#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d85 s SER 2 N 0.00 3.00 0.14 1.61 0.15 -1.26 -5.05 113.70 112.30 2d85 s SER 2 Ca 0.00 -0.63 -0.25 0.00 0.70 0.00 0.00 55.95 55.77 2d85 s SER 2 Cb 0.00 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 64.08 2d85 s SER 2 CO 0.00 0.20 1.61 -1.28 1.20 0.00 0.00 173.24 174.97 2d85 h SER 3 N 4.48 -0.98 0.00 5.45 0.87 -2.10 -3.47 113.55 117.80 2d85 h SER 3 Ca -0.47 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 2d85 h SER 3 Cb 1.16 0.43 0.00 0.00 -0.44 0.00 0.00 62.40 63.55 2d85 h SER 3 CO 0.42 -0.34 0.00 0.61 -0.53 0.00 0.00 176.83 176.99 2d85 n GLY 4 N -1.40 3.46 3.34 5.77 0.00 -1.26 -5.12 105.19 109.98 2d85 n GLY 4 Ca -0.02 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 2d85 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d85 n SER 5 N 0.00 -2.24 -3.64 1.61 7.64 -1.26 -5.04 113.62 110.69 2d85 n SER 5 Ca 0.00 0.08 -0.05 0.00 1.01 0.00 0.00 58.87 59.90 2d85 n SER 5 Cb 0.00 -1.07 -0.07 0.00 -1.01 0.00 0.00 64.21 62.06 2d85 n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2d85 s SER 6 N -1.93 -0.88 0.00 6.43 1.04 -1.26 -5.11 113.70 112.00 2d85 s SER 6 Ca 0.56 1.38 0.00 0.00 0.48 0.00 0.00 55.95 58.37 2d85 s SER 6 Cb -0.16 1.44 0.00 0.00 0.10 0.00 0.00 66.02 67.39 2d85 s SER 6 CO 0.67 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.28 2d85 n GLY 7 N 4.31 4.41 0.13 7.32 0.00 -1.26 -4.73 105.19 115.37 2d85 n GLY 7 Ca -0.19 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.40 2d85 n GLY 7 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2d85 h ASN 8 N 0.00 0.35 0.76 1.61 2.35 -2.02 -3.11 115.58 115.50 2d85 h ASN 8 Ca 0.00 -0.43 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 2d85 h ASN 8 Cb 0.00 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.27 2d85 h ASN 8 CO 0.00 0.70 -0.43 0.47 -1.65 0.00 0.00 177.43 176.52 2d85 n ASP 9 N -4.62 0.50 0.00 5.81 8.00 -1.26 -3.60 116.55 121.38 2d85 n ASP 9 Ca -0.06 0.04 0.10 0.00 0.71 0.00 0.00 54.79 55.59 2d85 n ASP 9 Cb 0.31 0.04 0.48 0.00 -0.02 0.00 0.00 41.12 41.93 2d85 n ASP 9 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2d85 n ASP 10 N -1.74 0.00 0.09 -2.24 -0.08 -1.18 -2.75 116.55 108.66 2d85 n ASP 10 Ca 0.05 0.30 0.11 0.00 -1.51 0.00 0.00 54.79 53.74 2d85 n ASP 10 Cb 0.38 -0.42 0.45 0.00 2.34 0.00 0.00 41.12 43.86 2d85 n ASP 10 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2d85 n ILE 11 N -1.42 0.81 0.22 5.18 3.06 -1.23 -2.86 119.36 123.13 2d85 n ILE 11 Ca 0.07 0.17 0.10 0.00 -2.50 0.00 0.00 62.75 60.59 2d85 n ILE 11 Cb 0.21 -1.04 0.66 0.00 0.54 0.00 0.00 39.64 40.01 2d85 n ILE 11 CO 0.00 0.00 0.00 0.40 -2.50 0.00 0.00 176.55 174.45 2d85 h ILE 12 N 0.00 0.94 0.01 9.51 2.04 -1.80 -0.30 117.51 127.91 2d85 h ILE 12 Ca 0.00 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.73 2d85 h ILE 12 Cb 0.38 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 2d85 h ILE 12 CO 0.00 0.00 -0.70 0.58 0.00 0.00 0.00 178.15 178.03 2d85 h VAL 13 N 0.00 1.32 -0.34 1.67 2.07 -1.80 -3.27 116.25 115.89 2d85 h VAL 13 Ca 0.04 -2.27 0.06 0.00 0.82 0.00 0.00 66.70 65.35 2d85 h VAL 13 Cb 0.16 2.78 -0.05 0.00 -1.52 0.00 0.00 31.29 32.66 2d85 h VAL 13 CO -0.00 0.47 0.02 -1.13 0.02 0.00 0.00 177.57 176.95 2d85 h ASN 14 N -0.95 -0.10 -0.85 0.57 -0.73 -1.62 -1.50 115.58 110.39 2d85 h ASN 14 Ca -0.19 0.07 0.11 0.00 1.87 0.00 0.00 56.30 58.17 2d85 h ASN 14 Cb 1.20 0.13 -0.08 0.00 0.27 0.00 0.00 38.32 39.83 2d85 h ASN 14 CO -0.10 -0.02 0.48 -0.25 -0.37 0.00 0.00 177.43 177.18 2d85 h TRP 15 N 0.12 0.87 0.39 0.67 7.01 -1.23 -1.30 115.95 122.48 2d85 h TRP 15 Ca 0.17 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.18 2d85 h TRP 15 Cb 0.22 -0.26 0.00 0.00 -2.10 0.00 0.00 29.16 27.02 2d85 h TRP 15 CO -0.23 0.32 -0.19 0.28 -2.79 0.00 0.00 178.44 175.83 2d85 h VAL 16 N 0.77 0.62 0.03 2.65 2.07 -1.36 -0.52 116.25 120.51 2d85 h VAL 16 Ca 0.43 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.81 2d85 h VAL 16 Cb 0.46 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.88 2d85 h VAL 16 CO -0.28 0.03 -0.40 0.78 0.02 0.00 0.00 177.57 177.72 2d85 h ASN 17 N -0.62 -1.20 0.18 0.57 2.35 -0.85 -1.20 115.58 114.82 2d85 h ASN 17 Ca -0.05 0.14 0.01 0.00 -0.55 0.00 0.00 56.30 55.85 2d85 h ASN 17 Cb 0.45 0.47 -0.04 0.00 0.05 0.00 0.00 38.32 39.25 2d85 h ASN 17 CO 0.09 -0.45 -0.39 -0.33 -1.65 0.00 0.00 177.43 174.70 2d85 h GLU 18 N -0.57 -0.63 -1.02 0.81 5.08 -1.25 0.21 114.58 117.20 2d85 h GLU 18 Ca 0.04 0.04 0.30 0.00 -1.00 0.00 0.00 59.36 58.75 2d85 h GLU 18 Cb 0.64 0.14 -0.14 0.00 0.50 0.00 0.00 28.75 29.90 2d85 h GLU 18 CO -0.29 -0.42 0.60 1.15 -1.00 0.00 0.00 179.01 179.05 2d85 h THR 19 N -0.66 0.37 -0.03 1.13 2.02 -0.82 0.36 112.91 115.29 2d85 h THR 19 Ca 0.01 -0.13 -0.26 0.00 0.77 0.00 0.00 66.41 66.80 2d85 h THR 19 Cb 0.66 -0.05 0.02 0.00 -1.74 0.00 0.00 68.15 67.04 2d85 h THR 19 CO -0.19 0.07 -1.00 -0.07 0.37 0.00 0.00 175.52 174.70 2d85 h LEU 20 N 0.39 0.91 -0.10 2.58 3.38 -0.25 -3.15 115.31 119.08 2d85 h LEU 20 Ca 0.70 -0.71 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2d85 h LEU 20 Cb 1.58 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 2d85 h LEU 20 CO -0.54 1.51 0.06 -0.09 0.09 0.00 0.00 178.44 179.47 2d85 h ARG 21 N 0.42 0.13 -0.67 1.13 9.65 0.27 0.22 114.38 125.54 2d85 h ARG 21 Ca -0.12 -0.01 0.11 0.00 -1.10 0.00 0.00 59.98 58.86 2d85 h ARG 21 Cb 1.65 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 30.16 2d85 h ARG 21 CO 0.20 0.13 0.44 0.93 2.80 0.00 0.00 179.97 184.47 2d85 h GLU 22 N 0.10 0.45 0.00 0.20 5.08 -0.86 0.18 114.58 119.73 2d85 h GLU 22 Ca 0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2d85 h GLU 22 Cb 0.03 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.18 2d85 h GLU 22 CO -0.01 0.30 -0.45 0.00 -1.00 0.00 0.00 179.01 177.85 2d85 n ALA 23 N -2.51 3.07 -2.75 3.43 0.00 -0.90 -4.96 120.51 115.90 2d85 n ALA 23 Ca 0.11 -0.26 -0.08 0.00 0.00 0.00 0.00 53.44 53.22 2d85 n ALA 23 Cb 0.40 -1.21 0.03 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.77 -2.69 -2.98 0.00 1.02 0.64 -5.03 120.64 109.83 2d85 n GLU 24 Ca 0.05 0.30 -0.31 0.00 -0.02 0.00 0.00 57.16 57.18 2d85 n GLU 24 Cb 0.38 -3.72 -0.04 0.00 -0.02 0.00 0.00 31.44 28.04 2d85 n GLU 24 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2d85 s LYS 25 N -5.10 3.86 -0.01 3.49 3.01 0.41 -4.98 119.74 120.42 2d85 s LYS 25 Ca 0.13 0.53 0.16 0.00 -1.01 0.00 0.00 55.97 55.78 2d85 s LYS 25 Cb -0.06 -2.41 0.47 0.00 -1.01 0.00 0.00 37.83 34.82 2d85 s LYS 25 CO 0.26 0.05 1.39 0.43 0.51 0.00 0.00 175.35 177.99 2d85 n SER 26 N -0.92 2.92 -4.89 2.83 7.64 -1.26 -4.75 113.62 115.19 2d85 n SER 26 Ca 0.03 -2.04 -0.23 0.00 1.01 0.00 0.00 58.87 57.63 2d85 n SER 26 Cb 0.54 -0.37 -0.04 0.00 -1.01 0.00 0.00 64.21 63.33 2d85 n SER 26 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2d85 s SER 27 N -0.97 5.93 -0.20 6.43 1.04 -1.26 -5.08 113.70 119.58 2d85 s SER 27 Ca 0.36 -0.04 -0.33 0.00 0.48 0.00 0.00 55.95 56.42 2d85 s SER 27 Cb 0.19 -1.65 0.15 0.00 0.10 0.00 0.00 66.02 64.80 2d85 s SER 27 CO 0.23 -0.01 1.20 -0.94 0.98 0.00 0.00 173.24 174.71 2d85 s SER 28 N -3.60 -0.16 -0.04 7.02 1.04 -1.26 -4.89 113.70 111.81 2d85 s SER 28 Ca 0.33 0.07 0.05 0.00 0.48 0.00 0.00 55.95 56.88 2d85 s SER 28 Cb -0.09 0.15 -0.01 0.00 0.10 0.00 0.00 66.02 66.17 2d85 s SER 28 CO 0.27 -0.22 -0.18 0.27 0.98 0.00 0.00 173.24 174.36 2d85 s ILE 29 N -1.90 1.46 0.01 -1.02 -4.36 -1.26 -4.77 121.20 109.36 2d85 s ILE 29 Ca 0.07 -0.75 -0.18 0.00 -0.26 0.00 0.00 60.65 59.54 2d85 s ILE 29 Cb -0.01 -1.25 -0.32 0.00 1.25 0.00 0.00 42.46 42.13 2d85 s ILE 29 CO -0.05 0.42 1.00 -1.28 0.24 0.00 0.00 174.94 175.28 2d85 h SER 30 N 6.09 0.74 -5.37 4.36 0.87 -1.95 -3.48 113.55 114.81 2d85 h SER 30 Ca -0.34 -0.89 0.19 0.00 -1.23 0.00 0.00 61.79 59.52 2d85 h SER 30 Cb 1.17 -0.24 -0.08 0.00 -0.44 0.00 0.00 62.40 62.81 2d85 h SER 30 CO 0.48 1.57 0.52 -0.55 -0.53 0.00 0.00 176.83 178.32 2d85 s SER 31 N -7.32 -0.15 0.61 6.23 0.15 -1.26 -4.99 113.70 106.97 2d85 s SER 31 Ca -0.11 -0.41 0.25 0.00 0.70 0.00 0.00 55.95 56.38 2d85 s SER 31 Cb 0.03 0.47 0.97 0.00 -1.71 0.00 0.00 66.02 65.78 2d85 s SER 31 CO 0.90 -0.87 1.40 -0.26 1.20 0.00 0.00 173.24 175.62 2d85 h PHE 32 N 2.00 0.00 -1.85 3.44 0.04 -2.00 0.45 116.94 119.01 2d85 h PHE 32 Ca -0.25 0.00 -0.69 0.00 2.80 0.00 0.00 57.97 59.83 2d85 h PHE 32 Cb 1.23 0.00 -0.34 0.00 2.20 0.00 0.00 35.95 39.04 2d85 h PHE 32 CO 0.47 0.00 0.23 1.63 -0.60 0.00 0.00 178.31 180.04 2d85 n LYS 33 N -3.26 3.28 -3.13 1.51 5.02 -1.26 -4.75 118.16 115.58 2d85 n LYS 33 Ca 0.18 -4.11 -0.39 0.00 -2.02 0.00 0.00 58.31 51.98 2d85 n LYS 33 Cb 1.31 -2.28 -0.06 0.00 -0.02 0.00 0.00 35.03 33.99 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 -2.25 7.18 0.08 4.39 -1.08 0.16 -4.99 116.67 120.16 2d85 s ASP 34 Ca 0.49 1.40 -0.17 0.00 -0.52 0.00 0.00 52.55 53.75 2d85 s ASP 34 Cb 0.39 -2.42 -0.11 0.00 -1.46 0.00 0.00 42.92 39.32 2d85 s ASP 34 CO -0.28 0.19 1.39 1.55 0.52 0.00 0.00 175.17 178.54 2d85 h PRO 35 N 4.78 0.56 -0.91 4.34 0.13 -1.96 -3.06 132.00 135.88 2d85 h PRO 35 Ca -0.47 -0.29 0.27 0.00 -0.87 0.00 0.00 66.00 64.63 2d85 h PRO 35 Cb 1.21 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 2d85 h PRO 35 CO 0.66 0.88 0.69 0.87 -0.23 0.00 0.00 178.00 180.88 2d85 h LYS 36 N 0.26 0.00 -0.40 0.86 6.56 -1.94 0.33 116.57 122.24 2d85 h LYS 36 Ca 0.04 0.00 0.10 0.00 -1.06 0.00 0.00 60.65 59.73 2d85 h LYS 36 Cb 0.78 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.42 2d85 h LYS 36 CO 0.06 0.00 0.28 0.82 -2.06 0.00 0.00 179.45 178.55 2d85 h ILE 37 N 0.00 0.84 -0.22 1.86 2.04 -1.87 -0.07 117.51 120.09 2d85 h ILE 37 Ca 0.43 -0.03 0.03 0.00 1.00 0.00 0.00 64.86 66.29 2d85 h ILE 37 Cb 1.81 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 2d85 h ILE 37 CO -0.00 0.02 0.15 -1.28 0.00 0.00 0.00 178.15 177.03 2d85 h SER 38 N 0.09 0.16 0.50 1.72 0.87 -0.49 0.57 113.55 116.96 2d85 h SER 38 Ca 0.19 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2d85 h SER 38 Cb 0.64 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2d85 h SER 38 CO -0.02 0.11 -0.38 0.35 -0.53 0.00 0.00 176.83 176.37 2d85 n THR 39 N -4.50 0.00 -1.88 2.23 -2.24 -0.05 -4.56 114.28 103.28 2d85 n THR 39 Ca 0.01 -0.03 -0.11 0.00 -2.27 0.00 0.00 64.05 61.65 2d85 n THR 39 Cb 0.17 0.17 -0.02 0.00 -2.10 0.00 0.00 70.33 68.54 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 -1.32 -3.96 0.10 3.42 7.64 0.19 -4.80 113.62 114.89 2d85 n SER 40 Ca 0.07 0.10 -0.12 0.00 1.01 0.00 0.00 58.87 59.93 2d85 n SER 40 Cb 0.33 -2.91 -0.08 0.00 -1.01 0.00 0.00 64.21 60.54 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 -0.25 -1.19 -3.43 3.38 -1.79 0.14 115.31 112.17 2d85 h LEU 41 Ca -0.26 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.38 2d85 h LEU 41 Cb 1.03 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2d85 h LEU 41 CO 0.33 0.19 -0.33 1.55 0.09 0.00 0.00 178.44 180.27 2d85 h PRO 42 N -0.76 0.00 0.15 1.13 0.13 -1.86 -0.34 132.00 130.44 2d85 h PRO 42 Ca -0.03 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.79 2d85 h PRO 42 Cb 0.50 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.64 2d85 h PRO 42 CO 0.05 0.33 -1.49 0.28 -0.23 0.00 0.00 178.00 176.94 2d85 h VAL 43 N 0.00 1.22 0.06 1.56 2.07 -1.91 -2.70 116.25 116.55 2d85 h VAL 43 Ca -0.00 -2.81 -0.00 0.00 0.82 0.00 0.00 66.70 64.70 2d85 h VAL 43 Cb 0.74 2.84 0.00 0.00 -1.52 0.00 0.00 31.29 33.35 2d85 h VAL 43 CO 0.04 0.84 -0.03 -0.07 0.02 0.00 0.00 177.57 178.37 2d85 h LEU 44 N 0.08 -0.06 -0.69 2.57 3.38 -0.64 -3.22 115.31 116.74 2d85 h LEU 44 Ca -0.23 -0.57 -0.00 0.00 0.09 0.00 0.00 57.88 57.17 2d85 h LEU 44 Cb 2.04 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 42.77 2d85 h LEU 44 CO 0.19 0.65 0.42 0.44 0.09 0.00 0.00 178.44 180.22 2d85 h ASP 45 N -0.89 0.82 -0.86 -0.43 5.19 -1.23 -2.55 116.42 116.47 2d85 h ASP 45 Ca -0.01 -0.06 0.18 0.00 -0.62 0.00 0.00 57.03 56.52 2d85 h ASP 45 Cb 0.63 -0.21 -0.11 0.00 0.18 0.00 0.00 39.33 39.82 2d85 h ASP 45 CO 0.01 0.64 0.40 0.25 -3.12 0.00 0.00 179.24 177.42 2d85 h LEU 46 N 0.93 0.41 0.79 1.55 5.85 -1.59 -2.36 115.31 120.90 2d85 h LEU 46 Ca 0.25 0.12 -0.04 0.00 0.84 0.00 0.00 57.88 59.05 2d85 h LEU 46 Cb -0.04 0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.08 2d85 h LEU 46 CO -0.05 0.11 -0.39 0.40 -0.34 0.00 0.00 178.44 178.17 2d85 h ILE 47 N 0.50 0.00 -0.98 4.05 2.04 -1.46 -3.10 117.51 118.55 2d85 h ILE 47 Ca 0.50 