#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2n n SER 2 N 0.00 -5.22 -3.85 1.61 2.88 -1.26 -5.00 113.62 102.78 1x2n n SER 2 Ca 0.00 -0.59 -0.12 0.00 -1.33 0.00 0.00 58.87 56.83 1x2n n SER 2 Cb 0.00 -4.88 -0.13 0.00 -0.75 0.00 0.00 64.21 58.45 1x2n n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x2n s SER 3 N -3.55 -0.06 -0.23 -3.46 0.01 -1.26 -5.05 113.70 100.11 1x2n s SER 3 Ca 0.47 0.11 0.08 0.00 1.31 0.00 0.00 55.95 57.91 1x2n s SER 3 Cb -0.21 0.19 0.25 0.00 0.21 0.00 0.00 66.02 66.46 1x2n s SER 3 CO 0.75 -0.09 1.14 0.61 0.41 0.00 0.00 173.24 176.06 1x2n n GLY 4 N 2.77 0.78 3.69 3.44 0.00 -1.26 -5.13 105.19 109.49 1x2n n GLY 4 Ca -0.14 -0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 1x2n n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x2n s SER 5 N -0.69 6.83 -0.21 1.61 0.01 -1.26 -4.96 113.70 115.03 1x2n s SER 5 Ca 0.06 1.00 -0.17 0.00 1.31 0.00 0.00 55.95 58.15 1x2n s SER 5 Cb 0.27 -2.37 -0.19 0.00 0.21 0.00 0.00 66.02 63.94 1x2n s SER 5 CO -0.08 -0.18 0.12 -1.20 0.41 0.00 0.00 173.24 172.32 1x2n n SER 6 N 4.34 1.92 -2.06 2.44 7.64 -1.26 -5.05 113.62 121.60 1x2n n SER 6 Ca -0.02 0.35 -0.04 0.00 1.01 0.00 0.00 58.87 60.18 1x2n n SER 6 Cb 0.51 -0.91 0.02 0.00 -1.01 0.00 0.00 64.21 62.82 1x2n n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x2n n GLY 7 N 1.52 0.09 3.14 0.23 0.00 -1.26 -5.03 105.19 103.88 1x2n n GLY 7 Ca -0.37 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.29 1x2n n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x2n s LYS 8 N -3.37 2.09 -0.12 1.61 2.20 -1.26 -5.06 119.74 115.84 1x2n s LYS 8 Ca 0.12 -1.82 -0.14 0.00 -0.36 0.00 0.00 55.97 53.77 1x2n s LYS 8 Cb -0.02 -3.65 0.04 0.00 -1.51 0.00 0.00 37.83 32.69 1x2n s LYS 8 CO 0.24 -1.10 0.38 1.21 -0.36 0.00 0.00 175.35 175.73 1x2n s ASN 9 N 1.98 -0.38 -0.11 1.43 3.84 -1.26 -5.08 114.94 115.36 1x2n s ASN 9 Ca 0.08 0.67 -0.13 0.00 0.21 0.00 0.00 52.86 53.68 1x2n s ASN 9 Cb -0.23 0.71 -0.04 0.00 -0.55 0.00 0.00 41.25 41.13 1x2n s ASN 9 CO -0.04 -0.20 -0.26 0.29 -2.79 0.00 0.00 177.10 174.11 1x2n n LYS 10 N 2.57 0.39 -1.70 0.43 4.01 -1.26 -4.96 118.16 117.64 1x2n n LYS 10 Ca -0.15 0.16 -0.55 0.00 -0.51 0.00 0.00 58.31 57.26 1x2n n LYS 10 Cb 0.57 -1.19 -0.07 0.00 -0.51 0.00 0.00 35.03 33.84 1x2n n LYS 10 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1x2n n ARG 11 N -4.18 1.38 -2.65 1.97 3.00 -1.26 -4.82 116.66 