#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pr6 s ASP 21 N 0.00 6.96 -0.37 -1.43 1.01 -1.26 -4.96 116.67 116.61 2pr6 s ASP 21 Ca 0.00 2.52 0.12 0.00 0.71 0.00 0.00 52.55 55.89 2pr6 s ASP 21 Cb 0.00 -2.64 0.34 0.00 1.01 0.00 0.00 42.92 41.64 2pr6 s ASP 21 CO 0.00 -0.40 0.74 1.41 0.21 0.00 0.00 175.17 177.13 2pr6 n HIS 22 N 1.09 0.02 -4.28 4.23 8.25 -1.26 -5.06 115.22 118.21 2pr6 n HIS 22 Ca 0.00 -3.73 -0.15 0.00 -0.26 0.00 0.00 57.72 53.58 2pr6 n HIS 22 Cb 0.43 -0.32 -0.10 0.00 1.12 0.00 0.00 29.99 31.11 2pr6 n HIS 22 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2pr6 s VAL 23 N -2.26 1.16 0.63 1.59 -7.23 -1.26 -5.15 120.40 107.89 2pr6 s VAL 23 Ca 0.39 -2.06 -0.15 0.00 -1.81 0.00 0.00 61.98 58.35 2pr6 s VAL 23 Cb 0.34 -2.00 -0.01 0.00 0.56 0.00 0.00 36.38 35.26 2pr6 s VAL 23 CO -0.08 -0.62 1.09 -0.13 -0.31 0.00 0.00 175.10 175.05 2pr6 s ARG 24 N -3.77 3.01 0.30 4.82 0.52 -1.26 -4.94 118.95 117.62 2pr6 s ARG 24 Ca 0.20 1.32 -0.17 0.00 -0.52 0.00 0.00 55.73 56.56 2pr6 s ARG 24 Cb 0.03 -1.98 -0.09 0.00 0.52 0.00 0.00 34.95 33.43 2pr6 s ARG 24 CO 0.03 -1.07 0.75 0.14 0.02 0.00 0.00 175.30 175.17 2pr6 s VAL 25 N -2.38 4.62 0.15 3.52 -7.23 -1.26 -4.82 120.40 112.99 2pr6 s VAL 25 Ca 0.66 1.10 -0.18 0.00 -1.81 0.00 0.00 61.98 61.75 2pr6 s VAL 25 Cb -0.19 -3.69 -0.07 0.00 0.56 0.00 0.00 36.38 32.99 2pr6 s VAL 25 CO 0.40 -0.07 0.62 -0.83 -0.31 0.00 0.00 175.10 174.90 2pr6 s GLY 26 N -2.07 2.59 -0.04 2.32 0.00 0.12 -4.33 107.32 105.91 2pr6 s GLY 26 Ca 0.51 0.03 0.03 0.00 0.00 0.00 0.00 44.72 45.30 2pr6 s GLY 26 CO 0.18 0.39 -0.13 0.14 0.00 0.00 0.00 173.10 173.68 2pr6 s VAL 27 N -1.36 1.14 0.02 1.40 1.01 -1.26 -0.61 120.40 120.74 2pr6 s VAL 27 Ca 0.37 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.85 2pr6 s VAL 27 Cb -0.17 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 2pr6 s VAL 27 CO 0.20 0.34 -0.12 -0.69 0.00 0.00 0.00 175.10 174.83 2pr6 s VAL 28 N 0.24 0.97 -0.05 2.92 1.01 -0.53 -1.79 120.40 123.18 2pr6 s VAL 28 Ca -0.06 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.23 2pr6 s VAL 28 Cb -0.12 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 2pr6 s VAL 28 CO 0.02 0.11 -0.23 -0.63 0.00 0.00 0.00 175.10 174.37 2pr6 s ILE 29 N -0.59 1.87 0.28 2.22 1.01 -0.36 -0.52 121.20 125.12 2pr6 s ILE 29 Ca 0.02 -0.96 0.11 0.00 0.00 0.00 0.00 60.65 59.82 2pr6 s ILE 29 Cb -0.06 -1.59 -0.05 0.00 0.01 0.00 0.00 42.46 40.77 2pr6 s ILE 29 CO 0.00 0.52 -0.13 0.42 0.00 0.00 0.00 174.94 175.76 2pr6 s THR 30 N -0.09 2.76 -0.36 2.92 -4.23 -0.37 -0.42 115.64 115.85 2pr6 s THR 30 Ca -0.04 -2.24 0.01 0.00 -1.18 0.00 0.00 61.69 58.24 2pr6 s THR 30 Cb -0.13 -2.49 0.10 0.00 1.34 0.00 0.00 72.50 71.31 2pr6 s THR 30 CO 0.03 -0.38 0.10 -0.62 -0.54 0.00 0.00 174.62 173.22 2pr6 s ASP 31 N -3.57 4.96 0.00 3.99 -1.08 -0.83 -2.37 116.67 117.77 2pr6 s ASP 31 Ca 0.31 -2.01 0.22 0.00 -0.52 0.00 0.00 52.55 50.55 2pr6 s ASP 31 Cb -0.05 -1.71 1.07 0.00 -1.46 0.00 0.00 42.92 40.77 2pr6 s ASP 31 CO 0.17 -0.43 1.70 -0.81 0.52 0.00 0.00 175.17 176.31 2pr6 n PRO 32 N 4.43 0.26 0.21 4.34 -0.04 -1.26 -1.92 135.00 141.02 2pr6 n PRO 32 Ca -0.01 0.09 0.11 0.00 -0.04 0.00 0.00 63.50 63.65 2pr6 n PRO 32 Cb 0.42 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.60 2pr6 n PRO 32 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2pr6 h ALA 33 N 2.98 0.94 -2.34 0.55 0.00 -1.93 -3.42 119.26 116.03 2pr6 h ALA 33 Ca 0.00 -0.10 -0.50 0.00 0.00 0.00 0.00 54.91 54.31 2pr6 h ALA 33 Cb 0.23 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.01 2pr6 h ALA 33 CO 0.00 0.13 0.02 -0.51 0.00 0.00 0.00 179.25 178.89 2pr6 s LEU 34 N -6.29 3.87 0.17 0.00 1.43 -0.81 -5.00 118.68 112.05 2pr6 s LEU 34 Ca 0.05 0.93 -0.32 0.00 -1.03 0.00 0.00 54.13 53.76 2pr6 s LEU 34 Cb 0.06 -3.80 -0.12 0.00 0.03 0.00 0.00 46.19 42.36 2pr6 s LEU 34 CO 0.67 -0.36 1.75 1.21 0.23 0.00 0.00 176.35 179.84 2pr6 n GLU 35 N -1.39 2.68 -1.95 1.70 2.13 -1.26 -1.61 120.64 120.95 2pr6 n GLU 35 Ca 0.00 0.97 -0.18 0.00 0.66 0.00 0.00 57.16 58.61 2pr6 n GLU 35 Cb 0.54 -2.82 -0.04 0.00 0.27 0.00 0.00 31.44 29.39 2pr6 n GLU 35 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2pr6 n ASP 36 N 4.49 -5.25 -3.76 4.31 2.03 -1.26 -4.07 116.55 113.04 2pr6 n ASP 36 Ca 0.17 0.21 -0.35 0.00 0.52 0.00 0.00 54.79 55.34 2pr6 n ASP 36 Cb 0.35 -4.33 0.04 0.00 -0.72 0.00 