#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mr6 s GLN 2 N 0.00 2.49 -0.45 0.03 -0.21 -1.26 0.16 119.66 120.42 1mr6 s GLN 2 Ca 0.00 -1.18 0.05 0.00 0.02 0.00 0.00 55.36 54.25 1mr6 s GLN 2 Cb 0.00 -2.83 0.18 0.00 1.00 0.00 0.00 33.01 31.35 1mr6 s GLN 2 CO 0.00 -0.47 0.53 0.00 -2.12 0.00 0.00 175.29 173.24 1mr6 n LYS 4 N 3.32 0.03 -3.04 0.00 4.76 -1.17 -4.59 118.16 117.47 1mr6 n LYS 4 Ca 0.19 0.01 -0.16 0.00 -2.87 0.00 0.00 58.31 55.49 1mr6 n LYS 4 Cb 0.51 -1.07 -0.01 0.00 -1.84 0.00 0.00 35.03 32.62 1mr6 n LYS 4 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1mr6 n THR 5 N -1.92 0.19 0.00 -0.18 -2.24 -1.15 -4.19 114.28 104.79 1mr6 n THR 5 Ca 0.05 -4.18 0.00 0.00 -2.27 0.00 0.00 64.05 57.65 1mr6 n THR 5 Cb 0.50 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 1mr6 n THR 5 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mr6 n SER 7 N -1.74 0.00 0.07 0.00 3.41 -1.23 -4.51 113.62 109.62 1mr6 n SER 7 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.67 1mr6 n SER 7 Cb 0.00 0.00 0.30 0.00 -0.26 0.00 0.00 64.21 64.25 1mr6 n SER 7 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1mr6 n PHE 8 N 0.00 0.35 1.50 7.33 -0.00 -1.26 0.31 117.46 125.69 1mr6 n PHE 8 Ca 0.00 0.17 0.06 0.00 -0.00 0.00 0.00 57.45 57.68 1mr6 n PHE 8 Cb 0.00 -0.77 0.34 0.00 -0.00 0.00 0.00 39.48 39.05 1mr6 n PHE 8 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.76 179.24 1mr6 n TYR 9 N -1.85 0.00 0.00 -5.13 0.18 -1.26 -3.82 117.16 105.28 1mr6 n TYR 9 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1mr6 n TYR 9 Cb 0.05 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.01 1mr6 n TYR 9 CO 0.00 0.00 0.00 -2.37 -2.08 0.00 0.00 176.86 172.41 1mr6 n THR 10 N -0.74 0.00 -3.58 -3.48 5.66 0.21 -5.08 114.28 107.27 1mr6 n THR 10 Ca 0.09 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.81 1mr6 n THR 10 Cb 0.04 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 68.71 1mr6 n THR 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1mr6 n PRO 12 N 2.86 0.20 -1.16 0.00 -0.04 -1.26 -4.63 135.00 130.97 1mr6 n PRO 12 Ca 0.22 0.01 -0.24 0.00 -0.04 0.00 0.00 63.50 63.45 1mr6 n PRO 12 Cb 0.41 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.56 1mr6 n PRO 12 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1mr6 n ASN 13 N -1.40 -0.97 -3.84 3.54 4.13 -1.26 -5.09 115.26 110.37 1mr6 n ASN 13 Ca 0.10 -1.20 -0.11 0.00 1.68 0.00 0.00 54.58 55.06 1mr6 n ASN 13 Cb 0.29 -0.81 -0.09 0.00 -1.54 0.00 0.00 39.78 37.63 1mr6 n ASN 13 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1mr6 s SER 14 N -4.36 0.02 -0.18 6.41 1.04 -1.26 -4.89 113.70 110.48 1mr6 s SER 14 Ca 0.59 -0.33 -0.27 0.00 0.48 0.00 0.00 55.95 56.42 1mr6 s SER 14 Cb -0.04 0.28 0.08 0.00 0.10 0.00 0.00 66.02 66.44 1mr6 s SER 14 CO 0.43 -0.53 0.74 -0.70 0.98 0.00 0.00 173.24 174.16 1mr6 s GLU 15 N -2.37 0.88 0.00 4.02 2.12 -1.26 -4.96 118.70 117.13 1mr6 s GLU 15 Ca -0.07 0.66 0.00 0.00 0.36 0.00 0.00 54.97 55.92 1mr6 s GLU 15 Cb -0.02 0.42 0.00 0.00 0.26 0.00 0.00 34.13 34.79 1mr6 s GLU 15 CO -0.03 -0.19 0.00 2.41 -0.54 