110.10 1x2n n ARG 11 Ca -0.10 0.51 -0.03 0.00 -0.00 0.00 0.00 57.85 58.22 1x2n n ARG 11 Cb 0.39 -2.23 0.10 0.00 0.00 0.00 0.00 32.46 30.71 1x2n n ARG 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1x2n n GLY 12 N 4.30 -1.94 3.75 5.14 0.00 -1.26 -5.15 105.19 110.03 1x2n n GLY 12 Ca 0.26 1.08 -0.36 0.00 0.00 0.00 0.00 46.02 47.00 1x2n n GLY 12 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1x2n s VAL 13 N 0.01 4.94 0.06 1.61 -7.23 -1.26 -5.11 120.40 113.42 1x2n s VAL 13 Ca 0.23 0.00 0.02 0.00 -1.81 0.00 0.00 61.98 60.42 1x2n s VAL 13 Cb 0.24 -3.15 -0.03 0.00 0.56 0.00 0.00 36.38 34.00 1x2n s VAL 13 CO -0.13 0.57 -0.07 -0.76 -0.31 0.00 0.00 175.10 174.41 1x2n s LEU 14 N -0.63 2.33 0.63 1.32 1.43 -1.26 -5.15 118.68 117.35 1x2n s LEU 14 Ca 0.12 -0.68 -0.16 0.00 -1.03 0.00 0.00 54.13 52.37 1x2n s LEU 14 Cb -0.12 -0.13 -0.01 0.00 0.03 0.00 0.00 46.19 45.96 1x2n s LEU 14 CO 0.02 -0.29 1.11 -2.16 0.23 0.00 0.00 176.35 175.27 1x2n s PRO 15 N -2.24 2.93 0.29 1.29 0.04 -1.26 -4.85 135.00 131.20 1x2n s PRO 15 Ca -0.04 1.44 0.02 0.00 0.04 0.00 0.00 61.00 62.46 1x2n s PRO 15 Cb -0.05 -1.96 0.56 0.00 0.04 0.00 0.00 34.50 33.08 1x2n s PRO 15 CO -0.01 -1.16 1.86 -0.22 0.04 0.00 0.00 177.00 177.51 1x2n h LYS 16 N 0.29 0.96 -0.71 4.56 1.63 -2.01 -1.25 116.57 120.05 1x2n h LYS 16 Ca -0.47 -0.06 0.10 0.00 -0.85 0.00 0.00 60.65 59.37 1x2n h LYS 16 Cb 1.25 -0.22 -0.07 0.00 -0.60 0.00 0.00 32.23 32.59 1x2n h LYS 16 CO 0.55 0.64 0.34 1.25 -3.45 0.00 0.00 179.45 178.77 1x2n h HIS 17 N 0.99 0.60 -0.21 1.91 2.76 -1.98 0.31 115.15 119.52 1x2n h HIS 17 Ca 0.47 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.58 1x2n h HIS 17 Cb 0.43 -0.16 -0.00 0.00 1.55 0.00 0.00 27.41 29.23 1x2n h HIS 17 CO -0.00 0.19 -0.23 0.00 -1.30 0.00 0.00 177.93 176.59 1x2n h ALA 18 N 1.44 0.32 0.00 5.26 0.00 -1.54 -3.07 119.26 121.67 1x2n h ALA 18 Ca 0.36 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1x2n h ALA 18 Cb 0.41 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1x2n h ALA 18 CO -0.29 0.28 -0.18 1.79 0.00 0.00 0.00 179.25 180.85 1x2n h THR 19 N 0.22 1.12 0.68 0.00 1.35 -0.67 -2.95 112.91 112.66 1x2n h THR 19 Ca 0.03 -0.63 -0.03 0.00 -0.55 0.00 0.00 66.41 65.23 1x2n h THR 19 Cb 0.79 1.34 -0.00 0.00 -1.73 0.00 0.00 68.15 68.55 1x2n h THR 19 CO 0.06 0.18 -0.41 0.78 -0.25 0.00 0.00 175.52 175.88 1x2n h ASN 20 N 0.00 -1.02 0.21 5.36 2.35 -0.31 0.17 