#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d89 s SER 2 N 0.00 6.95 0.13 1.61 0.15 -1.26 -4.89 113.70 116.39 2d89 s SER 2 Ca 0.00 -2.74 -0.27 0.00 0.70 0.00 0.00 55.95 53.65 2d89 s SER 2 Cb 0.00 -2.40 -0.07 0.00 -1.71 0.00 0.00 66.02 61.84 2d89 s SER 2 CO 0.00 -0.83 1.46 0.28 1.20 0.00 0.00 173.24 175.35 2d89 h SER 3 N 7.62 -1.74 0.00 5.45 0.02 -2.09 -3.44 113.55 119.37 2d89 h SER 3 Ca 0.27 0.25 0.00 0.00 -0.84 0.00 0.00 61.79 61.47 2d89 h SER 3 Cb 0.92 0.75 0.00 0.00 0.14 0.00 0.00 62.40 64.21 2d89 h SER 3 CO 1.20 -0.25 0.00 0.61 -1.14 0.00 0.00 176.83 177.26 2d89 n GLY 4 N -1.25 -1.39 3.22 -3.77 0.00 -1.26 -5.17 105.19 95.58 2d89 n GLY 4 Ca 0.00 0.37 -0.29 0.00 0.00 0.00 0.00 46.02 46.10 2d89 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d89 s SER 5 N 0.00 2.71 0.55 1.61 1.04 -1.26 -5.14 113.70 113.22 2d89 s SER 5 Ca 0.00 -0.44 -0.07 0.00 0.48 0.00 0.00 55.95 55.92 2d89 s SER 5 Cb 0.00 -0.67 -0.02 0.00 0.10 0.00 0.00 66.02 65.43 2d89 s SER 5 CO 0.00 0.22 0.88 -0.44 0.98 0.00 0.00 173.24 174.89 2d89 s SER 6 N -0.17 6.01 -0.30 7.02 0.01 -1.26 -4.69 113.70 120.32 2d89 s SER 6 Ca -0.01 0.97 -0.11 0.00 1.31 0.00 0.00 55.95 58.10 2d89 s SER 6 Cb -0.12 -2.11 0.01 0.00 0.21 0.00 0.00 66.02 64.01 2d89 s SER 6 CO 0.02 -0.82 0.41 0.61 0.41 0.00 0.00 173.24 173.87 2d89 n GLY 7 N -2.49 -1.29 0.00 3.44 0.00 -1.26 -4.86 105.19 98.73 2d89 n GLY 7 Ca 0.03 0.85 0.08 0.00 0.00 0.00 0.00 46.02 46.98 2d89 n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d89 n PRO 8 N -0.31 0.48 -1.09 1.61 -0.04 -1.26 -4.82 135.00 129.56 2d89 n PRO 8 Ca 0.08 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.30 2d89 n PRO 8 Cb 0.31 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.14 2d89 n PRO 8 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2d89 n ASN 9 N -1.01 -0.31 -3.64 3.54 4.13 -1.26 -4.76 115.26 111.95 2d89 n ASN 9 Ca 0.11 -0.08 -0.06 0.00 1.68 0.00 0.00 54.58 56.23 2d89 n ASN 9 Cb 0.06 -0.55 -0.07 0.00 -1.54 0.00 0.00 39.78 37.68 2d89 n ASN 9 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2d89 s ALA 10 N 3.89 -1.96 0.16 5.41 0.00 -1.26 -5.04 121.76 122.95 2d89 s ALA 10 Ca 0.97 2.39 -0.29 0.00 0.00 0.00 0.00 51.96 55.03 2d89 s ALA 10 Cb -0.79 -1.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.81 2d89 s ALA 10 CO 0.38 -0.39 1.55 0.66 0.00 0.00 0.00 175.76 177.96 2d89 h SER 11 N 6.87 -1.82 -0.26 0.00 4.64 -2.00 -0.20 113.55 120.79 2d89 h SER 11 Ca -0.29 0.27 0.06 0.00 -0.47 0.00 0.00 61.79 61.37 2d89 h SER 11 Cb 1.22 0.80 -0.07 0.00 -0.31 0.00 0.00 62.40 64.03 2d89 h SER 11 CO 0.16 -0.33 -0.28 -0.61 -0.87 0.00 0.00 176.83 174.91 2d89 h GLN 12 N -0.20 -0.27 -0.58 4.77 5.75 -1.97 -0.58 115.11 122.03 2d89 h GLN 12 Ca 0.15 0.02 0.12 0.00 -0.15 0.00 0.00 58.65 58.79 2d89 h GLN 12 Cb 0.53 0.06 -0.11 0.00 1.07 0.00 0.00 27.48 29.04 2d89 h GLN 12 CO -0.75 -0.18 -0.09 0.77 -2.65 0.00 0.00 178.83 175.93 2d89 h SER 13 N -0.28 -0.44 0.91 -0.69 0.02 -1.44 0.62 113.55 112.25 2d89 h SER 13 Ca 0.14 0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 61.21 2d89 h SER 13 Cb 0.50 0.32 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2d89 h SER 13 CO -0.41 -0.16 -0.49 0.25 -1.14 0.00 0.00 176.83 174.87 2d89 h LEU 14 N 0.04 -1.20 -0.75 5.07 5.85 -0.15 0.44 115.31 124.61 2d89 h LEU 14 Ca 0.29 0.05 0.17 0.00 0.84 0.00 0.00 57.88 59.24 2d89 h LEU 14 Cb 0.45 0.33 -0.13 0.00 0.37 0.00 0.00 40.66 41.69 2d89 h LEU 14 CO -0.56 -0.79 0.06 0.25 -0.34 0.00 0.00 178.44 177.05 2d89 h LEU 15 N -1.29 -0.24 -0.50 2.25 5.85 -0.63 0.79 115.31 121.53 2d89 h LEU 15 Ca -0.12 0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2d89 h LEU 15 Cb 1.01 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 42.32 2d89 h LEU 15 CO 0.17 -0.14 0.24 0.58 -0.34 0.00 0.00 178.44 178.94 2d89 h VAL 16 N 0.14 1.20 -0.61 1.05 2.07 -0.70 -2.03 116.25 117.37 2d89 h VAL 16 Ca 0.42 -0.56 0.10 0.00 0.82 0.00 0.00 66.70 67.48 2d89 h VAL 16 Cb 0.74 0.63 -0.08 0.00 -1.52 0.00 0.00 31.29 