#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d85 n SER 2 N 0.00 -5.01 -4.53 1.61 7.64 -1.26 -4.83 113.62 107.24 2d85 n SER 2 Ca 0.00 -0.34 -0.37 0.00 1.01 0.00 0.00 58.87 59.17 2d85 n SER 2 Cb 0.00 -3.66 -0.09 0.00 -1.01 0.00 0.00 64.21 59.45 2d85 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2d85 n SER 3 N -1.57 1.28 -3.23 6.43 7.64 -1.26 -0.80 113.62 122.11 2d85 n SER 3 Ca -0.01 -0.24 -0.23 0.00 1.01 0.00 0.00 58.87 59.40 2d85 n SER 3 Cb 0.55 -1.26 0.03 0.00 -1.01 0.00 0.00 64.21 62.52 2d85 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d85 n GLY 4 N 6.24 -0.52 3.52 0.23 0.00 -1.26 -4.98 105.19 108.42 2d85 n GLY 4 Ca 0.51 0.14 -0.26 0.00 0.00 0.00 0.00 46.02 46.41 2d85 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d85 s SER 5 N -2.82 3.98 -0.15 1.61 0.01 0.02 -5.06 113.70 111.29 2d85 s SER 5 Ca 0.39 -0.70 -0.17 0.00 1.31 0.00 0.00 55.95 56.78 2d85 s SER 5 Cb -0.18 -0.56 -0.24 0.00 0.21 0.00 0.00 66.02 65.25 2d85 s SER 5 CO 0.48 0.10 0.39 0.28 0.41 0.00 0.00 173.24 174.90 2d85 h SER 6 N 2.90 0.21 0.00 2.44 0.02 -1.94 -3.48 113.55 113.70 2d85 h SER 6 Ca -0.46 -0.74 0.00 0.00 -0.84 0.00 0.00 61.79 59.75 2d85 h SER 6 Cb 1.21 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2d85 h SER 6 CO 0.53 1.58 0.00 0.61 -1.14 0.00 0.00 176.83 178.41 2d85 n GLY 7 N 1.66 4.42 2.52 -3.77 0.00 -1.26 -4.20 105.19 104.56 2d85 n GLY 7 Ca -0.28 -0.61 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 2d85 n GLY 7 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2d85 n ASN 8 N 0.00 7.86 -0.07 1.61 4.13 -1.26 -4.49 115.26 123.05 2d85 n ASN 8 Ca 0.00 -3.28 -0.16 0.00 1.68 0.00 0.00 54.58 52.81 2d85 n ASN 8 Cb 0.00 -1.31 -0.14 0.00 -1.54 0.00 0.00 39.78 36.79 2d85 n ASN 8 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2d85 n ASP 9 N 1.25 1.52 0.13 6.41 8.00 -1.26 -4.26 116.55 128.35 2d85 n ASP 9 Ca 0.58 0.07 -0.24 0.00 0.71 0.00 0.00 54.79 55.92 2d85 n ASP 9 Cb 0.25 -0.26 -0.16 0.00 -0.02 0.00 0.00 41.12 40.94 2d85 n ASP 9 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 2d85 h ASP 10 N 0.02 0.79 0.00 -2.24 3.58 -1.96 -3.24 116.42 113.38 2d85 h ASP 10 Ca -0.49 -0.92 0.00 0.00 0.42 0.00 0.00 57.03 56.04 2d85 h ASP 10 Cb 2.02 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 42.81 2d85 h ASP 10 CO 0.01 1.66 0.22 -0.29 -2.88 0.00 0.00 179.24 177.96 2d85 h ILE 11 N 0.07 0.00 -1.03 2.25 2.10 -1.88 -2.04 117.51 116.98 2d85 h ILE 11 Ca -0.24 0.00 0.26 0.00 1.08 0.00 0.00 64.86 65.97 2d85 h ILE 11 Cb 2.07 0.71 -0.12 0.00 -1.09 0.00 0.00 36.82 38.39 2d85 h ILE 11 CO 0.26 0.00 0.62 0.40 -1.08 0.00 0.00 178.15 178.35 2d85 h ILE 12 N 0.00 0.50 0.00 2.19 2.04 -1.73 0.19 117.51 120.70 2d85 h ILE 12 Ca 0.00 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 2d85 h ILE 12 Cb 0.44 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.48 2d85 h ILE 12 CO 0.00 0.09 -0.20 0.58 0.00 0.00 0.00 178.15 178.62 2d85 h VAL 13 N 0.49 1.29 -1.01 1.67 2.07 -1.62 -3.25 116.25 115.89 2d85 h VAL 13 Ca 0.64 -2.04 0.24 0.00 0.82 0.00 0.00 66.70 66.37 2d85 h VAL 13 Cb 1.38 2.51 -0.12 0.00 -1.52 0.00 0.00 31.29 33.54 2d85 h VAL 13 CO -0.43 0.44 0.61 -1.13 0.02 0.00 0.00 177.57 177.08 2d85 h ASN 14 N -1.00 0.66 0.40 0.57 -0.73 -1.49 -0.92 115.58 113.06 2d85 h ASN 14 Ca -0.05 0.12 -0.02 0.00 1.87 0.00 0.00 56.30 58.22 2d85 h ASN 14 Cb 0.85 0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.46 2d85 h ASN 14 CO -0.03 0.13 -0.19 -0.25 -0.37 0.00 0.00 177.43 176.72 2d85 h TRP 15 N 0.58 -0.49 -0.10 0.67 7.01 -0.78 -2.81 115.95 120.03 2d85 h TRP 15 Ca 0.63 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.65 2d85 h TRP 15 Cb 1.22 0.16 -0.06 0.00 -2.10 0.00 0.00 29.16 28.38 2d85 h TRP 15 CO -0.01 -0.27 -0.43 0.28 -2.79 0.00 0.00 178.44 175.23 2d85 h VAL 16 N -0.59 0.14 -0.77 2.65 2.07 -1.22 0.59 116.25 119.11 2d85 h VAL 16 Ca -0.05 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.59 2d85 h VAL 16 Cb 0.44 0.14 -0.13 0.00 -1.52 0.00 0.00 31.29 30.22 2d85 h VAL 16 CO 0.09 0.00 -0.38 0.78 0.02 0.00 0.00 177.57 178.08 2d85 h ASN 17 N -0.52 -1.36 0.36 0.57 2.35 -1.38 0.43 115.58 116.03 2d85 h ASN 17 Ca 0.07 0.27 -0.02 0.00 -0.55 0.00 0.00 