#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edy n SER 2 N 0.00 -4.65 -4.31 1.61 7.64 -1.26 -4.78 113.62 107.87 2edy n SER 2 Ca 0.00 0.30 -0.39 0.00 1.01 0.00 0.00 58.87 59.80 2edy n SER 2 Cb 0.00 -0.89 0.02 0.00 -1.01 0.00 0.00 64.21 62.33 2edy n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2edy n SER 3 N 2.22 -2.90 0.00 6.43 2.88 -1.26 -4.88 113.62 116.10 2edy n SER 3 Ca 0.02 0.66 0.00 0.00 -1.33 0.00 0.00 58.87 58.22 2edy n SER 3 Cb 0.54 -0.95 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 2edy n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2edy n GLY 4 N 2.30 -0.16 0.21 0.46 0.00 -1.26 -4.96 105.19 101.78 2edy n GLY 4 Ca 0.09 -0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 2edy n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2edy h SER 5 N 0.00 -0.51 -4.18 1.61 0.87 -1.97 -3.42 113.55 105.95 2edy h SER 5 Ca 0.00 0.11 -0.46 0.00 -1.23 0.00 0.00 61.79 60.21 2edy h SER 5 Cb 0.00 0.27 0.12 0.00 -0.44 0.00 0.00 62.40 62.35 2edy h SER 5 CO 0.00 -0.19 0.37 -0.44 -0.53 0.00 0.00 176.83 176.04 2edy s SER 6 N -5.12 4.10 0.00 6.23 0.01 -1.26 -4.99 113.70 112.68 2edy s SER 6 Ca -0.14 0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.63 2edy s SER 6 Cb 0.12 -0.88 0.00 0.00 0.21 0.00 0.00 66.02 65.47 2edy s SER 6 CO 0.69 -2.12 0.00 0.61 0.41 0.00 0.00 173.24 172.83 2edy n GLY 7 N -3.38 1.14 3.77 3.44 0.00 -1.26 -4.74 105.19 104.17 2edy n GLY 7 Ca 0.11 -1.94 -0.40 0.00 0.00 0.00 0.00 46.02 43.80 2edy n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edy s PRO 8 N -2.17 4.27 -0.40 1.61 0.04 -1.26 -4.77 135.00 132.32 2edy s PRO 8 Ca 0.00 1.98 0.06 0.00 0.04 0.00 0.00 61.00 63.07 2edy s PRO 8 Cb 0.00 -2.92 0.62 0.00 0.04 0.00 0.00 34.50 32.24 2edy s PRO 8 CO 0.00 -0.18 1.77 -1.13 0.04 0.00 0.00 177.00 177.51 2edy n SER 9 N 0.55 3.34 -3.93 6.66 3.41 -1.26 -3.78 113.62 118.60 2edy n SER 9 Ca 0.02 -3.67 -0.08 0.00 -0.26 0.00 0.00 58.87 54.88 2edy n SER 9 Cb 0.44 -0.77 -0.04 0.00 -0.26 0.00 0.00 64.21 63.58 2edy n SER 9 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2edy s GLY 10 N -1.70 0.31 0.15 5.00 0.00 -1.26 -4.96 107.32 104.86 2edy s GLY 10 Ca 0.53 -0.67 0.07 0.00 0.00 0.00 0.00 44.72 44.65 2edy s GLY 10 CO 0.07 -0.43 -0.16 -0.11 0.00 0.00 0.00 173.10 172.47 2edy s PHE 11 N -3.96 1.64 1.19 1.90 -0.71 -1.26 -4.47 117.98 112.31 2edy s PHE 11 Ca 0.18 -0.52 -0.19 0.00 -1.04 0.00 0.00 56.93 55.37 2edy s PHE 11 Cb -0.03 -0.83 0.28 0.00 -1.21 0.00 0.00 43.02 41.24 2edy s PHE 11 CO 0.08 0.25 1.11 -1.25 -1.34 0.00 0.00 175.22 174.08 2edy s PRO 12 N -2.82 -1.16 0.38 1.99 0.04 -1.26 -4.65 135.00 127.52 2edy s PRO 12 Ca 0.14 -0.04 0.06 0.00 0.04 0.00 0.00 61.00 61.19 2edy s PRO 12 Cb -0.05 -1.60 -0.02 0.00 0.04 0.00 0.00 34.50 32.87 2edy s PRO 12 CO 0.05 -3.67 0.22 1.04 0.04 0.00 0.00 177.00 174.68 2edy n GLN 13 N -4.74 0.49 -2.31 4.56 1.13 -1.10 -4.86 117.38 110.55 2edy n GLN 13 Ca 0.13 -3.49 -0.18 0.00 -1.94 0.00 0.00 57.00 51.52 2edy n GLN 13 Cb 0.59 2.40 -0.01 0.00 0.11 0.00 0.00 30.24 33.34 2edy n GLN 13 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2edy n ASN 14 N -1.58 -5.15 -4.63 1.08 5.03 -1.26 -0.09 115.26 108.65 2edy n ASN 14 Ca 0.01 -0.01 -0.43 0.00 0.87 0.00 0.00 54.58 55.03 2edy n ASN 14 Cb 0.63 -4.23 -0.02 0.00 -1.02 0.00 0.00 39.78 35.14 2edy n ASN 14 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2edy s LEU 15 N -5.03 3.89 0.00 