#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 5.51 -4.19 1.61 7.64 -1.26 -4.72 113.62 118.20 2edy n SER 2 Ca 0.00 -2.53 -0.41 0.00 1.01 0.00 0.00 58.87 56.94 2edy n SER 2 Cb 0.00 -1.18 -0.06 0.00 -1.01 0.00 0.00 64.21 61.96 2edy n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2edy s SER 3 N 1.71 5.94 -0.42 6.43 0.01 -1.26 -4.84 113.70 121.28 2edy s SER 3 Ca 0.19 -2.88 0.05 0.00 1.31 0.00 0.00 55.95 54.63 2edy s SER 3 Cb 0.11 -2.01 0.31 0.00 0.21 0.00 0.00 66.02 64.64 2edy s SER 3 CO -0.01 -0.43 1.18 0.61 0.41 0.00 0.00 173.24 175.00 2edy n GLY 4 N 3.57 -0.15 2.23 3.44 0.00 -1.26 -5.00 105.19 108.02 2edy n GLY 4 Ca 0.12 0.31 -0.31 0.00 0.00 0.00 0.00 46.02 46.14 2edy n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2edy n SER 5 N 0.58 6.76 -0.03 1.61 3.41 -1.26 -4.60 113.62 120.08 2edy n SER 5 Ca 0.03 -3.77 -0.03 0.00 -0.26 0.00 0.00 58.87 54.84 2edy n SER 5 Cb 0.71 -0.84 -0.01 0.00 -0.26 0.00 0.00 64.21 63.80 2edy n SER 5 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2edy n SER 6 N -0.91 0.73 -3.05 4.04 3.41 -1.26 -5.03 113.62 111.55 2edy n SER 6 Ca 0.58 0.12 -0.03 0.00 -0.26 0.00 0.00 58.87 59.28 2edy n SER 6 Cb 0.80 -0.54 0.03 0.00 -0.26 0.00 0.00 64.21 64.24 2edy n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2edy n GLY 7 N 1.72 -2.91 3.65 5.00 0.00 -1.25 -4.84 105.19 106.57 2edy n GLY 7 Ca -0.05 -0.96 -0.29 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.62 -0.06 0.00 1.61 0.04 -1.25 -4.89 135.00 127.83 2edy s PRO 8 Ca 0.08 0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.46 2edy s PRO 8 Cb -0.01 -1.70 0.00 0.00 0.04 0.00 0.00 34.50 32.83 2edy s PRO 8 CO 0.06 -3.02 0.00 0.45 0.04 0.00 0.00 177.00 174.53 2edy n SER 9 N -4.35 1.60 -4.63 6.66 2.88 -1.26 -4.25 113.62 110.28 2edy n SER 9 Ca 0.07 -0.28 -0.25 0.00 -1.33 0.00 0.00 58.87 57.09 2edy n SER 9 Cb 0.58 0.87 -0.08 0.00 -0.75 0.00 0.00 64.21 64.84 2edy n SER 9 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2edy s GLY 10 N -1.19 1.69 0.24 0.46 0.00 -1.26 -4.73 107.32 102.52 2edy s GLY 10 Ca 0.00 -1.55 0.09 0.00 0.00 0.00 0.00 44.72 43.26 2edy s GLY 10 CO 0.00 -1.60 -0.03 -0.11 0.00 0.00 0.00 173.10 171.36 2edy s PHE 11 N -2.06 2.68 0.94 1.90 -0.71 -1.26 -4.71 117.98 114.76 2edy s PHE 11 Ca 0.29 -0.22 -0.12 0.00 -1.04 0.00 0.00 56.93 55.84 2edy s PHE 11 Cb -0.08 -1.23 0.15 0.00 -1.21 0.00 0.00 43.02 40.66 2edy s PHE 11 CO 0.18 0.59 1.09 -1.25 -1.34 0.00 0.00 175.22 174.50 2edy s PRO 12 N -3.39 0.92 0.40 1.99 0.04 -1.26 -4.65 135.00 129.05 2edy s PRO 12 Ca 0.29 0.71 0.02 0.00 0.04 0.00 0.00 61.00 62.06 2edy s PRO 12 Cb -0.07 -1.78 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 2edy s PRO 12 CO 0.18 -2.44 0.06 1.04 0.04 0.00 0.00 177.00 175.88 2edy n GLN 13 N -4.00 0.79 -2.11 4.56 1.13 -1.10 -4.79 117.38 111.86 2edy n GLN 13 Ca 0.06 -3.11 -0.17 0.00 -1.94 0.00 0.00 57.00 51.84 2edy n GLN 13 Cb 0.56 1.23 -0.03 0.00 0.11 0.00 0.00 30.24 32.11 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 -1.42 -5.10 -4.62 1.08 5.03 -1.26 0.09 115.26 109.06 2edy n ASN 14 Ca -0.12 0.10 -0.43 0.00 0.87 0.00 0.00 54.58 55.01 2edy n ASN 14 Cb 0.55 -4.17 -0.02 0.00 -1.02 0.00 0.00 39.78 35.11 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 -4.72 3.76 0.00 3.41 2.96 -1.26 -3.75 118.68 119.08 2edy s LEU 15 Ca 0.00 0.96 -0.10 0.00 -0.22 0.00 0.00 54.13 54.77 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 -1.19 0.51 0.00 -1.32 0.00 0.00 176.35 174.36 2edy n HIS 16 N 7.92 -1.17 -4.15 5.38 1.44 -1.20 -4.90 115.22 118.54 2edy n HIS 16 Ca 0.14 -0.75 -0.34 0.00 -2.01 0.00 0.00 57.72 54.76 2edy n HIS 16 Cb 0.47 0.37 -0.11 0.00 0.12 0.00 0.00 29.99 30.85 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 -2.36 4.44 -0.76 0.61 0.11 -1.26 -1.09 120.40 120.09 2edy s VAL 17 Ca 0.11 -0.16 0.23 0.00 -2.93 0.00 0.00 61.98 59.23 2edy s VAL 17 Cb -0.02 -2.98 -0.14 0.00 -1.53 0.00 0.00 36.38 31.71 2edy s VAL 17 CO 0.04 0.47 1.02 1.07 -3.33 0.00 0.00 175.10 174.37 2edy n THR 18 N 3.57 0.08 -2.66 5.04 5.66 -1.25 -4.78 114.28 119.93 2edy n THR 18 Ca -0.17 -0.14 -0.04 0.00 -3.05 0.00 0.00 64.05 60.65 2edy n THR 18 Cb 0.52 0.44 0.05 0.00 -1.55 0.00 0.00 70.33 69.80 2edy n THR 18 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2edy n GLY 19 N 1.42 -1.85 3.58 1.09 0.00 -1.26 -5.06 105.19 103.12 2edy n GLY 19 Ca 0.03 1.26 -0.28 0.00 0.00 0.00 0.00 46.02 47.03 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 0.59 1.10 0.04 0.99 2.34 -1.26 -3.03 118.68 119.44 2edy s LEU 20 Ca 0.24 1.28 -0.07 0.00 0.06 0.00 0.00 54.13 55.64 2edy s LEU 20 Cb 0.17 -3.29 -0.01 0.00 -0.56 0.00 0.00 46.19 42.50 2edy s LEU 20 CO -0.10 -3.73 0.13 -0.89 -1.06 0.00 0.00 176.35 170.71 2edy s THR 21 N -2.73 0.12 0.27 5.48 2.01 0.60 -4.77 115.64 116.62 2edy s THR 21 Ca 0.67 -1.01 -0.06 0.00 0.31 0.00 0.00 61.69 61.61 2edy s THR 21 Cb -0.21 -0.89 0.37 0.00 0.01 0.00 0.00 72.50 71.78 2edy s THR 21 CO 0.61 -0.56 1.59 0.71 -0.69 0.00 0.00 174.62 176.28 2edy h THR 22 N 3.60 0.14 0.00 -0.82 1.35 -1.91 -3.12 112.91 112.15 2edy h THR 22 Ca -0.32 -0.01 -0.36 0.00 -0.55 0.00 0.00 66.41 65.17 2edy h THR 22 Cb 1.19 0.11 -0.06 0.00 -1.73 0.00 0.00 68.15 67.66 2edy h THR 22 CO 0.49 0.01 -2.26 -1.54 -0.25 0.00 0.00 175.52 171.97 2edy n SER 23 N -5.50 1.94 -4.95 5.36 3.41 -1.26 -2.22 113.62 110.40 2edy n SER 23 Ca 0.16 0.11 -0.23 0.00 -0.26 0.00 0.00 58.87 58.65 2edy n SER 23 Cb 0.54 -0.53 -0.00 0.00 -0.26 0.00 0.00 64.21 63.96 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 -2.43 4.56 -0.15 6.66 -4.23 -1.18 -1.70 115.64 117.17 2edy s THR 24 Ca -0.31 -0.51 -0.04 0.00 -1.18 0.00 0.00 61.69 59.65 2edy s THR 24 Cb 0.10 -3.67 0.07 0.00 1.34 0.00 0.00 72.50 70.34 2edy s THR 24 CO 0.45 -0.44 0.14 -0.89 -0.54 0.00 0.00 174.62 173.34 2edy s THR 25 N -2.41 -0.20 0.66 3.99 2.01 -0.99 0.22 115.64 118.92 2edy s THR 25 Ca 0.44 -0.01 -0.13 0.00 0.31 0.00 0.00 61.69 62.31 2edy s THR 25 Cb -0.10 -0.52 -0.01 0.00 0.01 0.00 0.00 72.50 71.88 2edy s THR 25 CO 0.37 -0.14 1.06 -1.61 -0.69 0.00 0.00 174.62 173.61 2edy s GLU 26 N 2.23 3.02 0.10 4.92 2.02 -1.17 0.45 118.70 130.27 2edy s GLU 26 Ca 0.04 1.08 -0.01 0.00 0.02 0.00 0.00 54.97 56.10 2edy s GLU 26 Cb -0.15 -2.00 -0.04 0.00 0.10 0.00 0.00 34.13 32.05 2edy s GLU 26 CO -0.09 -1.04 0.03 -0.51 0.02 0.00 0.00 175.26 173.67 2edy s LEU 27 N -5.16 2.00 -0.30 1.80 1.43 0.39 -3.95 118.68 114.89 2edy s LEU 27 Ca 0.61 -1.12 -0.06 0.00 -1.03 0.00 0.00 54.13 52.53 2edy s LEU 27 Cb -0.15 0.30 0.19 0.00 0.03 0.00 0.00 46.19 46.55 2edy s LEU 27 CO 0.48 -0.69 0.84 0.00 