115.58 122.34 1x2n h ASN 20 Ca -0.00 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1x2n h ASN 20 Cb 0.32 0.29 -0.04 0.00 0.05 0.00 0.00 38.32 38.95 1x2n h ASN 20 CO 0.02 -0.63 -0.49 0.58 -1.65 0.00 0.00 177.43 175.26 1x2n h VAL 21 N -1.02 0.00 -0.83 2.81 2.07 -1.56 0.87 116.25 118.60 1x2n h VAL 21 Ca -0.09 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.61 1x2n h VAL 21 Cb 0.81 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.47 1x2n h VAL 21 CO 0.10 0.00 0.33 0.24 0.02 0.00 0.00 177.57 178.26 1x2n h MET 22 N -0.77 0.40 0.86 1.57 2.86 -1.55 -1.32 114.93 116.99 1x2n h MET 22 Ca -0.02 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1x2n h MET 22 Cb 0.74 -0.09 0.01 0.00 0.06 0.00 0.00 31.60 32.32 1x2n h MET 22 CO -0.21 0.27 -0.42 0.00 1.06 0.00 0.00 176.91 177.61 1x2n h ARG 23 N 0.41 -1.12 -0.46 1.72 3.08 0.10 -0.76 114.38 117.35 1x2n h ARG 23 Ca 0.48 0.08 0.08 0.00 0.07 0.00 0.00 59.98 60.69 1x2n h ARG 23 Cb 0.83 0.25 -0.10 0.00 0.08 0.00 0.00 29.97 31.04 1x2n h ARG 23 CO -0.48 -0.74 -0.36 1.03 -1.07 0.00 0.00 179.97 178.35 1x2n h SER 24 N -1.18 -1.22 0.22 7.04 0.87 -0.17 0.15 113.55 119.26 1x2n h SER 24 Ca -0.12 0.21 0.01 0.00 -1.23 0.00 0.00 61.79 60.66 1x2n h SER 24 Cb 0.89 0.57 -0.03 0.00 -0.44 0.00 0.00 62.40 63.39 1x2n h SER 24 CO 0.20 -0.33 -0.38 -0.25 -0.53 0.00 0.00 176.83 175.54 1x2n h TRP 25 N -0.25 -1.04 -0.66 2.24 7.01 -1.23 0.12 115.95 122.15 1x2n h TRP 25 Ca 0.18 0.02 0.14 0.00 2.11 0.00 0.00 58.89 61.34 1x2n h TRP 25 Cb 0.56 0.43 -0.12 0.00 -2.10 0.00 0.00 29.16 27.92 1x2n h TRP 25 CO -0.60 -0.50 -0.10 1.25 -2.79 0.00 0.00 178.44 175.71 1x2n h LEU 26 N -0.68 -0.49 -0.62 0.65 5.85 -0.39 0.84 115.31 120.47 1x2n h LEU 26 Ca 0.00 0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1x2n h LEU 26 Cb 0.66 0.36 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 1x2n h LEU 26 CO -0.16 -0.19 0.38 -0.26 -0.34 0.00 0.00 178.44 177.87 1x2n h PHE 27 N 0.04 0.82 -0.35 1.25 0.04 -0.53 0.48 116.94 118.69 1x2n h PHE 27 Ca 0.33 0.00 0.05 0.00 2.80 0.00 0.00 57.97 61.15 1x2n h PHE 27 Cb 0.53 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 1x2n h PHE 27 CO -0.47 0.55 0.24 1.96 -0.60 0.00 0.00 178.31 179.99 1x2n h GLN 28 N 0.85 0.26 -0.20 1.51 1.08 0.12 -2.04 115.11 116.69 1x2n h GLN 28 Ca 0.22 -0.02 -0.14 0.00 -1.45 0.00 0.00 58.65 57.27 1x2n h GLN 28 Cb -0.03 -0.06 -0.10 0.00 -0.05 0.00 0.00 27.48 