#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vap h LEU 2 N 0.00 0.35 -0.27 -4.53 5.85 -1.80 -1.39 115.31 113.52 1vap h LEU 2 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1vap h LEU 2 Cb 0.00 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1vap h LEU 2 CO 0.00 0.24 0.17 -0.26 -0.34 0.00 0.00 178.44 178.25 1vap h PHE 3 N 0.41 0.34 -0.62 1.25 -1.00 -1.99 -2.05 116.94 113.28 1vap h PHE 3 Ca 0.19 0.01 -0.05 0.00 2.81 0.00 0.00 57.97 60.93 1vap h PHE 3 Cb 0.23 -0.12 -0.03 0.00 3.61 0.00 0.00 35.95 39.65 1vap h PHE 3 CO -0.00 0.23 0.21 1.96 -1.61 0.00 0.00 178.31 179.09 1vap h GLN 4 N 0.36 0.95 -0.31 1.51 4.20 -1.76 -2.67 115.11 117.40 1vap h GLN 4 Ca 0.10 -0.20 0.03 0.00 0.06 0.00 0.00 58.65 58.64 1vap h GLN 4 Cb -0.03 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.58 1vap h GLN 4 CO -0.02 0.84 0.13 0.35 -0.67 0.00 0.00 178.83 179.46 1vap h PHE 5 N 0.88 0.24 -0.74 2.96 3.57 -1.14 -0.08 116.94 122.63 1vap h PHE 5 Ca 0.20 0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.87 1vap h PHE 5 Cb 0.27 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 38.84 1vap h PHE 5 CO 0.02 0.12 0.22 1.49 -2.23 0.00 0.00 178.31 177.93 1vap h GLU 6 N 0.28 0.32 -0.41 1.11 4.57 -1.32 -0.11 114.58 119.03 1vap h GLU 6 Ca 0.13 -0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.17 1vap h GLU 6 Cb 0.07 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 1vap h GLU 6 CO -0.11 0.21 -0.23 0.87 -1.18 0.00 0.00 179.01 178.57 1vap h LYS 7 N 0.33 0.82 -0.59 1.92 1.57 -0.71 -2.04 116.57 117.86 1vap h LYS 7 Ca 0.42 -0.34 -0.10 0.00 -1.87 0.00 0.00 60.65 58.76 1vap h LYS 7 Cb 0.69 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 1vap h LYS 7 CO -0.47 0.97 -0.00 -0.07 -0.57 0.00 0.00 179.45 179.31 1vap h LEU 8 N 0.71 1.03 -0.14 2.94 4.07 -0.61 -1.68 115.31 121.63 1vap h LEU 8 Ca 0.09 -0.31 -0.02 0.00 0.08 0.00 0.00 57.88 57.73 1vap h LEU 8 Cb 0.76 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 42.22 1vap h LEU 8 CO 0.06 1.09 0.01 0.40 -1.08 0.00 0.00 178.44 178.92 1vap h ILE 9 N 0.95 1.23 -0.81 1.22 2.04 -0.70 -1.09 117.51 120.34 1vap h ILE 9 Ca 0.17 -0.75 0.12 0.00 1.00 0.00 0.00 64.86 65.39 1vap h ILE 9 Cb 0.56 1.45 -0.08 0.00 -0.74 0.00 0.00 36.82 38.01 1vap h ILE 9 CO 0.03 0.22 0.43 0.50 0.00 0.00 0.00 178.15 179.33 1vap h LYS 10 N 0.01 0.65 -0.79 2.37 1.63 -1.29 0.10 116.57 119.26 1vap h LYS 10 Ca 0.04 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.76 1vap h LYS 10 Cb 0.33 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.77 1vap h LYS 10 CO 0.00 0.43 0.32 -0.22 -3.45 0.00 0.00 179.45 176.53 1vap h LYS 11 N 0.67 1.18 0.04 1.90 1.63 -0.86 0.44 116.57 121.57 1vap h LYS 11 Ca 0.42 -0.22 -0.24 0.00 -0.85 0.00 0.00 60.65 59.76 1vap h LYS 11 Cb 0.50 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.92 1vap h LYS 11 CO -0.31 0.96 -1.19 0.52 -3.45 0.00 0.00 179.45 175.98 1vap h MET 12 N 1.15 0.09 0.00 1.90 2.86 -0.84 -3.40 114.93 116.69 1vap h MET 12 Ca 0.26 -0.15 -0.10 0.00 -2.06 0.00 0.00 59.70 57.65 1vap h MET 12 Cb 0.22 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 1vap h MET 12 CO -0.02 1.01 -1.62 0.25 1.06 0.00 0.00 176.91 177.58 1vap n THR 13 N -3.37 0.38 -0.31 2.22 -2.24 0.32 -4.70 114.28 106.58 1vap n THR 13 Ca -0.05 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1vap n THR 13 Cb 0.98 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 1vap n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vap n GLY 14 N 2.12 1.50 3.64 3.38 0.00 0.14 -5.01 105.19 110.96 1vap n GLY 14 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1vap n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vap s LYS 15 N -0.31 2.38 0.05 1.61 