#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 6.75 -0.04 1.61 0.15 -1.26 -4.91 113.70 116.00 2d88 s SER 2 Ca 0.00 1.57 -0.32 0.00 0.70 0.00 0.00 55.95 57.90 2d88 s SER 2 Cb 0.00 -2.50 -0.16 0.00 -1.71 0.00 0.00 66.02 61.65 2d88 s SER 2 CO 0.00 -0.46 0.89 -1.20 1.20 0.00 0.00 173.24 173.66 2d88 n SER 3 N -1.12 0.10 0.00 5.45 7.64 -1.26 -2.59 113.62 121.84 2d88 n SER 3 Ca 0.06 0.92 0.00 0.00 1.01 0.00 0.00 58.87 60.86 2d88 n SER 3 Cb 0.54 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 2d88 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d88 n GLY 4 N 1.40 3.47 3.57 0.23 0.00 -1.26 -5.09 105.19 107.52 2d88 n GLY 4 Ca 0.17 -1.04 -0.53 0.00 0.00 0.00 0.00 46.02 44.62 2d88 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d88 n SER 5 N 0.00 1.36 -4.81 1.61 7.64 -1.07 -4.94 113.62 113.41 2d88 n SER 5 Ca 0.00 1.13 -0.29 0.00 1.01 0.00 0.00 58.87 60.72 2d88 n SER 5 Cb 0.00 -1.15 0.12 0.00 -1.01 0.00 0.00 64.21 62.17 2d88 n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2d88 s SER 6 N 0.36 3.88 -0.14 6.43 1.04 -1.26 -4.90 113.70 119.11 2d88 s SER 6 Ca 0.84 0.87 -0.39 0.00 0.48 0.00 0.00 55.95 57.76 2d88 s SER 6 Cb -0.99 -1.40 -0.18 0.00 0.10 0.00 0.00 66.02 63.55 2d88 s SER 6 CO 0.49 -2.31 1.13 0.61 0.98 0.00 0.00 173.24 174.14 2d88 n GLY 7 N -2.68 -0.12 3.12 7.32 0.00 -1.26 -4.95 105.19 106.61 2d88 n GLY 7 Ca 0.07 0.77 -0.12 0.00 0.00 0.00 0.00 46.02 46.73 2d88 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d88 s VAL 8 N 0.84 -0.02 0.23 1.61 0.11 -1.26 -5.05 120.40 116.87 2d88 s VAL 8 Ca 0.87 0.06 -0.08 0.00 -2.93 0.00 0.00 61.98 59.90 2d88 s VAL 8 Cb -1.23 -0.39 0.22 0.00 -1.53 0.00 0.00 36.38 33.46 2d88 s VAL 8 CO 0.59 0.03 1.66 0.00 -3.33 0.00 0.00 175.10 174.05 2d88 h ALA 9 N 6.40 0.74 -1.08 1.54 0.00 -2.04 -3.43 119.26 121.39 2d88 h ALA 9 Ca -0.32 0.19 -0.69 0.00 0.00 0.00 0.00 54.91 54.09 2d88 h ALA 9 Cb 1.18 0.32 0.09 0.00 0.00 0.00 0.00 17.79 19.38 2d88 h ALA 9 CO 0.35 -0.38 -0.32 -2.13 0.00 0.00 0.00 179.25 176.76 2d88 n ARG 10 N -5.26 0.12 -3.13 0.00 0.00 -1.26 -2.22 116.66 104.92 2d88 n ARG 10 Ca 0.11 0.04 -0.14 0.00 -0.00 0.00 0.00 57.85 57.87 2d88 n ARG 10 Cb 0.41 -1.20 0.07 0.00 0.00 0.00 0.00 32.46 31.74 2d88 n ARG 10 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2d88 n SER 11 N 1.85 -3.33 -4.59 6.15 7.64 -1.26 -4.93 113.62 115.14 2d88 n SER 11 Ca 0.18 -0.55 -0.38 0.00 1.01 0.00 0.00 58.87 59.13 2d88 n SER 11 Cb 0.21 -4.42 0.04 0.00 -1.01 0.00 0.00 64.21 59.04 2d88 n SER 11 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2d88 n SER 12 N -2.85 0.58 -0.16 6.43 7.64 -0.94 -4.71 113.62 119.60 2d88 n SER 12 Ca -0.18 0.84 -0.03 0.00 1.01 0.00 0.00 58.87 60.50 2d88 n SER 12 Cb 0.63 -1.35 0.03 0.00 -1.01 0.00 0.00 64.21 62.51 2d88 n SER 12 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2d88 h LYS 13 N 0.64 -0.04 0.00 1.43 6.56 -1.92 -1.55 116.57 121.70 2d88 h LYS 13 Ca -0.47 0.00 0.02 0.00 -1.06 0.00 0.00 60.65 59.14 2d88 h LYS 13 Cb 1.36 0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 33.01 2d88 h LYS 13 CO 0.51 -0.03 -0.11 1.25 -2.06 0.00 0.00 179.45 179.02 2d88 h LEU 14 N -0.04 -0.30 -0.35 2.94 5.85 -2.00 -3.04 115.31 118.36 2d88 h LEU 14 Ca 0.24 0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.05 2d88 h LEU 14 Cb 0.41 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.50 2d88 h LEU 14 CO -0.54 -0.15 -0.49 0.25 -0.34 0.00 0.00 178.44 177.17 2d88 h LEU 15 N -0.18 -1.62 -0.87 2.25 5.85 -1.65 -2.09 115.31 116.99 2d88 h LEU 15 Ca 0.04 0.21 0.09 0.00 0.84 0.00 0.00 57.88 59.06 2d88 h LEU 15 Cb 0.23 0.66 -0.11 0.00 0.37 0.00 0.00 40.66 41.81 2d88 h LEU 15 CO -0.10 -0.35 -0.48 0.61 -0.34 0.00 0.00 178.44 177.77 2d88 n GLY 16 N -1.33 -2.19 0.36 3.75 0.00 -0.81 -0.28 105.19 104.70 2d88 n GLY 16 Ca -0.03 1.03 -0.05 0.00 0.00 0.00 0.00 46.02 46.96 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 -1.04 -0.76 1.61 7.01 -1.35 0.34 115.95 121.76 2d88 h TRP 17 Ca 0.17 0.08 0.02 