27.24 1x2n h GLN 28 CO -0.04 0.17 -0.51 0.72 -0.95 0.00 0.00 178.83 178.22 1x2n n HIS 29 N -4.48 0.70 -0.31 2.96 8.25 -0.43 -4.82 115.22 117.08 1x2n n HIS 29 Ca 0.04 -1.67 0.15 0.00 -0.26 0.00 0.00 57.72 55.98 1x2n n HIS 29 Cb 0.22 -0.30 0.32 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 1.24 0.18 -0.54 1.59 6.09 0.69 0.31 117.51 127.07 1x2n h ILE 30 Ca 0.10 -0.04 0.07 0.00 -1.37 0.00 0.00 64.86 63.63 1x2n h ILE 30 Cb 1.17 0.06 -0.06 0.00 0.47 0.00 0.00 36.82 38.46 1x2n h ILE 30 CO 0.21 0.02 0.21 1.23 -3.07 0.00 0.00 178.15 176.75 1x2n h GLY 31 N 0.11 0.74 -6.66 8.18 0.00 -1.85 -3.33 103.07 100.26 1x2n h GLY 31 Ca 0.60 -0.12 -0.60 0.00 0.00 0.00 0.00 47.33 47.21 1x2n h GLY 31 CO -0.76 0.02 -0.83 -1.58 0.00 0.00 0.00 176.54 173.39 1x2n s HIS 32 N -6.12 1.86 -1.18 5.60 5.65 0.10 -5.05 115.29 116.15 1x2n s HIS 32 Ca -0.13 -2.57 -0.23 0.00 0.25 0.00 0.00 55.06 52.39 1x2n s HIS 32 Cb 0.15 -1.54 -0.09 0.00 -1.18 0.00 0.00 32.58 29.93 1x2n s HIS 32 CO 0.74 -0.74 1.93 -0.35 -0.65 0.00 0.00 174.74 175.67 1x2n n PRO 33 N 2.78 1.60 -3.66 2.88 -0.04 -0.75 -4.85 135.00 132.97 1x2n n PRO 33 Ca 0.23 -2.46 -0.27 0.00 -0.04 0.00 0.00 63.50 60.95 1x2n n PRO 33 Cb 0.42 -3.72 -0.16 0.00 -0.04 0.00 0.00 33.50 29.99 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 10.99 0.67 0.27 0.54 1.51 -1.26 -5.01 117.35 125.06 1x2n s TYR 34 Ca 0.68 -0.73 -0.29 0.00 -1.01 0.00 0.00 57.07 55.72 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 1.25 -1.25 -1.11 0.00 0.00 175.55 173.95 1x2n s PRO 35 N 1.98 4.44 0.14 -1.71 0.04 -1.26 -5.02 135.00 133.60 1x2n s PRO 35 Ca 0.02 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 62.96 1x2n s PRO 35 Cb -0.17 -3.14 -0.07 0.00 0.04 0.00 0.00 34.50 31.16 1x2n s PRO 35 CO -0.14 -0.10 0.56 0.95 0.04 0.00 0.00 177.00 178.31 1x2n s THR 36 N -0.73 4.83 0.30 1.26 -4.23 -1.26 -4.86 115.64 110.95 1x2n s THR 36 Ca 0.50 0.91 0.22 0.00 -1.18 0.00 0.00 61.69 62.14 1x2n s THR 36 Cb -0.37 -3.76 0.34 0.00 1.34 0.00 0.00 72.50 70.05 1x2n s THR 36 CO 0.45 0.29 1.10 -0.62 -0.54 0.00 0.00 174.62 175.30 1x2n n GLU 37 N 0.95 -0.03 -0.03 3.99 -0.58 -1.26 0.23 120.64 123.91 1x2n n GLU 37 Ca -0.06 0.90 -0.14 0.00 -0.42 0.00 0.00 57.16 57.43 1x2n n GLU 37 Cb 0.52 -1.74 -0.11 0.00 -0.57 0.00 0.00 31.44 29.54 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 0.19 -0.48 1.62 5.19 -2.00 -3.15 116.42 117.79 1x2n h ASP 38 Ca 