3.41 2.96 -1.26 -3.74 118.68 118.91 2edy s LEU 15 Ca 0.00 1.06 -0.15 0.00 -0.22 0.00 0.00 54.13 54.82 2edy s LEU 15 Cb 0.00 -3.54 0.05 0.00 0.50 0.00 0.00 46.19 43.20 2edy s LEU 15 CO 0.00 -0.98 0.72 0.00 -1.32 0.00 0.00 176.35 174.77 2edy n HIS 16 N 7.21 -1.23 -4.07 5.38 1.44 -1.22 -4.94 115.22 117.79 2edy n HIS 16 Ca 0.13 -0.96 -0.35 0.00 -2.01 0.00 0.00 57.72 54.53 2edy n HIS 16 Cb 0.47 0.47 -0.13 0.00 0.12 0.00 0.00 29.99 30.92 2edy n HIS 16 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2edy s VAL 17 N -2.22 3.95 -0.51 0.61 1.01 -1.26 -0.91 120.40 121.06 2edy s VAL 17 Ca 0.16 -0.31 0.24 0.00 0.00 0.00 0.00 61.98 62.06 2edy s VAL 17 Cb -0.02 -2.79 0.11 0.00 0.00 0.00 0.00 36.38 33.68 2edy s VAL 17 CO 0.04 0.43 1.35 0.00 0.00 0.00 0.00 175.10 176.92 2edy h THR 18 N 5.38 0.00 -0.24 3.92 1.03 -1.83 -3.43 112.91 117.73 2edy h THR 18 Ca -0.36 -0.70 -0.03 0.00 -0.01 0.00 0.00 66.41 65.31 2edy h THR 18 Cb 1.18 1.38 -0.15 0.00 -1.07 0.00 0.00 68.15 69.49 2edy h THR 18 CO 0.61 0.00 -0.17 0.61 -0.01 0.00 0.00 175.52 176.56 2edy n GLY 19 N 1.26 -1.52 3.54 2.99 0.00 -1.26 -5.07 105.19 105.12 2edy n GLY 19 Ca 0.03 1.11 -0.29 0.00 0.00 0.00 0.00 46.02 46.87 2edy n GLY 19 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2edy s LEU 20 N 0.72 0.77 0.05 0.99 2.34 -1.26 -3.28 118.68 119.01 2edy s LEU 20 Ca 0.25 1.21 -0.04 0.00 0.06 0.00 0.00 54.13 55.61 2edy s LEU 20 Cb 0.13 -3.12 -0.02 0.00 -0.56 0.00 0.00 46.19 42.62 2edy s LEU 20 CO -0.10 -4.02 0.06 -0.89 -1.06 0.00 0.00 176.35 170.33 2edy s THR 21 N -2.67 0.17 0.22 5.48 2.01 0.26 -4.77 115.64 116.34 2edy s THR 21 Ca 0.68 -1.41 -0.12 0.00 0.31 0.00 0.00 61.69 61.15 2edy s THR 21 Cb -0.20 -1.24 0.28 0.00 0.01 0.00 0.00 72.50 71.35 2edy s THR 21 CO 0.61 -0.78 1.61 0.71 -0.69 0.00 0.00 174.62 176.09 2edy h THR 22 N 3.27 0.30 0.00 -0.82 1.35 -1.92 -3.20 112.91 111.90 2edy h THR 22 Ca -0.33 -0.00 -0.37 0.00 -0.55 0.00 0.00 66.41 65.15 2edy h THR 22 Cb 1.17 0.30 -0.06 0.00 -1.73 0.00 0.00 68.15 67.83 2edy h THR 22 CO 0.58 0.00 -2.34 -0.24 -0.25 0.00 0.00 175.52 173.27 2edy n SER 23 N -5.46 2.04 -4.95 5.36 2.88 -1.26 -2.32 113.62 109.90 2edy n SER 23 Ca 0.09 0.03 -0.21 0.00 -1.33 0.00 0.00 58.87 57.45 2edy n SER 23 Cb 0.36 -0.49 0.04 0.00 -0.75 0.00 0.00 64.21 63.37 2edy n SER 23 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2edy s THR 24 N -2.46 2.64 -0.21 2.46 -4.23 -1.21 -1.41 115.64 111.23 2edy s THR 24 Ca -0.32 -0.73 -0.05 0.00 -1.18 0.00 0.00 61.69 59.41 2edy s THR 24 Cb 0.10 -2.91 0.10 0.00 1.34 0.00 0.00 72.50 71.13 2edy s THR 24 CO 0.50 0.00 0.39 -0.89 -0.54 0.00 0.00 174.62 174.08 2edy s THR 25 N -2.73 -0.61 0.69 3.99 2.01 -1.05 0.89 115.64 118.82 2edy s THR 25 Ca 0.58 0.09 -0.11 0.00 0.31 0.00 0.00 61.69 62.56 2edy s THR 25 Cb -0.10 -0.70 0.00 0.00 0.01 0.00 0.00 72.50 71.71 2edy s THR 25 CO 0.38 0.00 1.06 -1.61 -0.69 0.00 0.00 174.62 173.76 2edy s GLU 26 N 2.57 3.03 0.11 4.92 2.02 -1.21 0.85 118.70 131.00 2edy s GLU 26 Ca 0.04 0.81 -0.05 0.00 0.02 0.00 0.00 54.97 55.79 2edy s GLU 26 Cb -0.13 -2.01 -0.02 0.00 0.10 0.00 0.00 34.13 32.06 2edy s GLU 26 CO -0.14 -0.99 0.12 -0.51 0.02 0.00 0.00 175.26 173.76 2edy s LEU 27 N -5.44 1.67 -0.30 1.80 1.43 0.29 -4.10 118.68 114.02 2edy s LEU 27 Ca 0.57 -0.94 -0.05 0.00 -1.03 0.00 0.00 54.13 52.69 2edy s LEU 27 Cb -0.13 0.67 0.19 0.00 0.03 0.00 0.00 46.19 46.95 2edy s LEU 27 CO 0.54 -0.74 0.82 0.00 