#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 1.49 0.29 1.61 0.15 -1.26 -5.16 113.70 110.82 1x2n s SER 2 Ca 0.00 -0.70 0.02 0.00 0.70 0.00 0.00 55.95 55.98 1x2n s SER 2 Cb 0.00 -0.02 -0.03 0.00 -1.71 0.00 0.00 66.02 64.27 1x2n s SER 2 CO 0.00 -0.17 0.27 -0.44 1.20 0.00 0.00 173.24 174.09 1x2n s SER 3 N -2.05 1.01 0.20 5.45 0.01 -1.26 -5.19 113.70 111.87 1x2n s SER 3 Ca 0.01 -1.57 -0.03 0.00 1.31 0.00 0.00 55.95 55.67 1x2n s SER 3 Cb -0.07 0.52 -0.03 0.00 0.21 0.00 0.00 66.02 66.64 1x2n s SER 3 CO 0.01 -1.03 0.17 -0.83 0.41 0.00 0.00 173.24 171.97 1x2n s GLY 4 N -3.27 1.25 -0.16 3.44 0.00 -1.26 -5.17 107.32 102.14 1x2n s GLY 4 Ca 0.38 -1.55 -0.29 0.00 0.00 0.00 0.00 44.72 43.26 1x2n s GLY 4 CO 0.21 -1.29 0.89 -0.45 0.00 0.00 0.00 173.10 172.47 1x2n s SER 5 N -3.12 -0.50 0.35 1.64 0.15 -1.26 -5.19 113.70 105.78 1x2n s SER 5 Ca 0.35 0.67 0.03 0.00 0.70 0.00 0.00 55.95 57.70 1x2n s SER 5 Cb 0.06 0.58 -0.04 0.00 -1.71 0.00 0.00 66.02 64.91 1x2n s SER 5 CO 0.10 -0.37 0.11 -0.94 1.20 0.00 0.00 173.24 173.35 1x2n s SER 6 N -0.75 2.27 0.00 5.45 1.04 -1.26 -5.13 113.70 115.32 1x2n s SER 6 Ca -0.03 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 54.85 1x2n s SER 6 Cb -0.02 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.40 1x2n s SER 6 CO 0.02 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 174.03 1x2n n GLY 7 N -0.74 -0.66 3.54 7.32 0.00 -1.26 -5.05 105.19 108.33 1x2n n GLY 7 Ca -0.03 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1x2n n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x2n s LYS 8 N -0.20 3.82 0.00 1.61 3.01 -1.26 -4.97 119.74 121.75 1x2n s LYS 8 Ca 0.00 -1.79 0.01 0.00 -1.01 0.00 0.00 55.97 53.18 1x2n s LYS 8 Cb 0.00 -5.31 -0.04 0.00 -1.01 0.00 0.00 37.83 31.47 1x2n s LYS 8 CO 0.00 -2.09 0.03 0.54 0.51 0.00 0.00 175.35 174.34 1x2n s ASN 9 N 4.14 5.30 -1.13 2.83 4.22 -1.26 -5.03 114.94 124.01 1x2n s ASN 9 Ca 0.46 0.04 -0.22 0.00 -2.14 0.00 0.00 52.86 51.00 1x2n s ASN 9 Cb 0.00 -1.43 -0.03 0.00 1.28 0.00 0.00 41.25 41.08 1x2n s ASN 9 CO -0.02 0.27 1.84 -0.54 -2.04 0.00 0.00 177.10 176.62 1x2n s LYS 10 N -1.64 2.96 0.89 3.55 3.01 -1.26 -4.95 119.74 122.29 1x2n s LYS 10 Ca 0.21 -1.17 -0.12 0.00 -1.01 0.00 0.00 55.97 53.88 1x2n s LYS 10 Cb -0.12 -5.29 0.12 0.00 -1.01 0.00 0.00 37.83 31.54 1x2n s LYS 10 CO 0.12 -3.28 1.10 -0.98 0.51 0.00 0.00 175.35 172.81 1x2n s ARG 11 N 5.92 1.34 0.00 1.68 1.70 -1.26 -5.03 118.95 123.30 