56.30 56.07 2d85 h ASN 17 Cb 0.64 0.68 0.00 0.00 0.05 0.00 0.00 38.32 39.69 2d85 h ASN 17 CO -0.38 -0.30 -0.19 -0.33 -1.65 0.00 0.00 177.43 174.58 2d85 h GLU 18 N -0.10 -0.49 -1.12 0.81 5.08 -1.14 0.20 114.58 117.82 2d85 h GLU 18 Ca 0.27 0.03 0.31 0.00 -1.00 0.00 0.00 59.36 58.97 2d85 h GLU 18 Cb 0.57 0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.84 2d85 h GLU 18 CO -0.82 -0.33 0.75 1.15 -1.00 0.00 0.00 179.01 178.76 2d85 h THR 19 N -0.51 0.43 0.20 1.13 2.02 0.54 0.27 112.91 117.00 2d85 h THR 19 Ca -0.05 -0.09 -0.32 0.00 0.77 0.00 0.00 66.41 66.73 2d85 h THR 19 Cb 0.40 0.16 0.02 0.00 -1.74 0.00 0.00 68.15 67.00 2d85 h THR 19 CO 0.07 0.05 -1.49 -0.07 0.37 0.00 0.00 175.52 174.44 2d85 h LEU 20 N 0.25 0.67 0.25 2.58 3.38 -0.43 -3.22 115.31 118.77 2d85 h LEU 20 Ca 0.62 -0.92 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 2d85 h LEU 20 Cb 1.86 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.40 2d85 h LEU 20 CO -0.24 1.69 -0.12 -0.09 0.09 0.00 0.00 178.44 179.78 2d85 h ARG 21 N 0.01 -0.32 -0.63 1.13 2.43 0.20 0.29 114.38 117.50 2d85 h ARG 21 Ca -0.28 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.03 2d85 h ARG 21 Cb 2.03 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 31.62 2d85 h ARG 21 CO 0.20 -0.20 0.42 1.05 -1.51 0.00 0.00 179.97 179.94 2d85 h GLU 22 N -0.35 0.32 0.00 0.20 4.11 -0.77 0.29 114.58 118.38 2d85 h GLU 22 Ca -0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.38 2d85 h GLU 22 Cb 0.27 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2d85 h GLU 22 CO 0.06 0.21 -0.39 0.00 0.07 0.00 0.00 179.01 178.96 2d85 n ALA 23 N -2.54 3.00 -2.66 1.06 0.00 -0.92 -4.96 120.51 113.49 2d85 n ALA 23 Ca 0.11 -0.24 -0.07 0.00 0.00 0.00 0.00 53.44 53.24 2d85 n ALA 23 Cb 0.46 -1.24 0.03 0.00 0.00 0.00 0.00 19.45 18.70 2d85 n ALA 23 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2d85 n GLU 24 N -1.74 -2.68 -3.35 0.00 -0.58 0.10 -5.03 120.64 107.36 2d85 n GLU 24 Ca 0.05 0.32 -0.34 0.00 -0.42 0.00 0.00 57.16 56.77 2d85 n GLU 24 Cb 0.37 -3.78 -0.06 0.00 -0.57 0.00 0.00 31.44 27.41 2d85 n GLU 24 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2d85 s LYS 25 N -4.83 3.95 -0.01 3.49 3.01 0.70 -4.97 119.74 121.09 2d85 s LYS 25 Ca 0.07 0.47 0.11 0.00 -1.01 0.00 0.00 55.97 55.61 2d85 s LYS 25 Cb -0.03 -2.84 0.32 0.00 -1.01 0.00 0.00 37.83 34.28 2d85 s LYS 25 CO 0.28 0.42 1.25 0.45 0.51 0.00 0.00 175.35 178.26 2d85 n SER 26 N 0.52 2.02 -4.94 2.83 2.88 -1.26 -4.74 113.62 110.93 2d85 n SER 26 Ca -0.03 -2.03 -0.19 0.00 -1.33 0.00 0.00 58.87 55.29 2d85 n SER 26 Cb 0.52 -0.26 -0.01 0.00 -0.75 0.00 0.00 64.21 63.70 2d85 n SER 26 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2d85 s SER 27 N -0.96 5.45 -0.05 -3.46 0.15 -1.26 -5.11 113.70 108.46 2d85 s SER 27 Ca 0.24 -0.51 -0.31 0.00 0.70 0.00 0.00 55.95 56.07 2d85 s SER 27 Cb 0.13 -0.75 0.12 0.00 -1.71 0.00 0.00 66.02 63.82 2d85 s SER 27 CO 0.16 -0.63 1.28 -0.94 1.20 0.00 0.00 173.24 174.31 2d85 s SER 28 N -4.21 -0.07 -0.04 5.45 1.04 -1.26 -4.92 113.70 109.69 2d85 s SER 28 Ca 0.50 -0.11 -0.01 0.00 0.48 0.00 0.00 55.95 56.80 2d85 s SER 28 Cb -0.07 0.15 0.03 0.00 0.10 0.00 0.00 66.02 66.24 2d85 s SER 28 CO 0.30 -0.28 0.09 0.27 0.98 0.00 0.00 173.24 174.60 2d85 s ILE 29 N -2.41 -0.06 0.05 -1.02 -4.36 -1.26 -4.67 121.20 107.47 2d85 s ILE 29 Ca 0.13 0.21 -0.12 0.00 -0.26 0.00 0.00 60.65 60.61 2d85 s ILE 29 Cb 0.04 -0.16 -0.31 0.00 1.25 0.00 0.00 42.46 43.27 2d85 s ILE 29 CO -0.04 0.09 1.08 -1.28 0.24 0.00 0.00 174.94 175.03 2d85 h SER 30 N 7.35 0.75 -5.38 4.36 0.87 -1.96 -3.48 113.55 116.07 2d85 h SER 30 Ca -0.42 -0.76 0.30 0.00 -1.23 0.00 0.00 61.79 59.67 2d85 h SER 30 Cb 1.13 -0.24 -0.13 0.00 -0.44 0.00 0.00 62.40 62.71 2d85 h SER 30 CO 0.43 1.58 0.79 -0.55 -0.53 0.00 0.00 176.83 178.55 2d85 s SER 31 N -7.42 -0.09 0.59 6.23 0.15 -1.26 -4.99 113.70 106.91 2d85 s SER 31 Ca -0.08 -0.12 0.31 0.00 0.70 0.00 0.00 55.95 56.75 2d85 s SER 31 Cb 0.05 0.19 1.25 0.00 -1.71 0.00 0.00 66.02 65.80 2d85 s SER 31 CO 0.93 -0.34 1.57 -0.26 1.20 0.00 0.00 173.24 176.34 2d85 h PHE 32 N 2.00 0.00 -1.03 3.44 0.04 -2.00 0.81 116.94 120.20 2d85 h PHE 32 Ca -0.25 0.00 -0.67 0.00 2.80 0.00 