYS 38 N 0.00 0.09 -0.39 2.37 1.63 -1.58 -2.96 116.57 115.73 2da1 h LYS 38 Ca 0.34 -0.15 0.03 0.00 -0.85 0.00 0.00 60.65 60.02 2da1 h LYS 38 Cb 1.74 0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 33.40 2da1 h LYS 38 CO -0.00 1.07 0.26 1.05 -3.45 0.00 0.00 179.45 178.38 2da1 h GLU 39 N -0.67 0.42 0.06 1.90 4.11 -0.47 -2.67 114.58 117.26 2da1 h GLU 39 Ca -0.36 -0.03 -0.10 0.00 0.07 0.00 0.00 59.36 58.95 2da1 h GLU 39 Cb 1.52 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.68 2da1 h GLU 39 CO -0.11 0.28 -0.42 0.52 0.07 0.00 0.00 179.01 179.35 2da1 h MET 40 N 0.43 0.19 -1.12 1.06 2.86 -0.72 -2.13 114.93 115.50 2da1 h MET 40 Ca 0.16 -0.28 0.32 0.00 -2.06 0.00 0.00 59.70 57.85 2da1 h MET 40 Cb 0.09 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 2da1 h MET 40 CO -0.04 1.09 0.90 0.00 1.06 0.00 0.00 176.91 179.92 2da1 h ALA 41 N 0.11 3.01 0.07 6.32 0.00 -1.30 0.25 119.26 127.72 2da1 h ALA 41 Ca -0.07 -0.04 -0.38 0.00 0.00 0.00 0.00 54.91 54.43 2da1 h ALA 41 Cb 1.28 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 2da1 h ALA 41 CO 0.08 -1.47 -2.19 -3.47 0.00 0.00 0.00 179.25 172.20 2da1 n ASP 42 N -3.93 2.07 -0.24 0.00 -0.08 -1.10 -1.32 116.55 111.94 2da1 n ASP 42 Ca 0.24 0.07 0.01 0.00 -1.51 0.00 0.00 54.79 53.60 2da1 n ASP 42 Cb 1.26 -0.68 0.24 0.00 2.34 0.00 0.00 41.12 44.28 2da1 n ASP 42 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2da1 h LYS 43 N 0.03 1.01 0.00 -0.67 1.57 -0.11 -3.25 116.57 115.15 2da1 h LYS 43 Ca -0.49 -0.06 -0.40 0.00 -1.87 0.00 0.00 60.65 57.83 2da1 h LYS 43 Cb 1.97 -0.23 -0.07 0.00 0.08 0.00 0.00 32.23 33.99 2da1 h LYS 43 CO 0.01 0.67 -2.45 -1.13 -0.57 0.00 0.00 179.45 175.97 2da1 n SER 44 N -4.43 2.00 0.00 0.86 3.41 0.60 -5.03 113.62 111.03 2da1 n SER 44 Ca 0.09 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 2da1 n SER 44 Cb 0.06 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 2da1 n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2da1 n GLY 45 N 1.99 0.90 3.86 5.00 0.00 -0.44 -5.00 105.19 111.51 2da1 n GLY 45 Ca -0.47 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 2da1 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2da1 s LEU 46 N 0.00 3.97 1.23 0.99 1.43 -0.94 -4.92 118.68 120.44 2da1 s LEU 46 Ca 0.00 1.18 -0.20 0.00 -1.03 0.00 0.00 54.13 54.08 2da1 s LEU 46 Cb 0.00 -4.01 0.30 0.00 0.03 0.00 0.00 46.19 42.51 2da1 s LEU 46 CO 0.00 -0.28 1.11 -2.16 0.23 0.00 0.00 176.35 175.25 2da1 s PRO 47 N -3.37 -1.44 0.29 1.29 0.04 -1.26 -4.10 135.00 126.45 2da1 s PRO 47 Ca 0.52 -0.14 0.16 0.00 0.04 0.00 0.00 61.00 61.58 2da1 s PRO 47 Cb -0.10 -1.58 0.09 0.00 0.04 0.00 0.00 34.50 32.95 2da1 s PRO 47 CO 0.24 -3.84 1.46 1.96 0.04 0.00 0.00 177.00 176.86 2da1 h GLN 48 N -2.67 0.00 0.07 4.56 4.20 -1.95 -3.05 115.11 116.26 2da1 h GLN 48 Ca -0.43 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.01 2da1 h GLN 48 Cb 1.29 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.08 2da1 h GLN 48 CO 0.31 0.47 -1.11 1.57 -0.67 0.00 0.00 178.83 179.40 2da1 h LYS 49 N 0.00 0.46 -0.24 1.46 2.10 -1.96 -2.55 116.57 115.83 2da1 h LYS 49 Ca -0.00 -0.58 -0.07 0.00 -2.00 0.00 0.00 60.65 58.00 2da1 h LYS 49 Cb 1.36 0.19 -0.01 0.00 -0.90 0.00 0.00 32.23 32.87 2da1 h LYS 49 CO 0.06 1.22 -0.11 0.28 -2.00 0.00 0.00 179.45 178.90 2da1 h VAL 50 N 0.22 1.30 0.56 0.07 2.07 -1.94 -2.23 116.25 116.30 2da1 h VAL 50 Ca -0.13 -1.