0.00 0.00 175.26 176.92 1mr6 n THR 16 N 1.90 0.00 -4.28 -1.70 -1.04 -1.26 -1.74 114.28 106.16 1mr6 n THR 16 Ca -0.16 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.64 1mr6 n THR 16 Cb 0.56 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 68.95 1mr6 n THR 16 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mr6 s PRO 18 N -2.31 1.93 0.09 0.00 0.04 -1.26 -4.74 135.00 128.76 1mr6 s PRO 18 Ca 0.09 0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.36 1mr6 s PRO 18 Cb -0.08 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1mr6 s PRO 18 CO 0.05 -1.64 0.00 -0.40 0.04 0.00 0.00 177.00 175.04 1mr6 n ASP 19 N -3.37 -0.15 -2.82 6.66 5.68 -1.26 -2.69 116.55 118.61 1mr6 n ASP 19 Ca 0.07 0.00 -0.31 0.00 -0.50 0.00 0.00 54.79 54.05 1mr6 n ASP 19 Cb 0.60 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.54 1mr6 n ASP 19 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1mr6 n GLY 20 N 0.00 4.63 0.00 6.12 0.00 -1.26 -4.89 105.19 109.78 1mr6 n GLY 20 Ca 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1mr6 n GLY 20 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1mr6 n LYS 21 N 1.17 0.27 0.00 1.61 3.00 -1.09 -4.95 118.16 118.17 1mr6 n LYS 21 Ca 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.84 1mr6 n LYS 21 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.48 1mr6 n LYS 21 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1mr6 n ASN 22 N -1.96 0.00 -3.99 3.14 3.02 -1.19 -3.17 115.26 111.12 1mr6 n ASN 22 Ca 0.00 -0.54 -0.10 0.00 -0.03 0.00 0.00 54.58 53.91 1mr6 n ASN 22 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1mr6 n ASN 22 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1mr6 s ILE 23 N 0.00 0.00 0.14 2.41 1.01 0.99 -4.57 121.20 121.18 1mr6 s ILE 23 Ca 0.00 -1.59 0.04 0.00 0.00 0.00 0.00 60.65 59.10 1mr6 s ILE 23 Cb 0.00 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 1mr6 s ILE 23 CO 0.00 0.00 0.15 0.00 0.00 0.00 0.00 174.94 175.09 1mr6 s VAL 25 N -1.67 0.08 0.22 0.00 -7.23 -0.46 -2.41 120.40 108.92 1mr6 s VAL 25 Ca 0.31 -0.62 -0.20 0.00 -1.81 0.00 0.00 61.98 59.66 1mr6 s VAL 25 Cb -0.11 -1.06 0.04 0.00 0.56 0.00 0.00 36.38 35.81 1mr6 s VAL 25 CO 0.24 -0.34 0.62 -0.75 -0.31 0.00 0.00 175.10 174.56 1mr6 s LYS 26 N -3.05 1.51 -0.01 4.82 2.20 0.25 -2.42 119.74 123.04 1mr6 s LYS 26 Ca -0.02 -0.80 -0.09 0.00 -0.36 0.00 0.00 55.97 54.70 1mr6 s LYS 26 Cb 0.01 0.57 0.01 0.00 -1.51 0.00 0.00 37.83 36.91 1mr6 s LYS 26 CO -0.07 -0.67 0.18 1.03 -0.36 0.00 0.00 175.35 175.47 1mr6 s ARG 27 N -3.86 0.51 -0.17 4.03 0.52 -0.68 -0.97 118.95 118.33 1mr6 s ARG 27 Ca 0.08 -0.30 -0.04 0.00 -0.52 0.00 0.00 55.73 54.95 1mr6 s ARG 27 Cb -0.03 0.22 0.08 0.00 0.52 0.00 0.00 34.95 35.74 1mr6 s ARG 27 CO -0.02 -0.12 0.26 -1.54 0.02 0.00 0.00 175.30 173.90 1mr6 s SER 28 N -1.25 0.68 0.10 0.23 1.04 -0.80 -2.23 113.70 111.46 1mr6 s SER 28 Ca -0.13 0.29 0.03 0.00 0.48 0.00 0.00 55.95 56.61 1mr6 s SER 28 Cb -0.07 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 1mr6 s SER 28 CO 0.02 -0.27 -0.08 -1.66 0.98 0.00 0.00 173.24 172.22 1mr6 s TRP 