0.23 0.00 0.00 176.35 177.21 2edy s ALA 28 N -3.95 -3.02 0.46 4.21 0.00 -0.09 -3.57 121.76 115.81 2edy s ALA 28 Ca 0.14 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.55 2edy s ALA 28 Cb 0.06 -2.50 -0.02 0.00 0.00 0.00 0.00 23.12 20.66 2edy s ALA 28 CO -0.05 -1.66 0.08 1.67 0.00 0.00 0.00 175.76 175.80 2edy s TRP 29 N 2.90 1.81 0.27 0.00 -2.14 -0.57 -3.37 118.94 117.84 2edy s TRP 29 Ca 0.14 -1.16 0.10 0.00 2.66 0.00 0.00 56.10 57.84 2edy s TRP 29 Cb -0.10 -1.35 -0.05 0.00 -3.10 0.00 0.00 33.47 28.87 2edy s TRP 29 CO -0.20 -0.08 -0.15 -0.51 -2.66 0.00 0.00 176.95 173.36 2edy s ASP 30 N -3.74 3.22 0.90 -2.66 1.11 0.87 -4.66 116.67 111.72 2edy s ASP 30 Ca 0.15 -1.08 -0.12 0.00 0.18 0.00 0.00 52.55 51.68 2edy s ASP 30 Cb 0.02 -0.25 0.13 0.00 1.07 0.00 0.00 42.92 43.89 2edy s ASP 30 CO 0.09 -0.11 1.09 -2.16 1.18 0.00 0.00 175.17 175.26 2edy s PRO 31 N -3.59 1.20 0.20 8.23 0.04 -1.26 -2.70 135.00 137.12 2edy s PRO 31 Ca 0.28 0.80 -0.30 0.00 0.04 0.00 0.00 61.00 61.82 2edy s PRO 31 Cb -0.01 -1.80 -0.09 0.00 0.04 0.00 0.00 34.50 32.63 2edy s PRO 31 CO 0.13 -2.27 1.30 -1.25 0.04 0.00 0.00 177.00 174.94 2edy s PRO 32 N -4.94 4.40 0.12 0.56 0.04 -1.26 -4.35 135.00 129.57 2edy s PRO 32 Ca 0.64 2.05 -0.35 0.00 0.04 0.00 0.00 61.00 63.37 2edy s PRO 32 Cb -0.18 -3.19 -0.15 0.00 0.04 0.00 0.00 34.50 31.01 2edy s PRO 32 CO 0.57 -0.24 1.43 1.33 0.04 0.00 0.00 177.00 180.14 2edy n VAL 33 N 2.54 0.05 -0.48 -0.36 0.24 -1.26 -4.75 118.33 114.31 2edy n VAL 33 Ca 0.06 -0.01 0.38 0.00 -2.04 0.00 0.00 64.34 62.73 2edy n VAL 33 Cb 0.43 -1.13 0.61 0.00 -1.47 0.00 0.00 33.84 32.28 2edy n VAL 33 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2edy n LEU 34 N 2.86 0.09 -0.04 1.34 -0.00 -1.26 0.19 117.00 120.18 2edy n LEU 34 Ca 0.17 0.98 -0.11 0.00 -0.00 0.00 0.00 56.01 57.06 2edy n LEU 34 Cb 0.24 -0.49 -0.04 0.00 -0.00 0.00 0.00 43.42 43.13 2edy n LEU 34 CO 0.63 -1.03 0.88 0.00 -0.00 0.00 0.00 177.39 177.87 2edy h ALA 35 N 1.07 0.23 -1.86 1.47 0.00 -2.03 -3.28 119.26 114.86 2edy h ALA 35 Ca 0.75 -0.07 -0.79 0.00 0.00 0.00 0.00 54.91 54.79 2edy h ALA 35 Cb 2.70 -0.07 -0.25 0.00 0.00 0.00 0.00 17.79 20.17 2edy h ALA 35 CO -0.20 -0.22 0.99 0.39 0.00 0.00 0.00 179.25 180.21 2edy n GLU 36 N -4.89 4.00 -3.65 0.00 -0.58 0.51 -4.93 120.64 111.11 2edy n GLU 36 Ca -0.04 -4.28 -0.19 0.00 -0.42 0.00 0.00 57.16 52.23 2edy n GLU 36 Cb 0.09 -2.64 -0.17 0.00 -0.57 0.00 0.00 31.44 28.15 2edy n GLU 36 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2edy s ARG 37 N -1.46 -0.01 -0.27 3.49 0.52 -1.24 -4.44 118.95 115.54 2edy s ARG 37 Ca 0.34 0.38 0.01 0.00 -0.52 0.00 0.00 55.73 55.94 2edy s ARG 37 Cb 0.01 -0.62 0.34 0.00 0.52 0.00 0.00 34.95 35.20 2edy s ARG 37 CO 0.03 -0.38 1.62 -1.71 0.02 0.00 0.00 175.30 174.89 2edy n ASN 38 N 5.31 4.16 0.00 0.23 2.85 -1.26 -4.93 115.26 121.62 2edy n ASN 38 Ca -0.04 -2.95 0.00 0.00 -0.11 0.00 0.00 54.58 51.48 2edy n ASN 38 Cb 0.50 -0.77 0.00 0.00 1.24 0.00 0.00 39.78 40.75 2edy n ASN 38 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2edy n GLY 39 N -0.27 0.79 3.25 8.20 0.00 -1.26 -4.74 105.19 111.15 2edy n GLY 39 Ca 0.33 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.64 2edy n GLY 39 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2edy s ARG 40 N 0.00 1.13 -0.00 1.61 1.70 -1.26 -5.16 118.95 116.97 2edy s ARG 40 Ca 0.00 -1.55 0.03 0.00 -0.47 0.00 0.00 55.73 53.74 2edy s ARG 