#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d89 n SER 2 N 0.00 -1.77 0.00 1.61 7.64 -1.26 -4.94 113.62 114.90 2d89 n SER 2 Ca 0.00 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.32 2d89 n SER 2 Cb 0.00 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.00 2d89 n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2d89 n SER 3 N -0.81 0.46 -0.97 6.43 3.41 -1.26 -5.12 113.62 115.77 2d89 n SER 3 Ca 0.08 -0.75 0.00 0.00 -0.26 0.00 0.00 58.87 57.94 2d89 n SER 3 Cb 0.52 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.80 2d89 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d89 n GLY 4 N 0.33 -4.22 0.32 5.00 0.00 -1.26 -4.69 105.19 100.66 2d89 n GLY 4 Ca 0.00 -0.67 0.15 0.00 0.00 0.00 0.00 46.02 45.50 2d89 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2d89 h SER 5 N 1.58 -0.07 -3.06 1.61 0.02 -2.05 -3.40 113.55 108.17 2d89 h SER 5 Ca 0.00 0.22 -0.55 0.00 -0.84 0.00 0.00 61.79 60.62 2d89 h SER 5 Cb 0.00 0.31 -0.16 0.00 0.14 0.00 0.00 62.40 62.69 2d89 h SER 5 CO 0.00 -0.22 -0.77 -0.94 -1.14 0.00 0.00 176.83 173.76 2d89 s SER 6 N -5.03 3.01 0.00 3.07 1.04 -1.26 -5.06 113.70 109.47 2d89 s SER 6 Ca -0.12 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 55.36 2d89 s SER 6 Cb 0.27 -0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.19 2d89 s SER 6 CO 0.77 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 175.58 2d89 n GLY 7 N -0.12 -0.15 0.00 7.32 0.00 -1.26 -5.01 105.19 105.98 2d89 n GLY 7 Ca -0.10 0.11 0.08 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 0.43 -1.11 1.61 -0.04 -1.26 -4.41 135.00 130.23 2d89 n PRO 8 Ca 0.00 0.03 -0.39 0.00 -0.04 0.00 0.00 63.50 63.10 2d89 n PRO 8 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 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 -1.06 3.13 -3.56 3.54 4.13 -1.26 -4.61 115.26 115.57 2d89 n ASN 9 Ca 0.11 -2.62 0.01 0.00 1.68 0.00 0.00 54.58 53.76 2d89 n ASN 9 Cb 0.07 -1.15 -0.06 0.00 -1.54 0.00 0.00 39.78 37.10 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 4.53 -2.61 0.24 5.41 0.00 -1.26 -5.02 121.76 123.05 2d89 s ALA 10 Ca 0.53 2.05 -0.04 0.00 0.00 0.00 0.00 51.96 54.49 2d89 s ALA 10 Cb 0.14 -1.94 0.44 0.00 0.00 0.00 0.00 23.12 21.76 2d89 s ALA 10 CO 0.07 -0.49 1.75 0.66 0.00 0.00 0.00 175.76 177.76 2d89 h SER 11 N 5.99 0.39 0.40 0.00 4.64 -1.99 -2.37 113.55 120.62 2d89 h SER 11 Ca -0.24 0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 61.15 2d89 h SER 11 Cb 1.16 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2d89 h SER 11 CO 0.18 0.18 -0.19 -0.61 -0.87 0.00 0.00 176.83 175.52 2d89 h GLN 12 N 0.53 -0.52 -0.00 4.77 4.15 -1.96 -2.95 115.11 119.13 2d89 h GLN 12 Ca 0.41 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.86 2d89 h GLN 12 Cb 0.55 0.12 -0.00 0.00 0.21 0.00 0.00 27.48 28.36 2d89 h GLN 12 CO -0.35 -0.27 -0.00 0.43 -1.93 0.00 0.00 178.83 176.71 2d89 n SER 13 N -5.26 -0.00 -0.24 -0.69 7.64 -0.90 -0.32 113.62 113.84 2d89 n SER 13 Ca -0.11 0.81 -0.03 0.00 1.01 0.00 0.00 58.87 60.56 2d89 n SER 13 Cb 0.26 -0.41 0.03 0.00 -1.01 0.00 0.00 64.21 63.09 2d89 n SER 13 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2d89 h LEU 14 N 0.00 -1.08 -1.69 -3.43 5.85 -1.60 0.73 115.31 114.10 2d89 h LEU 14 Ca 0.00 0.24 0.21 0.00 0.84 0.00 0.00 57.88 59.17 2d89 h LEU 14 Cb 0.00 0.57 -0.05 0.00 0.37 0.00 0.00 40.66 41.55 2d89 h LEU 14 CO -0.00 -0.29 0.58 0.25 -0.34 0.00 0.00 178.44 178.64 2d89 h LEU 15 N -0.10 0.26 0.01 2.25 5.85 -0.55 -1.05 115.31 121.99 2d89 h LEU 15 Ca 0.28 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.92 2d89 h LEU 15 Cb 0.56 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.57 2d89 h LEU 15 CO -0.74 0.11 -0.42 0.58 -0.34 0.00 0.00 178.44 177.63 2d89 h VAL 16 N 0.26 1.52 -0.75 1.05 2.07 0.34 -2.56 116.25 118.18 2d89 h VAL 16 Ca 0.43 -2.08 0.17 0.00 0.82 0.00 0.00 66.70 66.04 2d89 h VAL 16 Cb 1.27 2.80 -0.11 0.00 -1.52 0.00 0.00 