1.02 -1.26 -4.99 119.74 118.23 1vap s LYS 15 Ca 0.00 -0.91 -0.30 0.00 0.02 0.00 0.00 55.97 54.78 1vap s LYS 15 Cb 0.00 -2.44 -0.05 0.00 -0.52 0.00 0.00 37.83 34.82 1vap s LYS 15 CO 0.00 0.53 1.11 0.45 -0.92 0.00 0.00 175.35 176.52 1vap s SER 16 N -2.22 7.20 0.13 2.83 0.15 -1.26 -3.12 113.70 117.41 1vap s SER 16 Ca 0.24 1.90 -0.19 0.00 0.70 0.00 0.00 55.95 58.59 1vap s SER 16 Cb -0.11 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.58 1vap s SER 16 CO 0.16 -0.37 1.75 1.23 1.20 0.00 0.00 173.24 177.21 1vap h GLY 17 N 6.65 0.27 1.15 9.45 0.00 -1.92 -1.00 103.07 117.66 1vap h GLY 17 Ca -0.42 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 46.88 1vap h GLY 17 CO 0.78 0.04 0.54 0.00 0.00 0.00 0.00 176.54 177.90 1vap h MET 18 N 0.19 1.05 0.08 4.80 -0.00 -1.94 -1.22 114.93 117.88 1vap h MET 18 Ca 0.09 -0.06 -0.00 0.00 -0.00 0.00 0.00 59.70 59.73 1vap h MET 18 Cb 0.05 -0.24 0.00 0.00 -0.00 0.00 0.00 31.60 31.42 1vap h MET 18 CO -0.09 0.69 -0.04 -0.07 -0.00 0.00 0.00 176.91 177.41 1vap h LEU 19 N 1.08 -0.09 0.00 -0.10 3.38 -1.92 -3.35 115.31 114.30 1vap h LEU 19 Ca 0.31 -0.51 -0.31 0.00 0.09 0.00 0.00 57.88 57.46 1vap h LEU 19 Cb -0.06 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.65 1vap h LEU 19 CO -0.08 0.58 -1.93 0.79 0.09 0.00 0.00 178.44 177.89 1vap n TRP 20 N -4.81 0.66 0.01 1.13 7.02 -0.40 -4.59 117.44 116.46 1vap n TRP 20 Ca -0.08 0.24 0.01 0.00 -1.02 0.00 0.00 57.50 56.65 1vap n TRP 20 Cb 0.29 -1.12 0.02 0.00 -2.42 0.00 0.00 31.31 28.08 1vap n TRP 20 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1vap n TYR 21 N -2.94 0.05 0.14 -5.99 4.01 -0.49 -4.73 117.16 107.21 1vap n TYR 21 Ca -0.22 -0.31 0.05 0.00 -0.16 0.00 0.00 57.90 57.25 1vap n TYR 21 Cb 1.08 -0.03 0.03 0.00 -0.31 0.00 0.00 39.34 40.12 1vap n TYR 21 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1vap h SER 22 N 0.38 0.00 -1.44 7.72 4.64 -1.63 -3.11 113.55 120.10 1vap h SER 22 Ca 0.00 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.90 1vap h SER 22 Cb 0.37 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.13 1vap h SER 22 CO 0.00 0.37 -0.97 0.00 -0.87 0.00 0.00 176.83 175.35 1vap n ALA 23 N -2.22 1.25 -3.31 5.18 0.00 -1.22 -2.96 120.51 117.22 1vap n ALA 23 Ca 0.00 -2.85 -0.31 0.00 0.00 0.00 0.00 53.44 50.29 1vap n ALA 23 Cb 0.69 -0.99 -0.17 0.00 0.00 0.00 0.00 19.45 18.99 1vap n ALA 23 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1vap s TYR 24 N -1.43 2.38 0.00 0.00 6.14 -0.92 -0.21 117.35 123.31 1vap s TYR 24 Ca 0.35 -0.99 0.00 0.00 0.64 0.00 0.00 57.07 57.07 1vap s TYR 24 Cb 0.30 -1.61 0.00 0.00 0.42 0.00 0.00 41.96 41.07 1vap s TYR 24 CO -0.09 -0.42 0.00 0.41 0.64 0.00 0.00 175.55 176.09 1vap n GLY 25 N 3.63 0.79 0.14 8.97 0.00 0.04 -1.38 105.19 117.39 1vap n GLY 25 Ca -0.20 -0.71 0.12 0.00 0.00 0.00 0.00 46.02 45.23 1vap n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vap n TYR 27 N -2.79 0.00 -2.56 0.00 4.01 -1.24 -3.35 117.16 111.22 1vap n TYR 27 Ca 0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.33 1vap n TYR 27 Cb 0.54 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.55 1vap n TYR 27 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1vap n GLY 29 N 3.10 0.60 3.78 0.00 0.00 -1.16 -2.17 105.19 109.34 1vap n GLY 29 Ca 0.08 -1.57 -0.32 0.00 0.00 0.00 0.00 46.02 44.21 1vap n GLY 29 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1vap s TRP 30 N 0.00 3.25 -0.50 1.61 1.48 -1.25 -4.86 118.94 118.67 1vap s TRP 30 Ca 0.00 0.16 -0.18 0.00 -1.06 0.00 0.00 56.10 55.02 1vap s TRP 30 Cb 0.00 -1.70 0.02 0.00 -1.16 0.00 0.00 33.47 30.64 1vap s TRP 30 CO 0.00 0.54 0.63 0.41 -4.06 0.00 0.00 176.95 174.47 1vap n GLY 31 N 0.96 -0.97 3.84 