31.06 2d89 h VAL 16 CO -0.62 0.22 0.19 -0.25 0.02 0.00 0.00 177.57 177.12 2d89 h TRP 17 N 0.67 0.31 0.22 1.57 7.01 0.14 0.52 115.95 126.40 2d89 h TRP 17 Ca 0.17 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 2d89 h TRP 17 Cb 0.13 -0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.14 2d89 h TRP 17 CO -0.01 0.04 -0.10 0.00 -2.79 0.00 0.00 178.44 175.58 2d89 h LYS 19 N -0.53 0.32 0.08 0.00 1.57 -0.91 -2.05 116.57 115.05 2d89 h LYS 19 Ca -0.03 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2d89 h LYS 19 Cb 0.40 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2d89 h LYS 19 CO 0.05 0.21 -0.04 1.49 -0.57 0.00 0.00 179.45 180.59 2d89 h GLU 20 N 0.33 -0.10 -0.36 3.15 4.81 0.23 -1.50 114.58 121.14 2d89 h GLU 20 Ca 0.12 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.46 2d89 h GLU 20 Cb 0.08 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2d89 h GLU 20 CO -0.03 -0.07 0.52 -0.39 -0.73 0.00 0.00 179.01 178.32 2d89 h VAL 21 N -0.12 0.22 -0.72 0.32 -1.51 -1.40 0.64 116.25 113.68 2d89 h VAL 21 Ca -0.01 0.00 -0.35 0.00 -1.23 0.00 0.00 66.70 65.10 2d89 h VAL 21 Cb 0.08 0.55 -0.21 0.00 -2.13 0.00 0.00 31.29 29.58 2d89 h VAL 21 CO 0.02 0.00 0.33 0.35 -1.23 0.00 0.00 177.57 177.04 2d89 n THR 22 N -3.40 2.92 -2.29 7.19 -2.24 -0.78 -4.75 114.28 110.93 2d89 n THR 22 Ca 0.06 -2.21 -0.42 0.00 -2.27 0.00 0.00 64.05 59.21 2d89 n THR 22 Cb 0.67 -0.40 -0.03 0.00 -2.10 0.00 0.00 70.33 68.48 2d89 n THR 22 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2d89 s LYS 23 N -3.24 4.28 -0.73 -0.78 -0.14 0.22 -3.15 119.74 116.21 2d89 s LYS 23 Ca 0.52 1.86 -0.03 0.00 -1.36 0.00 0.00 55.97 56.97 2d89 s LYS 23 Cb 0.45 -3.64 0.00 0.00 -1.68 0.00 0.00 37.83 32.96 2d89 s LYS 23 CO 0.07 -0.59 0.63 0.09 -0.76 0.00 0.00 175.35 174.79 2d89 n ASN 24 N 5.69 -3.33 -4.99 2.83 3.02 -1.26 -5.04 115.26 112.18 2d89 n ASN 24 Ca 0.13 -0.33 -0.20 0.00 -0.03 0.00 0.00 54.58 54.15 2d89 n ASN 24 Cb 0.44 -3.10 0.02 0.00 -0.61 0.00 0.00 39.78 36.53 2d89 n ASN 24 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2d89 s TYR 25 N -3.19 2.03 -0.96 3.10 1.51 -1.19 -5.02 117.35 113.64 2d89 s TYR 25 Ca 0.18 -0.62 -0.24 0.00 -1.01 0.00 0.00 57.07 55.38 2d89 s TYR 25 Cb -0.08 -2.21 0.01 0.00 -0.11 0.00 0.00 41.96 39.57 2d89 s TYR 25 CO 0.41 -0.70 1.67 0.50 -1.11 0.00 0.00 175.55 176.33 2d89 s ARG 26 N -4.44 3.12 -0.84 -0.62 6.06 -1.26 -4.12 118.95 116.84 2d89 s ARG 26 Ca 0.54 -0.71 -0.03 0.00 -2.50 0.00 0.00 55.73 53.03 2d89 s ARG 26 Cb -0.06 -5.19 -0.02 0.00 0.06 0.00 0.00 34.95 29.74 2d89 s ARG 26 CO 0.33 -2.72 0.75 0.41 -2.50 0.00 0.00 175.30 171.57 2d89 n GLY 27 N 6.82 -1.21 2.76 8.12 0.00 -1.26 -4.99 105.19 115.42 2d89 n GLY 27 Ca 0.35 0.51 -0.28 0.00 0.00 0.00 0.00 46.02 46.60 2d89 n GLY 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d89 s VAL 28 N -3.12 2.02 -0.65 1.61 1.01 -1.26 -4.97 120.40 115.05 2d89 s VAL 28 Ca 0.14 -3.47 -0.01 0.00 0.00 0.00 0.00 61.98 58.63 2d89 s VAL 28 Cb -0.02 -2.36 0.16 0.00 0.00 0.00 0.00 36.38 34.16 2d89 s VAL 28 CO 0.77 -1.01 0.46 -0.75 0.00 0.00 0.00 175.10 174.57 2d89 s LYS 29 N -0.63 2.56 -1.18 2.72 2.20 -1.26 -4.88 119.74 119.26 2d89 s LYS 29 Ca 0.24 -2.71 -0.23 0.00 -0.36 0.00 0.00 55.97 52.91 2d89 s LYS 29 Cb -0.09 -3.67 -0.09 0.00 -1.51 0.00 0.00 37.83 32.46 2d89 s LYS 29 CO -0.12 -1.18 1.94 -0.89 -0.36 0.00 0.00 175.35 174.74 2d89 n ILE 30 N 3.15 1.89 0.06 5.43 -0.00 -1.26 -4.64 119.36 124.00 2d89 n ILE 30 Ca 0.10 -1.96 -0.13 0.00 -0.00 0.00 0.00 62.75 60.76 2d89 n ILE 30 Cb 0.36 -2.17 -0.13 0.00 -0.00 0.00 0.00 39.64 37.70 2d89 n ILE 30 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.55 177.26 2d89 h THR 31 N 6.13 1.37 -3.94 1.39 1.35 -1.96 -3.48 112.91 113.77 2d89 h THR 31 Ca 0.22 -3.04 -0.31 0.00 -0.55 0.00 0.00 66.41 62.72 2d89 h THR 31 Cb 0.93 2.79 -0.08 0.00 -1.73 0.00 0.00 68.15 70.07 2d89 h THR 31 CO 1.23 0.85 -0.28 0.59 -0.25 0.00 0.00 175.52 177.66 2d89 n ASN 32 N -3.39 0.37 -0.55 5.36 3.02 -1.26 -5.07 115.26 