31.29 33.73 2d89 h VAL 16 CO -0.11 0.58 0.17 -0.25 0.02 0.00 0.00 177.57 177.98 2d89 h TRP 17 N -0.38 0.26 0.37 1.57 7.01 0.42 0.44 115.95 125.63 2d89 h TRP 17 Ca -0.06 0.04 -0.02 0.00 2.11 0.00 0.00 58.89 60.97 2d89 h TRP 17 Cb 1.18 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.25 2d89 h TRP 17 CO 0.18 -0.11 -0.18 0.00 -2.79 0.00 0.00 178.44 175.54 2d89 h LYS 19 N -0.95 0.00 0.24 0.00 1.57 -1.18 0.50 116.57 116.76 2d89 h LYS 19 Ca -0.05 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2d89 h LYS 19 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2d89 h LYS 19 CO 0.08 0.00 -0.12 1.49 -0.57 0.00 0.00 179.45 180.34 2d89 h GLU 20 N 0.00 -0.31 0.00 3.15 4.81 -0.10 -1.10 114.58 121.02 2d89 h GLU 20 Ca 0.33 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 2d89 h GLU 20 Cb 1.74 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 31.19 2d89 h GLU 20 CO -0.00 -0.00 -0.04 -0.39 -0.73 0.00 0.00 179.01 177.84 2d89 h VAL 21 N -0.98 0.36 -0.40 0.32 -1.51 -0.77 -1.33 116.25 111.94 2d89 h VAL 21 Ca -0.03 -0.23 -0.11 0.00 -1.23 0.00 0.00 66.70 65.10 2d89 h VAL 21 Cb 0.45 1.16 -0.07 0.00 -2.13 0.00 0.00 31.29 30.71 2d89 h VAL 21 CO 0.05 0.04 0.05 0.35 -1.23 0.00 0.00 177.57 176.83 2d89 n THR 22 N -3.52 2.52 0.05 7.19 -2.24 0.02 -4.60 114.28 113.70 2d89 n THR 22 Ca -0.02 -2.12 0.01 0.00 -2.27 0.00 0.00 64.05 59.64 2d89 n THR 22 Cb 0.15 -0.30 0.33 0.00 -2.10 0.00 0.00 70.33 68.41 2d89 n THR 22 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2d89 h LYS 23 N 1.66 0.39 -2.08 -0.78 2.10 0.02 -3.13 116.57 114.74 2d89 h LYS 23 Ca 0.14 -0.09 -0.65 0.00 -2.00 0.00 0.00 60.65 58.05 2d89 h LYS 23 Cb 1.72 -0.05 -0.38 0.00 -0.90 0.00 0.00 32.23 32.62 2d89 h LYS 23 CO 0.40 0.49 -0.19 0.09 -2.00 0.00 0.00 179.45 178.23 2d89 n ASN 24 N -4.26 5.35 -4.60 7.07 3.02 -1.26 -5.03 115.26 115.56 2d89 n ASN 24 Ca 0.00 -3.71 -0.29 0.00 -0.03 0.00 0.00 54.58 50.56 2d89 n ASN 24 Cb 0.27 -0.70 -0.09 0.00 -0.61 0.00 0.00 39.78 38.65 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 -3.71 2.14 -0.30 3.10 1.51 -1.19 -5.13 117.35 113.77 2d89 s TYR 25 Ca 0.47 -0.87 -0.04 0.00 -1.01 0.00 0.00 57.07 55.62 2d89 s TYR 25 Cb 0.30 -1.59 0.04 0.00 -0.11 0.00 0.00 41.96 40.60 2d89 s TYR 25 CO -0.17 0.24 0.04 0.50 -1.11 0.00 0.00 175.55 175.04 2d89 s ARG 26 N -3.79 2.63 -0.18 -0.62 3.52 -1.26 -4.63 118.95 114.62 2d89 s ARG 26 Ca 0.24 -1.15 -0.00 0.00 -0.13 0.00 0.00 55.73 54.69 2d89 s ARG 26 Cb 0.06 -3.27 0.00 0.00 -1.56 0.00 0.00 34.95 30.18 2d89 s ARG 26 CO 0.12 -0.58 0.15 0.41 -0.81 0.00 0.00 175.30 174.59 2d89 n GLY 27 N 4.72 0.40 2.68 8.12 0.00 -1.26 -5.04 105.19 114.81 2d89 n GLY 27 Ca -0.14 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 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 -3.05 1.32 -0.47 1.61 1.01 -1.26 -4.92 120.40 114.64 2d89 s VAL 28 Ca 0.02 -2.62 0.03 0.00 0.00 0.00 0.00 61.98 59.41 2d89 s VAL 28 Cb -0.01 -1.92 0.12 0.00 0.00 0.00 0.00 36.38 34.58 2d89 s VAL 28 CO 0.11 -0.94 0.21 -0.75 0.00 0.00 0.00 175.10 173.73 2d89 s LYS 29 N 0.26 1.89 -1.01 2.72 2.20 -1.26 -4.97 119.74 119.58 2d89 s LYS 29 Ca 0.19 -2.37 -0.16 0.00 -0.36 0.00 0.00 55.97 53.27 2d89 s LYS 29 Cb -0.20 -3.34 -0.09 0.00 -1.51 0.00 0.00 37.83 32.69 2d89 s LYS 29 CO -0.03 -1.07 2.10 -0.89 -0.36 0.00 0.00 175.35 175.11 2d89 n ILE 30 N 3.53 2.46 0.31 5.43 -0.00 -1.26 -4.52 119.36 125.31 2d89 n ILE 30 Ca 0.05 -1.93 0.12 0.00 -0.00 0.00 0.00 62.75 60.99 2d89 n ILE 30 Cb 0.36 -2.36 0.21 0.00 -0.00 0.00 0.00 39.64 37.85 2d89 n ILE 30 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.55 177.29 2d89 h THR 31 N 4.06 0.00 -4.63 1.39 2.02 -1.96 -3.47 112.91 110.32 2d89 h THR 31 Ca 0.50 -0.87 -0.42 0.00 0.77 0.00 0.00 66.41 66.39 2d89 h THR 31 Cb 0.53 1.84 -0.11 0.00 -1.74 0.00 0.00 68.15 68.67 2d89 h THR 31 CO 1.83 0.00 -0.36 0.20 0.37 0.00 0.00 175.52 177.56 2d89 s ASN 32 N -5.75 1.52 -0.11 4.18 0.01 -1.26 -5.06 114.94 108.47 2d89 s ASN 32 Ca 0.07 -1.70 0.14 0.00 -0.71 0.00 0.00 52.86 50.67 2d89 s ASN 32 Cb 0.07 0.62 0.26 0.00 0.41 0.00 0.00 41.25 42.61 2d89 s ASN 32 CO 0.66 -1.18 1.13 0.49 -1.51 0.00 0.00 177.10 176.69 2d89 n PHE 33 N -0.63 0.00 0.00 2.20 3.72 -1.26 -4.58 117.46 116.91 2d89 n PHE 33 Ca 0.05 -0.86 0.00 0.00 -0.05 0.00 0.00 57.45 56.59 2d89 n PHE 33 Cb 0.62 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 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 -1.01 0.00 -0.02 4.37 -2.24 -1.26 -4.55 114.28 109.57 2d89 n THR 34 Ca 0.13 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.75 2d89 n THR 34 Cb 0.69 -0.64 -0.11 0.00 -2.10 0.00 0.00 70.33 68.17 2d89 n THR 34 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2d89 h THR 35 N 0.00 1.48 -0.81 4.28 1.35 -1.92 -1.04 112.91 116.25 2d89 h THR 35 Ca 0.00 -1.90 0.23 0.00 -0.55 0.00 0.00 66.41 64.20 2d89 h THR 35 Cb 0.00 2.58 -0.03 0.00 -1.73 0.00 0.00 68.15 68.97 2d89 h THR 35 CO 0.00 0.53 0.92 0.28 -0.25 0.00 0.00 175.52 177.00 2d89 h SER 36 N -0.30 0.00 0.00 5.36 0.02 -1.92 0.68 113.55 117.40 2d89 h SER 36 Ca -0.04 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.79 2d89 h SER 36 Cb 1.06 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.58 2d89 h SER 36 CO 0.07 0.00 -1.80 0.79 -1.14 0.00 0.00 176.83 174.75 2d89 n TRP 37 N -3.43 0.00 -0.32 3.45 7.02 -1.20 -4.32 117.44 118.63 2d89 n TRP 37 Ca 0.17 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.66 2d89 n TRP 37 Cb 1.18 -0.50 0.06 0.00 -2.42 0.00 0.00 31.31 29.63 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 -2.25 -0.17 -0.23 -0.99 0.63 0.24 0.13 116.66 114.02 2d89 n ARG 38 Ca -0.12 1.32 -0.06 0.00 -0.92 0.00 0.00 57.85 58.06 2d89 n ARG 38 Cb 0.65 -1.96 0.04 0.00 0.45 0.00 0.00 32.46 31.65 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 0.81 0.00 6.15 7.08 -1.81 -3.45 115.58 124.36 2d89 h ASN 39 Ca 0.32 -0.10 0.00 0.00 -3.08 0.00 0.00 56.30 53.45 2d89 h ASN 39 Cb 0.54 -0.21 0.00 0.00 -2.08 0.00 0.00 38.32 36.57 2d89 h ASN 39 CO -0.85 0.68 0.00 0.61 -2.08 0.00 0.00 177.43 175.79 2d89 n GLY 40 N -1.05 1.68 0.03 9.14 0.00 0.36 -3.85 105.19 111.49 2d89 n GLY 40 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.86 0.99 3.38 -1.78 -3.25 115.31 112.79 2d89 h LEU 41 Ca 0.00 0.00 0.22 0.00 0.09 0.00 0.00 57.88 58.19 2d89 h LEU 41 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2d89 h LEU 41 CO 0.00 0.28 0.68 0.28 0.09 0.00 0.00 178.44 179.77 2d89 h SER 42 N -0.41 0.00 -0.04 -0.43 0.02 -1.91 0.24 113.55 111.02 2d89 h SER 42 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2d89 h SER 42 Cb 0.14 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 2d89 h SER 42 CO 0.00 0.00 -0.03 -0.26 -1.14 0.00 0.00 176.83 175.40 2d89 h PHE 43 N 0.00 0.10 -0.22 3.45 0.04 -1.91 -2.83 116.94 115.57 2d89 h PHE 43 Ca 0.36 -0.03 -0.19 0.00 2.80 0.00 0.00 57.97 60.91 2d89 h PHE 43 Cb 1.73 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.86 2d89 h PHE 43 CO 0.00 0.55 -0.60 0.00 -0.60 0.00 0.00 178.31 177.66 2d89 h ALA 45 N 0.61 -0.34 -0.06 0.00 0.00 -0.72 -0.47 119.26 118.28 2d89 h ALA 45 Ca -0.01 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2d89 h ALA 45 Cb 1.22 0.62 -0.03 0.00 0.00 0.00 0.00 17.79 19.60 2d89 h ALA 45 CO 0.13 -0.79 -0.25 0.82 0.00 0.00 0.00 179.25 179.16 2d89 h ILE 46 N -0.37 0.00 -0.62 0.00 2.04 -1.57 0.17 117.51 117.16 2d89 h ILE 46 Ca 0.11 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.15 2d89 h ILE 46 Cb 0.54 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 2d89 h ILE 46 CO -0.38 0.00 0.61 0.25 0.00 0.00 0.00 178.15 178.63 2d89 h LEU 47 N -0.28 0.00 -0.23 1.44 5.85 -1.55 0.43 115.31 120.98 2d89 h LEU 47 Ca 0.01 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.52 2d89 h LEU 47 Cb 0.