0.00 2.11 0.00 0.00 58.89 61.27 2d88 h TRP 17 Cb 0.39 0.55 -0.04 0.00 -2.10 0.00 0.00 29.16 27.96 2d88 h TRP 17 CO -0.88 -0.40 0.50 0.00 -2.79 0.00 0.00 178.44 174.88 2d88 h GLN 19 N 0.99 0.00 0.14 0.00 4.20 0.20 0.43 115.11 121.06 2d88 h GLN 19 Ca 0.29 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.65 2d88 h GLN 19 Cb -0.04 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 2d88 h GLN 19 CO -0.07 0.15 -1.88 0.00 -0.67 0.00 0.00 178.83 176.35 2d88 h ARG 20 N 0.00 0.29 0.18 1.46 3.08 0.22 -3.22 114.38 116.40 2d88 h ARG 20 Ca -0.00 -0.50 -0.01 0.00 0.07 0.00 0.00 59.98 59.54 2d88 h ARG 20 Cb 0.27 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2d88 h ARG 20 CO 0.02 1.24 -0.09 1.96 -1.07 0.00 0.00 179.97 182.03 2d88 h GLN 21 N 0.02 -0.24 0.00 0.04 1.08 -0.39 -3.09 115.11 112.53 2d88 h GLN 21 Ca -0.40 0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 56.82 2d88 h GLN 21 Cb 2.01 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 29.50 2d88 h GLN 21 CO 0.10 0.17 -0.00 1.79 -0.95 0.00 0.00 178.83 179.93 2d88 h THR 22 N -0.77 0.09 -1.85 -0.54 1.35 -0.36 -3.44 112.91 107.40 2d88 h THR 22 Ca -0.03 -0.05 -0.65 0.00 -0.55 0.00 0.00 66.41 65.14 2d88 h THR 22 Cb 0.51 1.04 0.05 0.00 -1.73 0.00 0.00 68.15 68.03 2d88 h THR 22 CO 0.04 0.00 0.60 -0.67 -0.25 0.00 0.00 175.52 175.24 2d88 n ASP 23 N -3.21 2.14 0.00 5.36 2.03 -1.17 -2.32 116.55 119.38 2d88 n ASP 23 Ca -0.03 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.38 2d88 n ASP 23 Cb 0.09 -1.26 0.00 0.00 -0.72 0.00 0.00 41.12 39.23 2d88 n ASP 23 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2d88 n GLY 24 N 2.93 2.62 3.14 0.27 0.00 -1.26 -5.03 105.19 107.86 2d88 n GLY 24 Ca 0.19 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 2d88 n GLY 24 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2d88 n TYR 25 N 0.00 -3.79 -4.93 1.61 4.02 -0.98 -5.03 117.16 108.07 2d88 n TYR 25 Ca 0.00 -0.82 -0.32 0.00 -0.01 0.00 0.00 57.90 56.75 2d88 n TYR 25 Cb 0.00 -1.21 -0.17 0.00 -0.02 0.00 0.00 39.34 37.94 2d88 n TYR 25 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2d88 s ALA 26 N -2.21 2.14 0.00 -0.72 0.00 -1.26 -4.69 121.76 115.02 2d88 s ALA 26 Ca 0.66 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.64 2d88 s ALA 26 Cb -0.11 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.13 2d88 s ALA 26 CO 0.55 0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.85 2d88 n GLY 27 N 3.80 2.42 0.06 0.00 0.00 -1.26 -4.87 105.19 105.34 2d88 n GLY 27 Ca -0.20 -0.11 -0.02 0.00 0.00 0.00 0.00 46.02 45.69 2d88 n GLY 27 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2d88 h VAL 28 N 0.00 0.00 -6.73 1.61 2.07 -1.95 -3.45 116.25 107.81 2d88 h VAL 28 Ca 0.00 0.00 -0.46 0.00 0.82 0.00 0.00 66.70 67.06 2d88 h VAL 28 Cb 0.00 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.66 2d88 h VAL 28 CO 0.00 0.00 -0.73 -3.20 0.02 0.00 0.00 177.57 173.66 2d88 n ASN 29 N -2.91 -0.45 -4.03 0.57 5.15 -1.26 -4.55 115.26 107.79 2d88 n ASN 29 Ca -0.01 -0.96 -0.57 0.00 -0.60 0.00 0.00 54.58 52.44 2d88 n ASN 29 Cb 0.05 -1.18 -0.10 0.00 -0.53 0.00 0.00 39.78 38.02 2d88 n ASN 29 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2d88 n VAL 30 N -3.79 0.00 -0.02 3.44 0.31 -1.26 -4.78 118.33 112.22 2d88 n VAL 30 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 2d88 n VAL 30 Cb 0.49 -0.45 -0.06 0.00 -0.91 0.00 0.00 33.84 32.91 2d88 n VAL 30 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2d88 n THR 31 N 5.07 0.26 -4.02 2.52 -2.24 -1.26 -4.92 114.28 109.69 2d88 n THR 31 Ca 0.42 -0.25 -0.10 0.00 -2.27 0.00 0.00 64.05 61.86 2d88 n THR 31 Cb -0.04 -0.27 -0.07 0.00 -2.10 0.00 0.00 70.33 67.85 2d88 n THR 31 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2d88 s ASP 32 N -3.42 0.04 -0.47 3.42 1.01 -1.26 -5.05 116.67 110.93 2d88 s ASP 32 Ca -0.03 -0.99 0.03 0.00 0.71 0.00 0.00 52.55 52.27 2d88 s ASP 32 Cb 0.03 0.46 0.52 0.00 1.01 0.00 0.00 42.92 44.94 2d88 s ASP 32 CO 0.31 -0.94 1.74 0.18 