113.74 2d89 n ASN 32 Ca -0.10 -2.33 0.07 0.00 -0.03 0.00 0.00 54.58 52.20 2d89 n ASN 32 Cb 1.01 0.81 0.16 0.00 -0.61 0.00 0.00 39.78 41.16 2d89 n ASN 32 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2d89 n PHE 33 N -0.47 0.00 0.05 3.10 3.72 -1.26 -4.47 117.46 118.13 2d89 n PHE 33 Ca 0.00 -1.20 0.00 0.00 -0.05 0.00 0.00 57.45 56.21 2d89 n PHE 33 Cb 0.37 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 2d89 n PHE 33 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2d89 n THR 34 N -0.98 0.50 -0.10 4.37 -2.24 -1.26 -4.40 114.28 110.17 2d89 n THR 34 Ca 0.16 0.16 -0.17 0.00 -2.27 0.00 0.00 64.05 61.94 2d89 n THR 34 Cb 0.73 -1.19 -0.08 0.00 -2.10 0.00 0.00 70.33 67.68 2d89 n THR 34 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2d89 n THR 35 N -3.24 1.50 -0.54 4.28 -2.24 -1.26 -2.28 114.28 110.50 2d89 n THR 35 Ca 0.00 0.03 0.42 0.00 -2.27 0.00 0.00 64.05 62.24 2d89 n THR 35 Cb 0.13 -2.14 0.67 0.00 -2.10 0.00 0.00 70.33 66.88 2d89 n THR 35 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2d89 n SER 36 N -4.48 0.08 -0.06 3.42 7.64 -1.26 0.21 113.62 119.17 2d89 n SER 36 Ca -0.25 1.02 -0.01 0.00 1.01 0.00 0.00 58.87 60.63 2d89 n SER 36 Cb 0.56 -0.50 -0.14 0.00 -1.01 0.00 0.00 64.21 63.12 2d89 n SER 36 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2d89 n TRP 37 N -4.00 0.00 -0.25 1.43 7.02 -1.26 -4.47 117.44 115.90 2d89 n TRP 37 Ca 0.38 0.00 0.06 0.00 -1.02 0.00 0.00 57.50 56.92 2d89 n TRP 37 Cb 1.61 -0.70 0.13 0.00 -2.42 0.00 0.00 31.31 29.93 2d89 n TRP 37 CO 0.00 0.00 0.00 -2.13 -2.02 0.00 0.00 177.69 173.54 2d89 n ARG 38 N -2.46 -0.06 0.14 -0.99 0.63 0.58 0.47 116.66 114.97 2d89 n ARG 38 Ca -0.19 1.09 -0.13 0.00 -0.92 0.00 0.00 57.85 57.71 2d89 n ARG 38 Cb 0.84 -1.66 -0.08 0.00 0.45 0.00 0.00 32.46 32.01 2d89 n ARG 38 CO 0.00 0.00 0.00 -2.95 -2.51 0.00 0.00 177.63 172.17 2d89 h ASN 39 N 0.00 -0.32 0.00 6.15 -1.07 -1.79 -3.46 115.58 115.10 2d89 h ASN 39 Ca 0.36 -0.20 0.00 0.00 0.07 0.00 0.00 56.30 56.54 2d89 h ASN 39 Cb 0.62 0.08 0.00 0.00 -2.07 0.00 0.00 38.32 36.95 2d89 h ASN 39 CO -0.71 0.06 0.00 0.61 0.07 0.00 0.00 177.43 177.45 2d89 n GLY 40 N -0.25 1.49 0.07 9.14 0.00 0.18 -3.78 105.19 112.02 2d89 n GLY 40 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 2d89 n GLY 40 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d89 h LEU 41 N 0.00 0.00 -0.92 0.99 3.38 -1.78 -3.28 115.31 113.70 2d89 h LEU 41 Ca 0.00 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 57.82 2d89 h LEU 41 Cb 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 2d89 h LEU 41 CO 0.00 0.83 0.58 0.28 0.09 0.00 0.00 178.44 180.21 2d89 h SER 42 N -1.00 0.91 -0.44 -0.43 0.02 -1.91 0.25 113.55 110.95 2d89 h SER 42 Ca -0.06 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 60.97 2d89 h SER 42 Cb 0.54 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.85 2d89 h SER 42 CO -0.04 0.58 0.12 -0.26 -1.14 0.00 0.00 176.83 176.09 2d89 h PHE 43 N 1.05 0.20 -0.09 3.45 0.04 -1.92 0.12 116.94 119.78 2d89 h PHE 43 Ca 0.40 0.02 -0.23 0.00 2.80 0.00 0.00 57.97 60.96 2d89 h PHE 43 Cb 0.19 -0.02 0.01 0.00 2.20 0.00 0.00 35.95 38.32 2d89 h PHE 43 CO -0.02 0.05 -0.87 0.00 -0.60 0.00 0.00 178.31 176.87 2d89 h ALA 45 N 0.56 -0.38 0.06 0.00 0.00 -0.07 -0.88 119.26 118.55 2d89 h ALA 45 Ca -0.08 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2d89 h ALA 45 Cb 1.50 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 19.49 2d89 h ALA 45 CO 0.17 -0.73 -0.45 0.82 0.00 0.00 0.00 179.25 179.05 2d89 h ILE 46 N -0.41 0.00 -0.83 0.00 2.04 -0.86 0.49 117.51 117.94 2d89 h ILE 46 Ca -0.00 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.05 2d89 h ILE 46 Cb 0.37 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.40 2d89 h ILE 46 CO -0.03 0.00 0.56 0.25 0.00 0.00 0.00 178.15 178.93 2d89 h LEU 47 N -0.61 0.27 -0.32 1.44 5.85 -1.51 0.14 115.31 120.57 2d89 h LEU 47 Ca 0.00 0.03 -0.20 0.00 0.84 0.00 0.00 57.88 58.55 2d89 h LEU 47 Cb 0.63 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.64 