#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 2.36 -0.04 0.03 1.11 -1.26 0.02 119.66 121.88 1mr6 s GLN 2 Ca 0.00 -1.30 -0.01 0.00 0.01 0.00 0.00 55.36 54.06 1mr6 s GLN 2 Cb 0.00 -3.10 0.03 0.00 -1.01 0.00 0.00 33.01 28.94 1mr6 s GLN 2 CO 0.00 -0.61 0.07 0.00 0.01 0.00 0.00 175.29 174.76 1mr6 n LYS 4 N 4.51 0.52 -1.16 0.00 5.02 -1.25 -4.39 118.16 121.42 1mr6 n LYS 4 Ca -0.21 0.25 -0.07 0.00 -2.02 0.00 0.00 58.31 56.26 1mr6 n LYS 4 Cb 0.50 -2.45 -0.05 0.00 -0.02 0.00 0.00 35.03 33.01 1mr6 n LYS 4 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1mr6 n THR 5 N -2.77 0.00 0.00 -0.18 -2.24 -1.26 -4.20 114.28 103.64 1mr6 n THR 5 Ca 0.14 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1mr6 n THR 5 Cb 0.49 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 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 0.00 4.37 -4.70 0.00 7.64 -1.26 -4.32 113.62 115.35 1mr6 n SER 7 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 1mr6 n SER 7 Cb 0.00 0.51 0.14 0.00 -1.01 0.00 0.00 64.21 63.85 1mr6 n SER 7 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1mr6 s PHE 8 N -1.85 2.22 -0.49 1.43 0.40 -1.26 -4.92 117.98 113.51 1mr6 s PHE 8 Ca 0.00 1.35 0.01 0.00 -0.60 0.00 0.00 56.93 57.69 1mr6 s PHE 8 Cb 0.00 -3.16 0.51 0.00 0.51 0.00 0.00 43.02 40.89 1mr6 s PHE 8 CO 0.00 -2.45 1.92 2.48 0.70 0.00 0.00 175.22 177.87 1mr6 n TYR 9 N -3.94 2.81 0.00 0.36 4.11 -1.26 -4.47 117.16 114.78 1mr6 n TYR 9 Ca 0.07 -2.20 0.00 0.00 -0.00 0.00 0.00 57.90 55.78 1mr6 n TYR 9 Cb 0.54 -1.09 0.00 0.00 -0.00 0.00 0.00 39.34 38.80 1mr6 n TYR 9 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 1mr6 n THR 10 N -0.84 0.00 -3.09 -3.48 5.66 -1.26 -5.04 114.28 106.23 1mr6 n THR 10 Ca 0.55 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 61.12 1mr6 n THR 10 Cb 1.15 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.87 1mr6 n THR 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1mr6 h PRO 12 N 8.79 0.00 0.00 0.00 0.13 -2.00 -3.42 132.00 135.50 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 0.89 0.07 0.00 0.09 -0.23 0.00 0.00 178.00 178.82 1mr6 n ASN 13 N -3.15 0.00 -3.64 1.44 4.13 -1.26 -5.07 115.26 107.71 1mr6 n ASN 13 Ca 0.02 0.00 -0.05 0.00 1.68 0.00 0.00 54.58 56.23 1mr6 n ASN 13 Cb 0.45 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.62 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 -1.92 -0.34 -0.54 6.41 1.04 -1.26 -5.08 113.70 112.01 1mr6 s SER 14 Ca 0.00 0.62 0.04 0.00 