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 2d89 h LEU 47 CO -0.20 0.00 -0.86 -0.74 -0.34 0.00 0.00 178.44 176.30 2d89 h HIS 48 N 0.00 0.72 -0.19 1.25 2.76 0.94 -2.02 115.15 118.61 2d89 h HIS 48 Ca 0.29 -0.35 0.05 0.00 -2.20 0.00 0.00 60.37 58.16 2d89 h HIS 48 Cb 1.51 -0.10 -0.07 0.00 1.55 0.00 0.00 27.41 30.30 2d89 h HIS 48 CO 0.00 1.16 -0.35 1.25 -1.30 0.00 0.00 177.93 178.69 2d89 h HIS 49 N 0.32 -0.99 -0.14 5.26 -0.00 0.21 0.15 115.15 119.96 2d89 h HIS 49 Ca -0.06 0.05 -0.14 0.00 -0.00 0.00 0.00 60.37 60.21 2d89 h HIS 49 Cb 1.47 0.46 0.00 0.00 -0.00 0.00 0.00 27.41 29.35 2d89 h HIS 49 CO 0.06 -0.42 -0.45 0.74 -0.00 0.00 0.00 177.93 177.87 2d89 h PHE 50 N -0.39 0.72 -2.86 5.26 -1.00 -1.64 -3.41 116.94 113.62 2d89 h PHE 50 Ca 0.11 -0.29 -0.58 0.00 2.81 0.00 0.00 57.97 60.01 2d89 h PHE 50 Cb 0.57 -0.12 -0.40 0.00 3.61 0.00 0.00 35.95 39.61 2d89 h PHE 50 CO -0.46 1.06 -0.78 1.03 -1.61 0.00 0.00 178.31 177.54 2d89 s ARG 51 N -3.84 0.77 0.00 1.51 1.81 -0.76 -4.97 118.95 113.47 2d89 s ARG 51 Ca -0.13 -1.38 0.10 0.00 -1.72 0.00 0.00 55.73 52.61 2d89 s ARG 51 Cb 0.06 -1.76 0.63 0.00 -0.45 0.00 0.00 34.95 33.43 2d89 s ARG 51 CO 0.82 -1.12 1.06 -0.35 -0.68 0.00 0.00 175.30 175.04 2d89 n PRO 52 N 4.22 0.49 -0.05 3.54 -0.04 0.49 -2.25 135.00 141.40 2d89 n PRO 52 Ca 0.06 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.48 2d89 n PRO 52 Cb 0.38 -1.34 -0.09 0.00 -0.04 0.00 0.00 33.50 32.41 2d89 n PRO 52 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2d89 n ASP 53 N -0.84 2.17 -0.20 3.54 -0.08 -1.26 -4.52 116.55 115.37 2d89 n ASP 53 Ca 0.08 0.00 0.17 0.00 -1.51 0.00 0.00 54.79 53.53 2d89 n ASP 53 Cb 0.04 0.91 0.51 0.00 2.34 0.00 0.00 41.12 44.91 2d89 n ASP 53 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2d89 h LEU 54 N 0.00 0.39 0.00 -2.67 3.38 -1.77 -3.43 115.31 111.21 2d89 h LEU 54 Ca -0.26 0.03 -0.48 0.00 0.09 0.00 0.00 57.88 57.26 2d89 h LEU 54 Cb 1.53 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 42.14 2d89 h LEU 54 CO 0.01 0.18 -0.36 -0.38 0.09 0.00 0.00 178.44 177.99 2d89 n ILE 55 N -4.49 0.00 -1.39 1.22 -0.00 -1.26 -4.90 119.36 108.54 2d89 n ILE 55 Ca 0.16 -1.81 0.02 0.00 -0.00 0.00 0.00 62.75 61.12 2d89 n ILE 55 Cb 0.61 0.43 0.20 0.00 -0.00 0.00 0.00 39.64 40.89 2d89 n ILE 55 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 2d89 n ASP 56 N -1.34 2.44 0.33 4.38 2.03 -1.26 -4.71 116.55 118.41 2d89 n ASP 56 Ca -0.13 -3.64 0.16 0.00 0.52 0.00 0.00 54.79 51.71 2d89 n ASP 56 Cb 0.48 -0.57 0.87 0.00 -0.72 0.00 0.00 41.12 41.17 2d89 n ASP 56 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2d89 h TYR 57 N 0.99 0.00 0.00 -0.67 5.03 -1.90 0.22 116.97 120.64 2d89 h TYR 57 Ca 0.11 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.41 2d89 h TYR 57 Cb 1.39 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 39.67 2d89 h TYR 57 CO 0.78 0.00 -0.06 1.57 -1.32 0.00 0.00 178.16 179.13 2d89 h LYS 58 N 0.00 0.00 -0.02 1.82 2.10 -1.87 -2.89 116.57 115.71 2d89 h LYS 58 Ca 0.01 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.52 2d89 h LYS 58 Cb 0.60 0.00 -0.28 0.00 -0.90 0.00 0.00 32.23 31.65 2d89 h LYS 58 CO -0.00 0.06 -0.89 0.45 -2.00 0.00 0.00 179.45 177.06 2d89 n SER 59 N -3.49 1.24 -3.26 7.07 2.88 0.75 -5.09 113.62 113.72 2d89 n SER 59 Ca -0.02 -2.53 -0.12 0.00 -1.33 0.00 0.00 58.87 54.87 2d89 n SER 59 Cb 0.18 -0.37 0.06 0.00 -0.75 0.00 0.00 64.21 63.33 2d89 n SER 59 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2d89 n LEU 60 N 0.03 0.00 -3.57 2.46 4.77 -0.98 -5.09 117.00 114.61 2d89 n LEU 60 Ca 0.10 -1.04 -0.05 0.00 -0.03 0.00 0.00 56.01 54.98 2d89 n LEU 60 Cb 1.02 -0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 41.76 2d89 n LEU 60 CO -0.03 -0.75 0.93 0.20 -1.33 0.00 0.00 177.39 176.41 2d89 s ASN 61 N -3.03 -0.19 0.00 -1.43 0.02 -1.26 -5.00 114.94 104.04 2d89 s ASN 61 Ca 0.33 0.01 0.10 0.00 -1.02 0.00 0.00 52.86 52.28 2d89 s ASN 61 Cb -0.02 0.20 0.61 0.00 0.02 0.00 0.00 41.25 42.07 2d89 s ASN 61 CO 0.22 -0.32 1.05 -0.81 0.02 