0.23 0.00 0.00 176.35 177.21 2edy s ALA 28 N -4.00 -3.00 0.46 4.21 0.00 -0.25 -3.63 121.76 115.56 2edy s ALA 28 Ca 0.17 1.51 0.03 0.00 0.00 0.00 0.00 51.96 53.67 2edy s ALA 28 Cb 0.08 -2.44 -0.01 0.00 0.00 0.00 0.00 23.12 20.74 2edy s ALA 28 CO -0.03 -1.55 0.10 1.67 0.00 0.00 0.00 175.76 175.95 2edy s TRP 29 N 2.91 1.77 0.24 0.00 -2.14 -0.76 -3.22 118.94 117.72 2edy s TRP 29 Ca 0.11 -1.23 0.10 0.00 2.66 0.00 0.00 56.10 57.74 2edy s TRP 29 Cb -0.11 -1.30 -0.05 0.00 -3.10 0.00 0.00 33.47 28.92 2edy s TRP 29 CO -0.18 -0.17 -0.18 0.16 -2.66 0.00 0.00 176.95 173.93 2edy s ASP 30 N -3.73 3.07 0.84 -2.66 -4.77 0.11 -4.73 116.67 104.81 2edy s ASP 30 Ca 0.14 -1.01 -0.11 0.00 -3.30 0.00 0.00 52.55 48.27 2edy s ASP 30 Cb 0.01 -0.22 0.10 0.00 -1.09 0.00 0.00 42.92 41.72 2edy s ASP 30 CO 0.10 -0.06 1.09 -2.16 0.70 0.00 0.00 175.17 174.85 2edy s PRO 31 N -3.49 1.70 0.13 2.11 0.04 -1.26 -2.69 135.00 131.53 2edy s PRO 31 Ca 0.25 0.98 -0.31 0.00 0.04 0.00 0.00 61.00 61.97 2edy s PRO 31 Cb -0.03 -1.85 -0.08 0.00 0.04 0.00 0.00 34.50 32.58 2edy s PRO 31 CO 0.11 -1.98 1.35 -1.25 0.04 0.00 0.00 177.00 175.26 2edy s PRO 32 N -4.92 4.35 0.20 0.56 0.04 -1.26 -4.38 135.00 129.59 2edy s PRO 32 Ca 0.62 2.03 -0.31 0.00 0.04 0.00 0.00 61.00 63.39 2edy s PRO 32 Cb -0.18 -3.24 -0.16 0.00 0.04 0.00 0.00 34.50 30.96 2edy s PRO 32 CO 0.57 -0.37 0.95 1.33 0.04 0.00 0.00 177.00 179.52 2edy n VAL 33 N 3.61 1.41 -0.41 -0.36 0.24 -1.26 -4.72 118.33 116.84 2edy n VAL 33 Ca 0.10 -0.35 0.37 0.00 -2.04 0.00 0.00 64.34 62.42 2edy n VAL 33 Cb 0.43 -0.60 0.73 0.00 -1.47 0.00 0.00 33.84 32.92 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 2.35 0.08 -1.14 1.34 -0.00 -1.96 0.68 115.31 116.67 2edy h LEU 34 Ca -0.39 0.02 -0.00 0.00 -0.00 0.00 0.00 57.88 57.51 2edy h LEU 34 Cb 1.37 0.01 -0.04 0.00 -0.00 0.00 0.00 40.66 42.01 2edy h LEU 34 CO 0.64 -0.01 0.49 0.00 -0.00 0.00 0.00 178.44 179.56 2edy h ALA 35 N 1.38 1.36 -1.30 0.17 0.00 -2.03 -2.89 119.26 115.95 2edy h ALA 35 Ca 0.66 -0.08 -0.68 0.00 0.00 0.00 0.00 54.91 54.81 2edy h ALA 35 Cb 2.48 -0.32 -0.35 0.00 0.00 0.00 0.00 17.79 19.60 2edy h ALA 35 CO -0.08 0.56 0.17 0.39 0.00 0.00 0.00 179.25 180.28 2edy n GLU 36 N -4.38 3.18 -3.71 0.00 -0.58 0.24 -4.85 120.64 110.53 2edy n GLU 36 Ca 0.09 -4.07 -0.28 0.00 -0.42 0.00 0.00 57.16 52.48 2edy n GLU 36 Cb 0.06 -2.27 -0.11 0.00 -0.57 0.00 0.00 31.44 28.56 2edy n GLU 36 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2edy n ARG 37 N -0.49 1.74 -0.26 3.49 1.74 -1.09 -4.23 116.66 117.56 2edy n ARG 37 Ca 0.46 -4.32 0.18 0.00 -0.77 0.00 0.00 57.85 53.40 2edy n ARG 37 Cb 0.44 -2.16 0.33 0.00 -1.02 0.00 0.00 32.46 30.05 2edy n ARG 37 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2edy n ASN 38 N 1.81 0.07 0.00 0.55 3.02 -1.26 -4.69 115.26 114.76 2edy n ASN 38 Ca 0.23 1.31 0.00 0.00 -0.03 0.00 0.00 54.58 56.10 2edy n ASN 38 Cb 0.39 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 2edy n ASN 38 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2edy n GLY 39 N -1.31 3.36 3.28 7.41 0.00 -1.26 -5.11 105.19 111.56 2edy n GLY 39 Ca 0.23 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 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 3.04 1.59 0.33 1.61 3.03 -1.26 -5.14 118.95 122.15 2edy s ARG 40 Ca 