0.00 41.12 36.45 2pr6 n ASP 36 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2pr6 n ASN 37 N -1.22 -5.10 -4.77 1.67 5.15 -0.63 -4.54 115.26 105.81 2pr6 n ASN 37 Ca -0.20 -1.08 -0.33 0.00 -0.60 0.00 0.00 54.58 52.37 2pr6 n ASN 37 Cb 0.63 -3.01 0.05 0.00 -0.53 0.00 0.00 39.78 36.92 2pr6 n ASN 37 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2pr6 s PRO 38 N -6.29 2.79 0.05 1.20 0.04 -1.26 -4.60 135.00 126.94 2pr6 s PRO 38 Ca 0.48 1.35 -0.31 0.00 0.04 0.00 0.00 61.00 62.57 2pr6 s PRO 38 Cb -0.19 -1.95 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 2pr6 s PRO 38 CO 0.89 -1.25 1.27 0.42 0.04 0.00 0.00 177.00 178.36 2pr6 s ILE 39 N -2.40 3.86 -0.20 0.56 1.01 -0.16 -1.97 121.20 121.91 2pr6 s ILE 39 Ca 0.66 1.31 0.06 0.00 0.00 0.00 0.00 60.65 62.68 2pr6 s ILE 39 Cb -0.20 -3.84 -0.07 0.00 0.01 0.00 0.00 42.46 38.36 2pr6 s ILE 39 CO 0.43 0.08 0.21 1.33 0.00 0.00 0.00 174.94 176.98 2pr6 n VAL 40 N 4.12 0.00 -3.75 2.92 0.24 0.44 -0.84 118.33 121.46 2pr6 n VAL 40 Ca 0.10 -0.30 -0.13 0.00 -2.04 0.00 0.00 64.34 61.97 2pr6 n VAL 40 Cb 0.45 0.83 -0.11 0.00 -1.47 0.00 0.00 33.84 33.55 2pr6 n VAL 40 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2pr6 s TYR 41 N -1.77 -0.39 -0.05 6.34 5.04 -1.05 -4.98 117.35 120.51 2pr6 s TYR 41 Ca 0.01 0.94 -0.04 0.00 -2.44 0.00 0.00 57.07 55.54 2pr6 s TYR 41 Cb 0.04 0.13 0.02 0.00 0.35 0.00 0.00 41.96 42.50 2pr6 s TYR 41 CO 0.24 -0.19 0.11 0.54 -1.34 0.00 0.00 175.55 174.91 2pr6 s VAL 42 N 0.23 -0.01 0.67 3.14 0.11 -1.26 -1.22 120.40 122.06 2pr6 s VAL 42 Ca -0.00 0.04 -0.02 0.00 -2.93 0.00 0.00 61.98 59.07 2pr6 s VAL 42 Cb -0.03 -0.17 0.09 0.00 -1.53 0.00 0.00 36.38 34.74 2pr6 s VAL 42 CO -0.00 0.02 0.94 0.54 -3.33 0.00 0.00 175.10 173.27 2pr6 s ASN 43 N 0.31 4.68 0.30 3.54 4.22 -0.74 -4.96 114.94 122.28 2pr6 s ASN 43 Ca -0.02 -0.06 0.10 0.00 -2.14 0.00 0.00 52.86 50.74 2pr6 s ASN 43 Cb -0.03 -0.51 0.45 0.00 1.28 0.00 0.00 41.25 42.43 2pr6 s ASN 43 CO -0.01 -1.62 1.67 1.56 -2.04 0.00 0.00 177.10 176.66 2pr6 h GLN 44 N -0.40 0.04 -0.82 3.55 1.08 -1.93 -2.71 115.11 113.93 2pr6 h GLN 44 Ca -0.40 -0.03 0.18 0.00 -1.45 0.00 0.00 58.65 56.95 2pr6 h GLN 44 Cb 1.28 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 28.61 2pr6 h GLN 44 CO 0.48 0.57 0.32 0.78 -0.95 0.00 0.00 178.83 180.02 2pr6 h GLY 45 N 1.57 1.30 1.57 3.46 0.00 -1.91 0.11 103.07 109.17 2pr6 h GLY 45 Ca -0.00 -0.13 -0.23 0.00 0.00 0.00 0.00 47.33 46.97 2pr6 h GLY 45 CO 0.07 -0.19 -0.95 -2.75 0.00 0.00 0.00 176.54 172.72 2pr6 h PHE 46 N 0.40 0.58 -0.42 5.60 3.57 -1.68 -1.80 116.94 123.18 2pr6 h PHE 46 Ca 0.48 -0.32 0.06 0.00 3.53 0.00 0.00 57.97 61.72 2pr6 h PHE 46 Cb 0.83 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 39.46 2pr6 h PHE 46 CO -0.18 1.14 0.13 0.28 -2.23 0.00 0.00 178.31 177.45 2pr6 h VAL 47 N 0.21 0.84 -0.38 1.41 2.07 -1.11 -0.53 116.25 118.75 2pr6 h VAL 47 Ca -0.08 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2pr6 h VAL 47 Cb 1.59 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 2pr6 h VAL 47 CO 0.16 0.05 0.18 1.56 0.02 0.00 0.00 177.57 179.54 2pr6 h GLN 48 N 0.28 0.55 -0.60 1.57 4.20 -0.71 -1.60 115.11 118.80 2pr6 h GLN 48 Ca 0.20 -0.08 -0.10 0.00 0.06 0.00 0.00 58.65 58.72 2pr6 h GLN 48 Cb 0.21 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 2pr6 h GLN 48 CO -0.23 0.49 -0.03 1.98 -0.67 0.00 0.00 178.83 180.38 2pr6 h MET 49 N 0.47 1.08 0.00 1.46 4.05 -1.08 -3.29 114.93 117.61 2pr6 h MET 49 Ca 0.13 -0.36 -0.01 0.00 -0.28 0.00 0.00 59.70 59.18 2pr6 h MET 49 Cb 0.13 -0.09 -0.00 0.00 -0.80 0.00 0.00 31.60 30.84 2pr6 h MET 49 CO -0.02 1.06 -1.53 0.25 0.23 0.00 0.00 176.91 176.91 2pr6 n THR 50 N -4.17 0.34 -0.88 -0.77 -2.24 -0.23 -4.83 114.28 101.50 2pr6 n THR 50 Ca 0.03 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2pr6 n THR 50 Cb 0.37 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 2pr6 n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2pr6 n GLY 51 N 1.23 0.74 3.76 3.38 0.00 -0.61 -0.66 105.19 113.04 2pr6 n GLY 51 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 2pr6 n GLY 51 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pr6 s TYR 52 N -2.84 3.34 0.75 1.61 2.02 -1.24 -4.63 117.35 116.36 2pr6 s TYR 52 Ca 0.00 0.32 -0.11 0.00 -0.37 0.00 0.00 57.07 56.91 2pr6 s TYR 52 Cb 0.00 -1.86 0.04 0.00 -0.40 0.00 0.00 41.96 39.74 