#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2n h SER 2 N 0.00 -0.26 -2.31 1.61 0.02 -2.12 -3.46 113.55 107.03 1x2n h SER 2 Ca 0.00 0.01 -0.58 0.00 -0.84 0.00 0.00 61.79 60.38 1x2n h SER 2 Cb 0.00 0.07 0.19 0.00 0.14 0.00 0.00 62.40 62.80 1x2n h SER 2 CO 0.00 0.17 -1.08 -1.54 -1.14 0.00 0.00 176.83 173.24 1x2n n SER 3 N -4.80 -3.42 -3.61 3.07 3.41 -1.26 -4.99 113.62 102.02 1x2n n SER 3 Ca -0.04 0.56 -0.04 0.00 -0.26 0.00 0.00 58.87 59.09 1x2n n SER 3 Cb 0.12 -0.93 -0.03 0.00 -0.26 0.00 0.00 64.21 63.10 1x2n n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1x2n s GLY 4 N -1.10 -0.13 -0.28 5.00 0.00 -1.26 -5.18 107.32 104.37 1x2n s GLY 4 Ca 0.56 2.20 -0.26 0.00 0.00 0.00 0.00 44.72 47.22 1x2n s GLY 4 CO 0.67 0.86 1.14 -0.45 0.00 0.00 0.00 173.10 175.32 1x2n s SER 5 N -1.50 -0.34 0.27 1.64 0.15 -1.26 -5.19 113.70 107.48 1x2n s SER 5 Ca 0.07 0.62 -0.12 0.00 0.70 0.00 0.00 55.95 57.23 1x2n s SER 5 Cb -0.01 0.62 0.00 0.00 -1.71 0.00 0.00 66.02 64.93 1x2n s SER 5 CO -0.05 -0.13 0.51 -0.44 1.20 0.00 0.00 173.24 174.33 1x2n s SER 6 N 0.04 0.05 -0.14 5.45 0.01 -1.26 -5.19 113.70 112.66 1x2n s SER 6 Ca 0.04 -1.01 -0.33 0.00 1.31 0.00 0.00 55.95 55.96 1x2n s SER 6 Cb -0.05 0.62 0.13 0.00 0.21 0.00 0.00 66.02 66.94 1x2n s SER 6 CO -0.08 -1.21 1.13 -0.83 0.41 0.00 0.00 173.24 172.66 1x2n s GLY 7 N -3.05 -0.34 -0.95 3.44 0.00 -1.26 -5.09 107.32 100.07 1x2n s GLY 7 Ca 0.23 1.44 -0.15 0.00 0.00 0.00 0.00 44.72 46.23 1x2n s GLY 7 CO 0.11 0.47 1.04 0.54 0.00 0.00 0.00 173.10 175.26 1x2n s LYS 8 N -2.59 3.75 -0.03 2.90 -0.14 -1.26 -4.76 119.74 117.61 1x2n s LYS 8 Ca 0.08 -2.31 -0.07 0.00 -1.36 0.00 0.00 55.97 52.31 1x2n s LYS 8 Cb -0.01 -4.72 -0.02 0.00 -1.68 0.00 0.00 37.83 31.40 1x2n s LYS 8 CO -0.06 -1.53 -0.14 -1.71 -0.76 0.00 0.00 175.35 171.15 1x2n n ASN 9 N 5.02 1.19 -3.66 2.83 5.15 -1.26 -5.07 115.26 119.45 1x2n n ASN 9 Ca 0.22 0.18 -0.07 0.00 -0.60 0.00 0.00 54.58 54.32 1x2n n ASN 9 Cb 0.46 -0.48 -0.07 0.00 -0.53 0.00 0.00 39.78 39.16 1x2n n ASN 9 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1x2n s LYS 10 N -2.13 0.56 0.29 1.20 2.47 -1.26 -5.04 119.74 115.83 1x2n s LYS 10 Ca -0.11 1.16 0.02 0.00 -1.56 0.00 0.00 55.97 55.48 1x2n s LYS 10 Cb 0.02 0.31 0.71 0.00 -1.46 0.00 0.00 37.83 37.40 1x2n s LYS 10 CO 0.17 -0.18 1.66 0.00 0.16 0.00 0.00 175.35 177.16 1x2n h ARG 11 N 7.43 0.26 -2.78 4.03 -0.00 -1.97 -3.47 114.38 117.88 1x2n h ARG 