0.00 -0.97 -0.11 0.00 2.03 0.00 0.00 55.73 56.68 2edy s ARG 40 Cb 0.00 -1.69 -0.07 0.00 -1.03 0.00 0.00 34.95 32.16 2edy s ARG 40 CO 0.00 0.44 0.69 0.42 -1.13 0.00 0.00 175.30 175.72 2edy s ILE 41 N -0.75 4.80 0.00 4.99 -1.09 -1.26 -3.91 121.20 123.98 2edy s ILE 41 Ca 0.09 0.66 0.00 0.00 -2.23 0.00 0.00 60.65 59.17 2edy s ILE 41 Cb -0.09 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.12 2edy s ILE 41 CO 0.01 -0.29 0.00 2.30 -1.23 0.00 0.00 174.94 175.73 2edy n ILE 42 N -0.70 0.00 -3.87 2.92 -5.35 -0.08 -4.95 119.36 107.32 2edy n ILE 42 Ca 0.02 0.00 -0.03 0.00 -0.27 0.00 0.00 62.75 62.47 2edy n ILE 42 Cb 0.53 -0.57 0.01 0.00 -1.74 0.00 0.00 39.64 37.88 2edy n ILE 42 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2edy s SER 43 N -2.50 -0.01 0.06 7.28 1.04 -1.25 -4.80 113.70 113.51 2edy s SER 43 Ca 0.00 -0.62 0.01 0.00 0.48 0.00 0.00 55.95 55.82 2edy s SER 43 Cb 0.00 0.48 -0.03 0.00 0.10 0.00 0.00 66.02 66.56 2edy s SER 43 CO 0.00 -0.94 -0.05 -0.31 0.98 0.00 0.00 173.24 172.92 2edy s TYR 44 N -2.28 0.63 -0.27 5.02 1.51 -1.14 -0.78 117.35 120.05 2edy s TYR 44 Ca 0.21 -0.83 0.00 0.00 -1.01 0.00 0.00 57.07 55.44 2edy s TYR 44 Cb -0.02 -0.40 0.05 0.00 -0.11 0.00 0.00 41.96 41.47 2edy s TYR 44 CO 0.05 -0.22 -0.07 0.99 -1.11 0.00 0.00 175.55 175.19 2edy s THR 45 N -2.98 2.60 -0.69 -0.71 2.01 -0.89 -2.94 115.64 112.04 2edy s THR 45 Ca 0.02 -1.36 -0.21 0.00 0.31 0.00 0.00 61.69 60.45 2edy s THR 45 Cb 0.01 -2.44 0.09 0.00 0.01 0.00 0.00 72.50 70.17 2edy s THR 45 CO -0.05 0.04 0.92 -0.69 -0.69 0.00 0.00 174.62 174.15 2edy s VAL 46 N 1.22 4.55 -0.33 3.82 1.01 0.05 -3.00 120.40 127.72 2edy s VAL 46 Ca -0.05 -0.80 -0.20 0.00 0.00 0.00 0.00 61.98 60.94 2edy s VAL 46 Cb -0.19 -4.65 -0.01 0.00 0.00 0.00 0.00 36.38 31.54 2edy s VAL 46 CO -0.04 -1.37 0.61 -0.69 0.00 0.00 0.00 175.10 173.61 2edy s VAL 47 N 3.37 4.94 -0.01 2.92 1.01 -0.99 0.01 120.40 131.65 2edy s VAL 47 Ca 0.21 0.69 0.08 0.00 0.00 0.00 0.00 61.98 62.96 2edy s VAL 47 Cb -0.16 -4.01 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 2edy s VAL 47 CO 0.05 -0.20 -0.25 0.72 0.00 0.00 0.00 175.10 175.42 2edy s PHE 48 N 2.60 2.25 -0.15 5.22 -0.71 0.22 -0.17 117.98 127.24 2edy s PHE 48 Ca 0.24 -0.42 -0.23 0.00 -1.04 0.00 0.00 56.93 55.47 2edy s PHE 48 Cb -0.15 -1.43 0.06 0.00 -1.21 0.00 0.00 43.02 40.29 2edy s PHE 48 CO 0.13 -0.01 0.59 0.50 -1.34 0.00 0.00 175.22 175.09 2edy s ARG 49 N -0.68 0.81 -0.39 1.99 3.52 0.48 -1.50 118.95 123.17 2edy s ARG 49 Ca 0.10 0.54 -0.29 0.00 -0.13 0.00 0.00 55.73 55.95 2edy s ARG 49 Cb -0.10 0.39 0.01 0.00 -1.56 0.00 0.00 34.95 33.69 2edy s ARG 49 CO -0.01 -0.17 1.27 0.34 -0.81 0.00 0.00 175.30 175.92 2edy s ASP 50 N -0.34 6.57 0.11 -2.12 2.15 -1.26 0.21 116.67 122.00 2edy s ASP 50 Ca -0.05 0.83 0.07 0.00 0.43 0.00 0.00 52.55 53.83 2edy s ASP 50 Cb -0.03 -2.54 0.37 0.00 -0.30 0.00 0.00 42.92 40.42 2edy s ASP 50 CO 0.04 -1.23 1.16 2.30 -0.17 0.00 0.00 175.17 177.27 2edy n ILE 51 N 6.67 1.47 0.34 4.11 -5.35 -1.20 0.29 119.36 125.68 2edy n ILE 51 Ca 0.14 0.59 0.11 0.00 -0.27 0.00 0.00 62.75 63.32 2edy n ILE 51 Cb 0.48 -1.59 -0.08 0.00 -1.74 0.00 0.00 39.64 36.72 2edy n ILE 51 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2edy n ASN 52 N -1.71 0.46 -4.65 7.28 3.02 -1.26 -4.97 115.26 