3.67 0.00 -1.26 -5.00 105.19 106.43 1vap n GLY 31 Ca -0.12 1.10 -0.33 0.00 0.00 0.00 0.00 46.02 46.67 1vap n GLY 31 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vap s GLY 32 N -2.43 2.36 0.23 -0.02 0.00 -1.26 -4.96 107.32 101.24 1vap s GLY 32 Ca 0.23 0.06 -0.22 0.00 0.00 0.00 0.00 44.72 44.79 1vap s GLY 32 CO 0.80 0.29 0.87 -0.86 0.00 0.00 0.00 173.10 174.19 1vap s GLN 33 N -2.89 1.53 3.02 2.90 -2.07 -1.21 -5.02 119.66 115.92 1vap s GLN 33 Ca 0.53 -0.88 0.00 0.00 -1.82 0.00 0.00 55.36 53.19 1vap s GLN 33 Cb -0.11 0.50 0.00 0.00 -1.09 0.00 0.00 33.01 32.31 1vap s GLN 33 CO 0.18 -0.71 0.00 0.41 -1.32 0.00 0.00 175.29 173.85 1vap n GLY 34 N -0.50 -0.24 3.57 2.60 0.00 -0.63 -4.76 105.19 105.24 1vap n GLY 34 Ca -0.05 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 1vap n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vap s ARG 35 N 0.00 2.69 0.34 1.61 0.52 -1.26 -4.03 118.95 118.81 1vap s ARG 35 Ca 0.00 -0.59 -0.29 0.00 -0.52 0.00 0.00 55.73 54.33 1vap s ARG 35 Cb 0.00 -2.55 -0.11 0.00 0.52 0.00 0.00 34.95 32.82 1vap s ARG 35 CO 0.00 0.65 1.38 -1.25 0.02 0.00 0.00 175.30 176.10 1vap s PRO 36 N -0.87 4.27 0.24 3.54 0.04 -1.26 -4.73 135.00 136.21 1vap s PRO 36 Ca 0.13 2.34 0.19 0.00 0.04 0.00 0.00 61.00 63.70 1vap s PRO 36 Cb -0.11 -3.04 0.05 0.00 0.04 0.00 0.00 34.50 31.44 1vap s PRO 36 CO 0.02 -0.32 1.23 0.87 0.04 0.00 0.00 177.00 178.84 1vap h LYS 37 N 3.42 0.00 0.00 4.56 1.79 -1.97 -3.46 116.57 120.91 1vap h LYS 37 Ca -0.49 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 57.97 1vap h LYS 37 Cb 1.23 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.88 1vap h LYS 37 CO 0.66 0.24 0.02 -0.40 -1.08 0.00 0.00 179.45 178.89 1vap n ASP 38 N -3.00 -0.18 -0.11 0.86 5.75 -1.26 -5.03 116.55 113.57 1vap n ASP 38 Ca -0.01 -1.15 -0.09 0.00 -0.01 0.00 0.00 54.79 53.53 1vap n ASP 38 Cb 0.68 0.31 -0.02 0.00 -1.03 0.00 0.00 41.12 41.07 1vap n ASP 38 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1vap h ALA 39 N 1.88 0.45 -0.12 2.12 0.00 -1.93 -1.19 119.26 120.47 1vap h ALA 39 Ca -0.03 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1vap h ALA 39 Cb 0.11 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1vap h ALA 39 CO 0.04 0.05 0.07 1.15 0.00 0.00 0.00 179.25 180.56 1vap h THR 40 N 0.42 1.01 -0.88 0.00 2.02 -1.92 -1.89 112.91 111.66 1vap h THR 40 Ca 0.12 -0.05 0.17 0.00 0.77 0.00 0.00 66.41 67.42 1vap h THR 40 Cb 0.19 0.85 -0.10 0.00 -1.74 0.00 0.00 68.15 67.35 1vap h THR 40 CO -0.01 0.03 0.45 -0.78 0.37 0.00 0.00 175.52 175.58 1vap h ASP 41 N 0.14 0.51 -0.41 4.18 3.58 -1.83 -0.58 116.42 122.00 1vap h ASP 41 Ca 0.05 0.11 -0.05 0.00 0.42 0.00 0.00 57.03 57.56 1vap h ASP 41 Cb -0.00 0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 1vap h ASP 41 CO -0.03 0.16 0.10 -0.09 -2.88 0.00 0.00 179.24 176.51 1vap h ARG 42 N 0.58 0.73 -0.54 0.28 2.43 -0.47 -1.35 114.38 116.05 1vap h ARG 42 Ca 0.51 -0.14 0.07 0.00 -0.81 0.00 0.00 59.98 59.60 1vap h ARG 42 Cb 0.81 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 30.19 1vap h ARG 42 CO -0.41 0.67 0.23 0.00 -1.51 0.00 0.00 179.97 178.95 1vap h PHE 45 N 0.83 0.89 0.00 0.00 3.57 -0.17 -0.90 116.94 121.16 1vap h PHE 45 Ca 0.15 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.55 1vap h PHE 45 Cb 0.55 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1vap h PHE 45 CO 0.03 0.60 -0.46 0.28 -2.23 0.00 0.00 178.31 176.53 1vap h VAL 46 N 0.92 1.06 -0.20 1.41 2.07 -1.07 -1.23 116.25 119.21 1vap h VAL 46 Ca 0.24 -1.76 -0.14 0.00 0.82 0.00 0.00 66.70 65.86 1vap h VAL 46 Cb -0.03 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1vap h VAL 46 CO -0.05 0.45 -0.43 -0.74 0.02 0.00 0.00 177.57 176.82 