0.21 0.00 0.00 175.17 176.67 2d88 n LEU 33 N -0.26 6.23 0.00 1.23 4.77 -1.26 -4.23 117.00 123.49 2d88 n LEU 33 Ca -0.04 -4.10 0.00 0.00 -0.03 0.00 0.00 56.01 51.84 2d88 n LEU 33 Cb 0.63 -0.76 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2d88 n LEU 33 CO 0.25 1.44 0.00 0.35 -1.33 0.00 0.00 177.39 178.10 2d88 n THR 34 N -0.99 0.00 -0.04 -5.08 -2.24 -1.26 -4.66 114.28 100.01 2d88 n THR 34 Ca 0.53 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 62.18 2d88 n THR 34 Cb 1.04 -0.21 -0.11 0.00 -2.10 0.00 0.00 70.33 68.95 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 -0.02 -1.91 -0.78 2.86 -1.95 -2.50 114.93 110.62 2d88 h MET 35 Ca 0.00 0.00 0.56 0.00 -2.06 0.00 0.00 59.70 58.21 2d88 h MET 35 Cb 0.00 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 31.58 2d88 h MET 35 CO 0.00 0.73 1.36 1.03 1.06 0.00 0.00 176.91 181.09 2d88 h SER 36 N -0.85 0.03 0.20 1.22 0.87 -1.94 1.16 113.55 114.24 2d88 h SER 36 Ca -0.00 0.02 -0.35 0.00 -1.23 0.00 0.00 61.79 60.23 2d88 h SER 36 Cb 0.76 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.71 2d88 h SER 36 CO 0.00 -0.04 -2.01 0.79 -0.53 0.00 0.00 176.83 175.04 2d88 n TRP 37 N -4.05 0.93 -0.33 2.24 7.02 -1.23 -4.23 117.44 117.80 2d88 n TRP 37 Ca 0.44 0.24 0.33 0.00 -1.02 0.00 0.00 57.50 57.49 2d88 n TRP 37 Cb 1.97 -1.14 0.60 0.00 -2.42 0.00 0.00 31.31 30.32 2d88 n TRP 37 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2d88 n LYS 38 N -3.28 -0.06 -0.24 -0.99 5.02 0.40 0.15 118.16 119.16 2d88 n LYS 38 Ca -0.30 1.37 -0.03 0.00 -2.02 0.00 0.00 58.31 57.34 2d88 n LYS 38 Cb 1.05 -2.48 0.09 0.00 -0.02 0.00 0.00 35.03 33.67 2d88 n LYS 38 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2d88 h SER 39 N 0.00 0.67 0.00 4.39 0.87 -1.70 -3.43 113.55 114.35 2d88 h SER 39 Ca 0.85 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 61.42 2d88 h SER 39 Cb 2.29 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 64.12 2d88 h SER 39 CO -0.75 0.45 0.00 0.61 -0.53 0.00 0.00 176.83 176.61 2d88 n GLY 40 N -1.29 3.10 0.35 5.77 0.00 0.40 -4.32 105.19 109.20 2d88 n GLY 40 Ca 0.08 -1.01 0.01 0.00 0.00 0.00 0.00 46.02 45.11 2d88 n GLY 40 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d88 h LEU 41 N 0.00 -1.08 -0.17 0.99 3.38 -1.87 -1.08 115.31 115.49 2d88 h LEU 41 Ca 0.00 0.28 0.02 0.00 0.09 0.00 0.00 57.88 58.27 2d88 h LEU 41 Cb 0.00 0.63 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 2d88 h LEU 41 CO 0.00 -0.30 -0.28 0.00 0.09 0.00 0.00 178.44 177.95 2d88 h ALA 42 N 1.63 -0.58 -0.78 1.53 0.00 -1.85 0.34 119.26 119.55 2d88 h ALA 42 Ca 0.38 -0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.47 2d88 h ALA 42 Cb 0.63 0.88 -0.13 0.00 0.00 0.00 0.00 17.79 19.18 2d88 h ALA 42 CO -0.93 -0.70 0.11 1.25 0.00 0.00 0.00 179.25 178.98 2d88 h LEU 43 N -0.23 -0.16 -0.99 0.00 5.85 -1.53 0.29 115.31 118.54 2d88 h LEU 43 Ca 0.03 0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 2d88 h LEU 43 Cb 0.31 0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 2d88 h LEU 43 CO -0.28 -0.13 0.55 0.00 -0.34 0.00 0.00 178.44 178.24 2d88 h ALA 45 N 1.34 1.00 0.02 0.00 0.00 0.34 -1.88 119.26 120.07 2d88 h ALA 45 Ca 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 2d88 h ALA 45 Cb -0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2d88 h ALA 45 CO -0.06 0.00 -0.01 0.82 0.00 0.00 0.00 179.25 180.00 2d88 h ILE 46 N 0.00 0.92 -0.42 0.00 1.08 -0.46 -2.48 117.51 116.15 2d88 h ILE 46 Ca 0.00 -1.64 -0.02 0.00 -0.39 0.00 0.00 64.86 62.82 2d88 h ILE 46 Cb 0.22 1.72 -0.02 0.00 -3.07 0.00 0.00 36.82 35.66 2d88 h ILE 46 CO 0.00 0.30 0.20 0.40 -0.69 0.00 0.00 178.15 178.36 2d88 h ILE 47 N -0.99 1.18 -0.25 -0.67 2.04 -1.39 -3.02 117.51 114.42 2d88 h ILE 47 Ca -0.00 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 2d88 h ILE 47 Cb 0.52 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 2d88 h ILE 47 CO 0.00 0.19 0.12 -0.74 0.00 0.00 0.00 178.15 177.73 2d88 h HIS 48 N 0.54 0.36 -0.82 1.37 2.76 -1.35 0.44 