11 Ca -0.27 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.20 1x2n h ARG 11 Cb 1.17 -0.06 0.00 0.00 0.00 0.00 0.00 29.97 31.08 1x2n h ARG 11 CO 0.17 0.17 0.00 0.41 0.00 0.00 0.00 179.97 180.72 1x2n n GLY 12 N -1.36 -2.68 3.70 0.04 0.00 -1.26 -4.96 105.19 98.67 1x2n n GLY 12 Ca 0.21 -0.37 -0.44 0.00 0.00 0.00 0.00 46.02 45.43 1x2n n GLY 12 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1x2n n VAL 13 N 0.05 1.01 -4.33 1.61 0.24 -1.26 -5.00 118.33 110.65 1x2n n VAL 13 Ca 0.00 -0.25 -0.28 0.00 -2.04 0.00 0.00 64.34 61.77 1x2n n VAL 13 Cb 0.00 -1.66 -0.11 0.00 -1.47 0.00 0.00 33.84 30.60 1x2n n VAL 13 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1x2n s LEU 14 N -0.15 2.74 0.59 1.34 1.43 -1.26 -5.12 118.68 118.25 1x2n s LEU 14 Ca 0.66 -0.64 -0.18 0.00 -1.03 0.00 0.00 54.13 52.94 1x2n s LEU 14 Cb -0.59 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 1x2n s LEU 14 CO 0.50 0.13 1.12 -2.16 0.23 0.00 0.00 176.35 176.17 1x2n s PRO 15 N -2.55 3.15 0.23 1.29 0.04 -1.26 -4.90 135.00 131.00 1x2n s PRO 15 Ca 0.21 1.53 -0.07 0.00 0.04 0.00 0.00 61.00 62.71 1x2n s PRO 15 Cb -0.09 -1.98 0.37 0.00 0.04 0.00 0.00 34.50 32.84 1x2n s PRO 15 CO 0.12 -1.00 1.70 -0.22 0.04 0.00 0.00 177.00 177.64 1x2n h LYS 16 N 0.77 0.27 -0.17 4.56 3.64 -2.00 -1.49 116.57 122.15 1x2n h LYS 16 Ca -0.49 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 58.92 1x2n h LYS 16 Cb 1.26 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.96 1x2n h LYS 16 CO 0.56 0.18 -0.16 1.25 -2.27 0.00 0.00 179.45 179.01 1x2n h HIS 17 N 0.28 -0.40 -0.64 1.91 2.76 -1.96 0.21 115.15 117.29 1x2n h HIS 17 Ca 0.36 0.03 0.14 0.00 -2.20 0.00 0.00 60.37 58.69 1x2n h HIS 17 Cb 0.57 0.20 -0.11 0.00 1.55 0.00 0.00 27.41 29.63 1x2n h HIS 17 CO -0.25 -0.23 0.03 0.00 -1.30 0.00 0.00 177.93 176.18 1x2n h ALA 18 N 0.91 0.68 -0.10 5.26 0.00 -1.53 0.88 119.26 125.35 1x2n h ALA 18 Ca 0.11 0.19 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 1x2n h ALA 18 Cb 0.34 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1x2n h ALA 18 CO -0.28 -0.38 -0.49 1.79 0.00 0.00 0.00 179.25 179.89 1x2n h THR 19 N 0.15 1.34 0.55 0.00 1.35 -1.01 -2.97 112.91 112.31 1x2n h THR 19 Ca 0.34 -1.72 -0.02 0.00 -0.55 0.00 0.00 66.41 64.46 1x2n h THR 19 Cb 0.56 1.81 -0.01 0.00 -1.73 0.00 0.00 68.15 68.78 1x2n h THR 19 CO -0.53 0.51 -0.37 0.78 -0.25 0.00 0.00 175.52 175.66 1x2n h ASN 20 N 0.21 -0.96 0.32 5.36 -0.26 0.18 0.40 115.58 120.84 1x2n h ASN 20 Ca 0.01 0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 1x2n h ASN 20 Cb 0.94 0.29 -0.03 0.00 -1.06 0.00 0.00 38.32 38.47 1x2n h ASN 20 CO 0.08 -0.57 -0.38 0.58 -1.06 0.00 0.00 177.43 176.08 1x2n h VAL 21 N -0.88 0.23 -0.79 2.81 2.07 -1.35 -0.13 116.25 118.20 1x2n h VAL 21 Ca -0.06 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.55 1x2n h VAL 21 Cb 0.73 0.23 -0.07 0.00 -1.52 0.00 0.00 31.29 30.66 1x2n h VAL 21 CO 0.04 0.00 0.43 0.24 0.02 0.00 0.00 177.57 178.30 1x2n h MET 22 N -0.74 0.70 0.85 1.57 2.86 -1.49 -1.73 114.93 116.95 1x2n h MET 22 Ca -0.02 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1x2n h MET 22 Cb 0.68 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1x2n h MET 22 CO -0.10 0.46 -0.48 0.00 1.06 0.00 0.00 176.91 177.86 1x2n h ARG 23 N 0.72 -1.18 -0.43 1.72 3.08 0.28 0.72 114.38 119.29 1x2n h ARG 23 Ca 0.39 0.08 0.08 0.00 0.07 0.00 0.00 59.98 60.60 1x2n h ARG 23 Cb 0.38 0.27 -0.09 0.00 0.08 0.00 0.00 29.97 30.61 1x2n h ARG 23 CO -0.26 -0.79 -0.35 1.03 -1.07 0.00 0.00 179.97 178.54 1x2n h SER 24 N -1.23 -1.16 0.23 7.04 0.87 -0.77 -0.16 113.55 118.38 1x2n h SER 24 Ca -0.12 0.20 0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1x2n h SER 24 Cb 0.97 0.54 -0.03 0.00 -0.44 0.00 0.00 62.40 63.43 1x2n h SER 24 CO 0.15 -0.33 -0.34 -0.25 -0.53 0.00 0.00 176.83 175.53 1x2n h TRP 25 N -0.25 -0.92 -0.82 2.24 7.01 -1.26 -0.23 115.95 121.72 1x2n h TRP 25 Ca 0.17 0.01 0.20 0.00 2.11 0.00 0.00 58.89 61.39 1x2n h TRP 25 Cb 0.55 0.37 -0.13 0.00 -2.10 0.00 0.00 29.16 27.86 1x2n h TRP 25 CO -0.57 -0.46 0.22 1.25 -2.79 0.00 0.00 178.44 176.08 1x2n h LEU 26 N -0.64 0.02 -0.37 0.65 5.85 -0.15 0.87 115.31 121.54 1x2n h LEU 26 Ca 0.00 0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 1x2n h LEU 26 Cb 0.62 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 1x2n h LEU 26 CO -0.13 -0.09 0.09 -0.26 -0.34 0.00 0.00 178.44 177.71 1x2n h PHE 27 N 0.25 0.62 -0.46 1.25 0.04 -0.47 0.40 116.94 118.57 1x2n h PHE 27 Ca 0.49 -0.07 0.10 0.00 2.80 0.00 0.00 57.97 61.28 1x2n h PHE 27 Cb 0.91 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.86 1x2n h PHE 27 CO -0.26 0.61 0.32 1.96 -0.60 0.00 0.00 178.31 180.34 1x2n h GLN 28 N 0.45 0.19 -0.18 1.51 4.20 0.93 -1.73 115.11 120.48 1x2n h GLN 28 Ca 0.12 -0.01 -0.13 0.00 0.06 0.00 0.00 58.65 58.68 1x2n h GLN 28 Cb 0.31 -0.04 -0.11 0.00 0.30 0.00 