#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b6g s THR 16 N 0.00 4.94 0.06 3.15 -4.23 -1.26 -4.91 115.64 113.39 3b6g s THR 16 Ca 0.00 0.25 0.33 0.00 -1.18 0.00 0.00 61.69 61.09 3b6g s THR 16 Cb 0.00 -3.73 0.39 0.00 1.34 0.00 0.00 72.50 70.50 3b6g s THR 16 CO 0.00 -0.38 1.96 0.03 -0.54 0.00 0.00 174.62 175.69 3b6g h ARG 17 N 1.57 0.00 0.33 3.99 3.08 -1.97 0.54 114.38 121.91 3b6g h ARG 17 Ca -0.47 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.56 3b6g h ARG 17 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.24 3b6g h ARG 17 CO 0.65 0.00 -0.16 0.77 -1.07 0.00 0.00 179.97 180.17 3b6g h SER 18 N 0.00 -0.37 -0.54 7.04 0.02 -1.90 -2.87 113.55 114.94 3b6g h SER 18 Ca 0.00 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.06 3b6g h SER 18 Cb 0.54 0.10 -0.11 0.00 0.14 0.00 0.00 62.40 63.07 3b6g h SER 18 CO 0.00 -0.19 -0.36 0.77 -1.14 0.00 0.00 176.83 175.91 3b6g h SER 19 N -0.58 -1.22 -1.72 3.07 4.64 -1.70 1.03 113.55 117.07 3b6g h SER 19 Ca -0.04 0.22 0.51 0.00 -0.47 0.00 0.00 61.79 62.01 3b6g h SER 19 Cb 0.34 0.58 -0.09 0.00 -0.31 0.00 0.00 62.40 62.92 3b6g h SER 19 CO 0.07 -0.32 1.21 -0.09 -0.87 0.00 0.00 176.83 176.84 3b6g h ARG 20 N -0.20 0.02 0.00 4.77 9.65 -0.00 0.12 114.38 128.73 3b6g h ARG 20 Ca 0.20 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.08 3b6g h ARG 20 Cb 0.55 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.13 3b6g h ARG 20 CO -0.65 0.01 -0.78 0.00 2.80 0.00 0.00 179.97 181.35 3b6g n ALA 21 N -2.81 2.70 0.00 2.80 0.00 0.48 -5.02 120.51 118.66 3b6g n ALA 21 Ca 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3b6g n ALA 21 Cb 1.79 -0.27 0.00 0.00 0.00 0.00 0.00 19.45 20.96 3b6g n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b6g n GLY 22 N 1.55 0.29 2.77 0.00 0.00 0.33 -5.07 105.19 105.05 3b6g n GLY 22 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 3b6g n GLY 22 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3b6g n LEU 23 N 0.00 0.00 0.00 0.99 4.77 -0.76 -4.86 117.00 117.14 3b6g n LEU 23 Ca 0.00 -1.19 0.00 0.00 -0.03 0.00 0.00 56.01 54.79 3b6g n LEU 23 Cb 0.00 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 3b6g n LEU 23 CO 0.00 -1.08 -0.46 0.00 -1.33 0.00 0.00 177.39 174.52 3b6g n GLN 24 N -2.81 1.95 -2.90 3.23 1.13 -1.26 -4.34 117.38 112.38 3b6g n GLN 24 Ca 0.12 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.77 3b6g n GLN 24 Cb 0.42 -0.96 -0.04 0.00 0.11 0.00 0.00 30.24 29.77 3b6g n GLN 24 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 3b6g s PHE 25 N -1.86 3.51 -0.51 1.08 0.40 -1.26 -4.89 117.98 114.44 3b6g s PHE 25 Ca 0.00 1.35 -0.28 0.00 -0.60 0.00 0.00 56.93 57.39 3b6g s PHE 25 Cb 0.00 -2.98 -0.10 0.00 0.51 0.00 0.00 43.02 40.45 3b6g s PHE 25 CO 0.00 -0.10 2.41 -0.35 0.70 0.00 0.00 175.22 177.87 3b6g n PRO 26 N 4.57 1.01 0.27 0.24 -0.04 -1.26 -4.80 135.00 134.99 3b6g n PRO 26 Ca 0.03 0.11 0.16 0.00 -0.04 0.00 0.00 63.50 63.76 3b6g n PRO 26 Cb 0.50 -2.98 0.68 0.00 -0.04 0.00 0.00 33.50 31.66 3b6g n PRO 26 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3b6g h VAL 27 N 7.59 0.16 0.18 0.52 2.07 -1.88 -2.06 116.25 122.83 3b6g h VAL 27 Ca -0.24 -0.61 -0.35 0.00 0.82 0.00 0.00 66.70 66.33 3b6g h VAL 27 Cb 1.28 1.52 0.01 0.00 -1.52 0.00 0.00 31.29 32.57 3b6g h VAL 27 CO 1.15 0.06 -1.74 1.23 0.02 0.00 0.00 177.57 178.28 3b6g h GLY 28 N 1.82 0.43 1.71 2.17 0.00 -1.92 -3.31 103.07 103.97 3b6g h GLY 28 Ca -0.00 -1.10 -0.14 0.00 0.00 0.00 0.00 47.33 46.08 3b6g h GLY 28 CO 0.01 0.96 -0.56 -0.09 0.00 0.00 0.00 176.54 176.86 3b6g h ARG 29 N 0.10 0.31 0.00 4.80 2.43 -1.87 -2.20 114.38 