#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1poe h LEU 2 N 0.00 0.00 0.09 -4.53 3.38 -1.74 -1.79 115.31 110.72 1poe h LEU 2 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1poe h LEU 2 Cb 0.00 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.77 1poe h LEU 2 CO 0.00 0.00 -0.70 0.58 0.09 0.00 0.00 178.44 178.42 1poe h VAL 3 N 0.00 1.50 -0.20 1.22 2.07 -1.99 -1.31 116.25 117.53 1poe h VAL 3 Ca -0.00 -2.36 0.00 0.00 0.82 0.00 0.00 66.70 65.16 1poe h VAL 3 Cb 0.03 3.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.79 1poe h VAL 3 CO 0.00 0.67 0.13 0.78 0.02 0.00 0.00 177.57 179.17 1poe h ASN 4 N -0.31 0.22 -0.93 0.57 -0.26 -1.74 -1.37 115.58 111.77 1poe h ASN 4 Ca -0.11 -0.00 0.02 0.00 -0.56 0.00 0.00 56.30 55.64 1poe h ASN 4 Cb 1.49 -0.05 -0.05 0.00 -1.06 0.00 0.00 38.32 38.65 1poe h ASN 4 CO 0.13 0.16 0.61 0.15 -1.06 0.00 0.00 177.43 177.42 1poe h PHE 5 N 0.26 1.15 -0.66 1.19 3.57 -1.43 -1.44 116.94 119.58 1poe h PHE 5 Ca 0.07 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1poe h PHE 5 Cb -0.02 -0.39 -0.03 0.00 2.79 0.00 0.00 35.95 38.30 1poe h PHE 5 CO -0.07 0.71 0.33 1.25 -2.23 0.00 0.00 178.31 178.30 1poe h HIS 6 N 1.23 0.95 -0.67 0.41 2.76 -0.86 -2.14 115.15 116.83 1poe h HIS 6 Ca 0.35 -0.04 -0.08 0.00 -2.20 0.00 0.00 60.37 58.40 1poe h HIS 6 Cb -0.10 -0.30 -0.03 0.00 1.55 0.00 0.00 27.41 28.54 1poe h HIS 6 CO -0.01 0.70 0.09 -0.09 -1.30 0.00 0.00 177.93 177.32 1poe h ARG 7 N 0.92 1.12 0.00 5.26 2.43 -0.48 -2.66 114.38 120.96 1poe h ARG 7 Ca 0.23 -0.31 -0.13 0.00 -0.81 0.00 0.00 59.98 58.96 1poe h ARG 7 Cb 0.10 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1poe h ARG 7 CO -0.03 1.03 -0.61 0.52 -1.51 0.00 0.00 179.97 179.37 1poe h MET 8 N 1.04 0.00 -0.01 0.20 0.00 -1.09 -2.67 114.93 112.40 1poe h MET 8 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 59.70 59.78 1poe h MET 8 Cb 0.47 0.00 -0.02 0.00 0.00 0.00 0.00 31.60 32.05 1poe h MET 8 CO 0.02 0.61 -0.54 0.82 0.00 0.00 0.00 176.91 177.82 1poe h ILE 9 N 0.00 1.39 -0.10 -1.22 2.04 -1.22 -1.71 117.51 116.68 1poe h ILE 9 Ca -0.01 -1.85 -0.21 0.00 1.00 0.00 0.00 64.86 63.80 1poe h ILE 9 Cb 1.22 1.99 0.00 0.00 -0.74 0.00 0.00 36.82 39.29 1poe h ILE 9 CO 0.08 0.53 -0.79 0.50 0.00 0.00 0.00 178.15 178.47 1poe h LYS 10 N 0.02 0.58 0.02 2.37 3.64 -1.40 -1.25 116.57 120.55 1poe h LYS 10 Ca -0.00 -0.50 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1poe h LYS 10 Cb 0.96 0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1poe h LYS 10 CO 0.07 1.12 -0.01 -0.07 -2.27 0.00 0.00 179.45 178.29 1poe h LEU 11 N 0.39 -0.02 0.00 5.20 3.38 -1.25 0.76 115.31 123.76 1poe h LEU 11 Ca -0.05 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 1poe h LEU 11 Cb 1.40 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 42.14 1poe h LEU 11 CO 0.15 -0.02 -0.89 0.71 0.09 0.00 0.00 178.44 178.48 1poe h THR 12 N -0.02 0.72 0.00 0.22 1.35 -1.34 -3.40 112.91 110.43 1poe h THR 12 Ca -0.00 -2.13 0.00 0.00 -0.55 0.00 0.00 66.41 63.73 1poe h THR 12 Cb 0.02 2.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1poe h THR 12 CO 0.00 0.41 -0.01 0.35 -0.25 0.00 0.00 175.52 176.02 1poe n THR 13 N -3.08 0.00 -0.75 6.82 -2.24 -0.47 -4.66 114.28 109.90 1poe n THR 13 Ca -0.03 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1poe n THR 13 Cb 0.78 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 70.00 1poe n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1poe n GLY 14 N 0.70 0.66 3.89 3.38 0.00 0.26 -4.98 105.19 109.10 1poe n GLY 14 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1poe n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1poe s LYS 15 N -0.38 3.68 -0.76 1.61 1.02 -1.26 -4.97 119.74 118.68 1poe s LYS 15 Ca 0.00 