#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2n s SER 2 N 0.00 2.85 0.48 1.61 1.04 -1.26 -5.12 113.70 113.31 1x2n s SER 2 Ca 0.00 -0.50 -0.24 0.00 0.48 0.00 0.00 55.95 55.70 1x2n s SER 2 Cb 0.00 -0.29 -0.07 0.00 0.10 0.00 0.00 66.02 65.77 1x2n s SER 2 CO 0.00 0.26 1.36 -0.94 0.98 0.00 0.00 173.24 174.90 1x2n s SER 3 N -0.88 5.74 0.00 7.02 1.04 -1.26 -5.03 113.70 120.33 1x2n s SER 3 Ca 0.10 2.77 0.00 0.00 0.48 0.00 0.00 55.95 59.30 1x2n s SER 3 Cb -0.09 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.39 1x2n s SER 3 CO 0.00 -1.26 0.00 0.61 0.98 0.00 0.00 173.24 173.58 1x2n n GLY 4 N 0.64 5.17 3.57 7.32 0.00 -1.26 -5.17 105.19 115.46 1x2n n GLY 4 Ca 0.07 -2.11 -0.11 0.00 0.00 0.00 0.00 46.02 43.87 1x2n n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x2n s SER 5 N -0.20 -0.38 -0.17 1.61 1.04 -1.26 -5.09 113.70 109.25 1x2n s SER 5 Ca 0.00 0.41 -0.13 0.00 0.48 0.00 0.00 55.95 56.71 1x2n s SER 5 Cb 0.00 0.31 -0.07 0.00 0.10 0.00 0.00 66.02 66.36 1x2n s SER 5 CO 0.00 -0.36 -0.11 -0.24 0.98 0.00 0.00 173.24 173.51 1x2n n SER 6 N 0.73 1.84 -4.65 7.02 2.88 -1.26 -4.86 113.62 115.31 1x2n n SER 6 Ca -0.11 0.55 -0.43 0.00 -1.33 0.00 0.00 58.87 57.56 1x2n n SER 6 Cb 0.58 -0.88 -0.03 0.00 -0.75 0.00 0.00 64.21 63.13 1x2n n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x2n s GLY 7 N -4.50 1.41 -0.23 0.46 0.00 -1.26 -4.99 107.32 98.21 1x2n s GLY 7 Ca -0.20 0.69 0.02 0.00 0.00 0.00 0.00 44.72 45.22 1x2n s GLY 7 CO 0.34 2.97 -0.13 1.25 0.00 0.00 0.00 173.10 177.52 1x2n s LYS 8 N 4.26 2.57 0.00 2.90 2.47 -1.26 -5.08 119.74 125.60 1x2n s LYS 8 Ca 0.71 -1.12 -0.39 0.00 -1.56 0.00 0.00 55.97 53.60 1x2n s LYS 8 Cb -0.28 -2.80 -0.19 0.00 -1.46 0.00 0.00 37.83 33.09 1x2n s LYS 8 CO 0.28 -0.43 1.20 0.27 0.16 0.00 0.00 175.35 176.83 1x2n n ASN 9 N 4.53 0.67 -4.58 1.43 6.94 -1.26 -4.86 115.26 118.13 1x2n n ASN 9 Ca -0.17 1.15 -0.43 0.00 -0.02 0.00 0.00 54.58 55.11 1x2n n ASN 9 Cb 0.45 -1.02 -0.03 0.00 -2.36 0.00 0.00 39.78 36.82 1x2n n ASN 9 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1x2n s LYS 10 N 0.38 3.65 -0.30 -3.83 2.20 -1.26 -4.99 119.74 115.60 1x2n s LYS 10 Ca 0.90 0.36 -0.01 0.00 -0.36 0.00 0.00 55.97 56.86 1x2n s LYS 10 Cb -1.17 -3.89 0.10 0.00 -1.51 0.00 0.00 37.83 31.36 1x2n s LYS 10 CO 0.55 -1.19 0.09 1.03 -0.36 0.00 0.00 175.35 175.47 1x2n s ARG 11 N 3.84 0.77 0.00 4.03 0.52 -1.26 -5.09 118.95 121.76 1x2n s ARG 11 Ca 0.40 -1.06 