0.00 57.97 59.84 2d85 h PHE 32 Cb 1.20 0.00 -0.30 0.00 2.20 0.00 0.00 35.95 39.05 2d85 h PHE 32 CO 0.32 0.00 0.75 1.63 -0.60 0.00 0.00 178.31 180.40 2d85 n LYS 33 N -3.54 2.77 -3.18 1.51 5.02 -1.26 -4.62 118.16 114.85 2d85 n LYS 33 Ca 0.21 -3.37 -0.39 0.00 -2.02 0.00 0.00 58.31 52.73 2d85 n LYS 33 Cb 1.27 -2.29 -0.06 0.00 -0.02 0.00 0.00 35.03 33.93 2d85 n LYS 33 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2d85 s ASP 34 N -1.94 7.16 0.07 4.39 -1.08 0.28 -5.00 116.67 120.55 2d85 s ASP 34 Ca 0.63 1.38 -0.17 0.00 -0.52 0.00 0.00 52.55 53.87 2d85 s ASP 34 Cb 0.50 -2.40 -0.11 0.00 -1.46 0.00 0.00 42.92 39.44 2d85 s ASP 34 CO -0.02 0.24 1.39 1.55 0.52 0.00 0.00 175.17 178.85 2d85 h PRO 35 N 4.41 0.54 -0.98 4.34 0.13 -1.94 -3.18 132.00 135.33 2d85 h PRO 35 Ca -0.49 -0.29 0.25 0.00 -0.87 0.00 0.00 66.00 64.60 2d85 h PRO 35 Cb 1.21 0.01 -0.13 0.00 0.13 0.00 0.00 31.00 32.22 2d85 h PRO 35 CO 0.64 0.87 0.54 0.87 -0.23 0.00 0.00 178.00 180.69 2d85 h LYS 36 N 0.23 0.49 -0.95 0.86 1.79 -1.94 0.48 116.57 117.52 2d85 h LYS 36 Ca 0.04 -0.03 0.27 0.00 -2.18 0.00 0.00 60.65 58.75 2d85 h LYS 36 Cb 0.77 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 31.27 2d85 h LYS 36 CO 0.05 0.32 0.68 0.82 -1.08 0.00 0.00 179.45 180.25 2d85 h ILE 37 N 0.50 0.53 -1.00 1.86 2.04 -1.86 0.74 117.51 120.33 2d85 h ILE 37 Ca 0.63 -0.01 0.23 0.00 1.00 0.00 0.00 64.86 66.71 2d85 h ILE 37 Cb 1.24 0.49 -0.09 0.00 -0.74 0.00 0.00 36.82 37.71 2d85 h ILE 37 CO -0.51 0.01 0.63 -1.28 0.00 0.00 0.00 178.15 177.00 2d85 h SER 38 N 0.04 0.54 0.73 1.72 0.87 -0.20 0.73 113.55 117.99 2d85 h SER 38 Ca 0.46 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 61.10 2d85 h SER 38 Cb 1.76 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.71 2d85 h SER 38 CO -0.03 0.16 -0.40 0.35 -0.53 0.00 0.00 176.83 176.38 2d85 n THR 39 N -4.65 0.10 -2.04 2.23 -2.24 0.25 -4.59 114.28 103.34 2d85 n THR 39 Ca 0.23 -0.07 -0.10 0.00 -2.27 0.00 0.00 64.05 61.84 2d85 n THR 39 Cb 0.74 -0.03 -0.01 0.00 -2.10 0.00 0.00 70.33 68.93 2d85 n THR 39 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2d85 n SER 40 N -1.67 -3.52 0.08 3.42 7.64 0.25 -4.81 113.62 115.03 2d85 n SER 40 Ca 0.05 0.03 -0.13 0.00 1.01 0.00 0.00 58.87 59.84 2d85 n SER 40 Cb 0.36 -2.63 -0.08 0.00 -1.01 0.00 0.00 64.21 60.85 2d85 n SER 40 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2d85 h LEU 41 N 0.00 -0.20 -1.19 -3.43 3.38 -1.78 -0.73 115.31 111.35 2d85 h LEU 41 Ca -0.23 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.38 2d85 h LEU 41 Cb 1.09 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 2d85 h LEU 41 CO 0.29 0.22 -0.32 1.55 0.09 0.00 0.00 178.44 180.27 2d85 h PRO 42 N -0.67 0.00 0.09 1.13 0.13 -1.84 -0.31 132.00 130.53 2d85 h PRO 42 Ca -0.02 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.85 2d85 h PRO 42 Cb 0.48 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.61 2d85 h PRO 42 CO 0.04 0.32 -1.16 0.28 -0.23 0.00 0.00 178.00 177.25 2d85 h VAL 43 N 0.00 1.52 0.00 1.56 2.07 -1.91 -2.61 116.25 116.88 2d85 h VAL 43 Ca -0.00 -3.04 -0.02 0.00 0.82 0.00 0.00 66.70 64.46 2d85 h VAL 43 Cb 0.74 2.86 -0.00 0.00 -1.52 0.00 0.00 31.29 33.36 2d85 h VAL 43 CO 0.04 0.88 -0.09 -0.07 0.02 0.00 0.00 177.57 178.36 2d85 h LEU 44 N 0.08 0.00 -1.56 2.57 3.38 -0.99 -3.19 115.31 115.59 2d85 h LEU 44 Ca -0.11 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 56.97 2d85 h LEU 44 Cb 1.88 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.61 2d85 h LEU 44 CO 0.19 1.00 0.27 0.44 0.09 0.00 0.00 178.44 180.42 2d85 h ASP 45 N -1.00 0.49 -0.33 -0.43 5.19 -1.20 -2.26 116.42 116.88 2d85 h ASP 45 Ca -0.02 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.36 2d85 h ASP 45 Cb 0.95 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 40.32 2d85 h ASP 45 CO -0.01 0.37 0.16 0.25 -3.12 0.00 0.00 179.24 176.88 2d85 h LEU 46 N 0.58 0.44 0.01 1.55 5.85 -1.58 -1.07 115.31 121.09 2d85 h LEU 46 Ca 0.15 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2d85 h LEU 46 Cb -0.05 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.87 2d85 h LEU 46 CO -0.03 0.44 -0.00 0.40 -0.34 0.00 0.00 178.44 178.91 2d85 h ILE 47 N 0.40 1.08 -0.56 