0.00 27.48 27.93 1x2n h GLN 28 CO 0.00 0.13 -0.59 0.72 -0.67 0.00 0.00 178.83 178.42 1x2n n HIS 29 N -4.45 0.65 -0.31 2.96 8.25 -0.51 -4.83 115.22 116.98 1x2n n HIS 29 Ca 0.07 -1.65 0.15 0.00 -0.26 0.00 0.00 57.72 56.03 1x2n n HIS 29 Cb 0.39 -0.27 0.32 0.00 1.12 0.00 0.00 29.99 31.55 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 1.44 0.18 -0.71 1.59 6.09 0.75 0.40 117.51 127.25 1x2n h ILE 30 Ca 0.08 -0.04 0.06 0.00 -1.37 0.00 0.00 64.86 63.60 1x2n h ILE 30 Cb 1.15 0.06 -0.06 0.00 0.47 0.00 0.00 36.82 38.44 1x2n h ILE 30 CO 0.18 0.02 0.40 1.23 -3.07 0.00 0.00 178.15 176.91 1x2n h GLY 31 N 0.11 1.05 -6.61 8.18 0.00 -1.85 -3.33 103.07 100.63 1x2n h GLY 31 Ca 0.60 -0.28 -0.60 0.00 0.00 0.00 0.00 47.33 47.05 1x2n h GLY 31 CO -0.76 0.17 -0.85 -1.58 0.00 0.00 0.00 176.54 173.52 1x2n s HIS 32 N -6.08 1.78 -1.17 5.60 5.65 0.13 -5.05 115.29 116.15 1x2n s HIS 32 Ca -0.13 -2.56 -0.23 0.00 0.25 0.00 0.00 55.06 52.40 1x2n s HIS 32 Cb 0.17 -1.45 -0.09 0.00 -1.18 0.00 0.00 32.58 30.03 1x2n s HIS 32 CO 0.77 -0.75 1.93 -0.35 -0.65 0.00 0.00 174.74 175.69 1x2n n PRO 33 N 2.73 1.60 -3.65 2.88 -0.04 -0.69 -4.83 135.00 132.99 1x2n n PRO 33 Ca 0.25 -2.44 -0.27 0.00 -0.04 0.00 0.00 63.50 60.99 1x2n n PRO 33 Cb 0.43 -3.69 -0.16 0.00 -0.04 0.00 0.00 33.50 30.04 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 10.72 0.64 0.23 0.54 1.51 -1.26 -5.01 117.35 124.71 1x2n s TYR 34 Ca 0.68 -0.71 -0.30 0.00 -1.01 0.00 0.00 57.07 55.73 1x2n s TYR 34 Cb 0.00 -0.93 -0.09 0.00 -0.11 0.00 0.00 41.96 40.84 1x2n s TYR 34 CO 0.14 -0.63 1.28 -1.25 -1.11 0.00 0.00 175.55 173.98 1x2n s PRO 35 N 1.99 4.41 0.33 -1.71 0.04 -1.26 -5.02 135.00 133.78 1x2n s PRO 35 Ca 0.03 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 62.96 1x2n s PRO 35 Cb -0.16 -3.18 -0.09 0.00 0.04 0.00 0.00 34.50 31.11 1x2n s PRO 35 CO -0.14 -0.19 0.74 0.95 0.04 0.00 0.00 177.00 178.40 1x2n s THR 36 N -0.21 4.67 0.39 1.26 -4.23 -1.26 -4.83 115.64 111.43 1x2n s THR 36 Ca 0.54 0.97 0.24 0.00 -1.18 0.00 0.00 61.69 62.26 1x2n s THR 36 Cb -0.36 -3.61 0.39 0.00 1.34 0.00 0.00 72.50 70.26 1x2n s THR 36 CO 0.41 -0.19 1.56 -1.84 -0.54 0.00 0.00 174.62 174.02 1x2n n GLU 37 N -0.38 -0.05 0.07 3.99 0.00 -1.26 0.23 120.64 123.25 1x2n n GLU 37 Ca 0.04 1.33 -0.12 0.00 0.00 0.00 0.00 57.16 58.41 1x2n n GLU 37 Cb 0.53 -2.46 -0.03 0.00 0.00 0.00 0.00 31.44 29.48 1x2n n GLU 37 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1x2n