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 2da1 h VAL 50 Cb 1.78 1.56 0.01 0.00 -1.52 0.00 0.00 31.29 33.11 2da1 h VAL 50 CO 0.20 0.37 -0.27 0.40 0.02 0.00 0.00 177.57 178.29 2da1 h ILE 51 N 0.23 0.33 -0.48 4.57 2.04 -1.63 -0.79 117.51 121.79 2da1 h ILE 51 Ca 0.06 -0.33 0.10 0.00 1.00 0.00 0.00 64.86 65.69 2da1 h ILE 51 Cb 0.61 0.44 -0.10 0.00 -0.74 0.00 0.00 36.82 37.03 2da1 h ILE 51 CO 0.03 0.04 -0.20 0.11 0.00 0.00 0.00 178.15 178.13 2da1 h LYS 52 N -0.99 -0.09 0.65 2.37 1.57 -1.54 -1.48 116.57 117.06 2da1 h LYS 52 Ca -0.08 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2da1 h LYS 52 Cb 0.64 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.97 2da1 h LYS 52 CO 0.13 -0.06 -0.39 0.45 -0.57 0.00 0.00 179.45 179.01 2da1 h HIS 53 N -0.10 -1.03 -0.91 -1.35 3.86 -1.41 -1.81 115.15 112.41 2da1 h HIS 53 Ca 0.23 -0.01 0.20 0.00 -1.16 0.00 0.00 60.37 59.63 2da1 h HIS 53 Cb 0.45 0.36 -0.17 0.00 1.06 0.00 0.00 27.41 29.11 2da1 h HIS 53 CO -0.48 -0.59 -0.13 2.35 0.86 0.00 0.00 177.93 179.94 2da1 h TRP 54 N -0.98 -0.31 -0.61 2.45 7.01 -0.61 0.66 115.95 123.57 2da1 h TRP 54 Ca -0.08 0.08 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 2da1 h TRP 54 Cb 0.79 0.28 -0.03 0.00 -2.10 0.00 0.00 29.16 28.10 2da1 h TRP 54 CO -0.09 -0.38 0.33 0.74 -2.79 0.00 0.00 178.44 176.24 2da1 h PHE 55 N 0.02 0.85 0.41 2.65 0.04 -1.04 -1.83 116.94 118.04 2da1 h PHE 55 Ca 0.48 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 61.20 2da1 h PHE 55 Cb 0.83 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 38.71 2da1 h PHE 55 CO -0.61 0.62 -0.20 -0.09 -0.60 0.00 0.00 178.31 177.43 2da1 h ARG 56 N 0.83 -0.54 -0.95 1.51 2.43 0.93 0.48 114.38 119.08 2da1 h ARG 56 Ca 0.21 0.04 0.29 0.00 -0.81 0.00 0.00 59.98 59.71 2da1 h ARG 56 Cb 0.06 0.12 -0.16 0.00 -0.42 0.00 0.00 29.97 29.57 2da1 h ARG 56 CO -0.03 -0.36 0.29 -0.91 -1.51 0.00 0.00 179.97 177.45 2da1 h ASN 57 N -0.79 0.01 0.07 -3.80 2.35 -0.14 0.34 115.58 113.63 2da1 h ASN 57 Ca -0.06 0.23 -0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2da1 h ASN 57 Cb 0.43 0.31 0.00 0.00 0.05 0.00 0.00 38.32 39.10 2da1 h ASN 57 CO 0.09 -0.26 -0.04 0.74 -1.65 0.00 0.00 177.43 176.32 2da1 h THR 58 N 0.13 0.00 -0.32 2.81 2.02 -1.34 -3.22 112.91 112.99 2da1 h THR 58 Ca 0.65 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 67.54 2da1 h THR 58 Cb 1.44 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.80 2da1 h THR 58 CO -0.74 0.00 -0.31 0.25 0.37 0.00 0.00 175.52 175.09 2da1 h LEU 59 N -0.42 -1.07 -0.93 2.58 5.85 0.39 0.12 115.31 