0.48 0.00 0.00 55.95 57.08 1mr6 s SER 14 Cb 0.00 0.79 0.15 0.00 0.10 0.00 0.00 66.02 67.06 1mr6 s SER 14 CO 0.00 -0.10 0.33 -0.70 0.98 0.00 0.00 173.24 173.75 1mr6 s GLU 15 N 0.51 1.79 -0.31 4.02 2.12 -1.26 -5.03 118.70 120.54 1mr6 s GLU 15 Ca 0.00 -2.59 -0.29 0.00 0.36 0.00 0.00 54.97 52.45 1mr6 s GLU 15 Cb -0.04 -2.83 -0.02 0.00 0.26 0.00 0.00 34.13 31.50 1mr6 s GLU 15 CO -0.11 -1.21 1.67 0.99 -0.54 0.00 0.00 175.26 176.06 1mr6 s THR 16 N -0.41 3.63 0.99 -1.70 2.01 -1.26 -2.39 115.64 116.51 1mr6 s THR 16 Ca 0.21 0.66 -0.15 0.00 0.31 0.00 0.00 61.69 62.73 1mr6 s THR 16 Cb -0.16 -3.77 0.02 0.00 0.01 0.00 0.00 72.50 68.61 1mr6 s THR 16 CO -0.07 -0.44 0.16 0.00 -0.69 0.00 0.00 174.62 173.58 1mr6 n PRO 18 N -1.24 -1.23 -1.23 0.00 -0.04 -1.26 -4.31 135.00 125.69 1mr6 n PRO 18 Ca 0.04 -0.79 -0.19 0.00 -0.04 0.00 0.00 63.50 62.52 1mr6 n PRO 18 Cb 0.56 -0.63 -0.12 0.00 -0.04 0.00 0.00 33.50 33.28 1mr6 n PRO 18 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1mr6 n ASP 19 N -3.57 5.81 0.00 3.54 9.92 -1.26 -3.47 116.55 127.52 1mr6 n ASP 19 Ca 0.07 -2.82 0.00 0.00 -0.53 0.00 0.00 54.79 51.51 1mr6 n ASP 19 Cb 0.24 -1.33 0.00 0.00 -0.64 0.00 0.00 41.12 39.39 1mr6 n ASP 19 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1mr6 n GLY 20 N 1.74 -0.01 0.00 0.44 0.00 -1.26 -5.03 105.19 101.07 1mr6 n GLY 20 Ca 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.46 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 -1.83 -0.02 0.00 1.61 3.00 -1.25 -4.95 118.16 114.72 1mr6 n LYS 21 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1mr6 n LYS 21 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 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 -2.83 0.00 -4.04 3.14 3.02 -1.21 -3.20 115.26 110.14 1mr6 n ASN 22 Ca 0.00 -0.89 -0.10 0.00 -0.03 0.00 0.00 54.58 53.56 1mr6 n ASN 22 Cb 0.00 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.10 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 0.01 0.01 2.41 1.01 0.11 -4.72 121.20 120.04 1mr6 s ILE 23 Ca 0.00 -1.54 -0.00 0.00 0.00 0.00 0.00 60.65 59.11 1mr6 s ILE 23 Cb 0.00 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 1mr6 s ILE 23 CO 0.00 -0.06 0.11 0.00 0.00 0.00 0.00 174.94 174.99 1mr6 s VAL 25 N -1.27 0.13 -0.28 0.00 -7.23 -0.64 -1.83 120.40 109.29 1mr6 s VAL 25 Ca 0.26 -1.10 -0.17 0.00 -1.81 0.00 0.00 61.98 59.15 1mr6 s VAL 25 Cb -0.12 -1.10 0.09 0.00 0.56 0.00 0.00 36.38 35.81 1mr6 s VAL 25 CO 0.17 -0.61 0.73 -0.54 -0.31 0.00 