2pr6 s TYR 52 CO 0.00 0.56 1.09 -1.21 -1.57 0.00 0.00 175.55 174.42 2pr6 s GLU 53 N -0.88 2.49 0.23 -0.62 0.41 -1.26 -4.41 118.70 114.65 2pr6 s GLU 53 Ca 0.13 0.69 -0.07 0.00 -0.41 0.00 0.00 54.97 55.31 2pr6 s GLU 53 Cb -0.12 -1.96 0.29 0.00 -1.78 0.00 0.00 34.13 30.56 2pr6 s GLU 53 CO 0.03 -1.35 1.83 1.79 -0.49 0.00 0.00 175.26 177.07 2pr6 h THR 54 N -0.89 1.01 -0.17 3.63 1.35 -1.96 -0.52 112.91 115.35 2pr6 h THR 54 Ca -0.46 -0.29 0.05 0.00 -0.55 0.00 0.00 66.41 65.17 2pr6 h THR 54 Cb 1.25 0.10 -0.01 0.00 -1.73 0.00 0.00 68.15 67.76 2pr6 h THR 54 CO 0.60 0.15 0.16 -0.33 -0.25 0.00 0.00 175.52 175.84 2pr6 h GLU 55 N 0.83 0.00 -0.17 4.72 5.08 -1.93 0.30 114.58 123.41 2pr6 h GLU 55 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 2pr6 h GLU 55 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2pr6 h GLU 55 CO -0.18 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.22 2pr6 n GLU 56 N -4.08 1.86 -0.04 2.33 1.02 -0.22 -4.35 120.64 117.16 2pr6 n GLU 56 Ca 0.01 -1.29 -0.08 0.00 -0.02 0.00 0.00 57.16 55.79 2pr6 n GLU 56 Cb 0.28 -1.43 -0.03 0.00 -0.02 0.00 0.00 31.44 30.25 2pr6 n GLU 56 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2pr6 n ILE 57 N 0.52 0.41 -1.83 -3.67 5.41 -0.04 -4.90 119.36 115.25 2pr6 n ILE 57 Ca 0.17 -0.11 -0.41 0.00 1.00 0.00 0.00 62.75 63.40 2pr6 n ILE 57 Cb 0.38 -1.53 -0.01 0.00 -0.71 0.00 0.00 39.64 37.78 2pr6 n ILE 57 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2pr6 s LEU 58 N -6.32 4.34 0.00 1.39 1.43 -0.38 -1.65 118.68 117.48 2pr6 s LEU 58 Ca -0.10 2.99 0.00 0.00 -1.03 0.00 0.00 54.13 55.98 2pr6 s LEU 58 Cb 0.04 -3.66 0.00 0.00 0.03 0.00 0.00 46.19 42.60 2pr6 s LEU 58 CO 0.13 -0.85 0.00 0.61 0.23 0.00 0.00 176.35 176.48 2pr6 n GLY 59 N 0.89 2.40 3.91 -3.19 0.00 -0.02 -4.96 105.19 104.23 2pr6 n GLY 59 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 2pr6 n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pr6 s LYS 60 N -0.50 3.23 0.26 1.61 1.02 -0.66 -4.62 119.74 120.09 2pr6 s LYS 60 Ca 0.00 0.08 -0.21 0.00 0.02 0.00 0.00 55.97 55.86 2pr6 s LYS 60 Cb 0.00 -2.33 -0.09 0.00 -0.52 0.00 0.00 37.83 34.89 2pr6 s LYS 60 CO 0.00 -0.44 0.78 1.21 -0.92 0.00 0.00 175.35 175.98 2pr6 s ASN 61 N -4.20 7.10 0.42 2.83 3.84 -1.26 -0.99 114.94 122.68 2pr6 s ASN 61 Ca 0.51 1.52 0.29 0.00 0.21 0.00 0.00 52.86 55.38 2pr6 s ASN 61 Cb -0.10 -2.46 1.49 0.00 -0.55 0.00 0.00 41.25 39.63 2pr6 s ASN 61 CO 0.45 -0.02 1.87 0.00 -2.79 0.00 0.00 177.10 176.61 2pr6 n ARG 63 N -2.52 0.13 0.22 0.00 1.85 -1.26 -2.31 116.66 112.77 2pr6 n ARG 63 Ca -0.01 0.56 0.16 0.00 -1.00 0.00 0.00 57.85 57.55 2pr6 n ARG 63 Cb 0.09 -1.88 0.78 0.00 -1.05 0.00 0.00 32.46 30.40 2pr6 n ARG 63 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 2pr6 h PHE 64 N 0.00 0.00 -0.00 2.89 -0.00 -1.86 -1.17 116.94 116.80 2pr6 h PHE 64 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 2pr6 h PHE 64 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.05 2pr6 h PHE 64 CO 0.00 0.00 -0.03 1.28 -0.00 0.00 0.00 178.31 179.56 2pr6 n LEU 65 N -2.60 0.12 -4.91 2.10 4.77 -0.98 -4.90 117.00 110.59 2pr6 n LEU 65 Ca -0.01 0.21 -0.27 0.00 -0.03 0.00 0.00 56.01 55.90 2pr6 n LEU 65 Cb 0.11 -0.25 0.08 0.00 -2.33 0.00 0.00 43.42 41.02 2pr6 n LEU 65 CO 0.16 0.02 0.70 -1.10 -1.33 0.00 0.00 177.39 175.85 2pr6 s GLN 66 N -2.53 2.12 0.00 3.23 -0.21 -0.44 -0.35 119.66 121.47 2pr6 s GLN 66 Ca 0.29 -0.05 0.00 0.00 0.02 0.00 0.00 55.36 55.62 2pr6 s GLN 66 Cb 0.20 -2.06 0.00 0.00 1.00 0.00 0.00 33.01 32.15 2pr6 s GLN 66 CO 0.46 -1.39 0.00 0.41 -2.12 0.00 0.00 175.29 172.65 2pr6 n GLY 67 N -3.11 1.01 0.25 3.09 0.00 -1.26 -4.78 105.19 100.39 2pr6 n GLY 67 Ca 0.08 -0.67 0.03 0.00 0.00 0.00 0.00 46.02 45.45 2pr6 n GLY 67 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2pr6 h LYS 68 N 0.00 0.22 -0.56 1.61 3.64 -1.97 -0.90 116.57 118.61 2pr6 h LYS 68 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2pr6 h LYS 68 Cb 0.00 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2pr6 h LYS 68 CO 0.00 0.14 0.00 0.72 -2.27 0.00 0.00 179.45 178.04 2pr6 n HIS 69 N -5.18 0.82 -2.18 1.91 8.25 -1.26 -4.85 115.22 112.73 2pr6 n HIS 69 Ca 0.11 -0.38 -0.43 0.00 -0.26 0.00 0.00 57.72 56.76 2pr6 n HIS 69 Cb 0.38 -0.05 -0.02 0.00 1.12 0.00 0.00 29.99 31.41 2pr6 n HIS 69 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2pr6 s THR 70 