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.51 2d85 h ILE 47 Cb 0.84 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.76 2d85 h ILE 47 CO -0.44 0.00 -0.39 -0.67 0.00 0.00 0.00 178.15 176.65 2d85 n ASP 48 N -4.90 -0.65 -0.35 1.72 2.03 -0.93 0.12 116.55 113.58 2d85 n ASP 48 Ca -0.13 1.72 0.26 0.00 0.52 0.00 0.00 54.79 57.16 2d85 n ASP 48 Cb 0.42 -0.39 0.52 0.00 -0.72 0.00 0.00 41.12 40.95 2d85 n ASP 48 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2d85 h ALA 49 N 1.33 2.15 0.59 -1.67 0.00 -1.37 -0.50 119.26 119.79 2d85 h ALA 49 Ca 0.34 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.37 2d85 h ALA 49 Cb 0.58 0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.53 2d85 h ALA 49 CO -0.97 -0.74 -0.28 0.82 0.00 0.00 0.00 179.25 178.07 2d85 h ILE 50 N 0.28 0.29 -3.39 0.00 1.08 0.11 -3.42 117.51 112.45 2d85 h ILE 50 Ca 0.73 -0.31 -0.59 0.00 -0.39 0.00 0.00 64.86 64.31 2d85 h ILE 50 Cb 1.84 0.38 -0.37 0.00 -3.07 0.00 0.00 36.82 35.60 2d85 h ILE 50 CO -0.53 0.03 -0.80 -1.58 -0.69 0.00 0.00 178.15 174.59 2d85 s GLN 51 N -5.03 1.73 -0.01 2.37 0.74 -0.20 -5.11 119.66 114.15 2d85 s GLN 51 Ca -0.15 -0.71 -0.30 0.00 0.05 0.00 0.00 55.36 54.25 2d85 s GLN 51 Cb 0.02 -2.25 -0.06 0.00 1.10 0.00 0.00 33.01 31.83 2d85 s GLN 51 CO 0.51 -0.44 1.46 -1.25 -0.55 0.00 0.00 175.29 175.02 2d85 s PRO 52 N 1.50 4.25 0.00 1.67 0.04 -1.19 -3.84 135.00 137.43 2d85 s PRO 52 Ca -0.01 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2d85 s PRO 52 Cb -0.16 -3.65 0.00 0.00 0.04 0.00 0.00 34.50 30.73 2d85 s PRO 52 CO -0.08 -0.65 0.00 0.41 0.04 0.00 0.00 177.00 176.73 2d85 n GLY 53 N 3.76 1.37 1.35 0.56 0.00 -1.26 -5.05 105.19 105.91 2d85 n GLY 53 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2d85 n GLY 53 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2d85 n SER 54 N 0.00 0.59 -4.77 1.61 3.41 -1.25 -5.07 113.62 108.14 2d85 n SER 54 Ca 0.00 0.22 -0.38 0.00 -0.26 0.00 0.00 58.87 58.44 2d85 n SER 54 Cb 0.00 -0.08 -0.06 0.00 -0.26 0.00 0.00 64.21 63.81 2d85 n SER 54 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2d85 s ILE 55 N -1.85 4.24 -0.53 -1.33 -1.09 -1.26 -5.03 121.20 114.35 2d85 s ILE 55 Ca 0.00 1.82 0.04 0.00 -2.23 0.00 0.00 60.65 60.28 2d85 s ILE 55 Cb 0.00 -4.13 0.15 0.00 -1.58 0.00 0.00 42.46 36.91 2d85 s ILE 55 CO 0.00 0.35 0.34 0.21 -1.23 0.00 0.00 174.94 174.61 2d85 s ASN 56 N -1.37 3.64 0.35 3.58 2.47 -1.26 -4.97 114.94 117.38 2d85 s ASN 56 Ca 0.43 -3.14 0.15 0.00 0.42 0.00 0.00 52.86 50.72 2d85 s ASN 56 Cb -0.22 -1.16 1.15 0.00 -1.45 0.00 0.00 41.25 39.56 2d85 s ASN 56 CO 0.27 -0.19 1.62 1.88 -3.72 0.00 0.00 177.10 176.96 2d85 h TYR 57 N 6.07 0.76 -0.91 0.43 0.05 -1.96 0.71 116.97 122.12 2d85 h TYR 57 Ca 0.09 0.04 0.21 0.00 0.05 0.00 0.00 58.73 59.12 2d85 h TYR 57 Cb 0.87 -0.17 -0.12 0.00 1.01 0.00 0.00 36.73 38.32 2d85 h TYR 57 CO 0.51 -0.33 0.44 0.22 -1.05 0.00 0.00 178.16 177.94 2d85 h ASP 58 N 0.15 0.44 0.90 3.88 3.58 -1.99 0.66 116.42 124.03 2d85 h ASP 58 Ca 0.76 0.14 -0.18 0.00 0.42 0.00 0.00 57.03 58.17 2d85 h ASP 58 Cb 1.84 0.09 -0.03 0.00 1.72 0.00 0.00 39.33 42.95 2d85 h ASP 58 CO -0.71 0.07 -1.19 -0.07 -2.88 0.00 0.00 179.24 174.46 2d85 h LEU 59 N 0.48 0.00-10.07 2.28 3.38 -0.07 -3.46 115.31 107.85 2d85 h LEU 59 Ca 0.56 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 58.00 2d85 h LEU 59 Cb 1.01 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.85 2d85 h LEU 59 CO -0.48 0.70 0.48 -0.76 0.09 0.00 0.00 178.44 178.47 2d85 s LEU 60 N -6.14 3.76 0.00 1.67 1.43 0.22 -5.00 118.68 114.63 2d85 s LEU 60 Ca -0.01 2.37 0.00 0.00 -1.03 0.00 0.00 54.13 55.46 2d85 s LEU 60 Cb 0.08 -4.50 0.00 0.00 0.03 0.00 0.00 46.19 41.80 2d85 s LEU 60 CO 0.80 -1.40 0.02 0.29 0.23 0.00 0.00 176.35 176.30 2d85 n LYS 61 N -1.28 0.00 -3.56 1.70 4.76 -1.26 -4.90 118.16 113.62 2d85 n LYS 61 Ca 0.12 0.48 -0.24 0.00 -2.87 0.00 0.00 58.31 55.79 2d85 n LYS 61 Cb 0.49 -0.99 -0.03 0.00 -1.84 0.00 0.00 35.03 32.66 2d85 n LYS 61 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 2d85 n THR 62 N -1.94 -0.48 -3.70 -0.18 5.66 -1.26 -4.87 114.28 107.52 2d85 n THR 62 Ca 0.00 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.72 