0.00 0.00 -0.52 0.00 0.00 55.73 54.55 1x2n s ARG 11 Cb -0.10 -2.07 0.00 0.00 0.52 0.00 0.00 34.95 33.31 1x2n s ARG 11 CO 0.26 -0.95 0.00 0.41 0.02 0.00 0.00 175.30 175.04 1x2n n GLY 12 N 4.83 1.11 2.65 -3.53 0.00 -1.26 -4.93 105.19 104.06 1x2n n GLY 12 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1x2n n GLY 12 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1x2n n VAL 13 N 0.00 1.16 -3.74 1.61 0.31 -1.26 -4.93 118.33 111.48 1x2n n VAL 13 Ca 0.00 -0.39 -0.26 0.00 -0.01 0.00 0.00 64.34 63.67 1x2n n VAL 13 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 1x2n n VAL 13 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1x2n s LEU 14 N 2.77 4.24 0.13 7.52 1.43 -1.26 -5.07 118.68 128.44 1x2n s LEU 14 Ca 0.49 0.33 -0.31 0.00 -1.03 0.00 0.00 54.13 53.61 1x2n s LEU 14 Cb -0.64 -3.10 -0.08 0.00 0.03 0.00 0.00 46.19 42.40 1x2n s LEU 14 CO 0.46 -0.05 1.35 -2.16 0.23 0.00 0.00 176.35 176.18 1x2n s PRO 15 N -3.46 4.35 0.36 1.29 0.04 -1.26 -4.79 135.00 131.53 1x2n s PRO 15 Ca 0.37 2.04 0.26 0.00 0.04 0.00 0.00 61.00 63.71 1x2n s PRO 15 Cb -0.11 -3.24 1.24 0.00 0.04 0.00 0.00 34.50 32.43 1x2n s PRO 15 CO 0.29 -0.37 1.31 1.17 0.04 0.00 0.00 177.00 179.44 1x2n n LYS 16 N 3.63 -0.03 -0.07 4.56 4.81 -1.26 0.19 118.16 129.99 1x2n n LYS 16 Ca 0.10 1.06 -0.09 0.00 -0.87 0.00 0.00 58.31 58.51 1x2n n LYS 16 Cb 0.43 -2.07 -0.02 0.00 0.02 0.00 0.00 35.03 33.39 1x2n n LYS 16 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1x2n h HIS 17 N 0.00 0.28 -0.17 5.64 2.76 -1.97 0.32 115.15 122.01 1x2n h HIS 17 Ca 0.73 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.88 1x2n h HIS 17 Cb 2.33 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 31.20 1x2n h HIS 17 CO -0.01 0.17 -0.04 0.00 -1.30 0.00 0.00 177.93 176.75 1x2n h ALA 18 N 1.11 0.23 0.00 5.26 0.00 0.18 -2.98 119.26 123.07 1x2n h ALA 18 Ca 0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1x2n h ALA 18 Cb -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1x2n h ALA 18 CO -0.05 -0.00 -0.17 1.79 0.00 0.00 0.00 179.25 180.81 1x2n h THR 19 N 0.03 1.03 0.63 0.00 1.35 -1.21 -3.07 112.91 111.68 1x2n h THR 19 Ca 0.04 -0.61 -0.02 0.00 -0.55 0.00 0.00 66.41 65.26 1x2n h THR 19 Cb 0.47 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 1x2n h THR 19 CO 0.02 0.17 -0.49 0.78 -0.25 0.00 0.00 175.52 175.75 1x2n h ASN 20 N 0.00 -1.30 0.26 5.36 2.35 -0.19 0.27 115.58 122.32 1x2n h ASN 20 Ca -0.00 