4.05 2.04 -1.42 -2.99 117.51 120.11 2d85 h ILE 47 Ca 0.11 -0.27 0.06 0.00 1.00 0.00 0.00 64.86 65.77 2d85 h ILE 47 Cb 0.12 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 2d85 h ILE 47 CO -0.01 0.07 0.26 -0.78 0.00 0.00 0.00 178.15 177.69 2d85 h ASP 48 N -0.12 0.35 -0.99 1.72 3.58 -1.34 -1.86 116.42 117.75 2d85 h ASP 48 Ca -0.00 0.04 0.37 0.00 0.42 0.00 0.00 57.03 57.86 2d85 h ASP 48 Cb 0.12 -0.02 -0.17 0.00 1.72 0.00 0.00 39.33 40.98 2d85 h ASP 48 CO 0.00 0.23 0.45 0.00 -2.88 0.00 0.00 179.24 177.05 2d85 h ALA 49 N 1.33 1.94 0.06 -0.78 0.00 -1.04 -1.29 119.26 119.48 2d85 h ALA 49 Ca 0.26 0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.43 2d85 h ALA 49 Cb 0.22 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2d85 h ALA 49 CO -0.21 -0.81 -0.03 0.82 0.00 0.00 0.00 179.25 179.03 2d85 h ILE 50 N 0.07 0.27 -3.45 0.00 2.04 -1.39 -3.42 117.51 111.62 2d85 h ILE 50 Ca 0.78 -1.12 -0.71 0.00 1.00 0.00 0.00 64.86 64.81 2d85 h ILE 50 Cb 1.94 0.50 -0.33 0.00 -0.74 0.00 0.00 36.82 38.19 2d85 h ILE 50 CO -0.76 0.09 -0.42 -1.58 0.00 0.00 0.00 178.15 175.47 2d85 s GLN 51 N -1.98 2.36 -0.04 2.37 2.00 -0.52 -5.07 119.66 118.78 2d85 s GLN 51 Ca -0.04 -1.99 -0.30 0.00 -2.00 0.00 0.00 55.36 51.03 2d85 s GLN 51 Cb -0.00 -3.77 -0.05 0.00 0.80 0.00 0.00 33.01 29.98 2d85 s GLN 51 CO 0.14 -1.15 1.48 -1.25 -0.50 0.00 0.00 175.29 174.02 2d85 s PRO 52 N 0.90 4.23 0.00 1.67 0.04 -1.01 -3.21 135.00 137.62 2d85 s PRO 52 Ca 0.10 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.15 2d85 s PRO 52 Cb -0.23 -3.75 0.00 0.00 0.04 0.00 0.00 34.50 30.56 2d85 s PRO 52 CO -0.03 -0.71 0.00 0.41 0.04 0.00 0.00 177.00 176.71 2d85 n GLY 53 N 3.83 0.76 0.38 0.56 0.00 -1.26 -5.00 105.19 104.47 2d85 n GLY 53 Ca 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.02 2d85 n GLY 53 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d85 h SER 54 N 1.84 -0.81 -4.04 1.61 4.64 -1.91 -3.43 113.55 111.45 2d85 h SER 54 Ca 0.00 0.03 -0.45 0.00 -0.47 0.00 0.00 61.79 60.90 2d85 h SER 54 Cb 0.00 0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2d85 h SER 54 CO 0.00 -0.57 0.35 -0.63 -0.87 0.00 0.00 176.83 175.11 2d85 s ILE 55 N -5.06 4.21 -0.22 0.95 -1.09 -1.26 -5.06 121.20 113.67 2d85 s ILE 55 Ca -0.14 1.43 -0.04 0.00 -2.23 0.00 0.00 60.65 59.68 2d85 s ILE 55 Cb 0.01 -3.61 0.09 0.00 -1.58 0.00 0.00 42.46 37.37 2d85 s ILE 55 CO 0.42 -0.24 0.17 0.21 -1.23 0.00 0.00 174.94 174.27 2d85 s ASN 56 N -2.05 2.18 0.32 3.58 2.47 -1.26 -5.01 114.94 115.17 2d85 s ASN 56 Ca 0.62 -0.65 0.08 0.00 0.42 0.00 0.00 52.86 53.33 2d85 s ASN 56 Cb -0.12 0.05 0.79 0.00 -1.45 0.00 0.00 41.25 40.53 2d85 s ASN 56 CO 0.16 -0.37 1.78 1.88 -3.72 0.00 0.00 177.10 176.83 2d85 h TYR 57 N 8.36 1.01 -1.00 0.43 -1.99 -1.97 0.46 116.97 122.27 2d85 h TYR 57 Ca -0.17 0.03 0.29 0.00 2.00 0.00 0.00 58.73 60.89 2d85 h TYR 57 Cb 1.11 -0.30 -0.14 0.00 2.00 0.00 0.00 36.73 39.40 2d85 h TYR 57 CO 0.19 0.21 0.58 0.22 -0.00 0.00 0.00 178.16 179.36 2d85 h ASP 58 N 0.71 0.57 0.41 3.88 1.82 -2.01 0.94 116.42 122.74 2d85 h ASP 58 Ca 0.58 0.17 -0.31 0.00 -0.39 0.00 0.00 57.03 57.08 2d85 h ASP 58 Cb 0.98 0.10 -0.01 0.00 0.68 0.00 0.00 39.33 41.08 2d85 h ASP 58 CO -0.37 -0.05 -1.59 -0.07 -1.61 0.00 0.00 179.24 175.55 2d85 h LEU 59 N 0.42 0.40-10.24 2.28 3.38 -1.37 -3.47 115.31 106.71 2d85 h LEU 59 Ca 0.70 -0.58 -0.49 0.00 0.09 0.00 0.00 57.88 57.60 2d85 h LEU 59 Cb 1.50 -0.13 0.20 0.00 0.09 0.00 0.00 40.66 42.32 2d85 h LEU 59 CO -0.56 1.49 0.17 -0.76 0.09 0.00 0.00 178.44 178.86 2d85 s LEU 60 N -6.97 2.22 -0.14 1.67 1.43 0.32 -5.01 118.68 112.20 2d85 s LEU 60 Ca -0.10 1.94 -0.15 0.00 -1.03 0.00 0.00 54.13 54.79 2d85 s LEU 60 Cb 0.07 -4.19 -0.05 0.00 0.03 0.00 0.00 46.19 42.04 2d85 s LEU 60 CO 0.85 -3.36 -0.29 0.29 0.23 0.00 0.00 176.35 174.06 2d85 n LYS 61 N -4.39 0.45 -1.95 1.70 4.01 -1.26 -4.93 118.16 111.79 2d85 n LYS 61 Ca 0.09 0.18 -0.03 0.00 -0.51 0.00 0.00 58.31 58.04 2d85 n LYS 61 Cb 0.53 -1.28 -0.01 0.00 -0.51 0.00 0.00 35.03 33.76 2d85 n LYS 61 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 2d85 n THR 62 N -4.28 -0.09 -3.75 -0.18 5.66 -1.26 -4.86 114.28 105.52 2d85 n THR 62 Ca -0.15 