#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 2.96 0.45 1.61 0.15 -1.26 -5.12 113.70 112.49 1x2n s SER 2 Ca 0.00 -0.68 -0.24 0.00 0.70 0.00 0.00 55.95 55.74 1x2n s SER 2 Cb 0.00 -0.21 -0.08 0.00 -1.71 0.00 0.00 66.02 64.03 1x2n s SER 2 CO 0.00 0.16 1.19 -0.44 1.20 0.00 0.00 173.24 175.34 1x2n s SER 3 N -1.77 6.22 0.66 5.45 0.01 -1.26 -5.03 113.70 117.98 1x2n s SER 3 Ca 0.11 2.36 -0.05 0.00 1.31 0.00 0.00 55.95 59.68 1x2n s SER 3 Cb -0.10 -2.61 0.05 0.00 0.21 0.00 0.00 66.02 63.57 1x2n s SER 3 CO 0.04 -0.89 0.96 -0.83 0.41 0.00 0.00 173.24 172.93 1x2n s GLY 4 N -1.24 1.70 -0.03 3.44 0.00 -1.26 -5.09 107.32 104.84 1x2n s GLY 4 Ca 0.62 -0.96 0.02 0.00 0.00 0.00 0.00 44.72 44.39 1x2n s GLY 4 CO 0.37 -0.59 -0.04 -0.56 0.00 0.00 0.00 173.10 172.28 1x2n s SER 5 N -4.47 4.82 0.21 1.64 0.01 -1.26 -5.02 113.70 109.63 1x2n s SER 5 Ca 0.59 -0.04 -0.19 0.00 1.31 0.00 0.00 55.95 57.62 1x2n s SER 5 Cb -0.11 -1.21 0.19 0.00 0.21 0.00 0.00 66.02 65.10 1x2n s SER 5 CO 0.44 0.32 1.57 0.28 0.41 0.00 0.00 173.24 176.25 1x2n h SER 6 N 4.76 -1.34 0.00 2.44 0.02 -2.05 -3.47 113.55 113.91 1x2n h SER 6 Ca -0.49 0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1x2n h SER 6 Cb 1.17 0.69 0.00 0.00 0.14 0.00 0.00 62.40 64.40 1x2n h SER 6 CO 0.54 -0.29 0.00 0.61 -1.14 0.00 0.00 176.83 176.55 1x2n n GLY 7 N -1.46 2.50 3.99 -3.77 0.00 -1.26 -5.11 105.19 100.08 1x2n n GLY 7 Ca 0.08 -0.69 -0.20 0.00 0.00 0.00 0.00 46.02 45.21 1x2n n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x2n s LYS 8 N -0.94 2.58 -0.23 1.61 -2.85 -1.26 -5.02 119.74 113.63 1x2n s LYS 8 Ca 0.00 -0.98 -0.29 0.00 -1.00 0.00 0.00 55.97 53.71 1x2n s LYS 8 Cb 0.00 -2.57 -0.03 0.00 -2.06 0.00 0.00 37.83 33.16 1x2n s LYS 8 CO 0.00 -0.61 1.82 0.54 0.10 0.00 0.00 175.35 177.20 1x2n s ASN 9 N -4.43 6.05 -0.05 0.03 2.20 -1.26 -4.97 114.94 112.52 1x2n s ASN 9 Ca 0.57 1.66 -0.04 0.00 -0.94 0.00 0.00 52.86 54.11 1x2n s ASN 9 Cb -0.10 -2.53 0.02 0.00 -2.00 0.00 0.00 41.25 36.64 1x2n s ASN 9 CO 0.37 -1.52 0.13 -0.75 -2.94 0.00 0.00 177.10 172.39 1x2n s LYS 10 N 5.29 0.13 0.11 3.55 2.20 -1.26 -5.16 119.74 124.60 1x2n s LYS 10 Ca 0.81 0.21 0.08 0.00 -0.36 0.00 0.00 55.97 56.71 1x2n s LYS 10 Cb -0.27 0.02 -0.04 0.00 -1.51 0.00 0.00 37.83 36.03 1x2n s LYS 10 CO 0.33 -0.05 -0.13 -0.98 -0.36 0.00 0.00 175.35 174.16 1x2n s ARG 11 N 0.28 1.99 0.00 4.03 1.70 -1.26 -5.07 118.95 