1vap h HIS 47 N 0.00 0.82 -0.67 1.57 -0.00 -1.14 0.32 115.15 116.05 1vap h HIS 47 Ca -0.00 -0.30 -0.02 0.00 -0.00 0.00 0.00 60.37 60.04 1vap h HIS 47 Cb 0.99 -0.15 -0.03 0.00 -0.00 0.00 0.00 27.41 28.22 1vap h HIS 47 CO 0.00 1.07 0.33 0.22 -0.00 0.00 0.00 177.93 179.55 1vap h ASP 48 N 0.33 0.87 -0.40 3.26 3.58 -0.48 -0.44 116.42 123.15 1vap h ASP 48 Ca 0.00 -0.13 -0.12 0.00 0.42 0.00 0.00 57.03 57.20 1vap h ASP 48 Cb 1.04 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.86 1vap h ASP 48 CO 0.10 0.76 -0.22 0.00 -2.88 0.00 0.00 179.24 176.99 1vap h TYR 51 N -0.56 0.90 0.00 0.00 -1.99 -0.98 -2.63 116.97 111.71 1vap h TYR 51 Ca 0.05 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.79 1vap h TYR 51 Cb 0.65 -0.29 -0.00 0.00 2.00 0.00 0.00 36.73 39.09 1vap h TYR 51 CO -0.45 0.39 -0.09 0.78 -0.00 0.00 0.00 178.16 178.80 1vap h GLY 52 N 0.81 0.00 0.97 3.88 0.00 -0.99 -2.34 103.07 105.39 1vap h GLY 52 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1vap h GLY 52 CO -0.18 0.00 -0.58 0.28 0.00 0.00 0.00 176.54 176.06 1vap n LYS 53 N -3.47 0.07 -2.49 4.80 5.02 -0.99 -4.82 118.16 116.27 1vap n LYS 53 Ca -0.02 0.01 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 1vap n LYS 53 Cb 0.23 -1.54 -0.02 0.00 -0.02 0.00 0.00 35.03 33.68 1vap n LYS 53 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1vap s VAL 54 N -3.04 4.00 -0.13 -0.18 -7.23 -0.88 -4.99 120.40 107.94 1vap s VAL 54 Ca 0.10 0.96 -0.01 0.00 -1.81 0.00 0.00 61.98 61.21 1vap s VAL 54 Cb 0.17 -4.50 -0.02 0.00 0.56 0.00 0.00 36.38 32.59 1vap s VAL 54 CO 0.72 -1.06 -0.11 0.28 -0.31 0.00 0.00 175.10 174.61 1vap s THR 55 N 5.16 3.19 0.00 5.32 -1.32 -1.26 -4.66 115.64 122.08 1vap s THR 55 Ca 0.51 -0.61 0.00 0.00 -1.21 0.00 0.00 61.69 60.38 1vap s THR 55 Cb -0.09 -2.35 0.00 0.00 -1.51 0.00 0.00 72.50 68.54 1vap s THR 55 CO 0.29 0.52 0.00 0.61 -2.21 0.00 0.00 174.62 173.83 1vap n GLY 56 N 3.52 0.75 3.83 6.08 0.00 -1.26 -4.92 105.19 113.19 1vap n GLY 56 Ca -0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.78 1vap n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vap s ASN 58 N -2.95 5.71 0.46 0.00 2.47 -1.26 -4.98 114.94 114.40 1vap s ASN 58 Ca 0.12 -1.31 0.15 0.00 0.42 0.00 0.00 52.86 52.24 1vap s ASN 58 Cb -0.05 -2.02 1.11 0.00 -1.45 0.00 0.00 41.25 38.85 1vap s ASN 58 CO 0.06 -0.50 2.02 1.55 -3.72 0.00 0.00 177.10 176.52 1vap h PRO 59 N 8.45 0.28 0.09 0.43 0.13 -1.91 0.23 132.00 139.71 1vap h PRO 59 Ca -0.24 -0.02 -0.26 0.00 -0.87 0.00 0.00 66.00 64.61 1vap h PRO 59 Cb 1.09 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 1vap h PRO 59 CO 0.74 0.19 -1.17 -0.22 -0.23 0.00 0.00 178.00 177.31 1vap h LYS 60 N 0.29 0.22 0.00 0.86 3.64 -1.96 -3.38 116.57 116.24 1vap h LYS 60 Ca 0.21 -0.37 -0.30 0.00 -1.27 0.00 0.00 60.65 58.92 1vap h LYS 60 Cb 0.45 0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.35 1vap h LYS 60 CO -0.04 1.16 -2.10 -0.12 -2.27 0.00 0.00 179.45 176.08 1vap n MET 61 N -3.51 0.46 -1.70 1.90 1.56 -1.00 -2.75 117.12 112.07 1vap n MET 61 Ca -0.07 0.14 -0.39 0.00 -0.27 0.00 0.00 57.70 57.12 1vap n MET 61 Cb 0.99 -1.33 0.04 0.00 2.15 0.00 0.00 33.22 35.08 1vap n MET 61 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1vap n ASP 62 N -3.34 2.03 -4.72 6.12 8.00 0.77 -4.48 116.55 120.94 1vap n ASP 62 Ca -0.36 0.93 -0.36 0.00 0.71 0.00 0.00 54.79 55.71 1vap n ASP 62 Cb 0.83 -1.51 -0.07 0.00 -0.02 0.00 0.00 41.12 40.35 1vap n ASP 62 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1vap s ILE 63 N -1.35 5.33 0.39 0.53 1.01 -1.26 0.07 121.20 125.92 1vap s ILE 63 Ca 0.73 0.45 0.08 0.00 0.00 0.00 0.00 60.65 61.91 1vap s ILE 63 Cb -0.43 -3.59 -0.05 0.00 0.01 0.00 0.00 42.46 38.40 