#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d88 s SER 2 N 0.00 6.81 -0.10 1.61 0.15 -1.26 -4.94 113.70 115.97 2d88 s SER 2 Ca 0.00 2.20 -0.02 0.00 0.70 0.00 0.00 55.95 58.83 2d88 s SER 2 Cb 0.00 -2.56 -0.01 0.00 -1.71 0.00 0.00 66.02 61.74 2d88 s SER 2 CO 0.00 -0.74 -0.04 0.28 1.20 0.00 0.00 173.24 173.94 2d88 h SER 3 N 7.80 0.00 -1.92 5.45 0.02 -2.01 -3.51 113.55 119.38 2d88 h SER 3 Ca -0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 2d88 h SER 3 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2d88 h SER 3 CO 0.90 0.50 0.00 0.61 -1.14 0.00 0.00 176.83 177.71 2d88 n GLY 4 N 1.76 0.79 0.10 -3.77 0.00 -1.26 -4.88 105.19 97.92 2d88 n GLY 4 Ca -0.02 -2.03 -0.13 0.00 0.00 0.00 0.00 46.02 43.85 2d88 n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2d88 h SER 5 N 0.00 -0.11 -3.54 1.61 0.87 -2.06 -3.45 113.55 106.87 2d88 h SER 5 Ca 0.00 -0.26 -0.27 0.00 -1.23 0.00 0.00 61.79 60.03 2d88 h SER 5 Cb 0.00 0.03 -0.32 0.00 -0.44 0.00 0.00 62.40 61.67 2d88 h SER 5 CO 0.00 0.21 -0.68 -0.55 -0.53 0.00 0.00 176.83 175.28 2d88 s SER 6 N -5.37 0.00 0.00 6.23 0.15 -1.26 -4.91 113.70 108.54 2d88 s SER 6 Ca -0.15 0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.62 2d88 s SER 6 Cb 0.03 0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.37 2d88 s SER 6 CO 0.63 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 175.57 2d88 n GLY 7 N 3.97 1.35 3.57 9.45 0.00 -1.26 -5.08 105.19 117.18 2d88 n GLY 7 Ca -0.24 0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 2d88 n GLY 7 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d88 s VAL 8 N -0.77 3.76 0.58 1.61 1.01 -1.26 -4.97 120.40 120.36 2d88 s VAL 8 Ca 0.00 -0.87 -0.15 0.00 0.00 0.00 0.00 61.98 60.96 2d88 s VAL 8 Cb 0.00 -4.70 -0.05 0.00 0.00 0.00 0.00 36.38 31.63 2d88 s VAL 8 CO 0.00 -1.53 1.02 0.00 0.00 0.00 0.00 175.10 174.60 2d88 s ALA 9 N 7.21 2.92 1.08 5.51 0.00 -1.26 -5.05 121.76 132.16 2d88 s ALA 9 Ca 0.58 0.21 -0.16 0.00 0.00 0.00 0.00 51.96 52.58 2d88 s ALA 9 Cb -0.01 -3.16 0.23 0.00 0.00 0.00 0.00 23.12 20.18 2d88 s ALA 9 CO -0.01 -0.60 1.14 1.03 0.00 0.00 0.00 175.76 177.32 2d88 s ARG 10 N -4.33 -0.28 0.06 0.00 3.00 -1.26 -4.89 118.95 111.25 2d88 s ARG 10 Ca 0.60 0.07 -0.37 0.00 0.00 0.00 0.00 55.73 56.03 2d88 s ARG 10 Cb -0.13 -1.69 -0.19 0.00 0.00 0.00 0.00 34.95 32.94 2d88 s ARG 10 CO 0.39 -3.11 1.04 0.43 0.00 0.00 0.00 175.30 174.05 2d88 n SER 11 N -4.36 0.21 -4.79 0.23 7.64 -1.26 -4.93 113.62 106.36 2d88 n SER 11 Ca 0.11 1.15 -0.36 0.00 1.01 0.00 0.00 58.87 60.77 2d88 n SER 11 Cb 0.59 -1.00 -0.08 0.00 -1.01 0.00 0.00 64.21 62.72 2d88 n SER 11 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2d88 s SER 12 N -0.07 5.84 0.29 6.43 0.15 -1.26 -4.98 113.70 120.10 2d88 s SER 12 Ca 0.84 0.31 0.11 0.00 0.70 0.00 0.00 55.95 57.91 2d88 s SER 12 Cb -1.13 -1.78 0.93 0.00 -1.71 0.00 0.00 66.02 62.33 2d88 s SER 12 CO 0.55 0.39 1.32 0.29 1.20 0.00 0.00 173.24 176.99 2d88 n LYS 13 N 2.00 -0.06 0.35 5.44 5.02 -1.26 0.16 118.16 129.82 2d88 n LYS 13 Ca -0.19 1.20 -0.16 0.00 -2.02 0.00 0.00 58.31 57.14 2d88 n LYS 13 Cb 0.54 -2.05 -0.08 0.00 -0.02 0.00 0.00 35.03 33.43 2d88 n LYS 13 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2d88 h LEU 14 N 0.00 -0.77 -0.68 -0.35 5.85 -1.99 -3.25 115.31 114.13 2d88 h LEU 14 Ca 0.63 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.40 2d88 h LEU 14 Cb 1.54 0.20 -0.08 0.00 0.37 0.00 0.00 40.66 42.69 2d88 h LEU 14 CO -0.71 -0.44 -0.40 -0.11 -0.34 0.00 0.00 178.44 176.45 2d88 n LEU 15 N -5.42 -0.72 -0.25 2.25 7.94 0.12 -1.17 117.00 119.76 2d88 n LEU 15 Ca -0.13 1.41 -0.07 0.00 -1.11 0.00 0.00 56.01 56.12 2d88 n LEU 15 Cb 0.38 -0.26 -0.06 0.00 0.53 0.00 0.00 43.42 44.01 2d88 n LEU 15 CO 0.33 -1.08 0.43 0.61 -1.11 0.00 0.00 177.39 176.57 2d88 n GLY 16 N -1.17 -2.48 0.34 -3.96 0.00 -1.03 0.12 105.19 97.02 2d88 n GLY 16 Ca 0.01 0.88 0.10 0.00 0.00 0.00 0.00 46.02 47.02 2d88 n GLY 16 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2d88 h TRP 17 N 0.00 -0.27 -0.74 1.61 