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1x2n h ASN 20 Cb 0.33 0.41 -0.04 0.00 0.05 0.00 0.00 38.32 39.06 1x2n h ASN 20 CO 0.02 -0.70 -0.50 0.58 -1.65 0.00 0.00 177.43 175.18 1x2n h VAL 21 N -1.08 0.03 -0.26 2.81 2.07 -1.54 -0.15 116.25 118.12 1x2n h VAL 21 Ca -0.08 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.50 1x2n h VAL 21 Cb 0.90 0.03 -0.08 0.00 -1.52 0.00 0.00 31.29 30.63 1x2n h VAL 21 CO 0.02 0.00 -0.31 0.24 0.02 0.00 0.00 177.57 177.54 1x2n h MET 22 N -0.83 -0.30 -0.08 1.57 2.86 -1.51 -0.76 114.93 115.88 1x2n h MET 22 Ca -0.02 0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.67 1x2n h MET 22 Cb 0.79 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.46 1x2n h MET 22 CO -0.20 -0.20 -0.45 0.00 1.06 0.00 0.00 176.91 177.12 1x2n h ARG 23 N -0.31 -0.53 -0.37 1.72 3.08 -0.17 0.11 114.38 117.91 1x2n h ARG 23 Ca 0.14 0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.30 1x2n h ARG 23 Cb 0.53 0.12 -0.09 0.00 0.08 0.00 0.00 29.97 30.61 1x2n h ARG 23 CO -0.44 -0.36 -0.27 1.03 -1.07 0.00 0.00 179.97 178.86 1x2n h SER 24 N -0.55 -0.91 0.22 7.04 0.87 -0.54 -0.89 113.55 118.80 1x2n h SER 24 Ca 0.05 0.17 0.01 0.00 -1.23 0.00 0.00 61.79 60.80 1x2n h SER 24 Cb 0.66 0.44 -0.03 0.00 -0.44 0.00 0.00 62.40 63.02 1x2n h SER 24 CO -0.38 -0.29 -0.37 -0.25 -0.53 0.00 0.00 176.83 175.01 1x2n h TRP 25 N -0.22 -1.01 -0.63 2.24 7.01 -0.57 -0.86 115.95 121.91 1x2n h TRP 25 Ca 0.17 0.02 0.12 0.00 2.11 0.00 0.00 58.89 61.31 1x2n h TRP 25 Cb 0.50 0.41 -0.12 0.00 -2.10 0.00 0.00 29.16 27.85 1x2n h TRP 25 CO -0.48 -0.49 -0.21 1.25 -2.79 0.00 0.00 178.44 175.72 1x2n h LEU 26 N -0.67 -0.77 -0.67 0.65 5.85 -0.23 0.11 115.31 119.59 1x2n h LEU 26 Ca 0.00 0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.97 1x2n h LEU 26 Cb 0.65 0.45 -0.05 0.00 0.37 0.00 0.00 40.66 42.09 1x2n h LEU 26 CO -0.15 -0.25 0.40 -0.26 -0.34 0.00 0.00 178.44 177.84 1x2n h PHE 27 N -0.05 0.73 -0.43 1.25 0.04 -0.78 0.74 116.94 118.44 1x2n h PHE 27 Ca 0.29 0.02 0.06 0.00 2.80 0.00 0.00 57.97 61.14 1x2n h PHE 27 Cb 0.51 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.40 1x2n h PHE 27 CO -0.56 0.39 0.29 1.96 -0.60 0.00 0.00 178.31 179.79 1x2n h GLN 28 N 0.75 0.32 -0.24 1.51 1.08 0.62 -2.15 115.11 117.00 1x2n h GLN 28 Ca 0.28 -0.02 -0.18 0.00 -1.45 0.00 0.00 58.65 57.28 1x2n h GLN 28 Cb 0.10 -0.07 -0.15 0.00 -0.05 0.00 0.00 27.48 27.31 1x2n h GLN 28 CO -0.14 0.21 -0.62 0.72 -0.95 0.00 