1x2n s ARG 11 Ca 0.63 0.67 0.00 0.00 -0.47 0.00 0.00 55.73 56.56 1x2n s ARG 11 Cb -0.01 -1.83 0.00 0.00 -0.57 0.00 0.00 34.95 32.54 1x2n s ARG 11 CO 0.07 -2.14 0.00 0.41 -1.08 0.00 0.00 175.30 172.55 1x2n n GLY 12 N -1.49 3.33 3.76 3.88 0.00 -1.26 -5.11 105.19 108.28 1x2n n GLY 12 Ca 0.07 -1.30 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 1x2n n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x2n s VAL 13 N -2.00 2.90 0.25 1.61 1.01 -1.26 -5.02 120.40 117.89 1x2n s VAL 13 Ca 0.00 0.83 -0.01 0.00 0.00 0.00 0.00 61.98 62.81 1x2n s VAL 13 Cb 0.00 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 1x2n s VAL 13 CO 0.00 0.17 0.45 -0.76 0.00 0.00 0.00 175.10 174.96 1x2n s LEU 14 N -1.10 4.15 0.67 3.92 1.43 -1.26 -5.09 118.68 121.41 1x2n s LEU 14 Ca 0.52 0.45 -0.15 0.00 -1.03 0.00 0.00 54.13 53.92 1x2n s LEU 14 Cb -0.39 -3.25 0.00 0.00 0.03 0.00 0.00 46.19 42.59 1x2n s LEU 14 CO 0.46 -0.13 1.11 -2.16 0.23 0.00 0.00 176.35 175.87 1x2n s PRO 15 N -3.63 2.75 0.17 1.29 0.04 -1.26 -4.88 135.00 129.48 1x2n s PRO 15 Ca 0.39 1.38 -0.14 0.00 0.04 0.00 0.00 61.00 62.67 1x2n s PRO 15 Cb -0.10 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.55 1x2n s PRO 15 CO 0.31 -1.29 1.83 -0.22 0.04 0.00 0.00 177.00 177.67 1x2n h LYS 16 N -0.07 0.68 -0.92 4.56 1.63 -1.98 -1.91 116.57 118.56 1x2n h LYS 16 Ca -0.46 -0.04 0.20 0.00 -0.85 0.00 0.00 60.65 59.49 1x2n h LYS 16 Cb 1.25 -0.15 -0.11 0.00 -0.60 0.00 0.00 32.23 32.61 1x2n h LYS 16 CO 0.54 0.46 0.49 1.25 -3.45 0.00 0.00 179.45 178.73 1x2n h HIS 17 N 0.70 0.84 -0.02 1.91 2.76 -1.97 0.50 115.15 119.87 1x2n h HIS 17 Ca 0.19 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.39 1x2n h HIS 17 Cb -0.08 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 28.65 1x2n h HIS 17 CO -0.04 0.10 -0.03 0.00 -1.30 0.00 0.00 177.93 176.66 1x2n h ALA 18 N 1.66 0.03 -0.00 5.26 0.00 -1.69 -3.16 119.26 121.35 1x2n h ALA 18 Ca 0.55 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1x2n h ALA 18 Cb 0.94 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1x2n h ALA 18 CO -0.44 -0.18 -0.06 1.79 0.00 0.00 0.00 179.25 180.36 1x2n h THR 19 N -0.49 1.04 0.64 0.00 1.35 -0.52 -2.85 112.91 112.08 1x2n h THR 19 Ca 0.00 -0.20 -0.03 0.00 -0.55 0.00 0.00 66.41 65.63 1x2n h THR 19 Cb 0.58 1.11 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 1x2n h THR 19 CO 0.01 0.06 -0.44 0.78 -0.25 0.00 0.00 175.52 175.68 1x2n h ASN 20 N 0.00 -1.13 