0.62 -0.70 0.10 0.00 -0.62 0.00 0.00 57.03 56.42 1x2n h ASP 38 Cb 1.93 -0.06 -0.08 0.00 0.18 0.00 0.00 39.33 41.30 1x2n h ASP 38 CO -0.36 0.86 -0.04 -0.33 -3.12 0.00 0.00 179.24 176.25 1x2n h GLU 39 N -0.47 0.07 -0.39 3.56 4.39 0.24 0.29 114.58 122.27 1x2n h GLU 39 Ca -0.02 -0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.75 1x2n h GLU 39 Cb 0.87 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.48 1x2n h GLU 39 CO 0.04 0.05 0.27 0.87 -1.16 0.00 0.00 179.01 179.07 1x2n h LYS 40 N 0.07 0.22 0.07 2.33 1.57 -1.41 0.38 116.57 119.81 1x2n h LYS 40 Ca 0.24 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1x2n h LYS 40 Cb 0.37 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1x2n h LYS 40 CO -0.44 0.15 -0.03 0.87 -0.57 0.00 0.00 179.45 179.42 1x2n h LYS 41 N 0.23 -0.09 0.54 3.15 1.57 -0.70 -2.82 116.57 118.45 1x2n h LYS 41 Ca 0.18 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.94 1x2n h LYS 41 Cb 0.41 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 1x2n h LYS 41 CO -0.03 0.24 -0.30 1.96 -0.57 0.00 0.00 179.45 180.75 1x2n h GLN 42 N -0.99 -0.76 -0.22 3.15 1.08 -0.36 -3.09 115.11 113.91 1x2n h GLN 42 Ca -0.01 0.05 0.06 0.00 -1.45 0.00 0.00 58.65 57.30 1x2n h GLN 42 Cb 0.38 0.17 -0.07 0.00 -0.05 0.00 0.00 27.48 27.91 1x2n h GLN 42 CO 0.02 -0.51 -0.32 0.82 -0.95 0.00 0.00 178.83 177.89 1x2n h ILE 43 N -0.79 0.28 -1.06 2.54 2.04 -0.42 -0.46 117.51 119.64 1x2n h ILE 43 Ca -0.07 0.00 0.41 0.00 1.00 0.00 0.00 64.86 66.20 1x2n h ILE 43 Cb 0.63 0.28 -0.16 0.00 -0.74 0.00 0.00 36.82 36.83 1x2n h ILE 43 CO 0.09 0.00 0.61 0.00 0.00 0.00 0.00 178.15 178.85 1x2n n ALA 44 N -2.88 1.07 0.12 1.87 0.00 -1.07 -0.04 120.51 119.59 1x2n n ALA 44 Ca -0.02 0.91 -0.06 0.00 0.00 0.00 0.00 53.44 54.28 1x2n n ALA 44 Cb 0.33 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.78 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 1.75 -0.52 -1.08 0.00 0.00 -1.04 1.75 119.26 120.12 1x2n h ALA 45 Ca 0.81 -0.08 0.30 0.00 0.00 0.00 0.00 54.91 55.94 1x2n h ALA 45 Cb 2.29 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 20.16 1x2n h ALA 45 CO -0.63 -0.49 0.75 1.96 0.00 0.00 0.00 179.25 180.84 1x2n h GLN 46 N -0.72 0.11 0.00 0.00 4.20 -0.72 0.65 115.11 118.63 1x2n h GLN 46 Ca -0.04 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1x2n h GLN 46 Cb 0.28 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1x2n h GLN 46 CO 