120.62 1x2n s ARG 11 Ca -0.02 -1.09 0.00 0.00 -0.47 0.00 0.00 55.73 54.15 1x2n s ARG 11 Cb -0.03 -2.23 0.00 0.00 -0.57 0.00 0.00 34.95 32.12 1x2n s ARG 11 CO -0.01 0.50 0.00 0.41 -1.08 0.00 0.00 175.30 175.12 1x2n n GLY 12 N 0.73 -1.39 3.57 3.88 0.00 -1.26 -5.13 105.19 105.58 1x2n n GLY 12 Ca -0.14 0.87 -0.54 0.00 0.00 0.00 0.00 46.02 46.21 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 0.00 0.00 -3.51 1.61 0.24 -1.26 -4.95 118.33 110.47 1x2n n VAL 13 Ca 0.00 -0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.01 1x2n n VAL 13 Cb 0.00 -0.59 -0.04 0.00 -1.47 0.00 0.00 33.84 31.74 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 0.37 4.15 0.60 1.34 1.43 -1.26 -5.08 118.68 120.23 1x2n s LEU 14 Ca 0.86 0.61 -0.17 0.00 -1.03 0.00 0.00 54.13 54.40 1x2n s LEU 14 Cb -1.04 -3.39 -0.03 0.00 0.03 0.00 0.00 46.19 41.75 1x2n s LEU 14 CO 0.50 -0.10 1.12 -2.16 0.23 0.00 0.00 176.35 175.94 1x2n s PRO 15 N -3.29 3.10 0.26 1.29 0.04 -1.26 -4.89 135.00 130.25 1x2n s PRO 15 Ca 0.42 1.50 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 1x2n s PRO 15 Cb -0.11 -1.98 0.51 0.00 0.04 0.00 0.00 34.50 32.96 1x2n s PRO 15 CO 0.28 -1.03 1.77 0.87 0.04 0.00 0.00 177.00 178.93 1x2n h LYS 16 N 0.64 0.65 -0.84 4.56 6.56 -1.99 -0.60 116.57 125.54 1x2n h LYS 16 Ca -0.48 -0.04 0.16 0.00 -1.06 0.00 0.00 60.65 59.22 1x2n h LYS 16 Cb 1.25 -0.15 -0.10 0.00 -0.57 0.00 0.00 32.23 32.67 1x2n h LYS 16 CO 0.56 0.43 0.41 1.25 -2.06 0.00 0.00 179.45 180.04 1x2n h HIS 17 N 0.67 0.71 -0.34 -1.35 -0.00 -1.98 -0.39 115.15 112.47 1x2n h HIS 17 Ca 0.45 0.04 -0.04 0.00 -0.00 0.00 0.00 60.37 60.82 1x2n h HIS 17 Cb 0.60 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 27.81 1x2n h HIS 17 CO -0.08 0.13 0.07 0.00 -0.00 0.00 0.00 177.93 178.05 1x2n h ALA 18 N 1.58 0.45 -0.17 5.26 0.00 -1.39 -2.77 119.26 122.21 1x2n h ALA 18 Ca 0.47 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1x2n h ALA 18 Cb 0.70 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1x2n h ALA 18 CO -0.39 0.13 0.07 1.79 0.00 0.00 0.00 179.25 180.85 1x2n h THR 19 N 0.39 1.07 0.61 0.00 1.35 -0.85 -2.66 112.91 112.82 1x2n h THR 19 Ca 0.10 -0.22 -0.02 0.00 -0.55 0.00 0.00 66.41 65.72 1x2n h THR 19 Cb 0.33 0.87 -0.01 0.00 -1.73 0.00 0.00 68.15 67.61 1x2n h THR 19 CO 0.00 0.08 -0.43 0.78 -0.25 0.00 0.00 175.52 175.71 1x2n h ASN 20 N 0.24 -1.12 0.50 5.36 2.35 -0.83 0.37 