0.43 5.36 2.35 -0.01 0.28 115.58 122.86 1x2n h ASN 20 Ca -0.00 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 1x2n h ASN 20 Cb 0.10 0.34 -0.03 0.00 0.05 0.00 0.00 38.32 38.79 1x2n h ASN 20 CO 0.01 -0.65 -0.51 0.58 -1.65 0.00 0.00 177.43 175.21 1x2n h VAL 21 N -1.02 0.00 -0.49 2.81 2.07 -1.54 -1.19 116.25 116.88 1x2n h VAL 21 Ca -0.08 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.53 1x2n h VAL 21 Cb 0.83 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.51 1x2n h VAL 21 CO 0.06 0.00 -0.17 0.24 0.02 0.00 0.00 177.57 177.71 1x2n h MET 22 N -0.96 -0.06 0.08 1.57 2.86 -1.52 -1.73 114.93 115.17 1x2n h MET 22 Ca -0.05 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1x2n h MET 22 Cb 0.86 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.49 1x2n h MET 22 CO -0.11 -0.04 -0.40 0.00 1.06 0.00 0.00 176.91 177.43 1x2n h ARG 23 N -0.06 -0.54 -0.70 1.72 3.08 -0.13 0.15 114.38 117.90 1x2n h ARG 23 Ca 0.24 0.04 0.12 0.00 0.07 0.00 0.00 59.98 60.44 1x2n h ARG 23 Cb 0.42 0.12 -0.13 0.00 0.08 0.00 0.00 29.97 30.47 1x2n h ARG 23 CO -0.54 -0.36 -0.34 1.03 -1.07 0.00 0.00 179.97 178.69 1x2n h SER 24 N -0.56 -1.19 0.23 7.04 0.87 -0.77 0.39 113.55 119.56 1x2n h SER 24 Ca -0.00 0.25 0.01 0.00 -1.23 0.00 0.00 61.79 60.81 1x2n h SER 24 Cb 0.57 0.61 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1x2n h SER 24 CO -0.22 -0.30 -0.30 -0.25 -0.53 0.00 0.00 176.83 175.24 1x2n h TRP 25 N -0.11 -0.79 -0.64 2.24 7.01 -0.89 0.32 115.95 123.07 1x2n h TRP 25 Ca 0.27 0.01 0.14 0.00 2.11 0.00 0.00 58.89 61.41 1x2n h TRP 25 Cb 0.56 0.32 -0.11 0.00 -2.10 0.00 0.00 29.16 27.83 1x2n h TRP 25 CO -0.69 -0.42 -0.04 1.25 -2.79 0.00 0.00 178.44 175.76 1x2n h LEU 26 N -0.58 -0.36 -0.65 0.65 5.85 0.60 0.49 115.31 121.32 1x2n h LEU 26 Ca 0.00 0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1x2n h LEU 26 Cb 0.56 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 1x2n h LEU 26 CO -0.10 -0.15 0.28 -0.26 -0.34 0.00 0.00 178.44 177.87 1x2n h PHE 27 N 0.09 0.96 -0.48 1.25 0.04 -0.58 0.28 116.94 118.49 1x2n h PHE 27 Ca 0.33 -0.06 0.05 0.00 2.80 0.00 0.00 57.97 61.09 1x2n h PHE 27 Cb 0.55 -0.29 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 1x2n h PHE 27 CO -0.41 0.74 0.32 1.96 -0.60 0.00 0.00 178.31 180.32 1x2n h GLN 28 N 0.90 0.44 -0.32 1.51 4.20 0.12 -2.14 115.11 119.81 1x2n h GLN 28 Ca 0.22 -0.03 -0.22 0.00 0.06 0.00 0.00 58.65 58.68 1x2n h GLN 28 Cb 0.16 -0.10 -0.16 