#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 1.97 -4.92 1.61 7.64 -1.26 -5.00 113.62 113.67 2edy n SER 2 Ca 0.00 0.06 -0.27 0.00 1.01 0.00 0.00 58.87 59.68 2edy n SER 2 Cb 0.00 -0.58 0.04 0.00 -1.01 0.00 0.00 64.21 62.66 2edy n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2edy s SER 3 N -6.94 5.35 0.00 6.43 0.15 -1.26 -4.75 113.70 112.69 2edy s SER 3 Ca -0.37 0.68 0.00 0.00 0.70 0.00 0.00 55.95 56.96 2edy s SER 3 Cb 0.12 -1.55 0.00 0.00 -1.71 0.00 0.00 66.02 62.87 2edy s SER 3 CO 0.55 -1.24 0.00 0.61 1.20 0.00 0.00 173.24 174.36 2edy n GLY 4 N -2.72 3.16 0.11 9.45 0.00 -1.26 -4.95 105.19 108.98 2edy n GLY 4 Ca 0.06 -0.47 -0.21 0.00 0.00 0.00 0.00 46.02 45.39 2edy n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2edy n SER 5 N 0.00 1.88 -3.50 1.61 7.64 -1.26 -5.01 113.62 114.98 2edy n SER 5 Ca 0.00 0.42 -0.20 0.00 1.01 0.00 0.00 58.87 60.11 2edy n SER 5 Cb 0.00 -0.92 0.08 0.00 -1.01 0.00 0.00 64.21 62.37 2edy n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2edy n SER 6 N -4.41 -3.66 -1.75 6.43 7.64 -1.26 -3.26 113.62 113.34 2edy n SER 6 Ca -0.34 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 58.94 2edy n SER 6 Cb 0.68 -5.06 0.00 0.00 -1.01 0.00 0.00 64.21 58.81 2edy n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2edy n GLY 7 N -1.47 2.08 3.77 0.23 0.00 -1.24 -4.20 105.19 104.36 2edy n GLY 7 Ca -0.18 -2.12 -0.39 0.00 0.00 0.00 0.00 46.02 43.33 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 -1.40 4.19 -0.52 1.61 0.04 -1.26 -4.88 135.00 132.80 2edy s PRO 8 Ca 0.00 1.95 0.02 0.00 0.04 0.00 0.00 61.00 63.01 2edy s PRO 8 Cb 0.00 -2.84 0.57 0.00 0.04 0.00 0.00 34.50 32.26 2edy s PRO 8 CO 0.00 -0.23 1.91 -1.13 0.04 0.00 0.00 177.00 177.58 2edy n SER 9 N 0.40 5.20 -3.76 6.66 3.41 -1.26 -3.70 113.62 120.56 2edy n SER 9 Ca 0.02 -3.70 -0.09 0.00 -0.26 0.00 0.00 58.87 54.85 2edy n SER 9 Cb 0.45 -0.86 -0.03 0.00 -0.26 0.00 0.00 64.21 63.51 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 -1.68 -0.12 0.18 5.00 0.00 -1.26 -4.97 107.32 104.48 2edy s GLY 10 Ca 0.59 -0.20 0.09 0.00 0.00 0.00 0.00 44.72 45.20 2edy s GLY 10 CO 0.05 -0.16 -0.19 -0.11 0.00 0.00 0.00 173.10 172.69 2edy s PHE 11 N -3.88 1.92 1.15 1.90 -0.71 -1.26 -4.42 117.98 112.67 2edy s PHE 11 Ca 0.10 -0.45 -0.19 0.00 -1.04 0.00 0.00 56.93 55.34 2edy s PHE 11 Cb -0.03 -0.94 0.29 0.00 -1.21 0.00 0.00 43.02 41.13 2edy s PHE 11 CO 0.00 0.39 1.02 -0.35 -1.34 0.00 0.00 175.22 174.94 2edy n PRO 12 N 0.16 -3.02 -3.62 1.99 -0.04 -1.26 -4.67 135.00 124.54 2edy n PRO 12 Ca -0.12 -1.63 -0.15 0.00 -0.04 0.00 0.00 63.50 61.56 2edy n PRO 12 Cb 0.57 -1.53 -0.06 0.00 -0.04 0.00 0.00 33.50 32.45 2edy n PRO 12 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2edy n GLN 13 N -4.63 0.34 -2.03 0.54 1.13 -1.13 -4.87 117.38 106.72 2edy n GLN 13 Ca 0.14 -2.40 -0.18 0.00 -1.94 0.00 0.00 57.00 52.62 2edy n GLN 13 Cb 0.55 1.88 -0.04 0.00 0.11 0.00 0.00 30.24 32.75 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 -2.01 -5.29 -4.63 1.08 5.03 -1.26 0.02 115.26 108.19 2edy n ASN 14 Ca 0.04 0.17 -0.43 0.00 0.87 0.00 0.00 54.58 55.23 2edy n ASN 14 Cb 0.43 -4.38 -0.02 0.00 -1.02 0.00 0.00 39.78 34.79 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 -4.86 3.91 0.00 3.41 2.96 -1.26 -3.69 118.68 119.14 2edy s LEU 15 Ca 0.00 1.26 -0.11 0.00 -0.22 0.00 0.00 54.13 55.06 2edy s LEU 15 Cb 0.00 -3.54 0.04 0.00 0.50 0.00 0.00 46.19 43.19 2edy s LEU 15 CO 0.00 -1.06 0.55 0.00 -1.32 0.00 0.00 176.35 174.52 2edy n HIS 16 N 7.57 -1.05 -4.13 5.38 1.44 -1.14 -4.95 115.22 118.34 2edy n HIS 16 Ca 0.15 -0.71 -0.35 0.00 -2.01 0.00 0.00 57.72 54.80 2edy n HIS 16 Cb 0.46 0.35 -0.13 0.00 0.12 0.00 0.00 29.99 30.79 2edy n HIS 16 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2edy s VAL 17 N -2.31 3.83 -0.47 0.61 0.11 -1.26 -0.71 120.40 120.20 2edy s VAL 17 Ca 0.12 -0.36 0.23 0.00 -2.93 0.00 0.00 61.98 59.05 2edy s VAL 17 Cb -0.02 -2.72 0.05 0.00 -1.53 0.00 0.00 36.38 32.17 2edy s VAL 17 CO 0.03 0.44 1.24 0.00 -3.33 0.00 0.00 175.10 173.48 2edy h THR 18 N 5.39 0.00 -0.26 5.04 1.03 -1.82 -3.44 112.91 118.85 2edy h THR 18 Ca -0.35 -0.72 -0.03 0.00 -0.01 0.00 0.00 66.41 65.29 2edy h THR 18 Cb 1.18 1.30 -0.15 0.00 -1.07 0.00 0.00 68.15 69.41 2edy h THR 18 CO 0.61 0.00 -0.18 0.61 -0.01 0.00 0.00 175.52 176.55 2edy n GLY 19 N 1.26 -1.48 3.60 2.99 0.00 -1.26 -5.07 105.19 105.22 2edy n GLY 19 Ca 0.02 1.08 -0.28 0.00 0.00 0.00 0.00 46.02 46.84 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 0.71 1.17 0.06 0.99 2.34 -1.26 -3.12 118.68 119.56 2edy s LEU 20 Ca 0.25 1.24 -0.05 0.00 0.06 0.00 0.00 54.13 55.63 2edy s LEU 20 Cb 0.13 -3.27 -0.02 0.00 -0.56 0.00 0.00 46.19 42.47 2edy s LEU 20 CO -0.10 -3.64 0.08 -0.89 -1.06 0.00 0.00 176.35 170.74 2edy s THR 21 N -2.79 0.17 0.27 5.48 2.01 0.22 -4.78 115.64 116.23 2edy s THR 21 Ca 0.67 -1.40 -0.00 0.00 0.31 0.00 0.00 61.69 61.26 2edy s THR 21 Cb -0.20 -1.28 0.25 0.00 0.01 0.00 0.00 72.50 71.27 2edy s THR 21 CO 0.60 -0.78 1.77 0.71 -0.69 0.00 0.00 174.62 176.24 2edy h THR 22 N 3.16 0.75 0.00 -0.82 1.35 -1.91 -3.21 112.91 112.24 2edy h THR 22 Ca -0.34 -0.23 -0.32 0.00 -0.55 0.00 0.00 66.41 64.97 2edy h THR 22 Cb 1.17 0.01 -0.06 0.00 -1.73 0.00 0.00 68.15 67.55 2edy h THR 22 CO 0.58 0.12 -2.19 -1.54 -0.25 0.00 0.00 175.52 172.24 2edy n SER 23 N -4.83 2.23 -4.99 5.36 3.41 -1.26 -2.02 113.62 111.50 2edy n SER 23 Ca 0.18 -0.04 -0.19 0.00 -0.26 0.00 0.00 58.87 58.56 2edy n SER 23 Cb 0.44 -0.39 0.02 0.00 -0.26 0.00 0.00 64.21 64.02 2edy n SER 23 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2edy s THR 24 N -2.41 2.47 -0.23 6.66 -4.23 -1.21 -0.69 115.64 115.99 2edy s THR 24 Ca -0.29 -1.09 -0.04 0.00 -1.18 0.00 0.00 61.69 59.10 2edy s THR 24 Cb 0.08 -2.56 0.12 0.00 1.34 0.00 0.00 72.50 71.48 2edy s THR 24 CO 0.46 0.00 0.40 -0.89 -0.54 0.00 0.00 174.62 174.05 2edy s THR 25 N -2.54 -0.63 0.59 3.99 2.01 -1.12 0.72 115.64 118.66 2edy s THR 25 Ca 0.55 0.01 -0.15 0.00 0.31 0.00 0.00 61.69 62.41 2edy s THR 25 Cb -0.07 -0.78 -0.04 0.00 0.01 0.00 0.00 72.50 71.63 2edy s THR 25 CO 0.34 -0.06 1.04 -1.61 -0.69 0.00 0.00 174.62 173.64 2edy s GLU 26 N 2.58 3.44 0.14 4.92 2.02 -1.18 0.19 118.70 130.81 2edy s GLU 26 Ca 0.09 1.06 0.00 0.00 0.02 0.00 0.00 54.97 56.15 2edy s GLU 26 Cb -0.14 -2.06 -0.04 0.00 0.10 0.00 0.00 34.13 31.99 2edy s GLU 26 CO -0.15 -0.70 0.02 -0.51 0.02 0.00 0.00 175.26 173.94 2edy s LEU 27 N -4.60 2.04 -0.30 1.80 1.43 0.25 -3.96 118.68 115.34 2edy s LEU 27 Ca 0.61 -1.16 -0.08 0.00 -1.03 0.00 0.00 54.13 52.47 2edy s LEU 27 Cb -0.14 0.11 0.18 0.00 0.03 0.00 0.00 46.19 46.37 2edy s LEU 27 CO 0.40 -0.63 0.86 0.00 0.23 0.00 0.00 176.35 