1vap s ILE 63 CO 0.49 0.39 0.16 -0.72 0.00 0.00 0.00 174.94 175.26 1vap s TYR 64 N 0.53 2.63 -0.19 3.97 -0.85 -1.26 -4.91 117.35 117.27 1vap s TYR 64 Ca 0.14 -0.51 -0.09 0.00 -0.52 0.00 0.00 57.07 56.09 1vap s TYR 64 Cb -0.13 -1.84 -0.05 0.00 0.38 0.00 0.00 41.96 40.33 1vap s TYR 64 CO 0.03 0.24 0.12 0.99 -1.52 0.00 0.00 175.55 175.41 1vap s THR 65 N -2.54 5.29 0.10 -3.49 2.01 -1.26 -4.98 115.64 110.77 1vap s THR 65 Ca 0.40 0.15 -0.16 0.00 0.31 0.00 0.00 61.69 62.39 1vap s THR 65 Cb 0.01 -3.40 0.03 0.00 0.01 0.00 0.00 72.50 69.16 1vap s THR 65 CO 0.22 0.47 0.37 -0.72 -0.69 0.00 0.00 174.62 174.27 1vap s TYR 66 N 0.18 -0.17 0.11 4.92 -0.85 -1.26 -1.11 117.35 119.17 1vap s TYR 66 Ca 0.08 -0.08 -0.01 0.00 -0.52 0.00 0.00 57.07 56.53 1vap s TYR 66 Cb -0.11 0.20 -0.04 0.00 0.38 0.00 0.00 41.96 42.39 1vap s TYR 66 CO -0.01 -0.64 0.05 -1.54 -1.52 0.00 0.00 175.55 171.89 1vap s SER 67 N -2.57 0.33 -0.21 -0.18 1.04 0.07 -4.94 113.70 107.24 1vap s SER 67 Ca 0.01 -1.14 -0.04 0.00 0.48 0.00 0.00 55.95 55.26 1vap s SER 67 Cb 0.01 0.28 -0.01 0.00 0.10 0.00 0.00 66.02 66.40 1vap s SER 67 CO -0.09 -0.71 -0.04 -0.69 0.98 0.00 0.00 173.24 172.69 1vap s VAL 68 N -4.01 3.43 -0.18 5.02 1.01 -1.26 -0.38 120.40 124.03 1vap s VAL 68 Ca 0.20 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1vap s VAL 68 Cb 0.07 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.93 1vap s VAL 68 CO -0.01 0.43 -0.19 -0.62 0.00 0.00 0.00 175.10 174.71 1vap s ASP 69 N 1.28 3.14 -1.21 3.32 2.15 0.38 -4.73 116.67 121.00 1vap s ASP 69 Ca 0.03 -0.66 -0.06 0.00 0.43 0.00 0.00 52.55 52.30 1vap s ASP 69 Cb -0.14 -1.46 0.04 0.00 -0.30 0.00 0.00 42.92 41.05 1vap s ASP 69 CO -0.02 -0.01 0.33 -3.20 -0.17 0.00 0.00 175.17 172.11 1vap n ASN 70 N 4.62 -3.95 0.00 -0.34 5.15 -1.26 -0.63 115.26 118.85 1vap n ASN 70 Ca -0.21 -0.17 0.00 0.00 -0.60 0.00 0.00 54.58 53.61 1vap n ASN 70 Cb 0.50 -3.29 0.00 0.00 -0.53 0.00 0.00 39.78 36.46 1vap n ASN 70 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1vap n GLY 71 N -1.07 1.42 3.85 8.20 0.00 -1.26 -5.04 105.19 111.29 1vap n GLY 71 Ca -0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 1vap n GLY 71 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vap s ASN 72 N -3.01 6.64 -0.11 1.61 0.02 0.19 -5.03 114.94 115.25 1vap s ASN 72 Ca 0.00 0.77 -0.28 0.00 -1.02 0.00 0.00 52.86 52.32 1vap s ASN 72 Cb 0.00 -2.18 -0.01 0.00 0.02 0.00 0.00 41.25 39.08 1vap s ASN 72 CO 0.00 0.36 0.95 -0.63 0.02 0.00 0.00 177.10 177.80 1vap s ILE 73 N -1.07 4.82 -0.14 0.60 1.01 -1.26 -0.47 121.20 124.69 1vap s ILE 73 Ca 0.20 1.92 -0.04 0.00 0.00 0.00 0.00 60.65 62.74 1vap s ILE 73 Cb -0.15 -4.26 -0.03 0.00 0.01 0.00 0.00 42.46 38.03 1vap s ILE 73 CO 0.10 0.03 0.00 -0.69 0.00 0.00 0.00 174.94 174.38 1vap s VAL 74 N 1.96 4.29 -0.38 2.92 1.01 0.49 -4.98 120.40 125.70 1vap s VAL 74 Ca 0.46 -0.23 -0.17 0.00 0.00 0.00 0.00 61.98 62.04 1vap s VAL 74 Cb -0.18 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.34 1vap s VAL 74 CO 0.17 0.52 0.43 0.00 0.00 0.00 0.00 175.10 176.22 1vap n GLY 76 N 4.99 4.38 0.00 0.00 0.00 -0.27 -5.01 105.19 109.29 1vap n GLY 76 Ca -0.07 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.05 1vap n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vap n GLY 77 N 5.00 -1.55 0.00 -0.02 0.00 -1.26 -4.56 105.19 102.80 1vap n GLY 77 Ca 0.00 -1.54 0.08 0.00 0.00 0.00 0.00 46.02 44.55 1vap n GLY 77 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vap n THR 78 N -1.79 0.00 -2.86 2.61 -2.24 -1.26 -4.93 114.28 103.81 1vap n THR 78 Ca 0.00 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 61.08 1vap n THR 78 Cb 0.00 0.45 -0.04 0.00 -2.10 0.00 0.00 70.33 68.64 1vap