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.61 2d85 n THR 62 Cb 0.47 -0.38 -0.17 0.00 -1.55 0.00 0.00 70.33 68.70 2d85 n THR 62 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2d85 s GLU 63 N -3.94 0.55 -1.20 1.09 -1.05 -1.26 -4.87 118.70 108.02 2d85 s GLU 63 Ca 0.00 0.00 -0.06 0.00 -0.15 0.00 0.00 54.97 54.76 2d85 s GLU 63 Cb 0.00 -1.23 0.06 0.00 -0.44 0.00 0.00 34.13 32.52 2d85 s GLU 63 CO 0.00 -0.39 0.15 0.09 0.95 0.00 0.00 175.26 176.06 2d85 n ASN 64 N 5.14 -0.03 -4.38 0.83 3.02 -1.26 -4.82 115.26 113.76 2d85 n ASN 64 Ca -0.07 -0.91 -0.31 0.00 -0.03 0.00 0.00 54.58 53.26 2d85 n ASN 64 Cb 0.49 -1.14 0.20 0.00 -0.61 0.00 0.00 39.78 38.72 2d85 n ASN 64 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2d85 n LEU 65 N -3.39 -1.55 -3.96 3.41 4.77 -1.26 -5.04 117.00 109.98 2d85 n LEU 65 Ca -0.12 -0.08 -0.12 0.00 -0.03 0.00 0.00 56.01 55.66 2d85 n LEU 65 Cb 0.44 -1.12 -0.01 0.00 -2.33 0.00 0.00 43.42 40.39 2d85 n LEU 65 CO 0.64 -3.18 0.31 0.54 -1.33 0.00 0.00 177.39 174.37 2d85 s ASN 66 N -2.11 0.48 0.56 -1.43 2.20 -1.26 -4.84 114.94 108.53 2d85 s ASN 66 Ca 0.62 -1.31 0.38 0.00 -0.94 0.00 0.00 52.86 51.61 2d85 s ASN 66 Cb -0.19 0.74 1.50 0.00 -2.00 0.00 0.00 41.25 41.30 2d85 s ASN 66 CO 0.66 -1.46 1.67 0.44 -2.94 0.00 0.00 177.10 175.47 2d85 h ASP 67 N 2.07 0.00 0.00 3.54 3.32 -1.97 0.92 116.42 124.30 2d85 h ASP 67 Ca -0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2d85 h ASP 67 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2d85 h ASP 67 CO 0.39 0.00 -0.07 0.44 -1.72 0.00 0.00 179.24 178.28 2d85 h ASP 68 N 0.00 0.00 0.22 6.45 3.32 -2.00 -3.30 116.42 121.11 2d85 h ASP 68 Ca 0.61 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.67 2d85 h ASP 68 Cb 2.66 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 42.20 2d85 h ASP 68 CO -0.01 0.22 -0.23 -0.33 -1.72 0.00 0.00 179.24 177.17 2d85 h GLU 69 N -0.37 -0.47 -0.95 3.56 4.39 -1.76 -2.69 114.58 116.29 2d85 h GLU 69 Ca 0.00 0.03 0.19 0.00 0.34 0.00 0.00 59.36 59.92 2d85 h GLU 69 Cb 0.07 0.11 -0.18 0.00 -0.10 0.00 0.00 28.75 28.65 2d85 h GLU 69 CO 0.00 -0.31 -0.25 0.87 -1.16 0.00 0.00 179.01 178.16 2d85 h LYS 70 N -0.49 -0.00 0.17 2.33 1.57 0.64 -0.68 116.57 120.11 2d85 h LYS 70 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2d85 h LYS 70 Cb 0.46 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 2d85 h LYS 70 CO -0.06 -0.00 -0.36 1.25 -0.57 0.00 0.00 179.45 179.71 2d85 h LEU 71 N -0.00 -1.07 -0.98 2.94 5.85 -1.56 -1.03 115.31 119.46 2d85 h LEU 71 Ca 0.45 0.10 0.35 0.00 0.84 0.00 0.00 57.88 59.62 2d85 h LEU 71 Cb 0.69 0.38 -0.17 0.00 0.37 0.00 0.00 40.66 41.93 2d85 h LEU 71 CO -0.97 -0.41 0.39 0.78 -0.34 0.00 0.00 178.44 177.88 2d85 h ASN 72 N -0.58 0.12 -0.39 1.25 2.35 -1.02 0.77 115.58 118.09 2d85 h ASN 72 Ca -0.02 0.25 -0.04 0.00 -0.55 0.00 0.00 56.30 55.94 2d85 h ASN 72 Cb 0.55 0.30 -0.02 0.00 0.05 0.00 0.00 38.32 39.21 2d85 h ASN 72 CO -0.15 -0.34 0.10 0.78 -1.65 0.00 0.00 177.43 176.17 2d85 h ASN 73 N 0.08 0.58 -0.04 5.81 4.21 -0.64 -1.19 115.58 124.39 2d85 h ASN 73 Ca 0.74 -0.23 -0.00 0.00 1.21 0.00 0.00 56.30 58.02 2d85 h ASN 73 Cb 1.77 -0.15 -0.00 0.00 -1.12 0.00 0.00 38.32 38.82 2d85 h ASN 73 CO -0.77 0.66 0.02 0.00 -1.29 0.00 0.00 177.43 176.05 2d85 h ALA 74 N 0.95 0.05 0.00 -0.83 0.00 0.17 -1.85 119.26 117.75 2d85 h ALA 74 Ca 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2d85 h ALA 74 Cb 0.30 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2d85 h ALA 74 CO 0.00 -0.40 -0.09 0.87 0.00 0.00 0.00 179.25 179.63 2d85 h LYS 75 N -0.03 0.00 -0.05 0.00 1.57 -0.94 -2.28 116.57 114.84 2d85 h LYS 75 Ca 0.01 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 2d85 h LYS 75 Cb 0.09 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2d85 h LYS 75 CO -0.00 0.09 -0.05 -0.92 -0.57 0.00 0.00 179.45 178.00 2d85 h TYR 76 N 0.00 0.14 0.10 -1.35 3.20 -0.73 -1.32 116.97 117.01 2d85 h TYR 76 Ca -0.00 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 2d85 h TYR 76 Cb 0.18 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 2d85 h TYR 76 CO 0.00 0.58 -0.07 0.00 -1.64 0.00 0.00 178.16 177.03 2d85 h ALA 77 N 0.54 -0.15 -0.96 1.82 0.00 -1.03 -0.33 119.26 119.14 2d85 