117.94 3b6g h ARG 29 Ca -0.34 -0.20 -0.08 0.00 -0.81 0.00 0.00 59.98 58.56 3b6g h ARG 29 Cb 2.09 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 31.65 3b6g h ARG 29 CO 0.17 0.79 -0.36 0.28 -1.51 0.00 0.00 179.97 179.34 3b6g h VAL 30 N 0.24 0.86 0.74 0.20 2.07 -1.57 -3.16 116.25 115.62 3b6g h VAL 30 Ca 0.00 -1.47 -0.04 0.00 0.82 0.00 0.00 66.70 66.01 3b6g h VAL 30 Cb 1.06 1.91 0.01 0.00 -1.52 0.00 0.00 31.29 32.74 3b6g h VAL 30 CO 0.09 0.35 -0.35 -0.74 0.02 0.00 0.00 177.57 176.94 3b6g h HIS 31 N 0.00 -0.92 -0.68 1.57 -0.00 -1.49 -2.58 115.15 111.05 3b6g h HIS 31 Ca -0.00 -0.02 0.14 0.00 -0.00 0.00 0.00 60.37 60.48 3b6g h HIS 31 Cb 0.88 0.30 -0.13 0.00 -0.00 0.00 0.00 27.41 28.46 3b6g h HIS 31 CO 0.00 -0.56 -0.15 -0.09 -0.00 0.00 0.00 177.93 177.13 3b6g h ARG 32 N -1.06 0.01 0.00 5.26 2.43 -1.52 -0.24 114.38 119.26 3b6g h ARG 32 Ca -0.10 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 3b6g h ARG 32 Cb 0.77 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 3b6g h ARG 32 CO 0.17 0.01 0.00 1.28 -1.51 0.00 0.00 179.97 179.91 3b6g n LEU 33 N -5.44 0.60 0.01 3.80 4.77 -1.14 0.64 117.00 120.24 3b6g n LEU 33 Ca 0.09 0.66 0.13 0.00 -0.03 0.00 0.00 56.01 56.85 3b6g n LEU 33 Cb 0.36 -0.58 0.39 0.00 -2.33 0.00 0.00 43.42 41.26 3b6g n LEU 33 CO 0.03 -0.55 0.66 0.18 -1.33 0.00 0.00 177.39 176.38 3b6g n LEU 34 N -2.17 0.34 -0.10 2.23 4.77 -0.12 -3.07 117.00 118.87 3b6g n LEU 34 Ca 0.02 0.24 -0.15 0.00 -0.03 0.00 0.00 56.01 56.09 3b6g n LEU 34 Cb 0.21 -0.34 -0.05 0.00 -2.33 0.00 0.00 43.42 40.90 3b6g n LEU 34 CO 0.19 0.05 -0.85 0.54 -1.33 0.00 0.00 177.39 175.98 3b6g n ARG 35 N -1.59 0.54 0.16 3.23 1.74 0.21 -4.34 116.66 116.61 3b6g n ARG 35 Ca 0.06 0.29 0.19 0.00 -0.77 0.00 0.00 57.85 57.62 3b6g n ARG 35 Cb 0.35 -1.50 0.79 0.00 -1.02 0.00 0.00 32.46 31.07 3b6g n ARG 35 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 3b6g h LYS 36 N -1.00 0.00 0.00 5.56 3.64 -0.97 -1.52 116.57 122.27 3b6g h LYS 36 Ca -0.23 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 58.99 3b6g h LYS 36 Cb 1.14 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 3b6g h LYS 36 CO -0.14 0.00 -0.75 0.78 -2.27 0.00 0.00 179.45 177.07 3b6g h GLY 37 N 0.00 0.00 -5.87 5.01 0.00 -1.76 -3.48 103.07 96.96 3b6g h GLY 37 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.10 3b6g h GLY 37 CO -0.00 0.00 -0.86 0.70 0.00 0.00 0.00 176.54 176.38 3b6g n ASN 38 N -3.38 -4.10 0.12 0.19 4.13 -0.58 -4.92 115.26 106.72 3b6g n ASN 38 Ca 0.00 -0.82 -0.20 0.00 1.68 0.00 0.00 54.58 55.24 3b6g n ASN 38 Cb 0.80 -4.36 -0.15 0.00 -1.54 0.00 0.00 39.78 34.53 3b6g n ASN 38 CO 0.00 0.00 0.00 1.88 0.28 0.00 0.00 177.26 179.42 3b6g h TYR 39 N -1.63 0.73 -3.89 3.10 -1.99 -1.85 -3.47 116.97 107.98 3b6g h TYR 39 Ca -0.62 -0.54 -0.29 0.00 2.00 0.00 0.00 58.73 59.28 3b6g h TYR 39 Cb 1.34 -0.03 -0.07 0.00 2.00 0.00 0.00 36.73 39.97 3b6g h TYR 39 CO 0.38 1.44 -0.22 0.00 -0.00 0.00 0.00 178.16 179.75 3b6g n ALA 40 N -2.64 0.07 0.02 3.88 0.00 -1.26 -5.11 120.51 115.46 3b6g n ALA 40 Ca -0.13 -1.41 -0.02 0.00 0.00 0.00 0.00 53.44 51.88 3b6g n ALA 40 Cb 1.07 1.14 -0.01 0.00 0.00 0.00 0.00 19.45 21.65 3b6g n ALA 40 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3b6g h GLU 41 N 0.00 -0.11 -5.50 0.00 4.57 -1.94 -3.47 114.58 108.13 3b6g h GLU 41 Ca -0.21 0.01 -0.64 0.00 -1.18 0.00 0.00 59.36 57.34 3b6g h GLU 41 Cb 0.96 0.03 -0.09 0.00 -0.16 0.00 0.00 28.75 29.48 3b6g h GLU 41 CO 0.29 -0.07 -0.47 1.03 -1.18 0.00 0.00 179.01 178.60 3b6g s ARG 42 N -1.82 3.78 -0.07 1.92 0.52 -1.26 -5.01 118.95 117.01 3b6g s ARG 42 Ca -0.02 -0.14 -0.13 0.00 -0.52 0.00 0.00 55.73 54.92 3b6g s ARG 42 Cb 0.00 -3.29 -0.05 0.00 0.52 0.00 0.00 34.95 32.13 3b6g s ARG 42 CO 0.05 0.57 0.32 0.08 0.02 0.00 0.00 175.30 176.34 3b6g s VAL 43 N -0.42 5.22 0.00 3.52 1.01 -1.26 -5.10 120.40 123.36 3b6g s VAL 43 Ca 0.13 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.73 3b6g s VAL 43 Cb -0.12 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.64 3b6g s VAL 43 CO 0.02 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.26 3b6g n GLY 44 N 2.33 -1.69 0.09 4.51 0.00 -1.26 -5.04 105.19 104.13 3b6g n GLY 44 Ca -0.14 -1.53 -0.12 0.00 0.00 0.00 0.00 46.02 44.23 3b6g n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b6g n ALA 45 N -3.00 1.61 -0.12 4.61 0.00 -1.26 -4.47 120.51 117.87 3b6g n ALA 45 Ca 0.00 -0.81 -0.13 0.00 0.00 0.00 0.00 53.44 52.50 3b6g n ALA 45 Cb 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 19.45 19.49 3b6g n ALA 45 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3b6g h GLY 46 N 1.58 1.03 -0.11 0.00 0.00 -2.00 -3.38 103.07 100.19 3b6g h GLY 46 Ca -0.41 -1.05 0.01 0.00 0.00 0.00 0.00 47.33 45.88 3b6g h GLY 46 CO -0.05 0.95 -0.06 0.00 0.00 0.00 0.00 176.54 177.37 3b6g n ALA 47 N -2.55 -0.07 0.23 3.60 0.00 -1.26 0.31 120.51 120.76 3b6g n ALA 47 Ca -0.02 0.09 0.10 0.00 0.00 0.00 0.00 53.44 53.61 3b6g n ALA 47 Cb 0.55 0.30 0.49 0.00 0.00 0.00 0.00 19.45 20.79 3b6g n ALA 47 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3b6g h PRO 48 N 0.00 0.00 0.39 0.00 0.13 -1.83 -1.68 132.00 129.02 3b6g h PRO 48 Ca 0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.13 3b6g h PRO 48 Cb 0.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.18 3b6g h PRO 48 CO -0.10 0.22 -0.19 0.28 -0.23 0.00 0.00 178.00 177.98 3b6g h VAL 49 N 0.00 0.00 -1.27 1.56 2.07 -1.45 -2.81 116.25 114.35 3b6g h VAL 49 Ca -0.00 -0.33 0.37 0.00 0.82 0.00 0.00 66.70 67.55 3b6g h VAL 49 Cb 0.70 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.40 3b6g h VAL 49 CO 0.03 0.00 0.89 0.22 0.02 0.00 0.00 177.57 178.73 3b6g h TYR 50 N -0.86 0.17 0.00 1.57 3.20 0.34 -1.70 116.97 119.68 3b6g h TYR 50 Ca -0.05 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.82 3b6g h TYR 50 Cb 0.41 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.63 3b6g h TYR 50 CO 0.03 -0.01 0.00 -0.11 -1.64 0.00 0.00 178.16 176.44 3b6g n LEU 51 N -4.28 0.03 0.00 2.82 7.94 -0.68 -3.18 117.00 119.65 3b6g n LEU 51 Ca 0.29 0.70 0.00 0.00 -1.11 0.00 0.00 56.01 55.89 3b6g n LEU 51 Cb 1.29 -0.49 0.00 0.00 0.53 0.00 0.00 43.42 44.75 3b6g n LEU 51 CO 0.36 -0.49 0.43 0.00 -1.11 0.00 0.00 177.39 176.58 3b6g n ALA 52 N -1.98 0.27 -0.08 1.96 0.00 -0.68 0.25 120.51 120.25 3b6g n ALA 52 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 3b6g n ALA 52 Cb 0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 19.45 19.08 3b6g n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3b6g h ALA 53 N 0.50 0.08 0.43 0.00 0.00 -1.45 -3.21 119.26 115.61 3b6g h ALA 53 Ca 0.00 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.19 3b6g h ALA 53 Cb 0.64 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 3b6g h ALA 53 CO 0.00 0.21 -0.29 0.28 0.00 0.00 0.00 179.25 179.45 3b6g h VAL 54 N -1.00 0.00 -0.84 0.00 2.07 0.34 0.64 116.25 117.46 3b6g h VAL 54 Ca -0.10 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.59 3b6g h VAL 54 Cb 1.08 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.69 3b6g h VAL 54 CO -0.06 0.00 -0.16 -0.07 0.02 0.00 0.00 177.57 177.30 3b6g h LEU 55 N -0.68 -0.69 0.45 2.57 3.38 -1.64 0.54 115.31 119.24 3b6g h LEU 55 Ca -0.06 0.25 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 