7.01 -1.17 1.02 115.95 123.41 2d88 h TRP 17 Ca 0.10 0.08 -0.05 0.00 2.11 0.00 0.00 58.89 61.12 2d88 h TRP 17 Cb 0.24 0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 27.54 2d88 h TRP 17 CO -0.89 -0.42 0.25 0.00 -2.79 0.00 0.00 178.44 174.59 2d88 h GLN 19 N 1.09 0.10 -0.23 0.00 4.20 0.27 0.33 115.11 120.88 2d88 h GLN 19 Ca 0.24 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.86 2d88 h GLN 19 Cb 0.27 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2d88 h GLN 19 CO -0.01 0.28 -0.10 0.00 -0.67 0.00 0.00 178.83 178.33 2d88 h ARG 20 N -0.10 0.48 0.15 1.46 2.47 -0.59 -2.22 114.38 116.03 2d88 h ARG 20 Ca 0.02 -0.20 -0.01 0.00 -1.26 0.00 0.00 59.98 58.53 2d88 h ARG 20 Cb 0.23 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.53 2d88 h ARG 20 CO -0.00 0.74 -0.07 1.96 0.56 0.00 0.00 179.97 183.16 2d88 h GLN 21 N 0.19 -0.20 0.00 0.04 1.08 -0.40 -2.14 115.11 113.68 2d88 h GLN 21 Ca 0.05 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 2d88 h GLN 21 Cb 0.60 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.07 2d88 h GLN 21 CO 0.03 0.01 0.00 0.25 -0.95 0.00 0.00 178.83 178.17 2d88 n THR 22 N -5.10 0.58 -2.05 -0.54 -2.24 0.12 -4.71 114.28 100.33 2d88 n THR 22 Ca -0.09 0.14 -0.42 0.00 -2.27 0.00 0.00 64.05 61.41 2d88 n THR 22 Cb 0.17 -0.97 -0.03 0.00 -2.10 0.00 0.00 70.33 67.40 2d88 n THR 22 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2d88 s ASP 23 N -2.45 6.70 0.00 3.42 2.15 -0.80 -2.94 116.67 122.75 2d88 s ASP 23 Ca 0.12 2.24 0.00 0.00 0.43 0.00 0.00 52.55 55.34 2d88 s ASP 23 Cb 0.07 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.15 2d88 s ASP 23 CO 0.16 -0.87 0.00 0.61 -0.17 0.00 0.00 175.17 174.90 2d88 n GLY 24 N 3.99 1.49 3.74 2.66 0.00 -1.26 -5.03 105.19 110.78 2d88 n GLY 24 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2d88 n GLY 24 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2d88 s TYR 25 N -1.20 2.13 -0.28 1.61 1.51 -1.15 -5.03 117.35 114.93 2d88 s TYR 25 Ca 0.00 0.82 -0.09 0.00 -1.01 0.00 0.00 57.07 56.79 2d88 s TYR 25 Cb 0.00 -3.40 -0.02 0.00 -0.11 0.00 0.00 41.96 38.43 2d88 s TYR 25 CO 0.00 -2.72 0.13 0.00 -1.11 0.00 0.00 175.55 171.85 2d88 s ALA 26 N -3.19 3.29 -0.49 3.71 0.00 -1.26 -4.34 121.76 119.48 2d88 s ALA 26 Ca 0.66 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 51.38 2d88 s ALA 26 Cb -0.15 -2.29 0.00 0.00 0.00 0.00 0.00 23.12 20.68 2d88 s ALA 26 CO 0.55 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 176.03 2d88 n GLY 27 N 4.98 0.73 2.85 0.00 0.00 -1.26 -4.95 105.19 107.54 2d88 n GLY 27 Ca -0.15 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 44.80 2d88 n GLY 27 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2d88 n VAL 28 N -2.85 3.65 -2.93 1.61 0.31 -1.26 -4.97 118.33 111.89 2d88 n VAL 28 Ca -0.05 -5.64 -0.44 0.00 -0.01 0.00 0.00 64.34 58.20 2d88 n VAL 28 Cb 0.16 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 2d88 n VAL 28 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2d88 n ASN 29 N -0.10 5.21 -4.61 4.52 5.15 -1.26 -4.79 115.26 119.37 2d88 n ASN 29 Ca 0.34 -2.98 -0.43 0.00 -0.60 0.00 0.00 54.58 50.91 2d88 n ASN 29 Cb 0.37 -1.58 -0.03 0.00 -0.53 0.00 0.00 39.78 38.01 2d88 n ASN 29 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2d88 s VAL 30 N 1.63 3.20 0.00 3.44 1.01 -1.26 -4.76 120.40 123.66 2d88 s VAL 30 Ca 0.43 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.62 2d88 s VAL 30 Cb -0.02 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.13 2d88 s VAL 30 CO 0.01 -0.12 0.11 1.07 0.00 0.00 0.00 175.10 176.16 2d88 n THR 31 N 7.13 0.00 -4.56 3.92 5.66 -1.26 -4.75 114.28 120.43 2d88 n THR 31 Ca 0.25 -0.33 -0.27 0.00 -3.05 0.00 0.00 64.05 60.65 2d88 n THR 31 Cb 0.45 1.11 -0.08 0.00 -1.55 0.00 0.00 70.33 70.25 2d88 n THR 31 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2d88 s ASP 32 N -0.45 3.04 -0.02 1.09 1.01 -1.26 -5.05 116.67 115.03 2d88 s ASP 32 Ca 0.00 -1.64 0.02 0.00 0.71 0.00 0.00 52.55 51.64 2d88 s ASP 32 Cb 0.00 0.44 0.04 0.00 1.01 0.00 0.00 42.92 