115.15 118.44 2d88 h HIS 48 Ca 0.14 -0.02 0.14 0.00 -2.20 0.00 0.00 60.37 58.44 2d88 h HIS 48 Cb 0.12 -0.11 -0.14 0.00 1.55 0.00 0.00 27.41 28.83 2d88 h HIS 48 CO -0.01 0.34 -0.28 -2.13 -1.30 0.00 0.00 177.93 174.54 2d88 n ARG 49 N -4.82 -0.15 -0.10 5.26 3.00 -0.93 -1.78 116.66 117.14 2d88 n ARG 49 Ca -0.03 1.27 -0.18 0.00 -0.00 0.00 0.00 57.85 58.92 2d88 n ARG 49 Cb 0.10 -1.90 -0.09 0.00 0.00 0.00 0.00 32.46 30.57 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 -3.52 -0.14 -1.99 -1.58 -3.44 116.97 106.30 2d88 h TYR 50 Ca 0.32 0.00 -0.65 0.00 2.00 0.00 0.00 58.73 60.40 2d88 h TYR 50 Cb 0.53 0.00 -0.40 0.00 2.00 0.00 0.00 36.73 38.86 2d88 h TYR 50 CO -0.69 1.15 -0.66 1.03 -0.00 0.00 0.00 178.16 178.99 2d88 s ARG 51 N -2.32 1.78 0.47 4.88 1.81 0.15 -4.94 118.95 120.77 2d88 s ARG 51 Ca -0.25 -2.28 0.25 0.00 -1.72 0.00 0.00 55.73 51.73 2d88 s ARG 51 Cb 0.05 -3.29 1.08 0.00 -0.45 0.00 0.00 34.95 32.34 2d88 s ARG 51 CO 0.51 -1.04 1.89 -1.00 -0.68 0.00 0.00 175.30 174.99 2d88 h PRO 52 N 7.03 0.00 0.76 3.54 0.13 -1.50 -3.22 132.00 138.74 2d88 h PRO 52 Ca -0.06 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.03 2d88 h PRO 52 Cb 0.95 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.09 2d88 h PRO 52 CO 0.62 0.19 -0.37 -0.44 -0.23 0.00 0.00 178.00 177.77 2d88 h ASP 53 N 0.00 -0.87 -0.74 1.44 5.19 -1.91 -3.24 116.42 116.30 2d88 h ASP 53 Ca -0.00 0.01 0.10 0.00 -0.62 0.00 0.00 57.03 56.52 2d88 h ASP 53 Cb 0.64 0.22 -0.12 0.00 0.18 0.00 0.00 39.33 40.25 2d88 h ASP 53 CO 0.02 -0.53 -0.46 -0.07 -3.12 0.00 0.00 179.24 175.09 2d88 h LEU 54 N -1.19 -1.64 -8.42 1.55 3.38 -1.92 -3.39 115.31 103.68 2d88 h LEU 54 Ca -0.10 0.28 -0.65 0.00 0.09 0.00 0.00 57.88 57.49 2d88 h LEU 54 Cb 0.80 0.76 -0.31 0.00 0.09 0.00 0.00 40.66 41.99 2d88 h LEU 54 CO 0.17 -0.31 -0.87 -0.51 0.09 0.00 0.00 178.44 177.01 2d88 s ILE 55 N -5.78 1.84 -0.43 1.22 2.07 -1.22 -5.00 121.20 113.90 2d88 s ILE 55 Ca -0.14 -0.96 -0.08 0.00 -1.41 0.00 0.00 60.65 58.06 2d88 s ILE 55 Cb 0.14 -1.56 0.09 0.00 0.13 0.00 0.00 42.46 41.26 2d88 s ILE 55 CO 0.66 0.52 0.27 -0.62 -1.91 0.00 0.00 174.94 173.86 2d88 s ASP 56 N -0.17 5.58 -0.03 4.50 -1.08 -1.25 -4.50 116.67 119.74 2d88 s ASP 56 Ca -0.02 -1.68 -0.25 0.00 -0.52 0.00 0.00 52.55 50.08 2d88 s ASP 56 Cb -0.12 -1.97 -0.20 0.00 -1.46 0.00 0.00 42.92 39.17 2d88 s ASP 56 CO 0.03 -0.58 1.21 0.15 0.52 0.00 0.00 175.17 176.50 2d88 h PHE 57 N 8.36 0.09 -0.98 -5.34 3.04 -1.89 -2.73 116.94 117.49 2d88 h PHE 57 Ca -0.21 -0.03 0.33 0.00 3.98 0.00 0.00 57.97 62.04 2d88 h PHE 57 Cb 1.07 -0.02 -0.16 0.00 2.56 0.00 0.00 35.95 39.41 2d88 h PHE 57 CO 0.61 0.62 0.48 0.22 -2.02 0.00 0.00 178.31 178.22 2d88 h ASP 58 N -0.46 0.33 -0.01 0.41 1.82 -1.98 1.00 116.42 117.53 2d88 h ASP 58 Ca 0.00 0.22 -0.01 0.00 -0.39 0.00 0.00 57.03 56.84 2d88 h ASP 58 Cb 0.61 0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.84 2d88 h ASP 58 CO 0.01 -0.23 -0.04 -1.28 -1.61 0.00 0.00 179.24 176.08 2d88 h SER 59 N 0.20 0.06 -2.71 2.28 0.87 -1.98 -3.45 113.55 108.82 2d88 h SER 59 Ca 0.73 -0.65 -0.59 0.00 -1.23 0.00 0.00 61.79 60.04 2d88 h SER 59 Cb 1.72 -0.02 0.15 0.00 -0.44 0.00 0.00 62.40 63.81 2d88 h SER 59 CO -0.68 0.70 -0.21 0.18 -0.53 0.00 0.00 176.83 176.29 2d88 n LEU 60 N -4.73 1.06 -4.52 2.23 4.77 0.34 -4.98 117.00 111.19 2d88 n LEU 60 Ca -0.09 0.91 -0.34 0.00 -0.03 0.00 0.00 56.01 56.47 2d88 n LEU 60 Cb 0.35 -1.21 -0.12 0.00 -2.33 0.00 0.00 43.42 40.11 2d88 n LEU 60 CO 0.35 -2.45 -0.38 -1.81 -1.33 0.00 0.00 177.39 171.77 2d88 s ASP 61 N -0.94 4.64 0.12 -1.43 1.11 -1.26 -4.95 116.67 113.95 2d88 s ASP 61 Ca 0.65 -0.11 0.08 0.00 0.18 0.00 0.00 52.55 53.35 2d88 s ASP 61 Cb -0.56 -1.50 0.43 0.00 1.07 0.00 0.00 42.92 42.36 2d88 s ASP 61 CO 0.56 0.25 1.22 -1.84 1.18 0.00 0.00 175.17 176.54 2d88 n GLU 62 N 2.96 0.05 0.08 8.23 0.00 -1.26 -1.23 120.64 129.48 2d88 n GLU 62 Ca -0.18 0.53 -0.22 0.00 0.00 0.00 0.00 57.16 57.30 2d88 n GLU 62 Cb 0.53 -1.70 -0.13 0.00 0.00 0.00 