3b6g h LEU 55 Cb 0.56 0.49 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3b6g h LEU 55 CO 0.04 -0.27 -0.22 -0.08 0.09 0.00 0.00 178.44 178.00 3b6g h GLU 56 N 0.02 -0.59 -0.50 1.13 4.81 -1.52 -1.16 114.58 116.77 3b6g h GLU 56 Ca 0.42 0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.78 3b6g h GLU 56 Cb 0.68 0.13 -0.10 0.00 0.63 0.00 0.00 28.75 30.10 3b6g h GLU 56 CO -0.84 -0.36 -0.39 -0.92 -0.73 0.00 0.00 179.01 175.77 3b6g h TYR 57 N -0.67 -1.11 0.30 0.92 3.20 0.13 0.26 116.97 119.99 3b6g h TYR 57 Ca -0.06 0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 3b6g h TYR 57 Cb 0.50 0.56 -0.04 0.00 1.54 0.00 0.00 36.73 39.29 3b6g h TYR 57 CO -0.03 -0.41 -0.51 -0.07 -1.64 0.00 0.00 178.16 175.49 3b6g h LEU 58 N -0.25 -1.48 -0.94 2.82 3.38 -1.15 0.57 115.31 118.25 3b6g h LEU 58 Ca 0.18 0.14 0.30 0.00 0.09 0.00 0.00 57.88 58.59 3b6g h LEU 58 Cb 0.56 0.52 -0.17 0.00 0.09 0.00 0.00 40.66 41.66 3b6g h LEU 58 CO -0.63 -0.60 0.16 0.41 0.09 0.00 0.00 178.44 177.87 3b6g n THR 59 N -5.46 -0.40 -0.04 0.22 -1.04 -0.44 -0.72 114.28 106.40 3b6g n THR 59 Ca -0.10 2.03 -0.13 0.00 -2.04 0.00 0.00 64.05 63.81 3b6g n THR 59 Cb 0.43 -3.06 -0.08 0.00 -1.82 0.00 0.00 70.33 65.80 3b6g n THR 59 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3b6g h ALA 60 N 1.89 0.16 -0.36 2.41 0.00 0.22 -3.15 119.26 120.44 3b6g h ALA 60 Ca 0.64 -0.32 0.08 0.00 0.00 0.00 0.00 54.91 55.31 3b6g h ALA 60 Cb 1.45 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 19.12 3b6g h ALA 60 CO -0.84 0.02 -0.24 1.49 0.00 0.00 0.00 179.25 179.68 3b6g h GLU 61 N -0.14 -0.19 -0.83 0.00 4.57 0.22 -2.90 114.58 115.32 3b6g h GLU 61 Ca 0.01 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 3b6g h GLU 61 Cb 0.66 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.29 3b6g h GLU 61 CO 0.03 -0.13 0.00 1.51 -1.18 0.00 0.00 179.01 179.24 3b6g n ILE 62 N -5.39 0.00 0.00 2.32 3.06 -0.29 -2.89 119.36 116.17 3b6g n ILE 62 Ca 0.01 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.26 3b6g n ILE 62 Cb 0.30 -0.42 0.00 0.00 0.54 0.00 0.00 39.64 40.06 3b6g n ILE 62 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 3b6g n LEU 63 N -0.02 0.00 0.28 9.51 4.77 -1.12 -3.33 117.00 127.10 3b6g n LEU 63 Ca 0.00 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.15 3b6g n LEU 63 Cb 0.21 0.00 0.78 0.00 -2.33 0.00 0.00 43.42 42.08 3b6g n LEU 63 CO 0.00 0.00 1.02 -0.08 -1.33 0.00 0.00 177.39 177.00 3b6g h GLU 64 N 0.00 0.00 0.00 3.23 4.57 -1.46 0.17 114.58 121.09 3b6g h GLU 64 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3b6g h GLU 64 Cb 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 3b6g h GLU 64 CO 0.00 0.03 -0.12 -0.07 -1.18 0.00 0.00 179.01 177.67 3b6g h LEU 65 N 0.00 0.00 0.00 1.64 3.38 -1.73 -3.36 115.31 115.24 3b6g h LEU 65 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3b6g h LEU 65 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3b6g h LEU 65 CO 0.00 0.21 0.00 0.00 0.09 0.00 0.00 178.44 178.74 3b6g n ALA 66 N -2.56 1.73 -0.11 1.53 0.00 -1.21 -0.75 120.51 119.14 3b6g n ALA 66 Ca -0.02 -0.01 -0.25 0.00 0.00 0.00 0.00 53.44 53.17 3b6g n ALA 66 Cb 0.06 -1.02 -0.11 0.00 0.00 0.00 0.00 19.45 18.37 3b6g n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b6g n GLY 67 N -0.33 -0.53 0.13 0.00 0.00 0.61 -3.92 105.19 101.14 3b6g n GLY 67 Ca 0.01 -0.10 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 3b6g n GLY 67 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3b6g h ASN 68 N -0.67 0.32 -0.71 1.61 2.35 -1.47 -1.51 115.58 115.49 3b6g h ASN 68 Ca -0.57 -0.18 0.12 