29 N 2.40 0.96 0.60 5.02 -2.14 -0.55 -2.90 118.94 122.34 1mr6 s TRP 29 Ca 0.04 -0.77 -0.13 0.00 2.66 0.00 0.00 56.10 57.90 1mr6 s TRP 29 Cb -0.14 -0.54 -0.04 0.00 -3.10 0.00 0.00 33.47 29.66 1mr6 s TRP 29 CO -0.10 -0.07 1.03 -0.08 -2.66 0.00 0.00 176.95 175.06 1mr6 s THR 30 N -2.98 4.41 -0.07 0.66 -1.32 -1.26 0.67 115.64 115.75 1mr6 s THR 30 Ca 0.08 0.94 0.00 0.00 -1.21 0.00 0.00 61.69 61.49 1mr6 s THR 30 Cb 0.01 -3.67 0.00 0.00 -1.51 0.00 0.00 72.50 67.32 1mr6 s THR 30 CO -0.02 -0.87 0.00 0.00 -2.21 0.00 0.00 174.62 171.51 1mr6 n ALA 31 N -2.38 0.00 -1.44 11.08 0.00 -0.65 -4.72 120.51 122.41 1mr6 n ALA 31 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.18 1mr6 n ALA 31 Cb 0.54 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.05 1mr6 n ALA 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1mr6 s VAL 32 N -4.00 3.14 0.00 0.00 -7.23 -1.26 -4.89 120.40 106.16 1mr6 s VAL 32 Ca 0.00 0.50 0.00 0.00 -1.81 0.00 0.00 61.98 60.67 1mr6 s VAL 32 Cb 0.00 -3.01 0.00 0.00 0.56 0.00 0.00 36.38 33.93 1mr6 s VAL 32 CO 0.00 -0.36 0.48 -2.11 -0.31 0.00 0.00 175.10 172.81 1mr6 n ARG 33 N -2.67 0.00 0.28 4.82 0.00 -1.26 -4.65 116.66 113.17 1mr6 n ARG 33 Ca 0.10 -0.47 0.16 0.00 -0.00 0.00 0.00 57.85 57.64 1mr6 n ARG 33 Cb 0.52 -0.42 0.76 0.00 -0.00 0.00 0.00 32.46 33.31 1mr6 n ARG 33 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1mr6 h GLY 34 N 0.00 0.00 -0.26 2.89 0.00 -1.92 -2.98 103.07 100.80 1mr6 h GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1mr6 h GLY 34 CO 0.00 0.00 -0.13 1.22 0.00 0.00 0.00 176.54 177.63 1mr6 n ASP 35 N -3.30 1.12 -0.48 0.19 8.00 -1.26 -5.08 116.55 115.73 1mr6 n ASP 35 Ca -0.01 -2.06 0.00 0.00 0.71 0.00 0.00 54.79 53.43 1mr6 n ASP 35 Cb 0.26 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.20 1mr6 n ASP 35 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mr6 n GLY 36 N -0.51 1.92 0.00 0.44 0.00 -1.13 -5.17 105.19 100.74 1mr6 n GLY 36 Ca 0.04 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1mr6 n GLY 36 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mr6 n PRO 37 N 0.00 0.09 -0.06 1.61 -0.04 -1.26 -4.50 135.00 130.84 1mr6 n PRO 37 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1mr6 n PRO 37 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 1mr6 n PRO 37 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1mr6 h LYS 38 N 0.00 0.00 -5.77 0.54 1.57 -1.90 -3.35 116.57 107.66 1mr6 h LYS 38 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1mr6 h LYS 38 Cb 0.00 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.19 1mr6 h LYS 38 CO 0.00 0.06 0.70 0.50 -0.57 0.00 0.00 179.45 180.14 1mr6 s ARG 39 N -1.85 3.16 0.42 3.15 3.52 -1.26 -1.63 118.95 124.47 1mr6 s ARG 39 Ca -0.07 -0.59 -0.25 0.00 -0.13 0.00 0.00 55.73 54.69 1mr6 s ARG 39 Cb 0.01 -4.19 -0.08 0.00 -1.56 0.00 0.00 34.95 29.12 1mr6 s ARG 39 CO 0.12 -1.88 1.30 -1.21 -0.81 0.00 0.00 175.30 172.82 1mr6 s GLU 40 N 4.55 3.87 0.36 5.12 0.41 0.21 -4.60 118.70 128.62 1mr6 s GLU 40 Ca 0.27 2.14 0.04 0.00 -0.41 0.00 0.00 54.97 57.00 1mr6 s GLU 40 Cb -0.14 -2.68 -0.04 