0.04 -0.22 0.00 0.02 0.00 0.00 55.97 55.80 1poe s LYS 15 Cb 0.00 -2.77 0.08 0.00 -0.52 0.00 0.00 37.83 34.61 1poe s LYS 15 CO 0.00 0.41 1.08 -2.00 -0.92 0.00 0.00 175.35 173.92 1poe s GLU 16 N -2.73 3.26 0.32 1.68 -6.30 -1.26 -3.90 118.70 109.76 1poe s GLU 16 Ca 0.43 -0.96 0.09 0.00 -2.50 0.00 0.00 54.97 52.03 1poe s GLU 16 Cb -0.12 -4.46 0.89 0.00 0.00 0.00 0.00 34.13 30.45 1poe s GLU 16 CO 0.24 -1.89 1.70 0.00 0.02 0.00 0.00 175.26 175.33 1poe h ALA 17 N 9.51 1.73 -0.34 6.30 0.00 -1.91 -2.11 119.26 132.43 1poe h ALA 17 Ca -0.16 0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1poe h ALA 17 Cb 1.05 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.85 1poe h ALA 17 CO 1.20 -0.36 -0.29 0.00 0.00 0.00 0.00 179.25 179.80 1poe h ALA 18 N 1.76 -0.15 0.00 0.00 0.00 -1.96 -0.60 119.26 118.30 1poe h ALA 18 Ca 0.64 0.10 -0.22 0.00 0.00 0.00 0.00 54.91 55.43 1poe h ALA 18 Cb 1.29 0.63 -0.04 0.00 0.00 0.00 0.00 17.79 19.67 1poe h ALA 18 CO -0.53 -0.70 -1.45 -0.07 0.00 0.00 0.00 179.25 176.51 1poe h LEU 19 N -0.25 0.00 0.10 0.00 3.38 -1.93 -2.69 115.31 113.92 1poe h LEU 19 Ca 0.16 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.84 1poe h LEU 19 Cb 0.51 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.29 1poe h LEU 19 CO -0.49 0.79 -1.22 0.28 0.09 0.00 0.00 178.44 177.89 1poe h SER 20 N 0.00 0.88 0.00 -0.43 0.02 -1.16 -3.40 113.55 109.46 1poe h SER 20 Ca -0.19 -0.80 0.00 0.00 -0.84 0.00 0.00 61.79 59.96 1poe h SER 20 Cb 1.77 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 64.04 1poe h SER 20 CO 0.07 1.60 0.00 -1.22 -1.14 0.00 0.00 176.83 176.14 1poe n TYR 21 N -3.80 0.00 0.27 3.45 4.02 -0.29 -4.58 117.16 116.23 1poe n TYR 21 Ca -0.13 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 57.90 1poe n TYR 21 Cb 0.98 0.00 0.77 0.00 -0.02 0.00 0.00 39.34 41.06 1poe n TYR 21 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1poe h GLY 22 N 0.00 0.00 0.00 2.72 0.00 -1.04 -2.66 103.07 102.08 1poe h GLY 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1poe h GLY 22 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 1poe n PHE 23 N -2.63 0.00 -1.71 5.60 3.01 -1.05 -3.62 117.46 117.05 1poe n PHE 23 Ca -0.02 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.01 1poe n PHE 23 Cb 0.24 0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.72 1poe n PHE 23 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 1poe n TYR 24 N 0.00 2.65 -2.90 1.38 4.19 -0.88 -3.96 117.16 117.65 1poe n TYR 24 Ca 0.00 0.14 0.00 0.00 3.31 0.00 0.00 57.90 61.35 1poe n TYR 24 Cb 0.47 -2.63 0.00 0.00 0.49 0.00 0.00 39.34 37.67 1poe n TYR 24 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1poe n GLY 25 N 3.44 3.16 0.00 2.98 0.00 -0.25 -2.17 105.19 112.35 1poe n GLY 25 Ca 0.15 -0.26 0.06 0.00 0.00 0.00 0.00 46.02 45.98 1poe n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1poe n HIS 27 N -1.43 0.00 -2.90 0.00 8.25 -1.25 -1.85 115.22 116.03 1poe n HIS 27 Ca 0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.06 1poe n HIS 27 Cb 0.24 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.30 1poe n HIS 27 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1poe n GLY 29 N 4.15 1.72 3.65 0.00 0.00 -1.24 -2.52 105.19 110.94 1poe n GLY 29 Ca 0.05 -2.24 -0.44 0.00 0.00 0.00 0.00 46.02 43.39 1poe n GLY 29 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1poe n VAL 30 N -0.98 0.66 -1.21 1.61 3.14 -1.26 -4.63 118.33 115.66 1poe n VAL 30 Ca 0.00 -0.18 0.00 0.00 -2.96 0.00 0.00 64.34 61.20 1poe n VAL 30 Cb 0.00 -2.25 0.00 0.00 -1.06 0.00 0.00 33.84 30.53 1poe n VAL 30 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1poe n GLY 31 N 4.74 -1.80 0.00 7.55 0.00 -1.26 -5.08 105.19 109.35 1poe n GLY 31 Ca 0.22 