0.00 178.83 178.06 1x2n n HIS 29 N -4.47 0.89 -0.31 2.96 8.25 -0.50 -4.83 115.22 117.20 1x2n n HIS 29 Ca 0.06 -1.72 0.12 0.00 -0.26 0.00 0.00 57.72 55.92 1x2n n HIS 29 Cb 0.26 -0.28 0.26 0.00 1.12 0.00 0.00 29.99 31.35 1x2n n HIS 29 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 1x2n h ILE 30 N 1.52 0.20 -0.64 1.59 6.09 0.11 0.26 117.51 126.65 1x2n h ILE 30 Ca 0.11 -0.03 0.11 0.00 -1.37 0.00 0.00 64.86 63.68 1x2n h ILE 30 Cb 1.19 0.09 -0.08 0.00 0.47 0.00 0.00 36.82 38.49 1x2n h ILE 30 CO 0.25 0.02 0.20 1.23 -3.07 0.00 0.00 178.15 176.77 1x2n h GLY 31 N 0.10 0.88 -6.67 8.18 0.00 -1.85 -3.32 103.07 100.38 1x2n h GLY 31 Ca 0.54 -0.08 -0.60 0.00 0.00 0.00 0.00 47.33 47.19 1x2n h GLY 31 CO -0.77 -0.08 -0.83 -1.58 0.00 0.00 0.00 176.54 173.28 1x2n s HIS 32 N -6.08 1.64 -1.18 5.60 2.46 0.87 -5.05 115.29 113.54 1x2n s HIS 32 Ca -0.13 -2.38 -0.23 0.00 0.47 0.00 0.00 55.06 52.79 1x2n s HIS 32 Cb 0.18 -1.44 -0.09 0.00 -0.13 0.00 0.00 32.58 31.10 1x2n s HIS 32 CO 0.75 -0.77 1.93 -0.35 -2.47 0.00 0.00 174.74 173.83 1x2n n PRO 33 N 3.09 1.60 -3.66 2.88 -0.04 -0.86 -4.85 135.00 133.17 1x2n n PRO 33 Ca 0.20 -2.45 -0.27 0.00 -0.04 0.00 0.00 63.50 60.93 1x2n n PRO 33 Cb 0.41 -3.71 -0.16 0.00 -0.04 0.00 0.00 33.50 30.00 1x2n n PRO 33 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1x2n s TYR 34 N 10.88 0.66 0.26 0.54 1.51 -1.26 -4.97 117.35 124.97 1x2n s TYR 34 Ca 0.68 -0.73 -0.29 0.00 -1.01 0.00 0.00 57.07 55.71 1x2n s TYR 34 Cb -0.00 -0.94 -0.09 0.00 -0.11 0.00 0.00 41.96 40.82 1x2n s TYR 34 CO 0.14 -0.63 1.26 -1.25 -1.11 0.00 0.00 175.55 173.96 1x2n s PRO 35 N 1.98 4.43 0.31 -1.71 0.04 -1.26 -5.02 135.00 133.76 1x2n s PRO 35 Ca 0.03 2.05 -0.13 0.00 0.04 0.00 0.00 61.00 62.99 1x2n s PRO 35 Cb -0.17 -3.15 -0.08 0.00 0.04 0.00 0.00 34.50 31.14 1x2n s PRO 35 CO -0.14 -0.13 0.69 0.95 0.04 0.00 0.00 177.00 178.40 1x2n s THR 36 N -0.58 4.77 0.40 1.26 -4.23 -1.26 -4.85 115.64 111.15 1x2n s THR 36 Ca 0.51 0.76 0.25 0.00 -1.18 0.00 0.00 61.69 62.04 1x2n s THR 36 Cb -0.37 -3.63 0.41 0.00 1.34 0.00 0.00 72.50 70.25 1x2n s THR 36 CO 0.44 -0.20 1.58 -0.62 -0.54 0.00 0.00 174.62 175.27 1x2n n GLU 37 N -0.44 -0.05 -0.03 3.99 -0.58 -1.26 0.84 120.64 123.10 1x2n n GLU 37 Ca 0.02 1.34 -0.14 0.00 -0.42 0.00 0.00 57.16 57.95 1x2n n GLU 37 Cb 0.53 -2.48 -0.10 0.00 -0.57 0.00 0.00 31.44 28.82 1x2n n GLU 37 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 1x2n h ASP 38 N 