0.00 0.30 0.00 0.00 27.48 27.68 1x2n h GLN 28 CO -0.02 0.29 -0.49 0.72 -0.67 0.00 0.00 178.83 178.66 1x2n n HIS 29 N -4.48 1.13 -0.32 2.96 8.25 -0.41 -4.82 115.22 117.54 1x2n n HIS 29 Ca 0.06 -1.79 0.16 0.00 -0.26 0.00 0.00 57.72 55.89 1x2n n HIS 29 Cb 0.21 -0.35 0.33 0.00 1.12 0.00 0.00 29.99 31.30 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 1.37 0.18 -0.48 1.59 6.09 0.24 0.24 117.51 126.73 1x2n h ILE 30 Ca 0.17 -0.04 0.09 0.00 -1.37 0.00 0.00 64.86 63.71 1x2n h ILE 30 Cb 1.27 0.05 -0.07 0.00 0.47 0.00 0.00 36.82 38.53 1x2n h ILE 30 CO 0.35 0.02 0.03 1.23 -3.07 0.00 0.00 178.15 176.71 1x2n h GLY 31 N 0.12 0.52 -6.65 8.18 0.00 -1.86 -3.33 103.07 100.05 1x2n h GLY 31 Ca 0.61 0.03 -0.60 0.00 0.00 0.00 0.00 47.33 47.37 1x2n h GLY 31 CO -0.76 -0.11 -0.84 -1.58 0.00 0.00 0.00 176.54 173.26 1x2n s HIS 32 N -6.16 1.66 -1.16 5.60 2.46 0.77 -5.05 115.29 113.40 1x2n s HIS 32 Ca -0.13 -2.42 -0.23 0.00 0.47 0.00 0.00 55.06 52.75 1x2n s HIS 32 Cb 0.15 -1.43 -0.09 0.00 -0.13 0.00 0.00 32.58 31.08 1x2n s HIS 32 CO 0.72 -0.77 1.93 -0.35 -2.47 0.00 0.00 174.74 173.81 1x2n n PRO 33 N 3.02 1.60 -3.65 2.88 -0.04 -0.85 -4.84 135.00 133.12 1x2n n PRO 33 Ca 0.21 -2.43 -0.27 0.00 -0.04 0.00 0.00 63.50 60.96 1x2n n PRO 33 Cb 0.41 -3.68 -0.16 0.00 -0.04 0.00 0.00 33.50 30.03 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 10.66 0.64 0.42 0.54 1.51 -1.26 -5.01 117.35 124.84 1x2n s TYR 34 Ca 0.68 -0.74 -0.25 0.00 -1.01 0.00 0.00 57.07 55.75 1x2n s TYR 34 Cb 0.00 -0.94 -0.08 0.00 -0.11 0.00 0.00 41.96 40.83 1x2n s TYR 34 CO 0.14 -0.64 1.18 -1.25 -1.11 0.00 0.00 175.55 173.87 1x2n s PRO 35 N 1.99 3.96 0.02 -1.71 0.04 -1.26 -5.04 135.00 133.00 1x2n s PRO 35 Ca 0.03 1.85 -0.03 0.00 0.04 0.00 0.00 61.00 62.90 1x2n s PRO 35 Cb -0.16 -2.61 -0.04 0.00 0.04 0.00 0.00 34.50 31.72 1x2n s PRO 35 CO -0.15 -0.40 0.21 0.95 0.04 0.00 0.00 177.00 177.65 1x2n s THR 36 N -1.43 5.39 0.26 1.26 -4.23 -1.26 -4.88 115.64 110.75 1x2n s THR 36 Ca 0.59 -0.16 0.17 0.00 -1.18 0.00 0.00 61.69 61.10 1x2n s THR 36 Cb -0.31 -3.57 0.27 0.00 1.34 0.00 0.00 72.50 70.23 1x2n s THR 36 CO 0.39 0.26 1.04 -1.84 -0.54 0.00 0.00 174.62 173.93 1x2n n GLU 37 N 0.73 -0.03 0.05 3.99 0.28 -1.26 0.18 120.64 124.57 1x2n n GLU 37 Ca -0.09 0.88 -0.12 0.00 -0.16 0.00 0.00 57.16 57.67 1x2n n GLU 37 Cb 0.52 -1.64 -0.09 0.00 1.43 0.00 0.00 31.44 31.67 1x2n n GLU 37 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1x2n h