h ALA 77 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2d85 h ALA 77 Cb 0.55 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 2d85 h ALA 77 CO 0.01 -0.59 0.60 0.82 0.00 0.00 0.00 179.25 180.09 2d85 h ILE 78 N -0.17 1.26 -0.21 0.00 2.04 -1.49 -2.44 117.51 116.49 2d85 h ILE 78 Ca -0.00 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 2d85 h ILE 78 Cb 0.15 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.10 2d85 h ILE 78 CO -0.00 0.26 0.09 -1.28 0.00 0.00 0.00 178.15 177.22 2d85 h SER 79 N 1.32 0.29 -0.81 1.72 0.87 -0.92 -2.88 113.55 113.15 2d85 h SER 79 Ca 0.35 -0.16 0.09 0.00 -1.23 0.00 0.00 61.79 60.84 2d85 h SER 79 Cb -0.09 -0.08 -0.07 0.00 -0.44 0.00 0.00 62.40 61.72 2d85 h SER 79 CO -0.07 0.37 0.46 0.24 -0.53 0.00 0.00 176.83 177.30 2d85 h MET 80 N 0.19 0.75 -0.76 2.24 2.86 -0.77 -2.12 114.93 117.32 2d85 h MET 80 Ca 0.07 -0.04 0.15 0.00 -2.06 0.00 0.00 59.70 57.82 2d85 h MET 80 Cb 0.17 -0.17 -0.14 0.00 0.06 0.00 0.00 31.60 31.52 2d85 h MET 80 CO -0.01 0.49 -0.19 0.00 1.06 0.00 0.00 176.91 178.27 2d85 h ALA 81 N 1.45 0.50 -0.50 6.32 0.00 -1.22 0.23 119.26 126.03 2d85 h ALA 81 Ca 0.39 0.30 -0.12 0.00 0.00 0.00 0.00 54.91 55.47 2d85 h ALA 81 Cb 0.36 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2d85 h ALA 81 CO -0.25 -0.41 -0.17 -0.09 0.00 0.00 0.00 179.25 178.33 2d85 h ARG 82 N -0.00 1.00 -0.40 0.00 2.43 -0.92 -1.64 114.38 114.84 2d85 h ARG 82 Ca 0.36 -0.40 0.05 0.00 -0.81 0.00 0.00 59.98 59.19 2d85 h ARG 82 Cb 0.56 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.01 2d85 h ARG 82 CO -0.78 1.08 0.13 0.87 -1.51 0.00 0.00 179.97 179.76 2d85 h LYS 83 N 0.87 0.28 0.00 0.20 6.56 -0.23 -0.64 116.57 123.61 2d85 h LYS 83 Ca 0.12 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.70 2d85 h LYS 83 Cb 0.74 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.33 2d85 h LYS 83 CO 0.06 0.19 0.00 -0.84 -2.06 0.00 0.00 179.45 176.80 2d85 h ILE 84 N 0.29 0.00 0.00 1.86 3.07 -0.88 -3.48 117.51 118.37 2d85 h ILE 84 Ca 0.19 -0.46 0.00 0.00 1.55 0.00 0.00 64.86 66.14 2d85 h ILE 84 Cb 0.18 1.38 0.00 0.00 -0.27 0.00 0.00 36.82 38.11 2d85 h ILE 84 CO -0.20 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.51 2d85 n GLY 85 N 0.81 1.92 2.99 0.16 0.00 -0.25 -5.09 105.19 105.72 2d85 n GLY 85 Ca 0.04 -0.51 -0.53 0.00 0.00 0.00 0.00 46.02 45.02 2d85 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d85 n ALA 86 N 0.00 -1.89 -2.82 4.61 0.00 -1.05 -4.39 120.51 114.98 2d85 n ALA 86 Ca 0.00 0.44 -0.37 0.00 0.00 0.00 0.00 53.44 53.51 2d85 n ALA 86 Cb 0.00 -1.52 -0.11 0.00 0.00 0.00 0.00 19.45 17.82 2d85 n ALA 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2d85 s ARG 87 N 1.48 3.85 -0.19 0.00 3.52 -1.26 -2.22 118.95 124.13 2d85 s ARG 87 Ca 0.81 -0.38 -0.07 0.00 -0.13 0.00 0.00 55.73 55.96 2d85 s ARG 87 Cb -1.15 -3.45 -0.04 0.00 -1.56 0.00 0.00 34.95 28.75 2d85 s ARG 87 CO 0.59 -0.09 0.06 0.14 -0.81 0.00 0.00 175.30 175.19 2d85 s VAL 88 N 1.42 4.74 -0.64 7.11 -7.23 -1.26 -4.97 120.40 119.58 2d85 s VAL 88 Ca 0.06 -0.05 -0.03 0.00 -1.81 0.00 0.00 61.98 60.15 2d85 s VAL 88 Cb -0.15 -3.14 0.21 0.00 0.56 0.00 0.00 36.38 33.86 2d85 s VAL 88 CO 0.06 0.45 2.39 0.00 -0.31 0.00 0.00 175.10 177.69 2d85 n TYR 89 N 3.62 2.27 -4.40 2.82 4.19 -1.26 -4.94 117.16 119.46 2d85 n TYR 89 Ca -0.17 -2.15 -0.25 0.00 3.31 0.00 0.00 57.90 58.65 2d85 n TYR 89 Cb 0.52 -1.29 -0.09 0.00 0.49 0.00 0.00 39.34 38.98 2d85 n TYR 89 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2d85 s ALA 90 N -2.85 3.09 -0.14 2.98 0.00 -1.26 -4.91 121.76 118.66 2d85 s ALA 90 Ca 0.55 -1.96 -0.02 0.00 0.00 0.00 0.00 51.96 50.53 2d85 s ALA 90 Cb 0.41 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 2d85 s ALA 90 CO -0.30 0.11 -0.07 -1.17 0.00 0.00 0.00 175.76 174.33 2d85 s LEU 91 N -3.66 3.06 0.05 0.00 2.96 -1.26 -5.02 118.68 114.80 2d85 s LEU 91 Ca 0.33 -0.19 -0.19 0.00 -0.22 0.00 0.00 54.13 53.86 2d85 s LEU 91 Cb -0.00 -1.72 -0.13 0.00 0.50 0.00 0.00 46.19 44.84 2d85 s LEU 91 CO 0.18 0.18 1.36 1.55 -1.32 0.00 0.00 176.35 178.30 2d85 h PRO 92 N 6.60 0.43 -0.39 0.98 0.13 -1.97 -3.00 132.00 134.79 2d85 h PRO 92 Ca -0.30 -0.22 0.11 0.00 -0.87 0.00 0.00 66.00 64.72 