2d85 n THR 62 Cb 0.00 -1.01 -0.11 0.00 -1.55 0.00 0.00 70.33 67.65 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 -6.19 1.76 -1.58 1.09 -1.05 -1.26 -4.87 118.70 106.60 2d85 s GLU 63 Ca 0.45 -2.73 -0.12 0.00 -0.15 0.00 0.00 54.97 52.43 2d85 s GLU 63 Cb -0.25 -2.58 0.10 0.00 -0.44 0.00 0.00 34.13 30.95 2d85 s GLU 63 CO 0.56 -1.30 0.69 0.27 0.95 0.00 0.00 175.26 176.42 2d85 n ASN 64 N 2.50 -2.49 -4.07 0.83 0.23 -1.26 -4.87 115.26 106.13 2d85 n ASN 64 Ca 0.22 -0.98 -0.37 0.00 -0.53 0.00 0.00 54.58 52.92 2d85 n ASN 64 Cb 0.39 -3.00 0.06 0.00 -2.08 0.00 0.00 39.78 35.15 2d85 n ASN 64 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2d85 n LEU 65 N -4.43 -3.35 -4.41 -4.53 4.32 -1.26 -5.02 117.00 98.32 2d85 n LEU 65 Ca -0.06 0.03 -0.22 0.00 -0.02 0.00 0.00 56.01 55.74 2d85 n LEU 65 Cb 0.56 -0.67 -0.09 0.00 -1.62 0.00 0.00 43.42 41.60 2d85 n LEU 65 CO 0.81 -3.38 -0.19 0.54 -1.22 0.00 0.00 177.39 173.95 2d85 s ASN 66 N -1.20 2.12 0.62 -1.43 4.22 -1.26 -4.77 114.94 113.23 2d85 s ASN 66 Ca 0.41 -1.63 0.22 0.00 -2.14 0.00 0.00 52.86 49.73 2d85 s ASN 66 Cb -0.01 0.44 0.82 0.00 1.28 0.00 0.00 41.25 43.78 2d85 s ASN 66 CO 0.70 -0.92 1.31 0.44 -2.04 0.00 0.00 177.10 176.58 2d85 h ASP 67 N 2.02 0.00 0.00 3.54 3.32 -1.98 0.43 116.42 123.75 2d85 h ASP 67 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2d85 h ASP 67 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2d85 h ASP 67 CO 0.52 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 178.51 2d85 n ASP 68 N -3.14 0.00 -0.17 6.45 8.00 -1.26 -4.10 116.55 122.33 2d85 n ASP 68 Ca 0.17 0.18 -0.03 0.00 0.71 0.00 0.00 54.79 55.82 2d85 n ASP 68 Cb 1.34 -0.45 0.03 0.00 -0.02 0.00 0.00 41.12 42.03 2d85 n ASP 68 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2d85 h GLU 69 N 0.00 -0.06 -0.89 -1.24 5.08 -1.75 -0.32 114.58 115.40 2d85 h GLU 69 Ca 0.00 0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.59 2d85 h GLU 69 Cb 0.00 0.01 -0.16 0.00 0.50 0.00 0.00 28.75 29.10 2d85 h GLU 69 CO 0.00 -0.04 0.02 0.87 -1.00 0.00 0.00 179.01 178.86 2d85 h LYS 70 N -0.06 0.06 0.78 2.33 1.57 -0.41 -1.30 116.57 119.54 2d85 h LYS 70 Ca 0.25 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.99 2d85 h LYS 70 Cb 0.45 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.75 2d85 h LYS 70 CO -0.58 0.04 -0.38 1.25 -0.57 0.00 0.00 179.45 179.21 2d85 h LEU 71 N 0.06 -0.90 -0.88 2.94 5.85 -1.21 -2.20 115.31 118.98 2d85 h LEU 71 Ca 0.51 0.03 0.28 0.00 0.84 0.00 0.00 57.88 59.55 2d85 h LEU 71 Cb 0.99 0.23 -0.16 0.00 0.37 0.00 0.00 40.66 42.09 2d85 h LEU 71 CO -0.81 -0.64 0.16 0.59 -0.34 0.00 0.00 178.44 177.40 2d85 n ASN 72 N -4.84 0.02 -0.19 1.25 3.02 -0.55 0.24 115.26 114.22 2d85 n ASN 72 Ca -0.13 1.49 -0.07 0.00 -0.03 0.00 0.00 54.58 55.84 2d85 n ASN 72 Cb 0.42 -0.60 0.08 0.00 -0.61 0.00 0.00 39.78 39.07 2d85 n ASN 72 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2d85 h ASN 73 N 0.00 0.96 -0.99 6.41 4.21 -1.17 -2.82 115.58 122.17 2d85 h ASN 73 Ca 0.60 -0.25 0.09 0.00 1.21 0.00 0.00 56.30 57.96 2d85 h ASN 73 Cb 1.37 -0.26 -0.07 0.00 -1.12 0.00 0.00 38.32 38.24 2d85 h ASN 73 CO -0.79 0.99 0.63 0.00 -1.29 0.00 0.00 177.43 176.98 2d85 h ALA 74 N 1.11 1.43 -0.60 -0.83 0.00 0.37 -1.59 119.26 119.15 2d85 h ALA 74 Ca 0.17 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2d85 h ALA 74 Cb 0.49 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2d85 h ALA 74 CO 0.02 0.34 0.17 0.87 0.00 0.00 0.00 179.25 180.65 2d85 h LYS 75 N 1.08 0.94 -0.16 0.00 6.56 -1.17 -2.80 116.57 121.03 2d85 h LYS 75 Ca 0.46 -0.21 0.02 0.00 -1.06 0.00 0.00 60.65 59.85 2d85 h LYS 75 Cb 0.31 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 31.82 2d85 h LYS 75 CO -0.21 0.85 0.04 -0.92 -2.06 0.00 0.00 179.45 177.15 2d85 h TYR 76 N 0.86 0.07 0.24 -1.35 3.20 -1.19 0.35 116.97 119.16 2d85 h TYR 76 Ca 0.19 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 2d85 h TYR 76 Cb 0.31 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 2d85 h TYR 76 CO 0.02 0.03 -0.36 0.00 -1.64 0.00 0.00 178.16 176.22 2d85 h ALA 77 N 1.11 -0.96 -0.12 1.82 0.00 -1.30 0.40 119.26 120.21 2d85 h ALA 77 Ca 0.07 