0.00 0.00 177.10 177.26 2d89 n PRO 62 N -0.11 0.49 0.00 -0.60 -0.04 -1.26 -2.61 135.00 130.87 2d89 n PRO 62 Ca -0.02 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.59 2d89 n PRO 62 Cb 0.59 -1.33 0.73 0.00 -0.04 0.00 0.00 33.50 33.45 2d89 n PRO 62 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d89 n GLN 63 N -0.83 0.50 -4.08 0.54 -0.00 -1.26 -4.63 117.38 107.61 2d89 n GLN 63 Ca 0.08 -0.05 -0.32 0.00 -0.00 0.00 0.00 57.00 56.71 2d89 n GLN 63 Cb 0.04 -1.50 -0.15 0.00 -0.00 0.00 0.00 30.24 28.62 2d89 n GLN 63 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2d89 s ASP 64 N -2.54 3.98 -0.25 2.61 1.01 -1.07 -4.98 116.67 115.42 2d89 s ASP 64 Ca 0.29 -1.14 -0.11 0.00 0.71 0.00 0.00 52.55 52.31 2d89 s ASP 64 Cb 0.20 -1.50 -0.15 0.00 1.01 0.00 0.00 42.92 42.48 2d89 s ASP 64 CO 0.46 -0.13 -0.19 -0.38 0.21 0.00 0.00 175.17 175.14 2d89 n ILE 65 N 4.51 1.54 -0.03 0.77 5.41 -1.25 -3.80 119.36 126.50 2d89 n ILE 65 Ca -0.16 -0.40 -0.14 0.00 1.00 0.00 0.00 62.75 63.04 2d89 n ILE 65 Cb 0.45 -1.78 -0.11 0.00 -0.71 0.00 0.00 39.64 37.49 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 -0.67 0.12 0.39 0.38 3.64 -1.80 -3.19 116.57 115.43 2d89 h LYS 66 Ca -0.60 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 58.65 2d89 h LYS 66 Cb 1.67 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.53 2d89 h LYS 66 CO -0.28 0.83 -0.19 1.49 -2.27 0.00 0.00 179.45 179.04 2d89 h GLU 67 N -0.56 -0.50 -0.76 1.90 4.81 -1.90 -0.30 114.58 117.28 2d89 h GLU 67 Ca -0.02 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.36 2d89 h GLU 67 Cb 0.87 0.11 -0.12 0.00 0.63 0.00 0.00 28.75 30.25 2d89 h GLU 67 CO 0.03 -0.33 -0.33 0.09 -0.73 0.00 0.00 179.01 177.74 2d89 n ASN 68 N -3.47 -0.56 -0.11 1.04 4.13 -1.25 0.11 115.26 115.15 2d89 n ASN 68 Ca -0.06 1.33 -0.09 0.00 1.68 0.00 0.00 54.58 57.44 2d89 n ASN 68 Cb 0.21 -0.28 -0.01 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 0.43 -0.92 6.41 2.35 -1.54 -2.51 115.58 119.80 2d89 h ASN 69 Ca 0.23 -0.08 0.12 0.00 -0.55 0.00 0.00 56.30 56.03 2d89 h ASN 69 Cb 0.42 -0.11 -0.07 0.00 0.05 0.00 0.00 38.32 38.61 2d89 h ASN 69 CO -0.75 0.38 0.59 0.50 -1.65 0.00 0.00 177.43 176.50 2d89 h LYS 70 N 0.44 0.83 -0.11 0.81 1.63 0.26 -2.20 116.57 118.23 2d89 h LYS 70 Ca 0.12 -0.05 0.05 0.00 -0.85 0.00 0.00 60.65 59.92 2d89 h LYS 70 Cb 0.04 -0.19 -0.06 0.00 -0.60 0.00 0.00 32.23 31.42 2d89 h LYS 70 CO -0.02 0.55 -0.28 0.87 -3.45 0.00 0.00 179.45 177.11 2d89 h LYS 71 N 0.85 -0.35 0.44 1.90 1.57 -0.13 -2.29 116.57 118.55 2d89 h LYS 71 Ca 0.45 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.23 2d89 h LYS 71 Cb 0.53 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.92 2d89 h LYS 71 CO -0.21 -0.23 -0.27 0.00 -0.57 0.00 0.00 179.45 178.17 2d89 h ALA 72 N 0.50 -1.11 -1.52 3.86 0.00 -1.40 -0.54 119.26 119.06 2d89 h ALA 72 Ca 0.09 -0.14 0.44 0.00 0.00 0.00 0.00 54.91 55.31 2d89 h ALA 72 Cb 0.51 0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 2d89 h ALA 72 CO -0.32 -1.08 1.23 0.66 0.00 0.00 0.00 179.25 179.73 2d89 n TYR 73 N -4.01 0.00 0.04 0.00 4.01 -1.02 0.23 117.16 116.42 2d89 n TYR 73 Ca -0.08 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.44 2d89 n TYR 73 Cb 0.28 -0.38 -0.14 0.00 -0.31 0.00 0.00 39.34 38.78 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 0.52 0.03 7.72 3.58 -0.80 -3.19 116.42 124.27 2d89 h ASP 74 Ca 0.72 -0.91 -0.00 0.00 0.42 0.00 0.00 57.03 57.26 2d89 h ASP 74 Cb 3.17 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 44.05 2d89 h ASP 74 CO -0.01 1.71 -0.01 1.23 -2.88 0.00 0.00 179.24 179.28 2d89 h GLY 75 N 0.39 -0.04 1.56 -0.78 0.00 0.45 -3.09 103.07 101.56 2d89 h GLY 75 Ca -0.32 0.01 0.05 0.00 0.00 0.00 0.00 47.33 47.07 2d89 h GLY 75 CO 0.13 -0.01 0.19 0.74 0.00 0.00 0.00 176.54 177.59 2d89 h PHE 76 N -0.76 0.16 0.00 5.60 0.04 -0.35 0.24 116.94 121.88 2d89 h PHE 76 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2d89 