N -1.42 3.83 -0.24 1.59 2.01 -0.34 -4.62 115.64 116.45 2pr6 s THR 70 Ca 0.36 0.97 -0.29 0.00 0.31 0.00 0.00 61.69 63.04 2pr6 s THR 70 Cb 0.20 -3.74 -0.00 0.00 0.01 0.00 0.00 72.50 68.97 2pr6 s THR 70 CO 0.23 -0.21 1.21 -0.62 -0.69 0.00 0.00 174.62 174.54 2pr6 s ASP 71 N 3.38 6.89 0.53 3.53 -1.08 -1.26 -4.91 116.67 123.74 2pr6 s ASP 71 Ca 0.67 1.40 0.30 0.00 -0.52 0.00 0.00 52.55 54.39 2pr6 s ASP 71 Cb -0.26 -2.54 1.45 0.00 -1.46 0.00 0.00 42.92 40.11 2pr6 s ASP 71 CO 0.26 -0.86 1.91 -0.65 0.52 0.00 0.00 175.17 176.35 2pr6 h PRO 72 N 8.39 0.02 -0.73 4.34 0.11 -1.96 0.01 132.00 142.16 2pr6 h PRO 72 Ca -0.24 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.90 2pr6 h PRO 72 Cb 1.09 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 2pr6 h PRO 72 CO 1.00 0.01 0.46 0.00 -0.21 0.00 0.00 178.00 179.26 2pr6 h ALA 73 N 1.60 0.96 -0.10 -0.75 0.00 -1.99 0.15 119.26 119.13 2pr6 h ALA 73 Ca 0.38 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 55.07 2pr6 h ALA 73 Cb 1.52 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2pr6 h ALA 73 CO -0.01 0.24 -0.76 0.93 0.00 0.00 0.00 179.25 179.64 2pr6 h GLU 74 N 0.89 0.55 -0.62 0.00 4.39 -1.39 -1.59 114.58 116.82 2pr6 h GLU 74 Ca 0.30 -0.46 0.05 0.00 0.34 0.00 0.00 59.36 59.59 2pr6 h GLU 74 Cb 0.03 0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 28.73 2pr6 h GLU 74 CO -0.12 1.09 0.34 0.28 -1.16 0.00 0.00 179.01 179.44 2pr6 h VAL 75 N 0.37 0.98 -0.38 3.13 2.07 -1.28 -2.00 116.25 119.14 2pr6 h VAL 75 Ca -0.04 -0.22 0.06 0.00 0.82 0.00 0.00 66.70 67.32 2pr6 h VAL 75 Cb 1.36 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.36 2pr6 h VAL 75 CO 0.14 0.12 0.04 0.44 0.02 0.00 0.00 177.57 178.33 2pr6 h ASP 76 N 0.65 -0.07 -0.58 0.57 3.32 -0.79 0.02 116.42 119.54 2pr6 h ASP 76 Ca 0.27 0.08 0.05 0.00 0.02 0.00 0.00 57.03 57.45 2pr6 h ASP 76 Cb 0.14 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.76 2pr6 h ASP 76 CO -0.16 -0.00 0.31 0.78 -1.72 0.00 0.00 179.24 178.45 2pr6 h ASN 77 N 0.15 0.46 -0.15 6.45 2.35 -0.84 0.08 115.58 124.09 2pr6 h ASN 77 Ca 0.19 0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 2pr6 h ASN 77 Cb 0.24 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 2pr6 h ASN 77 CO -0.28 0.31 0.01 0.40 -1.65 0.00 0.00 177.43 176.22 2pr6 h ILE 78 N 0.59 1.23 -0.48 2.81 2.04 -1.08 -2.43 117.51 120.19 2pr6 h ILE 78 Ca 0.26 -0.76 0.03 0.00 1.00 0.00 0.00 64.86 65.39 2pr6 h ILE 78 Cb 0.15 1.45 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 2pr6 h ILE 78 CO -0.16 0.22 0.26 -0.09 0.00 0.00 0.00 178.15 178.38 2pr6 h ARG 79 N 0.02 0.50 -0.53 2.37 2.43 -0.63 -1.61 114.38 116.91 2pr6 h ARG 79 Ca 0.04 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2pr6 h ARG 79 Cb 0.33 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 2pr6 h ARG 79 CO 0.00 0.33 0.30 1.15 -1.51 0.00 0.00 179.97 180.24 2pr6 h THR 80 N 0.51 1.18 -0.44 0.20 2.02 -0.98 -1.44 112.91 113.95 2pr6 h THR 80 Ca 0.20 -0.43 -0.09 0.00 0.77 0.00 0.00 66.41 66.86 2pr6 h THR 80 Cb 0.08 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 2pr6 h THR 80 CO -0.13 0.19 -0.07 0.00 0.37 0.00 0.00 175.52 175.88 2pr6 h ALA 81 N 1.13 0.61 -0.34 6.16 0.00 -0.98 -0.57 119.26 125.27 2pr6 h ALA 81 Ca 0.19 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2pr6 h ALA 81 Cb 0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2pr6 h ALA 81 CO -0.03 0.46 0.12 -0.07 0.00 0.00 0.00 179.25 179.73 2pr6 h LEU 82 N 0.67 0.49 -0.94 0.00 3.38 -1.24 0.13 115.31 117.80 2pr6 h LEU 82 Ca 0.12 -0.19 0.12 0.00 0.09 0.00 0.00 57.88 58.01 2pr6 h LEU 82 Cb 0.60 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.14 2pr6 h LEU 82 CO 0.04 0.55 0.57 -0.61 0.09 0.00 0.00 178.44 179.07 2pr6 h GLN 83 N 0.40 0.88 -0.00 1.13 5.75 -1.03 -1.47 115.11 120.76 2pr6 h GLN 83 Ca 0.11 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 2pr6 h GLN 83 Cb 0.23 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.58 2pr6 h GLN 83 CO -0.01 0.58 -0.03 0.09 -2.65 0.00 0.00 178.83 176.82 2pr6 n ASN 84 N -4.68 0.16 -3.68 -0.69 3.02 -0.24 -4.94 115.26 104.20 2pr6 n ASN 84 Ca 0.17 -0.53 -0.28 0.00 -0.03 0.00 0.00 54.58 53.92 2pr6 n ASN 84 Cb 0.34 -0.15 0.04 0.00 -0.61 0.00 0.00 39.78 39.40 2pr6 n ASN 84 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2pr6 n LYS 85 N -1.08 -2.18 -4.16 3.52 4.81 -0.20 -5.02 