ASP 38 N 0.00 -0.14 -0.58 -1.84 3.32 -1.99 -2.85 116.42 112.33 1x2n h ASP 38 Ca 0.57 -0.39 0.11 0.00 0.02 0.00 0.00 57.03 57.34 1x2n h ASP 38 Cb 1.64 0.04 -0.08 0.00 0.22 0.00 0.00 39.33 41.14 1x2n h ASP 38 CO -0.43 0.36 0.11 -0.33 -1.72 0.00 0.00 179.24 177.23 1x2n h GLU 39 N -0.70 0.23 -0.85 3.56 4.39 0.14 0.27 114.58 121.62 1x2n h GLU 39 Ca -0.02 -0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.73 1x2n h GLU 39 Cb 0.52 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 29.07 1x2n h GLU 39 CO 0.03 0.15 0.56 0.87 -1.16 0.00 0.00 179.01 179.46 1x2n h LYS 40 N 0.24 0.94 0.21 2.33 1.57 -1.24 0.43 116.57 121.05 1x2n h LYS 40 Ca 0.30 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 1x2n h LYS 40 Cb 0.44 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1x2n h LYS 40 CO -0.40 0.62 -0.10 0.87 -0.57 0.00 0.00 179.45 179.87 1x2n h LYS 41 N 0.97 -0.28 0.51 3.15 1.57 -0.75 -2.47 116.57 119.26 1x2n h LYS 41 Ca 0.36 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.15 1x2n h LYS 41 Cb 0.19 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1x2n h LYS 41 CO -0.13 0.06 -0.35 1.96 -0.57 0.00 0.00 179.45 180.43 1x2n h GLN 42 N -0.95 -0.80 -0.58 3.15 4.20 -0.41 -2.87 115.11 116.86 1x2n h GLN 42 Ca -0.03 0.05 0.12 0.00 0.06 0.00 0.00 58.65 58.85 1x2n h GLN 42 Cb 0.47 0.18 -0.10 0.00 0.30 0.00 0.00 27.48 28.33 1x2n h GLN 42 CO 0.05 -0.53 0.00 0.82 -0.67 0.00 0.00 178.83 178.50 1x2n h ILE 43 N -0.83 0.53 -1.13 2.54 2.04 -0.28 0.37 117.51 120.75 1x2n h ILE 43 Ca -0.06 -0.04 0.38 0.00 1.00 0.00 0.00 64.86 66.14 1x2n h ILE 43 Cb 0.69 0.40 -0.14 0.00 -0.74 0.00 0.00 36.82 37.03 1x2n h ILE 43 CO 0.03 0.02 0.69 0.00 0.00 0.00 0.00 178.15 178.89 1x2n h ALA 44 N 1.52 2.34 0.16 1.87 0.00 -1.21 0.24 119.26 124.19 1x2n h ALA 44 Ca 0.30 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.36 1x2n h ALA 44 Cb 0.47 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1x2n h ALA 44 CO -0.49 -0.97 -0.08 0.00 0.00 0.00 0.00 179.25 177.71 1x2n h ALA 45 N 1.75 -0.36 -1.09 0.00 0.00 -0.88 1.51 119.26 120.20 1x2n h ALA 45 Ca 0.78 -0.05 0.33 0.00 0.00 0.00 0.00 54.91 55.97 1x2n h ALA 45 Cb 2.12 0.09 -0.13 0.00 0.00 0.00 0.00 17.79 19.87 1x2n h ALA 45 CO -0.53 -0.34 0.66 1.96 0.00 0.00 0.00 179.25 181.00 1x2n h GLN 46 N -0.60 0.29 0.00 0.00 4.20 -1.04 0.86 115.11 118.83 1x2n h GLN 46 Ca -0.02 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1x2n h GLN 46 Cb 0.17 