44.41 2d88 s ASP 32 CO 0.00 -0.88 1.01 0.18 0.21 0.00 0.00 175.17 175.68 2d88 n LEU 33 N -0.96 1.98 0.00 1.23 4.77 -1.26 -4.56 117.00 118.20 2d88 n LEU 33 Ca -0.08 -2.08 0.00 0.00 -0.03 0.00 0.00 56.01 53.82 2d88 n LEU 33 Cb 0.66 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 2d88 n LEU 33 CO 0.37 0.51 0.00 0.35 -1.33 0.00 0.00 177.39 177.29 2d88 n THR 34 N -0.60 0.00 -0.11 -5.08 -2.24 -1.26 -4.50 114.28 100.48 2d88 n THR 34 Ca 0.02 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.69 2d88 n THR 34 Cb 0.31 -0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.15 2d88 n THR 34 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 2d88 h MET 35 N 0.00 0.60 -0.33 -0.78 2.86 -1.94 -2.20 114.93 113.14 2d88 h MET 35 Ca 0.00 -0.20 0.10 0.00 -2.06 0.00 0.00 59.70 57.54 2d88 h MET 35 Cb 0.00 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 2d88 h MET 35 CO 0.00 0.73 0.79 1.03 1.06 0.00 0.00 176.91 180.52 2d88 h SER 36 N 0.40 0.00 0.00 1.22 0.87 -1.91 1.38 113.55 115.50 2d88 h SER 36 Ca 0.09 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.63 2d88 h SER 36 Cb 0.48 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.43 2d88 h SER 36 CO 0.02 0.00 -1.76 0.79 -0.53 0.00 0.00 176.83 175.35 2d88 n TRP 37 N -3.00 0.00 -0.29 2.24 7.02 -1.02 -4.34 117.44 118.05 2d88 n TRP 37 Ca 0.07 0.00 0.06 0.00 -1.02 0.00 0.00 57.50 56.61 2d88 n TRP 37 Cb 0.91 -0.40 0.21 0.00 -2.42 0.00 0.00 31.31 29.62 2d88 n TRP 37 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 2d88 h LYS 38 N 0.00 0.63 -0.48 -0.99 1.57 0.25 0.72 116.57 118.28 2d88 h LYS 38 Ca -0.03 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2d88 h LYS 38 Cb 0.82 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 2d88 h LYS 38 CO 0.00 0.42 0.32 0.66 -0.57 0.00 0.00 179.45 180.28 2d88 h SER 39 N 0.65 0.50 0.00 0.86 4.64 -1.76 -3.45 113.55 114.99 2d88 h SER 39 Ca 0.45 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 2d88 h SER 39 Cb 0.59 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2d88 h SER 39 CO -0.34 0.35 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 2d88 n GLY 40 N -1.47 3.07 0.07 -0.77 0.00 0.24 -4.45 105.19 101.87 2d88 n GLY 40 Ca 0.05 -0.87 -0.02 0.00 0.00 0.00 0.00 46.02 45.17 2d88 n GLY 40 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d88 n LEU 41 N 0.00 -0.17 -0.07 0.99 4.77 -1.26 -1.54 117.00 119.72 2d88 n LEU 41 Ca 0.00 1.08 -0.02 0.00 -0.03 0.00 0.00 56.01 57.04 2d88 n LEU 41 Cb 0.00 -0.44 -0.02 0.00 -2.33 0.00 0.00 43.42 40.64 2d88 n LEU 41 CO 0.00 -0.63 0.35 0.00 -1.33 0.00 0.00 177.39 175.78 2d88 n ALA 42 N -3.01 -0.11 -0.32 -1.18 0.00 -1.26 0.14 120.51 114.77 2d88 n ALA 42 Ca 0.00 0.15 0.18 0.00 0.00 0.00 0.00 53.44 53.77 2d88 n ALA 42 Cb 0.04 0.24 0.37 0.00 0.00 0.00 0.00 19.45 20.10 2d88 n ALA 42 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2d88 h LEU 43 N 0.00 0.08 -0.84 0.00 5.85 -1.65 0.80 115.31 119.55 2d88 h LEU 43 Ca 0.03 0.21 -0.08 0.00 0.84 0.00 0.00 57.88 58.88 2d88 h LEU 43 Cb 0.07 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2d88 h LEU 43 CO -0.16 -0.21 -0.01 0.00 -0.34 0.00 0.00 178.44 177.72 2d88 h ALA 45 N 1.19 1.00 0.01 0.00 0.00 0.39 -1.59 119.26 120.26 2d88 h ALA 45 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2d88 h ALA 45 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2d88 h ALA 45 CO 0.02 0.00 -0.08 0.82 0.00 0.00 0.00 179.25 180.01 2d88 h ILE 46 N 0.00 1.74 -0.29 0.00 1.08 -0.65 -2.36 117.51 117.04 2d88 h ILE 46 Ca 0.00 -2.28 -0.07 0.00 -0.39 0.00 0.00 64.86 62.12 2d88 h ILE 46 Cb 0.24 3.29 -0.01 0.00 -3.07 0.00 0.00 36.82 37.26 2d88 h ILE 46 CO 0.00 0.60 -0.10 0.40 -0.69 0.00 0.00 178.15 178.36 2d88 h ILE 47 N -0.89 1.29 -0.28 -0.67 2.04 -1.43 -3.21 117.51 114.36 2d88 h ILE 47 Ca -0.01 -1.16 -0.02 0.00 1.00 0.00 0.00 64.86 64.67 2d88 h ILE 47 Cb 1.03 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.54 2d88 h ILE 47 CO 0.02 0.37 0.10 -0.74 0.00 0.00 0.00 178.15 177.90 2d88 h HIS 48 N 0.33 0.43 -0.78 1.37 2.76 -1.31 