h PHE 76 Cb 0.68 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.78 2d89 h PHE 76 CO 0.16 0.09 0.00 0.00 -0.60 0.00 0.00 178.31 177.96 2d89 n ALA 77 N -2.55 2.52 0.02 2.45 0.00 -1.21 -1.55 120.51 120.20 2d89 n ALA 77 Ca 0.03 -0.16 -0.09 0.00 0.00 0.00 0.00 53.44 53.22 2d89 n ALA 77 Cb 0.24 -1.49 0.06 0.00 0.00 0.00 0.00 19.45 18.26 2d89 n ALA 77 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2d89 h SER 78 N 0.00 0.55 0.24 0.00 0.02 -0.43 -3.29 113.55 110.64 2d89 h SER 78 Ca 0.00 -0.31 -0.34 0.00 -0.84 0.00 0.00 61.79 60.30 2d89 h SER 78 Cb 0.21 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 2d89 h SER 78 CO 0.00 1.01 -1.94 2.30 -1.14 0.00 0.00 176.83 177.06 2d89 n ILE 79 N -3.93 1.69 0.00 3.27 -0.00 -1.22 -4.97 119.36 114.20 2d89 n ILE 79 Ca -0.03 -0.71 0.00 0.00 -0.00 0.00 0.00 62.75 62.01 2d89 n ILE 79 Cb 0.62 -1.43 0.00 0.00 -0.00 0.00 0.00 39.64 38.83 2d89 n ILE 79 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2d89 n GLY 80 N 1.85 0.00 3.18 3.28 0.00 -1.21 -5.11 105.19 107.19 2d89 n GLY 80 Ca -0.28 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 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 4.53 0.01 -0.61 1.01 -0.60 -4.99 121.20 120.55 2d89 s ILE 81 Ca 0.00 -2.97 -0.40 0.00 0.00 0.00 0.00 60.65 57.28 2d89 s ILE 81 Cb 0.00 -3.86 -0.20 0.00 0.01 0.00 0.00 42.46 38.42 2d89 s ILE 81 CO 0.00 -0.97 1.09 -1.20 0.00 0.00 0.00 174.94 173.85 2d89 n SER 82 N 3.42 0.11 -4.62 3.58 7.64 -1.26 -3.97 113.62 118.52 2d89 n SER 82 Ca 0.13 1.16 -0.43 0.00 1.01 0.00 0.00 58.87 60.74 2d89 n SER 82 Cb 0.41 -0.94 -0.03 0.00 -1.01 0.00 0.00 64.21 62.64 2d89 n SER 82 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2d89 s ARG 83 N 0.03 3.98 -0.27 1.43 0.52 -1.26 -4.90 118.95 118.48 2d89 s ARG 83 Ca 0.90 0.86 -0.15 0.00 -0.52 0.00 0.00 55.73 56.82 2d89 s ARG 83 Cb -1.24 -3.76 -0.13 0.00 0.52 0.00 0.00 34.95 30.34 2d89 s ARG 83 CO 0.56 -0.91 -0.27 1.28 0.02 0.00 0.00 175.30 175.98 2d89 n LEU 84 N 6.81 1.94 -4.83 2.53 4.77 -1.26 -4.97 117.00 121.99 2d89 n LEU 84 Ca 0.10 0.35 -0.34 0.00 -0.03 0.00 0.00 56.01 56.09 2d89 n LEU 84 Cb 0.48 -0.84 -0.06 0.00 -2.33 0.00 0.00 43.42 40.66 2d89 n LEU 84 CO 0.58 0.51 0.43 -0.22 -1.33 0.00 0.00 177.39 177.36 2d89 s LEU 85 N -7.58 4.20 0.05 2.23 2.96 -1.26 -5.08 118.68 114.19 2d89 s LEU 85 Ca -0.37 1.37 0.02 0.00 -0.22 0.00 0.00 54.13 54.93 2d89 s LEU 85 Cb 0.13 -3.86 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 2d89 s LEU 85 CO 0.50 -0.09 0.08 -1.61 -1.32 0.00 0.00 176.35 173.91 2d89 s GLU 86 N -2.49 2.96 0.05 1.98 2.02 -1.26 -4.99 118.70 116.97 2d89 s GLU 86 Ca 0.49 -0.61 -0.20 0.00 0.02 0.00 0.00 54.97 54.68 2d89 s GLU 86 Cb -0.13 -2.78 -0.14 0.00 0.10 0.00 0.00 34.13 31.18 2d89 s GLU 86 CO 0.19 0.60 1.35 -1.00 0.02 0.00 0.00 175.26 176.42 2d89 h PRO 87 N 3.62 0.40 -0.71 0.39 0.13 -1.89 -3.23 132.00 130.71 2d89 h PRO 87 Ca -0.48 -0.21 -0.03 0.00 -0.87 0.00 0.00 66.00 64.41 2d89 h PRO 87 Cb 1.17 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2d89 h PRO 87 CO 0.65 0.77 0.33 0.66 -0.23 0.00 0.00 178.00 180.18 2d89 h SER 88 N 0.05 0.94 -0.55 1.44 4.64 -1.90 -2.94 113.55 115.22 2d89 h SER 88 Ca 0.03 -0.14 0.11 0.00 -0.47 0.00 0.00 61.79 61.31 2d89 h SER 88 Cb 0.70 -0.24 -0.11 0.00 -0.31 0.00 0.00 62.40 62.44 2d89 h SER 88 CO 0.04 0.82 -0.17 0.44 -0.87 0.00 0.00 176.83 177.09 2d89 h ASP 89 N 0.99 -0.63 -0.75 4.97 3.32 -1.98 0.53 116.42 122.87 2d89 h ASP 89 Ca 0.24 0.18 0.22 0.00 0.02 0.00 0.00 57.03 57.69 2d89 h ASP 89 Cb 0.14 0.38 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 2d89 h ASP 89 CO -0.03 -0.21 0.64 0.24 -1.72 0.00 0.00 179.24 178.16 2d89 h MET 90 N -0.04 0.00 0.06 3.56 2.86 -1.54 -0.97 114.93 118.86 2d89 h MET 90 Ca 0.26 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.66 2d89 h MET 90 Cb 0.44 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 2d89 h MET 90 