0.00 0.29 -0.47 1.62 3.32 -2.00 -3.13 116.42 116.05 1x2n h ASP 38 Ca 0.86 -0.65 0.09 0.00 0.02 0.00 0.00 57.03 57.35 1x2n h ASP 38 Cb 2.48 -0.08 -0.08 0.00 0.22 0.00 0.00 39.33 41.87 1x2n h ASP 38 CO -0.66 0.89 -0.02 -0.33 -1.72 0.00 0.00 179.24 177.40 1x2n h GLU 39 N -0.30 0.08 -0.55 3.56 4.39 0.08 0.27 114.58 122.12 1x2n h GLU 39 Ca -0.01 -0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.76 1x2n h GLU 39 Cb 0.88 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.48 1x2n h GLU 39 CO 0.05 0.06 0.37 0.87 -1.16 0.00 0.00 179.01 179.19 1x2n h LYS 40 N 0.09 0.41 0.12 2.33 1.57 -1.27 0.39 116.57 120.20 1x2n h LYS 40 Ca 0.23 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1x2n h LYS 40 Cb 0.35 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1x2n h LYS 40 CO -0.41 0.27 -0.06 0.87 -0.57 0.00 0.00 179.45 179.55 1x2n h LYS 41 N 0.42 -0.16 0.53 3.15 1.57 -0.83 -2.80 116.57 118.46 1x2n h LYS 41 Ca 0.25 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.02 1x2n h LYS 41 Cb 0.42 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 1x2n h LYS 41 CO -0.07 0.17 -0.33 1.96 -0.57 0.00 0.00 179.45 180.62 1x2n h GLN 42 N -0.98 -0.79 -0.46 3.15 1.08 -0.38 -2.98 115.11 113.75 1x2n h GLN 42 Ca -0.02 0.05 0.09 0.00 -1.45 0.00 0.00 58.65 57.33 1x2n h GLN 42 Cb 0.40 0.18 -0.09 0.00 -0.05 0.00 0.00 27.48 27.92 1x2n h GLN 42 CO 0.03 -0.53 -0.20 0.82 -0.95 0.00 0.00 178.83 178.00 1x2n h ILE 43 N -0.82 0.39 -1.22 2.54 2.04 -0.39 0.64 117.51 120.69 1x2n h ILE 43 Ca -0.06 0.00 0.43 0.00 1.00 0.00 0.00 64.86 66.23 1x2n h ILE 43 Cb 0.67 0.39 -0.15 0.00 -0.74 0.00 0.00 36.82 36.99 1x2n h ILE 43 CO 0.06 0.00 0.75 0.00 0.00 0.00 0.00 178.15 178.97 1x2n h ALA 44 N 1.22 2.54 0.16 1.87 0.00 -1.34 0.22 119.26 123.93 1x2n h ALA 44 Ca 0.22 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 1x2n h ALA 44 Cb 0.44 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1x2n h ALA 44 CO -0.53 -1.22 -0.08 0.00 0.00 0.00 0.00 179.25 177.43 1x2n h ALA 45 N 1.73 -0.29 -1.11 0.00 0.00 -0.84 1.55 119.26 120.29 1x2n h ALA 45 Ca 0.83 -0.05 0.33 0.00 0.00 0.00 0.00 54.91 56.03 1x2n h ALA 45 Cb 2.46 0.08 -0.12 0.00 0.00 0.00 0.00 17.79 20.21 1x2n h ALA 45 CO -0.54 -0.28 0.69 1.96 0.00 0.00 0.00 179.25 181.08 1x2n h GLN 46 N -0.71 0.28 0.00 0.00 4.20 -0.81 0.48 115.11 118.55 1x2n h GLN 46 Ca -0.02 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 1x2n h GLN 46 Cb 0.16 