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1poe n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1poe n GLY 32 N 0.00 2.38 3.16 -0.02 0.00 -1.26 -4.58 105.19 104.87 1poe n GLY 32 Ca 0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1poe n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1poe s ARG 33 N -1.39 0.57 1.39 1.61 0.52 -0.77 -5.00 118.95 115.88 1poe s ARG 33 Ca 0.00 -0.39 0.00 0.00 -0.52 0.00 0.00 55.73 54.82 1poe s ARG 33 Cb 0.00 0.24 0.00 0.00 0.52 0.00 0.00 34.95 35.71 1poe s ARG 33 CO 0.00 -0.15 0.00 0.41 0.02 0.00 0.00 175.30 175.58 1poe n GLY 34 N 1.25 0.38 3.76 -3.53 0.00 -1.26 -4.72 105.19 101.08 1poe n GLY 34 Ca -0.22 -0.76 -0.39 0.00 0.00 0.00 0.00 46.02 44.66 1poe n GLY 34 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1poe s SER 35 N -4.00 7.28 0.25 1.61 0.01 0.19 -4.25 113.70 114.79 1poe s SER 35 Ca 0.00 2.08 -0.30 0.00 1.31 0.00 0.00 55.95 59.04 1poe s SER 35 Cb 0.00 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.52 1poe s SER 35 CO 0.00 -0.12 1.39 -2.16 0.41 0.00 0.00 173.24 172.76 1poe s PRO 36 N -1.67 4.30 0.06 12.44 0.05 -1.26 -4.70 135.00 144.22 1poe s PRO 36 Ca 0.47 2.24 -0.28 0.00 0.05 0.00 0.00 61.00 63.48 1poe s PRO 36 Cb -0.27 -3.12 -0.17 0.00 0.05 0.00 0.00 34.50 30.99 1poe s PRO 36 CO 0.34 -0.35 1.56 0.87 0.05 0.00 0.00 177.00 179.47 1poe h LYS 37 N 4.87 -0.50 0.00 4.56 1.79 -1.95 -3.48 116.57 121.87 1poe h LYS 37 Ca -0.46 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.04 1poe h LYS 37 Cb 1.22 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 1poe h LYS 37 CO 0.76 -0.28 0.00 -0.40 -1.08 0.00 0.00 179.45 178.45 1poe n ASP 38 N -5.28 0.00 0.20 0.86 5.75 -1.26 -5.05 116.55 111.77 1poe n ASP 38 Ca -0.11 -0.77 0.04 0.00 -0.01 0.00 0.00 54.79 53.94 1poe n ASP 38 Cb 0.24 0.00 0.40 0.00 -1.03 0.00 0.00 41.12 40.73 1poe n ASP 38 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1poe h ALA 39 N 1.25 1.38 -0.05 2.12 0.00 -1.95 -2.93 119.26 119.07 1poe h ALA 39 Ca 0.00 -0.30 -0.21 0.00 0.00 0.00 0.00 54.91 54.39 1poe h ALA 39 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1poe h ALA 39 CO 0.00 0.42 -0.85 1.79 0.00 0.00 0.00 179.25 180.61 1poe h THR 40 N 0.00 1.36 -0.00 0.00 1.35 -1.92 -2.61 112.91 111.09 1poe h THR 40 Ca -0.00 -2.25 0.00 0.00 -0.55 0.00 0.00 66.41 63.61 1poe h THR 40 Cb 0.62 2.23 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1poe h THR 40 CO 0.04 0.68 -0.00 -0.90 -0.25 0.00 0.00 175.52 175.09 1poe n ASP 41 N -3.82 0.19 0.10 5.36 5.75 -1.17 -1.63 116.55 121.33 1poe n ASP 41 Ca -0.06 -1.03 -0.05 0.00 -0.01 0.00 0.00 54.79 53.64 1poe n ASP 41 Cb 0.78 -0.01 0.02 0.00 -1.03 0.00 0.00 41.12 40.88 1poe n ASP 41 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1poe h ARG 42 N 0.29 0.04 -0.42 0.11 -0.00 -1.29 -2.02 114.38 111.09 1poe h ARG 42 Ca 0.00 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.98 59.39 1poe h ARG 42 Cb 0.07 0.01 -0.02 0.00 0.00 0.00 0.00 29.97 30.03 1poe h ARG 42 CO 0.00 0.83 0.06 0.00 0.00 0.00 0.00 179.97 180.86 1poe h VAL 45 N 0.20 0.37 -0.40 0.00 3.04 -0.93 0.21 116.25 118.73 1poe h VAL 45 Ca -0.08 0.00 -0.11 0.00 -1.01 0.00 0.00 66.70 65.50 1poe h VAL 45 Cb 1.60 0.37 -0.01 0.00 -2.01 0.00 0.00 31.29 31.23 1poe h VAL 45 CO 0.16 0.00 -0.20 0.74 -1.01 0.00 0.00 177.57 177.26 1poe h THR 46 N -0.63 1.27 -0.47 3.17 2.02 -1.42 -1.43 112.91 115.42 1poe h THR 46 Ca -0.01 -1.31 -0.13 0.00 0.77 0.00 0.00 66.41 65.73 1poe h THR 46 Cb 0.58 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 1poe h THR 46 CO -0.07 0.44 -0.21 -0.74 0.37 0.00 0.00 175.52 175.31 1poe h HIS 47 N 0.69 1.11 -0.23 3.16 6.17 -0.82 -1.11 115.15 124.12 1poe h HIS 47 Ca 0.10 -0.26 -0.01 0.00 0.71 0.00 0.00 60.37 