0.00 175.10 174.54 1mr6 s LYS 26 N -3.11 0.69 0.38 4.82 3.01 0.32 -2.56 119.74 123.28 1mr6 s LYS 26 Ca -0.01 1.13 0.08 0.00 -1.01 0.00 0.00 55.97 56.16 1mr6 s LYS 26 Cb 0.02 0.17 -0.06 0.00 -1.01 0.00 0.00 37.83 36.95 1mr6 s LYS 26 CO -0.07 -0.14 0.08 -0.98 0.51 0.00 0.00 175.35 174.76 1mr6 s ARG 27 N 1.42 2.13 -0.30 1.68 1.70 -0.49 0.14 118.95 125.24 1mr6 s ARG 27 Ca -0.08 -1.83 -0.05 0.00 -0.47 0.00 0.00 55.73 53.30 1mr6 s ARG 27 Cb -0.05 -1.92 0.16 0.00 -0.57 0.00 0.00 34.95 32.58 1mr6 s ARG 27 CO -0.17 0.01 0.64 -1.54 -1.08 0.00 0.00 175.30 173.17 1mr6 s SER 28 N -3.79 -1.25 0.33 -2.89 1.04 -0.64 -2.12 113.70 104.37 1mr6 s SER 28 Ca 0.37 1.16 0.05 0.00 0.48 0.00 0.00 55.95 58.01 1mr6 s SER 28 Cb 0.03 2.20 -0.06 0.00 0.10 0.00 0.00 66.02 68.28 1mr6 s SER 28 CO 0.20 -0.24 0.02 -1.66 0.98 0.00 0.00 173.24 172.54 1mr6 s TRP 29 N 2.87 2.06 -0.48 5.02 -2.14 -1.08 -2.97 118.94 122.23 1mr6 s TRP 29 Ca 0.09 -0.83 -0.22 0.00 2.66 0.00 0.00 56.10 57.79 1mr6 s TRP 29 Cb -0.13 -1.33 0.03 0.00 -3.10 0.00 0.00 33.47 28.94 1mr6 s TRP 29 CO -0.20 0.17 0.78 0.95 -2.66 0.00 0.00 176.95 175.99 1mr6 s THR 30 N -3.11 4.64 -0.05 0.66 -4.23 -1.26 0.11 115.64 112.40 1mr6 s THR 30 Ca 0.34 0.22 -0.03 0.00 -1.18 0.00 0.00 61.69 61.05 1mr6 s THR 30 Cb 0.08 -4.36 0.03 0.00 1.34 0.00 0.00 72.50 69.59 1mr6 s THR 30 CO 0.15 -0.81 0.12 0.00 -0.54 0.00 0.00 174.62 173.53 1mr6 s ALA 31 N 3.29 -0.21 0.27 3.99 0.00 -1.26 -4.86 121.76 122.99 1mr6 s ALA 31 Ca 0.27 0.52 -0.31 0.00 0.00 0.00 0.00 51.96 52.44 1mr6 s ALA 31 Cb -0.13 -0.35 -0.12 0.00 0.00 0.00 0.00 23.12 22.52 1mr6 s ALA 31 CO 0.20 -0.12 1.62 1.55 0.00 0.00 0.00 175.76 179.01 1mr6 n VAL 32 N 3.90 0.79 -0.12 0.00 3.14 -1.26 -4.23 118.33 120.54 1mr6 n VAL 32 Ca -0.23 -0.20 -0.24 0.00 -2.96 0.00 0.00 64.34 60.71 1mr6 n VAL 32 Cb 0.53 -1.95 -0.09 0.00 -1.06 0.00 0.00 33.84 31.27 1mr6 n VAL 32 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1mr6 n ARG 33 N 2.55 0.54 0.00 1.45 5.12 -1.25 -5.00 116.66 120.08 1mr6 n ARG 33 Ca 0.10 0.21 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 1mr6 n ARG 33 Cb 0.36 -1.40 0.00 0.00 -1.16 0.00 0.00 32.46 30.26 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 1.69 -0.01 1.77 -0.13 0.00 -1.26 -4.99 105.19 102.25 1mr6 n GLY 34 Ca -0.47 -0.09 -0.03 0.00 0.00 0.00 0.00 46.02 45.43 1mr6 n GLY 34 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mr6 n ASP 35 N -1.78 -0.60 0.00 1.61 5.68 -1.26 -5.11 116.55 115.10 1mr6 n ASP 