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1x2n h GLN 46 CO 0.04 0.19 -1.57 0.25 -0.67 0.00 0.00 178.83 177.07 1x2n n THR 47 N -4.80 0.41 -2.46 -0.54 -2.24 0.67 -4.81 114.28 100.53 1x2n n THR 47 Ca 0.31 -0.55 -0.07 0.00 -2.27 0.00 0.00 64.05 61.47 1x2n n THR 47 Cb 1.07 -0.22 0.01 0.00 -2.10 0.00 0.00 70.33 69.09 1x2n n THR 47 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1x2n n ASN 48 N -2.50 -2.97 -4.60 3.42 2.85 0.43 -4.57 115.26 107.31 1x2n n ASN 48 Ca -0.04 -0.08 -0.24 0.00 -0.11 0.00 0.00 54.58 54.10 1x2n n ASN 48 Cb 0.61 -1.95 -0.08 0.00 1.24 0.00 0.00 39.78 39.60 1x2n n ASN 48 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1x2n s LEU 49 N -2.44 3.06 0.28 1.20 1.43 0.40 -4.96 118.68 117.65 1x2n s LEU 49 Ca 0.09 -0.67 -0.18 0.00 -1.03 0.00 0.00 54.13 52.33 1x2n s LEU 49 Cb -0.04 -1.62 -0.09 0.00 0.03 0.00 0.00 46.19 44.47 1x2n s LEU 49 CO 0.11 0.04 0.75 0.42 0.23 0.00 0.00 176.35 177.89 1x2n s THR 50 N -2.17 4.60 0.39 5.49 -4.23 -1.26 -4.34 115.64 114.11 1x2n s THR 50 Ca 0.29 1.16 0.28 0.00 -1.18 0.00 0.00 61.69 62.24 1x2n s THR 50 Cb -0.07 -3.73 0.44 0.00 1.34 0.00 0.00 72.50 70.48 1x2n s THR 50 CO 0.18 -0.01 1.40 0.18 -0.54 0.00 0.00 174.62 175.83 1x2n n LEU 51 N 0.13 0.20 0.14 4.79 7.99 -1.26 0.85 117.00 129.83 1x2n n LEU 51 Ca 0.01 1.26 -0.13 0.00 -0.01 0.00 0.00 56.01 57.14 1x2n n LEU 51 Cb 0.52 -0.62 -0.08 0.00 -0.11 0.00 0.00 43.42 43.13 1x2n n LEU 51 CO 0.42 -1.38 0.58 0.25 -1.51 0.00 0.00 177.39 175.76 1x2n h LEU 52 N 0.00 -0.31 0.64 2.23 5.85 -1.96 -2.31 115.31 119.46 1x2n h LEU 52 Ca 0.79 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 59.30 1x2n h LEU 52 Cb 2.51 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 43.61 1x2n h LEU 52 CO -0.44 0.04 -0.48 1.56 -0.34 0.00 0.00 178.44 178.78 1x2n h GLN 53 N -0.68 -1.05 -1.03 1.25 4.20 0.09 0.96 115.11 118.85 1x2n h GLN 53 Ca -0.04 0.07 0.29 0.00 0.06 0.00 0.00 58.65 59.03 1x2n h GLN 53 Cb 0.47 0.24 -0.13 0.00 0.30 0.00 0.00 27.48 28.36 1x2n h GLN 53 CO 0.06 -0.70 0.62 0.28 -0.67 0.00 0.00 178.83 178.42 1x2n h VAL 54 N -1.08 0.43 0.44 -0.54 2.07 -1.34 -1.09 116.25 115.14 1x2n h VAL 54 Ca -0.08 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1x2n h VAL 54 Cb 0.90 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1x2n h VAL 54 CO 0.03 0.08 -0.21 0.78 0.02 0.00 0.00 177.57 178.26 1x2n h ASN 55 N 0.43 -0.50 -0.75 0.57 2.35 -0.86 -2.96 115.58 113.86 1x2n h ASN 55 Ca 0.68 -0.05 0.13 0.00 -0.55 0.00 0.00 56.30 56.50 1x2n h ASN 55 Cb 1.51 0.13 -0.13 0.00 0.05 0.00 0.00 38.32 39.88 1x2n h ASN 55 CO -0.48 -0.07 -0.35 0.78 -1.65 0.00 0.00 177.43 175.65 1x2n h ASN 56 N -1.09 -1.24 -0.35 5.81 2.35 0.12 0.31 115.58 121.49 1x2n h ASN 56 Ca -0.06 0.26 0.08 0.00 -0.55 0.00 0.00 56.30 56.02 1x2n h ASN 56 Cb 0.52 0.64 -0.08 0.00 0.05 0.00 0.00 38.32 39.45 1x2n h ASN 56 CO 0.10 -0.30 -0.21 -0.25 -1.65 0.00 0.00 177.43 175.12 1x2n h TRP 57 N -0.10 -0.55 0.87 1.19 7.01 -1.32 -1.37 115.95 121.68 1x2n h TRP 57 Ca 0.28 0.04 -0.04 0.00 2.11 0.00 0.00 58.89 61.28 1x2n h TRP 57 Cb 0.57 0.29 0.01 0.00 -2.10 0.00 0.00 29.16 27.93 1x2n h TRP 57 CO -0.72 -0.29 -0.42 0.74 -2.79 0.00 0.00 178.44 174.96 1x2n h PHE 58 N -0.16 -1.08 -0.99 2.65 0.04 -0.76 0.14 116.94 116.77 1x2n h PHE 58 Ca 0.17 -0.03 0.37 0.00 2.80 0.00 0.00 57.97 61.29 1x2n h PHE 58 Cb 0.44 0.36 -0.17 0.00 2.20 0.00 0.00 35.95 38.77 1x2n h PHE 58 CO -0.42 -0.67 0.43 0.82 -0.60 0.00 0.00 178.31 177.86 1x2n h ILE 59 N -1.21 0.06 0.01 -0.55 2.04 -0.22 0.29 117.51 117.94 1x2n h ILE 59 Ca -0.12 -0.02 -0.09 0.00 1.00 0.00 0.00 64.86 65.63 1x2n h ILE 59 Cb 0.90 -0.00 0.01 0.00 -0.74 0.00 0.00 36.82 36.99 1x2n h ILE 59 CO 0.20 0.01 -0.36 -1.13 0.00 0.00 0.00 178.15 176.87 1x2n h ASN 60 N 0.06 0.30 -0.91 1.72 -0.73 -1.01 -3.33 115.58 111.68 1x2n h ASN 60 Ca 0.77 -0.80 0.16 0.00 1.87 0.00 0.00 56.30 58.29 1x2n h ASN 60 Cb 1.90 -0.09 -0.16 0.00 0.27 0.00 0.00 38.32 40.24 1x2n h ASN 60 CO -0.77 1.06 -0.29 0.00 -0.37 0.00 0.00 177.43 177.06 1x2n n ALA 61 N -2.56 0.05 -0.35 1.57 0.00 1.00 0.17 120.51 120.37 1x2n n ALA 61 Ca -0.10 0.95 0.12 0.00 0.00 0.00 0.00 53.44 54.40 1x2n n ALA 61 Cb 0.57 -0.50 0.30 0.00 0.00 0.00 0.00 19.45 19.82 1x2n n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x2n h ARG 62 N 0.00 0.79 0.00 0.00 3.08 -1.56 0.51 114.38 117.20 1x2n h ARG 62 Ca 0.37 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.38 1x2n h ARG 62 Cb 0.60 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1x2n h ARG 62 CO -0.92 0.52 -0.00 0.00 -1.07 0.00 0.00 179.97 178.50 1x2n h ARG 63 N 0.81 0.00 0.00 0.04 2.47 0.16 -0.16 114.38 117.69 1x2n h ARG 63 Ca 0.56 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 59.21 1x2n h ARG 63 Cb 0.81 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.12 1x2n h ARG 63 CO -0.36 0.00 -0.56 0.00 0.56 0.00 0.00 179.97 179.61 1x2n h ARG 64 N 0.00 0.00 -0.54 0.04 