0.00 -0.55 0.00 0.00 56.30 55.11 3b6g h ASN 68 Cb 1.65 -0.08 -0.12 0.00 0.05 0.00 0.00 38.32 39.82 3b6g h ASN 68 CO -0.25 0.42 -0.26 0.00 -1.65 0.00 0.00 177.43 175.69 3b6g n ALA 69 N -2.26 -0.03 0.17 -0.83 0.00 0.07 -0.19 120.51 117.44 3b6g n ALA 69 Ca -0.03 0.73 0.02 0.00 0.00 0.00 0.00 53.44 54.16 3b6g n ALA 69 Cb 0.14 -0.35 0.37 0.00 0.00 0.00 0.00 19.45 19.61 3b6g n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3b6g h ALA 70 N 1.09 1.43 -0.06 0.00 0.00 -1.40 -2.35 119.26 117.98 3b6g h ALA 70 Ca 0.27 -0.29 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 3b6g h ALA 70 Cb 0.45 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3b6g h ALA 70 CO -0.72 0.42 -0.77 -0.09 0.00 0.00 0.00 179.25 178.10 3b6g h ARG 71 N 0.07 0.38 -0.37 0.00 2.43 -0.36 -1.58 114.38 114.95 3b6g h ARG 71 Ca 0.01 -0.33 0.05 0.00 -0.81 0.00 0.00 59.98 58.90 3b6g h ARG 71 Cb 0.57 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 3b6g h ARG 71 CO 0.04 0.98 0.25 -0.44 -1.51 0.00 0.00 179.97 179.29 3b6g h ASP 72 N 0.25 0.26 -0.53 -3.80 3.32 -0.69 -1.74 116.42 113.49 3b6g h ASP 72 Ca -0.04 -0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.68 3b6g h ASP 72 Cb 1.35 -0.06 -0.20 0.00 0.22 0.00 0.00 39.33 40.64 3b6g h ASP 72 CO 0.13 0.17 -0.11 0.59 -1.72 0.00 0.00 179.24 178.30 3b6g n ASN 73 N -4.48 3.66 0.00 6.45 3.02 -1.20 -4.97 115.26 117.73 3b6g n ASN 73 Ca 0.04 -3.79 0.00 0.00 -0.03 0.00 0.00 54.58 50.81 3b6g n ASN 73 Cb 0.23 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 3b6g n ASN 73 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3b6g n LYS 74 N -1.02 -0.32 -1.48 3.52 5.02 -0.65 -4.95 118.16 118.28 3b6g n LYS 74 Ca 0.40 0.06 -0.30 0.00 -2.02 0.00 0.00 58.31 56.45 3b6g n LYS 74 Cb 0.99 -3.80 0.11 0.00 -0.02 0.00 0.00 35.03 32.31 3b6g n LYS 74 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3b6g s LYS 75 N -0.89 1.75 0.00 1.97 -0.14 -0.60 -4.96 119.74 116.87 3b6g s LYS 75 Ca 0.00 0.61 0.00 0.00 -1.36 0.00 0.00 55.97 55.22 3b6g s LYS 75 Cb 0.00 -1.88 0.00 0.00 -1.68 0.00 0.00 37.83 34.27 3b6g s LYS 75 CO 0.00 -1.84 0.40 0.25 -0.76 0.00 0.00 175.35 173.39 3b6g n THR 76 N -3.58 0.00 -4.19 2.17 -2.24 -1.26 -3.77 114.28 101.41 3b6g n THR 76 Ca 0.07 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.58 3b6g n THR 76 Cb 0.57 1.08 -0.17 0.00 -2.10 0.00 0.00 70.33 69.71 3b6g n THR 76 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3b6g s ARG 77 N 0.00 1.79 0.49 -0.78 3.52 -1.26 -5.10 118.95 117.62 3b6g s ARG 77 Ca 0.00 -0.39 -0.24 0.00 -0.13 0.00 0.00 55.73 54.97 3b6g s ARG 77 Cb 0.00 -1.66 -0.07 0.00 -1.56 0.00 0.00 34.95 31.66 3b6g s ARG 77 CO 0.00 -0.15 1.42 0.42 -0.81 0.00 0.00 175.30 176.17 3b6g s ILE 78 N 1.29 2.01 0.33 4.11 1.01 -1.26 -5.02 121.20 123.66 3b6g s ILE 78 Ca -0.02 0.01 0.07 0.00 0.00 0.00 0.00 60.65 60.70 3b6g s ILE 78 Cb -0.14 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 3b6g s ILE 78 CO -0.04 0.00 0.27 0.27 0.00 0.00 0.00 174.94 175.44 3b6g s ILE 79 N -1.23 0.02 0.07 2.92 -5.25 -1.26 -5.05 121.20 111.42 3b6g s ILE 79 Ca 0.65 -2.00 -0.23 0.00 -0.99 0.00 0.00 60.65 58.08 3b6g s ILE 79 Cb -0.43 -2.49 -0.15 0.00 2.95 0.00 0.00 42.46 42.33 3b6g s ILE 79 CO 0.54 0.00 1.67 -0.65 -1.79 0.00 0.00 174.94 174.71 3b6g h PRO 80 N 2.14 0.01 -0.69 0.37 0.11 -1.90 -3.14 132.00 128.91 3b6g h PRO 80 Ca -0.26 -0.00 0.15 0.00 0.11 0.00 0.00 66.00 66.00 3b6g h PRO 80 Cb 1.23 -0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.23 3b6g h PRO 80 CO 0.38 0.08 0.05 -0.09 -0.21 0.00 0.00 178.00 178.21 3b6g h ARG 81 N -0.06 0.15 -0.89 1.05 9.65 -1.90 0.97 