35 Ca 0.00 -2.07 0.00 0.00 -0.50 0.00 0.00 54.79 52.22 1mr6 n ASP 35 Cb 0.00 0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.23 1mr6 n ASP 35 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1mr6 n GLY 36 N -0.47 1.00 3.56 6.12 0.00 -1.26 -5.09 105.19 109.05 1mr6 n GLY 36 Ca -0.17 0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1mr6 n GLY 36 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1mr6 s PRO 37 N -0.12 3.41 0.00 1.61 0.04 -1.26 -3.74 135.00 134.94 1mr6 s PRO 37 Ca 0.00 -0.75 0.00 0.00 0.04 0.00 0.00 61.00 60.29 1mr6 s PRO 37 Cb 0.00 -4.90 0.00 0.00 0.04 0.00 0.00 34.50 29.64 1mr6 s PRO 37 CO 0.00 -2.22 0.00 1.63 0.04 0.00 0.00 177.00 176.45 1mr6 n LYS 38 N 9.08 0.00 -3.17 4.56 5.02 -1.26 -4.95 118.16 127.44 1mr6 n LYS 38 Ca 0.22 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.53 1mr6 n LYS 38 Cb 0.50 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.51 1mr6 n LYS 38 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1mr6 s ARG 39 N 0.86 0.59 -0.87 1.97 0.52 -1.26 -4.56 118.95 116.20 1mr6 s ARG 39 Ca 0.00 0.38 -0.24 0.00 -0.52 0.00 0.00 55.73 55.35 1mr6 s ARG 39 Cb 0.00 0.18 -0.18 0.00 0.52 0.00 0.00 34.95 35.47 1mr6 s ARG 39 CO 0.00 -1.07 2.23 -1.91 0.02 0.00 0.00 175.30 174.57 1mr6 n GLU 40 N 5.25 0.33 -1.66 3.54 4.07 0.30 -4.60 120.64 127.86 1mr6 n GLU 40 Ca 0.06 -1.05 -0.14 0.00 -0.06 0.00 0.00 57.16 55.97 1mr6 n GLU 40 Cb 0.54 -3.47 0.08 0.00 -0.06 0.00 0.00 31.44 28.53 1mr6 n GLU 40 CO 0.00 0.00 0.00 0.44 -0.06 0.00 0.00 177.13 177.51 1mr6 n ILE 41 N 8.49 0.00 -3.60 6.31 -6.64 -1.26 -2.62 119.36 120.04 1mr6 n ILE 41 Ca 0.44 -0.87 -0.04 0.00 -1.77 0.00 0.00 62.75 60.51 1mr6 n ILE 41 Cb 0.43 -1.19 -0.02 0.00 -1.44 0.00 0.00 39.64 37.42 1mr6 n ILE 41 CO 0.00 0.00 0.00 -0.60 -1.77 0.00 0.00 176.55 174.18 1mr6 s ARG 42 N -4.10 0.32 0.16 6.28 3.52 -0.90 -4.91 118.95 119.32 1mr6 s ARG 42 Ca 0.40 -0.12 -0.01 0.00 -0.13 0.00 0.00 55.73 55.87 1mr6 s ARG 42 Cb -0.02 0.14 -0.04 0.00 -1.56 0.00 0.00 34.95 33.47 1mr6 s ARG 42 CO 0.27 -0.14 0.08 -0.98 -0.81 0.00 0.00 175.30 173.71 1mr6 s ARG 43 N -2.43 1.04 0.00 5.12 3.03 -1.26 -1.40 118.95 123.05 1mr6 s ARG 43 Ca 0.10 -1.51 0.00 0.00 2.03 0.00 0.00 55.73 56.34 1mr6 s ARG 43 Cb -0.01 0.21 0.00 0.00 -1.03 0.00 0.00 34.95 34.13 1mr6 s ARG 43 CO -0.05 -0.30 0.00 -1.91 -1.13 0.00 0.00 175.30 171.92 1mr6 n GLU 44 N -0.17 -2.77 -4.88 3.89 4.07 -1.06 -4.81 120.64 114.92 1mr6 n GLU 44 Ca -0.03 0.00 -0.33 0.00 -0.06 