40 Cb 0.00 -0.26 -0.03 0.00 -0.57 0.00 0.00 34.95 34.08 2edy s ARG 40 CO 0.00 -0.14 -0.07 0.42 -1.08 0.00 0.00 175.30 174.42 2edy s ILE 41 N -3.67 3.60 0.00 4.99 -1.09 -1.26 -4.31 121.20 119.46 2edy s ILE 41 Ca 0.25 -0.76 0.00 0.00 -2.23 0.00 0.00 60.65 57.91 2edy s ILE 41 Cb 0.06 -2.55 0.00 0.00 -1.58 0.00 0.00 42.46 38.39 2edy s ILE 41 CO 0.05 0.42 0.00 2.30 -1.23 0.00 0.00 174.94 176.47 2edy n ILE 42 N 1.64 0.00 -3.79 2.92 -5.35 -0.64 -5.01 119.36 109.14 2edy n ILE 42 Ca -0.16 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.31 2edy n ILE 42 Cb 0.53 -0.83 0.00 0.00 -1.74 0.00 0.00 39.64 37.60 2edy n ILE 42 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2edy s SER 43 N -3.34 -0.07 0.08 7.28 0.15 -1.25 -4.74 113.70 111.80 2edy s SER 43 Ca 0.00 -0.41 0.04 0.00 0.70 0.00 0.00 55.95 56.28 2edy s SER 43 Cb 0.00 0.38 -0.03 0.00 -1.71 0.00 0.00 66.02 64.66 2edy s SER 43 CO 0.00 -0.73 -0.11 -0.31 1.20 0.00 0.00 173.24 173.29 2edy s TYR 44 N -2.60 1.01 -0.27 3.44 1.51 -1.11 -0.97 117.35 118.37 2edy s TYR 44 Ca 0.17 -0.58 -0.03 0.00 -1.01 0.00 0.00 57.07 55.63 2edy s TYR 44 Cb -0.00 -0.57 0.02 0.00 -0.11 0.00 0.00 41.96 41.30 2edy s TYR 44 CO 0.02 -0.01 -0.02 0.99 -1.11 0.00 0.00 175.55 175.42 2edy s THR 45 N -1.93 3.19 -0.64 -0.71 2.01 -0.93 -2.62 115.64 114.01 2edy s THR 45 Ca 0.00 -0.96 -0.21 0.00 0.31 0.00 0.00 61.69 60.83 2edy s THR 45 Cb -0.06 -2.64 0.08 0.00 0.01 0.00 0.00 72.50 69.89 2edy s THR 45 CO 0.01 0.14 0.88 -0.69 -0.69 0.00 0.00 174.62 174.26 2edy s VAL 46 N 1.37 4.50 -0.39 3.82 1.01 -0.49 -3.10 120.40 127.13 2edy s VAL 46 Ca 0.00 -0.60 -0.21 0.00 0.00 0.00 0.00 61.98 61.17 2edy s VAL 46 Cb -0.17 -4.62 0.01 0.00 0.00 0.00 0.00 36.38 31.60 2edy s VAL 46 CO -0.02 -1.35 0.68 -0.69 0.00 0.00 0.00 175.10 173.72 2edy s VAL 47 N 3.57 4.82 -0.08 2.92 1.01 -0.79 -1.27 120.40 130.57 2edy s VAL 47 Ca 0.19 0.51 0.04 0.00 0.00 0.00 0.00 61.98 62.72 2edy s VAL 47 Cb -0.19 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.03 2edy s VAL 47 CO 0.08 -0.45 -0.21 0.72 0.00 0.00 0.00 175.10 175.24 2edy s PHE 48 N 2.87 2.28 0.04 5.22 -0.71 0.46 -0.26 117.98 127.89 2edy s PHE 48 Ca 0.26 -0.87 -0.09 0.00 -1.04 0.00 0.00 56.93 55.18 2edy s PHE 48 Cb -0.14 -1.54 0.00 0.00 -1.21 0.00 0.00 43.02 40.14 2edy s PHE 48 CO 0.17 -0.35 0.19 0.50 -1.34 0.00 0.00 175.22 174.39 2edy s ARG 49 N 0.32 0.69 -0.48 1.99 3.52 -0.31 -1.84 118.95 122.83 2edy s ARG 49 Ca -0.15 -0.63 -0.25 0.00 -0.13 0.00 0.00 55.73 54.57 2edy s ARG 49 Cb -0.17 0.28 0.03 0.00 -1.56 0.00 0.00 34.95 33.54 2edy s ARG 49 CO 0.07 -0.20 0.90 0.16 -0.81 0.00 0.00 175.30 175.42 2edy s ASP 50 N -2.07 6.44 0.66 -2.12 1.47 -1.20 0.16 116.67 120.00 2edy s ASP 50 Ca -0.05 -0.04 0.40 0.00 1.18 0.00 0.00 52.55 54.04 2edy s ASP 50 Cb -0.01 -2.43 2.21 0.00 -0.34 0.00 0.00 42.92 42.35 2edy s ASP 50 CO -0.04 -1.07 2.28 0.16 0.68 0.00 0.00 175.17 177.18 2edy h ILE 51 N 6.05 0.08 -0.01 2.11 3.07 -1.92 0.33 117.51 127.22 2edy h ILE 51 Ca -0.25 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.16 2edy h ILE 51 Cb 1.08 0.94 0.00 0.00 -0.27 0.00 0.00 36.82 38.57 2edy h ILE 51 CO 1.03 0.00 -0.26 0.59 -1.05 0.00 0.00 178.15 178.45 2edy n ASN 52 N -3.18 1.42 -3.61 2.16 3.02 -1.26 -4.94 115.26 108.87 2edy n ASN 52 Ca -0.03 -1.17 -0.22 0.00 -0.03 0.00 0.00 54.58 53.14 2edy n ASN 52 Cb 0.13 0.19 -0.08 0.00 -0.61 0.00 0.00 39.78 39.42 2edy n ASN 52 