121.83 2da1 h LEU 59 Ca -0.01 0.15 0.30 0.00 0.84 0.00 0.00 57.88 59.15 2da1 h LEU 59 Cb 0.08 0.45 -0.17 0.00 0.37 0.00 0.00 40.66 41.39 2da1 h LEU 59 CO 0.02 -0.19 0.16 0.33 -0.34 0.00 0.00 178.44 178.42 2da1 n PHE 60 N -4.18 0.74 -0.06 1.25 7.35 0.12 0.10 117.46 122.78 2da1 n PHE 60 Ca -0.01 1.11 -0.11 0.00 -0.76 0.00 0.00 57.45 57.68 2da1 n PHE 60 Cb 0.17 -1.29 -0.05 0.00 0.35 0.00 0.00 39.48 38.67 2da1 n PHE 60 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 2da1 h LYS 61 N 0.00 0.30 -0.89 -4.13 3.64 -0.83 -2.22 116.57 112.44 2da1 h LYS 61 Ca 0.63 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.97 2da1 h LYS 61 Cb 1.44 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.17 2da1 h LYS 61 CO -0.83 0.41 0.58 0.93 -2.27 0.00 0.00 179.45 178.28 2da1 h GLU 62 N 0.13 1.11 -0.47 1.90 5.08 0.21 -2.50 114.58 120.05 2da1 h GLU 62 Ca 0.06 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2da1 h GLU 62 Cb 0.24 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2da1 h GLU 62 CO -0.00 0.74 0.28 0.00 -1.00 0.00 0.00 179.01 179.02 2da1 h ARG 63 N 1.15 0.64 -6.84 2.33 3.08 -0.69 -3.42 114.38 110.62 2da1 h ARG 63 Ca 0.34 -0.06 -0.48 0.00 0.07 0.00 0.00 59.98 59.86 2da1 h ARG 63 Cb -0.05 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 2da1 h ARG 63 CO -0.10 0.47 0.35 1.14 -1.07 0.00 0.00 179.97 180.76 2da1 s GLN 64 N -5.97 4.66 0.03 0.04 -2.07 -0.85 -5.07 119.66 110.43 2da1 s GLN 64 Ca -0.13 1.39 0.05 0.00 -1.82 0.00 0.00 55.36 54.85 2da1 s GLN 64 Cb 0.11 -2.95 -0.02 0.00 -1.09 0.00 0.00 33.01 29.07 2da1 s GLN 64 CO 0.74 0.34 -0.15 -1.54 -1.32 0.00 0.00 175.29 173.37 2da1 s SER 65 N -1.47 1.78 0.00 12.60 1.04 -1.26 -4.87 113.70 121.52 2da1 s SER 65 Ca 0.47 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.47 2da1 s SER 65 Cb -0.21 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 65.78 2da1 s SER 65 CO 0.27 0.07 0.00 0.61 0.98 0.00 0.00 173.24 175.17 2da1 n GLY 66 N 2.02 0.70 3.77 7.32 0.00 -1.26 -5.09 105.19 112.65 2da1 n GLY 66 Ca -0.17 -2.05 -0.32 0.00 0.00 0.00 0.00 46.02 43.48 2da1 n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2da1 s PRO 67 N -0.95 2.50 0.17 1.61 0.04 -1.26 -4.98 135.00 132.12 2da1 s PRO 67 Ca 0.00 1.27 -0.30 0.00 0.04 0.00 0.00 61.00 62.00 2da1 s PRO 67 Cb 0.00 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.54 2da1 s PRO 67 CO 0.00 -1.47 1.25 0.45 0.04 0.00 0.00 177.00 177.27 2da1 s SER 68 N -3.04 7.01 0.69 6.66 0.15 -1.26 -5.01 113.70 118.89 2da1 s SER 68 Ca 0.64 2.27 -0.12 0.00 0.70 0.00 0.00 55.95 59.44 2da1 s SER 68 Cb -0.19 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.53 2da1 s SER 68 CO 0.50 -0.45 1.07 -0.55 1.20 0.00 0.00 173.24 175.00 2da1 s SER 69 N 0.37 5.30 0.00 5.45 0.15 -1.26 -5.29 113.70 118.42 2da1 s SER 69 Ca 0.55 1.71 0.21 0.00 0.70 0.00 0.00 55.95 59.13 2da1 s SER 69 Cb -0.34 -2.51 1.28 0.00 -1.71 0.00 0.00 66.02 62.74 2da1 s SER 69 CO 0.36 -1.50 1.66 0.61 1.20 0.00 0.00 173.24 175.57