177.21 2edy s ALA 28 N -3.83 -2.92 0.27 4.21 0.00 0.11 -3.62 121.76 115.97 2edy s ALA 28 Ca 0.22 1.63 0.03 0.00 0.00 0.00 0.00 51.96 53.84 2edy s ALA 28 Cb 0.07 -2.34 -0.01 0.00 0.00 0.00 0.00 23.12 20.84 2edy s ALA 28 CO 0.01 -1.38 0.09 -2.67 0.00 0.00 0.00 175.76 171.81 2edy n TRP 29 N 5.44 0.11 -4.36 0.00 2.14 -0.47 -2.88 117.44 117.41 2edy n TRP 29 Ca -0.05 -1.70 -0.19 0.00 2.07 0.00 0.00 57.50 57.64 2edy n TRP 29 Cb 0.53 -0.01 -0.10 0.00 -0.81 0.00 0.00 31.31 30.91 2edy n TRP 29 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2edy s ASP 30 N -2.63 2.45 0.84 -0.67 1.01 0.10 -4.69 116.67 113.08 2edy s ASP 30 Ca 0.13 -1.10 -0.11 0.00 0.71 0.00 0.00 52.55 52.18 2edy s ASP 30 Cb 0.01 -0.11 0.10 0.00 1.01 0.00 0.00 42.92 43.92 2edy s ASP 30 CO 0.09 -0.29 1.09 -2.16 0.21 0.00 0.00 175.17 174.11 2edy s PRO 31 N -3.71 1.71 0.36 8.23 0.04 -1.26 -2.86 135.00 137.50 2edy s PRO 31 Ca 0.25 0.98 -0.27 0.00 0.04 0.00 0.00 61.00 62.00 2edy s PRO 31 Cb 0.02 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.62 2edy s PRO 31 CO 0.08 -1.97 1.21 -1.25 0.04 0.00 0.00 177.00 175.11 2edy s PRO 32 N -4.92 4.25 0.46 0.56 0.04 -1.26 -4.38 135.00 129.75 2edy s PRO 32 Ca 0.62 1.97 -0.23 0.00 0.04 0.00 0.00 61.00 63.40 2edy s PRO 32 Cb -0.18 -2.90 -0.09 0.00 0.04 0.00 0.00 34.50 31.37 2edy s PRO 32 CO 0.57 -0.19 1.06 1.33 0.04 0.00 0.00 177.00 179.80 2edy n VAL 33 N 0.52 2.73 -0.22 -0.36 0.24 -1.26 -4.65 118.33 115.32 2edy n VAL 33 Ca 0.02 -0.50 0.22 0.00 -2.04 0.00 0.00 64.34 62.04 2edy n VAL 33 Cb 0.44 -1.24 0.58 0.00 -1.47 0.00 0.00 33.84 32.15 2edy n VAL 33 CO 0.00 0.00 0.00 0.17 -2.14 0.00 0.00 176.83 174.86 2edy h LEU 34 N 1.43 0.28 0.08 1.34 8.10 -1.93 0.11 115.31 124.72 2edy h LEU 34 Ca -0.46 0.03 -0.00 0.00 0.11 0.00 0.00 57.88 57.56 2edy h LEU 34 Cb 1.33 -0.02 0.00 0.00 -0.44 0.00 0.00 40.66 41.53 2edy h LEU 34 CO 0.56 0.11 -0.04 0.00 -4.11 0.00 0.00 178.44 174.95 2edy h ALA 35 N 1.60 -0.97 -0.94 0.17 0.00 -2.03 -3.18 119.26 113.91 2edy h ALA 35 Ca 0.45 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.38 2edy h ALA 35 Cb 1.33 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 19.17 2edy h ALA 35 CO -0.13 -0.96 0.61 0.93 0.00 0.00 0.00 179.25 179.69 2edy h GLU 36 N -0.11 1.13 -3.92 0.00 5.08 -1.84 -3.42 114.58 111.49 2edy h GLU 36 Ca -0.01 -0.07 -0.39 0.00 -1.00 0.00 0.00 59.36 57.89 2edy h GLU 36 Cb 0.09 -0.25 -0.07 0.00 0.50 0.00 0.00 28.75 29.01 2edy h GLU 36 CO 0.01 0.75 1.37 0.54 -1.00 0.00 0.00 179.01 180.68 2edy n ARG 37 N -4.50 0.00 -0.22 2.33 1.74 0.35 -4.44 116.66 111.91 2edy n ARG 37 Ca 0.13 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.24 2edy n ARG 37 Cb 0.11 -1.17 0.14 0.00 -1.02 0.00 0.00 32.46 30.51 2edy n ARG 37 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2edy n ASN 38 N 8.19 2.01 0.00 0.55 2.85 -1.26 -4.96 115.26 122.64 2edy n ASN 38 Ca 0.52 -2.14 0.00 0.00 -0.11 0.00 0.00 54.58 52.85 2edy n ASN 38 Cb 0.02 -0.34 0.00 0.00 1.24 0.00 0.00 39.78 40.71 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 0.68 -1.03 3.86 8.20 0.00 -1.26 -4.85 105.19 110.78 2edy n GLY 39 Ca 0.10 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.72 2edy n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2edy s ARG 40 N -1.55 3.91 0.01 1.61 3.00 -1.26 -5.08 118.95 119.60 2edy s ARG 40 Ca 0.00 0.60 -0.04 0.00 0.00 0.00 0.00 55.73 56.28 2edy s ARG 40 Cb 0.00 -2.40 -0.04 0.00 0.00 0.00 0.00 34.95 32.50 2edy s ARG 40 CO 0.00 0.06 0.24 0.42 0.00 0.00 0.00 175.30 176.02 2edy s ILE 41 N -2.17 5.36 0.00 1.52 -1.09 -1.26 -4.27 121.20 119.28 2edy s ILE 41 Ca 0.53 -0.03 0.00 0.00 -2.23 0.00 0.00 60.65 58.93 2edy s ILE 41 Cb -0.10 -3.56 0.00 0.00 -1.58 0.00 0.00 42.46 37.21 2edy s ILE 41 CO 0.24 0.30 0.00 2.30 -1.23 0.00 0.00 174.94 176.55 2edy n ILE 42 N 0.90 0.00 -3.61 2.92 -5.35 -0.83 -4.98 119.36 108.40 2edy n ILE 42 Ca -0.10 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.37 2edy n ILE 42 Cb 0.52 -0.63 -0.01 0.00 -1.74 0.00 0.00 39.64 37.79 2edy n ILE 42 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2edy s SER 43 N -3.36 -0.10 0.22 7.28 0.01 -1.26 -4.81 113.70 111.68 2edy s SER 43 Ca 0.00 -0.10 0.11 0.00 1.31 0.00 0.00 55.95 57.27 2edy s SER 43 Cb 0.00 0.17 -0.05 0.00 0.21 0.00 0.00 66.02 66.36 2edy s SER 43 CO 0.00 -0.31 -0.21 -0.31 0.41 0.00 0.00 173.24 172.83 2edy s TYR 44 N -2.47 2.14 -0.29 2.43 1.51 -1.16 -1.46 117.35 118.04 2edy s TYR 44 Ca 0.12 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.79 2edy s TYR 44 Cb 0.02 -1.01 0.06 0.00 -0.11 0.00 0.00 41.96 40.93 2edy s TYR 44 CO -0.04 0.53 -0.03 0.99 -1.11 0.00 0.00 175.55 175.88 2edy s THR 45 N -2.16 2.61 -0.60 -0.71 2.01 -0.88 -3.14 115.64 112.76 2edy s THR 45 Ca 0.23 -1.59 -0.24 0.00 0.31 0.00 0.00 61.69 60.40 2edy s THR 45 Cb -0.06 -2.56 0.05 0.00 0.01 0.00 0.00 72.50 69.94 2edy s THR 45 CO 0.11 -0.14 0.99 -0.69 -0.69 0.00 0.00 174.62 174.20 2edy s VAL 46 N 1.16 4.30 -0.41 3.82 1.01 -0.69 -3.19 120.40 126.41 2edy s VAL 46 Ca -0.05 0.11 -0.18 0.00 0.00 0.00 0.00 61.98 61.85 2edy s VAL 46 Cb -0.20 -4.63 0.01 0.00 0.00 0.00 0.00 36.38 31.57 2edy s VAL 46 CO -0.03 -1.30 0.51 -0.69 0.00 0.00 0.00 175.10 173.59 2edy s VAL 47 N 4.18 4.99 -0.09 2.92 1.01 -0.77 -0.49 120.40 132.15 2edy s VAL 47 Ca 0.29 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.28 2edy s VAL 47 Cb -0.13 -4.06 -0.01 0.00 0.00 0.00 0.00 36.38 32.18 2edy s VAL 47 CO 0.16 -0.41 -0.23 0.72 0.00 0.00 0.00 175.10 175.34 2edy s PHE 48 N 2.40 2.55 -0.11 5.22 -0.71 0.41 -0.06 117.98 127.69 2edy s PHE 48 Ca 0.17 -0.88 -0.14 0.00 -1.04 0.00 0.00 56.93 55.04 2edy s PHE 48 Cb -0.16 -1.68 0.04 0.00 -1.21 0.00 0.00 43.02 40.00 2edy s PHE 48 CO 0.15 -0.32 0.38 0.50 -1.34 0.00 0.00 175.22 174.59 2edy s ARG 49 N 0.14 0.53 -0.54 1.99 3.52 0.19 -1.94 118.95 122.84 2edy s ARG 49 Ca -0.12 0.34 -0.28 0.00 -0.13 0.00 0.00 55.73 55.54 2edy s ARG 49 Cb -0.16 0.25 0.02 0.00 -1.56 0.00 0.00 34.95 33.50 2edy s ARG 49 CO 0.07 -0.10 1.35 0.34 -0.81 0.00 0.00 175.30 176.15 2edy s ASP 50 N -0.23 6.25 0.43 -2.12 2.15 -1.26 0.17 116.67 122.06 2edy s ASP 50 Ca -0.04 0.32 0.17 0.00 0.43 0.00 0.00 52.55 53.43 2edy s ASP 50 Cb -0.03 -2.55 0.92 0.00 -0.30 0.00 0.00 42.92 40.96 2edy s ASP 50 CO 0.02 -1.60 1.45 0.16 -0.17 0.00 0.00 175.17 175.02 2edy h ILE 51 N 6.33 0.00 0.00 4.11 3.07 -1.92 0.82 117.51 129.93 2edy h ILE 51 Ca -0.26 0.00 -0.19 0.00 1.55 0.00 0.00 64.86 65.95 2edy h ILE 51 Cb 1.08 0.38 -0.03 0.00 -0.27 0.00 0.00 36.82 37.98 2edy h ILE 51 CO 1.17 0.00 -1.44 0.78 -1.05 0.00 0.00 178.15 177.60 2edy h ASN 52 N 0.00 0.00 -0.78 2.16 2.35 -1.89 -3.48 115.58 113.95 2edy h ASN 52 Ca 0.00 0.00 -0.58 0.00 -0.55 0.00 0.00 56.30 55.17 2edy h ASN 52 Cb 0.68 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.99 2edy h ASN 52 CO 0.00 0.67 -0.34 -0.44 -1.65 0.00 0.00 177.43 175.67 2edy s SER 53 N -5.88 4.63 -0.21 5.81 0.01 0.29 -5.04 113.70 113.31 2edy s SER 53 Ca -0.03 -1.19 0.15 0.00 1.31 0.00 0.00 55.95 56.19 2edy s SER 53 Cb 0.08 0.21 0.53 0.00 0.21 0.00 0.00 66.02 67.05 2edy s SER 53 CO 0.81 -0.98 1.44 0.00 0.41 0.00 0.00 173.24 174.92 2edy n GLN 54 N -1.66 2.64 -3.27 12.44 6.02 -1.26 -4.63 117.38 127.65 2edy n GLN 54 Ca -0.02 -2.92 -0.46 0.00 -0.01 0.00 0.00 57.00 53.59 2edy n GLN 54 Cb 0.64 -1.85 -0.05 0.00 1.02 0.00 0.00 30.24 30.00 2edy n GLN 54 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2edy s GLN 55 N -2.94 3.00 0.23 -1.09 2.00 -1.26 -5.06 119.66 114.54 2edy s GLN 55 Ca 0.43 -1.57 -0.17 0.00 -2.00 0.00 0.00 55.36 52.04 2edy s GLN 55 Cb 0.36 -4.27 -0.08 0.00 0.80 0.00 0.00 33.01 29.82 2edy s GLN 55 CO 0.07 -1.34 0.69 -2.00 -0.50 0.00 0.00 175.29 172.21 2edy s GLU 56 N 1.85 4.14 0.01 1.67 -6.30 -1.26 -4.07 118.70 114.74 2edy s GLU 56 Ca 0.05 0.75 -0.12 0.00 -2.50 0.00 0.00 54.97 53.15 2edy s GLU 56 Cb -0.28 -2.79 0.01 0.00 0.00 0.00 0.00 34.13 31.07 2edy s GLU 56 CO 0.04 0.36 0.25 -0.51 0.02 0.00 0.00 175.26 175.42 2edy s LEU 57 N -2.20 1.10 0.06 2.70 1.43 -0.82 -5.02 118.68 115.93 2edy s LEU 57 Ca 0.44 -0.12 -0.04 0.00 -1.03 0.00 0.00 54.13 53.39 2edy s LEU 57 Cb -0.15 1.10 -0.02 0.00 0.03 0.00 0.00 46.19 47.15 2edy s LEU 57 CO 0.20 -0.49 0.06 -1.10 0.23 0.00 0.00 176.35 175.25 2edy s GLN 58 N -1.83 0.65 0.26 1.70 -0.21 -1.26 -0.44 119.66 118.53 2edy s GLN 58 Ca -0.10 -1.02 0.02 0.00 0.02 0.00 0.00 55.36 54.27 2edy s GLN 58 Cb -0.04 0.24 -0.04 0.00 1.00 0.00 0.00 33.01 34.17 2edy s GLN 58 CO 0.01 -0.16 0.14 -0.80 -2.12 0.00 0.00 175.29 172.36 2edy s ASN 59 N -2.66 1.02 -0.05 5.90 0.02 0.35 -4.97 114.94 114.56 2edy s ASN 59 Ca 0.03 -1.47 -0.02 0.00 -1.02 0.00 0.00 52.86 50.37 2edy s ASN 59 Cb 0.04 0.33 0.03 0.00 0.02 0.00 0.00 41.25 41.67 2edy s ASN 59 CO -0.09 -0.84 0.10 -0.63 0.02 0.00 0.00 177.10 175.67 2edy s ILE 60 N -3.81 -0.03 -0.08 0.60 1.01 -1.26 -1.70 121.20 115.93 2edy s ILE 60 Ca 0.38 0.12 -0.14 0.00 0.00 0.00 0.00 60.65 61.01 2edy s ILE 60 Cb 0.06 -0.17 0.03 0.00 0.01 0.00 0.00 42.46 42.39 2edy s ILE 60 CO 0.15 0.05 0.34 0.28 0.00 0.00 0.00 174.94 175.77 2edy s THR 61 N 0.76 0.03 -1.02 2.92 -1.32 -1.19 -5.02 115.64 110.79 2edy s THR 61 Ca -0.06 -0.21 0.02 0.00 -1.21 0.00 0.00 61.69 60.23 2edy s THR 61 Cb -0.08 -0.56 0.09 0.00 -1.51 0.00 0.00 72.50 70.44 2edy s THR 61 CO -0.03 -0.12 0.68 0.35 -2.21 0.00 0.00 174.62 173.29 2edy n THR 62 N 2.14 0.29 -4.37 5.08 -2.24 -1.26 -3.01 114.28 110.91 2edy n THR 62 Ca -0.17 -0.15 -0.19 0.00 -2.27 0.00 0.00 64.05 61.27 2edy n THR 62 Cb 0.57 -0.42 -0.10 0.00 -2.10 0.00 0.00 70.33 68.27 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 -0.18 2.58 -0.00 3.42 1.01 -1.26 -4.96 116.67 117.27 2edy s ASP 63 Ca 0.06 -1.08 0.00 0.00 0.71 0.00 0.00 52.55 52.24 2edy s ASP 63 Cb 0.04 -0.14 0.02 0.00 1.01 0.00 0.00 42.92 43.86 2edy s ASP 63 CO 0.02 -0.24 0.70 0.35 0.21 0.00 0.00 175.17 176.21 2edy n THR 64 N -0.44 0.05 -4.22 -1.27 -2.24 -1.26 -4.70 114.28 100.20 2edy n THR 64 Ca -0.07 -0.03 -0.13 0.00 -2.27 0.00 0.00 64.05 61.55 2edy n THR 64 Cb 0.61 -0.32 -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 -1.37 1.29 0.04 -0.78 1.04 -1.26 -1.36 118.95 116.54 2edy s ARG 65 Ca 0.01 -1.69 -0.28 0.00 -1.04 0.00 0.00 55.73 52.73 2edy s ARG 65 Cb 0.01 0.22 0.10 0.00 -2.04 0.00 0.00 34.95 33.24 2edy s ARG 65 CO 0.01 -0.41 1.09 0.12 -0.04 0.00 0.00 175.30 176.06 2edy s PHE 66 N -4.04 -0.13 -0.09 5.89 5.36 -1.24 -4.87 117.98 118.86 2edy s PHE 66 Ca 0.39 -0.06 -0.03 0.00 -0.96 0.00 0.00 56.93 56.27 2edy s PHE 66 Cb 0.07 0.58 0.04 0.00 -0.34 0.00 0.00 43.02 43.37 2edy s PHE 66 CO 0.14 -0.53 0.07 0.99 -1.46 0.00 0.00 175.22 174.42 2edy s THR 67 N -2.87 -0.05 1.03 0.12 2.01 -1.26 0.86 115.64 115.48 2edy s THR 67 Ca 0.12 0.16 -0.13 0.00 0.31 0.00 0.00 61.69 62.14 2edy s THR 67 Cb 0.01 -0.36 0.20 0.00 0.01 0.00 0.00 72.50 72.36 2edy s THR 67 CO -0.02 0.01 1.10 -0.76 -0.69 0.00 0.00 174.62 174.26 2edy s LEU 68 N 2.13 1.46 0.24 4.42 2.01 0.13 -4.83 118.68 124.24 2edy s LEU 68 Ca 0.04 1.06 -0.18 0.00 0.01 0.00 0.00 54.13 55.05 2edy s LEU 68 Cb -0.14 -3.17 0.02 0.00 0.01 0.00 0.00 46.19 42.91 2edy s LEU 68 CO -0.05 -3.26 0.60 0.42 1.01 0.00 0.00 176.35 175.06 2edy s THR 69 N -3.01 0.01 -1.36 5.49 -4.23 -1.26 -2.79 115.64 108.49 2edy s THR 69 Ca 0.66 -0.96 -0.06 0.00 -1.18 0.00 0.00 61.69 60.14 2edy s THR 69 Cb -0.17 -1.86 0.02 0.00 1.34 0.00 0.00 72.50 71.83 2edy s THR 69 CO 0.57 -0.03 1.00 0.61 -0.54 0.00 0.00 174.62 176.23 2edy n GLY 70 N -0.40 -0.44 3.65 3.99 0.00 -1.24 -4.93 105.19 105.81 2edy n GLY 70 Ca -0.06 0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 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 -6.97 3.22 0.04 0.99 1.43 0.13 -5.06 118.68 112.46 2edy s LEU 71 Ca 0.36 -0.62 -0.18 0.00 -1.03 0.00 0.00 54.13 52.66 2edy s LEU 71 Cb -0.17 -1.75 -0.06 0.00 0.03 0.00 0.00 46.19 44.24 2edy s LEU 71 CO 0.77 0.01 0.53 -0.75 0.23 0.00 0.00 176.35 177.14 2edy s LYS 72 N -3.63 4.16 0.46 1.70 2.20 -1.26 -4.27 119.74 119.10 2edy s LYS 72 Ca 0.31 0.65 -0.23 0.00 -0.36 0.00 0.00 55.97 56.35 2edy s LYS 72 Cb -0.07 -3.26 -0.07 0.00 -1.51 0.00 0.00 37.83 32.92 2edy s LYS 72 CO 0.20 0.60 1.16 -1.25 -0.36 0.00 0.00 175.35 175.70 2edy s PRO 73 N -0.91 3.74 -1.33 4.03 0.04 -0.86 -3.53 135.00 136.18 2edy s PRO 73 Ca 0.28 1.77 -0.05 0.00 0.04 0.00 0.00 61.00 63.03 2edy s PRO 73 Cb -0.19 -2.39 0.02 0.00 0.04 0.00 0.00 34.50 31.98 2edy s PRO 73 CO 0.17 -0.56 1.00 -3.47 0.04 0.00 0.00 177.00 174.18 2edy n ASP 74 N -0.52 -3.79 -3.74 6.66 2.03 -1.07 -4.88 116.55 111.23 2edy n ASP 74 Ca 0.07 -0.66 -0.15 0.00 0.52 0.00 0.00 54.79 54.57 2edy n ASP 74 Cb 0.48 -4.67 -0.15 0.00 -0.72 0.00 0.00 41.12 36.06 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 -3.40 -0.07 0.18 5.18 2.01 -1.23 -4.96 115.64 113.35 2edy s THR 75 Ca 0.31 0.23 -0.31 0.00 0.31 0.00 0.00 61.69 62.23 2edy s THR 75 Cb -0.14 -0.18 -0.10 0.00 0.01 0.00 0.00 72.50 72.09 2edy s THR 75 CO 0.76 0.09 1.55 -0.89 -0.69 0.00 0.00 174.62 175.45 2edy s THR 76 N 1.29 2.60 -0.25 -0.82 2.01 -1.26 -2.68 115.64 116.54 2edy s THR 76 Ca -0.07 0.44 0.01 0.00 0.31 0.00 0.00 61.69 62.38 2edy s THR 76 Cb -0.12 -3.28 0.07 0.00 0.01 0.00 0.00 72.50 69.17 2edy s THR 76 CO -0.05 0.04 -0.04 -0.31 -0.69 0.00 0.00 174.62 173.58 2edy s TYR 77 N 0.92 2.46 -0.62 4.92 2.02 -1.14 -3.31 117.35 122.59 2edy s TYR 77 Ca 0.68 -1.85 -0.26 0.00 -0.37 0.00 0.00 57.07 