0.00 0.00 57.16 56.74 1mr6 n GLU 44 Cb 0.64 0.00 -0.13 0.00 -0.06 0.00 0.00 31.44 31.89 1mr6 n GLU 44 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1mr6 n ALA 46 N 2.55 0.00 -0.35 0.00 0.00 -0.99 -4.91 120.51 116.81 1mr6 n ALA 46 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1mr6 n ALA 46 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 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 -0.05 -0.13 0.00 0.00 -1.26 0.06 120.51 116.13 1mr6 n ALA 47 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 1mr6 n ALA 47 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1mr6 n ALA 47 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1mr6 n THR 48 N -1.48 1.53 -1.30 0.00 -2.24 -1.26 -4.29 114.28 105.24 1mr6 n THR 48 Ca 0.00 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1mr6 n THR 48 Cb 0.00 -1.93 0.00 0.00 -2.10 0.00 0.00 70.33 66.30 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 -1.15 -1.12 -0.76 0.00 0.04 -1.26 -4.86 135.00 125.89 1mr6 s PRO 50 Ca 0.00 0.21 -0.26 0.00 0.04 0.00 0.00 61.00 60.99 1mr6 s PRO 50 Cb 0.00 -1.58 -0.00 0.00 0.04 0.00 0.00 34.50 32.95 1mr6 s PRO 50 CO 0.00 -3.70 1.67 -1.25 0.04 0.00 0.00 177.00 173.76 1mr6 s PRO 51 N -5.12 2.89 0.01 0.56 0.04 -1.26 -4.94 135.00 127.18 1mr6 s PRO 51 Ca 0.69 -0.03 -0.02 0.00 0.04 0.00 0.00 61.00 61.68 1mr6 s PRO 51 Cb -0.14 -4.60 -0.01 0.00 0.04 0.00 0.00 34.50 29.79 1mr6 s PRO 51 CO 0.58 -2.63 0.01 -1.12 0.04 0.00 0.00 177.00 173.88 1mr6 s SER 52 N 6.49 0.17 -0.10 6.66 0.01 -1.26 -5.00 113.70 120.67 1mr6 s SER 52 Ca 0.56 -0.38 0.13 0.00 1.31 0.00 0.00 55.95 57.57 1mr6 s SER 52 Cb -0.08 0.12 0.56 0.00 0.21 0.00 0.00 66.02 66.82 1mr6 s SER 52 CO 0.11 -0.29 1.42 1.17 0.41 0.00 0.00 173.24 176.06 1mr6 n LYS 53 N 1.70 3.17 0.00 12.44 4.81 -1.26 -4.85 118.16 134.17 1mr6 n LYS 53 Ca -0.23 -2.19 0.00 0.00 -0.87 0.00 0.00 58.31 55.03 1mr6 n LYS 53 Cb 0.56 -1.78 0.00 0.00 0.02 0.00 0.00 35.03 33.83 1mr6 n LYS 53 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1mr6 n LEU 54 N 0.77 0.00 0.11 3.14 7.94 -1.26 -4.78 117.00 122.91 1mr6 n LEU 54 Ca 0.20 0.00 0.14 0.00 -1.11 0.00 0.00 56.01 55.24 1mr6 n LEU 54 Cb 0.73 0.00 0.65 0.00 0.53 0.00 0.00 43.42 45.34 1mr6 n LEU 54 CO 0.19 0.00 1.14 1.23 -1.11 0.00 0.00 177.39 178.84 1mr6 h GLY 55 N 0.00 0.04 -5.32 -3.96 0.00 -2.01 -3.36 103.07 88.46 1mr6 h GLY 55 Ca 0.00 -0.01 -0.63 0.00 0.00 0.00 0.00 47.33 46.68 1mr6 h GLY 55 CO 0.00 0.01 -0.32 -2.27 0.00 0.00 0.00 