CO -0.59 0.00 -1.31 0.28 1.06 0.00 0.00 176.91 176.35 2d89 h VAL 91 N 0.00 0.99 -0.05 -2.22 2.07 -0.15 -3.40 116.25 113.49 2d89 h VAL 91 Ca 0.36 -2.29 0.01 0.00 0.82 0.00 0.00 66.70 65.59 2d89 h VAL 91 Cb 1.63 2.54 -0.01 0.00 -1.52 0.00 0.00 31.29 33.92 2d89 h VAL 91 CO -0.00 0.56 -0.11 -0.07 0.02 0.00 0.00 177.57 177.97 2d89 h LEU 92 N -0.60 -0.35-10.76 2.57 3.38 0.52 -3.42 115.31 106.65 2d89 h LEU 92 Ca -0.31 0.04 -0.45 0.00 0.09 0.00 0.00 57.88 57.24 2d89 h LEU 92 Cb 1.55 0.14 0.14 0.00 0.09 0.00 0.00 40.66 42.57 2d89 h LEU 92 CO -0.05 -0.09 0.37 -1.48 0.09 0.00 0.00 178.44 177.28 2d89 s LEU 93 N -6.23 2.72 -0.08 1.67 0.05 -0.92 -5.06 118.68 110.84 2d89 s LEU 93 Ca -0.03 0.28 -0.05 0.00 0.05 0.00 0.00 54.13 54.38 2d89 s LEU 93 Cb 0.01 -2.47 -0.02 0.00 -2.05 0.00 0.00 46.19 41.67 2d89 s LEU 93 CO 0.12 -2.42 -0.09 0.00 -0.55 0.00 0.00 176.35 173.41 2d89 h ALA 94 N -1.34 0.00 -3.18 1.48 0.00 -1.84 -3.46 119.26 110.92 2d89 h ALA 94 Ca -0.44 -0.36 -0.65 0.00 0.00 0.00 0.00 54.91 53.45 2d89 h ALA 94 Cb 1.26 0.27 -0.27 0.00 0.00 0.00 0.00 17.79 19.05 2d89 h ALA 94 CO 0.44 0.27 -0.74 0.42 0.00 0.00 0.00 179.25 179.64 2d89 s ILE 95 N -1.68 3.23 1.00 0.00 -1.09 -1.26 -4.97 121.20 116.42 2d89 s ILE 95 Ca -0.08 -0.57 -0.12 0.00 -2.23 0.00 0.00 60.65 57.65 2d89 s ILE 95 Cb 0.01 -2.41 0.19 0.00 -1.58 0.00 0.00 42.46 38.67 2d89 s ILE 95 CO 0.12 0.48 1.09 -2.16 -1.23 0.00 0.00 174.94 173.24 2d89 s PRO 96 N 0.81 0.44 -0.81 2.79 0.04 -1.26 -4.95 135.00 132.07 2d89 s PRO 96 Ca -0.03 0.53 -0.24 0.00 0.04 0.00 0.00 61.00 61.31 2d89 s PRO 96 Cb -0.15 -1.74 0.06 0.00 0.04 0.00 0.00 34.50 32.72 2d89 s PRO 96 CO 0.01 -2.73 1.20 -0.51 0.04 0.00 0.00 177.00 175.02 2d89 s ASP 97 N -3.45 6.31 0.25 6.66 1.11 -1.26 -4.88 116.67 121.42 2d89 s ASP 97 Ca 0.65 -1.08 0.11 0.00 0.18 0.00 0.00 52.55 52.42 2d89 s ASP 97 Cb -0.19 -2.50 0.85 0.00 1.07 0.00 0.00 42.92 42.16 2d89 s ASP 97 CO 0.58 -1.53 1.13 1.17 1.18 0.00 0.00 175.17 177.69 2d89 n LYS 98 N 8.35 -0.05 -0.02 8.23 4.81 -1.26 0.19 118.16 138.42 2d89 n LYS 98 Ca 0.11 1.01 -0.10 0.00 -0.87 0.00 0.00 58.31 58.47 2d89 n LYS 98 Cb 0.48 -1.76 -0.04 0.00 0.02 0.00 0.00 35.03 33.74 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 -0.12 0.00 3.14 3.38 -1.90 -2.00 115.31 117.81 2d89 h LEU 99 Ca 0.56 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.57 2d89 h LEU 99 Cb 1.41 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.24 2d89 h LEU 99 CO -0.59 -0.04 0.00 0.41 0.09 0.00 0.00 178.44 178.31 2d89 n THR 100 N -5.16 0.00 -0.29 0.22 -1.04 0.51 -1.62 114.28 106.90 2d89 n THR 100 Ca -0.04 1.35 -0.04 0.00 -2.04 0.00 0.00 64.05 63.28 2d89 n THR 100 Cb 0.09 -2.33 -0.01 0.00 -1.82 0.00 0.00 70.33 66.26 2d89 n THR 100 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2d89 n VAL 101 N -1.56 -0.43 -0.29 12.58 0.31 -1.04 0.21 118.33 128.11 2d89 n VAL 101 Ca 0.00 1.71 0.07 0.00 -0.01 0.00 0.00 64.34 66.11 2d89 n VAL 101 Cb 0.00 -2.20 0.22 0.00 -0.91 0.00 0.00 33.84 30.95 2d89 n VAL 101 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 2d89 h MET 102 N 0.00 0.60 -0.89 5.55 2.07 -1.37 0.48 114.93 121.37 2d89 h MET 102 Ca 0.19 -0.04 0.06 0.00 -2.07 0.00 0.00 59.70 57.85 2d89 h MET 102 Cb 0.38 -0.14 -0.06 0.00 -1.87 0.00 0.00 31.60 29.91 2d89 h MET 102 CO -0.70 0.40 0.58 1.15 1.07 0.00 0.00 176.91 179.41 2d89 h THR 103 N 0.62 1.08 -0.12 2.22 2.02 0.35 -2.11 112.91 116.96 2d89 h THR 103 Ca 0.46 -0.35 -0.14 0.00 0.77 0.00 0.00 66.41 67.14 2d89 h THR 103 Cb 0.64 -0.04 0.01 0.00 -1.74 0.00 0.00 68.15 67.02 2d89 h THR 103 CO -0.36 0.19 -0.48 0.22 0.37 0.00 0.00 175.52 175.46 2d89 h TYR 104 N 1.02 0.71 -0.06 3.16 3.20 -0.19 -3.31 116.97 121.50 2d89 h TYR 104 Ca 0.38 -0.30 0.04 0.00 3.14 0.00 0.00 58.73 61.99 2d89 h TYR 104 Cb 0.17 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.27 2d89 h TYR 104 CO -0.00 1.07 -0.32 -0.07 -1.64 0.00 0.00 178.16 177.20 2d89 