0.00 -1.78 0.00 0.00 34.13 29.50 1mr6 s GLU 40 CO 0.13 -0.57 0.12 0.96 -0.49 0.00 0.00 175.26 175.40 1mr6 s ILE 41 N -1.29 0.69 0.15 -1.63 -4.36 -1.26 -1.48 121.20 112.02 1mr6 s ILE 41 Ca 0.59 -2.00 -0.25 0.00 -0.26 0.00 0.00 60.65 58.73 1mr6 s ILE 41 Cb -0.38 -2.50 0.06 0.00 1.25 0.00 0.00 42.46 40.90 1mr6 s ILE 41 CO 0.48 0.00 0.82 -0.60 0.24 0.00 0.00 174.94 175.87 1mr6 s ARG 42 N -3.79 1.27 0.27 0.37 6.06 -0.95 -4.93 118.95 117.25 1mr6 s ARG 42 Ca 0.30 -0.62 0.03 0.00 -2.50 0.00 0.00 55.73 52.94 1mr6 s ARG 42 Cb 0.05 0.48 -0.03 0.00 0.06 0.00 0.00 34.95 35.51 1mr6 s ARG 42 CO 0.15 -0.57 0.22 1.03 -2.50 0.00 0.00 175.30 173.63 1mr6 s ARG 43 N -3.49 1.50 0.00 5.12 3.00 -1.26 -1.68 118.95 122.14 1mr6 s ARG 43 Ca 0.08 -1.82 0.00 0.00 0.00 0.00 0.00 55.73 53.99 1mr6 s ARG 43 Cb -0.02 0.31 0.00 0.00 0.00 0.00 0.00 34.95 35.23 1mr6 s ARG 43 CO -0.02 -0.53 0.00 -1.91 0.00 0.00 0.00 175.30 172.84 1mr6 n GLU 44 N -0.45 0.00 -4.41 3.54 2.13 -1.01 -4.81 120.64 115.62 1mr6 n GLU 44 Ca 0.05 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.52 1mr6 n GLU 44 Cb 0.64 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 32.25 1mr6 n GLU 44 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1mr6 n ALA 46 N 2.59 0.00 0.06 0.00 0.00 -1.05 -4.90 120.51 117.21 1mr6 n ALA 46 Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.04 1mr6 n ALA 46 Cb 0.53 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.83 1mr6 n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mr6 h ALA 47 N 2.00 0.06 0.00 0.00 0.00 -1.91 0.28 119.26 119.69 1mr6 h ALA 47 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1mr6 h ALA 47 Cb 0.00 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1mr6 h ALA 47 CO 0.00 0.77 0.00 0.25 0.00 0.00 0.00 179.25 180.27 1mr6 n THR 48 N -3.84 0.50 -3.75 0.00 -2.24 -1.26 -4.61 114.28 99.07 1mr6 n THR 48 Ca -0.22 0.17 -0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1mr6 n THR 48 Cb 0.97 -1.03 0.01 0.00 -2.10 0.00 0.00 70.33 68.17 1mr6 n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mr6 s PRO 50 N -2.02 -2.73 0.00 0.00 0.04 -1.26 -4.81 135.00 124.22 1mr6 s PRO 50 Ca 0.12 0.29 0.13 0.00 0.04 0.00 0.00 61.00 61.58 1mr6 s PRO 50 Cb -0.01 -1.39 0.76 0.00 0.04 0.00 0.00 34.50 33.91 1mr6 s PRO 50 CO 0.01 -4.78 1.22 -0.35 0.04 0.00 0.00 177.00 173.14 1mr6 n PRO 51 N -5.59 0.38 -0.29 0.56 -0.04 -1.26 -4.78 135.00 123.99 1mr6 n PRO 51 Ca 0.10 0.02 -0.30 0.00 -0.04 0.00 0.00 63.50 63.28 1mr6 n PRO 51 Cb 0.59 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.84 1mr6 n PRO 51 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1mr6 n SER 52 N -1.03 -3.59 0.00 3.54 7.64 -1.26 -4.98 113.62 113.94 1mr6 n SER 52 Ca 0.09 -0.70 0.00 0.00 1.01 0.00 0.00 58.87 59.28 1mr6 n SER 52 Cb 0.05 -1.08 0.00 0.00 -1.01 0.00 0.00 64.21 62.18 1mr6 n SER 52 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1mr6 n LYS 53 N -5.65 0.00 0.00 1.43 4.76 -1.26 -5.02 118.16 112.41 1mr6 n LYS 53 Ca 0.11 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 1mr6 n LYS 53 Cb 0.59 -0.59 0.00 0.00 -1.84 0.00 0.00 35.03 33.18 1mr6 n LYS 53 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1mr6 n LEU 54 N -2.70 0.00 0.08 -0.35 -0.00 -1.26 -4.92 117.00 107.84 1mr6 n LEU 54 Ca 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 56.01 56.19 1mr6 n LEU 54 Cb 0.41 0.00 0.71 0.00 -0.00 0.00 0.00 43.42 44.54 1mr6 n LEU 54 CO 0.00 0.00 1.16 1.23 -0.00 0.00 0.00 177.39 179.78 1mr6 h GLY 55 N 0.00 0.00 -2.35 -3.96 0.00 -2.02 -3.38 103.07 91.36 1mr6 h GLY 55 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.90 1mr6 h GLY 55 CO 0.00 0.00 -0.26 -2.27 0.00 0.00 0.00 176.54 174.01 1mr6 s LEU 56 N -8.56 3.58 -0.75 3.11 1.98 -1.26 -5.04 118.68 111.75 1mr6 s LEU 56 Ca -0.05 -0.49 -0.18 0.00 -2.89 0.00 0.00 54.13 50.52 1mr6 s LEU 56 Cb 0.18 -2.51 0.13 0.00 0.66 0.00 0.00 46.19 44.65 1mr6 s LEU 56 CO 0.68 -0.80 0.87 -0.89 -1.89 0.00 0.00 176.35 174.33 1mr6 s THR 57 N -2.39 4.89 0.40 3.68 2.01 -1.14 -4.88 115.64 118.21 1mr6 s THR 57 Ca 0.55 -1.38 -0.17 0.00 0.31 0.00 0.00 61.69 61.00 1mr6 s THR 57 Cb -0.09 -4.59 -0.09 0.00 0.01 0.00 0.00 72.50 67.73 1mr6 s THR 57 CO 0.33 -1.26 0.85 -0.69 -0.69 0.00 0.00 174.62 173.16 1mr6 s VAL 58 N 2.36 4.57 -0.17 3.82 1.01 -1.26 -1.90 120.40 128.84 1mr6 s VAL 58 Ca 0.20 1.14 -0.04 0.00 0.00 0.00 0.00 61.98 63.27 1mr6 s VAL 58 Cb -0.15 -3.64 0.08 0.00 0.00 0.00 0.00 36.38 32.67 1mr6 s VAL 58 CO -0.01 -0.36 0.26 0.12 0.00 0.00 0.00 175.10 175.12 1mr6 s PHE 59 N -2.21 -0.43 0.42 5.22 2.19 -0.15 -4.88 117.98 118.15 1mr6 s PHE 59 Ca 0.57 0.73 0.01 0.00 0.33 0.00 0.00 56.93 58.57 1mr6 s PHE 59 Cb -0.10 -0.13 0.01 0.00 -1.31 0.00 0.00 43.02 41.50 1mr6 s PHE 59 CO 0.20 -0.47 0.09 0.00 1.83 0.00 0.00 175.22 176.86 1mr6 n THR 62 N -0.17 0.08 0.00 0.00 -2.24 -1.26 -1.34 114.28 109.35 1mr6 n THR 62 Ca -0.01 -3.23 0.00 0.00 -2.27 0.00 0.00 64.05 58.54 1mr6 n THR 62 Cb 0.59 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 1mr6 n THR 62 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1mr6 n THR 63 N 0.16 0.00 0.00 4.28 5.66 -1.26 -5.08 114.28 118.04 1mr6 n THR 63 Ca 0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.15 1mr6 n THR 63 Cb 0.71 -0.54 0.00 0.00 -1.55 0.00 0.00 70.33 68.95 1mr6 n THR 63 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1mr6 n ASP 64 N -2.34 0.00 -3.79 1.09 5.68 -1.25 -4.93 116.55 111.01 1mr6 n ASP 64 Ca 0.00 0.00 -0.23 0.00 -0.50 0.00 0.00 54.79 54.06 1mr6 n ASP 64 Cb 0.34 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.25 1mr6 n ASP 64 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1mr6 n ASN 65 N 0.00 0.51 0.00 -1.12 0.23 0.12 -4.87 115.26 110.14 1mr6 n ASN 65 Ca 0.00 -0.91 0.00 0.00 -0.53 0.00 0.00 54.58 53.14 1mr6 n ASN 65 Cb 0.00 -1.14 0.00 0.00 -2.08 0.00 0.00 39.78 36.56 1mr6 n ASN 65 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1mr6 s ASN 67 N -1.84 6.20 0.00 0.00 0.02 -1.26 -4.89 114.94 113.17 1mr6 s ASN 67 Ca 0.00 -0.84 0.00 0.00 -1.02 0.00 0.00 52.86 51.00 1mr6 s ASN 67 Cb 0.00 -2.56 0.00 0.00 0.02 0.00 0.00 41.25 38.71 1mr6 s ASN 67 CO 0.00 -1.78 0.48 1.41 0.02 0.00 0.00 177.10 177.23