115.58 122.45 1x2n h ASN 20 Ca 0.06 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1x2n h ASN 20 Cb 0.05 0.34 -0.02 0.00 0.05 0.00 0.00 38.32 38.74 1x2n h ASN 20 CO -0.01 -0.63 -0.50 0.58 -1.65 0.00 0.00 177.43 175.22 1x2n h VAL 21 N -0.99 0.00 -0.47 2.81 2.07 -1.52 -1.13 116.25 117.03 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 0.81 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.49 1x2n h VAL 21 CO 0.05 0.00 -0.19 0.24 0.02 0.00 0.00 177.57 177.69 1x2n h MET 22 N -0.99 -0.08 0.09 1.57 2.86 -1.50 -1.82 114.93 115.05 1x2n h MET 22 Ca -0.06 0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1x2n h MET 22 Cb 0.86 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.50 1x2n h MET 22 CO -0.06 -0.05 -0.46 0.00 1.06 0.00 0.00 176.91 177.40 1x2n h ARG 23 N -0.08 -0.62 -0.78 1.72 3.08 -0.01 0.19 114.38 117.87 1x2n h ARG 23 Ca 0.22 0.04 0.16 0.00 0.07 0.00 0.00 59.98 60.48 1x2n h ARG 23 Cb 0.43 0.14 -0.14 0.00 0.08 0.00 0.00 29.97 30.48 1x2n h ARG 23 CO -0.52 -0.41 -0.14 1.03 -1.07 0.00 0.00 179.97 178.85 1x2n h SER 24 N -0.64 -0.63 0.66 7.04 0.87 -0.73 0.57 113.55 120.68 1x2n h SER 24 Ca -0.00 0.23 -0.03 0.00 -1.23 0.00 0.00 61.79 60.75 1x2n h SER 24 Cb 0.65 0.45 0.01 0.00 -0.44 0.00 0.00 62.40 63.07 1x2n h SER 24 CO -0.26 -0.24 -0.32 -0.25 -0.53 0.00 0.00 176.83 175.23 1x2n h TRP 25 N 0.02 -0.82 -0.59 2.24 7.01 -0.68 -1.48 115.95 121.65 1x2n h TRP 25 Ca 0.39 -0.02 0.12 0.00 2.11 0.00 0.00 58.89 61.48 1x2n h TRP 25 Cb 0.62 0.27 -0.12 0.00 -2.10 0.00 0.00 29.16 27.84 1x2n h TRP 25 CO -0.57 -0.50 -0.21 1.25 -2.79 0.00 0.00 178.44 175.62 1x2n h LEU 26 N -0.92 -0.76 -0.82 0.65 5.85 0.58 0.12 115.31 120.00 1x2n h LEU 26 Ca -0.09 0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1x2n h LEU 26 Cb 0.69 0.44 -0.06 0.00 0.37 0.00 0.00 40.66 42.11 1x2n h LEU 26 CO 0.15 -0.24 0.51 -0.26 -0.34 0.00 0.00 178.44 178.26 1x2n h PHE 27 N -0.07 0.95 -0.21 1.25 0.04 -0.84 0.61 116.94 118.67 1x2n h PHE 27 Ca 0.27 0.03 0.01 0.00 2.80 0.00 0.00 57.97 61.08 1x2n h PHE 27 Cb 0.49 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.32 1x2n h PHE 27 CO -0.54 0.51 0.14 1.96 -0.60 0.00 0.00 178.31 179.77 1x2n h GLN 28 N 0.96 0.25 -0.25 1.51 1.08 0.29 -2.41 115.11 116.54 1x2n h GLN 28 Ca 0.35 -0.02 -0.19 0.00 -1.45 0.00 0.00 58.65 57.35 1x2n h GLN 28 Cb 0.11 -0.06 -0.15 0.00 -0.05 0.00 0.00 27.48 27.33 1x2n h GLN 