0.17 115.15 118.12 2d88 h HIS 48 Ca 0.07 -0.04 0.12 0.00 -2.20 0.00 0.00 60.37 58.32 2d88 h HIS 48 Cb 0.60 -0.13 -0.12 0.00 1.55 0.00 0.00 27.41 29.30 2d88 h HIS 48 CO 0.06 0.44 -0.31 -2.13 -1.30 0.00 0.00 177.93 174.69 2d88 n ARG 49 N -4.74 -0.19 -0.09 5.26 3.00 -0.89 -1.74 116.66 117.28 2d88 n ARG 49 Ca -0.02 1.20 -0.17 0.00 -0.00 0.00 0.00 57.85 58.86 2d88 n ARG 49 Cb 0.14 -1.78 -0.10 0.00 0.00 0.00 0.00 32.46 30.71 2d88 n ARG 49 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.63 179.51 2d88 h TYR 50 N 0.00 0.00 -3.47 -0.14 -1.99 -1.63 -3.44 116.97 106.30 2d88 h TYR 50 Ca 0.27 0.00 -0.64 0.00 2.00 0.00 0.00 58.73 60.36 2d88 h TYR 50 Cb 0.46 0.00 -0.40 0.00 2.00 0.00 0.00 36.73 38.79 2d88 h TYR 50 CO -0.69 1.14 -0.72 1.03 -0.00 0.00 0.00 178.16 178.93 2d88 s ARG 51 N -2.27 1.37 0.24 4.88 0.52 0.59 -4.95 118.95 119.33 2d88 s ARG 51 Ca -0.23 -1.83 0.23 0.00 -0.52 0.00 0.00 55.73 53.38 2d88 s ARG 51 Cb 0.03 -2.89 0.96 0.00 0.52 0.00 0.00 34.95 33.56 2d88 s ARG 51 CO 0.56 -0.99 1.69 -0.35 0.02 0.00 0.00 175.30 176.23 2d88 n PRO 52 N 4.15 0.18 0.15 3.54 -0.04 -0.71 -3.40 135.00 138.87 2d88 n PRO 52 Ca 0.03 0.42 -0.08 0.00 -0.04 0.00 0.00 63.50 63.83 2d88 n PRO 52 Cb 0.40 -1.85 -0.04 0.00 -0.04 0.00 0.00 33.50 31.97 2d88 n PRO 52 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2d88 h ASP 53 N 0.00 -0.39 -0.91 3.54 3.32 -1.90 -3.33 116.42 116.75 2d88 h ASP 53 Ca 0.00 -0.02 0.15 0.00 0.02 0.00 0.00 57.03 57.18 2d88 h ASP 53 Cb 0.35 0.10 -0.15 0.00 0.22 0.00 0.00 39.33 39.85 2d88 h ASP 53 CO 0.00 0.06 -0.33 0.18 -1.72 0.00 0.00 179.24 177.43 2d88 n LEU 54 N -5.08 -0.54 -4.19 1.55 4.77 -1.22 -4.27 117.00 108.02 2d88 n LEU 54 Ca -0.06 1.59 -0.28 0.00 -0.03 0.00 0.00 56.01 57.23 2d88 n LEU 54 Cb 0.19 -0.39 -0.16 0.00 -2.33 0.00 0.00 43.42 40.73 2d88 n LEU 54 CO 0.15 -1.45 -0.53 -0.51 -1.33 0.00 0.00 177.39 173.73 2d88 s ILE 55 N -5.92 1.67 -0.71 -0.08 2.07 -1.25 -4.95 121.20 112.03 2d88 s ILE 55 Ca -0.13 -0.85 -0.13 0.00 -1.41 0.00 0.00 60.65 58.13 2d88 s ILE 55 Cb 0.20 -1.43 0.18 0.00 0.13 0.00 0.00 42.46 41.54 2d88 s ILE 55 CO 0.66 0.47 0.63 -0.62 -1.91 0.00 0.00 174.94 174.18 2d88 s ASP 56 N -0.05 6.38 0.03 4.50 -1.08 -1.26 -4.62 116.67 120.57 2d88 s ASP 56 Ca -0.04 -2.42 -0.26 0.00 -0.52 0.00 0.00 52.55 49.31 2d88 s ASP 56 Cb -0.12 -2.16 -0.17 0.00 -1.46 0.00 0.00 42.92 39.01 2d88 s ASP 56 CO 0.03 -0.63 1.39 0.15 0.52 0.00 0.00 175.17 176.63 2d88 h PHE 57 N 8.04 -0.40 -1.46 -5.34 3.57 -1.91 -2.25 116.94 117.18 2d88 h PHE 57 Ca -0.03 -0.01 0.45 0.00 3.53 0.00 0.00 57.97 61.90 2d88 h PHE 57 Cb 1.05 0.13 -0.10 0.00 2.79 0.00 0.00 35.95 39.83 2d88 h PHE 57 CO 0.89 -0.12 1.00 0.22 -2.23 0.00 0.00 178.31 178.08 2d88 h ASP 58 N -0.66 0.15 0.04 0.41 1.82 -1.97 0.36 116.42 116.57 2d88 h ASP 58 Ca -0.04 0.07 -0.09 0.00 -0.39 0.00 0.00 57.03 56.58 2d88 h ASP 58 Cb 0.47 0.06 0.01 0.00 0.68 0.00 0.00 39.33 40.55 2d88 h ASP 58 CO 0.07 -0.08 -0.37 0.28 -1.61 0.00 0.00 179.24 177.54 2d88 h SER 59 N 0.07 0.25 -3.40 2.28 0.02 -1.92 -3.46 113.55 107.39 2d88 h SER 59 Ca 0.79 -0.90 -0.56 0.00 -0.84 0.00 0.00 61.79 60.28 2d88 h SER 59 Cb 2.78 -0.08 0.18 0.00 0.14 0.00 0.00 62.40 65.42 2d88 h SER 59 CO -0.22 1.12 -0.19 0.18 -1.14 0.00 0.00 176.83 176.59 2d88 n LEU 60 N -4.40 1.96 -4.07 5.07 4.77 0.13 -5.01 117.00 115.45 2d88 n LEU 60 Ca -0.11 0.65 -0.27 0.00 -0.03 0.00 0.00 56.01 56.25 2d88 n LEU 60 Cb 0.61 -1.29 -0.17 0.00 -2.33 0.00 0.00 43.42 40.24 2d88 n LEU 60 CO 0.41 -2.64 -0.49 -0.62 -1.33 0.00 0.00 177.39 172.72 2d88 s ASP 61 N -1.47 2.13 0.40 -1.43 2.15 -1.26 -4.96 116.67 112.23 2d88 s ASP 61 Ca 0.69 -0.37 0.24 0.00 0.43 0.00 0.00 52.55 53.55 2d88 s ASP 61 Cb -0.36 -0.98 1.33 0.00 -0.30 0.00 0.00 42.92 42.61 2d88 s ASP 61 CO 0.54 0.06 1.62 1.05 -0.17 0.00 0.00 175.17 178.27 2d88 h GLU 62 N 6.98 0.12 -0.64 4.34 9.09 -1.96 0.91 114.58 133.42 2d88 h GLU 62 Ca -0.28 -0.01 -0.01 0.00 0.05 0.00 0.00 59.36 59.11 2d88 h GLU 62 Cb 1.20 -0.03 -0.03 0.00 -1.65 0.00 0.00 28.75 28.24 2d88 h GLU 