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2edy s SER 53 N -2.41 2.10 -0.37 6.41 0.01 0.12 -5.06 113.70 114.50 2edy s SER 53 Ca 0.25 -1.74 0.06 0.00 1.31 0.00 0.00 55.95 55.83 2edy s SER 53 Cb 0.19 0.56 0.51 0.00 0.21 0.00 0.00 66.02 67.49 2edy s SER 53 CO 0.50 -1.03 1.55 0.00 0.41 0.00 0.00 173.24 174.67 2edy n GLN 54 N -0.74 2.32 -3.39 12.44 10.64 -1.26 -4.58 117.38 132.82 2edy n GLN 54 Ca 0.03 -3.37 -0.44 0.00 -1.83 0.00 0.00 57.00 51.38 2edy n GLN 54 Cb 0.63 -2.01 -0.07 0.00 -0.86 0.00 0.00 30.24 27.93 2edy n GLN 54 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 2edy s GLN 55 N -3.41 2.92 0.07 2.61 2.00 -1.26 -5.05 119.66 117.54 2edy s GLN 55 Ca 0.50 -1.50 -0.13 0.00 -2.00 0.00 0.00 55.36 52.23 2edy s GLN 55 Cb 0.43 -4.15 -0.06 0.00 0.80 0.00 0.00 33.01 30.03 2edy s GLN 55 CO 0.01 -1.13 0.45 -2.00 -0.50 0.00 0.00 175.29 172.12 2edy s GLU 56 N 1.59 3.90 -0.01 1.67 2.12 -1.26 -3.26 118.70 123.45 2edy s GLU 56 Ca 0.04 0.37 -0.18 0.00 0.36 0.00 0.00 54.97 55.56 2edy s GLU 56 Cb -0.26 -3.07 0.03 0.00 0.26 0.00 0.00 34.13 31.09 2edy s GLU 56 CO 0.05 0.59 0.38 -0.51 -0.54 0.00 0.00 175.26 175.23 2edy s LEU 57 N -1.59 0.55 0.10 2.70 1.43 -0.77 -5.01 118.68 116.09 2edy s LEU 57 Ca 0.31 0.18 -0.06 0.00 -1.03 0.00 0.00 54.13 53.53 2edy s LEU 57 Cb -0.15 1.53 -0.02 0.00 0.03 0.00 0.00 46.19 47.58 2edy s LEU 57 CO 0.17 -0.50 0.14 -1.10 0.23 0.00 0.00 176.35 175.29 2edy s GLN 58 N -1.46 0.87 0.25 1.70 -0.21 -1.26 -0.40 119.66 119.15 2edy s GLN 58 Ca -0.12 -1.13 -0.03 0.00 0.02 0.00 0.00 55.36 54.10 2edy s GLN 58 Cb -0.04 0.30 -0.02 0.00 1.00 0.00 0.00 33.01 34.25 2edy s GLN 58 CO 0.04 -0.26 0.29 -0.80 -2.12 0.00 0.00 175.29 172.44 2edy s ASN 59 N -2.92 0.43 -0.08 5.90 0.02 -0.40 -4.96 114.94 112.94 2edy s ASN 59 Ca 0.11 -1.35 -0.05 0.00 -1.02 0.00 0.00 52.86 50.55 2edy s ASN 59 Cb 0.06 0.50 0.03 0.00 0.02 0.00 0.00 41.25 41.86 2edy s ASN 59 CO -0.07 -1.02 0.19 -0.63 0.02 0.00 0.00 177.10 175.59 2edy s ILE 60 N -3.84 -0.03 -0.10 0.60 1.01 -1.26 -1.39 121.20 116.19 2edy s ILE 60 Ca 0.34 0.10 -0.12 0.00 0.00 0.00 0.00 60.65 60.96 2edy s ILE 60 Cb 0.03 -0.28 0.03 0.00 0.01 0.00 0.00 42.46 42.25 2edy s ILE 60 CO 0.15 0.04 0.33 0.28 0.00 0.00 0.00 174.94 175.74 2edy s THR 61 N 0.74 0.01 -2.00 2.92 -1.32 -1.08 -5.01 115.64 109.90 2edy s THR 61 Ca -0.05 -0.10 0.10 0.00 -1.21 0.00 0.00 61.69 60.43 2edy s THR 61 Cb -0.07 -0.50 0.27 0.00 -1.51 0.00 0.00 72.50 70.70 2edy s THR 61 CO -0.04 -0.05 1.21 0.35 -2.21 0.00 0.00 174.62 173.87 2edy n THR 62 N 2.57 0.00 -4.28 5.08 -2.24 -1.26 -2.73 114.28 111.42 2edy n THR 62 Ca -0.15 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.40 2edy n THR 62 Cb 0.57 -0.29 -0.07 0.00 -2.10 0.00 0.00 70.33 68.44 2edy n THR 62 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2edy s ASP 63 N -1.50 4.49 -0.01 3.42 1.11 -1.26 -4.88 116.67 118.03 2edy s ASP 63 Ca 0.14 -0.72 0.01 0.00 0.18 0.00 0.00 52.55 52.17 2edy s ASP 63 Cb 0.07 -0.77 0.05 0.00 1.07 0.00 0.00 42.92 43.34 2edy s ASP 63 CO 0.11 -0.07 0.75 0.35 1.18 0.00 0.00 175.17 177.49 2edy n THR 64 N -0.93 0.15 -4.21 -1.27 -2.24 -1.26 -4.68 114.28 99.83 2edy n THR 64 Ca -0.06 -0.09 -0.12 0.00 -2.27 0.00 0.00 64.05 61.52 2edy n THR 64 Cb 0.60 -0.30 -0.10 0.00 -2.10 0.00 0.00 70.33 68.43 2edy n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2edy s ARG 65 N -1.41 1.18 0.04 -0.78 1.04 -1.26 -1.51 118.95 116.24 2edy s ARG 65 