0.06 0.07 -1.16 0.25 -0.67 0.00 0.00 178.83 177.38 1x2n n THR 47 N -4.32 0.01 -2.42 -0.54 -2.24 0.95 -4.83 114.28 100.88 1x2n n THR 47 Ca 0.24 -0.11 -0.17 0.00 -2.27 0.00 0.00 64.05 61.74 1x2n n THR 47 Cb 1.07 0.73 -0.00 0.00 -2.10 0.00 0.00 70.33 70.03 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 -1.67 -5.09 -4.69 3.42 5.15 0.50 -4.69 115.26 108.19 1x2n n ASN 48 Ca 0.02 -0.06 -0.24 0.00 -0.60 0.00 0.00 54.58 53.71 1x2n n ASN 48 Cb 0.38 -4.14 -0.07 0.00 -0.53 0.00 0.00 39.78 35.42 1x2n n ASN 48 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1x2n s LEU 49 N -5.04 3.37 0.22 1.20 1.43 0.39 -4.96 118.68 115.29 1x2n s LEU 49 Ca 0.04 -0.48 -0.16 0.00 -1.03 0.00 0.00 54.13 52.50 1x2n s LEU 49 Cb -0.02 -1.93 -0.08 0.00 0.03 0.00 0.00 46.19 44.19 1x2n s LEU 49 CO 0.05 0.02 0.66 0.42 0.23 0.00 0.00 176.35 177.73 1x2n s THR 50 N -2.10 4.71 0.29 5.49 -4.23 -1.26 -4.37 115.64 114.16 1x2n s THR 50 Ca 0.31 1.00 0.17 0.00 -1.18 0.00 0.00 61.69 61.99 1x2n s THR 50 Cb -0.08 -3.75 0.29 0.00 1.34 0.00 0.00 72.50 70.30 1x2n s THR 50 CO 0.21 0.11 1.18 0.18 -0.54 0.00 0.00 174.62 175.75 1x2n n LEU 51 N 0.43 0.24 0.05 4.79 7.99 -1.26 0.17 117.00 129.41 1x2n n LEU 51 Ca -0.02 1.20 -0.13 0.00 -0.01 0.00 0.00 56.01 57.05 1x2n n LEU 51 Cb 0.52 -0.59 -0.09 0.00 -0.11 0.00 0.00 43.42 43.16 1x2n n LEU 51 CO 0.43 -1.33 0.69 0.25 -1.51 0.00 0.00 177.39 175.91 1x2n h LEU 52 N 0.00 -0.09 0.54 2.23 5.85 -1.96 -2.34 115.31 119.55 1x2n h LEU 52 Ca 0.64 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 59.08 1x2n h LEU 52 Cb 1.77 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.82 1x2n h LEU 52 CO -0.53 0.22 -0.37 1.56 -0.34 0.00 0.00 178.44 178.97 1x2n h GLN 53 N -0.40 -0.85 -1.02 1.25 1.08 0.14 0.94 115.11 116.26 1x2n h GLN 53 Ca -0.01 0.06 0.25 0.00 -1.45 0.00 0.00 58.65 57.50 1x2n h GLN 53 Cb 0.34 0.19 -0.12 0.00 -0.05 0.00 0.00 27.48 27.85 1x2n h GLN 53 CO 0.02 -0.57 0.61 0.28 -0.95 0.00 0.00 178.83 178.23 1x2n h VAL 54 N -0.88 0.53 0.32 -0.54 2.07 -1.28 -1.31 116.25 115.17 1x2n h VAL 54 Ca -0.06 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 1x2n h VAL 54 Cb 0.73 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1x2n h VAL 54 CO 0.04 0.10 -0.15 0.78 0.02 0.00 0.00 177.57 178.35 1x2n h ASN 55 N 0.54 -0.36 -0.64 0.57 2.35 -0.92 -2.93 115.58 114.18 1x2n h ASN 55 Ca 0.64 -0.17 0.09 0.00 -0.55 0.00 0.00 56.30 56.31 1x2n h ASN 55 