62 CO 0.47 0.08 0.34 -0.56 0.05 0.00 0.00 179.01 179.39 2d88 h GLN 63 N 0.12 0.89 -4.42 1.06 3.07 -1.96 -3.30 115.11 110.57 2d88 h GLN 63 Ca 0.81 -0.11 -0.66 0.00 0.09 0.00 0.00 58.65 58.78 2d88 h GLN 63 Cb 2.29 -0.17 0.03 0.00 0.08 0.00 0.00 27.48 29.71 2d88 h GLN 63 CO -0.54 0.68 2.42 0.09 0.09 0.00 0.00 178.83 181.57 2d88 n ASN 64 N -4.54 2.77 0.00 0.06 3.02 0.31 -4.76 115.26 112.13 2d88 n ASN 64 Ca 0.05 -2.71 0.00 0.00 -0.03 0.00 0.00 54.58 51.89 2d88 n ASN 64 Cb 0.09 -1.22 0.00 0.00 -0.61 0.00 0.00 39.78 38.04 2d88 n ASN 64 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2d88 n VAL 65 N 5.88 0.00 -0.40 2.41 0.31 -1.25 -1.74 118.33 123.55 2d88 n VAL 65 Ca 0.50 1.25 -0.08 0.00 -0.01 0.00 0.00 64.34 66.00 2d88 n VAL 65 Cb 0.40 -2.11 -0.05 0.00 -0.91 0.00 0.00 33.84 31.17 2d88 n VAL 65 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2d88 n GLU 66 N -1.45 -0.37 -0.23 5.55 4.71 -1.26 -1.21 120.64 126.38 2d88 n GLU 66 Ca 0.00 1.49 -0.07 0.00 -0.01 0.00 0.00 57.16 58.57 2d88 n GLU 66 Cb 0.00 -2.20 -0.06 0.00 -1.01 0.00 0.00 31.44 28.17 2d88 n GLU 66 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 2d88 h LYS 67 N 0.00 -0.03 -1.63 3.49 3.64 -1.89 1.23 116.57 121.37 2d88 h LYS 67 Ca 0.22 0.00 0.47 0.00 -1.27 0.00 0.00 60.65 60.07 2d88 h LYS 67 Cb 0.46 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.22 2d88 h LYS 67 CO -0.94 -0.02 1.25 -0.91 -2.27 0.00 0.00 179.45 176.56 2d88 h ASN 68 N -0.04 0.00 0.00 4.20 2.35 -0.29 0.42 115.58 122.22 2d88 h ASN 68 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2d88 h ASN 68 Cb 0.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.63 2d88 h ASN 68 CO -0.54 0.00 -0.18 0.59 -1.65 0.00 0.00 177.43 175.65 2d88 n ASN 69 N -3.88 0.63 -0.32 5.81 3.02 0.37 -3.61 115.26 117.27 2d88 n ASN 69 Ca 0.36 0.38 0.30 0.00 -0.03 0.00 0.00 54.58 55.60 2d88 n ASN 69 Cb 1.75 -0.63 0.55 0.00 -0.61 0.00 0.00 39.78 40.84 2d88 n ASN 69 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 2d88 n GLN 70 N -3.07 -0.05 0.11 3.52 -0.06 0.19 -0.48 117.38 117.54 2d88 n GLN 70 Ca -0.02 1.21 -0.04 0.00 -2.00 0.00 0.00 57.00 56.14 2d88 n GLN 70 Cb 0.09 -2.22 -0.02 0.00 -4.06 0.00 0.00 30.24 24.03 2d88 n GLN 70 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 2d88 h LEU 71 N 0.00 -0.24 -0.66 1.69 5.85 -1.13 -2.88 115.31 117.95 2d88 h LEU 71 Ca 0.77 0.01 0.14 0.00 0.84 0.00 0.00 57.88 59.64 2d88 h LEU 71 Cb 2.14 0.06 -0.12 0.00 0.37 0.00 0.00 40.66 43.12 2d88 h LEU 71 CO -0.63 -0.13 -0.04 0.00 -0.34 0.00 0.00 178.44 177.30 2d88 h ALA 72 N -1.79 0.60 -0.61 1.25 0.00 -1.07 0.63 119.26 118.27 2d88 h ALA 72 Ca -0.03 0.22 0.18 0.00 0.00 0.00 0.00 54.91 55.28 2d88 h ALA 72 Cb 0.22 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2d88 h ALA 72 CO 0.05 -0.41 0.55 0.74 0.00 0.00 0.00 179.25 180.17 2d88 h PHE 73 N 0.08 0.00 0.00 0.00 0.04 -0.84 0.24 116.94 116.46 2d88 h PHE 73 Ca 0.34 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.11 2d88 h PHE 73 Cb 0.56 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.71 2d88 h PHE 73 CO -0.43 0.00 -0.66 -3.47 -0.60 0.00 0.00 178.31 173.15 2d88 n ASP 74 N -3.91 1.85 -0.20 2.17 -0.08 0.18 -3.97 116.55 112.59 2d88 n ASP 74 Ca 0.12 0.54 -0.00 0.00 -1.51 0.00 0.00 54.79 53.94 2d88 n ASP 74 Cb 0.78 -0.83 0.08 0.00 2.34 0.00 0.00 41.12 43.49 2d88 n ASP 74 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2d88 h ILE 75 N -1.00 0.44 0.02 5.18 1.08 -0.27 0.29 117.51 123.25 2d88 h ILE 75 Ca 0.00 -0.02 0.00 0.00 -0.39 0.00 0.00 64.86 64.45 2d88 h ILE 75 Cb 0.66 0.38 -0.01 0.00 -3.07 0.00 0.00 36.82 34.79 2d88 h ILE 75 CO 0.00 0.01 -0.10 0.00 -0.69 0.00 0.00 178.15 177.37 2d88 h ALA 76 N 1.58 -0.63 -0.94 1.87 0.00 -0.75 0.04 119.26 120.44 2d88 h ALA 76 Ca 0.31 -0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.35 2d88 h ALA 76 Cb 0.49 0.55 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 2d88 h ALA 76 CO -0.57 -0.65 0.60 1.49 0.00 0.00 0.00 179.25 180.11 2d88 h GLU 77 N -0.14 0.74 -0.43 0.00 4.81 -1.38 1.96 