118.16 113.85 2pr6 n LYS 85 Ca 0.17 0.51 -0.17 0.00 -0.87 0.00 0.00 58.31 57.95 2pr6 n LYS 85 Cb 0.22 -4.50 -0.12 0.00 0.02 0.00 0.00 35.03 30.65 2pr6 n LYS 85 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2pr6 s GLU 86 N -5.92 0.79 0.71 1.64 0.41 0.29 -4.89 118.70 111.73 2pr6 s GLU 86 Ca 0.33 -0.95 -0.14 0.00 -0.41 0.00 0.00 54.97 53.81 2pr6 s GLU 86 Cb -0.11 -0.74 0.03 0.00 -1.78 0.00 0.00 34.13 31.53 2pr6 s GLU 86 CO 0.85 0.16 1.14 -2.14 -0.49 0.00 0.00 175.26 174.78 2pr6 s PRO 87 N -1.79 2.41 -0.03 0.39 0.02 -1.26 -4.42 135.00 130.31 2pr6 s PRO 87 Ca -0.02 1.49 -0.14 0.00 0.02 0.00 0.00 61.00 62.34 2pr6 s PRO 87 Cb -0.10 -1.89 0.02 0.00 0.02 0.00 0.00 34.50 32.56 2pr6 s PRO 87 CO 0.02 -1.57 0.31 0.54 -0.33 0.00 0.00 177.00 175.97 2pr6 s VAL 88 N -2.31 0.05 -0.04 3.83 0.11 -0.42 -4.98 120.40 116.63 2pr6 s VAL 88 Ca 0.69 -0.40 0.03 0.00 -2.93 0.00 0.00 61.98 59.37 2pr6 s VAL 88 Cb -0.23 -0.59 0.01 0.00 -1.53 0.00 0.00 36.38 34.04 2pr6 s VAL 88 CO 0.45 -0.22 -0.12 -0.89 -3.33 0.00 0.00 175.10 171.00 2pr6 s THR 89 N -1.07 1.03 0.17 5.04 2.01 -1.26 -0.98 115.64 120.58 2pr6 s THR 89 Ca -0.11 -0.47 0.03 0.00 0.31 0.00 0.00 61.69 61.45 2pr6 s THR 89 Cb -0.05 -0.92 -0.05 0.00 0.01 0.00 0.00 72.50 71.50 2pr6 s THR 89 CO 0.04 0.32 -0.03 0.68 -0.69 0.00 0.00 174.62 174.93 2pr6 s VAL 90 N 0.32 0.91 -0.28 3.82 -7.23 0.03 -4.99 120.40 112.99 2pr6 s VAL 90 Ca -0.07 -2.01 -0.07 0.00 -1.81 0.00 0.00 61.98 58.02 2pr6 s VAL 90 Cb -0.12 -2.07 -0.01 0.00 0.56 0.00 0.00 36.38 34.75 2pr6 s VAL 90 CO 0.02 -0.54 0.08 -1.10 -0.31 0.00 0.00 175.10 173.24 2pr6 s GLN 91 N -3.85 3.36 0.05 4.82 -0.21 -1.26 -0.60 119.66 121.97 2pr6 s GLN 91 Ca 0.22 -0.68 0.05 0.00 0.02 0.00 0.00 55.36 54.97 2pr6 s GLN 91 Cb 0.05 -3.36 -0.02 0.00 1.00 0.00 0.00 33.01 30.68 2pr6 s GLN 91 CO 0.04 -0.33 -0.13 -1.50 -2.12 0.00 0.00 175.29 171.24 2pr6 s ILE 92 N 1.56 1.05 -0.08 1.08 2.07 0.02 -4.95 121.20 121.95 2pr6 s ILE 92 Ca 0.05 -1.05 -0.26 0.00 -1.41 0.00 0.00 60.65 57.98 2pr6 s ILE 92 Cb -0.16 -0.97 -0.03 0.00 0.13 0.00 0.00 42.46 41.43 2pr6 s ILE 92 CO 0.03 -0.07 0.82 -1.10 -1.91 0.00 0.00 174.94 172.71 2pr6 s GLN 93 N -1.28 4.43 0.38 3.50 -0.21 -1.26 -0.91 119.66 124.32 2pr6 s GLN 93 Ca -0.00 1.08 0.04 0.00 0.02 0.00 0.00 55.36 56.50 2pr6 s GLN 93 Cb -0.08 -3.49 -0.03 0.00 1.00 0.00 0.00 33.01 30.41 2pr6 s GLN 93 CO 0.01 -0.09 0.12 -0.80 -2.12 0.00 0.00 175.29 172.42 2pr6 s ASN 94 N 0.97 2.55 -0.02 5.90 0.02 -0.18 -4.32 114.94 119.86 2pr6 s ASN 94 Ca 0.42 -1.61 0.02 0.00 -1.02 0.00 0.00 52.86 50.67 2pr6 s ASN 94 Cb -0.18 0.40 -0.00 0.00 0.02 0.00 0.00 41.25 41.49 2pr6 s ASN 94 CO 0.19 -0.88 -0.08 -0.31 0.02 0.00 0.00 177.10 176.04 2pr6 s TYR 95 N -3.28 0.81 0.69 2.20 2.02 0.52 -0.46 117.35 119.85 2pr6 s TYR 95 Ca 0.27 -0.18 -0.11 0.00 -0.37 0.00 0.00 57.07 56.69 2pr6 s TYR 95 Cb 0.04 -0.56 0.00 0.00 -0.40 0.00 0.00 41.96 41.04 2pr6 s TYR 95 CO 0.15 -0.06 1.07 0.15 -1.57 0.00 0.00 175.55 175.29 2pr6 s LYS 96 N 0.03 3.02 0.37 -0.62 1.02 -0.09 -4.82 119.74 118.65 2pr6 s LYS 96 Ca -0.00 0.64 0.15 0.00 0.02 0.00 0.00 55.97 56.78 2pr6 s LYS 96 Cb -0.06 -2.02 1.02 0.00 -0.52 0.00 0.00 37.83 36.24 2pr6 s LYS 96 CO -0.00 -0.96 1.77 -0.22 -0.92 0.00 0.00 175.35 175.01 2pr6 h LYS 97 N -0.61 0.46 0.00 1.68 3.64 -1.15 0.10 116.57 120.70 2pr6 h LYS 97 Ca -0.45 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2pr6 h LYS 97 Cb 1.23 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2pr6 h LYS 97 CO 0.62 0.30 0.00 -0.40 -2.27 0.00 0.00 179.45 177.70 2pr6 n ASP 98 N -4.69 0.00 0.00 4.20 5.75 -1.26 -4.87 116.55 115.67 2pr6 n ASP 98 Ca 0.25 -1.53 0.00 0.00 -0.01 0.00 0.00 54.79 53.50 2pr6 n ASP 98 Cb 0.81 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.90 2pr6 n ASP 98 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pr6 n GLY 99 N 0.69 1.35 3.80 6.12 0.00 0.35 -5.05 105.19 112.45 2pr6 n GLY 99 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 2pr6 n GLY 99 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pr6 s THR 100 N -2.90 4.05 0.06 2.61 -4.23 -1.26 -4.71 115.64 109.27 2pr6 s THR 100 Ca 0.00 1.36 -0.15 0.00 -1.18 0.00 0.00 61.69 61.72 2pr6 s THR 100 Cb 0.00 -3.60 -0.06 0.00 1.34 0.00 0.00 72.50 70.18 2pr6 s THR 100 CO 0.00 -0.19 0.48 -0.32 -0.54 0.00 0.00 174.62 174.05 2pr6 s MET 101 N -2.97 3.98 0.08 3.99 1.75 -1.26 -0.91 119.30 123.95 2pr6 s MET 101 Ca 0.62 0.48 0.05 0.00 -1.25 0.00 0.00 55.69 55.59 2pr6 s MET 101 Cb -0.15 -3.14 -0.03 0.00 2.84 0.00 0.00 34.83 34.36 2pr6 s MET 101 CO 0.19 0.62 -0.13 -0.59 -0.65 0.00 0.00 175.02 174.46 2pr6 s PHE 102 N -1.21 1.16 -0.20 4.11 -0.71 0.39 -4.94 117.98 116.59 2pr6 s PHE 102 Ca 0.29 -0.51 -0.22 0.00 -1.04 0.00 0.00 56.93 55.46 2pr6 s PHE 102 Cb -0.17 -0.65 -0.02 0.00 -1.21 0.00 0.00 43.02 40.97 2pr6 s PHE 102 CO 0.17 0.05 0.67 -1.58 -1.34 0.00 0.00 175.22 173.19 2pr6 s TRP 103 N -1.57 3.37 -0.34 3.49 0.52 -1.26 -1.01 118.94 122.14 2pr6 s TRP 103 Ca -0.00 0.98 -0.05 0.00 0.02 0.00 0.00 56.10 57.05 2pr6 s TRP 103 Cb -0.08 -2.85 0.05 0.00 -1.15 0.00 0.00 33.47 29.44 2pr6 s TRP 103 CO 0.02 -0.21 0.10 1.21 0.02 0.00 0.00 176.95 178.09 2pr6 s ASN 104 N 1.22 5.22 -0.55 2.95 3.84 -0.08 -0.73 114.94 126.81 2pr6 s ASN 104 Ca 0.30 -1.29 -0.26 0.00 0.21 0.00 0.00 52.86 51.82 2pr6 s ASN 104 Cb -0.16 -1.83 0.03 0.00 -0.55 0.00 0.00 41.25 38.74 2pr6 s ASN 104 CO 0.10 -0.35 1.06 -0.70 -2.79 0.00 0.00 177.10 174.42 2pr6 s GLU 105 N 1.34 3.45 -0.17 0.43 2.12 0.51 -0.79 118.70 125.59 2pr6 s GLU 105 Ca -0.01 0.04 -0.02 0.00 0.36 0.00 0.00 54.97 55.34 2pr6 s GLU 105 Cb -0.20 -4.02 -0.02 0.00 0.26 0.00 0.00 34.13 30.16 2pr6 s GLU 105 CO 0.01 -1.53 -0.08 -1.17 -0.54 0.00 0.00 175.26 171.95 2pr6 s LEU 106 N 4.38 2.92 -0.11 2.70 2.96 0.23 -1.45 118.68 130.30 2pr6 s LEU 106 Ca 0.37 -0.29 0.03 0.00 -0.22 0.00 0.00 54.13 54.02 2pr6 s LEU 106 Cb -0.10 -1.70 0.01 0.00 0.50 0.00 0.00 46.19 44.90 2pr6 s LEU 106 CO 0.23 0.11 -0.21 0.21 -1.32 0.00 0.00 176.35 175.37 2pr6 s ASN 107 N 0.71 2.92 -0.09 3.68 2.47 -0.61 -0.79 114.94 123.23 2pr6 s ASN 107 Ca -0.04 -0.54 0.03 0.00 0.42 0.00 0.00 52.86 52.73 2pr6 s ASN 107 Cb -0.15 -1.34 0.01 0.00 -1.45 0.00 0.00 41.25 38.32 2pr6 s ASN 107 CO 0.02 0.10 -0.17 -0.63 -3.72 0.00 0.00 177.10 172.70 2pr6 s ILE 108 N 0.64 1.57 0.04 -5.21 1.01 -0.16 -0.44 121.20 118.65 2pr6 s ILE 108 Ca -0.12 -0.72 0.08 0.00 0.00 0.00 0.00 60.65 59.89 2pr6 s ILE 108 Cb -0.16 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.87 2pr6 s ILE 108 CO 0.03 0.45 -0.21 -1.81 0.00 0.00 0.00 174.94 173.40 2pr6 s ASP 109 N 0.67 3.58 0.66 3.58 1.01 -0.38 -1.30 116.67 124.49 2pr6 s ASP 109 Ca -0.13 -0.48 -0.13 0.00 0.71 0.00 0.00 52.55 52.52 2pr6 s ASP 109 Cb -0.16 -0.50 -0.01 0.00 1.01 0.00 0.00 42.92 43.26 2pr6 s ASP 109 CO 0.03 0.26 1.06 -2.16 0.21 0.00 0.00 175.17 174.57 2pr6 s PRO 110 N -1.35 3.08 0.13 8.23 0.04 -1.26 -0.87 135.00 143.01 2pr6 s PRO 110 Ca 0.13 1.04 -0.11 0.00 0.04 0.00 0.00 61.00 62.11 2pr6 s PRO 110 Cb -0.10 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2pr6 s PRO 110 CO 0.04 -0.99 0.29 0.00 0.04 0.00 0.00 177.00 176.38 2pr6 s MET 111 N -4.69 1.04 -0.14 4.56 0.23 0.93 -4.84 119.30 116.39 2pr6 s MET 111 Ca 0.60 -0.99 0.01 0.00 -1.03 0.00 0.00 55.69 54.28 2pr6 s MET 111 Cb -0.15 0.39 0.02 0.00 -1.53 0.00 0.00 34.83 33.56 2pr6 s MET 111 CO 0.48 -0.37 -0.17 -1.21 -2.03 0.00 0.00 175.02 171.72 2pr6 s GLU 112 N -3.89 2.58 -0.16 3.16 0.41 -1.26 -1.02 118.70 118.52 2pr6 s GLU 112 Ca 0.09 -0.68 0.00 0.00 -0.41 0.00 0.00 54.97 53.98 2pr6 s GLU 112 Cb 0.03 -2.22 0.03 0.00 -1.78 0.00 0.00 34.13 30.19 2pr6 s GLU 112 CO -0.06 -0.15 -0.13 0.42 -0.49 0.00 0.00 175.26 174.85 2pr6 s ILE 113 N 1.19 1.57 -1.35 -1.63 1.01 0.07 -4.77 121.20 117.29 2pr6 s ILE 113 Ca -0.00 -0.70 -0.06 0.00 0.00 0.00 0.00 60.65 59.89 2pr6 s ILE 113 Cb -0.14 -1.51 0.00 0.00 0.01 0.00 0.00 42.46 40.82 2pr6 s ILE 113 CO -0.07 0.40 0.48 -0.62 0.00 0.00 0.00 174.94 175.13 2pr6 n GLU 114 N 4.76 -2.61 -1.68 2.79 -0.58 -1.26 -1.55 120.64 120.51 2pr6 n GLU 114 Ca -0.16 0.38 -0.16 0.00 -0.42 0.00 0.00 57.16 56.79 2pr6 n GLU 114 Cb 0.49 -4.29 -0.05 0.00 -0.57 0.00 0.00 31.44 27.02 2pr6 n GLU 114 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2pr6 n ASP 115 N -2.88 -4.95 -4.16 1.62 8.00 -1.26 -5.00 116.55 107.92 2pr6 n ASP 115 Ca -0.26 0.30 -0.21 0.00 0.71 0.00 0.00 54.79 55.33 2pr6 n ASP 115 Cb 0.66 -3.94 -0.13 0.00 -0.02 0.00 0.00 41.12 37.69 2pr6 n ASP 115 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2pr6 s LYS 116 N -3.74 1.01 0.04 -1.24 2.20 -0.59 -5.13 119.74 112.27 2pr6 s LYS 116 Ca 0.00 -0.80 -0.09 0.00 -0.36 0.00 0.00 55.97 54.71 2pr6 s LYS 116 Cb 0.00 -1.04 -0.05 0.00 -1.51 0.00 