h ASP 38 N 0.00 0.44 -0.51 -1.84 5.19 -2.00 -3.08 116.42 114.62 1x2n h ASP 38 Ca 0.85 -0.35 -0.03 0.00 -0.62 0.00 0.00 57.03 56.88 1x2n h ASP 38 Cb 2.41 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 41.76 1x2n h ASP 38 CO -0.67 1.15 0.19 -0.33 -3.12 0.00 0.00 179.24 176.46 1x2n h GLU 39 N 0.19 0.78 -0.51 3.56 4.39 0.26 0.22 114.58 123.48 1x2n h GLU 39 Ca -0.07 -0.15 -0.04 0.00 0.34 0.00 0.00 59.36 59.44 1x2n h GLU 39 Cb 1.54 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 30.05 1x2n h GLU 39 CO 0.15 0.70 0.14 0.87 -1.16 0.00 0.00 179.01 179.71 1x2n h LYS 40 N 0.69 0.76 -0.00 2.33 1.57 -1.16 0.40 116.57 121.15 1x2n h LYS 40 Ca 0.17 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1x2n h LYS 40 Cb 0.22 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1x2n h LYS 40 CO -0.01 0.67 -0.22 0.87 -0.57 0.00 0.00 179.45 180.19 1x2n h LYS 41 N 0.74 0.16 0.33 3.15 1.57 -1.39 -2.48 116.57 118.66 1x2n h LYS 41 Ca 0.17 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1x2n h LYS 41 Cb 0.25 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1x2n h LYS 41 CO -0.01 0.90 -0.16 1.96 -0.57 0.00 0.00 179.45 181.57 1x2n h GLN 42 N -0.51 -0.43 -0.26 3.15 1.08 -0.46 -3.22 115.11 114.45 1x2n h GLN 42 Ca -0.03 0.03 0.06 0.00 -1.45 0.00 0.00 58.65 57.26 1x2n h GLN 42 Cb 0.98 0.10 -0.06 0.00 -0.05 0.00 0.00 27.48 28.44 1x2n h GLN 42 CO 0.04 -0.13 -0.13 0.82 -0.95 0.00 0.00 178.83 178.49 1x2n h ILE 43 N -0.73 0.60 -1.02 2.54 2.04 -0.35 -1.32 117.51 119.27 1x2n h ILE 43 Ca -0.05 0.00 0.41 0.00 1.00 0.00 0.00 64.86 66.22 1x2n h ILE 43 Cb 0.50 0.60 -0.17 0.00 -0.74 0.00 0.00 36.82 37.01 1x2n h ILE 43 CO 0.08 0.00 0.57 0.00 0.00 0.00 0.00 178.15 178.79 1x2n h ALA 44 N 1.13 2.18 0.32 1.87 0.00 -1.46 0.30 119.26 123.60 1x2n h ALA 44 Ca 0.14 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 1x2n h ALA 44 Cb 0.30 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1x2n h ALA 44 CO -0.32 -0.94 -0.16 0.00 0.00 0.00 0.00 179.25 177.83 1x2n h ALA 45 N 1.95 -0.59 -1.09 0.00 0.00 -1.26 2.03 119.26 120.30 1x2n h ALA 45 Ca 0.84 -0.10 0.30 0.00 0.00 0.00 0.00 54.91 55.95 1x2n h ALA 45 Cb 2.21 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 20.09 1x2n h ALA 45 CO -0.73 -0.56 0.74 1.96 0.00 0.00 0.00 179.25 180.66 1x2n h GLN 46 N -0.78 0.19 0.00 0.00 4.20 -0.92 0.62 115.11 118.42 1x2n h GLN 46 Ca -0.04 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1x2n