114.58 120.14 2d88 h GLU 77 Ca -0.00 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.24 2d88 h GLU 77 Cb 0.15 -0.17 -0.05 0.00 0.63 0.00 0.00 28.75 29.31 2d88 h GLU 77 CO -0.06 0.49 0.13 0.87 -0.73 0.00 0.00 179.01 179.71 2d88 h LYS 78 N 0.76 0.28 0.00 1.92 1.79 0.21 -2.70 116.57 118.84 2d88 h LYS 78 Ca 0.49 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.94 2d88 h LYS 78 Cb 0.72 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.31 2d88 h LYS 78 CO -0.25 0.19 -0.15 0.39 -1.08 0.00 0.00 179.45 178.55 2d88 n GLU 79 N -5.03 0.08 -0.34 3.15 -0.58 -0.06 -4.67 120.64 113.18 2d88 n GLU 79 Ca 0.03 0.03 0.20 0.00 -0.42 0.00 0.00 57.16 57.01 2d88 n GLU 79 Cb 0.17 -0.49 0.43 0.00 -0.57 0.00 0.00 31.44 30.99 2d88 n GLU 79 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2d88 h LEU 80 N -0.15 0.59 0.00 -4.62 3.38 0.28 -3.45 115.31 111.34 2d88 h LEU 80 Ca 0.00 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2d88 h LEU 80 Cb 0.15 0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2d88 h LEU 80 CO 0.00 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.19 2d88 n GLY 81 N -1.35 0.77 3.50 0.83 0.00 0.71 -4.91 105.19 104.74 2d88 n GLY 81 Ca 0.28 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 2d88 n GLY 81 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d88 s ILE 82 N -2.20 4.37 0.26 -0.61 1.01 -1.25 -4.79 121.20 117.98 2d88 s ILE 82 Ca 0.00 0.06 -0.31 0.00 0.00 0.00 0.00 60.65 60.40 2d88 s ILE 82 Cb 0.00 -4.58 -0.12 0.00 0.01 0.00 0.00 42.46 37.77 2d88 s ILE 82 CO 0.00 -1.23 1.65 -0.24 0.00 0.00 0.00 174.94 175.13 2d88 n SER 83 N 7.54 3.95 -4.76 3.58 2.88 -1.26 -2.97 113.62 122.58 2d88 n SER 83 Ca -0.00 1.11 -0.41 0.00 -1.33 0.00 0.00 58.87 58.24 2d88 n SER 83 Cb 0.47 -1.59 -0.03 0.00 -0.75 0.00 0.00 64.21 62.31 2d88 n SER 83 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2d88 s PRO 84 N 0.13 4.44 0.14 -1.46 0.04 -1.26 -4.95 135.00 132.08 2d88 s PRO 84 Ca 0.68 2.05 0.09 0.00 0.04 0.00 0.00 61.00 63.86 2d88 s PRO 84 Cb -0.49 -3.14 -0.17 0.00 0.04 0.00 0.00 34.50 30.73 2d88 s PRO 84 CO 0.42 -0.11 1.28 -0.84 0.04 0.00 0.00 177.00 177.79 2d88 h ILE 85 N 3.30 1.54 -3.46 0.56 3.07 -1.95 -3.47 117.51 117.10 2d88 h ILE 85 Ca -0.47 -3.20 -0.04 0.00 1.55 0.00 0.00 64.86 62.71 2d88 h ILE 85 Cb 1.22 2.76 -0.10 0.00 -0.27 0.00 0.00 36.82 40.43 2d88 h ILE 85 CO 0.70 0.88 -0.05 0.00 -1.05 0.00 0.00 178.15 178.63 2d88 s MET 86 N -2.75 1.42 0.34 0.16 0.23 -1.26 -5.17 119.30 112.27 2d88 s MET 86 Ca 0.01 -1.02 -0.07 0.00 -1.03 0.00 0.00 55.69 53.58 2d88 s MET 86 Cb 0.10 0.49 -0.06 0.00 -1.53 0.00 0.00 34.83 33.83 2d88 s MET 86 CO 0.81 -0.59 0.64 0.95 -2.03 0.00 0.00 175.02 174.80 2d88 s THR 87 N -3.93 4.93 0.23 3.16 -4.23 -1.26 -4.94 115.64 109.60 2d88 s THR 87 Ca 0.14 0.28 -0.09 0.00 -1.18 0.00 0.00 61.69 60.83 2d88 s THR 87 Cb -0.01 -3.74 0.24 0.00 1.34 0.00 0.00 72.50 70.34 2d88 s THR 87 CO 0.01 -0.41 1.64 1.23 -0.54 0.00 0.00 174.62 176.56 2d88 h GLY 88 N 1.48 0.73 0.58 3.99 0.00 -1.85 -0.90 103.07 107.10 2d88 h GLY 88 Ca -0.47 0.11 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 2d88 h GLY 88 CO 0.65 -0.25 -0.45 1.70 0.00 0.00 0.00 176.54 178.20 2d88 h LYS 89 N 0.10 -0.89 -0.99 4.80 1.63 -1.94 -1.47 116.57 117.81 2d88 h LYS 89 Ca 0.37 0.06 0.23 0.00 -0.85 0.00 0.00 60.65 60.46 2d88 h LYS 89 Cb 0.62 0.20 -0.09 0.00 -0.60 0.00 0.00 32.23 32.37 2d88 h LYS 89 CO -0.61 -0.59 0.64 0.93 -3.45 0.00 0.00 179.45 176.37 2d88 h GLU 90 N -0.92 0.43 -0.38 1.90 5.08 -1.76 0.37 114.58 119.30 2d88 h GLU 90 Ca -0.05 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.20 2d88 h GLU 90 Cb 0.80 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 2d88 h GLU 90 CO -0.05 0.29 -0.12 1.98 -1.00 0.00 0.00 179.01 180.10 2d88 h MET 91 N 0.45 0.67 0.04 2.33 4.05 -0.40 -0.09 114.93 121.98 2d88 h MET 91 Ca 0.55 -0.21 -0.27 0.00 -0.28 0.00 0.00 59.70 59.49 2d88 h MET 91 Cb 1.31 -0.06 0.02 0.00 -0.80 0.00 0.00 31.60 32.07 2d88 h MET 91 CO -0.26 0.77 -1.10 0.00 0.23 0.00 0.00 176.91 