#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 2.32 0.42 0.03 -0.21 -1.26 0.53 119.66 121.49 1mr6 s GLN 2 Ca 0.00 -1.22 0.04 0.00 0.02 0.00 0.00 55.36 54.20 1mr6 s GLN 2 Cb 0.00 -2.80 -0.01 0.00 1.00 0.00 0.00 33.01 31.20 1mr6 s GLN 2 CO 0.00 -0.51 0.13 0.00 -2.12 0.00 0.00 175.29 172.80 1mr6 s LYS 4 N -3.60 2.39 -0.27 0.00 1.02 -1.26 -3.51 119.74 114.51 1mr6 s LYS 4 Ca 0.19 -1.27 0.22 0.00 0.02 0.00 0.00 55.97 55.12 1mr6 s LYS 4 Cb 0.01 -3.07 0.50 0.00 -0.52 0.00 0.00 37.83 34.74 1mr6 s LYS 4 CO 0.13 -0.59 1.10 0.25 -0.92 0.00 0.00 175.35 175.32 1mr6 n THR 5 N 4.56 1.19 -0.74 2.17 -2.24 -1.26 -4.32 114.28 113.64 1mr6 n THR 5 Ca -0.14 -2.88 -0.30 0.00 -2.27 0.00 0.00 64.05 58.46 1mr6 n THR 5 Cb 0.43 1.20 0.18 0.00 -2.10 0.00 0.00 70.33 70.04 1mr6 n THR 5 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mr6 h SER 7 N -1.94 0.00 -4.36 0.00 4.64 -1.98 -3.43 113.55 106.49 1mr6 h SER 7 Ca -0.47 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.39 1mr6 h SER 7 Cb 1.28 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 63.49 1mr6 h SER 7 CO 0.45 0.11 0.36 -0.36 -0.87 0.00 0.00 176.83 176.52 1mr6 s PHE 8 N -4.78 2.50 -0.36 4.77 0.08 -1.26 -4.93 117.98 113.99 1mr6 s PHE 8 Ca -0.04 0.71 0.03 0.00 0.12 0.00 0.00 56.93 57.74 1mr6 s PHE 8 Cb 0.16 -3.56 0.52 0.00 -0.57 0.00 0.00 43.02 39.57 1mr6 s PHE 8 CO 0.68 -2.19 1.74 2.48 -0.10 0.00 0.00 175.22 177.83 1mr6 n TYR 9 N -3.59 2.43 -3.15 0.36 4.11 -1.26 -4.69 117.16 111.36 1mr6 n TYR 9 Ca 0.09 -1.62 0.06 0.00 -0.00 0.00 0.00 57.90 56.43 1mr6 n TYR 9 Cb 0.60 -0.82 -0.00 0.00 -0.00 0.00 0.00 39.34 39.11 1mr6 n TYR 9 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.86 176.78 1mr6 s THR 10 N -2.66 -0.07 -0.41 -3.48 -1.32 -1.25 -4.94 115.64 101.51 1mr6 s THR 10 Ca 0.45 0.00 -0.20 0.00 -1.21 0.00 0.00 61.69 60.73 1mr6 s THR 10 Cb 0.38 -0.21 0.02 0.00 -1.51 0.00 0.00 72.50 71.17 1mr6 s THR 10 CO 0.08 0.00 0.61 0.00 -2.21 0.00 0.00 174.62 173.10 1mr6 h PRO 12 N 8.75 0.00 0.00 0.00 0.13 -2.00 -3.42 132.00 135.46 1mr6 h PRO 12 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1mr6 h PRO 12 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1mr6 h PRO 12 CO 0.86 0.00 0.00 -1.71 -0.23 0.00 0.00 178.00 176.92 1mr6 n ASN 13 N -3.10 0.00 0.00 1.44 5.15 -1.26 -5.14 115.26 112.35 1mr6 n ASN 13 Ca 0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.01 1mr6 n ASN 13 Cb 0.43 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.68 1mr6 n ASN 13 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1mr6 