114.38 123.35 3b6g h ARG 81 Ca 0.00 -0.01 0.21 0.00 -1.10 0.00 0.00 59.98 59.09 3b6g h ARG 81 Cb 0.07 -0.03 -0.12 0.00 -1.39 0.00 0.00 29.97 28.50 3b6g h ARG 81 CO -0.00 0.10 0.39 0.45 2.80 0.00 0.00 179.97 183.71 3b6g h HIS 82 N 0.15 0.65 -0.80 2.20 3.86 -1.91 -1.80 115.15 117.50 3b6g h HIS 82 Ca 0.37 0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.59 3b6g h HIS 82 Cb 0.63 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.91 3b6g h HIS 82 CO -0.35 -0.03 0.37 -0.07 0.86 0.00 0.00 177.93 178.71 3b6g h LEU 83 N 0.42 1.06 -1.48 2.43 3.38 0.10 -0.94 115.31 120.28 3b6g h LEU 83 Ca 0.55 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.37 3b6g h LEU 83 Cb 1.02 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 3b6g h LEU 83 CO -0.51 0.90 0.15 -0.61 0.09 0.00 0.00 178.44 178.46 3b6g h GLN 84 N 1.15 0.50 0.37 1.13 5.75 -0.98 0.39 115.11 123.42 3b6g h GLN 84 Ca 0.28 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.70 3b6g h GLN 84 Cb 0.14 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 28.59 3b6g h GLN 84 CO -0.03 0.41 -0.18 -0.07 -2.65 0.00 0.00 178.83 176.31 3b6g h LEU 85 N 0.50 -0.42 0.00 -2.39 3.38 -0.86 -1.00 115.31 114.52 3b6g h LEU 85 Ca 0.13 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3b6g h LEU 85 Cb 0.09 0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3b6g h LEU 85 CO -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.50 3b6g n ALA 86 N -2.69 0.00 -0.34 1.53 0.00 -0.45 0.47 120.51 119.02 3b6g n ALA 86 Ca -0.06 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.40 3b6g n ALA 86 Cb 0.20 0.03 0.09 0.00 0.00 0.00 0.00 19.45 19.77 3b6g n ALA 86 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3b6g h VAL 87 N 0.00 0.04 0.00 0.00 2.07 -0.33 -2.18 116.25 115.85 3b6g h VAL 87 Ca 0.00 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.35 3b6g h VAL 87 Cb 0.00 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.79 3b6g h VAL 87 CO 0.00 0.00 -0.83 0.03 0.02 0.00 0.00 177.57 176.79 3b6g h ARG 88 N -0.01 0.00 -0.69 1.57 2.47 -0.33 -3.08 114.38 114.31 3b6g h ARG 88 Ca 0.41 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.13 3b6g h ARG 88 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.97 3b6g h ARG 88 CO -0.96 0.83 0.00 0.09 0.56 0.00 0.00 179.97 180.48 3b6g n ASN 89 N -3.53 1.43 -3.69 7.04 3.02 0.18 -4.81 115.26 114.90 3b6g n ASN 89 Ca -0.00 -2.11 -0.26 0.00 -0.03 0.00 0.00 54.58 52.18 3b6g n ASN 89 Cb 0.80 -0.40 -0.17 0.00 -0.61 0.00 0.00 39.78 39.40 3b6g n ASN 89 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3b6g s ASP 90 N -0.38 2.31 0.12 6.41 2.15 -1.16 -5.03 116.67 121.09 3b6g s ASP 90 Ca 0.09 -0.54 -0.24 0.00 0.43 0.00 0.00 52.55 52.29 3b6g s ASP 90 Cb 0.06 -0.39 -0.05 0.00 -0.30 0.00 0.00 42.92 42.23 3b6g s ASP 90 CO 0.03 -0.30 1.36 1.21 -0.17 0.00 0.00 175.17 177.31 3b6g n GLU 91 N 5.18 -0.33 0.14 4.34 2.13 -1.26 -1.77 120.64 129.06 3b6g n GLU 91 Ca -0.07 1.34 -0.09 0.00 0.66 0.00 0.00 57.16 59.00 3b6g n GLU 91 Cb 0.49 -1.98 -0.05 0.00 0.27 0.00 0.00 31.44 30.17 3b6g n GLU 91 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 3b6g h GLU 92 N 0.00 -0.42 -1.06 5.31 5.08 -1.97 -2.96 114.58 118.57 3b6g h GLU 92 Ca 0.12 0.03 0.42 0.00 -1.00 0.00 0.00 59.36 58.93 3b6g h GLU 92 Cb 0.31 0.09 -0.17 0.00 0.50 0.00 0.00 28.75 29.49 3b6g h GLU 92 CO -0.72 -0.18 0.59 -0.07 -1.00 0.00 0.00 179.01 177.64 3b6g h LEU 93 N -1.06 0.32 -0.50 1.33 3.38 -1.80 0.28 115.31 117.27 3b6g h LEU 93 Ca -0.04 0.24 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 3b6g h LEU 93 Cb 0.43 0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 