176.55 2d88 h ALA 92 N 1.26 0.14 0.18 0.39 0.00 0.61 -3.34 119.26 118.49 2d88 h ALA 92 Ca 0.10 -0.73 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 2d88 h ALA 92 Cb 0.57 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2d88 h ALA 92 CO 0.04 0.73 -0.08 0.77 0.00 0.00 0.00 179.25 180.71 2d88 h SER 93 N 0.30 -0.20 -3.01 0.00 0.02 -0.73 -3.44 113.55 106.50 2d88 h SER 93 Ca -0.14 -0.28 -0.58 0.00 -0.84 0.00 0.00 61.79 59.95 2d88 h SER 93 Cb 1.75 0.05 0.12 0.00 0.14 0.00 0.00 62.40 64.47 2d88 h SER 93 CO 0.21 0.20 0.25 0.55 -1.14 0.00 0.00 176.83 176.89 2d88 n VAL 94 N -5.02 2.25 0.17 2.27 3.14 -0.06 -4.89 118.33 116.19 2d88 n VAL 94 Ca -0.09 -0.50 0.05 0.00 -2.96 0.00 0.00 64.34 60.85 2d88 n VAL 94 Cb 0.24 -1.23 0.15 0.00 -1.06 0.00 0.00 33.84 31.95 2d88 n VAL 94 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2d88 h GLY 95 N 1.88 0.00 -5.76 7.55 0.00 -1.87 -3.46 103.07 101.41 2d88 h GLY 95 Ca -0.44 0.00 0.13 0.00 0.00 0.00 0.00 47.33 47.02 2d88 h GLY 95 CO 0.59 0.00 0.32 1.85 0.00 0.00 0.00 176.54 179.30 2d88 s GLU 96 N -3.17 0.37 0.41 4.80 2.12 -1.26 -5.03 118.70 116.93 2d88 s GLU 96 Ca 0.03 0.71 -0.25 0.00 0.36 0.00 0.00 54.97 55.83 2d88 s GLU 96 Cb 0.08 0.20 -0.08 0.00 0.26 0.00 0.00 34.13 34.59 2d88 s GLU 96 CO 0.71 -0.09 1.19 -1.25 -0.54 0.00 0.00 175.26 175.27 2d88 s PRO 97 N 1.71 4.00 -0.26 4.30 0.04 -1.26 -4.91 135.00 138.61 2d88 s PRO 97 Ca -0.07 1.87 -0.29 0.00 0.04 0.00 0.00 61.00 62.55 2d88 s PRO 97 Cb -0.05 -2.65 -0.06 0.00 0.04 0.00 0.00 34.50 31.78 2d88 s PRO 97 CO -0.16 -0.37 2.24 -3.47 0.04 0.00 0.00 177.00 175.27 2d88 n ASP 98 N 0.00 2.99 -0.07 6.66 2.03 -1.26 -4.84 116.55 122.07 2d88 n ASP 98 Ca 0.05 0.19 -0.02 0.00 0.52 0.00 0.00 54.79 55.53 2d88 n ASP 98 Cb 0.46 -1.51 -0.02 0.00 -0.72 0.00 0.00 41.12 39.34 2d88 n ASP 98 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2d88 n LYS 99 N 8.69 -0.07 -0.37 -0.67 0.00 -1.26 -0.02 118.16 124.46 2d88 n LYS 99 Ca 0.33 0.80 -0.04 0.00 0.00 0.00 0.00 58.31 59.40 2d88 n LYS 99 Cb 0.41 -1.20 0.00 0.00 0.00 0.00 0.00 35.03 34.25 2d88 n LYS 99 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2d88 h LEU 100 N 0.00 -1.60 -0.90 3.14 3.38 -1.91 0.70 115.31 118.12 2d88 h LEU 100 Ca 0.03 0.31 0.09 0.00 0.09 0.00 0.00 57.88 58.39 2d88 h LEU 100 Cb 0.07 0.79 -0.07 0.00 0.09 0.00 0.00 40.66 41.54 2d88 h LEU 100 CO -0.15 -0.28 0.55 0.28 0.09 0.00 0.00 178.44 178.93 2d88 h SER 101 N -0.02 0.83 0.71 -0.43 0.02 -0.81 0.16 113.55 114.00 2d88 h SER 101 Ca 0.29 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.24 2d88 h SER 101 Cb 0.55 -0.13 0.01 0.00 0.14 0.00 0.00 62.40 62.97 2d88 h SER 101 CO -0.95 0.49 -0.34 0.24 -1.14 0.00 0.00 176.83 175.13 2d88 h MET 102 N 0.94 -0.92 -0.25 3.45 2.86 0.35 0.58 114.93 121.94 2d88 h MET 102 Ca 0.42 0.06 0.06 0.00 -2.06 0.00 0.00 59.70 58.18 2d88 h MET 102 Cb 0.32 0.21 -0.06 0.00 0.06 0.00 0.00 31.60 32.13 2d88 h MET 102 CO -0.22 -0.61 -0.14 0.28 1.06 0.00 0.00 176.91 177.28 2d88 h VAL 103 N -1.05 0.58 0.10 -2.22 2.07 -0.61 -0.36 116.25 114.77 2d88 h VAL 103 Ca -0.10 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 2d88 h VAL 103 Cb 0.73 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2d88 h VAL 103 CO 0.16 0.00 -0.08 0.24 0.02 0.00 0.00 177.57 177.91 2d88 h MET 104 N -0.11 -0.17 -0.93 1.57 2.86 -0.71 0.11 114.93 117.56 2d88 h MET 104 Ca 0.14 0.01 0.22 0.00 -2.06 0.00 0.00 59.70 58.01 2d88 h MET 104 Cb 0.32 0.04 -0.17 0.00 0.06 0.00 0.00 31.60 31.84 2d88 h MET 104 CO -0.32 -0.11 -0.09 -0.92 1.06 0.00 0.00 176.91 176.53 2d88 h TYR 105 N -0.17 -0.24 0.07 -0.22 3.20 -0.82 0.22 116.97 119.02 2d88 h TYR 105 Ca -0.01 0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 2d88 h TYR 105 Cb 0.14 0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 2d88 h TYR 105 CO -0.00 -0.39 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.00 2d88 h LEU 106 N 0.02 -0.14 -0.77 2.82 3.38 -0.88 -2.91 115.31 116.82 2d88 h LEU 106 Ca 0.51 0.01 0.15 0.00 0.09 0.00 0.00 57.88 58.64 2d88 h LEU 