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2d85 h ALA 77 Cb 0.05 0.66 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2d85 h ALA 77 CO -0.08 -1.01 0.08 0.82 0.00 0.00 0.00 179.25 179.06 2d85 h ILE 78 N -0.63 1.00 0.00 0.00 2.04 -1.45 -0.41 117.51 118.07 2d85 h ILE 78 Ca -0.03 -0.04 -0.11 0.00 1.00 0.00 0.00 64.86 65.68 2d85 h ILE 78 Cb 0.57 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 2d85 h ILE 78 CO -0.11 0.02 -0.53 0.28 0.00 0.00 0.00 178.15 177.82 2d85 h SER 79 N 0.11 0.00 0.18 1.72 0.02 0.43 -3.21 113.55 112.80 2d85 h SER 79 Ca 0.05 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.72 2d85 h SER 79 Cb 0.06 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.62 2d85 h SER 79 CO -0.01 0.53 -1.27 -0.03 -1.14 0.00 0.00 176.83 174.90 2d85 h MET 80 N 0.00 0.39 -0.30 3.45 1.85 0.13 -3.17 114.93 117.28 2d85 h MET 80 Ca -0.01 -0.66 0.03 0.00 -0.61 0.00 0.00 59.70 58.46 2d85 h MET 80 Cb 1.00 0.25 -0.05 0.00 0.43 0.00 0.00 31.60 33.22 2d85 h MET 80 CO 0.07 1.32 -0.32 0.00 -0.40 0.00 0.00 176.91 177.57 2d85 h ALA 81 N 0.08 -0.52 0.00 0.39 0.00 -1.15 0.24 119.26 118.31 2d85 h ALA 81 Ca -0.24 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2d85 h ALA 81 Cb 1.90 1.00 -0.00 0.00 0.00 0.00 0.00 17.79 20.69 2d85 h ALA 81 CO 0.18 -0.69 -0.03 0.07 0.00 0.00 0.00 179.25 178.78 2d85 h ARG 82 N -0.18 0.00 0.78 0.00 -0.00 -1.53 -1.22 114.38 112.23 2d85 h ARG 82 Ca 0.05 0.00 -0.04 0.00 -0.00 0.00 0.00 59.98 59.99 2d85 h ARG 82 Cb 0.32 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.29 2d85 h ARG 82 CO -0.38 0.03 -0.40 -0.22 -0.00 0.00 0.00 179.97 179.01 2d85 h LYS 83 N 0.00 -1.04 -0.01 0.08 3.64 -0.57 -2.93 116.57 115.73 2d85 h LYS 83 Ca -0.00 0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.36 2d85 h LYS 83 Cb 0.07 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2d85 h LYS 83 CO 0.00 -0.69 -0.43 -0.84 -2.27 0.00 0.00 179.45 175.22 2d85 h ILE 84 N -1.08 1.31 0.00 2.00 3.07 -0.89 -3.47 117.51 118.45 2d85 h ILE 84 Ca -0.11 -1.48 0.00 0.00 1.55 0.00 0.00 64.86 64.82 2d85 h ILE 84 Cb 0.84 1.78 0.00 0.00 -0.27 0.00 0.00 36.82 39.17 2d85 h ILE 84 CO 0.16 0.43 0.00 0.61 -1.05 0.00 0.00 178.15 178.30 2d85 n GLY 85 N -0.28 0.47 3.15 0.16 0.00 -0.54 -5.13 105.19 103.01 2d85 n GLY 85 Ca -0.02 -0.42 0.04 0.00 0.00 0.00 0.00 46.02 45.63 2d85 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d85 s ALA 86 N 0.00 -2.61 0.24 4.61 0.00 -0.72 -4.92 121.76 118.36 2d85 s ALA 86 Ca 0.00 1.55 -0.31 0.00 0.00 0.00 0.00 51.96 53.19 2d85 s ALA 86 Cb 0.00 -2.36 -0.12 0.00 0.00 0.00 0.00 23.12 20.64 2d85 s ALA 86 CO 0.00 -1.53 1.65 0.54 0.00 0.00 0.00 175.76 176.42 2d85 n ARG 87 N 5.41 2.68 -3.80 0.00 1.74 -1.26 -2.59 116.66 118.84 2d85 n ARG 87 Ca 0.00 0.96 -0.24 0.00 -0.77 0.00 0.00 57.85 57.80 2d85 n ARG 87 Cb 0.53 -2.77 -0.17 0.00 -1.02 0.00 0.00 32.46 29.03 2d85 n ARG 87 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2d85 s VAL 88 N 0.61 0.53 -0.80 1.55 1.01 -1.26 -4.53 120.40 117.51 2d85 s VAL 88 Ca 0.70 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.69 2d85 s VAL 88 Cb -0.52 -0.67 0.34 0.00 0.00 0.00 0.00 36.38 35.53 2d85 s VAL 88 CO 0.40 0.26 1.54 0.00 0.00 0.00 0.00 175.10 177.30 2d85 n TYR 89 N 5.10 3.24 -4.31 5.22 4.19 -1.26 -4.99 117.16 124.35 2d85 n TYR 89 Ca -0.08 -2.98 -0.15 0.00 3.31 0.00 0.00 57.90 58.00 2d85 n TYR 89 Cb 0.50 -0.87 -0.04 0.00 0.49 0.00 0.00 39.34 39.42 2d85 n TYR 89 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2d85 n ALA 90 N -0.25 0.32 -3.04 2.98 0.00 -1.26 -4.96 120.51 114.29 2d85 n ALA 90 Ca 0.43 -1.20 -0.21 0.00 0.00 0.00 0.00 53.44 52.45 2d85 n ALA 90 Cb 0.34 0.79 -0.16 0.00 0.00 0.00 0.00 19.45 20.42 2d85 n ALA 90 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2d85 s LEU 91 N 0.00 1.79 0.00 0.00 2.96 -1.26 -5.02 118.68 117.15 2d85 s LEU 91 Ca 0.10 -0.22 0.14 0.00 -0.22 0.00 0.00 54.13 53.94 2d85 s LEU 91 Cb 0.00 -0.63 0.61 0.00 0.50 0.00 0.00 46.19 46.68 2d85 s LEU 91 CO 0.07 0.08 1.45 -0.81 -1.32 0.00 0.00 176.35 175.82 2d85 n PRO 92 N 3.31 0.01 0.10 0.98 -0.04 -1.26 -1.62 135.00 136.47 2d85 n PRO 92 Ca -0.19 0.25 -0.22 0.00 -0.04 