2d89 h LEU 47 CO -0.27 0.12 -0.78 -0.74 -0.34 0.00 0.00 178.44 176.43 2d89 h HIS 48 N 0.28 0.64 -0.17 1.25 2.76 0.37 -2.77 115.15 117.50 2d89 h HIS 48 Ca 0.42 -0.29 0.05 0.00 -2.20 0.00 0.00 60.37 58.34 2d89 h HIS 48 Cb 1.21 -0.09 -0.06 0.00 1.55 0.00 0.00 27.41 30.01 2d89 h HIS 48 CO -0.00 1.07 -0.29 1.25 -1.30 0.00 0.00 177.93 178.66 2d89 h HIS 49 N 0.30 -0.79 -0.30 5.26 -0.00 0.28 -0.95 115.15 118.96 2d89 h HIS 49 Ca -0.04 0.04 -0.05 0.00 -0.00 0.00 0.00 60.37 60.32 2d89 h HIS 49 Cb 1.37 0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 29.14 2d89 h HIS 49 CO 0.05 -0.37 0.01 0.74 -0.00 0.00 0.00 177.93 178.36 2d89 h PHE 50 N -0.34 0.58 -2.72 5.26 -1.00 -1.60 -3.41 116.94 113.71 2d89 h PHE 50 Ca 0.11 -0.10 -0.44 0.00 2.81 0.00 0.00 57.97 60.35 2d89 h PHE 50 Cb 0.51 -0.15 -0.38 0.00 3.61 0.00 0.00 35.95 39.53 2d89 h PHE 50 CO -0.40 0.66 -0.72 0.50 -1.61 0.00 0.00 178.31 176.75 2d89 s ARG 51 N -5.01 0.17 0.00 1.51 6.06 -0.93 -4.99 118.95 115.76 2d89 s ARG 51 Ca -0.13 -0.19 0.15 0.00 -2.50 0.00 0.00 55.73 53.06 2d89 s ARG 51 Cb 0.08 -1.30 0.73 0.00 0.06 0.00 0.00 34.95 34.53 2d89 s ARG 51 CO 0.76 -0.84 1.42 -0.35 -2.50 0.00 0.00 175.30 173.79 2d89 n PRO 52 N 5.28 0.18 -1.25 5.12 -0.04 -0.41 -2.72 135.00 141.17 2d89 n PRO 52 Ca -0.06 0.16 -0.26 0.00 -0.04 0.00 0.00 63.50 63.31 2d89 n PRO 52 Cb 0.46 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.57 2d89 n PRO 52 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2d89 n ASP 53 N -1.31 4.88 0.00 3.54 9.92 -1.26 -4.29 116.55 128.03 2d89 n ASP 53 Ca 0.07 -3.69 0.00 0.00 -0.53 0.00 0.00 54.79 50.64 2d89 n ASP 53 Cb 0.12 -0.85 0.00 0.00 -0.64 0.00 0.00 41.12 39.76 2d89 n ASP 53 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2d89 n LEU 54 N -1.06 2.10 -4.52 0.64 4.77 -1.10 -5.09 117.00 112.74 2d89 n LEU 54 Ca 0.58 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 56.32 2d89 n LEU 54 Cb 1.28 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 42.27 2d89 n LEU 54 CO 0.62 0.35 -0.28 -0.63 -1.33 0.00 0.00 177.39 176.13 2d89 s ILE 55 N -1.98 1.50 -0.38 -0.08 1.09 -1.26 -4.95 121.20 115.14 2d89 s ILE 55 Ca 0.00 -2.00 0.07 0.00 -1.10 0.00 0.00 60.65 57.62 2d89 s ILE 55 Cb 0.00 -2.87 0.68 0.00 -1.06 0.00 0.00 42.46 39.21 2d89 s ILE 55 CO 0.00 0.00 1.82 0.47 -0.10 0.00 0.00 174.94 177.13 2d89 n ASP 56 N -0.80 4.05 -0.03 3.58 9.92 -1.26 -4.60 116.55 127.41 2d89 n ASP 56 Ca -0.03 -3.46 0.24 0.00 -0.53 0.00 0.00 54.79 51.00 2d89 n ASP 56 Cb 0.67 -0.77 0.72 0.00 -0.64 0.00 0.00 41.12 41.09 2d89 n ASP 56 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2d89 h TYR 57 N 1.68 0.00 -0.17 1.24 5.03 -1.92 0.29 116.97 123.13 2d89 h TYR 57 Ca 0.43 0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.79 2d89 h TYR 57 Cb 2.51 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 40.78 2d89 h TYR 57 CO 1.39 0.00 0.21 1.57 -1.32 0.00 0.00 178.16 180.01 2d89 h LYS 58 N 0.00 0.00 -0.22 1.82 2.10 -1.93 -2.06 116.57 116.28 2d89 h LYS 58 Ca 0.30 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.74 2d89 h LYS 58 Cb 1.42 0.00 -0.31 0.00 -0.90 0.00 0.00 32.23 32.43 2d89 h LYS 58 CO -0.00 0.00 -0.91 0.43 -2.00 0.00 0.00 179.45 176.96 2d89 n SER 59 N -3.72 1.88 -4.92 7.07 7.64 0.10 -5.09 113.62 116.59 2d89 n SER 59 Ca 0.01 -2.67 -0.21 0.00 1.01 0.00 0.00 58.87 57.01 2d89 n SER 59 Cb 0.32 -0.40 0.08 0.00 -1.01 0.00 0.00 64.21 63.20 2d89 n SER 59 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2d89 s LEU 60 N -2.22 3.01 0.05 -3.43 1.43 -0.78 -5.08 118.68 111.66 2d89 s LEU 60 Ca 0.36 -0.78 -0.27 0.00 -1.03 0.00 0.00 54.13 52.41 2d89 s LEU 60 Cb 0.37 -1.58 0.09 0.00 0.03 0.00 0.00 46.19 45.10 2d89 s LEU 60 CO -0.08 -1.57 0.80 0.20 0.23 0.00 0.00 176.35 175.93 2d89 s ASN 61 N -4.73 -0.42 0.00 2.29 0.02 -1.26 -5.01 114.94 105.83 2d89 s ASN 61 Ca 0.64 -0.02 0.09 0.00 -1.02 0.00 0.00 52.86 52.54 2d89 s ASN 61 Cb -0.05 0.46 0.51 0.00 0.02 0.00 0.00 41.25 42.19 2d89 s ASN 61 CO 0.41 -0.74 0.96 -0.81 0.02 0.00 0.00 177.10 176.94 2d89 n PRO 62 N -0.29 0.49 0.19 -0.60 -0.04 -1.26 -2.59 135.00 130.89 2d89 n PRO 62 Ca -0.11 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.43 2d89 n PRO 62 Cb 0.63 -1.27 0.11 0.00 -0.04 0.00 0.00 33.50 32.92 2d89 n PRO 62 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2d89 h GLN 63 N 0.00 0.00 -4.71 0.54 -0.00 -1.98 -3.43 115.11 105.53 2d89 h GLN 63 Ca 0.00 0.00 -0.68 0.00 -0.00 0.00 0.00 58.65 57.97 2d89 h GLN 63 Cb 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 27.48 27.29 2d89 h GLN 63 CO 0.00 0.21 -0.49 -0.51 -0.00 0.00 0.00 178.83 178.04 2d89 s ASP 64 N -6.31 6.00 -0.27 0.06 1.01 -1.07 -4.94 116.67 111.15 2d89 s ASP 64 Ca 0.06 -0.46 -0.09 0.00 0.71 0.00 0.00 52.55 52.76 2d89 s ASP 64 Cb 0.06 -2.12 -0.14 0.00 1.01 0.00 0.00 42.92 41.73 2d89 s ASP 64 CO 0.70 -0.24 -0.30 -0.38 0.21 0.00 0.00 175.17 175.16 2d89 n ILE 65 N 5.09 1.52 -0.02 0.77 5.41 -1.26 -3.90 119.36 126.98 2d89 n ILE 65 Ca -0.13 -0.44 -0.16 0.00 1.00 0.00 0.00 62.75 63.03 2d89 n ILE 65 Cb 0.49 -1.74 -0.11 0.00 -0.71 0.00 0.00 39.64 37.57 2d89 n ILE 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2d89 h LYS 66 N -0.68 0.22 0.33 0.38 3.64 -1.78 -3.23 116.57 115.44 2d89 h LYS 66 Ca -0.66 -0.24 -0.02 0.00 -1.27 0.00 0.00 60.65 58.47 2d89 h LYS 66 Cb 1.70 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.59 2d89 h LYS 66 CO -0.32 0.96 -0.16 1.49 -2.27 0.00 0.00 179.45 179.16 2d89 h GLU 67 N -0.43 -0.42 -0.70 1.90 4.81 -1.89 -0.27 114.58 117.58 2d89 h GLU 67 Ca -0.04 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.28 2d89 h GLU 67 Cb 1.08 0.10 -0.09 0.00 0.63 0.00 0.00 28.75 30.47 2d89 h GLU 67 CO 0.06 -0.28 -0.40 0.09 -0.73 0.00 0.00 179.01 177.75 2d89 n ASN 68 N -3.28 -0.72 0.32 1.04 4.13 -1.25 -0.21 115.26 115.29 2d89 n ASN 68 Ca -0.05 1.24 -0.17 0.00 1.68 0.00 0.00 54.58 57.27 2d89 n ASN 68 Cb 0.17 -0.17 -0.09 0.00 -1.54 0.00 0.00 39.78 38.16 2d89 n ASN 68 CO 0.00 0.00 0.00 0.78 0.28 0.00 0.00 177.26 178.32 2d89 h ASN 69 N 0.00 -0.83 -0.86 6.41 2.35 -1.59 -2.81 115.58 118.26 2d89 h ASN 69 Ca 0.12 0.05 0.20 0.00 -0.55 0.00 0.00 56.30 56.12 2d89 h ASN 69 Cb 0.29 0.24 -0.16 0.00 0.05 0.00 0.00 38.32 38.75 2d89 h ASN 69 CO -0.66 -0.53 -0.05 0.50 -1.65 0.00 0.00 177.43 175.05 2d89 h LYS 70 N -0.84 0.05 -0.37 0.81 3.64 0.13 0.11 116.57 120.09 2d89 h LYS 70 Ca -0.07 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.39 2d89 h LYS 70 Cb 0.68 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.40 2d89 h LYS 70 CO 0.08 0.03 -0.24 0.87 -2.27 0.00 0.00 179.45 177.92 2d89 h LYS 71 N 0.05 -0.18 0.01 1.90 1.57 -0.33 -2.05 116.57 117.55 2d89 h LYS 71 Ca 0.47 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.26 2d89 h LYS 71 Cb 0.85 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.20 2d89 h LYS 71 CO -0.81 -0.12 -0.01 0.00 -0.57 0.00 0.00 179.45 177.94 2d89 h ALA 72 N 0.97 -0.76 -0.79 3.86 0.00 -0.67 -1.66 119.26 120.21 2d89 h ALA 72 Ca 0.18 -0.00 0.32 0.00 0.00 0.00 0.00 54.91 55.41 2d89 h ALA 72 Cb 0.47 0.26 -0.13 0.00 0.00 0.00 0.00 17.79 18.39 2d89 h ALA 72 CO -0.48 -0.76 0.44 0.66 0.00 0.00 0.00 179.25 179.10 2d89 n TYR 73 N -2.33 0.83 -0.06 0.00 4.01 -0.94 0.23 117.16 118.90 2d89 n TYR 73 Ca -0.00 0.83 -0.12 0.00 -0.16 0.00 0.00 57.90 58.45 2d89 n TYR 73 Cb 0.01 -1.26 -0.06 0.00 -0.31 0.00 0.00 39.34 37.72 2d89 n TYR 73 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 2d89 h ASP 74 N 0.00 0.31 0.50 7.72 1.82 -0.86 -1.66 116.42 124.25 2d89 h ASP 74 Ca 0.64 -0.36 -0.02 0.00 -0.39 0.00 0.00 57.03 56.90 2d89 h ASP 74 Cb 1.74 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 41.67 2d89 h ASP 74 CO -0.55 0.59 -0.24 1.23 -1.61 0.00 0.00 179.24 178.67 2d89 h GLY 75 N 0.02 -0.70 0.01 -0.78 0.00 0.38 -1.06 103.07 100.94 2d89 h GLY 75 Ca 0.04 0.26 0.14 0.00 0.00 0.00 0.00 47.33 47.77 2d89 h GLY 75 CO 0.01 -0.26 0.13 0.74 0.00 0.00 0.00 176.54 177.17 2d89 h PHE 76 N -1.16 0.19 0.00 5.60 0.04 -0.98 0.35 