106 Cb 0.92 0.05 -0.14 0.00 0.09 0.00 0.00 40.66 41.57 2d88 h LEU 106 CO -0.90 -0.09 -0.21 0.41 0.09 0.00 0.00 178.44 177.74 2d88 n THR 107 N -5.16 -0.34 -0.33 0.22 -1.04 0.77 0.12 114.28 108.52 2d88 n THR 107 Ca -0.07 1.78 0.13 0.00 -2.04 0.00 0.00 64.05 63.84 2d88 n THR 107 Cb 0.09 -2.44 0.27 0.00 -1.82 0.00 0.00 70.33 66.42 2d88 n THR 107 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 2d88 h GLN 108 N 0.00 0.02 0.69 -2.82 4.20 -1.40 0.17 115.11 115.98 2d88 h GLN 108 Ca 0.36 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.03 2d88 h GLN 108 Cb 0.55 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.33 2d88 h GLN 108 CO -0.79 0.02 -0.33 0.74 -0.67 0.00 0.00 178.83 177.79 2d88 h PHE 109 N 0.03 -0.87 -0.43 2.96 -1.00 0.77 -2.65 116.94 115.74 2d88 h PHE 109 Ca 0.57 -0.02 0.06 0.00 2.81 0.00 0.00 57.97 61.39 2d88 h PHE 109 Cb 1.14 0.29 -0.09 0.00 3.61 0.00 0.00 35.95 40.90 2d88 h PHE 109 CO -0.50 -0.54 -0.50 -0.92 -1.61 0.00 0.00 178.31 174.24 2d88 h TYR 110 N -1.10 -1.50 -0.30 -0.55 3.20 -1.03 0.73 116.97 116.42 2d88 h TYR 110 Ca -0.10 0.08 0.09 0.00 3.14 0.00 0.00 58.73 61.94 2d88 h TYR 110 Cb 0.72 0.72 -0.01 0.00 1.54 0.00 0.00 36.73 39.69 2d88 h TYR 110 CO 0.03 -0.47 0.50 0.93 -1.64 0.00 0.00 178.16 177.51 2d88 h GLU 111 N -0.35 0.00 0.12 1.82 5.08 -0.80 0.80 114.58 121.25 2d88 h GLU 111 Ca 0.11 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.21 2d88 h GLU 111 Cb 0.59 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.87 2d88 h GLU 111 CO -0.60 0.00 -1.09 1.98 -1.00 0.00 0.00 179.01 178.29 2d88 h MET 112 N 0.00 0.52 -0.57 2.33 4.05 0.83 -3.34 114.93 118.75 2d88 h MET 112 Ca 0.14 -0.73 -0.39 0.00 -0.28 0.00 0.00 59.70 58.44 2d88 h MET 112 Cb 1.14 0.25 -0.27 0.00 -0.80 0.00 0.00 31.60 31.93 2d88 h MET 112 CO -0.00 1.32 -0.37 1.19 0.23 0.00 0.00 176.91 179.29 2d88 n PHE 113 N -3.92 1.97 0.09 1.39 3.72 0.73 -4.66 117.46 116.78 2d88 n PHE 113 Ca -0.14 -2.07 -0.18 0.00 -0.05 0.00 0.00 57.45 55.02 2d88 n PHE 113 Cb 0.92 -0.51 -0.14 0.00 -0.94 0.00 0.00 39.48 38.81 2d88 n PHE 113 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2d88 h LYS 114 N 1.68 0.30 0.13 -1.08 2.10 0.30 -3.32 116.57 116.67 2d88 h LYS 114 Ca 0.31 -0.51 -0.01 0.00 -2.00 0.00 0.00 60.65 58.44 2d88 h LYS 114 Cb 1.39 0.19 0.00 0.00 -0.90 0.00 0.00 32.23 32.92 2d88 h LYS 114 CO 0.66 1.20 -0.06 0.38 -2.00 0.00 0.00 179.45 179.63 2d88 h ASP 115 N 0.08 -0.14 -1.58 7.07 2.03 -1.83 -3.24 116.42 118.80 2d88 h ASP 115 Ca -0.22 -0.39 0.48 0.00 -0.73 0.00 0.00 57.03 56.17 2d88 h ASP 115 Cb 2.03 0.04 -0.10 0.00 -0.83 0.00 0.00 39.33 40.47 2d88 h ASP 115 CO 0.19 0.46 1.09 0.28 -1.03 0.00 0.00 179.24 180.23 2d88 h SER 116 N -0.90 0.11 -4.07 4.15 0.02 -1.88 -3.40 113.55 107.59 2d88 h SER 116 Ca -0.02 0.06 -0.50 0.00 -0.84 0.00 0.00 61.79 60.50 2d88 h SER 116 Cb 0.52 0.06 0.06 0.00 0.14 0.00 0.00 62.40 63.18 2d88 h SER 116 CO 0.03 -0.08 0.30 -0.83 -1.14 0.00 0.00 176.83 175.11 2d88 s GLY 117 N -4.02 1.60 0.32 -3.77 0.00 -1.23 -4.99 107.32 95.25 2d88 s GLY 117 Ca -0.06 -0.32 0.11 0.00 0.00 0.00 0.00 44.72 44.45 2d88 s GLY 117 CO 0.85 -0.07 1.73 -0.56 0.00 0.00 0.00 173.10 175.05 2d88 h PRO 118 N -0.20 0.01 -6.71 2.90 0.13 -1.84 -3.44 132.00 122.85 2d88 h PRO 118 Ca -0.45 -0.01 -0.50 0.00 -0.87 0.00 0.00 66.00 64.17 2d88 h PRO 118 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2d88 h PRO 118 CO 0.62 0.49 0.07 -1.12 -0.23 0.00 0.00 178.00 177.83 2d88 s SER 119 N -6.89 6.70 0.11 1.44 0.01 -1.26 -5.09 113.70 108.71 2d88 s SER 119 Ca -0.02 1.19 -0.07 0.00 1.31 0.00 0.00 55.95 58.36 2d88 s SER 119 Cb 0.14 -2.34 -0.01 0.00 0.21 0.00 0.00 66.02 64.02 2d88 s SER 119 CO 0.74 -0.23 0.19 -0.55 0.41 0.00 0.00 173.24 173.80 2d88 s SER 120 N -2.49 0.14 0.00 2.44 0.15 -1.26 -4.68 113.70 108.01 2d88 s SER 120 Ca 0.53 -0.79 0.00 0.00 0.70 0.00 0.00 55.95 56.39 2d88 s SER 120 Cb -0.10 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 2d88 s SER 120 CO 0.21 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.49