Ca 0.04 -1.61 -0.28 0.00 -1.04 0.00 0.00 55.73 52.84 2edy s ARG 65 Cb 0.02 0.16 0.09 0.00 -2.04 0.00 0.00 34.95 33.19 2edy s ARG 65 CO 0.02 -0.34 1.03 0.12 -0.04 0.00 0.00 175.30 176.08 2edy s PHE 66 N -4.06 -0.17 -0.18 5.89 5.36 -1.23 -4.87 117.98 118.72 2edy s PHE 66 Ca 0.35 -0.02 -0.04 0.00 -0.96 0.00 0.00 56.93 56.27 2edy s PHE 66 Cb 0.07 0.58 0.06 0.00 -0.34 0.00 0.00 43.02 43.39 2edy s PHE 66 CO 0.10 -0.58 0.06 0.99 -1.46 0.00 0.00 175.22 174.33 2edy s THR 67 N -2.99 0.20 1.14 0.12 2.01 -1.26 0.10 115.64 114.96 2edy s THR 67 Ca 0.10 -0.32 -0.13 0.00 0.31 0.00 0.00 61.69 61.65 2edy s THR 67 Cb -0.00 -0.77 0.27 0.00 0.01 0.00 0.00 72.50 72.01 2edy s THR 67 CO -0.03 -0.23 1.04 -0.76 -0.69 0.00 0.00 174.62 173.96 2edy s LEU 68 N 2.01 0.87 0.21 4.42 2.01 0.25 -4.79 118.68 123.66 2edy s LEU 68 Ca 0.01 1.35 -0.22 0.00 0.01 0.00 0.00 54.13 55.28 2edy s LEU 68 Cb -0.16 -3.29 0.05 0.00 0.01 0.00 0.00 46.19 42.80 2edy s LEU 68 CO -0.08 -4.02 0.65 0.42 1.01 0.00 0.00 176.35 174.32 2edy s THR 69 N -2.60 0.00 -0.99 5.49 -4.23 -1.26 -2.53 115.64 109.52 2edy s THR 69 Ca 0.68 -0.45 -0.03 0.00 -1.18 0.00 0.00 61.69 60.70 2edy s THR 69 Cb -0.23 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.17 2edy s THR 69 CO 0.63 -0.01 0.85 0.61 -0.54 0.00 0.00 174.62 176.16 2edy n GLY 70 N -0.41 -0.20 3.66 3.99 0.00 -1.25 -4.94 105.19 106.04 2edy n GLY 70 Ca -0.11 0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 2edy n GLY 70 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2edy s LEU 71 N -5.64 2.99 -0.07 0.99 1.43 -0.50 -5.06 118.68 112.82 2edy s LEU 71 Ca 0.21 -1.16 -0.07 0.00 -1.03 0.00 0.00 54.13 52.09 2edy s LEU 71 Cb -0.09 -1.22 -0.04 0.00 0.03 0.00 0.00 46.19 44.86 2edy s LEU 71 CO 0.57 -0.42 0.19 -0.75 0.23 0.00 0.00 176.35 176.17 2edy s LYS 72 N -3.78 3.51 0.40 1.70 2.20 -1.26 -4.34 119.74 118.16 2edy s LYS 72 Ca 0.37 -0.10 -0.25 0.00 -0.36 0.00 0.00 55.97 55.63 2edy s LYS 72 Cb 0.05 -3.16 -0.08 0.00 -1.51 0.00 0.00 37.83 33.12 2edy s LYS 72 CO 0.20 0.73 1.19 -1.25 -0.36 0.00 0.00 175.35 175.86 2edy s PRO 73 N -1.29 4.04 -1.23 4.03 0.04 -0.98 -3.59 135.00 136.02 2edy s PRO 73 Ca 0.20 1.89 -0.02 0.00 0.04 0.00 0.00 61.00 63.11 2edy s PRO 73 Cb -0.13 -2.69 0.00 0.00 0.04 0.00 0.00 34.50 31.73 2edy s PRO 73 CO 0.09 -0.35 1.03 -3.47 0.04 0.00 0.00 177.00 174.34 2edy n ASP 74 N 0.08 -2.83 -3.73 6.66 2.03 -1.10 -4.82 116.55 112.84 2edy n ASP 74 Ca 0.04 -0.61 -0.13 0.00 0.52 0.00 0.00 54.79 54.61 2edy n ASP 74 Cb 0.46 -5.10 -0.14 0.00 -0.72 0.00 0.00 41.12 35.62 2edy n ASP 74 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2edy s THR 75 N -3.36 -0.06 0.19 5.18 2.01 -1.24 -4.96 115.64 113.41 2edy s THR 75 Ca 0.11 0.17 -0.31 0.00 0.31 0.00 0.00 61.69 61.98 2edy s THR 75 Cb -0.05 -0.31 -0.09 0.00 0.01 0.00 0.00 72.50 72.06 2edy s THR 75 CO 0.73 0.07 1.45 -0.89 -0.69 0.00 0.00 174.62 175.30 2edy s THR 76 N 1.28 2.84 -0.28 -0.82 2.01 -1.26 -2.56 115.64 116.85 2edy s THR 76 Ca -0.09 0.65 0.00 0.00 0.31 0.00 0.00 61.69 62.56 2edy s THR 76 Cb -0.11 -3.41 0.08 0.00 0.01 0.00 0.00 72.50 69.07 2edy s THR 76 CO -0.07 0.08 0.04 -0.31 -0.69 0.00 0.00 174.62 173.66 2edy s TYR 77 N 0.58 2.20 -0.53 4.92 2.02 -1.16 -3.30 117.35 122.08 2edy s TYR 77 Ca 0.63 -1.87 -0.26 0.00 -0.37 0.00 0.00 57.07 55.21 2edy s TYR 77 Cb -0.41 -1.81 -0.07 0.00 -0.40 0.00 0.00 41.96 39.27 2edy s TYR 77 CO 0.36 -0.83 2.36 0.34 -1.57 0.00 