h GLN 46 Cb 0.33 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1x2n h GLN 46 CO 0.07 0.13 -1.14 0.25 -0.67 0.00 0.00 178.83 177.47 1x2n n THR 47 N -4.43 0.02 -2.81 -0.54 -2.24 0.93 -4.77 114.28 100.44 1x2n n THR 47 Ca 0.25 -0.12 -0.20 0.00 -2.27 0.00 0.00 64.05 61.71 1x2n n THR 47 Cb 1.04 0.66 0.02 0.00 -2.10 0.00 0.00 70.33 69.96 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 -1.70 -5.60 -4.60 3.42 2.85 0.61 -4.57 115.26 105.67 1x2n n ASN 48 Ca 0.02 -0.20 -0.25 0.00 -0.11 0.00 0.00 54.58 54.04 1x2n n ASN 48 Cb 0.39 -4.48 -0.08 0.00 1.24 0.00 0.00 39.78 36.85 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 -5.85 3.08 0.20 1.20 1.43 0.33 -4.96 118.68 114.10 1x2n s LEU 49 Ca 0.21 -0.61 -0.20 0.00 -1.03 0.00 0.00 54.13 52.50 1x2n s LEU 49 Cb -0.09 -1.68 -0.08 0.00 0.03 0.00 0.00 46.19 44.37 1x2n s LEU 49 CO 0.26 0.06 0.71 0.42 0.23 0.00 0.00 176.35 178.02 1x2n s THR 50 N -2.01 4.58 0.30 5.49 -4.23 -1.26 -4.39 115.64 114.12 1x2n s THR 50 Ca 0.28 1.29 0.21 0.00 -1.18 0.00 0.00 61.69 62.29 1x2n s THR 50 Cb -0.08 -3.88 0.33 0.00 1.34 0.00 0.00 72.50 70.22 1x2n s THR 50 CO 0.17 0.26 1.13 0.18 -0.54 0.00 0.00 174.62 175.82 1x2n n LEU 51 N 0.87 0.18 0.13 4.79 7.99 -1.26 0.16 117.00 129.86 1x2n n LEU 51 Ca -0.03 1.05 -0.13 0.00 -0.01 0.00 0.00 56.01 56.89 1x2n n LEU 51 Cb 0.51 -0.52 -0.08 0.00 -0.11 0.00 0.00 43.42 43.22 1x2n n LEU 51 CO 0.43 -1.15 0.62 0.25 -1.51 0.00 0.00 177.39 176.03 1x2n h LEU 52 N 0.00 -0.28 0.60 2.23 6.46 -1.97 -2.25 115.31 120.10 1x2n h LEU 52 Ca 0.63 -0.18 -0.02 0.00 -0.12 0.00 0.00 57.88 58.19 1x2n h LEU 52 Cb 1.92 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 41.91 1x2n h LEU 52 CO -0.40 0.03 -0.41 1.56 -0.62 0.00 0.00 178.44 178.61 1x2n h GLN 53 N -0.61 -0.93 -1.05 1.25 4.20 0.12 0.71 115.11 118.80 1x2n h GLN 53 Ca -0.03 0.06 0.28 0.00 0.06 0.00 0.00 58.65 59.02 1x2n h GLN 53 Cb 0.44 0.21 -0.11 0.00 0.30 0.00 0.00 27.48 28.32 1x2n h GLN 53 CO 0.06 -0.62 0.65 0.28 -0.67 0.00 0.00 178.83 178.53 1x2n h VAL 54 N -0.97 0.47 0.34 -0.54 2.07 -1.36 -0.81 116.25 115.45 1x2n h VAL 54 Ca -0.07 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1x2n h VAL 54 Cb 0.80 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1x2n h VAL 54 CO 0.04 0.08 -0.16 0.78 0.02 0.00 0.00 177.57 178.33 1x2n h ASN 55 N 0.42 -0.39 -0.76 0.57 2.35 -0.86 -2.80 115.58 114.11 1x2n h ASN 55 Ca 0.65 -0.11 0.16 