0.00 0.00 63.50 63.31 2d85 n PRO 92 Cb 0.54 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.35 2d85 n PRO 92 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2d85 h GLU 93 N 0.00 0.40 0.00 0.54 5.08 -1.95 -3.34 114.58 115.31 2d85 h GLU 93 Ca 0.00 -0.69 -0.13 0.00 -1.00 0.00 0.00 59.36 57.54 2d85 h GLU 93 Cb 0.24 0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2d85 h GLU 93 CO 0.00 1.31 -1.18 -0.44 -1.00 0.00 0.00 179.01 177.70 2d85 h ASP 94 N 0.11 0.00 0.04 1.42 3.32 -1.94 -3.33 116.42 116.04 2d85 h ASP 94 Ca -0.28 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.77 2d85 h ASP 94 Cb 2.10 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.65 2d85 h ASP 94 CO 0.21 0.46 -0.02 0.25 -1.72 0.00 0.00 179.24 178.43 2d85 h LEU 95 N 0.00 0.00 -1.03 1.55 5.85 -1.44 -1.52 115.31 118.72 2d85 h LEU 95 Ca -0.11 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.55 2d85 h LEU 95 Cb 1.45 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.46 2d85 h LEU 95 CO 0.04 0.02 0.05 0.58 -0.34 0.00 0.00 178.44 178.79 2d85 h VAL 96 N 0.00 1.23 -0.32 1.05 2.07 -1.68 -1.94 116.25 116.65 2d85 h VAL 96 Ca -0.00 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.64 2d85 h VAL 96 Cb 0.04 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 2d85 h VAL 96 CO 0.00 0.31 0.00 -0.62 0.02 0.00 0.00 177.57 177.29 2d85 n GLU 97 N -4.25 2.99 -2.46 1.57 1.02 -0.61 -4.19 120.64 114.71 2d85 n GLU 97 Ca 0.03 -1.68 -0.15 0.00 -0.02 0.00 0.00 57.16 55.33 2d85 n GLU 97 Cb 0.26 -1.85 -0.01 0.00 -0.02 0.00 0.00 31.44 29.82 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 0.38 -0.75 -1.45 2.62 0.31 -0.73 -4.74 118.33 113.97 2d85 n VAL 98 Ca 0.15 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 64.03 2d85 n VAL 98 Cb 0.72 -2.17 -0.13 0.00 -0.91 0.00 0.00 33.84 31.35 2d85 n VAL 98 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2d85 n ASN 99 N -1.89 0.68 0.00 4.52 5.03 -0.98 -4.72 115.26 117.90 2d85 n ASN 99 Ca -0.18 0.23 0.08 0.00 0.87 0.00 0.00 54.58 55.58 2d85 n ASN 99 Cb 0.63 -1.00 0.45 0.00 -1.02 0.00 0.00 39.78 38.84 2d85 n ASN 99 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 2d85 n PRO 100 N 8.33 0.49 0.03 3.52 -0.04 -1.26 -1.87 135.00 144.20 2d85 n PRO 100 Ca 0.60 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 64.04 2d85 n PRO 100 Cb 0.08 -1.48 -0.08 0.00 -0.04 0.00 0.00 33.50 31.97 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 0.00 0.00 0.54 1.57 -1.97 -3.39 116.57 113.32 2d85 h LYS 101 Ca 0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.49 2d85 h LYS 101 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 2d85 h LYS 101 CO 0.00 0.36 -2.08 0.00 -0.57 0.00 0.00 179.45 177.16 2d85 n MET 102 N -2.96 1.06 0.21 3.15 0.00 -0.96 -4.42 117.12 113.20 2d85 n MET 102 Ca -0.10 0.05 0.13 0.00 0.00 0.00 0.00 57.70 57.78 2d85 n MET 102 Cb 0.87 -1.39 0.47 0.00 0.00 0.00 0.00 33.22 33.17 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 0.00 0.06 -0.74 3.17 2.07 -1.57 -0.68 116.25 118.55 2d85 h VAL 103 Ca -0.43 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.26 2d85 h VAL 103 Cb 1.83 0.33 -0.12 0.00 -1.52 0.00 0.00 31.29 31.81 2d85 h VAL 103 CO -0.02 0.00 0.06 0.00 0.02 0.00 0.00 177.57 177.63 2d85 h MET 104 N 0.00 0.14 0.11 1.57 -0.00 -1.77 -2.16 114.93 112.82 2d85 h MET 104 Ca 0.11 -0.01 -0.34 0.00 -0.00 0.00 0.00 59.70 59.46 2d85 h MET 104 Cb 1.54 -0.03 -0.02 0.00 -0.00 0.00 0.00 31.60 33.09 2d85 h MET 104 CO -0.00 0.09 -1.84 1.79 -0.00 0.00 0.00 176.91 176.96 2d85 h THR 105 N 0.14 0.79 -0.90 -0.10 1.35 -1.46 -3.08 112.91 109.66 2d85 h THR 105 Ca 0.41 -2.50 0.18 0.00 -0.55 0.00 0.00 66.41 63.94 2d85 h THR 105 Cb 0.73 2.57 -0.17 0.00 -1.73 0.00 0.00 68.15 69.55 2d85 h THR 105 CO -0.62 0.80 -0.24 0.52 -0.25 0.00 0.00 175.52 175.74 2d85 n VAL 106 N -3.41 -0.39 0.05 6.82 0.31 -0.84 -0.82 118.33 120.05 2d85 n VAL 106 Ca -0.26 2.06 -0.23 0.00 -0.01 0.00 0.00 64.34 65.91 2d85 n VAL 106 Cb 1.05 -2.84 -0.15 0.00 -0.91 0.00 0.00 33.84 31.00 2d85 n VAL 106 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2d85 h PHE 107 N 0.00 0.66 -0.23 3.52 0.04 -1.66 -3.40 116.94 115.88 2d85 h