28 CO -0.15 0.17 -0.62 0.72 -0.95 0.00 0.00 178.83 178.00 1x2n n HIS 29 N -4.51 0.92 -0.32 2.96 8.25 -0.43 -4.83 115.22 117.26 1x2n n HIS 29 Ca 0.00 -1.73 0.15 0.00 -0.26 0.00 0.00 57.72 55.88 1x2n n HIS 29 Cb 0.09 -0.28 0.31 0.00 1.12 0.00 0.00 29.99 31.23 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 1.49 0.14 -0.47 1.59 6.09 0.70 0.25 117.51 127.32 1x2n h ILE 30 Ca 0.12 -0.03 0.09 0.00 -1.37 0.00 0.00 64.86 63.67 1x2n h ILE 30 Cb 1.19 0.05 -0.07 0.00 0.47 0.00 0.00 36.82 38.46 1x2n h ILE 30 CO 0.25 0.02 0.01 1.23 -3.07 0.00 0.00 178.15 176.59 1x2n h GLY 31 N 0.08 0.48 -6.68 8.18 0.00 -1.86 -3.33 103.07 99.95 1x2n h GLY 31 Ca 0.60 0.05 -0.60 0.00 0.00 0.00 0.00 47.33 47.38 1x2n h GLY 31 CO -0.80 -0.12 -0.83 -1.58 0.00 0.00 0.00 176.54 173.22 1x2n s HIS 32 N -6.17 1.73 -1.17 5.60 2.46 0.84 -5.05 115.29 113.52 1x2n s HIS 32 Ca -0.13 -2.45 -0.23 0.00 0.47 0.00 0.00 55.06 52.72 1x2n s HIS 32 Cb 0.15 -1.49 -0.09 0.00 -0.13 0.00 0.00 32.58 31.02 1x2n s HIS 32 CO 0.72 -0.76 1.93 -0.35 -2.47 0.00 0.00 174.74 173.81 1x2n n PRO 33 N 2.99 1.59 -3.66 2.88 -0.04 -0.83 -4.84 135.00 133.10 1x2n n PRO 33 Ca 0.21 -2.44 -0.27 0.00 -0.04 0.00 0.00 63.50 60.95 1x2n n PRO 33 Cb 0.41 -3.70 -0.16 0.00 -0.04 0.00 0.00 33.50 30.01 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 10.81 0.66 0.27 0.54 1.51 -1.26 -4.92 117.35 124.95 1x2n s TYR 34 Ca 0.68 -0.74 -0.29 0.00 -1.01 0.00 0.00 57.07 55.71 1x2n s TYR 34 Cb 0.00 -0.94 -0.10 0.00 -0.11 0.00 0.00 41.96 40.81 1x2n s TYR 34 CO 0.14 -0.63 1.26 -1.25 -1.11 0.00 0.00 175.55 173.95 1x2n s PRO 35 N 1.98 4.44 0.15 -1.71 0.04 -1.26 -5.02 135.00 133.61 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 -0.07 0.00 0.04 0.00 0.00 34.50 31.16 1x2n s PRO 35 CO -0.15 -0.12 0.54 0.95 0.04 0.00 0.00 177.00 178.26 1x2n s THR 36 N -0.66 4.88 0.31 1.26 -4.23 -1.26 -4.85 115.64 111.10 1x2n s THR 36 Ca 0.51 0.76 0.23 0.00 -1.18 0.00 0.00 61.69 62.01 1x2n s THR 36 Cb -0.37 -3.72 0.35 0.00 1.34 0.00 0.00 72.50 70.11 1x2n s THR 36 CO 0.44 0.22 1.13 -1.84 -0.54 0.00 0.00 174.62 174.04 1x2n n GLU 37 N 0.73 -0.03 -0.03 3.99 0.28 -1.26 0.24 120.64 124.56 1x2n n GLU 37 Ca -0.05 0.92 -0.14 0.00 -0.16 0.00 0.00 57.16 57.73 1x2n n GLU 37 Cb 0.52 -1.79 -0.10 0.00 1.43 0.00 0.00 31.44 31.50 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 0.27 -0.57 -1.84 3.32 -2.00 -3.00 116.42 112.60 1x2n