3b6g h LEU 93 CO 0.07 -0.39 0.13 -1.13 0.09 0.00 0.00 178.44 177.22 3b6g h ASN 94 N 0.03 0.75 1.57 -0.43 -1.24 -1.19 0.40 115.58 115.47 3b6g h ASN 94 Ca 0.84 -0.23 -0.00 0.00 0.71 0.00 0.00 56.30 57.63 3b6g h ASN 94 Cb 2.28 -0.20 -0.00 0.00 0.73 0.00 0.00 38.32 41.14 3b6g h ASN 94 CO -0.71 0.78 -0.01 0.50 -1.29 0.00 0.00 177.43 176.70 3b6g h LYS 95 N 0.68 0.00 0.00 6.67 3.64 -0.47 -1.60 116.57 125.49 3b6g h LYS 95 Ca 0.16 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.42 3b6g h LYS 95 Cb 0.32 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3b6g h LYS 95 CO 0.00 0.01 -0.54 1.25 -2.27 0.00 0.00 179.45 177.90 3b6g h LEU 96 N 0.00 0.00 -5.04 5.20 5.85 0.37 -3.35 115.31 118.33 3b6g h LEU 96 Ca -0.00 0.00 -0.54 0.00 0.84 0.00 0.00 57.88 58.18 3b6g h LEU 96 Cb 0.80 0.00 -0.41 0.00 0.37 0.00 0.00 40.66 41.41 3b6g h LEU 96 CO 0.00 0.54 -0.85 0.18 -0.34 0.00 0.00 178.44 177.97 3b6g n LEU 97 N -3.48 3.55 0.19 2.25 4.77 0.13 -4.76 117.00 119.65 3b6g n LEU 97 Ca 0.00 -5.08 0.12 0.00 -0.03 0.00 0.00 56.01 51.03 3b6g n LEU 97 Cb 0.65 -0.18 0.13 0.00 -2.33 0.00 0.00 43.42 41.69 3b6g n LEU 97 CO 0.40 2.17 0.61 1.23 -1.33 0.00 0.00 177.39 180.47 3b6g h GLY 98 N 2.83 0.00 -0.24 -0.72 0.00 -1.47 -3.33 103.07 100.15 3b6g h GLY 98 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 3b6g h GLY 98 CO 0.73 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.81 3b6g n ARG 99 N -2.97 1.76 -3.50 4.80 5.12 -1.26 -5.01 116.66 115.59 3b6g n ARG 99 Ca 0.03 -2.46 -0.19 0.00 -1.93 0.00 0.00 57.85 53.30 3b6g n ARG 99 Cb 0.53 -1.47 -0.01 0.00 -1.16 0.00 0.00 32.46 30.35 3b6g n ARG 99 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3b6g s VAL 100 N -2.58 3.74 -0.20 1.55 1.01 -1.25 -5.11 120.40 117.56 3b6g s VAL 100 Ca 0.29 -1.10 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 3b6g s VAL 100 Cb 0.25 -3.28 0.09 0.00 0.00 0.00 0.00 36.38 33.43 3b6g s VAL 100 CO 0.04 -0.13 0.22 -0.89 0.00 0.00 0.00 175.10 174.33 3b6g s THR 101 N -2.24 -0.32 -0.44 3.92 2.01 -1.26 -5.08 115.64 112.23 3b6g s THR 101 Ca 0.45 -0.10 -0.26 0.00 0.31 0.00 0.00 61.69 62.10 3b6g s THR 101 Cb -0.08 -0.67 0.03 0.00 0.01 0.00 0.00 72.50 71.79 3b6g s THR 101 CO 0.30 -0.19 0.94 -0.63 -0.69 0.00 0.00 174.62 174.34 3b6g s ILE 102 N 2.32 4.48 -0.96 1.82 1.09 -1.26 -4.93 121.20 123.77 3b6g s ILE 102 Ca 0.07 0.85 -0.25 0.00 -1.10 0.00 0.00 60.65 60.22 3b6g s ILE 102 Cb -0.16 -4.42 -0.08 0.00 -1.06 0.00 0.00 42.46 36.73 3b6g s ILE 102 CO -0.12 -0.79 2.04 0.00 -0.10 0.00 0.00 174.94 175.97 3b6g s ALA 103 N 3.74 1.43 0.00 9.38 0.00 -1.26 -1.08 121.76 133.97 3b6g s ALA 103 Ca 0.38 -1.52 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3b6g s ALA 103 Cb -0.10 -4.60 0.00 0.00 0.00 0.00 0.00 23.12 18.42 3b6g s ALA 103 CO 0.25 -5.26 0.00 1.04 0.00 0.00 0.00 175.76 171.79 3b6g n GLN 104 N 8.68 0.00 -2.01 0.00 1.13 -1.26 -4.89 117.38 119.02 3b6g n GLN 104 Ca 0.42 0.00 -0.28 0.00 -1.94 0.00 0.00 57.00 55.21 3b6g n GLN 104 Cb 0.46 -0.70 0.03 0.00 0.11 0.00 0.00 30.24 30.13 3b6g n GLN 104 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3b6g n GLY 105 N -0.14 6.16 1.18 1.08 0.00 -0.24 -3.93 105.19 109.30 3b6g n GLY 105 Ca 0.00 -2.62 0.00 0.00 0.00 0.00 0.00 46.02 43.40 3b6g n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b6g n GLY 106 N -0.68 0.43 3.63 -0.02 0.00 -1.26 -4.73 105.19 102.56 3b6g n GLY 106 Ca 0.47 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.36 3b6g n GLY 106 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3b6g s VAL 107 N 0.00 0.00 -0.22 1.61 -7.23 -1.26 -5.02 120.40 108.28 