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.88 1x2n h GLN 46 CO 0.04 0.19 -1.06 0.25 -0.67 0.00 0.00 178.83 177.58 1x2n n THR 47 N -4.86 0.14 -2.70 -0.54 -2.24 0.76 -4.81 114.28 100.04 1x2n n THR 47 Ca 0.31 -0.23 -0.16 0.00 -2.27 0.00 0.00 64.05 61.70 1x2n n THR 47 Cb 1.05 0.27 0.02 0.00 -2.10 0.00 0.00 70.33 69.56 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 -1.93 -4.80 -4.59 3.42 2.85 0.37 -4.62 115.26 105.97 1x2n n ASN 48 Ca 0.02 -0.17 -0.25 0.00 -0.11 0.00 0.00 54.58 54.07 1x2n n ASN 48 Cb 0.43 -3.71 -0.09 0.00 1.24 0.00 0.00 39.78 37.65 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 -4.82 3.01 0.25 1.20 1.43 0.42 -4.96 118.68 115.22 1x2n s LEU 49 Ca 0.17 -0.65 -0.20 0.00 -1.03 0.00 0.00 54.13 52.42 1x2n s LEU 49 Cb -0.08 -1.62 -0.09 0.00 0.03 0.00 0.00 46.19 44.43 1x2n s LEU 49 CO 0.22 0.06 0.77 0.42 0.23 0.00 0.00 176.35 178.04 1x2n s THR 50 N -2.00 4.52 0.26 5.49 -4.23 -1.26 -4.30 115.64 114.11 1x2n s THR 50 Ca 0.28 1.35 0.15 0.00 -1.18 0.00 0.00 61.69 62.28 1x2n s THR 50 Cb -0.08 -3.86 0.25 0.00 1.34 0.00 0.00 72.50 70.16 1x2n s THR 50 CO 0.17 0.15 1.13 0.18 -0.54 0.00 0.00 174.62 175.71 1x2n n LEU 51 N 0.57 0.24 0.23 4.79 7.99 -1.26 0.12 117.00 129.68 1x2n n LEU 51 Ca -0.01 1.19 -0.15 0.00 -0.01 0.00 0.00 56.01 57.03 1x2n n LEU 51 Cb 0.51 -0.58 -0.08 0.00 -0.11 0.00 0.00 43.42 43.17 1x2n n LEU 51 CO 0.43 -1.33 0.58 0.25 -1.51 0.00 0.00 177.39 175.81 1x2n h LEU 52 N 0.00 -0.49 0.34 2.23 5.85 -1.96 -2.15 115.31 119.12 1x2n h LEU 52 Ca 0.60 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 59.24 1x2n h LEU 52 Cb 1.59 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.71 1x2n h LEU 52 CO -0.56 -0.20 -0.52 1.56 -0.34 0.00 0.00 178.44 178.39 1x2n h GLN 53 N -0.80 -0.87 -0.96 1.25 4.20 0.54 0.61 115.11 119.08 1x2n h GLN 53 Ca -0.06 0.06 0.26 0.00 0.06 0.00 0.00 58.65 58.97 1x2n h GLN 53 Cb 0.55 0.20 -0.13 0.00 0.30 0.00 0.00 27.48 28.39 1x2n h GLN 53 CO 0.10 -0.58 0.49 0.28 -0.67 0.00 0.00 178.83 178.45 1x2n h VAL 54 N -0.90 0.42 0.44 -0.54 2.07 -1.35 -1.02 116.25 115.37 1x2n h VAL 54 Ca -0.04 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 1x2n h VAL 54 Cb 0.83 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1x2n h VAL 54 CO -0.16 0.08 -0.21 0.78 0.02 0.00 0.00 177.57 178.07 1x2n h ASN 55 N 0.41 -0.50 -0.23 0.57 2.35 -0.65 -2.59 115.58 114.95 1x2n h ASN 55 Ca 0.64 -0.10 0.04 0.00 -0.55 0.00 0.00 56.30 56.33 1x2n h ASN 55 Cb 