60.90 1poe h HIS 47 Cb 0.71 -0.26 -0.01 0.00 2.52 0.00 0.00 27.41 30.37 1poe h HIS 47 CO 0.04 1.08 0.08 -0.44 0.71 0.00 0.00 177.93 179.40 1poe h ASP 48 N 0.84 0.32 -0.70 3.26 5.19 -0.40 -1.16 116.42 123.76 1poe h ASP 48 Ca 0.11 -0.18 -0.01 0.00 -0.62 0.00 0.00 57.03 56.34 1poe h ASP 48 Cb 0.78 -0.08 -0.03 0.00 0.18 0.00 0.00 39.33 40.18 1poe h ASP 48 CO 0.07 0.41 0.41 0.00 -3.12 0.00 0.00 179.24 177.00 1poe h TYR 51 N 0.89 0.60 -0.56 0.00 -1.99 -0.29 -2.79 116.97 112.84 1poe h TYR 51 Ca 0.38 -0.27 -0.07 0.00 2.00 0.00 0.00 58.73 60.76 1poe h TYR 51 Cb 0.24 -0.09 -0.02 0.00 2.00 0.00 0.00 36.73 38.85 1poe h TYR 51 CO -0.04 1.04 0.06 -0.22 -0.00 0.00 0.00 178.16 178.99 1poe h LYS 52 N 0.30 0.92 -0.15 4.88 3.64 0.08 0.93 116.57 127.17 1poe h LYS 52 Ca -0.04 -0.24 0.02 0.00 -1.27 0.00 0.00 60.65 59.12 1poe h LYS 52 Cb 1.33 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.02 1poe h LYS 52 CO 0.13 0.88 0.02 -0.09 -2.27 0.00 0.00 179.45 178.12 1poe h ARG 53 N 0.86 0.08 -0.45 1.90 2.43 -1.16 -0.25 114.38 117.80 1poe h ARG 53 Ca 0.17 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.26 1poe h ARG 53 Cb 0.43 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1poe h ARG 53 CO 0.01 0.05 -0.00 -0.07 -1.51 0.00 0.00 179.97 178.45 1poe h LEU 54 N 0.08 0.77 -0.14 3.80 4.07 -1.19 -2.50 115.31 120.20 1poe h LEU 54 Ca 0.06 -0.31 0.05 0.00 0.08 0.00 0.00 57.88 57.76 1poe h LEU 54 Cb 0.06 -0.21 -0.06 0.00 1.08 0.00 0.00 40.66 41.53 1poe h LEU 54 CO -0.09 0.90 -0.27 -0.08 -1.08 0.00 0.00 178.44 177.81 1poe h GLU 55 N 0.63 -0.33 -0.29 1.13 4.81 -0.60 -1.65 114.58 118.30 1poe h GLU 55 Ca 0.13 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 1poe h GLU 55 Cb 0.50 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.94 1poe h GLU 55 CO 0.02 -0.22 0.12 0.87 -0.73 0.00 0.00 179.01 179.07 1poe h LYS 56 N -0.34 0.40 0.00 1.92 1.79 -0.97 -2.04 116.57 117.32 1poe h LYS 56 Ca 0.10 -0.04 -0.07 0.00 -2.18 0.00 0.00 60.65 58.46 1poe h LYS 56 Cb 0.49 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 1poe h LYS 56 CO -0.33 0.33 -0.35 -0.09 -1.08 0.00 0.00 179.45 177.93 1poe h ARG 57 N 0.40 0.00 0.00 3.15 2.43 -0.93 -3.47 114.38 115.96 1poe h ARG 57 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1poe h ARG 57 Cb 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1poe h ARG 57 CO -0.01 0.35 0.00 0.41 -1.51 0.00 0.00 179.97 179.21 1poe n GLY 58 N 0.24 1.18 3.86 2.80 0.00 -0.77 -5.10 105.19 107.41 1poe n GLY 58 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1poe n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1poe s GLY 60 N -2.07 1.66 0.00 0.00 0.00 -1.26 -4.08 107.32 101.56 1poe s GLY 60 Ca 0.43 0.05 0.00 0.00 0.00 0.00 0.00 44.72 45.20 1poe s GLY 60 CO 0.20 0.38 0.00 -1.30 0.00 0.00 0.00 173.10 172.39 1poe n THR 61 N -3.21 0.00 0.21 0.90 -2.24 -1.26 -4.66 114.28 104.02 1poe n THR 61 Ca 0.08 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.91 1poe n THR 61 Cb 0.54 -0.37 0.47 0.00 -2.10 0.00 0.00 70.33 68.86 1poe n THR 61 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1poe h LYS 62 N 0.00 0.00 -0.07 -0.78 1.57 -1.96 -3.16 116.57 112.18 1poe h LYS 62 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1poe h LYS 62 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1poe h LYS 62 CO 0.00 0.26 0.00 1.19 -0.57 0.00 0.00 179.45 180.33 1poe n PHE 63 N -4.12 0.09 -3.09 -1.35 3.72 -1.26 -2.34 117.46 109.10 1poe n PHE 63 Ca -0.02 -0.49 -0.41 0.00 -0.05 0.00 0.00 57.45 56.48 1poe n PHE 63 Cb 0.32 -0.04 -0.06 0.00 -0.94 0.00 0.00 39.48 38.75 1poe n PHE 63 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1poe s LEU 64 N -0.98 4.15 0.41 4.37 0.20 -1.19 -4.86 118.68 120.78 1poe s LEU 64 Ca 0.05 0.42 -0.20 0.00 0.69 0.00 0.00 54.13 55.09 1poe s LEU 64 Cb 0.02 -2.84 -0.10 0.00 -0.43 0.00 0.00 46.19 42.84 1poe s LEU 64 CO 0.03 -0.51 0.91 -0.55 -0.29 0.00 0.00 176.35 175.94 1poe s SER 65 N 1.66 6.89 0.13 3.68 0.15 -1.26 0.41 113.70 125.36 1poe s SER 65 Ca 0.26 1.60 -0.12 0.00 0.70 0.00 0.00 55.95 58.39 1poe s SER 65 Cb -0.15 -2.50 0.01 0.00 -1.71 0.00 0.00 66.02 61.67 1poe s SER 65 CO 0.12 -0.34 0.31 -0.72 1.20 0.00 0.00 173.24 173.82 1poe s TYR 66 N -2.16 0.07 -0.04 3.44 -0.85 -1.26 -4.82 117.35 111.73 1poe s TYR 66 Ca 0.60 -0.45 -0.02 0.00 -0.52 0.00 0.00 57.07 56.69 1poe s TYR 66 Cb -0.09 0.09 -0.04 0.00 0.38 0.00 0.00 41.96 42.30 1poe s TYR 66 CO 0.15 -0.67 0.07 0.15 -1.52 0.00 0.00 175.55 173.72 1poe s LYS 67 N -3.87 3.08 -0.06 -3.49 1.02 -1.26 -4.90 119.74 110.26 1poe s LYS 67 Ca 0.08 -0.42 -0.29 0.00 0.02 0.00 0.00 55.97 55.35 1poe s LYS 67 Cb 0.03 -2.88 0.07 0.00 -0.52 0.00 0.00 37.83 34.53 1poe s LYS 67 CO -0.08 0.68 0.64 -0.59 -0.92 0.00 0.00 175.35 175.08 1poe s PHE 68 N -1.09 -0.62 0.22 3.18 -0.12 -1.26 -3.77 117.98 114.52 1poe s PHE 68 Ca 0.19 1.08 0.10 0.00 -0.05 0.00 0.00 56.93 58.25 1poe s PHE 68 Cb -0.12 0.37 -0.04 0.00 -0.63 0.00 0.00 43.02 42.60 1poe s PHE 68 CO 0.09 -0.58 -0.14 -1.12 -0.05 0.00 0.00 175.22 173.43 1poe s SER 69 N -1.12 3.93 0.01 1.98 0.01 -0.74 -4.95 113.70 112.81 1poe s SER 69 Ca -0.11 -0.76 0.01 0.00 1.31 0.00 0.00 55.95 56.40 1poe s SER 69 Cb -0.01 -0.52 -0.01 0.00 0.21 0.00 0.00 66.02 65.69 1poe s SER 69 CO 0.09 0.08 -0.04 0.54 0.41 0.00 0.00 173.24 174.32 1poe s ASN 70 N -3.04 0.42 -0.40 2.44 2.20 -1.26 -1.48 114.94 113.81 1poe s ASN 70 Ca 0.26 -0.18 0.01 0.00 -0.94 0.00 0.00 52.86 52.01 1poe s ASN 70 Cb -0.07 -0.01 0.13 0.00 -2.00 0.00 0.00 41.25 39.29 1poe s ASN 70 CO 0.14 -0.04 0.20 -0.55 -2.94 0.00 0.00 177.10 173.92 1poe s SER 71 N -0.45 3.70 1.24 3.54 0.15 -0.67 -5.00 113.70 116.22 1poe s SER 71 Ca -0.02 -2.36 0.00 0.00 0.70 0.00 0.00 55.95 54.26 1poe s SER 71 Cb -0.03 -0.96 0.00 0.00 -1.71 0.00 0.00 66.02 63.32 1poe s SER 71 CO -0.00 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.74 1poe n GLY 72 N 3.88 1.36 1.05 9.45 0.00 -1.26 -2.46 105.19 117.21 1poe n GLY 72 Ca 0.06 -0.52 0.11 0.00 0.00 0.00 0.00 46.02 45.67 1poe n GLY 72 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1poe n SER 73 N 6.91 3.31 -4.67 1.61 3.41 -1.26 -4.90 113.62 118.02 1poe n SER 73 Ca 0.00 -1.95 -0.43 0.00 -0.26 0.00 0.00 58.87 56.23 1poe n SER 73 Cb 0.00 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 63.69 1poe n SER 73 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1poe s ARG 74 N -1.36 4.33 -0.18 4.33 3.52 -1.03 -4.79 118.95 123.76 1poe s ARG 74 Ca 0.35 1.39 -0.06 0.00 -0.13 0.00 0.00 55.73 57.29 1poe s ARG 74 Cb 0.21 -3.60 -0.03 0.00 -1.56 0.00 0.00 34.95 29.96 1poe s ARG 74 CO 0.29 -0.50 0.02 0.42 -0.81 0.00 0.00 175.30 174.72 1poe s ILE 75 N 2.69 4.28 -0.17 4.11 1.01 -1.26 -1.68 121.20 130.18 1poe s ILE 75 Ca 0.46 -0.21 0.01 0.00 0.00 0.00 0.00 60.65 60.91 1poe s ILE 75 Cb -0.17 -2.92 0.03 0.00 0.01 0.00 0.00 42.46 39.41 1poe s ILE 75 CO 0.12 0.45 -0.14 -0.89 0.00 0.00 0.00 174.94 174.48 1poe s THR 76 N 0.63 1.66 -0.88 2.92 2.01 -0.55 -5.01 115.64 116.42 1poe s THR 76 Ca 0.01 -0.80 -0.25 0.00 0.31 0.00 0.00 61.69 60.96 1poe s THR 76 Cb -0.14 -1.61 0.01 0.00 0.01 0.00 0.00 72.50 70.77 1poe s THR 76 CO 0.02 0.37 1.59 0.00 -0.69 0.00 0.00 174.62 175.91 1poe s ALA 78 N 6.92 3.46 0.23 0.00 0.00 -1.25 -4.98 121.76 126.14 1poe s ALA 78 Ca 0.52 -2.85 0.01 0.00 0.00 0.00 0.00 51.96 49.64 1poe s ALA 78 Cb -0.05 -4.04 -0.00 0.00 0.00 0.00 0.00 23.12 19.03 1poe s ALA 78 CO 0.01 -2.94 0.04 1.63 0.00 0.00 0.00 175.76 174.50 1poe n LYS 79 N 6.37 1.05 0.00 0.00 4.76 -1.26 -4.51 118.16 124.57 1poe n LYS 79 Ca 0.25 -1.79 0.00 0.00 -2.87 0.00 0.00 58.31 53.90 1poe n LYS 79 Cb 0.48 0.74 0.00 0.00 -1.84 0.00 0.00 35.03 34.41 1poe n LYS 79 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1poe n GLN 80 N -0.54 0.00 -1.43 1.97 3.00 -1.26 -5.05 117.38 114.07 1poe n GLN 80 Ca -0.06 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.54 1poe n GLN 80 Cb 0.31 0.00 0.04 0.00 0.00 0.00 0.00 30.24 30.59 1poe n GLN 80 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 1poe n ASP 81 N 0.00 -1.32 -0.21 1.08 5.75 -1.26 -4.62 116.55 115.97 1poe n ASP 81 Ca 0.00 0.72 0.01 0.00 -0.01 0.00 0.00 54.79 55.51 1poe n ASP 81 Cb 0.00 -1.14 0.12 0.00 -1.03 0.00 0.00 41.12 39.07 1poe n ASP 81 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1poe h SER 82 N 0.18 0.11 -0.22 -1.12 0.02 -1.99 -1.86 113.55 108.67 1poe h SER 82 Ca -0.45 0.10 0.02 0.00 -0.84 0.00 0.00 61.79 60.62 1poe h SER 82 Cb 1.40 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 64.03 1poe h SER 82 CO 0.46 0.06 -0.13 0.00 -1.14 0.00 0.00 176.83 176.08 1poe h ARG 84 N 0.00 0.34 0.00 0.00 3.08 -1.78 -2.84 114.38 113.18 1poe h ARG 84 Ca 0.03 -0.40 -0.11 0.00 0.07 0.00 0.00 59.98 59.57 1poe h ARG 84 Cb 0.09 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1poe h ARG 84 CO -0.20 1.09 -0.54 0.66 -1.07 0.00 0.00 179.97 179.91 1poe h SER 85 N 0.18 0.00 -0.20 7.04 4.64 -1.19 -0.01 113.55 124.01 1poe h SER 85 Ca -0.08 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.13 1poe h SER 85 Cb 1.63 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.72 1poe h SER 85 CO 0.16 0.54 -0.31 1.56 -0.87 0.00 0.00 176.83 177.91 1poe h GLN 86 N 0.00 0.57 -0.19 4.77 1.08 -1.19 -1.60 115.11 118.54 1poe h GLN 86 Ca -0.01 -0.34 -0.02 0.00 -1.45 0.00 0.00 58.65 56.83 1poe h GLN 86 Cb 1.21 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.67 1poe h GLN 86 CO 0.07 0.95 0.05 1.25 -0.95 0.00 0.00 178.83 180.20 1poe h LEU 87 N 0.24 0.29 -0.75 1.46 6.46 -1.43 -0.43 115.31 121.16 1poe h LEU 87 Ca 0.02 -0.23 0.07 0.00 -0.12 0.00 0.00 57.88 57.62 1poe h LEU 87 Cb 0.90 -0.08 -0.06 0.00 -0.73 0.00 0.00 40.66 40.69 1poe h LEU 87 CO 0.07 0.44 0.43 0.00 -0.62 0.00 0.00 178.44 178.77 1poe h GLU 89 N 0.77 0.88 -0.74 0.00 4.39 -1.09 -0.58 114.58 118.20 1poe h GLU 89 Ca 0.34 -0.40 0.06 0.00 0.34 0.00 0.00 59.36 59.70 1poe h GLU 89 Cb 0.22 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.80 1poe h GLU 89 CO -0.20 1.05 0.43 0.00 -1.16 0.00 0.00 179.01 179.14 1poe h ASP 91 N 0.80 0.04 -0.89 0.00 3.32 -1.15 -2.97 116.42 115.57 1poe h ASP 91 Ca 0.33 -0.62 0.09 0.00 0.02 0.00 0.00 57.03 56.85 1poe h ASP 91 Cb 0.18 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 1poe h ASP 91 CO -0.18 0.65 0.58 0.50 -1.72 0.00 0.00 179.24 179.07 1poe h LYS 92 N -0.56 0.89 -0.31 3.56 3.64 -0.93 0.09 116.57 122.94 1poe h LYS 92 Ca -0.00 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1poe h LYS 92 Cb 0.65 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1poe h LYS 92 CO 0.01 0.59 0.18 0.00 -2.27 0.00 0.00 179.45 177.96 1poe h ALA 93 N 1.55 0.39 -0.36 5.00 0.00 -1.15 -1.75 119.26 122.94 1poe h ALA 93 Ca 0.41 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 55.12 1poe h ALA 93 Cb 0.35 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1poe h ALA 93 CO -0.17 -0.10 -0.32 0.00 0.00 0.00 0.00 179.25 178.66 1poe h ALA 94 N 1.07 0.52 -0.52 0.00 0.00 -1.16 -0.97 119.26 118.19 1poe h ALA 94 Ca 0.11 -0.42 0.03 0.00 0.00 0.00 0.00 54.91 54.62 1poe h ALA 94 Cb 0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1poe h ALA 94 CO -0.02 0.58 0.31 0.00 0.00 0.00 0.00 179.25 180.11 1poe h ALA 95 N 0.76 0.67 -0.03 0.00 0.00 -0.88 0.14 119.26 119.92 1poe h ALA 