176.54 173.95 1mr6 s LEU 56 N -8.93 4.43 -0.68 3.11 2.96 -1.26 -4.99 118.68 113.32 1mr6 s LEU 56 Ca -0.05 0.74 -0.26 0.00 -0.22 0.00 0.00 54.13 54.33 1mr6 s LEU 56 Cb 0.18 -2.36 -0.03 0.00 0.50 0.00 0.00 46.19 44.48 1mr6 s LEU 56 CO 0.71 0.35 1.94 -0.89 -1.32 0.00 0.00 176.35 177.14 1mr6 s THR 57 N -0.99 3.34 0.68 3.68 2.01 -1.16 -4.85 115.64 118.36 1mr6 s THR 57 Ca 0.20 0.04 -0.11 0.00 0.31 0.00 0.00 61.69 62.13 1mr6 s THR 57 Cb -0.15 -3.86 -0.00 0.00 0.01 0.00 0.00 72.50 68.51 1mr6 s THR 57 CO 0.09 -0.82 1.07 -0.69 -0.69 0.00 0.00 174.62 173.58 1mr6 s VAL 58 N 9.74 3.91 -0.27 3.82 1.01 -1.26 -1.63 120.40 135.73 1mr6 s VAL 58 Ca 0.71 0.62 -0.02 0.00 0.00 0.00 0.00 61.98 63.29 1mr6 s VAL 58 Cb -0.12 -3.59 0.16 0.00 0.00 0.00 0.00 36.38 32.83 1mr6 s VAL 58 CO 0.16 -0.81 0.48 0.12 0.00 0.00 0.00 175.10 175.04 1mr6 s PHE 59 N -3.28 -1.18 0.39 5.22 2.19 0.38 -4.88 117.98 116.83 1mr6 s PHE 59 Ca 0.57 1.22 0.08 0.00 0.33 0.00 0.00 56.93 59.13 1mr6 s PHE 59 Cb -0.11 0.26 -0.06 0.00 -1.31 0.00 0.00 43.02 41.80 1mr6 s PHE 59 CO 0.53 -0.80 0.07 0.00 1.83 0.00 0.00 175.22 176.85 1mr6 n THR 62 N 1.54 2.86 -4.00 0.00 -2.24 -1.26 -3.04 114.28 108.14 1mr6 n THR 62 Ca -0.22 -4.04 -0.09 0.00 -2.27 0.00 0.00 64.05 57.42 1mr6 n THR 62 Cb 0.56 -1.18 -0.06 0.00 -2.10 0.00 0.00 70.33 67.55 1mr6 n THR 62 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1mr6 s THR 63 N -4.86 0.01 1.03 4.28 -4.23 -1.26 -5.11 115.64 105.50 1mr6 s THR 63 Ca 0.54 -1.42 -0.14 0.00 -1.18 0.00 0.00 61.69 59.48 1mr6 s THR 63 Cb 0.43 -2.16 0.16 0.00 1.34 0.00 0.00 72.50 72.27 1mr6 s THR 63 CO -0.05 -0.03 0.26 -0.90 -0.54 0.00 0.00 174.62 173.36 1mr6 n ASP 64 N -0.36 -2.97 -3.36 3.99 5.68 -1.25 -4.14 116.55 114.16 1mr6 n ASP 64 Ca -0.02 -0.36 -0.22 0.00 -0.50 0.00 0.00 54.79 53.68 1mr6 n ASP 64 Cb 0.62 -0.78 -0.15 0.00 -1.14 0.00 0.00 41.12 39.67 1mr6 n ASP 64 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1mr6 n ASN 65 N -1.29 -0.57 -0.12 -1.12 3.02 0.25 -4.66 115.26 110.77 1mr6 n ASN 65 Ca 0.05 -0.19 -0.22 0.00 -0.03 0.00 0.00 54.58 54.19 1mr6 n ASN 65 Cb 0.39 -0.51 -0.12 0.00 -0.61 0.00 0.00 39.78 38.93 1mr6 n ASN 65 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mr6 s ASN 67 N -6.87 6.55 0.00 0.00 2.47 -1.26 -5.09 114.94 110.75 1mr6 s ASN 67 Ca -0.35 -2.06 0.07 0.00 0.42 0.00 0.00 52.86 50.93 1mr6 s ASN 67 Cb 0.10 -2.32 0.39 0.00 -1.45 0.00 0.00 41.25 37.97 1mr6 s ASN 67 CO 0.58 -0.95 0.85 1.41 -3.72 0.00 0.00 177.10 175.28