n SER 14 N 0.00 0.00 -3.63 1.20 3.41 -1.26 -5.10 113.62 108.24 1mr6 n SER 14 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.32 1mr6 n SER 14 Cb 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 1mr6 n SER 14 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1mr6 s GLU 15 N -2.00 1.01 -0.50 4.33 2.12 -1.23 -5.07 118.70 117.36 1mr6 s GLU 15 Ca 0.00 -1.73 -0.28 0.00 0.36 0.00 0.00 54.97 53.33 1mr6 s GLU 15 Cb 0.00 -1.97 -0.01 0.00 0.26 0.00 0.00 34.13 32.42 1mr6 s GLU 15 CO 0.00 -1.17 1.66 0.99 -0.54 0.00 0.00 175.26 176.20 1mr6 s THR 16 N 0.66 3.58 1.00 -1.70 2.01 -1.26 -2.61 115.64 117.31 1mr6 s THR 16 Ca 0.17 0.50 -0.17 0.00 0.31 0.00 0.00 61.69 62.49 1mr6 s THR 16 Cb -0.24 -4.04 -0.05 0.00 0.01 0.00 0.00 72.50 68.18 1mr6 s THR 16 CO -0.00 -0.84 -0.38 0.00 -0.69 0.00 0.00 174.62 172.71 1mr6 s PRO 18 N -2.78 -0.86 -1.42 0.00 0.04 -1.26 -4.09 135.00 124.63 1mr6 s PRO 18 Ca 0.48 -0.21 -0.11 0.00 0.04 0.00 0.00 61.00 61.20 1mr6 s PRO 18 Cb -0.14 -1.65 0.06 0.00 0.04 0.00 0.00 34.50 32.81 1mr6 s PRO 18 CO 0.73 -3.45 2.27 -0.40 0.04 0.00 0.00 177.00 176.19 1mr6 n ASP 19 N -4.54 5.49 0.00 6.66 5.68 -1.26 -2.01 116.55 126.56 1mr6 n ASP 19 Ca 0.14 -2.90 0.00 0.00 -0.50 0.00 0.00 54.79 51.53 1mr6 n ASP 19 Cb 0.60 -1.56 0.00 0.00 -1.14 0.00 0.00 41.12 39.02 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 3.39 0.29 0.35 6.12 0.00 -1.26 -4.97 105.19 109.11 1mr6 n GLY 20 Ca 0.54 -0.16 -0.03 0.00 0.00 0.00 0.00 46.02 46.37 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 -1.39 -0.13 0.00 1.61 3.00 -1.24 -4.86 118.16 115.16 1mr6 n LYS 21 Ca 0.00 -0.18 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 1mr6 n LYS 21 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 35.03 34.91 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 -3.08 0.00 -2.93 3.14 3.02 -0.90 -2.37 115.26 112.14 1mr6 n ASN 22 Ca 0.01 -1.00 -0.08 0.00 -0.03 0.00 0.00 54.58 53.49 1mr6 n ASN 22 Cb 0.05 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.25 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 0.07 2.41 1.01 0.39 -4.69 121.20 120.40 1mr6 s ILE 23 Ca 0.00 -0.92 0.08 0.00 0.00 0.00 0.00 60.65 59.81 1mr6 s ILE 23 Cb 0.00 -2.97 -0.04 0.00 0.01 0.00 0.00 42.46 39.47 1mr6 s ILE 23 CO 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 174.94 174.78 1mr6 s VAL 25 N -1.05 -0.88 0.30 0.00 -7.23 0.16 -2.87 120.40 108.83 1mr6 s VAL 25 Ca 0.17 -0.16 0.02 0.00 -1.81 0.00 0.00 61.98 60.20 1mr6 s VAL 25 Cb -0.11 -0.38 -0.03 0.00 0.56 0.00 