113.43 2edy n ASN 52 Ca -0.00 -0.16 -0.32 0.00 -0.03 0.00 0.00 54.58 54.07 2edy n ASN 52 Cb 0.08 1.24 -0.08 0.00 -0.61 0.00 0.00 39.78 40.41 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 -4.23 3.90 -0.27 6.41 0.01 0.15 -5.06 113.70 114.60 2edy s SER 53 Ca -0.01 -1.65 0.10 0.00 1.31 0.00 0.00 55.95 55.70 2edy s SER 53 Cb 0.14 0.50 0.50 0.00 0.21 0.00 0.00 66.02 67.37 2edy s SER 53 CO 0.85 -0.86 1.45 0.00 0.41 0.00 0.00 173.24 175.09 2edy n GLN 54 N -1.20 1.97 -3.28 12.44 10.64 -1.26 -4.62 117.38 132.07 2edy n GLN 54 Ca -0.17 -3.13 -0.46 0.00 -1.83 0.00 0.00 57.00 51.42 2edy n GLN 54 Cb 0.67 -1.81 -0.03 0.00 -0.86 0.00 0.00 30.24 28.20 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 -3.18 3.33 0.19 2.61 2.00 -1.26 -5.05 119.66 118.29 2edy s GLN 55 Ca 0.44 -2.04 -0.27 0.00 -2.00 0.00 0.00 55.36 51.49 2edy s GLN 55 Cb 0.39 -4.39 -0.08 0.00 0.80 0.00 0.00 33.01 29.73 2edy s GLN 55 CO 0.01 -1.36 0.84 -2.00 -0.50 0.00 0.00 175.29 172.29 2edy s GLU 56 N 1.07 4.68 0.17 1.67 2.12 -1.26 -4.08 118.70 123.07 2edy s GLU 56 Ca 0.13 1.29 -0.15 0.00 0.36 0.00 0.00 54.97 56.60 2edy s GLU 56 Cb -0.18 -3.28 0.02 0.00 0.26 0.00 0.00 34.13 30.95 2edy s GLU 56 CO -0.03 0.53 0.43 -0.51 -0.54 0.00 0.00 175.26 175.14 2edy s LEU 57 N -1.09 0.42 0.30 2.70 1.43 -0.56 -5.02 118.68 116.86 2edy s LEU 57 Ca 0.38 -0.57 -0.20 0.00 -1.03 0.00 0.00 54.13 52.72 2edy s LEU 57 Cb -0.24 1.79 0.03 0.00 0.03 0.00 0.00 46.19 47.80 2edy s LEU 57 CO 0.28 -0.97 0.73 0.00 0.23 0.00 0.00 176.35 176.63 2edy s GLN 58 N -3.89 1.89 0.23 1.70 -2.07 -1.26 0.69 119.66 116.95 2edy s GLN 58 Ca 0.10 -1.10 -0.04 0.00 -1.82 0.00 0.00 55.36 52.50 2edy s GLN 58 Cb 0.01 0.61 -0.03 0.00 -1.09 0.00 0.00 33.01 32.51 2edy s GLN 58 CO -0.04 -0.87 0.25 -0.80 -1.32 0.00 0.00 175.29 172.51 2edy s ASN 59 N -2.96 0.19 -0.04 12.60 0.02 0.10 -4.92 114.94 119.94 2edy s ASN 59 Ca 0.12 -1.28 0.02 0.00 -1.02 0.00 0.00 52.86 50.70 2edy s ASN 59 Cb -0.06 0.46 0.01 0.00 0.02 0.00 0.00 41.25 41.68 2edy s ASN 59 CO 0.08 -0.96 -0.08 -0.63 0.02 0.00 0.00 177.10 175.54 2edy s ILE 60 N -4.04 0.72 -0.11 0.60 1.01 -1.26 -0.77 121.20 117.35 2edy s ILE 60 Ca 0.34 -0.28 -0.11 0.00 0.00 0.00 0.00 60.65 60.60 2edy s ILE 60 Cb 0.04 -0.67 0.03 0.00 0.01 0.00 0.00 42.46 41.87 2edy s ILE 60 CO 0.12 0.24 0.30 0.28 0.00 0.00 0.00 174.94 175.88 2edy s THR 61 N 0.49 0.00 -1.87 2.92 -1.32 -1.15 -5.02 115.64 109.69 2edy s THR 61 Ca -0.07 -0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.37 2edy s THR 61 Cb -0.11 -0.43 0.00 0.00 -1.51 0.00 0.00 72.50 70.45 2edy s THR 61 CO 0.01 -0.02 0.89 0.35 -2.21 0.00 0.00 174.62 173.64 2edy n THR 62 N 2.82 0.00 -4.41 5.08 -2.24 -1.26 -2.86 114.28 111.41 2edy n THR 62 Ca -0.13 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.41 2edy n THR 62 Cb 0.58 -0.08 -0.09 0.00 -2.10 0.00 0.00 70.33 68.64 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 -0.92 3.96 -0.01 3.42 1.11 -1.26 -4.90 116.67 118.07 2edy s ASP 63 Ca 0.00 -0.94 0.01 0.00 0.18 0.00 0.00 52.55 51.81 2edy s ASP 63 Cb 0.00 -0.49 0.06 0.00 1.07 0.00 0.00 42.92 43.56 2edy s ASP 63 CO 0.00 -0.04 0.69 0.35 1.18 0.00 0.00 175.17 177.35 2edy n THR 64 N -0.77 0.18 -4.13 -1.27 -2.24 -1.26 -4.71 114.28 100.09 2edy n THR 64 Ca -0.05 -0.10 -0.10 0.00 -2.27 0.00 