n THR 78 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1vap s ASN 79 N -3.33 6.65 0.35 3.42 3.84 -1.26 -4.94 114.94 119.67 1vap s ASN 79 Ca -0.02 0.53 0.04 0.00 0.21 0.00 0.00 52.86 53.62 1vap s ASN 79 Cb 0.11 -2.44 0.66 0.00 -0.55 0.00 0.00 41.25 39.02 1vap s ASN 79 CO 0.65 -0.80 1.96 -0.65 -2.79 0.00 0.00 177.10 175.48 1vap h PRO 80 N 8.43 0.66 -0.26 0.43 0.11 -1.96 -2.45 132.00 136.97 1vap h PRO 80 Ca -0.24 -0.08 -0.06 0.00 0.11 0.00 0.00 66.00 65.73 1vap h PRO 80 Cb 1.08 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1vap h PRO 80 CO 0.95 0.52 -0.08 0.00 -0.21 0.00 0.00 178.00 179.19 1vap h LYS 82 N 0.26 1.05 -0.87 0.00 1.57 -1.93 -2.23 116.57 114.42 1vap h LYS 82 Ca 0.06 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1vap h LYS 82 Cb 0.56 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 1vap h LYS 82 CO 0.03 0.80 0.44 -0.22 -0.57 0.00 0.00 179.45 179.93 1vap h LYS 83 N 1.05 1.23 -0.25 3.15 3.64 -1.05 -2.39 116.57 121.95 1vap h LYS 83 Ca 0.26 -0.17 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1vap h LYS 83 Cb 0.08 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1vap h LYS 83 CO -0.04 0.93 0.10 1.96 -2.27 0.00 0.00 179.45 180.13 1vap h GLN 84 N 1.23 0.22 -0.40 1.90 4.20 -0.45 -1.63 115.11 120.18 1vap h GLN 84 Ca 0.30 -0.01 0.05 0.00 0.06 0.00 0.00 58.65 59.04 1vap h GLN 84 Cb 0.08 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.77 1vap h GLN 84 CO -0.04 0.15 0.15 0.82 -0.67 0.00 0.00 178.83 179.23 1vap h ILE 85 N 0.23 0.89 -0.77 2.54 2.04 -1.17 -0.74 117.51 120.54 1vap h ILE 85 Ca 0.11 -0.11 0.09 0.00 1.00 0.00 0.00 64.86 65.95 1vap h ILE 85 Cb 0.06 0.55 -0.07 0.00 -0.74 0.00 0.00 36.82 36.62 1vap h ILE 85 CO -0.10 0.06 0.42 0.00 0.00 0.00 0.00 178.15 178.54 1vap h GLU 87 N 0.73 0.68 -0.07 0.00 5.08 -0.78 0.26 114.58 120.49 1vap h GLU 87 Ca 0.37 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 1vap h GLU 87 Cb 0.33 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1vap h GLU 87 CO -0.24 0.84 -0.05 0.00 -1.00 0.00 0.00 179.01 178.56 1vap h ASP 89 N -0.25 0.24 -0.71 0.00 5.19 -0.97 -2.14 116.42 117.79 1vap h ASP 89 Ca 0.01 -0.04 -0.06 0.00 -0.62 0.00 0.00 57.03 56.32 1vap h ASP 89 Cb 0.53 -0.06 -0.03 0.00 0.18 0.00 0.00 39.33 39.95 1vap h ASP 89 CO 0.01 0.21 0.21 -0.09 -3.12 0.00 0.00 179.24 176.46 1vap h ARG 90 N 0.24 1.11 -0.37 3.56 2.43 -0.48 -1.73 114.38 119.14 1vap h ARG 90 Ca 0.07 -0.25 -0.04 0.00 -0.81 0.00 0.00 59.98 58.96 1vap h ARG 90 Cb 0.01 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 1vap h ARG 90 CO -0.01 0.96 0.08 0.00 -1.51 0.00 0.00 179.97 179.48 1vap h ALA 91 N 1.10 1.45 0.05 2.80 0.00 -1.04 -0.54 119.26 123.09 1vap h ALA 91 Ca 0.23 -0.16 -0.27 0.00 0.00 0.00 0.00 54.91 54.71 1vap h ALA 91 Cb 0.33 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 17.98 1vap h ALA 91 CO -0.00 0.40 -1.10 0.00 0.00 0.00 0.00 179.25 178.54 1vap h ALA 92 N 1.56 0.15 -0.24 0.00 0.00 -1.16 -1.27 119.26 118.31 1vap h ALA 92 Ca 0.12 -0.74 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1vap h ALA 92 Cb 0.22 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1vap h ALA 92 CO -0.00 0.75 0.11 0.00 0.00 0.00 0.00 179.25 180.11 1vap h ALA 93 N 0.48 0.31 -0.41 0.00 0.00 -0.96 0.11 119.26 118.79 1vap h ALA 93 Ca -0.14 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.70 1vap h ALA 93 Cb 1.76 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.43 1vap h ALA 93 CO 0.20 -0.13 0.24 0.82 0.00 0.00 0.00 179.25 180.39 1vap h ILE 94 N 0.25 1.05 -0.64 0.00 1.08 -1.07 -2.46 117.51 115.73 1vap h ILE 94 Ca 0.08 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 1vap h ILE 94 Cb 0.12 0.51 -0.03 0.00 -3.07 