0.00 36.38 36.42 1mr6 s VAL 25 CO 0.08 -0.10 0.47 -1.59 -0.31 0.00 0.00 175.10 173.65 1mr6 s LYS 26 N 2.05 3.47 -0.19 4.82 -2.85 -0.70 -2.87 119.74 123.46 1mr6 s LYS 26 Ca 0.14 -0.50 -0.20 0.00 -1.00 0.00 0.00 55.97 54.42 1mr6 s LYS 26 Cb -0.07 -2.76 0.05 0.00 -2.06 0.00 0.00 37.83 32.99 1mr6 s LYS 26 CO -0.12 0.27 0.55 1.03 0.10 0.00 0.00 175.35 177.18 1mr6 s ARG 27 N -4.14 0.67 -0.32 1.78 0.52 0.00 -1.01 118.95 116.45 1mr6 s ARG 27 Ca 0.38 0.71 0.01 0.00 -0.52 0.00 0.00 55.73 56.31 1mr6 s ARG 27 Cb -0.09 0.32 0.10 0.00 0.52 0.00 0.00 34.95 35.80 1mr6 s ARG 27 CO 0.33 -0.09 0.08 -1.54 0.02 0.00 0.00 175.30 174.09 1mr6 s SER 28 N 0.16 4.28 0.16 0.23 1.04 -1.14 -0.64 113.70 117.80 1mr6 s SER 28 Ca -0.01 -1.80 0.07 0.00 0.48 0.00 0.00 55.95 54.68 1mr6 s SER 28 Cb -0.04 -1.14 -0.04 0.00 0.10 0.00 0.00 66.02 64.90 1mr6 s SER 28 CO 0.01 -0.40 0.02 -1.66 0.98 0.00 0.00 173.24 172.20 1mr6 s TRP 29 N 1.36 2.92 -0.08 5.02 -2.14 -1.14 -2.68 118.94 122.20 1mr6 s TRP 29 Ca 0.10 -0.10 -0.23 0.00 2.66 0.00 0.00 56.10 58.53 1mr6 s TRP 29 Cb -0.18 -1.42 -0.04 0.00 -3.10 0.00 0.00 33.47 28.73 1mr6 s TRP 29 CO -0.19 0.51 0.68 0.95 -2.66 0.00 0.00 176.95 176.24 1mr6 s THR 30 N -1.66 5.06 -0.19 0.66 -4.23 -0.56 -1.60 115.64 113.11 1mr6 s THR 30 Ca 0.28 1.39 0.05 0.00 -1.18 0.00 0.00 61.69 62.22 1mr6 s THR 30 Cb -0.10 -4.02 0.16 0.00 1.34 0.00 0.00 72.50 69.89 1mr6 s THR 30 CO 0.19 0.25 0.98 0.00 -0.54 0.00 0.00 174.62 175.50 1mr6 n ALA 31 N 3.87 -0.41 -0.77 3.99 0.00 -1.26 -4.98 120.51 120.95 1mr6 n ALA 31 Ca -0.02 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1mr6 n ALA 31 Cb 0.51 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.23 1mr6 n ALA 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1mr6 n VAL 32 N -0.60 0.00 0.00 0.00 0.31 -1.26 -4.97 118.33 111.82 1mr6 n VAL 32 Ca -0.11 1.12 0.00 0.00 -0.01 0.00 0.00 64.34 65.34 1mr6 n VAL 32 Cb 0.67 -2.06 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 1mr6 n VAL 32 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1mr6 n ARG 33 N -0.91 0.00 0.00 5.55 5.12 -1.26 -5.04 116.66 120.12 1mr6 n ARG 33 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1mr6 n ARG 33 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1mr6 n ARG 33 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1mr6 n GLY 34 N 0.00 -0.07 0.28 -0.13 0.00 -1.26 -4.98 105.19 99.04 1mr6 n GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1mr6 n GLY 34 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mr6 n ASP 35 N -1.59 