2d85 h PRO 92 Cb 1.20 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2d85 h PRO 92 CO 0.60 0.79 0.88 0.93 -0.23 0.00 0.00 178.00 180.96 2d85 h GLU 93 N 0.08 0.00 0.06 0.86 5.08 -1.95 0.79 114.58 119.49 2d85 h GLU 93 Ca 0.03 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.02 2d85 h GLU 93 Cb 0.71 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.91 2d85 h GLU 93 CO 0.04 0.00 -2.21 -0.25 -1.00 0.00 0.00 179.01 175.59 2d85 n ASP 94 N -2.97 1.86 -0.35 1.42 9.92 -1.15 -4.30 116.55 120.97 2d85 n ASP 94 Ca 0.08 0.06 0.13 0.00 -0.53 0.00 0.00 54.79 54.53 2d85 n ASP 94 Cb 1.01 -0.50 0.33 0.00 -0.64 0.00 0.00 41.12 41.31 2d85 n ASP 94 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 2d85 h LEU 95 N 0.03 0.77 -1.44 0.64 5.85 0.72 0.60 115.31 122.49 2d85 h LEU 95 Ca -0.49 0.10 0.36 0.00 0.84 0.00 0.00 57.88 58.69 2d85 h LEU 95 Cb 1.99 -0.04 -0.11 0.00 0.37 0.00 0.00 40.66 42.88 2d85 h LEU 95 CO 0.01 0.26 0.78 0.58 -0.34 0.00 0.00 178.44 179.73 2d85 h VAL 96 N 0.75 0.32 -0.84 1.05 2.07 -1.63 0.85 116.25 118.81 2d85 h VAL 96 Ca 0.59 -0.07 -0.53 0.00 0.82 0.00 0.00 66.70 67.51 2d85 h VAL 96 Cb 0.93 0.08 -0.28 0.00 -1.52 0.00 0.00 31.29 30.50 2d85 h VAL 96 CO -0.39 0.04 0.40 -0.62 0.02 0.00 0.00 177.57 177.01 2d85 n GLU 97 N -4.62 2.55 -4.22 1.57 1.02 0.19 -4.67 120.64 112.46 2d85 n GLU 97 Ca 0.31 -3.33 -0.38 0.00 -0.02 0.00 0.00 57.16 53.74 2d85 n GLU 97 Cb 1.18 -2.17 -0.05 0.00 -0.02 0.00 0.00 31.44 30.38 2d85 n GLU 97 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2d85 n VAL 98 N -0.99 -1.74 -2.59 2.62 0.31 0.30 -4.83 118.33 111.40 2d85 n VAL 98 Ca 0.54 -0.54 -0.43 0.00 -0.01 0.00 0.00 64.34 63.90 2d85 n VAL 98 Cb 1.05 -1.56 -0.02 0.00 -0.91 0.00 0.00 33.84 32.40 2d85 n VAL 98 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2d85 s ASN 99 N -4.01 6.68 0.00 4.52 3.84 -1.11 -4.88 114.94 119.98 2d85 s ASN 99 Ca 0.22 0.61 0.15 0.00 0.21 0.00 0.00 52.86 54.05 2d85 s ASN 99 Cb -0.12 -2.55 0.79 0.00 -0.55 0.00 0.00 41.25 38.82 2d85 s ASN 99 CO 0.99 -1.19 1.39 -0.81 -2.79 0.00 0.00 177.10 174.69 2d85 n PRO 100 N 7.66 0.28 0.04 0.43 -0.04 -1.26 -2.38 135.00 139.72 2d85 n PRO 100 Ca 0.12 0.11 -0.20 0.00 -0.04 0.00 0.00 63.50 63.49 2d85 n PRO 100 Cb 0.49 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.34 2d85 n PRO 100 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2d85 h LYS 101 N 0.00 0.71 0.08 0.54 1.79 -1.97 -3.31 116.57 114.40 2d85 h LYS 101 Ca 0.00 -0.76 -0.35 0.00 -2.18 0.00 0.00 60.65 57.36 2d85 h LYS 101 Cb 0.11 0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 30.94 2d85 h LYS 101 CO 0.00 1.33 -1.93 0.00 -1.08 0.00 0.00 179.45 177.77 2d85 n MET 102 N -3.86 0.69 -0.57 3.15 0.00 -1.12 -4.17 117.12 111.25 2d85 n MET 102 Ca -0.11 0.32 0.46 0.00 0.00 0.00 0.00 57.70 58.36 2d85 n MET 102 Cb 0.88 -1.68 0.76 0.00 0.00 0.00 0.00 33.22 33.18 2d85 n MET 102 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2d85 h VAL 103 N -0.23 0.10 -0.68 3.17 2.07 -1.63 -1.40 116.25 117.65 2d85 h VAL 103 Ca -0.45 -0.01 0.11 0.00 0.82 0.00 0.00 66.70 67.18 2d85 h VAL 103 Cb 1.84 0.08 -0.11 0.00 -1.52 0.00 0.00 31.29 31.57 2d85 h VAL 103 CO -0.03 0.00 -0.25 0.80 0.02 0.00 0.00 177.57 178.12 2d85 n MET 104 N -4.21 -0.14 0.13 1.57 0.00 -1.25 0.36 117.12 113.58 2d85 n MET 104 Ca 0.39 1.04 -0.24 0.00 0.00 0.00 0.00 57.70 58.89 2d85 n MET 104 Cb 1.72 -1.55 -0.16 0.00 0.00 0.00 0.00 33.22 33.23 2d85 n MET 104 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 175.97 177.76 2d85 h THR 105 N 0.00 1.22 -0.88 1.12 1.35 -1.57 -2.33 112.91 111.82 2d85 h THR 105 Ca 0.25 -2.66 0.19 0.00 -0.55 0.00 0.00 66.41 63.65 2d85 h THR 105 Cb 0.42 3.00 -0.17 0.00 -1.73 0.00 0.00 68.15 69.67 2d85 h THR 105 CO -0.68 0.82 -0.16 0.52 -0.25 0.00 0.00 175.52 175.77 2d85 n VAL 106 N -3.71 -0.37 -0.09 6.82 0.31 0.16 -0.34 118.33 121.10 2d85 n VAL 106 Ca -0.18 2.00 -0.14 0.00 -0.01 0.00 0.00 64.34 66.01 2d85 n VAL 106 Cb 1.09 -2.81 -0.06 0.00 -0.91 0.00 0.00 33.84 31.15 2d85 n VAL 106 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2d85 n PHE 107 N -5.40 0.76 -0.32 3.52 3.72 -0.73 -4.04 117.46 114.97 2d85 n PHE 107 Ca 0.16 0.33 0.02 0.00 -0.05 0.00 