3b6g s VAL 107 Ca 0.00 0.00 -0.41 0.00 -1.81 0.00 0.00 61.98 59.76 3b6g s VAL 107 Cb 0.00 -1.00 -0.17 0.00 0.56 0.00 0.00 36.38 35.77 3b6g s VAL 107 CO 0.00 0.00 1.60 0.18 -0.31 0.00 0.00 175.10 176.57 3b6g n LEU 108 N 2.95 1.91 -4.66 1.32 4.77 -1.26 -4.86 117.00 117.17 3b6g n LEU 108 Ca -0.15 1.11 -0.44 0.00 -0.03 0.00 0.00 56.01 56.50 3b6g n LEU 108 Cb 0.56 -1.10 -0.02 0.00 -2.33 0.00 0.00 43.42 40.54 3b6g n LEU 108 CO 0.02 -0.71 0.85 -2.65 -1.33 0.00 0.00 177.39 173.58 3b6g n PRO 109 N 4.35 1.89 -3.65 3.23 -0.02 -1.26 -4.96 135.00 134.59 3b6g n PRO 109 Ca 0.25 0.67 0.01 0.00 -2.02 0.00 0.00 63.50 62.41 3b6g n PRO 109 Cb 0.11 -2.22 -0.06 0.00 -0.02 0.00 0.00 33.50 31.31 3b6g n PRO 109 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3b6g s ASN 110 N -0.18 -0.19 -0.04 2.55 2.47 -1.26 -5.16 114.94 113.14 3b6g s ASN 110 Ca 0.61 0.30 -0.01 0.00 0.42 0.00 0.00 52.86 54.17 3b6g s ASN 110 Cb -0.63 1.08 0.03 0.00 -1.45 0.00 0.00 41.25 40.28 3b6g s ASN 110 CO 0.58 -0.05 0.07 -0.63 -3.72 0.00 0.00 177.10 173.35 3b6g s ILE 111 N 1.13 -0.07 0.84 -5.21 1.01 -1.26 -5.15 121.20 112.48 3b6g s ILE 111 Ca -0.08 0.24 -0.10 0.00 0.00 0.00 0.00 60.65 60.71 3b6g s ILE 111 Cb -0.03 -0.14 0.10 0.00 0.01 0.00 0.00 42.46 42.41 3b6g s ILE 111 CO -0.11 0.10 1.12 -1.10 0.00 0.00 0.00 174.94 174.95 3b6g s GLN 112 N 1.30 1.67 -0.01 2.79 -1.52 -1.26 -5.00 119.66 117.62 3b6g s GLN 112 Ca -0.07 1.37 -0.22 0.00 -1.95 0.00 0.00 55.36 54.49 3b6g s GLN 112 Cb -0.12 -1.82 -0.12 0.00 -0.22 0.00 0.00 33.01 30.73 3b6g s GLN 112 CO -0.04 -2.12 0.91 0.77 -0.25 0.00 0.00 175.29 174.56 3b6g h SER 113 N -1.45 -0.59 0.00 5.90 0.02 -2.01 -3.19 113.55 112.22 3b6g h SER 113 Ca -0.43 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 3b6g h SER 113 Cb 1.25 0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.94 3b6g h SER 113 CO 0.47 -0.18 0.00 1.33 -1.14 0.00 0.00 176.83 177.30 3b6g n VAL 114 N -5.25 0.04 -1.11 2.27 0.24 -1.26 -1.18 118.33 112.09 3b6g n VAL 114 Ca -0.09 0.01 -0.09 0.00 -2.04 0.00 0.00 64.34 62.13 3b6g n VAL 114 Cb 0.29 -0.99 0.27 0.00 -1.47 0.00 0.00 33.84 31.95 3b6g n VAL 114 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3b6g n LEU 115 N -1.01 6.08 -4.38 1.34 4.77 -1.21 -4.93 117.00 117.66 3b6g n LEU 115 Ca 0.01 -3.33 -0.32 0.00 -0.03 0.00 0.00 56.01 52.34 3b6g n LEU 115 Cb 0.01 -0.75 -0.15 0.00 -2.33 0.00 0.00 43.42 40.19 3b6g n LEU 115 CO 0.01 0.88 -0.50 -0.76 -1.33 0.00 0.00 177.39 175.69 3b6g s LEU 116 N -3.07 2.43 -0.26 2.23 1.43 -0.32 -4.98 118.68 116.13 3b6g s LEU 116 Ca 0.55 -0.35 -0.19 0.00 -1.03 0.00 0.00 54.13 53.11 3b6g s LEU 116 Cb 0.45 -1.48 -0.02 0.00 0.03 0.00 0.00 46.19 45.17 3b6g s LEU 116 CO 0.12 0.29 0.58 -2.16 0.23 0.00 0.00 176.35 175.41 3b6g s PRO 117 N -0.40 4.09 0.00 1.29 0.04 -1.26 -5.02 135.00 133.74 3b6g s PRO 117 Ca 0.04 0.45 0.00 0.00 0.04 0.00 0.00 61.00 61.53 3b6g s PRO 117 Cb -0.12 -3.65 0.00 0.00 0.04 0.00 0.00 34.50 30.77 3b6g s PRO 117 CO 0.02 -0.38 0.00 1.63 0.04 0.00 0.00 177.00 178.30 3b6g n LYS 118 N 5.63 0.00 -3.22 4.56 4.76 -1.26 -4.91 118.16 123.71 3b6g n LYS 118 Ca -0.02 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.20 3b6g n LYS 118 Cb 0.49 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.68 3b6g n LYS 118 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 3b6g n LYS 119 N 0.00 -3.43 0.00 1.97 3.00 -1.26 -5.30 118.16 113.14 3b6g n LYS 119 Ca 0.00 0.53 0.00 0.00 -0.00 0.00 0.00 58.31 58.84 3b6g n LYS 119 Cb 0.00 -5.24 0.00 0.00 0.00 0.00 0.00 35.03 29.79 3b6g n LYS 119 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03