116.94 120.98 2d89 h PHE 76 Ca -0.07 0.04 -0.05 0.00 2.80 0.00 0.00 57.97 60.70 2d89 h PHE 76 Cb 0.54 0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 2d89 h PHE 76 CO 0.00 -0.08 -0.22 0.00 -0.60 0.00 0.00 178.31 177.41 2d89 h ALA 77 N 1.56 1.13 -0.41 2.45 0.00 -1.35 -2.22 119.26 120.42 2d89 h ALA 77 Ca 0.37 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.13 2d89 h ALA 77 Cb 0.60 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2d89 h ALA 77 CO -0.48 0.28 0.09 1.03 0.00 0.00 0.00 179.25 180.17 2d89 h SER 78 N 0.00 0.03 -0.10 0.00 0.87 0.11 -2.09 113.55 112.37 2d89 h SER 78 Ca -0.00 0.07 -0.15 0.00 -1.23 0.00 0.00 61.79 60.48 2d89 h SER 78 Cb 0.63 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 2d89 h SER 78 CO 0.03 0.05 -0.44 0.16 -0.53 0.00 0.00 176.83 176.10 2d89 h ILE 79 N 0.22 1.30 0.00 2.23 3.07 -1.46 -3.46 117.51 119.41 2d89 h ILE 79 Ca 0.20 -1.62 0.00 0.00 1.55 0.00 0.00 64.86 64.98 2d89 h ILE 79 Cb 0.23 1.57 0.00 0.00 -0.27 0.00 0.00 36.82 38.35 2d89 h ILE 79 CO -0.25 0.52 0.00 0.61 -1.05 0.00 0.00 178.15 177.98 2d89 n GLY 80 N 0.09 0.00 3.30 0.16 0.00 -0.79 -5.11 105.19 102.84 2d89 n GLY 80 Ca -0.02 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.54 2d89 n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d89 s ILE 81 N 0.00 5.24 -0.45 -0.61 1.01 -0.84 -4.97 121.20 120.58 2d89 s ILE 81 Ca 0.00 -1.93 -0.40 0.00 0.00 0.00 0.00 60.65 58.32 2d89 s ILE 81 Cb 0.00 -4.32 -0.16 0.00 0.01 0.00 0.00 42.46 37.99 2d89 s ILE 81 CO 0.00 -0.92 2.17 -1.20 0.00 0.00 0.00 174.94 174.99 2d89 n SER 82 N 4.69 1.29 -4.76 3.58 7.64 -1.26 -3.60 113.62 121.20 2d89 n SER 82 Ca -0.02 0.56 -0.40 0.00 1.01 0.00 0.00 58.87 60.01 2d89 n SER 82 Cb 0.43 -1.05 -0.03 0.00 -1.01 0.00 0.00 64.21 62.55 2d89 n SER 82 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d89 s ARG 83 N 6.16 4.49 0.03 1.43 1.04 -1.26 -4.94 118.95 125.89 2d89 s ARG 83 Ca 1.16 2.01 0.00 0.00 -1.04 0.00 0.00 55.73 57.86 2d89 s ARG 83 Cb -1.23 -3.12 0.00 0.00 -2.04 0.00 0.00 34.95 28.55 2d89 s ARG 83 CO 0.59 0.01 0.00 1.28 -0.04 0.00 0.00 175.30 177.14 2d89 n LEU 84 N 0.98 0.22 -4.78 -1.89 4.77 -1.26 -5.06 117.00 109.97 2d89 n LEU 84 Ca -0.01 0.04 -0.37 0.00 -0.03 0.00 0.00 56.01 55.65 2d89 n LEU 84 Cb 0.43 -0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 2d89 n LEU 84 CO 0.56 -0.22 0.67 -0.22 -1.33 0.00 0.00 177.39 176.85 2d89 s LEU 85 N -6.13 4.28 0.10 2.23 2.96 -1.26 -5.07 118.68 115.79 2d89 s LEU 85 Ca 0.00 1.86 0.05 0.00 -0.22 0.00 0.00 54.13 55.83 2d89 s LEU 85 Cb 0.00 -4.08 -0.04 0.00 0.50 0.00 0.00 46.19 42.57 2d89 s LEU 85 CO 0.00 -0.16 -0.01 -1.61 -1.32 0.00 0.00 176.35 173.25 2d89 s GLU 86 N -2.21 2.49 -0.02 1.98 0.41 -1.26 -4.97 118.70 115.12 2d89 s GLU 86 Ca 0.52 -0.89 -0.25 0.00 -0.41 0.00 0.00 54.97 53.94 2d89 s GLU 86 Cb -0.19 -2.50 -0.19 0.00 -1.78 0.00 0.00 34.13 29.48 2d89 s GLU 86 CO 0.24 0.53 1.21 -1.00 -0.49 0.00 0.00 175.26 175.74 2d89 h PRO 87 N 3.35 -0.08 0.54 0.39 0.13 -1.90 -3.21 132.00 131.21 2d89 h PRO 87 Ca -0.48 0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 2d89 h PRO 87 Cb 1.17 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2d89 h PRO 87 CO 0.59 0.37 -0.47 0.66 -0.23 0.00 0.00 178.00 178.92 2d89 h SER 88 N -0.57 -1.27 -0.87 1.44 4.64 -1.90 -2.56 113.55 112.46 2d89 h SER 88 Ca -0.01 0.09 0.23 0.00 -0.47 0.00 0.00 61.79 61.64 2d89 h SER 88 Cb 0.49 0.41 -0.16 0.00 -0.31 0.00 0.00 62.40 62.83 2d89 h SER 88 CO 0.01 -0.65 -0.01 -0.90 -0.87 0.00 0.00 176.83 174.41 2d89 n ASP 89 N -5.32 -0.13 -0.29 4.97 5.68 -1.25 0.18 116.55 120.39 2d89 n ASP 89 Ca -0.12 1.48 0.08 0.00 -0.50 0.00 0.00 54.79 55.74 2d89 n ASP 89 Cb 0.44 -0.53 0.24 0.00 -1.14 0.00 0.00 41.12 40.13 2d89 n ASP 89 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 2d89 h MET 90 N 0.00 0.47 -0.02 0.11 2.86 -1.45 -1.81 114.93 115.09 2d89 h MET 90 Ca 0.51 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 58.10 2d89 h MET 90 Cb 1.03 