95 Ca 0.06 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 1poe h ALA 95 Cb 0.90 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1poe h ALA 95 CO 0.08 0.01 -0.70 1.79 0.00 0.00 0.00 179.25 180.43 1poe h THR 96 N 0.61 1.45 -0.64 0.00 1.35 -1.29 -2.71 112.91 111.68 1poe h THR 96 Ca 0.21 -2.27 -0.06 0.00 -0.55 0.00 0.00 66.41 63.74 1poe h THR 96 Cb 0.03 2.21 -0.03 0.00 -1.73 0.00 0.00 68.15 68.63 1poe h THR 96 CO -0.10 0.66 0.16 0.00 -0.25 0.00 0.00 175.52 175.99 1poe h PHE 98 N 0.96 0.52 -0.00 0.00 0.04 -0.63 -2.61 116.94 115.22 1poe h PHE 98 Ca 0.20 -0.09 -0.26 0.00 2.80 0.00 0.00 57.97 60.63 1poe h PHE 98 Cb 0.36 -0.14 0.02 0.00 2.20 0.00 0.00 35.95 38.40 1poe h PHE 98 CO 0.03 0.63 -1.00 0.00 -0.60 0.00 0.00 178.31 177.37 1poe h ALA 99 N 1.39 0.13 -0.69 2.45 0.00 -1.22 -2.49 119.26 118.82 1poe h ALA 99 Ca 0.08 -0.68 0.15 0.00 0.00 0.00 0.00 54.91 54.45 1poe h ALA 99 Cb 0.55 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.28 1poe h ALA 99 CO 0.04 0.65 0.02 0.00 0.00 0.00 0.00 179.25 179.96 1poe h ARG 100 N 0.36 0.12 -0.62 0.00 -0.00 -0.59 -2.81 114.38 110.84 1poe h ARG 100 Ca -0.12 -0.01 -0.40 0.00 -0.50 0.00 0.00 59.98 58.95 1poe h ARG 100 Cb 1.66 -0.03 -0.24 0.00 0.00 0.00 0.00 29.97 31.36 1poe h ARG 100 CO 0.20 0.08 -0.06 0.09 0.00 0.00 0.00 179.97 180.28 1poe n ASN 101 N -5.29 4.21 0.27 7.04 3.02 -1.00 -4.65 115.26 118.85 1poe n ASN 101 Ca 0.12 -3.78 0.18 0.00 -0.03 0.00 0.00 54.58 51.06 1poe n ASN 101 Cb 0.42 -0.64 0.78 0.00 -0.61 0.00 0.00 39.78 39.73 1poe n ASN 101 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1poe h LYS 102 N 1.51 0.00 -0.32 3.52 3.64 -1.17 -2.38 116.57 121.37 1poe h LYS 102 Ca 0.36 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.76 1poe h LYS 102 Cb 1.53 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.33 1poe h LYS 102 CO 0.76 0.00 0.17 1.79 -2.27 0.00 0.00 179.45 179.91 1poe h THR 103 N 0.00 1.01 0.00 1.00 1.35 -1.83 -2.81 112.91 111.62 1poe h THR 103 Ca 0.00 -0.12 -0.03 0.00 -0.55 0.00 0.00 66.41 65.70 1poe h THR 103 Cb 0.35 0.62 -0.00 0.00 -1.73 0.00 0.00 68.15 67.38 1poe h THR 103 CO 0.00 0.07 -0.16 0.74 -0.25 0.00 0.00 175.52 175.91 1poe h THR 104 N 0.36 0.33 -1.06 6.82 2.02 -1.80 -3.46 112.91 116.11 1poe h THR 104 Ca 0.13 -1.16 -0.68 0.00 0.77 0.00 0.00 66.41 65.47 1poe h THR 104 Cb 0.03 1.90 0.10 0.00 -1.74 0.00 0.00 68.15 68.44 1poe h THR 104 CO -0.08 0.16 -0.41 0.00 0.37 0.00 0.00 175.52 175.56 1poe n TYR 105 N -3.21 -0.25 -3.54 3.16 4.19 -1.06 -4.94 117.16 111.51 1poe n TYR 105 Ca 0.02 0.97 -0.12 0.00 3.31 0.00 0.00 57.90 62.07 1poe n TYR 105 Cb 0.49 -1.99 -0.11 0.00 0.49 0.00 0.00 39.34 38.22 1poe n TYR 105 CO 0.00 0.00 0.00 1.21 0.91 0.00 0.00 176.86 178.98 1poe s ASN 106 N -0.83 0.44 0.58 2.98 3.84 -1.26 -5.03 114.94 115.66 1poe s ASN 106 Ca 0.68 0.39 0.30 0.00 0.21 0.00 0.00 52.86 54.44 1poe s ASN 106 Cb -0.97 0.85 1.41 0.00 -0.55 0.00 0.00 41.25 41.99 1poe s ASN 106 CO 0.56 -0.27 1.79 0.11 -2.79 0.00 0.00 177.10 176.50 1poe h LYS 107 N 8.25 0.00 -0.82 0.43 6.56 -2.00 -0.87 116.57 128.11 1poe h LYS 107 Ca -0.16 0.00 0.13 0.00 -1.06 0.00 0.00 60.65 59.56 1poe h LYS 107 Cb 1.13 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 32.73 1poe h LYS 107 CO 0.20 0.00 0.54 -0.22 -2.06 0.00 0.00 179.45 177.91 1poe h LYS 108 N 0.00 0.61 0.00 3.15 3.64 -2.00 -2.18 116.57 119.80 1poe h LYS 108 Ca 0.33 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 1poe h LYS 108 Cb 1.66 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 33.35 1poe h LYS 108 CO -0.00 0.40 -1.42 0.66 -2.27 0.00 0.00 179.45 176.82 1poe n TYR 109 N -4.52 0.44 -0.34 1.91 4.01 -0.34 -4.31 117.16 114.00 1poe n TYR 109 Ca 0.15 0.13 0.04 0.00 -0.16 0.00 0.00 57.90 58.06 