0.00 -0.55 0.00 0.00 56.30 56.44 1x2n h ASN 55 Cb 1.53 0.10 -0.14 0.00 0.05 0.00 0.00 38.32 39.86 1x2n h ASN 55 CO -0.40 0.07 -0.14 0.78 -1.65 0.00 0.00 177.43 176.10 1x2n h ASN 56 N -1.03 -0.61 0.11 5.81 -0.26 0.04 0.22 115.58 119.86 1x2n h ASN 56 Ca -0.05 0.22 0.01 0.00 -0.56 0.00 0.00 56.30 55.93 1x2n h ASN 56 Cb 0.48 0.44 -0.03 0.00 -1.06 0.00 0.00 38.32 38.15 1x2n h ASN 56 CO 0.08 -0.24 -0.20 -0.25 -1.06 0.00 0.00 177.43 175.76 1x2n h TRP 57 N 0.02 -0.53 -0.13 1.19 7.01 -1.26 -2.35 115.95 119.89 1x2n h TRP 57 Ca 0.38 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.42 1x2n h TRP 57 Cb 0.62 0.22 -0.03 0.00 -2.10 0.00 0.00 29.16 27.86 1x2n h TRP 57 CO -0.56 -0.29 -0.07 0.74 -2.79 0.00 0.00 178.44 175.47 1x2n h PHE 58 N -0.39 -0.16 -1.04 2.65 0.04 -0.78 0.22 116.94 117.49 1x2n h PHE 58 Ca 0.03 0.01 0.27 0.00 2.80 0.00 0.00 57.97 61.08 1x2n h PHE 58 Cb 0.40 0.09 -0.11 0.00 2.20 0.00 0.00 35.95 38.53 1x2n h PHE 58 CO -0.19 -0.11 0.65 0.82 -0.60 0.00 0.00 178.31 178.88 1x2n h ILE 59 N -0.06 0.49 0.14 -0.55 2.04 -0.42 0.16 117.51 119.32 1x2n h ILE 59 Ca 0.08 -0.15 -0.30 0.00 1.00 0.00 0.00 64.86 65.48 1x2n h ILE 59 Cb 0.17 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.26 1x2n h ILE 59 CO -0.17 0.08 -1.43 -1.13 0.00 0.00 0.00 178.15 175.50 1x2n h ASN 60 N 0.44 0.46 -0.01 1.72 -1.24 -0.79 -3.10 115.58 113.06 1x2n h ASN 60 Ca 0.63 -0.56 0.00 0.00 0.71 0.00 0.00 56.30 57.09 1x2n h ASN 60 Cb 1.47 -0.15 -0.00 0.00 0.73 0.00 0.00 38.32 40.37 1x2n h ASN 60 CO -0.38 1.46 0.01 0.00 -1.29 0.00 0.00 177.43 177.22 1x2n h ALA 61 N 0.48 1.75 0.05 1.57 0.00 0.22 -0.33 119.26 122.99 1x2n h ALA 61 Ca -0.21 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.42 1x2n h ALA 61 Cb 2.02 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.78 1x2n h ALA 61 CO 0.19 -0.02 -1.51 0.00 0.00 0.00 0.00 179.25 177.91 1x2n h ARG 62 N 0.00 0.11 0.00 0.00 3.08 -1.22 -3.07 114.38 113.28 1x2n h ARG 62 Ca 0.01 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1x2n h ARG 62 Cb 0.03 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1x2n h ARG 62 CO -0.00 0.89 0.00 0.00 -1.07 0.00 0.00 179.97 179.79 1x2n h ARG 63 N 0.03 0.00 0.06 0.04 3.08 -1.24 -1.30 114.38 115.05 1x2n h ARG 63 Ca -0.22 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.52 1x2n h ARG 63 Cb 1.96 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.98 1x2n h ARG 63 CO 0.12 0.00 -1.74 0.07 -1.07 0.00 0.00 179.97 177.35 1x2n h ARG 64 N 0.00 0.13 0.07 0.04 0.11 -1.18 -3.16 114.38 110.40 1x2n h ARG 64 Ca 0.00 -0.22 -0.12 0.00 0.10 0.00 0.00 59.98 59.74 1x2n h ARG 64 Cb 0.73 0.08 0.01 0.00 1.11 0.00 0.00 29.97 31.90 1x2n h ARG 64 CO 0.00 0.86 -0.55 -0.84 0.10 0.00 0.00 179.97 179.53 1x2n h ILE 65 N 0.04 1.56 -0.50 0.08 3.07 -1.51 -3.35 117.51 116.89 1x2n h ILE 65 Ca -0.31 -2.43 -0.00 0.00 1.55 0.00 0.00 64.86 63.66 1x2n h ILE 65 Cb 2.01 3.19 -0.02 0.00 -0.27 0.00 0.00 36.82 41.73 1x2n h ILE 65 CO 0.10 0.65 0.30 -0.07 -1.05 0.00 0.00 178.15 178.08 1x2n h LEU 66 N -0.66 0.61 -9.12 0.16 -0.00 -1.43 -3.41 115.31 101.47 1x2n h LEU 66 Ca -0.11 -0.06 -0.56 0.00 -0.00 0.00 0.00 57.88 57.15 1x2n h LEU 66 Cb 1.37 -0.15 -0.02 0.00 -0.00 0.00 0.00 40.66 41.86 1x2n h LEU 66 CO 0.06 0.49 1.11 -1.58 -0.00 0.00 0.00 178.44 178.52 1x2n s GLN 67 N -5.97 3.94 -0.24 1.13 0.74 -1.19 -4.98 119.66 113.09 1x2n s GLN 67 Ca -0.13 1.84 -0.15 0.00 0.05 0.00 0.00 55.36 56.97 1x2n s GLN 67 Cb 0.12 -4.01 -0.04 0.00 1.10 0.00 0.00 33.01 30.18 1x2n s GLN 67 CO 0.75 -1.12 0.35 -1.12 -0.55 0.00 0.00 175.29 173.60 1x2n s SER 68 N 3.86 6.31 0.00 6.67 0.01 -1.26 -4.86 113.70 124.43 1x2n s SER 68 Ca 0.71 0.36 0.00 0.00 1.31 0.00 0.00 55.95 58.33 1x2n s SER 68 Cb -0.27 -2.20 0.00 0.00 0.21 0.00 0.00 66.02 63.75 1x2n s SER 68 CO 0.28 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.44 1x2n n GLY 69 N 4.29 -0.59 3.76 3.44 0.00 -1.26 -5.16 105.19 109.67 1x2n n GLY 69 Ca -0.09 -0.61 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 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 -0.30 2.00 -0.23 1.61 0.04 -1.26 -5.08 135.00 131.79 1x2n s PRO 70 Ca 0.00 1.08 -0.11 0.00 0.04 0.00 0.00 61.00 62.01 1x2n s PRO 70 Cb 0.00 -1.87 0.08 0.00 0.04 0.00 0.00 34.50 32.75 1x2n s PRO 70 CO 0.00 -1.79 0.52 0.45 0.04 0.00 0.00 177.00 176.22 1x2n s SER 71 N -3.41 -0.67 -0.16 6.66 0.15 -1.26 -5.12 113.70 109.90 1x2n s SER 71 Ca 0.62 1.19 -0.37 0.00 0.70 0.00 0.00 55.95 58.09 1x2n s SER 71 Cb -0.17 1.32 -0.14 0.00 -1.71 0.00 0.00 66.02 65.32 1x2n s SER 71 CO 0.56 -0.22 1.80 -1.54 1.20 0.00 0.00 173.24 175.04 1x2n n SER 72 N 4.74 2.94 0.00 5.45 3.41 -1.26 -5.35 113.62 123.56 1x2n n SER 72 Ca -0.17 1.02 0.00 0.00 -0.26 0.00 0.00 58.87 59.46 1x2n n SER 72 Cb 0.54 -1.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.22 1x2n n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49