0.00 0.00 36.82 34.36 1vap h ILE 94 CO -0.01 0.09 0.40 0.00 -0.69 0.00 0.00 178.15 177.94 1vap h PHE 96 N 0.86 -1.01 -0.95 0.00 0.04 -0.61 -2.27 116.94 113.00 1vap h PHE 96 Ca 0.23 0.03 0.14 0.00 2.80 0.00 0.00 57.97 61.17 1vap h PHE 96 Cb -0.05 0.44 -0.09 0.00 2.20 0.00 0.00 35.95 38.45 1vap h PHE 96 CO -0.02 -0.45 0.57 -0.09 -0.60 0.00 0.00 178.31 177.72 1vap h ARG 97 N -0.52 0.81 0.00 1.51 9.65 -1.01 -2.14 114.38 122.68 1vap h ARG 97 Ca 0.05 -0.05 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 1vap h ARG 97 Cb 0.60 -0.18 -0.00 0.00 -1.39 0.00 0.00 29.97 29.00 1vap h ARG 97 CO -0.28 0.54 -0.11 -0.44 2.80 0.00 0.00 179.97 182.48 1vap h ASP 98 N 0.84 0.00 -0.19 -3.80 3.32 -0.70 -3.09 116.42 112.80 1vap h ASP 98 Ca 0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.55 1vap h ASP 98 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1vap h ASP 98 CO -0.31 0.11 0.00 0.59 -1.72 0.00 0.00 179.24 177.90 1vap n ASN 99 N -4.09 3.16 -0.20 6.45 3.02 -0.83 -4.65 115.26 118.12 1vap n ASN 99 Ca -0.02 -2.72 0.15 0.00 -0.03 0.00 0.00 54.58 51.96 1vap n ASN 99 Cb 0.19 -0.40 0.48 0.00 -0.61 0.00 0.00 39.78 39.44 1vap n ASN 99 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1vap h LEU 100 N 1.27 0.45 0.00 3.41 3.38 -1.40 -2.46 115.31 119.96 1vap h LEU 100 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1vap h LEU 100 Cb 1.10 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1vap h LEU 100 CO 0.11 0.22 0.00 2.29 0.09 0.00 0.00 178.44 181.15 1vap n LYS 101 N -4.50 0.14 0.00 1.13 2.85 -1.26 -2.26 118.16 114.26 1vap n LYS 101 Ca 0.16 0.16 0.00 0.00 -1.05 0.00 0.00 58.31 57.58 1vap n LYS 101 Cb 0.54 -1.50 -0.00 0.00 -0.65 0.00 0.00 35.03 33.41 1vap n LYS 101 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1vap n THR 102 N -1.38 0.00 -1.65 0.58 -2.24 -0.94 -5.02 114.28 103.62 1vap n THR 102 Ca 0.06 -0.48 -0.50 0.00 -2.27 0.00 0.00 64.05 60.86 1vap n THR 102 Cb 0.16 1.00 -0.05 0.00 -2.10 0.00 0.00 70.33 69.34 1vap n THR 102 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vap n TYR 103 N -0.82 1.98 -3.59 4.78 9.36 -0.96 -4.92 117.16 122.99 1vap n TYR 103 Ca 0.00 0.39 -0.29 0.00 3.32 0.00 0.00 57.90 61.32 1vap n TYR 103 Cb 0.02 -2.48 -0.13 0.00 -0.63 0.00 0.00 39.34 36.12 1vap n TYR 103 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1vap s ASP 104 N 1.73 3.34 0.30 2.98 2.15 -1.26 -4.98 116.67 120.94 1vap s ASP 104 Ca 0.86 -2.32 0.10 0.00 0.43 0.00 0.00 52.55 51.61 1vap s ASP 104 Cb -0.84 -0.70 0.47 0.00 -0.30 0.00 0.00 42.92 41.55 1vap s ASP 104 CO 0.48 -0.30 1.69 0.77 -0.17 0.00 0.00 175.17 177.64 1vap h SER 105 N 6.99 0.09 -0.59 -0.34 4.64 -1.95 -1.16 113.55 121.23 1vap h SER 105 Ca 0.01 -0.04 0.07 0.00 -0.47 0.00 0.00 61.79 61.36 1vap h SER 105 Cb 0.95 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 62.96 1vap h SER 105 CO 0.38 0.57 0.26 0.11 -0.87 0.00 0.00 176.83 177.28 1vap h LYS 106 N 0.07 0.47 0.11 4.77 6.56 -1.93 -2.11 116.57 124.51 1vap h LYS 106 Ca -0.00 -0.03 -0.36 0.00 -1.06 0.00 0.00 60.65 59.21 1vap h LYS 106 Cb 0.90 -0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 32.43 1vap h LYS 106 CO 0.07 0.31 -1.96 0.25 -2.06 0.00 0.00 179.45 176.07 1vap n THR 107 N -4.92 1.76 0.19 -0.16 -2.24 -1.20 -4.69 114.28 103.03 1vap n THR 107 Ca 0.07 -0.68 0.09 0.00 -2.27 0.00 0.00 64.05 61.26 1vap n THR 107 Cb 0.22 -1.64 -0.12 0.00 -2.10 0.00 0.00 70.33 66.68 1vap n THR 107 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1vap n TYR 108 N -3.42 0.00 -2.45 4.78 4.01 -0.44 -4.71 117.16 114.92 1vap n TYR 108 Ca -0.30 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.02 1vap n TYR 108 Cb 1.05 -0.30 -0.03 0.00 -0.31 0.00 0.00 39.34 