0.00 31.44 30.13 2d88 n GLU 62 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 2d88 h GLN 63 N 0.00 0.60 -6.38 3.44 4.20 -1.98 -3.43 115.11 111.56 2d88 h GLN 63 Ca 0.00 -0.79 -0.57 0.00 0.06 0.00 0.00 58.65 57.35 2d88 h GLN 63 Cb 0.07 0.26 -0.05 0.00 0.30 0.00 0.00 27.48 28.06 2d88 h GLN 63 CO 0.00 1.36 1.01 -0.80 -0.67 0.00 0.00 178.83 179.72 2d88 s ASN 64 N -7.35 6.57 -0.23 1.46 0.01 -0.36 -4.87 114.94 110.16 2d88 s ASN 64 Ca -0.10 1.18 -0.08 0.00 -0.71 0.00 0.00 52.86 53.15 2d88 s ASN 64 Cb 0.05 -2.54 -0.17 0.00 0.41 0.00 0.00 41.25 39.00 2d88 s ASN 64 CO 0.92 -1.17 -0.09 0.52 -1.51 0.00 0.00 177.10 175.76 2d88 n VAL 65 N 6.41 1.56 0.01 1.60 0.31 -1.26 -3.79 118.33 123.17 2d88 n VAL 65 Ca 0.16 -0.45 -0.08 0.00 -0.01 0.00 0.00 64.34 63.96 2d88 n VAL 65 Cb 0.47 -1.72 0.09 0.00 -0.91 0.00 0.00 33.84 31.77 2d88 n VAL 65 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2d88 h GLU 66 N -0.45 0.54 0.64 5.55 4.81 -1.81 -3.16 114.58 120.69 2d88 h GLU 66 Ca -0.56 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 58.34 2d88 h GLU 66 Cb 1.75 0.02 0.01 0.00 0.63 0.00 0.00 28.75 31.15 2d88 h GLU 66 CO -0.18 0.90 -0.31 -0.22 -0.73 0.00 0.00 179.01 178.47 2d88 h LYS 67 N 0.43 -0.82 -1.00 1.92 1.63 -1.91 0.19 116.57 117.00 2d88 h LYS 67 Ca 0.02 0.06 0.39 0.00 -0.85 0.00 0.00 60.65 60.27 2d88 h LYS 67 Cb 1.00 0.19 -0.17 0.00 -0.60 0.00 0.00 32.23 32.64 2d88 h LYS 67 CO 0.09 -0.55 0.51 -0.91 -3.45 0.00 0.00 179.45 175.15 2d88 h ASN 68 N -1.08 0.31 0.12 4.20 2.35 -1.66 0.18 115.58 120.01 2d88 h ASN 68 Ca -0.09 0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.91 2d88 h ASN 68 Cb 0.65 0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.28 2d88 h ASN 68 CO 0.14 -0.38 -0.06 0.78 -1.65 0.00 0.00 177.43 176.27 2d88 h ASN 69 N 0.06 -0.13 -1.04 5.81 2.35 -1.50 -3.09 115.58 118.04 2d88 h ASN 69 Ca 0.81 0.00 0.40 0.00 -0.55 0.00 0.00 56.30 56.97 2d88 h ASN 69 Cb 2.08 0.03 -0.17 0.00 0.05 0.00 0.00 38.32 40.32 2d88 h ASN 69 CO -0.75 0.24 0.59 -0.61 -1.65 0.00 0.00 177.43 175.24 2d88 h GLN 70 N -0.82 0.09 0.17 0.81 5.75 0.49 -0.31 115.11 121.28 2d88 h GLN 70 Ca -0.02 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 2d88 h GLN 70 Cb 0.12 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.65 2d88 h GLN 70 CO 0.03 0.06 -0.08 1.25 -2.65 0.00 0.00 178.83 177.43 2d88 h LEU 71 N 0.09 -0.19 -0.70 -2.39 5.85 -0.79 -2.82 115.31 114.36 2d88 h LEU 71 Ca 0.82 0.01 0.12 0.00 0.84 0.00 0.00 57.88 59.67 2d88 h LEU 71 Cb 2.16 0.05 -0.13 0.00 0.37 0.00 0.00 40.66 43.11 2d88 h LEU 71 CO -0.69 -0.12 -0.32 0.00 -0.34 0.00 0.00 178.44 176.97 2d88 h ALA 72 N -1.87 0.08 -1.03 1.25 0.00 -1.15 0.90 119.26 117.45 2d88 h ALA 72 Ca -0.02 0.21 0.30 0.00 0.00 0.00 0.00 54.91 55.39 2d88 h ALA 72 Cb 0.17 0.80 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 2d88 h ALA 72 CO 0.04 -0.62 0.79 0.74 0.00 0.00 0.00 179.25 180.20 2d88 h PHE 73 N -0.11 0.00 0.00 0.00 0.04 -1.16 0.36 116.94 116.08 2d88 h PHE 73 Ca 0.28 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.02 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 -0.68 0.00 -0.57 0.22 -0.60 0.00 0.00 178.31 176.68 2d88 h ASP 74 N 0.00 0.00 -0.32 2.17 1.82 0.90 -3.34 116.42 117.65 2d88 h ASP 74 Ca 0.49 -0.06 0.07 0.00 -0.39 0.00 0.00 57.03 57.14 2d88 h ASP 74 Cb 2.07 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 42.00 2d88 h ASP 74 CO -0.01 0.83 -0.22 0.40 -1.61 0.00 0.00 179.24 178.63 2d88 h ILE 75 N -1.00 0.40 0.00 2.25 1.08 0.04 0.29 117.51 120.57 2d88 h ILE 75 Ca -0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 2d88 h ILE 75 Cb 0.58 0.40 0.00 0.00 -3.07 0.00 0.00 36.82 34.73 2d88 h ILE 75 CO -0.02 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.44 2d88 n ALA 76 N -2.84 -0.11 -0.28 1.87 0.00 0.12 -0.90 120.51 118.37 2d88 n ALA 76 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.49 2d88 n ALA 76 Cb 0.29 0.35 0.19 0.00 0.00 0.00 0.00 19.45 20.28 2d88 n ALA 76 