Cb 1.29 0.09 -0.11 0.00 0.05 0.00 0.00 38.32 39.64 1x2n h ASN 55 CO -0.44 0.09 -0.43 0.78 -1.65 0.00 0.00 177.43 175.78 1x2n h ASN 56 N -0.95 -1.51 -0.54 5.81 4.21 0.02 0.24 115.58 122.86 1x2n h ASN 56 Ca -0.04 0.26 0.11 0.00 1.21 0.00 0.00 56.30 57.83 1x2n h ASN 56 Cb 0.51 0.70 -0.09 0.00 -1.12 0.00 0.00 38.32 38.31 1x2n h ASN 56 CO 0.07 -0.32 -0.03 -0.25 -1.29 0.00 0.00 177.43 175.61 1x2n h TRP 57 N -0.19 -0.09 0.21 1.19 7.01 -1.37 -1.48 115.95 121.24 1x2n h TRP 57 Ca 0.20 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.23 1x2n h TRP 57 Cb 0.56 0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.74 1x2n h TRP 57 CO -0.74 -0.15 -0.11 0.74 -2.79 0.00 0.00 178.44 175.39 1x2n h PHE 58 N 0.09 -0.27 -1.02 2.65 0.04 -0.71 0.88 116.94 118.60 1x2n h PHE 58 Ca 0.27 -0.01 0.25 0.00 2.80 0.00 0.00 57.97 61.29 1x2n h PHE 58 Cb 0.42 0.09 -0.09 0.00 2.20 0.00 0.00 35.95 38.57 1x2n h PHE 58 CO -0.35 -0.17 0.65 0.82 -0.60 0.00 0.00 178.31 178.66 1x2n h ILE 59 N -0.29 0.56 0.09 -0.55 2.04 0.10 0.26 117.51 119.72 1x2n h ILE 59 Ca -0.03 -0.15 -0.26 0.00 1.00 0.00 0.00 64.86 65.43 1x2n h ILE 59 Cb 0.23 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1x2n h ILE 59 CO 0.04 0.08 -1.17 -1.13 0.00 0.00 0.00 178.15 175.97 1x2n h ASN 60 N 0.44 0.31 0.23 1.72 -1.24 -0.78 -3.23 115.58 113.02 1x2n h ASN 60 Ca 0.58 -0.33 -0.06 0.00 0.71 0.00 0.00 56.30 57.20 1x2n h ASN 60 Cb 1.40 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 40.34 1x2n h ASN 60 CO -0.30 1.26 -0.27 0.00 -1.29 0.00 0.00 177.43 176.83 1x2n h ALA 61 N 0.70 1.47 0.00 1.57 0.00 0.19 -1.88 119.26 121.30 1x2n h ALA 61 Ca -0.10 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1x2n h ALA 61 Cb 1.91 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.64 1x2n h ALA 61 CO 0.18 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.82 1x2n h ARG 62 N 0.07 0.00 0.00 0.00 3.08 -1.08 -2.83 114.38 113.62 1x2n h ARG 62 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1x2n h ARG 62 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1x2n h ARG 62 CO 0.04 0.00 -0.68 0.54 -1.07 0.00 0.00 179.97 178.79 1x2n n ARG 63 N -2.47 0.08 -0.08 0.04 1.74 -0.74 -3.29 116.66 111.95 1x2n n ARG 63 Ca 0.05 0.01 -0.11 0.00 -0.77 0.00 0.00 57.85 57.02 1x2n n ARG 63 Cb 0.42 -1.53 -0.15 0.00 -1.02 0.00 0.00 32.46 30.18 1x2n n ARG 63 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1x2n n ARG 