55.27 2edy s TYR 77 Cb -0.44 -1.69 -0.05 0.00 -0.40 0.00 0.00 41.96 39.38 2edy s TYR 77 CO 0.34 -0.80 2.08 0.34 -1.57 0.00 0.00 175.55 175.94 2edy s ASP 78 N 1.37 4.90 -0.15 2.29 -1.08 0.45 -1.92 116.67 122.54 2edy s ASP 78 Ca -0.04 0.43 -0.02 0.00 -0.52 0.00 0.00 52.55 52.40 2edy s ASP 78 Cb -0.19 -2.53 -0.02 0.00 -1.46 0.00 0.00 42.92 38.72 2edy s ASP 78 CO -0.08 -2.68 -0.07 -0.63 0.52 0.00 0.00 175.17 172.23 2edy s ILE 79 N 10.57 3.58 0.24 4.11 1.01 -1.26 -0.64 121.20 138.82 2edy s ILE 79 Ca 0.79 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 61.00 2edy s ILE 79 Cb -0.13 -2.55 -0.01 0.00 0.01 0.00 0.00 42.46 39.78 2edy s ILE 79 CO 0.19 0.51 0.12 2.29 0.00 0.00 0.00 174.94 178.04 2edy n LYS 80 N 3.52 0.58 -3.83 2.79 2.85 0.92 -1.59 118.16 123.40 2edy n LYS 80 Ca -0.18 -2.16 -0.10 0.00 -1.05 0.00 0.00 58.31 54.83 2edy n LYS 80 Cb 0.53 1.34 -0.05 0.00 -0.65 0.00 0.00 35.03 36.20 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 -2.61 0.04 -0.19 0.58 0.11 -1.26 -1.85 120.40 115.22 2edy s VAL 81 Ca 0.17 -1.03 -0.27 0.00 -2.93 0.00 0.00 61.98 57.92 2edy s VAL 81 Cb 0.01 -1.69 0.07 0.00 -1.53 0.00 0.00 36.38 33.24 2edy s VAL 81 CO 0.12 -0.19 0.71 0.00 -3.33 0.00 0.00 175.10 172.40 2edy s ARG 82 N -3.91 0.92 0.15 1.54 1.70 -1.19 0.25 118.95 118.41 2edy s ARG 82 Ca 0.12 0.74 -0.18 0.00 -0.47 0.00 0.00 55.73 55.94 2edy s ARG 82 Cb 0.01 0.44 -0.07 0.00 -0.57 0.00 0.00 34.95 34.75 2edy s ARG 82 CO -0.02 -0.18 0.62 0.00 -1.08 0.00 0.00 175.30 174.65 2edy s ALA 83 N -0.17 3.52 0.06 7.88 0.00 -1.26 -2.08 121.76 129.71 2edy s ALA 83 Ca -0.04 0.04 0.09 0.00 0.00 0.00 0.00 51.96 52.04 2edy s ALA 83 Cb -0.03 -2.67 -0.03 0.00 0.00 0.00 0.00 23.12 20.38 2edy s ALA 83 CO 0.04 0.39 -0.22 -1.58 0.00 0.00 0.00 175.76 174.39 2edy s TRP 84 N -1.36 2.44 0.29 0.00 0.52 -0.54 -3.30 118.94 116.98 2edy s TRP 84 Ca 0.37 -0.33 0.12 0.00 0.02 0.00 0.00 56.10 56.27 2edy s TRP 84 Cb -0.17 -1.39 -0.05 0.00 -1.15 0.00 0.00 33.47 30.70 2edy s TRP 84 CO 0.20 0.24 -0.17 0.95 0.02 0.00 0.00 176.95 178.18 2edy s THR 85 N -0.93 2.51 0.65 2.01 -4.23 0.46 -1.97 115.64 114.14 2edy s THR 85 Ca 0.14 -2.35 0.20 0.00 -1.18 0.00 0.00 61.69 58.50 2edy s THR 85 Cb -0.10 -2.38 0.23 0.00 1.34 0.00 0.00 72.50 71.59 2edy s THR 85 CO 0.05 -0.37 1.57 0.77 -0.54 0.00 0.00 174.62 176.09 2edy h SER 86 N 2.21 0.00 0.00 3.99 4.64 -1.94 -1.32 113.55 121.14 2edy h SER 86 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2edy h SER 86 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2edy h SER 86 CO 0.61 0.00 -0.18 0.11 -0.87 0.00 0.00 176.83 176.50 2edy h LYS 87 N 0.00 0.00 0.00 4.77 6.56 -1.85 -3.51 116.57 122.54 2edy h LYS 87 Ca 0.09 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.68 2edy h LYS 87 Cb 1.40 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.06 2edy h LYS 87 CO -0.00 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.80 2edy n GLY 88 N 1.74 2.52 3.65 3.86 0.00 -0.50 -4.91 105.19 111.55 2edy n GLY 88 Ca -0.03 0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 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 3.74 0.00 1.61 1.04 -1.26 -0.40 113.70 120.42 2edy s SER 89 Ca 0.00 -1.50 0.00 0.00 0.48 0.00 0.00 55.95 54.93 2edy s SER 89 Cb 0.00 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.17 2edy s SER 89 CO 0.00 