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2d88 h GLU 77 N 0.00 0.66 -0.38 0.00 4.22 -1.55 2.01 114.58 119.54 2d88 h GLU 77 Ca 0.00 -0.04 0.06 0.00 0.08 0.00 0.00 59.36 59.46 2d88 h GLU 77 Cb 0.00 -0.15 -0.09 0.00 0.50 0.00 0.00 28.75 29.01 2d88 h GLU 77 CO 0.00 0.44 -0.45 0.87 -2.18 0.00 0.00 179.01 177.68 2d88 h LYS 78 N 0.68 -0.34 0.00 1.92 1.79 0.47 -2.21 116.57 118.88 2d88 h LYS 78 Ca 0.42 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.91 2d88 h LYS 78 Cb 0.49 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.22 2d88 h LYS 78 CO -0.30 -0.23 -0.73 0.39 -1.08 0.00 0.00 179.45 177.49 2d88 n GLU 79 N -5.41 0.40 0.18 3.15 -0.58 -0.07 -4.70 120.64 113.60 2d88 n GLU 79 Ca -0.01 0.18 -0.16 0.00 -0.42 0.00 0.00 57.16 56.74 2d88 n GLU 79 Cb 0.35 -1.22 -0.08 0.00 -0.57 0.00 0.00 31.44 29.92 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 -0.76 -1.29 0.00 -4.62 3.38 0.29 -3.47 115.31 108.84 2d88 h LEU 80 Ca 0.00 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2d88 h LEU 80 Cb 0.73 0.46 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2d88 h LEU 80 CO 0.00 -0.55 0.00 0.61 0.09 0.00 0.00 178.44 178.59 2d88 n GLY 81 N -1.50 0.89 3.55 0.83 0.00 0.11 -4.90 105.19 104.17 2d88 n GLY 81 Ca -0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.00 3.41 0.27 -0.61 1.01 -1.26 -4.70 121.20 117.32 2d88 s ILE 82 Ca 0.00 0.23 -0.31 0.00 0.00 0.00 0.00 60.65 60.57 2d88 s ILE 82 Cb 0.00 -4.09 -0.12 0.00 0.01 0.00 0.00 42.46 38.26 2d88 s ILE 82 CO 0.00 -1.06 1.57 -0.24 0.00 0.00 0.00 174.94 175.21 2d88 n SER 83 N 12.24 3.63 -4.77 3.58 2.88 -1.26 -3.45 113.62 126.47 2d88 n SER 83 Ca 0.18 1.13 -0.40 0.00 -1.33 0.00 0.00 58.87 58.45 2d88 n SER 83 Cb 0.52 -1.55 -0.03 0.00 -0.75 0.00 0.00 64.21 62.40 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 -0.24 4.35 0.06 -1.46 0.04 -1.26 -4.96 135.00 131.53 2d88 s PRO 84 Ca 0.67 2.01 0.15 0.00 0.04 0.00 0.00 61.00 63.87 2d88 s PRO 84 Cb -0.53 -3.00 -0.15 0.00 0.04 0.00 0.00 34.50 30.85 2d88 s PRO 84 CO 0.46 -0.12 0.87 -0.84 0.04 0.00 0.00 177.00 177.42 2d88 h ILE 85 N 2.87 0.73 -3.18 0.56 3.07 -1.97 -3.47 117.51 116.12 2d88 h ILE 85 Ca -0.48 -2.33 -0.11 0.00 1.55 0.00 0.00 64.86 63.49 2d88 h ILE 85 Cb 1.22 2.24 -0.19 0.00 -0.27 0.00 0.00 36.82 39.83 2d88 h ILE 85 CO 0.65 0.41 -0.27 0.00 -1.05 0.00 0.00 178.15 177.89 2d88 s MET 86 N -2.81 0.72 0.63 0.16 0.23 -1.26 -5.16 119.30 111.80 2d88 s MET 86 Ca -0.02 -0.35 -0.13 0.00 -1.03 0.00 0.00 55.69 54.16 2d88 s MET 86 Cb 0.08 0.32 -0.03 0.00 -1.53 0.00 0.00 34.83 33.67 2d88 s MET 86 CO 0.81 -0.21 1.04 0.95 -2.03 0.00 0.00 175.02 175.58 2d88 s THR 87 N -1.90 4.25 0.20 3.16 -4.23 -1.26 -4.88 115.64 110.98 2d88 s THR 87 Ca -0.10 0.84 -0.10 0.00 -1.18 0.00 0.00 61.69 61.15 2d88 s THR 87 Cb -0.03 -3.57 0.13 0.00 1.34 0.00 0.00 72.50 70.36 2d88 s THR 87 CO 0.01 -0.85 1.80 1.23 -0.54 0.00 0.00 174.62 176.27 2d88 h GLY 88 N -0.15 0.90 1.36 3.99 0.00 -1.87 -0.44 103.07 106.86 2d88 h GLY 88 Ca -0.45 -0.22 -0.04 0.00 0.00 0.00 0.00 47.33 46.61 2d88 h GLY 88 CO 0.59 0.13 0.16 1.70 0.00 0.00 0.00 176.54 179.11 2d88 h LYS 89 N 0.61 0.81 0.00 4.80 3.64 -1.93 0.21 116.57 124.71 2d88 h LYS 89 Ca 0.28 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 2d88 h LYS 89 Cb 0.19 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2d88 h LYS 89 CO -0.19 0.71 -0.15 0.93 -2.27 0.00 0.00 179.45 178.48 2d88 h GLU 90 N 0.79 0.00 0.00 1.90 4.39 -1.71 -1.70 114.58 118.25 2d88 h GLU 90 Ca 0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.88 2d88 h GLU 90 Cb 0.