0.00 -4.77 1.61 2.03 -1.26 -5.11 116.55 107.46 1mr6 n ASP 35 Ca 0.00 -1.34 -0.38 0.00 0.52 0.00 0.00 54.79 53.59 1mr6 n ASP 35 Cb 0.00 -0.07 -0.00 0.00 -0.72 0.00 0.00 41.12 40.33 1mr6 n ASP 35 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1mr6 s GLY 36 N -0.34 2.82 -0.07 0.27 0.00 -1.26 -4.97 107.32 103.77 1mr6 s GLY 36 Ca 0.00 1.03 -0.30 0.00 0.00 0.00 0.00 44.72 45.45 1mr6 s GLY 36 CO 0.00 1.51 1.05 2.56 0.00 0.00 0.00 173.10 178.22 1mr6 s PRO 37 N -2.66 4.44 -0.19 2.90 0.04 -1.26 -4.55 135.00 133.73 1mr6 s PRO 37 Ca 0.64 1.47 -0.36 0.00 0.04 0.00 0.00 61.00 62.79 1mr6 s PRO 37 Cb -0.31 -3.52 0.15 0.00 0.04 0.00 0.00 34.50 30.86 1mr6 s PRO 37 CO 0.38 -0.28 1.36 0.21 0.04 0.00 0.00 177.00 178.71 1mr6 s LYS 38 N 1.80 0.11 -0.30 4.56 2.47 -1.26 -5.02 119.74 122.10 1mr6 s LYS 38 Ca 0.51 -0.05 -0.03 0.00 -1.56 0.00 0.00 55.97 54.83 1mr6 s LYS 38 Cb -0.21 0.05 0.18 0.00 -1.46 0.00 0.00 37.83 36.39 1mr6 s LYS 38 CO 0.21 -0.05 0.63 1.03 0.16 0.00 0.00 175.35 177.33 1mr6 s ARG 39 N -2.14 0.55 -0.83 4.03 0.52 -1.26 -4.37 118.95 115.46 1mr6 s ARG 39 Ca 0.13 1.07 -0.25 0.00 -0.52 0.00 0.00 55.73 56.15 1mr6 s ARG 39 Cb 0.02 0.61 -0.02 0.00 0.52 0.00 0.00 34.95 36.07 1mr6 s ARG 39 CO -0.04 -0.52 1.82 -1.21 0.02 0.00 0.00 175.30 175.37 1mr6 s GLU 40 N 2.87 2.74 0.00 3.54 0.41 -0.63 -4.64 118.70 122.99 1mr6 s GLU 40 Ca 0.15 -0.15 0.00 0.00 -0.41 0.00 0.00 54.97 54.56 1mr6 s GLU 40 Cb -0.14 -4.86 0.00 0.00 -1.78 0.00 0.00 34.13 27.35 1mr6 s GLU 40 CO -0.20 -2.98 1.12 0.44 -0.49 0.00 0.00 175.26 173.15 1mr6 n ILE 41 N 7.48 1.12 -0.80 -1.63 -6.64 -1.11 -2.89 119.36 114.90 1mr6 n ILE 41 Ca 0.32 -0.07 -0.27 0.00 -1.77 0.00 0.00 62.75 60.95 1mr6 n ILE 41 Cb 0.49 -1.06 0.02 0.00 -1.44 0.00 0.00 39.64 37.65 1mr6 n ILE 41 CO 0.00 0.00 0.00 -1.14 -1.77 0.00 0.00 176.55 173.64 1mr6 n ARG 42 N 0.65 0.00 -3.80 6.28 0.63 0.19 -4.03 116.66 116.58 1mr6 n ARG 42 Ca 0.00 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.79 1mr6 n ARG 42 Cb 0.49 -0.73 -0.15 0.00 0.45 0.00 0.00 32.46 32.52 1mr6 n ARG 42 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1mr6 s ARG 43 N -1.21 0.00 0.08 -0.14 3.00 -1.26 -0.82 118.95 118.60 1mr6 s ARG 43 Ca 0.34 0.15 -0.25 0.00 0.00 0.00 0.00 55.73 55.96 1mr6 s ARG 43 Cb -0.21 -0.14 0.07 0.00 0.00 0.00 0.00 34.95 34.67 1mr6 s ARG 43 CO 0.56 -0.10 0.61 -1.21 0.00 0.00 0.00 175.30 175.16 1mr6 s GLU 44 N 0.67 1.17 0.35 3.54 2.02 -1.14 -4.94 118.70 120.37 1mr6 s GLU 44 Ca -0.05 -0.23 -0.16 0.00 0.02 0.00 0.00 54.97 54.55 1mr6 s