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.58 2d89 h MET 90 CO -0.83 0.31 -0.06 0.28 1.06 0.00 0.00 176.91 177.67 2d89 h VAL 91 N 0.49 1.46 -0.48 -2.22 2.07 0.19 -3.33 116.25 114.42 2d89 h VAL 91 Ca 0.48 -1.46 0.05 0.00 0.82 0.00 0.00 66.70 66.59 2d89 h VAL 91 Cb 0.78 2.38 -0.08 0.00 -1.52 0.00 0.00 31.29 32.85 2d89 h VAL 91 CO -0.43 0.39 -0.48 -0.07 0.02 0.00 0.00 177.57 176.99 2d89 h LEU 92 N -0.48 -1.66-10.40 2.57 3.38 -0.47 -3.41 115.31 104.84 2d89 h LEU 92 Ca -0.00 0.23 -0.48 0.00 0.09 0.00 0.00 57.88 57.72 2d89 h LEU 92 Cb 0.67 0.70 0.05 0.00 0.09 0.00 0.00 40.66 42.16 2d89 h LEU 92 CO 0.01 -0.30 0.14 -1.48 0.09 0.00 0.00 178.44 176.90 2d89 s LEU 93 N -9.66 3.35 -0.12 1.67 0.05 -0.76 -5.04 118.68 108.18 2d89 s LEU 93 Ca -0.12 0.71 -0.10 0.00 0.05 0.00 0.00 54.13 54.68 2d89 s LEU 93 Cb 0.08 -3.57 -0.09 0.00 -2.05 0.00 0.00 46.19 40.56 2d89 s LEU 93 CO 0.52 -0.93 0.24 0.00 -0.55 0.00 0.00 176.35 175.63 2d89 h ALA 94 N -0.04 0.01 -3.24 1.48 0.00 -1.80 -3.45 119.26 112.21 2d89 h ALA 94 Ca -0.46 -0.20 -0.67 0.00 0.00 0.00 0.00 54.91 53.58 2d89 h ALA 94 Cb 1.25 0.04 -0.33 0.00 0.00 0.00 0.00 17.79 18.75 2d89 h ALA 94 CO 0.60 0.04 -0.85 0.42 0.00 0.00 0.00 179.25 179.46 2d89 s ILE 95 N -1.81 2.24 0.31 0.00 -1.09 -1.26 -4.99 121.20 114.60 2d89 s ILE 95 Ca -0.07 -0.93 -0.05 0.00 -2.23 0.00 0.00 60.65 57.37 2d89 s ILE 95 Cb -0.01 -1.90 0.08 0.00 -1.58 0.00 0.00 42.46 39.05 2d89 s ILE 95 CO 0.24 0.54 0.27 -0.81 -1.23 0.00 0.00 174.94 173.95 2d89 n PRO 96 N 3.89 -1.56 -3.32 2.79 -0.04 -1.26 -4.98 135.00 130.51 2d89 n PRO 96 Ca -0.19 -0.43 -0.46 0.00 -0.04 0.00 0.00 63.50 62.37 2d89 n PRO 96 Cb 0.52 -0.41 -0.05 0.00 -0.04 0.00 0.00 33.50 33.52 2d89 n PRO 96 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2d89 s ASP 97 N -2.24 6.17 0.26 3.54 1.11 -1.26 -4.95 116.67 119.31 2d89 s ASP 97 Ca 0.18 -1.78 -0.04 0.00 0.18 0.00 0.00 52.55 51.09 2d89 s ASP 97 Cb -0.02 -2.20 0.53 0.00 1.07 0.00 0.00 42.92 42.30 2d89 s ASP 97 CO 0.14 -0.85 1.41 1.17 1.18 0.00 0.00 175.17 178.22 2d89 n LYS 98 N 5.24 -0.08 -0.29 8.23 4.81 -1.26 0.18 118.16 134.98 2d89 n LYS 98 Ca -0.14 1.39 0.03 0.00 -0.87 0.00 0.00 58.31 58.72 2d89 n LYS 98 Cb 0.40 -2.12 0.17 0.00 0.02 0.00 0.00 35.03 33.50 2d89 n LYS 98 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2d89 h LEU 99 N 0.00 0.68 0.38 3.14 3.38 -1.92 -1.02 115.31 119.95 2d89 h LEU 99 Ca 0.48 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.48 2d89 h LEU 99 Cb 0.85 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.52 2d89 h LEU 99 CO -0.90 0.39 -0.18 0.74 0.09 0.00 0.00 178.44 178.58 2d89 h THR 100 N 0.80 0.00 -0.51 0.22 2.02 0.14 -2.54 112.91 113.04 2d89 h THR 100 Ca 0.40 -0.11 0.05 0.00 0.77 0.00 0.00 66.41 67.53 2d89 h THR 100 Cb 0.37 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.70 2d89 h THR 100 CO -0.25 0.00 -0.52 0.58 0.37 0.00 0.00 175.52 175.71 2d89 h VAL 101 N -0.62 0.00 -0.86 3.16 2.07 -1.22 0.47 116.25 119.25 2d89 h VAL 101 Ca -0.05 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.68 2d89 h VAL 101 Cb 0.39 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.00 2d89 h VAL 101 CO 0.08 0.00 0.00 0.24 0.02 0.00 0.00 177.57 177.92 2d89 h MET 102 N -0.27 0.07 -0.03 1.57 2.07 -1.28 0.49 114.93 117.54 2d89 h MET 102 Ca 0.09 -0.00 0.04 0.00 -2.07 0.00 0.00 59.70 57.75 2d89 h MET 102 Cb 0.50 -0.02 -0.05 0.00 -1.87 0.00 0.00 31.60 30.16 2d89 h MET 102 CO -0.62 0.05 -0.26 1.15 1.07 0.00 0.00 176.91 178.29 2d89 h THR 103 N 0.07 0.40 0.27 2.22 2.02 -0.48 -2.58 112.91 114.83 2d89 h THR 103 Ca 0.49 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.67 2d89 h THR 103 Cb 0.91 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 2d89 h THR 103 CO -0.78 0.00 -0.46 0.22 0.37 0.00 0.00 175.52 174.87 2d89 h TYR 104 N -0.39 -1.30 -0.68 3.16 3.20 -0.27 -2.96 116.97 117.72 2d89 h TYR 104 Ca 0.07 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.03 2d89 h TYR 104 Cb 0.49 0.53 -0.08 0.00 1.54 0.00 0.00 36.73 39.21 2d89 h TYR 