h ASP 38 Ca 0.64 -0.64 0.07 0.00 0.02 0.00 0.00 57.03 57.11 1x2n h ASP 38 Cb 2.01 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 41.42 1x2n h ASP 38 CO -0.36 0.87 0.26 -0.33 -1.72 0.00 0.00 179.24 177.96 1x2n h GLU 39 N -0.30 0.48 -0.48 3.56 4.39 0.27 0.21 114.58 122.70 1x2n h GLU 39 Ca -0.01 -0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.67 1x2n h GLU 39 Cb 0.85 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.37 1x2n h GLU 39 CO 0.04 0.32 0.32 0.87 -1.16 0.00 0.00 179.01 179.40 1x2n h LYS 40 N 0.49 0.60 0.07 2.33 1.57 -1.30 0.42 116.57 120.76 1x2n h LYS 40 Ca 0.27 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1x2n h LYS 40 Cb 0.24 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1x2n h LYS 40 CO -0.22 0.40 -0.03 0.87 -0.57 0.00 0.00 179.45 179.89 1x2n h LYS 41 N 0.62 -0.09 0.51 3.15 1.57 -1.03 -2.65 116.57 118.64 1x2n h LYS 41 Ca 0.18 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 1x2n h LYS 41 Cb -0.01 0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.32 1x2n h LYS 41 CO -0.04 0.46 -0.25 1.96 -0.57 0.00 0.00 179.45 181.01 1x2n h GLN 42 N -0.90 -0.66 -0.05 3.15 1.08 -0.48 -3.17 115.11 114.08 1x2n h GLN 42 Ca -0.01 0.05 0.04 0.00 -1.45 0.00 0.00 58.65 57.27 1x2n h GLN 42 Cb 0.59 0.15 -0.06 0.00 -0.05 0.00 0.00 27.48 28.11 1x2n h GLN 42 CO 0.02 -0.42 -0.38 0.82 -0.95 0.00 0.00 178.83 177.92 1x2n h ILE 43 N -0.74 0.20 -1.09 2.54 2.04 -0.31 -0.79 117.51 119.36 1x2n h ILE 43 Ca -0.07 0.00 0.40 0.00 1.00 0.00 0.00 64.86 66.19 1x2n h ILE 43 Cb 0.55 0.20 -0.13 0.00 -0.74 0.00 0.00 36.82 36.70 1x2n h ILE 43 CO 0.12 0.00 0.67 0.00 0.00 0.00 0.00 178.15 178.94 1x2n n ALA 44 N -2.86 1.09 0.12 1.87 0.00 -1.00 -0.18 120.51 119.55 1x2n n ALA 44 Ca -0.05 0.81 -0.07 0.00 0.00 0.00 0.00 53.44 54.12 1x2n n ALA 44 Cb 0.35 -0.92 -0.04 0.00 0.00 0.00 0.00 19.45 18.85 1x2n n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x2n h ALA 45 N 1.51 -0.38 -0.99 0.00 0.00 -1.13 2.15 119.26 120.43 1x2n h ALA 45 Ca 0.76 -0.12 0.20 0.00 0.00 0.00 0.00 54.91 55.75 1x2n h ALA 45 Cb 2.31 0.15 -0.11 0.00 0.00 0.00 0.00 17.79 20.13 1x2n h ALA 45 CO -0.50 -0.37 0.58 1.96 0.00 0.00 0.00 179.25 180.92 1x2n h GLN 46 N -1.07 0.68 0.00 0.00 1.08 -0.17 0.11 115.11 115.74 1x2n h GLN 46 Ca -0.04 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 1x2n h GLN 46 Cb 0.37 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 