PHE 107 Ca 0.42 -0.48 0.02 0.00 2.80 0.00 0.00 57.97 60.73 2d85 h PHE 107 Cb 0.64 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.74 2d85 h PHE 107 CO -0.70 1.72 -0.14 0.00 -0.60 0.00 0.00 178.31 178.59 2d85 n ALA 108 N -2.90 -0.15 -0.51 2.45 0.00 -0.00 0.17 120.51 119.57 2d85 n ALA 108 Ca -0.27 0.19 0.42 0.00 0.00 0.00 0.00 53.44 53.78 2d85 n ALA 108 Cb 1.07 0.28 0.71 0.00 0.00 0.00 0.00 19.45 21.51 2d85 n ALA 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d85 n LEU 110 N -4.44 0.22 -0.19 0.00 4.77 0.45 -4.03 117.00 113.78 2d85 n LEU 110 Ca 0.38 0.36 0.28 0.00 -0.03 0.00 0.00 56.01 57.00 2d85 n LEU 110 Cb 1.59 -0.45 0.47 0.00 -2.33 0.00 0.00 43.42 42.70 2d85 n LEU 110 CO 0.29 -0.45 1.25 0.00 -1.33 0.00 0.00 177.39 177.15 2d85 h MET 111 N 0.00 0.00 -1.81 3.23 -0.00 0.62 -0.80 114.93 116.17 2d85 h MET 111 Ca 0.00 0.00 0.53 0.00 -0.00 0.00 0.00 59.70 60.23 2d85 h MET 111 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 31.60 31.53 2d85 h MET 111 CO 0.00 0.00 1.33 0.41 -0.00 0.00 0.00 176.91 178.65 2d85 n GLY 112 N -1.70 -0.92 0.16 -3.00 0.00 0.11 0.14 105.19 99.98 2d85 n GLY 112 Ca 0.22 0.64 -0.10 0.00 0.00 0.00 0.00 46.02 46.77 2d85 n GLY 112 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2d85 h LYS 113 N 0.00 0.47 0.56 1.61 3.11 -1.41 -3.32 116.57 117.59 2d85 h LYS 113 Ca 0.86 -0.11 -0.03 0.00 -2.81 0.00 0.00 60.65 58.56 2d85 h LYS 113 Cb 3.52 -0.06 0.01 0.00 -1.00 0.00 0.00 32.23 34.69 2d85 h LYS 113 CO -0.01 0.54 -0.27 0.78 -2.81 0.00 0.00 179.45 177.69 2d85 h GLY 114 N 0.31 -0.78 -3.09 5.01 0.00 1.00 -3.46 103.07 102.05 2d85 h GLY 114 Ca 0.09 0.29 -0.52 0.00 0.00 0.00 0.00 47.33 47.19 2d85 h GLY 114 CO 0.00 -0.28 -0.78 -0.29 0.00 0.00 0.00 176.54 175.19 2d85 s MET 115 N -4.02 1.33 0.35 4.80 1.75 -1.06 -5.16 119.30 117.29 2d85 s MET 115 Ca -0.11 -1.47 0.03 0.00 -1.25 0.00 0.00 55.69 52.90 2d85 s MET 115 Cb 0.01 -1.36 -0.05 0.00 2.84 0.00 0.00 34.83 36.27 2d85 s MET 115 CO 0.33 0.27 0.08 -1.59 -0.65 0.00 0.00 175.02 173.46 2d85 s LYS 116 N -2.97 1.72 0.33 4.11 0.00 -1.26 -4.03 119.74 117.64 2d85 s LYS 116 Ca 0.18 -1.99 0.07 0.00 0.00 0.00 0.00 55.97 54.23 2d85 s LYS 116 Cb -0.05 -0.76 -0.02 0.00 0.00 0.00 0.00 37.83 36.99 2d85 s LYS 116 CO 0.07 -0.28 0.24 0.54 0.00 0.00 0.00 175.35 175.92 2d85 n ARG 117 N -0.74 0.43 -3.62 1.78 1.74 -1.26 -5.15 116.66 109.84 2d85 n ARG 117 Ca -0.03 -3.20 -0.37 0.00 -0.77 0.00 0.00 57.85 53.48 2d85 n ARG 117 Cb 0.66 2.43 -0.06 0.00 -1.02 0.00 0.00 32.46 34.47 2d85 n ARG 117 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2d85 s VAL 118 N -3.23 5.26 0.02 1.55 0.11 -1.26 -5.09 120.40 117.75 2d85 s VAL 118 Ca 0.34 0.57 0.05 0.00 -2.93 0.00 0.00 61.98 60.00 2d85 s VAL 118 Cb 0.02 -3.60 -0.02 0.00 -1.53 0.00 0.00 36.38 31.25 2d85 s VAL 118 CO 0.24 0.53 -0.15 -0.55 -3.33 0.00 0.00 175.10 171.84 2d85 s SER 119 N -0.54 1.72 0.14 3.54 0.15 -1.26 -5.14 113.70 112.31 2d85 s SER 119 Ca 0.19 -0.37 -0.10 0.00 0.70 0.00 0.00 55.95 56.37 2d85 s SER 119 Cb -0.14 -0.15 0.04 0.00 -1.71 0.00 0.00 66.02 64.06 2d85 s SER 119 CO 0.08 0.11 0.50 0.61 1.20 0.00 0.00 173.24 175.73 2d85 n GLY 120 N 2.28 1.14 3.62 9.45 0.00 -1.26 -5.12 105.19 115.30 2d85 n GLY 120 Ca -0.16 -1.08 -0.43 0.00 0.00 0.00 0.00 46.02 44.35 2d85 n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d85 s PRO 121 N -2.04 3.62 -0.50 1.61 0.04 -1.26 -4.97 135.00 131.50 2d85 s PRO 121 Ca 0.11 1.50 -0.06 0.00 0.04 0.00 0.00 61.00 62.58 2d85 s PRO 121 Cb -0.02 -4.09 0.13 0.00 0.04 0.00 0.00 34.50 30.56 2d85 s PRO 121 CO 0.04 -1.51 0.34 -1.12 0.04 0.00 0.00 177.00 174.79 2d85 s SER 122 N 4.81 5.54 -0.03 6.66 0.01 -1.26 -5.04 113.70 124.38 2d85 s SER 122 Ca 0.73 -2.17 -0.30 0.00 1.31 0.00 0.00 55.95 55.52 2d85 s SER 122 Cb -0.23 -1.94 0.07 0.00 0.21 0.00 0.00 66.02 64.14 2d85 s SER 122 CO 0.31 -0.58 0.69 -0.44 0.41 0.00 0.00 173.24 173.63 2d85 s SER 123 N 2.01 -0.63 0.00 2.44 0.01 -1.26 -5.34 113.70 110.93 2d85 s SER 123 Ca 0.09 0.62 0.18 0.00 1.31 0.00 0.00 55.95 58.15 2d85 s SER 123 Cb -0.23 0.53 1.10 0.00 0.21 0.00 0.00 66.02 67.63 2d85 s SER 123 CO -0.03 -0.63 1.50 0.61 0.41 0.00 0.00 173.24 175.10