0.00 57.45 57.90 2d85 n PHE 107 Cb 0.50 -0.88 0.07 0.00 -0.94 0.00 0.00 39.48 38.24 2d85 n PHE 107 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2d85 n ALA 108 N -3.72 0.03 -0.21 4.37 0.00 -0.88 0.24 120.51 120.34 2d85 n ALA 108 Ca -0.21 0.88 0.06 0.00 0.00 0.00 0.00 53.44 54.17 2d85 n ALA 108 Cb 0.50 -0.45 0.33 0.00 0.00 0.00 0.00 19.45 19.83 2d85 n ALA 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d85 h LEU 110 N 0.81 0.00 -1.09 0.00 3.38 0.29 -3.33 115.31 115.36 2d85 h LEU 110 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2d85 h LEU 110 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2d85 h LEU 110 CO -0.11 0.20 0.64 0.00 0.09 0.00 0.00 178.44 179.25 2d85 h MET 111 N -0.35 0.00 -1.27 1.13 -0.00 0.65 -1.65 114.93 113.44 2d85 h MET 111 Ca 0.00 0.00 0.41 0.00 -0.00 0.00 0.00 59.70 60.11 2d85 h MET 111 Cb 0.04 0.00 -0.13 0.00 -0.00 0.00 0.00 31.60 31.52 2d85 h MET 111 CO 0.00 0.00 0.82 0.78 -0.00 0.00 0.00 176.91 178.51 2d85 h GLY 112 N 0.00 1.33 0.44 -3.00 0.00 -1.02 0.70 103.07 101.51 2d85 h GLY 112 Ca 0.00 -0.13 0.14 0.00 0.00 0.00 0.00 47.33 47.34 2d85 h GLY 112 CO 0.00 -0.38 0.62 0.50 0.00 0.00 0.00 176.54 177.28 2d85 h LYS 113 N 0.12 0.86 -2.13 4.80 1.79 -1.55 -2.45 116.57 118.01 2d85 h LYS 113 Ca 0.79 -0.05 -0.10 0.00 -2.18 0.00 0.00 60.65 59.11 2d85 h LYS 113 Cb 2.42 -0.19 -0.04 0.00 -1.58 0.00 0.00 32.23 32.84 2d85 h LYS 113 CO -0.42 0.57 -0.14 0.41 -1.08 0.00 0.00 179.45 178.79 2d85 n GLY 114 N -1.37 2.43 3.75 3.86 0.00 0.24 -4.83 105.19 109.27 2d85 n GLY 114 Ca 0.19 -0.63 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 2d85 n GLY 114 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2d85 n MET 115 N 2.26 0.64 -3.32 1.61 2.81 -0.92 -4.71 117.12 115.49 2d85 n MET 115 Ca 0.23 -3.11 -0.17 0.00 -1.81 0.00 0.00 57.70 52.83 2d85 n MET 115 Cb 0.62 -0.06 0.07 0.00 -0.71 0.00 0.00 33.22 33.14 2d85 n MET 115 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2d85 n LYS 116 N -2.08 -6.17 -0.41 0.03 5.02 -1.26 -5.00 118.16 108.28 2d85 n LYS 116 Ca 0.11 0.72 -0.25 0.00 -2.02 0.00 0.00 58.31 56.87 2d85 n LYS 116 Cb 0.59 -5.39 0.23 0.00 -0.02 0.00 0.00 35.03 30.44 2d85 n LYS 116 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2d85 n ARG 117 N -3.97 -3.85 -0.07 1.97 1.74 -1.26 -4.91 116.66 106.31 2d85 n ARG 117 Ca -0.14 -1.28 -0.08 0.00 -0.77 0.00 0.00 57.85 55.58 2d85 n ARG 117 Cb 0.61 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.55 2d85 n ARG 117 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2d85 h VAL 118 N -3.07 0.92 -3.75 1.55 2.07 -2.00 -3.45 116.25 108.51 2d85 h VAL 118 Ca -0.33 -0.07 -0.08 0.00 0.82 0.00 0.00 66.70 67.04 2d85 h VAL 118 Cb 1.07 0.69 -0.11 0.00 -1.52 0.00 0.00 31.29 31.42 2d85 h VAL 118 CO 0.20 0.04 -0.21 -0.94 0.02 0.00 0.00 177.57 176.68 2d85 s SER 119 N -5.32 -0.05 0.00 0.57 1.04 -1.26 -5.17 113.70 103.50 2d85 s SER 119 Ca -0.13 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 55.44 2d85 s SER 119 Cb 0.11 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.74 2d85 s SER 119 CO 0.70 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 174.52 2d85 n GLY 120 N -0.30 2.63 0.00 7.32 0.00 -1.26 -4.99 105.19 108.59 2d85 n GLY 120 Ca -0.05 -0.45 0.08 0.00 0.00 0.00 0.00 46.02 45.59 2d85 n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d85 n PRO 121 N 0.00 0.40 -2.64 1.61 -0.04 -1.26 -4.76 135.00 128.30 2d85 n PRO 121 Ca 0.00 0.05 -0.40 0.00 -0.04 0.00 0.00 63.50 63.10 2d85 n PRO 121 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 2d85 n PRO 121 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2d85 s SER 122 N -2.19 7.47 0.08 3.54 1.04 -1.26 -4.97 113.70 117.40 2d85 s SER 122 Ca 0.20 2.01 -0.26 0.00 0.48 0.00 0.00 55.95 58.38 2d85 s SER 122 Cb 0.11 -2.61 -0.16 0.00 0.10 0.00 0.00 66.02 63.45 2d85 s SER 122 CO 0.20 -0.02 1.68 -1.28 0.98 0.00 0.00 173.24 174.80 2d85 h SER 123 N 4.55 -0.26 0.00 7.02 0.87 -2.05 -3.52 113.55 120.16 2d85 h SER 123 Ca -0.45 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2d85 h SER 123 Cb 1.21 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 2d85 h SER 123 CO 0.69 -0.17 0.00 0.61 -0.53 0.00 0.00 176.83 177.43