1x2n h GLN 46 CO 0.06 0.45 -1.30 0.25 -0.95 0.00 0.00 178.83 177.34 1x2n n THR 47 N -4.82 0.30 -2.15 -0.54 -2.24 0.60 -4.95 114.28 100.49 1x2n n THR 47 Ca 0.24 -0.44 -0.07 0.00 -2.27 0.00 0.00 64.05 61.50 1x2n n THR 47 Cb 0.61 -0.07 -0.00 0.00 -2.10 0.00 0.00 70.33 68.77 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 -2.33 -2.73 -4.82 3.42 2.85 0.64 -4.69 115.26 107.59 1x2n n ASN 48 Ca -0.01 -0.01 -0.23 0.00 -0.11 0.00 0.00 54.58 54.22 1x2n n ASN 48 Cb 0.52 -2.05 -0.05 0.00 1.24 0.00 0.00 39.78 39.45 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 -2.11 3.82 0.18 1.20 1.43 0.36 -4.94 118.68 118.62 1x2n s LEU 49 Ca 0.00 -0.21 -0.18 0.00 -1.03 0.00 0.00 54.13 52.71 1x2n s LEU 49 Cb -0.00 -2.37 -0.08 0.00 0.03 0.00 0.00 46.19 43.77 1x2n s LEU 49 CO 0.00 -0.01 0.66 0.42 0.23 0.00 0.00 176.35 177.65 1x2n s THR 50 N -2.03 4.67 0.27 5.49 -4.23 -1.26 -4.31 115.64 114.24 1x2n s THR 50 Ca 0.32 1.14 0.16 0.00 -1.18 0.00 0.00 61.69 62.13 1x2n s THR 50 Cb -0.08 -3.83 0.26 0.00 1.34 0.00 0.00 72.50 70.19 1x2n s THR 50 CO 0.25 0.25 1.13 0.18 -0.54 0.00 0.00 174.62 175.89 1x2n n LEU 51 N 0.85 0.24 0.04 4.79 7.99 -1.26 0.18 117.00 129.83 1x2n n LEU 51 Ca -0.04 1.18 -0.13 0.00 -0.01 0.00 0.00 56.01 57.01 1x2n n LEU 51 Cb 0.51 -0.57 -0.09 0.00 -0.11 0.00 0.00 43.42 43.16 1x2n n LEU 51 CO 0.43 -1.31 0.70 0.25 -1.51 0.00 0.00 177.39 175.94 1x2n h LEU 52 N 0.00 -0.07 0.57 2.23 5.85 -1.96 -2.28 115.31 119.65 1x2n h LEU 52 Ca 0.61 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 59.05 1x2n h LEU 52 Cb 1.64 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.67 1x2n h LEU 52 CO -0.54 0.23 -0.42 1.56 -0.34 0.00 0.00 178.44 178.93 1x2n h GLN 53 N -0.37 -0.92 -1.01 1.25 4.20 0.16 0.14 115.11 118.56 1x2n h GLN 53 Ca -0.01 0.06 0.25 0.00 0.06 0.00 0.00 58.65 59.01 1x2n h GLN 53 Cb 0.33 0.21 -0.12 0.00 0.30 0.00 0.00 27.48 28.20 1x2n h GLN 53 CO 0.01 -0.61 0.60 0.28 -0.67 0.00 0.00 178.83 178.44 1x2n h VAL 54 N -0.96 0.54 0.49 -0.54 2.07 -1.30 -0.76 116.25 115.79 1x2n h VAL 54 Ca -0.07 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1x2n h VAL 54 Cb 0.80 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1x2n h VAL 54 CO 0.03 0.10 -0.23 0.78 0.02 0.00 0.00 177.57 178.27 1x2n h ASN 55 N 0.57 -0.55 -0.75 0.57 2.35 -0.91 -2.86 115.58 114.00 1x2n h ASN 55 Ca 0.64 -0.01 0.13 0.00 -0.55 0.00 0.00 