104 CO -0.31 -0.59 -0.40 1.28 -1.64 0.00 0.00 178.16 176.50 2d89 n LEU 105 N -5.50 -0.72 -0.25 2.82 4.77 -0.67 0.87 117.00 118.33 2d89 n LEU 105 Ca -0.09 1.46 0.24 0.00 -0.03 0.00 0.00 56.01 57.58 2d89 n LEU 105 Cb 0.41 -0.28 0.44 0.00 -2.33 0.00 0.00 43.42 41.67 2d89 n LEU 105 CO 0.22 -1.11 0.79 -1.22 -1.33 0.00 0.00 177.39 174.74 2d89 n TYR 106 N -4.57 0.83 -0.10 -1.77 4.01 -0.99 0.24 117.16 114.81 2d89 n TYR 106 Ca 0.01 0.84 -0.09 0.00 -0.16 0.00 0.00 57.90 58.50 2d89 n TYR 106 Cb 0.18 -1.26 -0.01 0.00 -0.31 0.00 0.00 39.34 37.94 2d89 n TYR 106 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2d89 h GLN 107 N 0.00 0.46 0.47 -0.72 1.08 0.46 0.28 115.11 117.14 2d89 h GLN 107 Ca 0.63 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.77 2d89 h GLN 107 Cb 1.70 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 29.04 2d89 h GLN 107 CO -0.55 0.32 -0.23 0.82 -0.95 0.00 0.00 178.83 178.25 2d89 h ILE 108 N 0.45 0.16 -0.88 2.54 5.03 0.31 -1.36 117.51 123.77 2d89 h ILE 108 Ca 0.12 -0.55 0.16 0.00 -0.12 0.00 0.00 64.86 64.47 2d89 h ILE 108 Cb -0.03 0.25 -0.07 0.00 -3.03 0.00 0.00 36.82 33.94 2d89 h ILE 108 CO -0.03 0.03 0.57 -0.09 -0.68 0.00 0.00 178.15 177.96 2d89 h ARG 109 N -1.11 0.58 -0.14 2.37 1.12 -1.27 -1.36 114.38 114.56 2d89 h ARG 109 Ca -0.06 -0.03 -0.05 0.00 -1.11 0.00 0.00 59.98 58.73 2d89 h ARG 109 Cb 0.54 -0.13 -0.00 0.00 -0.01 0.00 0.00 29.97 30.37 2d89 h ARG 109 CO 0.11 0.38 -0.09 0.00 -3.11 0.00 0.00 179.97 177.26 2d89 h ALA 110 N 1.61 0.20 0.17 2.80 0.00 -0.45 -0.46 119.26 123.13 2d89 h ALA 110 Ca 0.45 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2d89 h ALA 110 Cb 0.85 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 2d89 h ALA 110 CO -0.20 0.02 -0.48 1.25 0.00 0.00 0.00 179.25 179.85 2d89 h HIS 111 N -0.04 -1.38 -0.00 0.00 -0.00 -0.12 -1.94 115.15 111.66 2d89 h HIS 111 Ca 0.03 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.43 2d89 h HIS 111 Cb 0.57 0.58 -0.00 0.00 -0.00 0.00 0.00 27.41 28.57 2d89 h HIS 111 CO 0.07 -0.56 0.00 0.74 -0.00 0.00 0.00 177.93 178.18 2d89 h PHE 112 N -0.73 0.00 -3.55 5.26 0.04 -1.52 -3.37 116.94 113.07 2d89 h PHE 112 Ca -0.01 -0.00 -0.68 0.00 2.80 0.00 0.00 57.97 60.08 2d89 h PHE 112 Cb 0.71 -0.00 -0.37 0.00 2.20 0.00 0.00 35.95 38.49 2d89 h PHE 112 CO -0.41 0.05 -0.60 0.45 -0.60 0.00 0.00 178.31 177.21 2d89 s SER 113 N -5.24 4.99 -0.77 2.17 0.15 -0.18 -5.05 113.70 109.76 2d89 s SER 113 Ca -0.13 -2.27 -0.22 0.00 0.70 0.00 0.00 55.95 54.03 2d89 s SER 113 Cb 0.06 -1.74 0.08 0.00 -1.71 0.00 0.00 66.02 62.71 2d89 s SER 113 CO 0.66 -0.44 1.08 -0.44 1.20 0.00 0.00 173.24 175.30 2d89 s SER 114 N 1.16 6.33 0.02 5.45 0.01 -0.75 -4.03 113.70 121.88 2d89 s SER 114 Ca 0.11 -1.29 -0.23 0.00 1.31 0.00 0.00 55.95 55.85 2d89 s SER 114 Cb -0.21 -2.44 -0.13 0.00 0.21 0.00 0.00 66.02 63.45 2d89 s SER 114 CO -0.05 -1.37 1.11 1.23 0.41 0.00 0.00 173.24 174.57 2d89 h GLY 115 N 11.34 -0.87 0.77 3.44 0.00 -1.92 -3.01 103.07 112.82 2d89 h GLY 115 Ca -0.12 0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.53 2d89 h GLY 115 CO 1.19 -0.31 0.00 -1.55 0.00 0.00 0.00 176.54 175.87 2d89 n PRO 116 N -4.76 0.49 -1.04 4.80 -0.04 -1.26 -4.11 135.00 129.08 2d89 n PRO 116 Ca -0.10 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.03 2d89 n PRO 116 Cb 0.33 -1.38 -0.10 0.00 -0.04 0.00 0.00 33.50 32.30 2d89 n PRO 116 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d89 n SER 117 N -0.88 0.29 -4.70 3.54 2.88 -1.14 -4.82 113.62 108.79 2d89 n SER 117 Ca 0.09 0.22 -0.41 0.00 -1.33 0.00 0.00 58.87 57.43 2d89 n SER 117 Cb 0.04 -0.66 -0.04 0.00 -0.75 0.00 0.00 64.21 62.80 2d89 n SER 117 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2d89 s SER 118 N 6.01 7.15 0.00 -3.46 0.15 -1.26 -5.12 113.70 117.16 2d89 s SER 118 Ca 0.96 1.40 0.00 0.00 0.70 0.00 0.00 55.95 59.01 2d89 s SER 118 Cb -0.95 -2.50 0.00 0.00 -1.71 0.00 0.00 66.02 60.85 2d89 s SER 118 CO 0.38 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.12