39.75 1vap n TYR 108 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1vap s TRP 109 N -3.05 3.46 -1.12 -0.72 0.52 -0.80 -0.78 118.94 116.45 1vap s TRP 109 Ca -0.03 1.34 -0.04 0.00 0.02 0.00 0.00 56.10 57.38 1vap s TRP 109 Cb 0.12 -3.39 0.00 0.00 -1.15 0.00 0.00 33.47 29.05 1vap s TRP 109 CO 0.71 -1.16 0.56 1.63 0.02 0.00 0.00 176.95 178.72 1vap n LYS 110 N 3.91 -4.24 -1.97 4.98 4.76 0.71 -4.94 118.16 121.38 1vap n LYS 110 Ca 0.09 0.66 -0.37 0.00 -2.87 0.00 0.00 58.31 55.82 1vap n LYS 110 Cb 0.47 -5.04 0.03 0.00 -1.84 0.00 0.00 35.03 28.65 1vap n LYS 110 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1vap s TYR 111 N -3.07 2.41 -0.72 2.13 5.04 -1.21 -4.95 117.35 116.97 1vap s TYR 111 Ca 0.28 1.48 -0.27 0.00 -2.44 0.00 0.00 57.07 56.12 1vap s TYR 111 Cb -0.12 -3.57 0.03 0.00 0.35 0.00 0.00 41.96 38.64 1vap s TYR 111 CO 0.35 -2.35 1.27 -1.25 -1.34 0.00 0.00 175.55 172.22 1vap s PRO 112 N -3.11 3.22 0.00 4.97 0.04 -1.26 -4.83 135.00 134.03 1vap s PRO 112 Ca 0.74 -0.20 0.00 0.00 0.04 0.00 0.00 61.00 61.58 1vap s PRO 112 Cb -0.34 -4.16 0.00 0.00 0.04 0.00 0.00 34.50 30.04 1vap s PRO 112 CO 0.38 -2.10 0.81 1.63 0.04 0.00 0.00 177.00 177.75 1vap n LYS 113 N 9.28 0.00 0.26 4.56 4.76 -1.26 0.69 118.16 136.45 1vap n LYS 113 Ca 0.03 0.32 0.10 0.00 -2.87 0.00 0.00 58.31 55.89 1vap n LYS 113 Cb 0.49 -1.65 0.69 0.00 -1.84 0.00 0.00 35.03 32.72 1vap n LYS 113 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 1vap h LYS 114 N 0.00 0.00 -0.01 1.97 2.10 -2.01 0.13 116.57 118.74 1vap h LYS 114 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1vap h LYS 114 Cb 0.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 1vap h LYS 114 CO 0.00 0.07 -0.05 0.09 -2.00 0.00 0.00 179.45 177.56 1vap n ASN 115 N -4.15 1.11 -1.61 7.07 4.13 0.22 -3.95 115.26 118.07 1vap n ASN 115 Ca -0.03 -1.24 -0.15 0.00 1.68 0.00 0.00 54.58 54.84 1vap n ASN 115 Cb 0.15 0.01 0.14 0.00 -1.54 0.00 0.00 39.78 38.54 1vap n ASN 115 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1vap n LYS 117 N -1.00 3.62 -2.37 0.00 5.02 -1.25 -1.60 118.16 120.58 1vap n LYS 117 Ca 0.42 -2.88 -0.27 0.00 -2.02 0.00 0.00 58.31 53.56 1vap n LYS 117 Cb 0.99 -1.93 0.03 0.00 -0.02 0.00 0.00 35.03 34.10 1vap n LYS 117 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1vap s GLU 118 N -2.51 3.05 -0.16 1.97 1.03 -1.26 -4.91 118.70 115.90 1vap s GLU 118 Ca 0.45 0.10 -0.31 0.00 0.03 0.00 0.00 54.97 55.25 1vap s GLU 118 Cb 0.34 -2.26 -0.08 0.00 -0.80 0.00 0.00 34.13 31.33 1vap s GLU 118 CO 0.14 -0.64 2.10 0.39 -1.33 0.00 0.00 175.26 175.92 1vap n GLU 119 N -2.57 2.05 -2.07 -4.83 1.02 -1.26 -3.48 120.64 109.50 1vap n GLU 119 Ca 0.04 0.65 -0.36 0.00 -0.02 0.00 0.00 57.16 57.47 1vap n GLU 119 Cb 0.57 -2.95 0.02 0.00 -0.02 0.00 0.00 31.44 29.06 1vap n GLU 119 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1vap s SER 120 N 6.55 5.48 0.03 1.62 0.01 -1.26 -4.54 113.70 121.59 1vap s SER 120 Ca 0.98 2.40 -0.26 0.00 1.31 0.00 0.00 55.95 60.39 1vap s SER 120 Cb -0.51 -2.60 -0.05 0.00 0.21 0.00 0.00 66.02 63.07 1vap s SER 120 CO 0.42 -1.39 0.79 -0.70 0.41 0.00 0.00 173.24 172.77 1vap s GLU 121 N -3.12 4.51 0.64 12.44 2.12 -1.26 -5.02 118.70 129.00 1vap s GLU 121 Ca 0.73 1.10 -0.17 0.00 0.36 0.00 0.00 54.97 56.99 1vap s GLU 121 Cb -0.31 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 30.68 1vap s GLU 121 CO 0.35 0.20 1.17 -2.14 -0.54 0.00 0.00 175.26 174.30 1vap s PRO 122 N 0.22 2.79 0.00 4.30 0.02 -1.26 -5.11 135.00 135.96 1vap s PRO 122 Ca 0.41 1.66 0.29 0.00 0.02 0.00 0.00 61.00 63.37 1vap s PRO 122 Cb -0.20 -1.92 1.71 0.00 0.02 0.00 0.00 34.50 34.10 1vap s PRO 122 CO 0.23 -1.31 2.05 0.00 -0.33 0.00 0.00 177.00 177.64