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 2d88 h GLU 90 CO -0.01 0.15 -1.33 -0.12 -1.16 0.00 0.00 179.01 176.55 2d88 n MET 91 N -3.25 0.56 0.07 2.33 1.56 -0.26 -2.97 117.12 115.17 2d88 n MET 91 Ca 0.01 -0.00 0.11 0.00 -0.27 0.00 0.00 57.70 57.55 2d88 n MET 91 Cb 0.44 -1.68 0.01 0.00 2.15 0.00 0.00 33.22 34.13 2d88 n MET 91 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2d88 n ALA 92 N -2.14 2.81 -0.10 -5.12 0.00 0.66 -4.35 120.51 112.27 2d88 n ALA 92 Ca -0.01 -0.31 -0.24 0.00 0.00 0.00 0.00 53.44 52.88 2d88 n ALA 92 Cb 0.53 -1.04 -0.11 0.00 0.00 0.00 0.00 19.45 18.83 2d88 n ALA 92 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2d88 n SER 93 N -2.39 1.96 -4.56 0.00 7.64 -0.66 -4.96 113.62 110.65 2d88 n SER 93 Ca 0.00 0.27 -0.45 0.00 1.01 0.00 0.00 58.87 59.70 2d88 n SER 93 Cb 0.51 -0.81 -0.02 0.00 -1.01 0.00 0.00 64.21 62.88 2d88 n SER 93 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2d88 n VAL 94 N -4.04 1.99 0.07 0.44 3.14 -1.16 -4.87 118.33 113.91 2d88 n VAL 94 Ca -0.43 -0.50 -0.01 0.00 -2.96 0.00 0.00 64.34 60.45 2d88 n VAL 94 Cb 0.86 -0.86 0.27 0.00 -1.06 0.00 0.00 33.84 33.06 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 1.86 0.36 -5.70 7.55 0.00 -1.92 -3.46 103.07 101.76 2d88 h GLY 95 Ca -0.38 -0.28 0.10 0.00 0.00 0.00 0.00 47.33 46.78 2d88 h GLY 95 CO 0.60 0.26 0.52 1.85 0.00 0.00 0.00 176.54 179.76 2d88 s GLU 96 N -4.47 0.38 0.59 4.80 2.12 -1.26 -5.02 118.70 115.84 2d88 s GLU 96 Ca -0.06 0.51 -0.10 0.00 0.36 0.00 0.00 54.97 55.68 2d88 s GLU 96 Cb 0.14 0.15 0.15 0.00 0.26 0.00 0.00 34.13 34.83 2d88 s GLU 96 CO 0.77 -0.06 0.53 -0.35 -0.54 0.00 0.00 175.26 175.61 2d88 n PRO 97 N 2.58 -2.06 -3.76 4.30 -0.04 -1.26 -5.03 135.00 129.74 2d88 n PRO 97 Ca -0.14 -0.84 -0.37 0.00 -0.04 0.00 0.00 63.50 62.11 2d88 n PRO 97 Cb 0.57 -0.79 -0.13 0.00 -0.04 0.00 0.00 33.50 33.11 2d88 n PRO 97 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2d88 s ASP 98 N -2.92 5.11 0.11 3.54 -1.08 -1.26 -5.00 116.67 115.16 2d88 s ASP 98 Ca 0.34 -0.51 -0.21 0.00 -0.52 0.00 0.00 52.55 51.66 2d88 s ASP 98 Cb -0.03 -1.90 -0.05 0.00 -1.46 0.00 0.00 42.92 39.48 2d88 s ASP 98 CO 0.26 -0.13 1.06 1.17 0.52 0.00 0.00 175.17 178.06 2d88 n LYS 99 N 4.89 -0.29 0.00 4.34 0.00 -1.26 -0.21 118.16 125.63 2d88 n LYS 99 Ca -0.15 1.04 0.00 0.00 0.00 0.00 0.00 58.31 59.20 2d88 n LYS 99 Cb 0.49 -1.54 0.00 0.00 0.00 0.00 0.00 35.03 33.99 2d88 n LYS 99 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2d88 n LEU 100 N -4.76 0.00 -0.36 3.14 4.77 -1.26 -0.94 117.00 117.58 2d88 n LEU 100 Ca 0.01 0.90 -0.01 0.00 -0.03 0.00 0.00 56.01 56.88 2d88 n LEU 100 Cb 0.17 -0.40 0.04 0.00 -2.33 0.00 0.00 43.42 40.90 2d88 n LEU 100 CO -0.11 -0.40 0.55 -1.20 -1.33 0.00 0.00 177.39 174.90 2d88 n SER 101 N -2.11 -0.60 0.04 -1.43 7.64 -0.59 -0.57 113.62 115.99 2d88 n SER 101 Ca 0.00 1.63 -0.07 0.00 1.01 0.00 0.00 58.87 61.43 2d88 n SER 101 Cb 0.00 -0.37 -0.05 0.00 -1.01 0.00 0.00 64.21 62.78 2d88 n SER 101 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2d88 h MET 102 N 0.00 -0.31 -0.11 1.43 2.86 -0.30 0.10 114.93 118.60 2d88 h MET 102 Ca 0.32 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 58.01 2d88 h MET 102 Cb 0.56 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.23 2d88 h MET 102 CO -0.92 -0.21 -0.47 0.28 1.06 0.00 0.00 176.91 176.65 2d88 h VAL 103 N -0.32 0.00 -0.77 -2.22 2.07 0.50 0.25 116.25 115.75 2d88 h VAL 103 Ca 0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.67 2d88 h VAL 103 Cb 0.34 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.96 2d88 h VAL 103 CO -0.15 0.00 -0.27 0.24 0.02 0.00 0.00 177.57 177.41 2d88 h MET 104 N -0.51 -0.05 0.80 1.57 2.86 -0.71 0.14 114.93 119.04 2d88 h MET 104 Ca 0.03 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 2d88 h MET 104 Cb 0.59 0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.27 2d88 h MET 104 CO -0.37 -0.03 -0.38 -0.92 1.06 0.00 0.00 176.91 176.26 2d88 h TYR 105 N -0.05 -1.00 -0.84 -0.22 3.20 0.03 -3.09 116.97 115.00 2d88 h TYR 105 Ca 0.34 -0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.35 2d88 h TYR 105 Cb 0.58 0.33 -0.16 0.00 1.54 0.00 0.00 36.73 39.02 2d88 h TYR 105 CO -0.67 -0.62 -0.21 -0.07 -1.64 0.00 0.00 178.16 174.95 2d88 h LEU 106 N -1.10 -0.78 -0.77 2.82 3.38 0.19 -0.26 115.31 118.79 2d88 h LEU 106 Ca -0.11 0.25 0.12 0.00 0.09 0.00 0.00 57.88 58.23 2d88 h LEU 106 Cb 0.82 0.52 -0.12 0.00 0.09 0.00 0.00 40.66 41.97 2d88 h LEU 106 CO 0.18 -0.28 -0.29 0.41 0.09 0.00 0.00 178.44 178.55 2d88 n THR 107 N -5.54 -0.40 -0.31 0.22 -1.04 0.43 0.71 114.28 108.35 2d88 n THR 107 Ca 0.13 1.79 0.06 0.00 -2.04 0.00 0.00 64.05 63.99 2d88 n THR 107 Cb 0.43 -2.37 0.13 0.00 -1.82 0.00 0.00 70.33 66.70 2d88 n THR 107 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2d88 n GLN 108 N -5.13 -0.08 0.28 -2.82 6.02 -0.11 0.11 117.38 115.64 2d88 n GLN 108 Ca 0.08 1.33 -0.16 0.00 -0.01 0.00 0.00 57.00 58.24 2d88 n GLN 108 Cb 0.31 -2.00 -0.08 0.00 1.02 0.00 0.00 30.24 29.49 2d88 n GLN 108 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2d88 h PHE 109 N 0.00 -0.61 0.13 1.08 0.04 0.14 -2.81 116.94 114.91 2d88 h PHE 109 Ca 0.42 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 61.19 2d88 h PHE 109 Cb 0.66 0.20 -0.04 0.00 2.20 0.00 0.00 35.95 38.97 2d88 h PHE 109 CO -0.64 -0.36 -0.40 -0.92 -0.60 0.00 0.00 178.31 175.39 2d88 h TYR 110 N -0.70 -1.13 -0.27 -0.55 5.03 -0.20 0.13 116.97 119.27 2d88 h TYR 110 Ca -0.07 0.03 0.08 0.00 2.58 0.00 0.00 58.73 61.35 2d88 h TYR 110 Cb 0.53 0.48 -0.01 0.00 1.55 0.00 0.00 36.73 39.27 2d88 h TYR 110 CO -0.03 -0.51 0.67 0.93 -1.32 0.00 0.00 178.16 177.90 2d88 h GLU 111 N -0.65 0.00 0.00 1.82 4.39 -0.61 1.85 114.58 121.38 2d88 h GLU 111 Ca 0.02 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.41 2d88 h GLU 111 Cb 0.67 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.26 2d88 h GLU 111 CO -0.23 0.00 -1.86 -0.12 -1.16 0.00 0.00 179.01 175.64 2d88 n MET 112 N -3.05 0.64 -0.51 2.33 1.56 0.24 -4.20 117.12 114.13 2d88 n MET 112 Ca 0.05 0.23 0.04 0.00 -0.27 0.00 0.00 57.70 57.75 2d88 n MET 112 Cb 0.78 -1.73 0.21 0.00 2.15 0.00 0.00 33.22 34.63 2d88 n MET 112 CO 0.00 0.00 0.00 1.19 -0.73 0.00 0.00 175.97 176.43 2d88 n PHE 113 N -2.97 0.77 0.09 1.12 3.72 0.35 -4.48 117.46 116.06 2d88 n PHE 113 Ca -0.20 -1.18 -0.22 0.00 -0.05 0.00 0.00 57.45 55.79 2d88 n PHE 113 Cb 1.07 -0.34 -0.15 0.00 -0.94 0.00 0.00 39.48 39.12 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 1.15 0.44 -0.64 -1.08 2.10 0.21 -3.38 116.57 115.37 2d88 h LYS 114 Ca 0.08 -0.72 -0.38 0.00 -2.00 0.00 0.00 60.65 57.62 2d88 h LYS 114 Cb 1.41 0.26 -0.41 0.00 -0.90 0.00 0.00 32.23 32.59 2d88 h LYS 114 CO 0.23 1.34 -0.99 -0.40 -2.00 0.00 0.00 179.45 177.62 2d88 n ASP 115 N -3.93 3.00 -4.41 7.07 5.68 -1.26 -5.09 116.55 117.61 2d88 n ASP 115 Ca -0.15 -2.81 -0.35 0.00 -0.50 0.00 0.00 54.79 50.98 2d88 n ASP 115 Cb 0.95 -0.43 0.08 0.00 -1.14 0.00 0.00 41.12 40.59 2d88 n ASP 115 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 2d88 n SER 116 N -0.60 -1.89 -3.26 -1.12 2.88 -1.26 -4.80 113.62 103.57 2d88 n SER 116 Ca 0.23 0.48 -0.30 0.00 -1.33 0.00 0.00 58.87 57.94 2d88 n SER 116 Cb 0.86 -1.17 0.01 0.00 -0.75 0.00 0.00 64.21 63.15 2d88 n SER 116 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d88 n GLY 117 N 1.75 -2.40 0.25 0.46 0.00 -1.26 -4.81 105.19 99.18 2d88 n GLY 117 Ca 0.08 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.12 2d88 n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d88 h PRO 118 N 0.04 0.00 -5.34 1.61 0.13 -2.01 -3.43 132.00 123.00 2d88 h PRO 118 Ca -0.31 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.46 2d88 h PRO 118 Cb 1.11 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 2d88 h PRO 118 CO 0.33 0.12 1.38 0.43 -0.23 0.00 0.00 178.00 180.03 2d88 n SER 119 N -3.31 1.29 -4.46 1.44 7.64 -1.26 -4.78 113.62 110.18 2d88 n SER 119 Ca -0.00 -0.55 -0.46 0.00 1.01 0.00 0.00 58.87 58.87 2d88 n SER 119 Cb 0.35 -1.32 -0.08 0.00 -1.01 0.00 0.00 64.21 62.14 2d88 n SER 119 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2d88 n SER 120 N 14.04 1.66 0.00 6.43 2.88 -1.26 -5.19 113.62 132.19 2d88 n SER 120 Ca 0.50 0.18 0.00 0.00 -1.33 0.00 0.00 58.87 58.22 2d88 n SER 120 Cb 0.35 -1.23 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 2d88 n SER 120 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42