0.00 64.05 61.52 2edy n THR 64 Cb 0.60 -0.37 -0.09 0.00 -2.10 0.00 0.00 70.33 68.37 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 -1.31 1.07 -0.02 -0.78 1.04 -1.26 -1.84 118.95 115.86 2edy s ARG 65 Ca 0.04 -1.44 -0.29 0.00 -1.04 0.00 0.00 55.73 53.00 2edy s ARG 65 Cb 0.03 0.28 0.10 0.00 -2.04 0.00 0.00 34.95 33.33 2edy s ARG 65 CO 0.02 -0.34 0.89 0.12 -0.04 0.00 0.00 175.30 175.94 2edy s PHE 66 N -4.06 -0.36 -0.24 5.89 5.36 -1.24 -4.89 117.98 118.44 2edy s PHE 66 Ca 0.27 0.28 -0.02 0.00 -0.96 0.00 0.00 56.93 56.50 2edy s PHE 66 Cb 0.06 0.53 0.07 0.00 -0.34 0.00 0.00 43.02 43.34 2edy s PHE 66 CO 0.05 -0.53 0.05 0.99 -1.46 0.00 0.00 175.22 174.32 2edy s THR 67 N -2.88 0.66 1.27 0.12 2.01 -1.26 0.15 115.64 115.71 2edy s THR 67 Ca 0.04 -0.87 -0.16 0.00 0.31 0.00 0.00 61.69 61.01 2edy s THR 67 Cb -0.01 -1.27 0.33 0.00 0.01 0.00 0.00 72.50 71.56 2edy s THR 67 CO -0.08 -0.37 0.98 -0.76 -0.69 0.00 0.00 174.62 173.70 2edy s LEU 68 N 1.77 0.05 0.24 4.42 2.01 0.17 -4.73 118.68 122.61 2edy s LEU 68 Ca 0.02 1.35 -0.22 0.00 0.01 0.00 0.00 54.13 55.29 2edy s LEU 68 Cb -0.17 -3.06 0.03 0.00 0.01 0.00 0.00 46.19 43.00 2edy s LEU 68 CO -0.15 -4.74 0.73 0.42 1.01 0.00 0.00 176.35 173.62 2edy s THR 69 N -2.32 0.00 -1.22 5.49 -4.23 -1.26 -2.36 115.64 109.74 2edy s THR 69 Ca 0.69 -0.78 -0.05 0.00 -1.18 0.00 0.00 61.69 60.36 2edy s THR 69 Cb -0.23 -1.81 0.01 0.00 1.34 0.00 0.00 72.50 71.80 2edy s THR 69 CO 0.64 0.00 1.05 0.61 -0.54 0.00 0.00 174.62 176.38 2edy n GLY 70 N -0.44 -0.40 3.86 3.99 0.00 -1.25 -4.92 105.19 106.03 2edy n GLY 70 Ca -0.06 0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 -6.61 2.55 -0.05 0.99 1.43 -0.69 -5.06 118.68 111.25 2edy s LEU 71 Ca 0.36 -1.39 -0.00 0.00 -1.03 0.00 0.00 54.13 52.07 2edy s LEU 71 Cb -0.16 -1.03 -0.03 0.00 0.03 0.00 0.00 46.19 45.00 2edy s LEU 71 CO 0.68 -1.04 -0.01 -0.75 0.23 0.00 0.00 176.35 175.46 2edy s LYS 72 N -4.16 2.87 0.35 1.70 2.20 -1.26 -4.49 119.74 116.95 2edy s LYS 72 Ca 0.24 -0.51 -0.27 0.00 -0.36 0.00 0.00 55.97 55.07 2edy s LYS 72 Cb -0.01 -2.72 -0.09 0.00 -1.51 0.00 0.00 37.83 33.50 2edy s LYS 72 CO 0.15 0.67 1.21 -1.25 -0.36 0.00 0.00 175.35 175.77 2edy s PRO 73 N -1.14 4.27 -1.14 4.03 0.04 -0.94 -3.58 135.00 136.54 2edy s PRO 73 Ca 0.16 1.98 -0.01 0.00 0.04 0.00 0.00 61.00 63.17 2edy s PRO 73 Cb -0.11 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.50 2edy s PRO 73 CO 0.05 -0.17 0.95 -3.47 0.04 0.00 0.00 177.00 174.40 2edy n ASP 74 N 0.56 -2.32 -3.69 6.66 2.03 -1.12 -4.87 116.55 113.81 2edy n ASP 74 Ca 0.02 -0.58 -0.14 0.00 0.52 0.00 0.00 54.79 54.61 2edy n ASP 74 Cb 0.44 -4.85 -0.14 0.00 -0.72 0.00 0.00 41.12 35.86 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 -3.34 -0.23 0.14 5.18 2.01 -1.24 -4.97 115.64 113.21 2edy s THR 75 Ca 0.04 0.25 -0.31 0.00 0.31 0.00 0.00 61.69 61.97 2edy s THR 75 Cb -0.02 -0.36 -0.09 0.00 0.01 0.00 0.00 72.50 72.04 2edy s THR 75 CO 0.69 0.10 1.54 -0.89 -0.69 0.00 0.00 174.62 175.37 2edy s THR 76 N 1.91 2.82 -0.27 -0.82 2.01 -1.26 -2.87 115.64 117.15 2edy s THR 76 Ca -0.03 0.55 0.02 0.00 0.31 0.00 0.00 61.69 62.54 2edy s THR 76 Cb -0.12 -3.35 0.07 0.00 0.01 0.00 0.00 72.50 69.11 2edy s THR 76 CO -0.08 0.04 -0.03 -0.31 -0.69 0.00 0.00 174.62 173.55 2edy s TYR 77 N 1.34 2.75 -0.50 4.92 2.02 -1.19 -3.26 117.35 123.43 2edy s TYR 77 Ca 0.69 -2.10 -0.26 0.00 -0.37 0.00 0.00 57.07 55.03 2edy s TYR 77 Cb -0.42 -1.92 -0.06 0.00 -0.40 0.00 0.00 41.96 39.17 2edy s TYR 77 CO 0.31 -0.84 2.29 0.34 -1.57 0.00 0.00 175.55 176.08 2edy s ASP 78 N 1.27 4.64 -0.14 2.29 -1.08 0.57 -2.14 116.67 122.08 2edy s ASP 78 Ca -0.02 0.97 -0.01 0.00 -0.52 0.00 0.00 52.55 52.96 2edy s ASP 78 Cb -0.19 -2.51 -0.02 0.00 -1.46 0.00 0.00 42.92 38.74 2edy s ASP 78 CO -0.08 -2.75 -0.09 -0.63 0.52 0.00 0.00 175.17 172.14 2edy s ILE 79 N 11.44 3.39 0.19 4.11 1.01 -1.26 -0.39 121.20 139.70 2edy s ILE 79 Ca 0.92 -0.54 0.02 0.00 0.00 0.00 0.00 60.65 61.05 2edy s ILE 79 Cb -0.17 -2.45 -0.01 0.00 0.01 0.00 0.00 42.46 39.84 2edy s ILE 79 CO 0.25 0.51 0.07 2.29 0.00 0.00 0.00 174.94 178.07 2edy n LYS 80 N 3.49 0.72 -3.62 2.79 2.85 0.76 -0.61 118.16 124.54 2edy n LYS 80 Ca -0.18 -1.59 -0.10 0.00 -1.05 0.00 0.00 58.31 55.39 2edy n LYS 80 Cb 0.53 0.90 -0.04 0.00 -0.65 0.00 0.00 35.03 35.77 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 -2.29 0.04 -0.25 0.58 0.11 -1.26 -2.35 120.40 114.99 2edy s VAL 81 Ca 0.10 -0.52 -0.16 0.00 -2.93 0.00 0.00 61.98 58.48 2edy s VAL 81 Cb 0.01 -1.27 0.07 0.00 -1.53 0.00 0.00 36.38 33.66 2edy s VAL 81 CO 0.07 -0.18 0.62 0.00 -3.33 0.00 0.00 175.10 172.29 2edy s ARG 82 N -3.82 0.65 0.52 1.54 1.70 -1.16 0.41 118.95 118.79 2edy s ARG 82 Ca 0.05 1.09 -0.19 0.00 -0.47 0.00 0.00 55.73 56.20 2edy s ARG 82 Cb 0.00 0.14 -0.07 0.00 -0.57 0.00 0.00 34.95 34.45 2edy s ARG 82 CO -0.09 -0.14 1.06 0.00 -1.08 0.00 0.00 175.30 175.05 2edy s ALA 83 N 1.39 2.80 -0.03 7.88 0.00 -1.26 -2.09 121.76 130.46 2edy s ALA 83 Ca -0.08 0.61 0.05 0.00 0.00 0.00 0.00 51.96 52.53 2edy s ALA 83 Cb -0.06 -3.27 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 2edy s ALA 83 CO -0.15 -0.52 -0.19 -1.58 0.00 0.00 0.00 175.76 173.32 2edy s TRP 84 N -2.04 1.73 0.28 0.00 0.52 0.04 -3.69 118.94 115.77 2edy s TRP 84 Ca 0.68 -0.39 0.09 0.00 0.02 0.00 0.00 56.10 56.50 2edy s TRP 84 Cb -0.18 -1.13 -0.04 0.00 -1.15 0.00 0.00 33.47 30.97 2edy s TRP 84 CO 0.25 -0.08 0.01 0.95 0.02 0.00 0.00 176.95 178.10 2edy s THR 85 N -0.28 3.37 0.58 2.01 -4.23 -0.19 -0.91 115.64 115.99 2edy s THR 85 Ca 0.03 -1.90 0.33 0.00 -1.18 0.00 0.00 61.69 58.98 2edy s THR 85 Cb -0.09 -2.85 0.48 0.00 1.34 0.00 0.00 72.50 71.37 2edy s THR 85 CO 0.00 -0.35 1.60 -1.28 -0.54 0.00 0.00 174.62 174.05 2edy h SER 86 N 1.85 0.00 0.14 3.99 0.87 -1.93 -0.80 113.55 117.67 2edy h SER 86 Ca -0.44 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.11 2edy h SER 86 Cb 1.25 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 2edy h SER 86 CO 0.61 0.00 -0.07 0.11 -0.53 0.00 0.00 176.83 176.95 2edy h LYS 87 N 0.00 -0.18 0.00 2.24 6.56 -1.92 -3.51 116.57 119.76 2edy h LYS 87 Ca 0.51 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 60.11 2edy h LYS 87 Cb 2.49 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 34.19 2edy h LYS 87 CO -0.01 -0.12 0.00 0.41 -2.06 0.00 0.00 179.45 177.67 2edy n GLY 88 N 1.21 1.64 3.57 3.86 0.00 -0.31 -4.91 105.19 110.26 2edy n GLY 88 Ca -0.02 0.26 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 2edy n GLY 88 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2edy s SER 89 N 2.00 3.12 0.00 1.61 