0.00 37.83 35.23 2pr6 s LYS 116 CO 0.00 0.26 0.35 -0.08 -0.36 0.00 0.00 175.35 175.51 2pr6 s THR 117 N -0.86 5.17 0.23 3.43 -1.32 -1.26 -0.75 115.64 120.27 2pr6 s THR 117 Ca 0.02 0.41 -0.03 0.00 -1.21 0.00 0.00 61.69 60.88 2pr6 s THR 117 Cb -0.08 -3.62 -0.03 0.00 -1.51 0.00 0.00 72.50 67.26 2pr6 s THR 117 CO 0.01 0.37 0.24 -0.31 -2.21 0.00 0.00 174.62 172.73 2pr6 s TYR 118 N -1.30 1.01 -0.02 9.09 2.02 -0.19 -4.47 117.35 123.49 2pr6 s TYR 118 Ca 0.29 -1.24 0.04 0.00 -0.37 0.00 0.00 57.07 55.80 2pr6 s TYR 118 Cb -0.14 -0.37 -0.03 0.00 -0.40 0.00 0.00 41.96 41.02 2pr6 s TYR 118 CO 0.16 -0.77 -0.14 -0.06 -1.57 0.00 0.00 175.55 173.18 2pr6 s PHE 119 N -4.02 2.70 -0.10 2.71 0.08 -1.00 -0.05 117.98 118.31 2pr6 s PHE 119 Ca 0.35 -0.16 0.03 0.00 0.12 0.00 0.00 56.93 57.27 2pr6 s PHE 119 Cb 0.04 -1.58 -0.01 0.00 -0.57 0.00 0.00 43.02 40.90 2pr6 s PHE 119 CO 0.13 0.24 -0.19 0.54 -0.10 0.00 0.00 175.22 175.83 2pr6 s VAL 120 N -0.83 2.51 -0.04 -0.44 0.11 -0.05 -1.24 120.40 120.43 2pr6 s VAL 120 Ca 0.13 -0.87 0.06 0.00 -2.93 0.00 0.00 61.98 58.37 2pr6 s VAL 120 Cb -0.11 -1.99 -0.02 0.00 -1.53 0.00 0.00 36.38 32.73 2pr6 s VAL 120 CO 0.03 0.55 -0.21 -0.83 -3.33 0.00 0.00 175.10 171.31 2pr6 s GLY 121 N 0.12 1.38 -0.16 6.54 0.00 0.33 -1.24 107.32 114.27 2pr6 s GLY 121 Ca -0.10 -1.05 0.01 0.00 0.00 0.00 0.00 44.72 43.58 2pr6 s GLY 121 CO 0.06 -0.83 -0.20 -0.42 0.00 0.00 0.00 173.10 171.71 2pr6 s ILE 122 N -0.61 2.00 -0.17 0.90 1.01 0.41 -1.45 121.20 123.30 2pr6 s ILE 122 Ca 0.09 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.82 2pr6 s ILE 122 Cb -0.11 -1.80 -0.01 0.00 0.01 0.00 0.00 42.46 40.56 2pr6 s ILE 122 CO 0.00 0.53 -0.12 -1.10 0.00 0.00 0.00 174.94 174.25 2pr6 s GLN 123 N 1.18 3.29 -0.15 2.79 1.11 0.22 -1.57 119.66 126.53 2pr6 s GLN 123 Ca 0.02 -0.70 0.02 0.00 0.01 0.00 0.00 55.36 54.70 2pr6 s GLN 123 Cb -0.14 -2.72 0.01 0.00 -1.01 0.00 0.00 33.01 29.15 2pr6 s GLN 123 CO -0.10 -0.00 -0.21 -0.80 0.01 0.00 0.00 175.29 174.19 2pr6 s ASN 124 N 0.90 3.21 -0.46 5.90 0.01 -0.53 -0.70 114.94 123.27 2pr6 s ASN 124 Ca -0.03 -0.59 -0.29 0.00 -0.71 0.00 0.00 52.86 51.25 2pr6 s ASN 124 Cb -0.15 -1.47 0.02 0.00 0.41 0.00 0.00 41.25 40.06 2pr6 s ASN 124 CO -0.01 0.07 1.28 -0.62 -1.51 0.00 0.00 177.10 176.32 2pr6 s ASP 125 N 0.87 6.45 -0.21 -1.22 2.15 -1.26 -0.36 116.67 123.09 2pr6 s ASP 125 Ca -0.06 0.60 0.14 0.00 0.43 0.00 0.00 52.55 53.66 2pr6 s ASP 125 Cb -0.15 -2.55 0.49 0.00 -0.30 0.00 0.00 42.92 40.41 2pr6 s ASP 125 CO -0.03 -1.38 1.40 2.30 -0.17 0.00 0.00 175.17 177.29 2pr6 n ILE 126 N 6.96 2.32 -0.08 4.11 -5.35 0.09 -4.79 119.36 122.62 2pr6 n ILE 126 Ca 0.14 -2.24 -0.07 0.00 -0.27 0.00 0.00 62.75 60.31 2pr6 n ILE 126 Cb 0.49 -0.28 -0.00 0.00 -1.74 0.00 0.00 39.64 38.11 2pr6 n ILE 126 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2pr6 h THR 127 N 1.27 0.80 -0.46 7.28 2.02 -1.90 -0.78 112.91 121.14 2pr6 h THR 127 Ca 0.07 -0.03 -0.12 0.00 0.77 0.00 0.00 66.41 67.10 2pr6 h THR 127 Cb 1.45 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 2pr6 h THR 127 CO 0.24 0.02 -0.19 0.11 0.37 0.00 0.00 175.52 176.07 2pr6 h LYS 128 N 0.10 0.92 -0.95 6.66 1.57 -1.94 -2.05 116.57 120.88 2pr6 h LYS 128 Ca 0.14 -0.37 0.02 0.00 -1.87 0.00 0.00 60.65 58.56 2pr6 h LYS 128 Cb 0.18 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.40 2pr6 h LYS 128 CO -0.23 1.03 0.63 0.37 -0.57 0.00 0.00 179.45 180.68 2pr6 h GLN 129 N 0.80 1.22 -0.51 3.15 4.15 -1.81 -0.79 115.11 121.31 2pr6 h GLN 129 Ca 0.11 -0.07 -0.11 0.00 0.77 0.00 0.00 58.65 59.35 2pr6 h GLN 129 Cb 0.75 -0.28 -0.02 0.00 0.21 0.00 0.00 27.48 28.14 2pr6 h GLN 129 CO 0.06 0.81 -0.10 0.87 -1.93 0.00 0.00 178.83 178.54 2pr6 h LYS 130 N 1.26 0.98 -0.25 1.69 1.57 -0.96 0.13 116.57 120.99 2pr6 h LYS 130 Ca 0.36 -0.36 0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2pr6 h LYS 130 Cb -0.10 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 2pr6 h LYS 130 CO -0.09 1.03 0.06 0.93 -0.57 0.00 0.00 179.45 180.81 2pr6 h GLU 131 N 0.84 0.15 -0.48 3.15 5.08 -1.04 -1.44 114.58 120.84 2pr6 h GLU 131 Ca 0.13 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2pr6 h GLU 131 Cb 0.66 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 2pr6 h GLU 131 CO 0.05 0.10 0.21 1.88 -1.00 0.00 0.00 179.01 180.25 2pr6 h TYR 132 N 0.15 0.71 -0.76 4.33 0.05 -0.86 -2.68 116.97 