56.30 56.51 1x2n h ASN 55 Cb 1.24 0.14 -0.14 0.00 0.05 0.00 0.00 38.32 39.62 1x2n h ASN 55 CO -0.46 -0.13 -0.30 0.78 -1.65 0.00 0.00 177.43 175.67 1x2n h ASN 56 N -1.15 -1.09 -0.29 5.81 2.35 -0.09 0.31 115.58 121.44 1x2n h ASN 56 Ca -0.07 0.25 0.07 0.00 -0.55 0.00 0.00 56.30 56.00 1x2n h ASN 56 Cb 0.53 0.59 -0.07 0.00 0.05 0.00 0.00 38.32 39.42 1x2n h ASN 56 CO 0.11 -0.29 -0.17 -0.25 -1.65 0.00 0.00 177.43 175.18 1x2n h TRP 57 N -0.07 -0.42 0.92 1.19 7.01 -1.24 -1.57 115.95 121.76 1x2n h TRP 57 Ca 0.31 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.30 1x2n h TRP 57 Cb 0.57 0.23 0.01 0.00 -2.10 0.00 0.00 29.16 27.87 1x2n h TRP 57 CO -0.69 -0.24 -0.44 0.74 -2.79 0.00 0.00 178.44 175.02 1x2n h PHE 58 N -0.14 -1.14 -1.00 2.65 0.04 -0.69 0.22 116.94 116.89 1x2n h PHE 58 Ca 0.15 -0.03 0.38 0.00 2.80 0.00 0.00 57.97 61.27 1x2n h PHE 58 Cb 0.37 0.38 -0.18 0.00 2.20 0.00 0.00 35.95 38.72 1x2n h PHE 58 CO -0.36 -0.71 0.44 0.82 -0.60 0.00 0.00 178.31 177.91 1x2n h ILE 59 N -1.28 0.05 0.01 -0.55 2.04 -0.29 0.21 117.51 117.70 1x2n h ILE 59 Ca -0.13 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 1x2n h ILE 59 Cb 0.95 -0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1x2n h ILE 59 CO 0.21 0.01 -0.13 -1.13 0.00 0.00 0.00 178.15 177.10 1x2n h ASN 60 N 0.05 0.10 -0.34 1.72 -1.24 -1.05 -3.27 115.58 111.54 1x2n h ASN 60 Ca 0.78 -0.87 0.04 0.00 0.71 0.00 0.00 56.30 56.96 1x2n h ASN 60 Cb 1.97 -0.03 -0.05 0.00 0.73 0.00 0.00 38.32 40.93 1x2n h ASN 60 CO -0.78 0.96 -0.33 0.00 -1.29 0.00 0.00 177.43 175.99 1x2n h ALA 61 N 0.14 -0.49 -0.90 1.57 0.00 0.26 0.11 119.26 119.94 1x2n h ALA 61 Ca -0.02 0.02 0.25 0.00 0.00 0.00 0.00 54.91 55.16 1x2n h ALA 61 Cb 0.99 1.04 -0.14 0.00 0.00 0.00 0.00 17.79 19.67 1x2n h ALA 61 CO 0.03 -0.68 0.29 0.07 0.00 0.00 0.00 179.25 178.96 1x2n h ARG 62 N -0.16 0.22 0.00 0.00 0.11 -1.43 1.12 114.38 114.24 1x2n h ARG 62 Ca 0.06 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 60.10 1x2n h ARG 62 Cb 0.31 -0.05 -0.00 0.00 1.11 0.00 0.00 29.97 31.33 1x2n h ARG 62 CO -0.41 0.15 -0.13 0.00 0.10 0.00 0.00 179.97 179.68 1x2n h ARG 63 N 0.23 0.00 -0.14 0.08 3.08 -0.91 -1.04 114.38 115.68 1x2n h ARG 63 Ca 0.58 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.56 1x2n h ARG 63 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 1x2n h ARG 63 CO -0.65 0.13 -0.19 0.00 -1.07 0.00 0.00 179.97 