GLU 44 Cb -0.08 0.54 -0.09 0.00 0.10 0.00 0.00 34.13 34.60 1mr6 s GLU 44 CO -0.02 -0.46 0.78 0.00 0.02 0.00 0.00 175.26 175.57 1mr6 n ALA 46 N -0.45 0.00 -2.29 0.00 0.00 -0.18 -4.84 120.51 112.75 1mr6 n ALA 46 Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.52 1mr6 n ALA 46 Cb 0.53 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.02 1mr6 n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mr6 n ALA 47 N -3.00 2.42 -3.00 0.00 0.00 -1.26 0.15 120.51 115.81 1mr6 n ALA 47 Ca 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 53.44 51.23 1mr6 n ALA 47 Cb 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 18.80 1mr6 n ALA 47 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1mr6 n THR 48 N 0.21 0.00 0.00 0.00 -1.04 -1.26 -5.00 114.28 107.20 1mr6 n THR 48 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1mr6 n THR 48 Cb 1.01 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.52 1mr6 n THR 48 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mr6 s PRO 50 N 0.00 -0.50 0.06 0.00 0.04 -1.26 -4.98 135.00 128.36 1mr6 s PRO 50 Ca 0.00 0.31 -0.30 0.00 0.04 0.00 0.00 61.00 61.05 1mr6 s PRO 50 Cb 0.00 -1.65 -0.05 0.00 0.04 0.00 0.00 34.50 32.84 1mr6 s PRO 50 CO 0.00 -3.31 1.13 -1.25 0.04 0.00 0.00 177.00 173.61 1mr6 s PRO 51 N -5.06 4.49 0.13 0.56 0.04 -1.26 -4.79 135.00 129.10 1mr6 s PRO 51 Ca 0.68 1.67 0.10 0.00 0.04 0.00 0.00 61.00 63.48 1mr6 s PRO 51 Cb -0.16 -3.37 -0.04 0.00 0.04 0.00 0.00 34.50 30.97 1mr6 s PRO 51 CO 0.58 -0.16 -0.21 -1.12 0.04 0.00 0.00 177.00 176.13 1mr6 s SER 52 N 0.90 3.69 0.00 6.66 0.01 -1.26 -4.46 113.70 119.25 1mr6 s SER 52 Ca 0.56 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.17 1mr6 s SER 52 Cb -0.27 -0.43 0.00 0.00 0.21 0.00 0.00 66.02 65.53 1mr6 s SER 52 CO 0.29 0.17 0.00 1.17 0.41 0.00 0.00 173.24 175.28 1mr6 n LYS 53 N 0.72 0.00 0.00 12.44 3.00 -1.19 -4.87 118.16 128.26 1mr6 n LYS 53 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.15 1mr6 n LYS 53 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.56 1mr6 n LYS 53 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1mr6 n LEU 54 N -1.92 0.00 0.27 3.14 7.94 -1.26 -4.68 117.00 120.49 1mr6 n LEU 54 Ca 0.00 0.00 0.18 0.00 -1.11 0.00 0.00 56.01 55.08 1mr6 n LEU 54 Cb 0.00 0.00 0.93 0.00 0.53 0.00 0.00 43.42 44.88 1mr6 n LEU 54 CO 0.00 0.00 1.15 1.23 -1.11 0.00 0.00 177.39 178.66 1mr6 h GLY 55 N 0.00 0.00 -5.80 -3.96 0.00 -1.96 -3.32 103.07 88.02 1mr6 h GLY 55 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.34 1mr6 h GLY 