3.08 0.22 -2.60 114.38 114.59 1x2n h ARG 64 Ca -0.00 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.09 1x2n h ARG 64 Cb 0.03 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 1x2n h ARG 64 CO 0.00 0.48 0.30 -0.84 -1.07 0.00 0.00 179.97 178.84 1x2n h ILE 65 N -1.00 1.00 -0.04 2.04 3.07 -1.20 -2.95 117.51 118.44 1x2n h ILE 65 Ca -0.11 -0.20 -0.02 0.00 1.55 0.00 0.00 64.86 66.08 1x2n h ILE 65 Cb 0.75 0.37 -0.00 0.00 -0.27 0.00 0.00 36.82 37.67 1x2n h ILE 65 CO -0.07 0.11 -0.04 -0.07 -1.05 0.00 0.00 178.15 177.03 1x2n h LEU 66 N 0.58 0.10 -9.63 0.16 4.07 -1.22 -3.44 115.31 105.93 1x2n h LEU 66 Ca 0.23 -0.49 -0.52 0.00 0.08 0.00 0.00 57.88 57.17 1x2n h LEU 66 Cb 0.09 -0.03 0.02 0.00 1.08 0.00 0.00 40.66 41.82 1x2n h LEU 66 CO -0.13 0.57 0.60 -1.58 -1.08 0.00 0.00 178.44 176.82 1x2n s GLN 67 N -4.25 4.44 0.42 1.13 2.00 -0.98 -4.95 119.66 117.47 1x2n s GLN 67 Ca -0.15 1.93 -0.22 0.00 -2.00 0.00 0.00 55.36 54.91 1x2n s GLN 67 Cb 0.02 -3.24 -0.13 0.00 0.80 0.00 0.00 33.01 30.46 1x2n s GLN 67 CO 0.69 -0.18 0.45 0.45 -0.50 0.00 0.00 175.29 176.20 1x2n n SER 68 N 2.84 -1.29 0.00 6.67 2.88 -1.26 -4.72 113.62 118.74 1x2n n SER 68 Ca 0.06 0.88 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1x2n n SER 68 Cb 0.44 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 62.83 1x2n n SER 68 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x2n n GLY 69 N 1.90 -1.51 3.61 0.46 0.00 -1.26 -5.03 105.19 103.35 1x2n n GLY 69 Ca 0.11 0.62 -0.43 0.00 0.00 0.00 0.00 46.02 46.32 1x2n n GLY 69 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x2n s PRO 70 N 0.00 3.51 0.00 1.61 0.04 -1.26 -4.77 135.00 134.13 1x2n s PRO 70 Ca 0.00 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.45 1x2n s PRO 70 Cb 0.00 -4.12 0.00 0.00 0.04 0.00 0.00 34.50 30.42 1x2n s PRO 70 CO 0.00 -1.64 0.00 0.43 0.04 0.00 0.00 177.00 175.83 1x2n n SER 71 N 9.48 1.48 -4.56 6.66 7.64 -1.26 -5.04 113.62 128.02 1x2n n SER 71 Ca 0.21 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.73 1x2n n SER 71 Cb 0.46 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.56 1x2n n SER 71 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x2n s SER 72 N -4.35 5.39 0.00 6.43 0.15 -1.26 -5.33 113.70 114.73 1x2n s SER 72 Ca 0.00 -0.03 0.08 0.00 0.70 0.00 0.00 55.95 56.70 1x2n s SER 72 Cb 0.00 -1.93 0.06 0.00 -1.71 0.00 0.00 66.02 62.44 1x2n s SER 72 CO 0.00 0.11 0.75 0.61 1.20 0.00 0.00 173.24 175.91