64 N -1.64 0.67 0.08 5.56 1.85 -1.03 -3.76 116.66 118.39 1x2n n ARG 64 Ca 0.04 0.09 -0.22 0.00 -1.00 0.00 0.00 57.85 56.77 1x2n n ARG 64 Cb 0.36 -1.59 -0.13 0.00 -1.05 0.00 0.00 32.46 30.04 1x2n n ARG 64 CO 0.00 0.00 0.00 -0.84 -0.01 0.00 0.00 177.63 176.78 1x2n h ILE 65 N 0.00 1.33 -0.29 8.89 3.07 -1.65 -3.33 117.51 125.53 1x2n h ILE 65 Ca -0.48 -2.46 -0.03 0.00 1.55 0.00 0.00 64.86 63.44 1x2n h ILE 65 Cb 2.15 2.80 -0.01 0.00 -0.27 0.00 0.00 36.82 41.49 1x2n h ILE 65 CO 0.03 0.74 0.06 -0.07 -1.05 0.00 0.00 178.15 177.86 1x2n h LEU 66 N 0.13 0.45-10.32 0.16 -0.00 -1.76 -3.44 115.31 100.53 1x2n h LEU 66 Ca -0.18 -0.24 -0.50 0.00 -0.00 0.00 0.00 57.88 56.96 1x2n h LEU 66 Cb 1.85 -0.12 0.06 0.00 -0.00 0.00 0.00 40.66 42.45 1x2n h LEU 66 CO 0.22 0.57 0.40 -1.10 -0.00 0.00 0.00 178.44 178.53 1x2n s GLN 67 N -5.26 3.45 -0.16 1.13 -1.52 -1.25 -5.07 119.66 110.98 1x2n s GLN 67 Ca -0.13 0.87 0.01 0.00 -1.95 0.00 0.00 55.36 54.15 1x2n s GLN 67 Cb 0.08 -2.06 0.02 0.00 -0.22 0.00 0.00 33.01 30.84 1x2n s GLN 67 CO 0.74 -0.69 -0.16 -1.12 -0.25 0.00 0.00 175.29 173.82 1x2n s SER 68 N -3.83 2.91 0.36 5.90 0.01 -1.26 -4.86 113.70 112.93 1x2n s SER 68 Ca 0.57 -0.58 0.00 0.00 1.31 0.00 0.00 55.95 57.24 1x2n s SER 68 Cb -0.12 -1.29 0.00 0.00 0.21 0.00 0.00 66.02 64.82 1x2n s SER 68 CO 0.50 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.71 1x2n n GLY 69 N 4.71 -0.53 3.61 3.44 0.00 -1.26 -4.69 105.19 110.47 1x2n n GLY 69 Ca -0.18 -1.11 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 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 3.55 0.21 1.61 0.04 -1.26 -4.90 135.00 134.26 1x2n s PRO 70 Ca 0.00 1.44 -0.11 0.00 0.04 0.00 0.00 61.00 62.37 1x2n s PRO 70 Cb 0.00 -4.11 0.29 0.00 0.04 0.00 0.00 34.50 30.72 1x2n s PRO 70 CO 0.00 -1.59 1.66 0.77 0.04 0.00 0.00 177.00 177.87 1x2n h SER 71 N 11.69 -0.33 -0.89 6.66 0.02 -1.99 -0.64 113.55 128.08 1x2n h SER 71 Ca -0.33 0.16 0.21 0.00 -0.84 0.00 0.00 61.79 60.99 1x2n h SER 71 Cb 1.15 0.29 -0.16 0.00 0.14 0.00 0.00 62.40 63.82 1x2n h SER 71 CO 1.03 -0.13 -0.05 -1.28 -1.14 0.00 0.00 176.83 175.25 1x2n h SER 72 N 0.09 -0.54 0.00 3.07 0.87 -1.98 -3.52 113.55 111.54 1x2n h SER 72 Ca 0.32 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 61.13 1x2n h SER 72 Cb 0.52 0.46 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1x2n h SER 72 CO -0.55 -0.28 0.00 0.61 -0.53 0.00 0.00 176.83 176.08