55 CO 0.00 0.00 -0.33 -2.27 0.00 0.00 0.00 176.54 173.94 1mr6 s LEU 56 N -7.06 -1.18 -0.53 3.11 2.96 -1.25 -1.49 118.68 113.23 1mr6 s LEU 56 Ca -0.05 -0.45 -0.18 0.00 -0.22 0.00 0.00 54.13 53.23 1mr6 s LEU 56 Cb 0.14 1.55 0.08 0.00 0.50 0.00 0.00 46.19 48.46 1mr6 s LEU 56 CO 0.48 -0.15 0.59 -0.89 -1.32 0.00 0.00 176.35 175.07 1mr6 s THR 57 N 2.07 4.96 0.35 3.68 2.01 -1.09 -3.16 115.64 124.46 1mr6 s THR 57 Ca 0.16 -0.87 -0.15 0.00 0.31 0.00 0.00 61.69 61.14 1mr6 s THR 57 Cb -0.03 -4.33 -0.09 0.00 0.01 0.00 0.00 72.50 68.07 1mr6 s THR 57 CO -0.12 -0.87 0.76 -0.69 -0.69 0.00 0.00 174.62 173.01 1mr6 s VAL 58 N 2.35 4.68 -0.16 3.82 1.01 -1.25 -2.88 120.40 127.96 1mr6 s VAL 58 Ca 0.11 0.92 -0.04 0.00 0.00 0.00 0.00 61.98 62.97 1mr6 s VAL 58 Cb -0.23 -3.63 0.08 0.00 0.00 0.00 0.00 36.38 32.59 1mr6 s VAL 58 CO 0.08 -0.27 0.20 0.12 0.00 0.00 0.00 175.10 175.23 1mr6 s PHE 59 N -2.08 -0.23 0.44 5.22 5.36 -0.18 -4.60 117.98 121.91 1mr6 s PHE 59 Ca 0.54 0.35 0.03 0.00 -0.96 0.00 0.00 56.93 56.90 1mr6 s PHE 59 Cb -0.10 -0.33 -0.04 0.00 -0.34 0.00 0.00 43.02 42.21 1mr6 s PHE 59 CO 0.20 -0.49 0.03 0.00 -1.46 0.00 0.00 175.22 173.50 1mr6 n THR 62 N 2.75 4.32 -3.88 0.00 -2.24 -1.26 -2.66 114.28 111.32 1mr6 n THR 62 Ca -0.14 -5.64 0.02 0.00 -2.27 0.00 0.00 64.05 56.01 1mr6 n THR 62 Cb 0.55 -2.15 0.01 0.00 -2.10 0.00 0.00 70.33 66.64 1mr6 n THR 62 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1mr6 s THR 63 N -2.47 0.00 1.02 4.28 -1.32 -1.26 -5.09 115.64 110.79 1mr6 s THR 63 Ca 0.33 -0.24 -0.17 0.00 -1.21 0.00 0.00 61.69 60.39 1mr6 s THR 63 Cb 0.05 -2.69 0.07 0.00 -1.51 0.00 0.00 72.50 68.41 1mr6 s THR 63 CO 0.04 0.00 -0.17 -0.90 -2.21 0.00 0.00 174.62 171.38 1mr6 n ASP 64 N -0.94 -2.71 -1.60 8.08 5.75 -1.15 -4.20 116.55 119.79 1mr6 n ASP 64 Ca -0.00 -0.20 -0.15 0.00 -0.01 0.00 0.00 54.79 54.43 1mr6 n ASP 64 Cb 0.60 -0.76 -0.05 0.00 -1.03 0.00 0.00 41.12 39.87 1mr6 n ASP 64 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1mr6 n ASN 65 N -0.25 0.11 -3.20 -1.12 0.23 0.11 -4.50 115.26 106.64 1mr6 n ASN 65 Ca 0.02 0.07 -0.23 0.00 -0.53 0.00 0.00 54.58 53.91 1mr6 n ASN 65 Cb 0.50 -0.33 -0.06 0.00 -2.08 0.00 0.00 39.78 37.82 1mr6 n ASN 65 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1mr6 n ASN 67 N 0.81 -1.17 0.00 0.00 3.02 -1.26 -4.51 115.26 112.14 1mr6 n ASN 67 Ca 0.25 -2.00 0.04 0.00 -0.03 0.00 0.00 54.58 52.84 1mr6 n ASN 67 Cb 0.53 0.49 0.24 0.00 -0.61 0.00 0.00 39.78 40.43 1mr6 n ASN 67 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64