h LEU 105 N 0.15 -0.99 -1.54 2.82 3.38 -0.63 -0.45 115.31 118.05 2d89 h LEU 105 Ca -0.03 0.14 0.46 0.00 0.09 0.00 0.00 57.88 58.54 2d89 h LEU 105 Cb 1.11 0.41 -0.12 0.00 0.09 0.00 0.00 40.66 42.15 2d89 h LEU 105 CO 0.10 -0.37 0.97 1.88 0.09 0.00 0.00 178.44 181.10 2d89 h TYR 106 N -0.44 0.40 0.79 1.13 0.05 -1.48 0.16 116.97 117.57 2d89 h TYR 106 Ca 0.08 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.84 2d89 h TYR 106 Cb 0.56 -0.10 0.01 0.00 1.01 0.00 0.00 36.73 38.21 2d89 h TYR 106 CO -0.38 -0.17 -0.38 1.96 -1.05 0.00 0.00 178.16 178.15 2d89 h GLN 107 N 0.05 -1.02 0.02 4.88 4.20 -1.18 0.49 115.11 122.55 2d89 h GLN 107 Ca 0.84 0.07 0.03 0.00 0.06 0.00 0.00 58.65 59.65 2d89 h GLN 107 Cb 2.83 0.23 -0.05 0.00 0.30 0.00 0.00 27.48 30.78 2d89 h GLN 107 CO -0.33 -0.67 -0.46 0.82 -0.67 0.00 0.00 178.83 177.53 2d89 h ILE 108 N -1.22 0.10 -0.98 2.54 5.03 -0.66 0.70 117.51 123.03 2d89 h ILE 108 Ca -0.11 0.00 0.11 0.00 -0.12 0.00 0.00 64.86 64.74 2d89 h ILE 108 Cb 0.82 0.10 -0.08 0.00 -3.03 0.00 0.00 36.82 34.64 2d89 h ILE 108 CO 0.18 0.00 0.62 -0.09 -0.68 0.00 0.00 178.15 178.18 2d89 h ARG 109 N -0.62 0.94 0.18 2.37 2.43 -1.46 -2.18 114.38 116.04 2d89 h ARG 109 Ca 0.03 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 2d89 h ARG 109 Cb 0.68 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2d89 h ARG 109 CO -0.32 0.62 -0.09 0.00 -1.51 0.00 0.00 179.97 178.68 2d89 h ALA 110 N 1.54 -0.24 0.05 2.80 0.00 0.26 0.41 119.26 124.07 2d89 h ALA 110 Ca 0.47 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2d89 h ALA 110 Cb 0.46 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2d89 h ALA 110 CO -0.24 -0.61 -0.13 1.25 0.00 0.00 0.00 179.25 179.53 2d89 h HIS 111 N -0.29 -0.38 -0.18 0.00 -0.00 -0.29 -2.73 115.15 111.28 2d89 h HIS 111 Ca -0.02 0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.39 2d89 h HIS 111 Cb 0.23 0.16 -0.04 0.00 -0.00 0.00 0.00 27.41 27.76 2d89 h HIS 111 CO -0.05 -0.15 -0.06 0.74 -0.00 0.00 0.00 177.93 178.41 2d89 h PHE 112 N -0.20 -0.14 -3.41 5.26 0.04 -1.51 -3.34 116.94 113.64 2d89 h PHE 112 Ca -0.00 0.02 -0.75 0.00 2.80 0.00 0.00 57.97 60.04 2d89 h PHE 112 Cb 0.19 0.09 -0.28 0.00 2.20 0.00 0.00 35.95 38.15 2d89 h PHE 112 CO -0.30 -0.10 -0.22 0.45 -0.60 0.00 0.00 178.31 177.54 2d89 s SER 113 N -5.18 6.03 -0.05 2.17 0.15 0.14 -5.04 113.70 111.93 2d89 s SER 113 Ca -0.14 -2.21 -0.40 0.00 0.70 0.00 0.00 55.95 53.90 2d89 s SER 113 Cb 0.10 -2.09 -0.20 0.00 -1.71 0.00 0.00 66.02 62.12 2d89 s SER 113 CO 0.68 -0.66 1.10 -1.54 1.20 0.00 0.00 173.24 174.03 2d89 n SER 114 N 4.56 0.11 0.00 5.45 3.41 -1.04 -4.07 113.62 122.04 2d89 n SER 114 Ca -0.02 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.74 2d89 n SER 114 Cb 0.42 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2d89 n SER 114 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d89 n GLY 115 N 1.71 5.07 3.56 5.00 0.00 -1.25 -4.93 105.19 114.35 2d89 n GLY 115 Ca 0.21 -0.92 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 2d89 n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d89 s PRO 116 N 2.83 2.56 -0.29 1.61 0.04 -1.26 -4.86 135.00 135.63 2d89 s PRO 116 Ca 0.00 -0.23 -0.13 0.00 0.04 0.00 0.00 61.00 60.68 2d89 s PRO 116 Cb 0.00 -5.01 0.12 0.00 0.04 0.00 0.00 34.50 29.64 2d89 s PRO 116 CO 0.00 -3.33 0.73 0.45 0.04 0.00 0.00 177.00 174.89 2d89 s SER 117 N 8.03 -0.95 0.14 6.66 0.15 -1.26 -5.06 113.70 121.41 2d89 s SER 117 Ca 0.70 1.40 -0.31 0.00 0.70 0.00 0.00 55.95 58.44 2d89 s SER 117 Cb -0.07 1.79 -0.07 0.00 -1.71 0.00 0.00 66.02 65.96 2d89 s SER 117 CO 0.01 -0.21 1.55 -1.28 1.20 0.00 0.00 173.24 174.51 2d89 h SER 118 N 7.38 -1.80 0.00 5.45 0.87 -2.07 -3.54 113.55 119.85 2d89 h SER 118 Ca -0.23 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2d89 h SER 118 Cb 1.16 0.76 0.00 0.00 -0.44 0.00 0.00 62.40 63.88 2d89 h SER 118 CO 0.13 -0.37 0.00 0.61 -0.53 0.00 0.00 176.83 176.67