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.18 2edy n GLY 90 N -1.05 5.35 3.64 7.32 0.00 -1.21 -3.63 105.19 115.60 2edy n GLY 90 Ca -0.10 -1.38 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 2edy n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edy s PRO 91 N 3.73 -0.39 -0.17 1.61 0.04 -1.24 -4.98 135.00 133.61 2edy s PRO 91 Ca 0.00 0.23 -0.00 0.00 0.04 0.00 0.00 61.00 61.27 2edy s PRO 91 Cb 0.00 -1.67 -0.00 0.00 0.04 0.00 0.00 34.50 32.87 2edy s PRO 91 CO 0.00 -3.22 -0.14 -0.51 0.04 0.00 0.00 177.00 173.17 2edy s LEU 92 N -6.70 2.51 0.78 -3.56 1.43 -1.26 -4.52 118.68 107.36 2edy s LEU 92 Ca 0.68 -0.48 -0.14 0.00 -1.03 0.00 0.00 54.13 53.16 2edy s LEU 92 Cb -0.15 -1.58 0.05 0.00 0.03 0.00 0.00 46.19 44.54 2edy s LEU 92 CO 0.57 0.06 1.08 -1.54 0.23 0.00 0.00 176.35 176.75 2edy n SER 93 N 4.23 0.70 -4.64 2.29 3.41 0.14 -4.89 113.62 114.86 2edy n SER 93 Ca -0.19 0.60 -0.43 0.00 -0.26 0.00 0.00 58.87 58.60 2edy n SER 93 Cb 0.51 -1.46 -0.03 0.00 -0.26 0.00 0.00 64.21 62.98 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 -3.81 3.93 0.52 4.33 0.04 -1.26 -4.38 135.00 134.36 2edy s PRO 94 Ca 0.73 1.77 -0.20 0.00 0.04 0.00 0.00 61.00 63.34 2edy s PRO 94 Cb -0.31 -3.99 -0.09 0.00 0.04 0.00 0.00 34.50 30.15 2edy s PRO 94 CO 0.51 -1.13 0.67 -1.13 0.04 0.00 0.00 177.00 175.96 2edy n SER 95 N 7.96 -0.37 -0.05 6.66 3.41 -1.26 -4.85 113.62 125.12 2edy n SER 95 Ca 0.18 0.83 0.01 0.00 -0.26 0.00 0.00 58.87 59.64 2edy n SER 95 Cb 0.45 -1.22 -0.15 0.00 -0.26 0.00 0.00 64.21 63.03 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 -1.31 0.56 -3.47 -1.33 -5.35 -0.62 -4.91 119.36 102.93 2edy n ILE 96 Ca 0.11 -0.59 -0.19 0.00 -0.27 0.00 0.00 62.75 61.81 2edy n ILE 96 Cb 0.44 -0.20 0.09 0.00 -1.74 0.00 0.00 39.64 38.23 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 -2.40 -6.97 -2.01 6.28 6.02 -1.21 -4.88 117.38 112.21 2edy n GLN 97 Ca -0.15 0.84 -0.43 0.00 -0.01 0.00 0.00 57.00 57.25 2edy n GLN 97 Cb 0.77 -5.84 -0.03 0.00 1.02 0.00 0.00 30.24 26.16 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 -4.04 5.85 -0.38 1.08 0.15 -0.81 -4.07 113.70 111.49 2edy s SER 98 Ca 0.17 1.22 -0.28 0.00 0.70 0.00 0.00 55.95 57.76 2edy s SER 98 Cb -0.08 -2.53 0.02 0.00 -1.71 0.00 0.00 66.02 61.73 2edy s SER 98 CO 0.72 -1.75 1.07 -0.60 1.20 0.00 0.00 173.24 173.88 2edy s ARG 99 N 5.75 3.91 0.62 5.44 3.52 -1.26 -2.88 118.95 134.05 2edy s ARG 99 Ca 0.78 0.81 -0.18 0.00 -0.13 0.00 0.00 55.73 57.02 2edy s ARG 99 Cb -0.21 -3.80 -0.12 0.00 -1.56 0.00 0.00 34.95 29.25 2edy s ARG 99 CO 0.33 -1.07 -0.04 0.25 -0.81 0.00 0.00 175.30 173.96 2edy n THR 100 N 6.21 0.58 -1.91 4.11 -2.24 -1.09 -4.76 114.28 115.17 2edy n THR 100 Ca 0.11 -0.48 -0.41 0.00 -2.27 0.00 0.00 64.05 61.00 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 -1.56 4.19 -0.85 -0.78 0.00 -1.23 -2.60 119.30 116.47 2edy s MET 101 Ca 0.57 2.45 -0.25 0.00 0.00 0.00 0.00 55.69 58.46 2edy s MET 101 Cb -0.42 -3.00 -0.04 0.00 0.00 0.00 0.00 34.83 31.36 2edy s MET 101 CO 0.66 -0.41 1.93 -1.25 0.00 0.00 0.00 175.02 175.95 2edy s PRO 102 N -1.99 2.57 0.00 3.16 0.04 -1.26 -3.38 135.00 134.13 2edy s PRO 102 Ca 0.51 -0.12 0.00 0.00 0.04 0.00 0.00 61.00 61.43 2edy s PRO 102 Cb -0.44 -4.94 0.00 0.00 0.04 0.00 0.00 34.50 29.16 2edy s PRO 102 CO 0.60 -3.26 0.00 1.55 0.04 0.00 0.00 177.00 175.92