178.19 1x2n h ARG 64 N 0.00 0.37 -0.50 0.04 2.47 0.29 -0.27 114.38 116.78 1x2n h ARG 64 Ca -0.00 -0.22 -0.11 0.00 -1.26 0.00 0.00 59.98 58.39 1x2n h ARG 64 Cb 0.23 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.56 1x2n h ARG 64 CO 0.02 0.79 -0.11 -0.84 0.56 0.00 0.00 179.97 180.39 1x2n h ILE 65 N -0.02 1.27 -0.16 2.04 3.07 -1.04 -3.18 117.51 119.49 1x2n h ILE 65 Ca 0.01 -1.25 -0.04 0.00 1.55 0.00 0.00 64.86 65.14 1x2n h ILE 65 Cb 0.75 1.03 -0.00 0.00 -0.27 0.00 0.00 36.82 38.33 1x2n h ILE 65 CO 0.04 0.44 -0.06 -0.07 -1.05 0.00 0.00 178.15 177.45 1x2n h LEU 66 N 0.82 0.33 -9.26 0.16 -0.00 -1.23 -3.44 115.31 102.69 1x2n h LEU 66 Ca 0.13 -0.39 -0.68 0.00 -0.00 0.00 0.00 57.88 56.94 1x2n h LEU 66 Cb 0.67 -0.09 0.05 0.00 -0.00 0.00 0.00 40.66 41.29 1x2n h LEU 66 CO 0.05 0.64 0.47 1.67 -0.00 0.00 0.00 178.44 181.27 1x2n n GLN 67 N -4.66 1.13 -4.01 1.13 7.27 -0.11 -4.96 117.38 113.17 1x2n n GLN 67 Ca -0.05 0.41 -0.10 0.00 0.07 0.00 0.00 57.00 57.33 1x2n n GLN 67 Cb 0.28 -2.05 -0.07 0.00 2.41 0.00 0.00 30.24 30.81 1x2n n GLN 67 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 1x2n s SER 68 N 0.64 0.04 0.00 1.69 1.04 -1.26 -4.93 113.70 110.92 1x2n s SER 68 Ca 0.85 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 56.31 1x2n s SER 68 Cb -0.96 0.45 0.00 0.00 0.10 0.00 0.00 66.02 65.60 1x2n s SER 68 CO 0.48 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 174.38 1x2n n GLY 69 N -0.25 1.40 0.00 7.32 0.00 -1.26 -4.65 105.19 107.76 1x2n n GLY 69 Ca -0.05 -0.77 0.07 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 0.12 -2.14 1.61 -0.04 -1.26 -4.72 135.00 128.57 1x2n n PRO 70 Ca 0.00 0.19 -0.43 0.00 -0.04 0.00 0.00 63.50 63.22 1x2n n PRO 70 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 1x2n n PRO 70 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x2n s SER 71 N -2.74 6.43 0.00 3.54 0.01 -1.26 -4.75 113.70 114.92 1x2n s SER 71 Ca 0.11 1.61 0.00 0.00 1.31 0.00 0.00 55.95 58.98 1x2n s SER 71 Cb 0.10 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.79 1x2n s SER 71 CO 0.24 -1.22 0.00 -1.54 0.41 0.00 0.00 173.24 171.13 1x2n n SER 72 N 8.28 0.00 0.00 2.44 3.41 -1.26 -5.07 113.62 121.43 1x2n n SER 72 Ca 0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 1x2n n SER 72 Cb 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1x2n n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49