1poe n TYR 109 Cb 0.44 -0.67 0.11 0.00 -0.31 0.00 0.00 39.34 38.91 1poe n TYR 109 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 1poe h GLN 110 N 0.00 -0.01 -0.15 -0.72 4.15 -1.34 0.77 115.11 117.82 1poe h GLN 110 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 1poe h GLN 110 Cb 0.94 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.62 1poe h GLN 110 CO 0.00 -0.00 -0.05 0.66 -1.93 0.00 0.00 178.83 177.51 1poe n TYR 111 N -5.58 0.52 -1.68 3.99 4.01 -1.26 -2.07 117.16 115.09 1poe n TYR 111 Ca 0.14 -1.07 -0.56 0.00 -0.16 0.00 0.00 57.90 56.25 1poe n TYR 111 Cb 0.46 -0.27 -0.07 0.00 -0.31 0.00 0.00 39.34 39.15 1poe n TYR 111 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 1poe n TYR 112 N -1.00 1.90 -2.41 -0.72 4.19 0.10 -4.89 117.16 114.33 1poe n TYR 112 Ca 0.21 0.56 -0.41 0.00 3.31 0.00 0.00 57.90 61.57 1poe n TYR 112 Cb 0.80 -2.42 -0.03 0.00 0.49 0.00 0.00 39.34 38.17 1poe n TYR 112 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 1poe s SER 113 N 2.67 7.11 0.53 2.98 0.15 -1.26 -4.59 113.70 121.29 1poe s SER 113 Ca 0.94 2.16 0.31 0.00 0.70 0.00 0.00 55.95 60.07 1poe s SER 113 Cb -1.04 -2.60 1.43 0.00 -1.71 0.00 0.00 66.02 62.10 1poe s SER 113 CO 0.60 -0.37 2.02 0.78 1.20 0.00 0.00 173.24 177.47 1poe h ASN 114 N 5.59 0.00 0.00 5.45 4.21 -1.90 -3.19 115.58 125.73 1poe h ASN 114 Ca -0.44 0.00 -0.67 0.00 1.21 0.00 0.00 56.30 56.40 1poe h ASN 114 Cb 1.21 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.41 1poe h ASN 114 CO 0.76 0.08 2.91 1.17 -1.29 0.00 0.00 177.43 181.06 1poe n LYS 115 N -3.29 2.46 0.00 0.81 4.81 -1.26 -1.46 118.16 120.23 1poe n LYS 115 Ca -0.01 -2.27 0.00 0.00 -0.87 0.00 0.00 58.31 55.17 1poe n LYS 115 Cb 0.29 -3.09 0.00 0.00 0.02 0.00 0.00 35.03 32.25 1poe n LYS 115 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1poe n HIS 116 N 6.22 0.00 -2.63 5.64 8.25 -1.21 -5.12 115.22 126.37 1poe n HIS 116 Ca 0.53 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.57 1poe n HIS 116 Cb 0.37 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.45 1poe n HIS 116 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1poe s ARG 118 N 2.17 2.15 0.36 0.00 3.03 -1.26 -4.58 118.95 120.83 1poe s ARG 118 Ca 0.50 -2.37 0.00 0.00 2.03 0.00 0.00 55.73 55.89 1poe s ARG 118 Cb -0.20 -1.27 0.00 0.00 -1.03 0.00 0.00 34.95 32.45 1poe s ARG 118 CO 0.18 -0.42 0.00 0.41 -1.13 0.00 0.00 175.30 174.34 1poe n GLY 119 N -1.20 -2.42 3.78 3.88 0.00 -1.26 0.55 105.19 108.52 1poe n GLY 119 Ca -0.17 -1.64 -0.39 0.00 0.00 0.00 0.00 46.02 43.82 1poe n GLY 119 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1poe s SER 120 N -2.72 7.24 -0.10 1.61 1.04 -1.26 -4.24 113.70 115.27 1poe s SER 120 Ca 0.00 1.47 -0.29 0.00 0.48 0.00 0.00 55.95 57.61 1poe s SER 120 Cb 0.00 -2.45 -0.05 0.00 0.10 0.00 0.00 66.02 63.63 1poe s SER 120 CO 0.00 0.17 1.64 -0.89 0.98 0.00 0.00 173.24 175.14 1poe s THR 121 N -0.80 3.63 0.30 2.02 2.01 -1.26 -3.58 115.64 117.95 1poe s THR 121 Ca 0.34 0.74 -0.30 0.00 0.31 0.00 0.00 61.69 62.79 1poe s THR 121 Cb -0.21 -3.52 -0.12 0.00 0.01 0.00 0.00 72.50 68.66 1poe s THR 121 CO 0.23 -0.12 1.54 -0.81 -0.69 0.00 0.00 174.62 174.78 1poe n PRO 122 N 7.27 2.59 -3.05 4.92 -0.05 -1.26 -4.95 135.00 140.46 1poe n PRO 122 Ca 0.18 0.92 -0.40 0.00 -0.05 0.00 0.00 63.50 64.15 1poe n PRO 122 Cb 0.43 -2.67 -0.05 0.00 -0.05 0.00 0.00 33.50 31.17 1poe n PRO 122 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 175.50 176.48 1poe s ARG 123 N -0.82 4.43 0.00 0.54 0.52 -1.26 -5.11 118.95 117.26 1poe s ARG 123 Ca 0.62 0.89 0.00 0.00 -0.52 0.00 0.00 55.73 56.73 1poe s ARG 123 Cb -0.51 -3.42 0.00 0.00 0.52 0.00 0.00 34.95 31.53 1poe s ARG 123 CO 0.52 0.13 0.34 0.00 0.02 0.00 0.00 175.30 176.30