117.91 2pr6 h TYR 132 Ca 0.11 -0.04 0.04 0.00 0.05 0.00 0.00 58.73 58.89 2pr6 h TYR 132 Cb 0.10 -0.21 -0.05 0.00 1.01 0.00 0.00 36.73 37.58 2pr6 h TYR 132 CO -0.15 0.58 0.47 0.93 -1.05 0.00 0.00 178.16 178.94 2pr6 h GLU 133 N 0.63 0.87 -0.62 4.88 5.08 -0.57 -1.88 114.58 122.96 2pr6 h GLU 133 Ca 0.16 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2pr6 h GLU 133 Cb 0.15 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 2pr6 h GLU 133 CO -0.02 0.57 0.36 -0.22 -1.00 0.00 0.00 179.01 178.71 2pr6 h LYS 134 N 0.89 0.85 -0.50 2.33 3.64 -1.00 -0.03 116.57 122.75 2pr6 h LYS 134 Ca 0.31 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.52 2pr6 h LYS 134 Cb 0.07 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 2pr6 h LYS 134 CO -0.13 0.62 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.55 2pr6 h LEU 135 N 0.84 0.90 -0.43 5.20 3.38 -1.15 -0.20 115.31 123.86 2pr6 h LEU 135 Ca 0.22 -0.33 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 2pr6 h LEU 135 Cb 0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2pr6 h LEU 135 CO -0.04 1.01 -0.10 -0.07 0.09 0.00 0.00 178.44 179.34 2pr6 h LEU 136 N 0.77 0.83 -0.12 1.67 4.07 -1.16 -0.48 115.31 120.89 2pr6 h LEU 136 Ca 0.14 -0.36 0.01 0.00 0.08 0.00 0.00 57.88 57.75 2pr6 h LEU 136 Cb 0.58 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.08 2pr6 h LEU 136 CO 0.03 0.99 0.04 -0.33 -1.08 0.00 0.00 178.44 178.10 2pr6 h GLU 137 N 0.65 0.10 -0.51 1.13 5.08 -0.88 -0.92 114.58 119.24 2pr6 h GLU 137 Ca 0.11 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.51 2pr6 h GLU 137 Cb 0.63 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.81 2pr6 h GLU 137 CO 0.04 0.07 0.25 -0.44 -1.00 0.00 0.00 179.01 177.93 2pr6 h ASP 138 N 0.10 0.35 -0.40 1.42 3.32 -0.95 -1.25 116.42 119.01 2pr6 h ASP 138 Ca 0.05 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 2pr6 h ASP 138 Cb 0.02 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 2pr6 h ASP 138 CO -0.04 0.24 0.05 0.28 -1.72 0.00 0.00 179.24 178.05 2pr6 h SER 139 N 0.48 0.72 -0.52 6.45 0.02 -0.90 -0.48 113.55 119.31 2pr6 h SER 139 Ca 0.22 -0.15 -0.09 0.00 -0.84 0.00 0.00 61.79 60.94 2pr6 h SER 139 Cb 0.15 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 2pr6 h SER 139 CO -0.17 0.75 -0.01 0.25 -1.14 0.00 0.00 176.83 176.51 2pr6 h LEU 140 N 0.72 0.95 -0.51 5.07 5.85 -0.82 0.20 115.31 126.76 2pr6 h LEU 140 Ca 0.15 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.53 2pr6 h LEU 140 Cb 0.36 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 2pr6 h LEU 140 CO 0.01 1.01 0.02 0.74 -0.34 0.00 0.00 178.44 179.88 2pr6 h THR 141 N 0.89 1.26 -0.02 1.05 2.02 -0.72 -1.81 112.91 115.58 2pr6 h THR 141 Ca 0.16 -1.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.28 2pr6 h THR 141 Cb 0.54 0.93 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2pr6 h THR 141 CO 0.03 0.37 -0.02 -0.33 0.37 0.00 0.00 175.52 175.94 2pr6 h GLU 142 N 0.76 0.05 -0.53 6.66 5.08 -0.77 -1.95 114.58 123.88 2pr6 h GLU 142 Ca 0.15 -0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.59 2pr6 h GLU 142 Cb 0.49 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.64 2pr6 h GLU 142 CO 0.02 0.51 -0.11 0.97 -1.00 0.00 0.00 179.01 179.40 2pr6 h ILE 143 N -0.40 0.49 -0.06 3.13 6.09 -0.62 -1.89 117.51 124.25 2pr6 h ILE 143 Ca 0.00 -0.01 -0.06 0.00 -1.37 0.00 0.00 64.86 63.43 2pr6 h ILE 143 Cb 0.49 0.47 -0.01 0.00 0.47 0.00 0.00 36.82 38.24 2pr6 h ILE 143 CO 0.00 0.00 -0.25 0.74 -3.07 0.00 0.00 178.15 175.58 2pr6 h THR 144 N 0.02 1.21 0.00 2.19 2.02 -1.22 -1.13 112.91 116.00 2pr6 h THR 144 Ca 0.26 -0.98 0.00 0.00 0.77 0.00 0.00 66.41 66.46 2pr6 h THR 144 Cb 0.40 1.45 0.00 0.00 -1.74 0.00 0.00 68.15 68.26 2pr6 h THR 144 CO -0.53 0.29 0.00 0.00 0.37 0.00 0.00 175.52 175.65 2pr6 h ALA 145 N 1.66 1.00 -3.00 6.16 0.00 -0.54 -3.44 119.26 121.09 2pr6 h ALA 145 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2pr6 h ALA 145 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2pr6 h ALA 145 CO 0.04 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.57 2pr6 n LEU 146 N -2.56 0.00 0.00 0.00 4.77 -0.43 -5.10 117.00 113.69 2pr6 n LEU 146 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2pr6 n LEU 146 Cb 0.28 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2pr6 n LEU 146 CO 0.23 0.00 0.18 -1.20 -1.33 0.00 0.00 177.39 175.27