0.00 175.55 176.22 2edy s ASP 78 N 1.45 4.44 -0.15 2.29 -1.08 0.41 -2.44 116.67 121.59 2edy s ASP 78 Ca 0.04 0.90 -0.03 0.00 -0.52 0.00 0.00 52.55 52.94 2edy s ASP 78 Cb -0.18 -2.51 -0.03 0.00 -1.46 0.00 0.00 42.92 38.74 2edy s ASP 78 CO -0.14 -2.95 -0.03 -0.63 0.52 0.00 0.00 175.17 171.93 2edy s ILE 79 N 12.24 3.95 0.31 4.11 1.01 -1.26 -1.17 121.20 140.40 2edy s ILE 79 Ca 0.94 -0.34 0.05 0.00 0.00 0.00 0.00 60.65 61.30 2edy s ILE 79 Cb -0.16 -2.72 -0.02 0.00 0.01 0.00 0.00 42.46 39.57 2edy s ILE 79 CO 0.23 0.51 0.19 2.29 0.00 0.00 0.00 174.94 178.16 2edy n LYS 80 N 3.35 0.47 -3.96 2.79 2.85 0.64 -1.62 118.16 122.68 2edy n LYS 80 Ca -0.17 -2.90 -0.10 0.00 -1.05 0.00 0.00 58.31 54.09 2edy n LYS 80 Cb 0.53 2.02 -0.06 0.00 -0.65 0.00 0.00 35.03 36.86 2edy n LYS 80 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2edy s VAL 81 N -3.03 0.03 -0.28 0.58 0.11 -1.26 -1.88 120.40 114.68 2edy s VAL 81 Ca 0.27 -1.36 -0.20 0.00 -2.93 0.00 0.00 61.98 57.76 2edy s VAL 81 Cb 0.01 -1.97 0.09 0.00 -1.53 0.00 0.00 36.38 32.98 2edy s VAL 81 CO 0.19 -0.16 0.80 0.00 -3.33 0.00 0.00 175.10 172.60 2edy s ARG 82 N -3.99 0.66 0.23 1.54 1.70 -1.18 0.18 118.95 118.09 2edy s ARG 82 Ca 0.19 0.98 -0.30 0.00 -0.47 0.00 0.00 55.73 56.14 2edy s ARG 82 Cb 0.02 0.22 -0.09 0.00 -0.57 0.00 0.00 34.95 34.53 2edy s ARG 82 CO 0.03 -0.11 0.92 0.00 -1.08 0.00 0.00 175.30 175.07 2edy s ALA 83 N 1.04 3.35 0.05 7.88 0.00 -1.26 -2.18 121.76 130.63 2edy s ALA 83 Ca -0.05 0.59 0.07 0.00 0.00 0.00 0.00 51.96 52.57 2edy s ALA 83 Cb -0.05 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.85 2edy s ALA 83 CO -0.11 0.21 -0.17 -1.58 0.00 0.00 0.00 175.76 174.11 2edy s TRP 84 N -1.16 2.59 0.47 0.00 0.52 -0.14 -3.64 118.94 117.58 2edy s TRP 84 Ca 0.41 -0.24 0.05 0.00 0.02 0.00 0.00 56.10 56.33 2edy s TRP 84 Cb -0.26 -1.46 -0.03 0.00 -1.15 0.00 0.00 33.47 30.58 2edy s TRP 84 CO 0.31 0.28 0.13 0.95 0.02 0.00 0.00 176.95 178.64 2edy s THR 85 N -0.96 1.72 0.42 2.01 -4.23 0.01 -1.61 115.64 113.00 2edy s THR 85 Ca 0.15 -1.82 0.39 0.00 -1.18 0.00 0.00 61.69 59.23 2edy s THR 85 Cb -0.11 -2.55 0.39 0.00 1.34 0.00 0.00 72.50 71.58 2edy s THR 85 CO 0.06 0.00 2.19 0.28 -0.54 0.00 0.00 174.62 176.61 2edy h SER 86 N 1.34 0.00 0.00 3.99 0.02 -1.96 -2.89 113.55 114.05 2edy h SER 86 Ca -0.42 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.47 2edy h SER 86 Cb 1.28 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 2edy h SER 86 CO 0.71 0.00 -0.53 0.11 -1.14 0.00 0.00 176.83 175.98 2edy h LYS 87 N 0.00 0.00 0.00 3.45 6.56 -1.95 -3.51 116.57 121.12 2edy h LYS 87 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2edy h LYS 87 Cb 0.03 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.69 2edy h LYS 87 CO 0.00 0.37 0.00 0.41 -2.06 0.00 0.00 179.45 178.17 2edy n GLY 88 N 1.60 1.47 3.57 3.86 0.00 -1.09 -4.93 105.19 109.67 2edy n GLY 88 Ca -0.12 0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 2edy n GLY 88 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2edy s SER 89 N 2.00 3.13 0.00 1.61 1.04 -1.26 -0.81 113.70 119.41 2edy s SER 89 Ca 0.00 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 54.86 2edy s SER 89 Cb 0.00 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.39 2edy s SER 89 CO 0.00 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.05 2edy n GLY 90 N -0.95 5.43 2.71 7.32 0.00 -1.24 -4.09 105.19 114.38 2edy n GLY 90 Ca -0.08 -1.22 -0.23 0.00 0.00 0.00 0.00 46.02 44.49 2edy n GLY 90 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2edy n PRO 91 N 0.00 -2.67 -4.28 1.61 -0.04 -1.25 -5.00 135.00 123.37 2edy n PRO 91 Ca 0.00 -1.35 -0.29 0.00 -0.04 0.00 0.00 63.50 61.82 2edy n PRO 91 Cb 0.00 -1.27 -0.17 0.00 -0.04 0.00 0.00 33.50 32.03 2edy n PRO 91 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2edy s LEU 92 N 0.00 1.70 0.79 1.53 1.43 -1.26 -4.64 118.68 118.23 2edy s LEU 92 Ca 0.55 -0.45 -0.14 0.00 -1.03 0.00 0.00 54.13 53.06 2edy s LEU 92 Cb -0.05 -1.12 0.04 0.00 0.03 0.00 0.00 46.19 45.09 2edy s LEU 92 CO 0.42 -0.01 1.01 -1.54 0.23 0.00 0.00 176.35 176.45 2edy n SER 93 N 4.43 0.42 -4.64 2.29 3.41 0.13 -4.89 113.62 114.76 2edy n SER 93 Ca -0.18 0.59 -0.43 0.00 -0.26 0.00 0.00 58.87 58.59 2edy n SER 93 Cb 0.51 -1.43 -0.03 0.00 -0.26 0.00 0.00 64.21 63.00 2edy n SER 93 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2edy s PRO 94 N -3.72 3.97 0.56 4.33 0.04 -1.26 -4.39 135.00 134.53 2edy s PRO 94 Ca 0.71 1.81 -0.19 0.00 0.04 0.00 0.00 61.00 63.37 2edy s PRO 94 Cb -0.31 -3.98 -0.07 0.00 0.04 0.00 0.00 34.50 30.18 2edy s PRO 94 CO 0.53 -1.08 0.78 -1.13 0.04 0.00 0.00 177.00 176.13 2edy n SER 95 N 7.80 0.05 -0.06 6.66 3.41 -1.26 -4.85 113.62 125.38 2edy n SER 95 Ca 0.18 0.81 -0.02 0.00 -0.26 0.00 0.00 58.87 59.58 2edy n SER 95 Cb 0.44 -1.29 -0.14 0.00 -0.26 0.00 0.00 64.21 62.97 2edy n SER 95 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2edy n ILE 96 N -1.51 0.75 -3.25 -1.33 -5.35 -0.64 -4.91 119.36 103.13 2edy n ILE 96 Ca 0.12 -0.62 -0.16 0.00 -0.27 0.00 0.00 62.75 61.82 2edy n ILE 96 Cb 0.46 -0.32 0.07 0.00 -1.74 0.00 0.00 39.64 38.11 2edy n ILE 96 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2edy n GLN 97 N -2.46 -5.81 -2.01 6.28 6.02 -1.24 -4.90 117.38 113.26 2edy n GLN 97 Ca -0.19 0.69 -0.42 0.00 -0.01 0.00 0.00 57.00 57.07 2edy n GLN 97 Cb 0.85 -5.27 -0.03 0.00 1.02 0.00 0.00 30.24 26.81 2edy n GLN 97 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2edy s SER 98 N -3.84 5.84 -0.38 1.08 0.15 -1.02 -4.12 113.70 111.40 2edy s SER 98 Ca 0.15 1.19 -0.28 0.00 0.70 0.00 0.00 55.95 57.71 2edy s SER 98 Cb -0.07 -2.53 0.02 0.00 -1.71 0.00 0.00 66.02 61.74 2edy s SER 98 CO 0.60 -1.77 1.07 -0.60 1.20 0.00 0.00 173.24 173.74 2edy s ARG 99 N 5.78 3.91 0.75 5.44 3.52 -1.26 -2.98 118.95 134.11 2edy s ARG 99 Ca 0.78 0.81 -0.17 0.00 -0.13 0.00 0.00 55.73 57.02 2edy s ARG 99 Cb -0.21 -3.81 -0.12 0.00 -1.56 0.00 0.00 34.95 29.26 2edy s ARG 99 CO 0.32 -1.07 -0.19 0.25 -0.81 0.00 0.00 175.30 173.80 2edy n THR 100 N 6.21 0.40 -1.99 4.11 -2.24 -1.06 -4.75 114.28 114.96 2edy n THR 100 Ca 0.11 -0.46 -0.40 0.00 -2.27 0.00 0.00 64.05 61.03 2edy n THR 100 Cb 0.48 -0.20 -0.01 0.00 -2.10 0.00 0.00 70.33 68.50 2edy n THR 100 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2edy s MET 101 N -1.89 4.09 -0.63 -0.78 0.00 -1.23 -2.70 119.30 116.16 2edy s MET 101 Ca 0.53 2.29 -0.26 0.00 0.00 0.00 0.00 55.69 58.25 2edy s MET 101 Cb -0.34 -2.89 -0.02 0.00 0.00 0.00 0.00 34.83 31.58 2edy s MET 101 CO 0.70 -0.44 1.87 -1.25 0.00 0.00 0.00 175.02 175.90 2edy s PRO 102 N -2.09 2.62 0.00 3.16 0.04 -1.26 -3.19 135.00 134.28 2edy s PRO 102 Ca 0.54 0.54 0.00 0.00 0.04 0.00 0.00 61.00 62.12 2edy s PRO 102 Cb -0.41 -4.44 0.00 0.00 0.04 0.00 0.00 34.50 29.69 2edy s PRO 102 CO 0.54 -2.78 0.04 1.55 0.04 0.00 0.00 177.00 176.39