1.30 0.13 -0.07 0.00 0.05 0.00 0.00 38.32 39.73 1x2n h ASN 55 CO -0.55 -0.15 -0.52 0.78 -1.65 0.00 0.00 177.43 175.34 1x2n h ASN 56 N -0.88 -1.70 -0.51 5.81 2.35 0.30 -0.36 115.58 120.59 1x2n h ASN 56 Ca -0.06 0.21 0.09 0.00 -0.55 0.00 0.00 56.30 55.99 1x2n h ASN 56 Cb 0.57 0.67 -0.10 0.00 0.05 0.00 0.00 38.32 39.51 1x2n h ASN 56 CO 0.10 -0.43 -0.37 -0.25 -1.65 0.00 0.00 177.43 174.83 1x2n h TRP 57 N -0.49 -1.05 -0.03 1.19 7.01 -1.32 -1.71 115.95 119.56 1x2n h TRP 57 Ca 0.05 0.07 0.03 0.00 2.11 0.00 0.00 58.89 61.14 1x2n h TRP 57 Cb 0.61 0.54 -0.06 0.00 -2.10 0.00 0.00 29.16 28.15 1x2n h TRP 57 CO -0.64 -0.40 -0.49 0.74 -2.79 0.00 0.00 178.44 174.86 1x2n h PHE 58 N -0.23 -1.42 -1.21 2.65 0.04 -0.95 0.22 116.94 116.03 1x2n h PHE 58 Ca 0.19 0.05 0.36 0.00 2.80 0.00 0.00 57.97 61.36 1x2n h PHE 58 Cb 0.56 0.63 -0.10 0.00 2.20 0.00 0.00 35.95 39.24 1x2n h PHE 58 CO -0.63 -0.54 0.81 0.82 -0.60 0.00 0.00 178.31 178.17 1x2n h ILE 59 N -0.62 0.33 0.14 -0.55 2.04 -0.29 0.50 117.51 119.07 1x2n h ILE 59 Ca 0.03 -0.07 -0.30 0.00 1.00 0.00 0.00 64.86 65.53 1x2n h ILE 59 Cb 0.69 0.12 0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1x2n h ILE 59 CO -0.36 0.04 -1.27 0.78 0.00 0.00 0.00 178.15 177.33 1x2n h ASN 60 N 0.19 0.77 0.19 1.72 2.35 -0.12 -2.88 115.58 117.81 1x2n h ASN 60 Ca 0.69 -0.74 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1x2n h ASN 60 Cb 2.14 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 40.26 1x2n h ASN 60 CO -0.27 1.56 -0.10 0.00 -1.65 0.00 0.00 177.43 176.97 1x2n h ALA 61 N 0.35 1.52 0.08 -0.83 0.00 0.30 0.23 119.26 120.90 1x2n h ALA 61 Ca -0.19 -0.09 -0.28 0.00 0.00 0.00 0.00 54.91 54.36 1x2n h ALA 61 Cb 1.95 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.71 1x2n h ALA 61 CO 0.24 0.12 -1.38 0.00 0.00 0.00 0.00 179.25 178.22 1x2n h ARG 62 N 0.00 0.16 0.00 0.00 3.08 -1.16 -2.87 114.38 113.59 1x2n h ARG 62 Ca -0.00 -0.27 -0.12 0.00 0.07 0.00 0.00 59.98 59.65 1x2n h ARG 62 Cb 0.22 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1x2n h ARG 62 CO 0.01 1.02 -0.66 0.00 -1.07 0.00 0.00 179.97 179.27 1x2n h ARG 63 N 0.04 0.00 0.00 0.04 3.08 -1.18 -2.77 114.38 113.60 1x2n h ARG 63 Ca -0.17 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.73 1x2n h ARG 63 Cb 1.95 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.98 1x2n h ARG 63 CO 0.15 0.54 -0.83 0.07 -1.07 0.00 0.00 179.97 178.83 1x2n h ARG 64 N 0.00 0.00 0.16 0.04 -0.00 -0.67 -2.43 114.38 111.48 1x2n h ARG 64 Ca -0.02 0.00 -0.22 0.00 -0.00 0.00 0.00 59.98 59.74 1x2n h ARG 64 Cb 1.45 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 31.45 1x2n h ARG 64 CO 0.07 0.57 -0.99 -0.84 -0.00 0.00 0.00 179.97 178.78 1x2n h ILE 65 N 0.00 1.43 -0.17 0.08 3.07 -1.54 -3.36 117.51 117.01 1x2n h ILE 65 Ca -0.05 -2.56 -0.11 0.00 1.55 0.00 0.00 64.86 63.70 1x2n h ILE 65 Cb 1.53 3.13 0.00 0.00 -0.27 0.00 0.00 36.82 41.21 1x2n h ILE 65 CO 0.08 0.73 -0.31 -0.07 -1.05 0.00 0.00 178.15 177.53 1x2n h LEU 66 N -0.27 0.57 -8.54 0.16 4.07 -1.61 -3.41 115.31 106.28 1x2n h LEU 66 Ca -0.18 -0.54 -0.70 0.00 0.08 0.00 0.00 57.88 56.54 1x2n h LEU 66 Cb 1.75 -0.16 -0.21 0.00 1.08 0.00 0.00 40.66 43.11 1x2n h LEU 66 CO 0.17 1.01 -0.48 -1.58 -1.08 0.00 0.00 178.44 176.47 1x2n s GLN 67 N -4.07 3.14 -0.23 1.13 0.74 -0.91 -5.06 119.66 114.39 1x2n s GLN 67 Ca -0.13 -0.88 -0.09 0.00 0.05 0.00 0.00 55.36 54.30 1x2n s GLN 67 Cb 0.06 -3.82 -0.04 0.00 1.10 0.00 0.00 33.01 30.31 1x2n s GLN 67 CO 0.80 -0.60 0.13 -1.12 -0.55 0.00 0.00 175.29 173.94 1x2n s SER 68 N 1.66 5.84 0.00 6.67 0.01 -1.26 -4.49 113.70 122.13 1x2n s SER 68 Ca 0.05 0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.35 1x2n s SER 68 Cb -0.18 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.00 1x2n s SER 68 CO 0.09 0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.41 1x2n n GLY 69 N 4.29 -1.89 0.00 3.44 0.00 -1.26 -4.94 105.19 104.83 1x2n n GLY 69 Ca -0.15 0.53 0.07 0.00 0.00 0.00 0.00 46.02 46.47 1x2n n GLY 69 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x2n n PRO 70 N -1.55 0.02 -3.75 1.61 -0.04 -1.26 -4.44 135.00 125.60 1x2n n PRO 70 Ca 0.00 0.24 -0.28 0.00 -0.04 0.00 0.00 63.50 63.43 1x2n n PRO 70 Cb 0.00 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 31.80 1x2n n PRO 70 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x2n s SER 71 N -2.95 2.98 -0.28 3.54 0.15 -1.26 -5.09 113.70 110.79 1x2n s SER 71 Ca 0.08 -0.85 -0.30 0.00 0.70 0.00 0.00 55.95 55.58 1x2n s SER 71 Cb 0.09 -0.63 -0.07 0.00 -1.71 0.00 0.00 66.02 63.70 1x2n s SER 71 CO 0.25 -0.30 2.24 -1.54 1.20 0.00 0.00 173.24 175.09 1x2n n SER 72 N 5.03 2.90 0.00 5.45 3.41 -1.26 -4.88 113.62 124.26 1x2n n SER 72 Ca -0.09 0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1x2n n SER 72 Cb 0.47 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 62.93 1x2n n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49