0.15 -1.26 -1.03 113.70 118.29 2edy s SER 89 Ca 0.00 -1.55 0.00 0.00 0.70 0.00 0.00 55.95 55.10 2edy s SER 89 Cb 0.00 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.54 2edy s SER 89 CO 0.00 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.29 2edy n GLY 90 N -0.94 5.51 3.58 9.45 0.00 -1.24 -3.77 105.19 117.78 2edy n GLY 90 Ca -0.08 -1.17 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 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 4.93 -1.58 -0.17 1.61 0.04 -1.26 -5.00 135.00 133.58 2edy s PRO 91 Ca 0.00 -0.19 0.01 0.00 0.04 0.00 0.00 61.00 60.85 2edy s PRO 91 Cb 0.00 -1.57 0.02 0.00 0.04 0.00 0.00 34.50 33.00 2edy s PRO 91 CO 0.00 -3.92 -0.17 -0.51 0.04 0.00 0.00 177.00 172.44 2edy s LEU 92 N -7.04 1.92 0.77 -3.56 1.43 -1.26 -4.62 118.68 106.32 2edy s LEU 92 Ca 0.72 -0.58 -0.15 0.00 -1.03 0.00 0.00 54.13 53.09 2edy s LEU 92 Cb -0.08 -1.33 0.01 0.00 0.03 0.00 0.00 46.19 44.82 2edy s LEU 92 CO 0.56 -0.03 0.80 -1.54 0.23 0.00 0.00 176.35 176.36 2edy n SER 93 N 4.69 -0.30 -4.62 2.29 3.41 0.16 -4.87 113.62 114.38 2edy n SER 93 Ca -0.19 0.58 -0.43 0.00 -0.26 0.00 0.00 58.87 58.57 2edy n SER 93 Cb 0.50 -1.34 -0.03 0.00 -0.26 0.00 0.00 64.21 63.09 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 -3.34 3.73 0.77 4.33 0.04 -1.26 -4.31 135.00 134.96 2edy s PRO 94 Ca 0.69 1.59 -0.17 0.00 0.04 0.00 0.00 61.00 63.15 2edy s PRO 94 Cb -0.32 -4.05 -0.12 0.00 0.04 0.00 0.00 34.50 30.05 2edy s PRO 94 CO 0.55 -1.38 -0.24 0.45 0.04 0.00 0.00 177.00 176.43 2edy n SER 95 N 8.69 -4.04 -0.04 6.66 2.88 -1.26 -4.85 113.62 121.66 2edy n SER 95 Ca 0.19 0.44 -0.01 0.00 -1.33 0.00 0.00 58.87 58.15 2edy n SER 95 Cb 0.46 -0.91 -0.10 0.00 -0.75 0.00 0.00 64.21 62.91 2edy n SER 95 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2edy n ILE 96 N -2.19 0.54 -3.22 2.46 -5.35 0.22 -4.89 119.36 106.93 2edy n ILE 96 Ca 0.04 -0.45 -0.15 0.00 -0.27 0.00 0.00 62.75 61.93 2edy n ILE 96 Cb 0.52 -0.36 0.08 0.00 -1.74 0.00 0.00 39.64 38.14 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 -2.28 -5.56 -2.08 6.28 6.02 -1.22 -4.89 117.38 113.64 2edy n GLN 97 Ca -0.14 0.73 -0.40 0.00 -0.01 0.00 0.00 57.00 57.18 2edy n GLN 97 Cb 0.70 -5.38 -0.03 0.00 1.02 0.00 0.00 30.24 26.55 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 -4.14 5.58 -0.43 1.08 0.15 -0.91 -4.23 113.70 110.80 2edy s SER 98 Ca 0.01 0.62 -0.29 0.00 0.70 0.00 0.00 55.95 57.00 2edy s SER 98 Cb -0.00 -2.53 0.02 0.00 -1.71 0.00 0.00 66.02 61.80 2edy s SER 98 CO 0.63 -2.08 1.17 -0.60 1.20 0.00 0.00 173.24 173.56 2edy s ARG 99 N 6.40 3.78 0.57 5.44 3.52 -1.26 -3.18 118.95 134.22 2edy s ARG 99 Ca 0.69 0.76 -0.18 0.00 -0.13 0.00 0.00 55.73 56.87 2edy s ARG 99 Cb -0.15 -3.89 -0.14 0.00 -1.56 0.00 0.00 34.95 29.21 2edy s ARG 99 CO 0.25 -1.30 -0.07 0.25 -0.81 0.00 0.00 175.30 173.63 2edy n THR 100 N 6.65 0.40 -1.92 4.11 -2.24 -1.14 -4.76 114.28 115.38 2edy n THR 100 Ca 0.13 -0.49 -0.41 0.00 -2.27 0.00 0.00 64.05 61.00 2edy n THR 100 Cb 0.48 -0.13 -0.01 0.00 -2.10 0.00 0.00 70.33 68.57 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 -1.34 4.21 -0.56 -0.78 0.00 -1.25 -2.77 119.30 116.81 2edy s MET 101 Ca 0.57 2.43 -0.27 0.00 0.00 0.00 0.00 55.69 58.42 2edy s MET 101 Cb -0.45 -3.04 -0.02 0.00 0.00 0.00 0.00 34.83 31.32 2edy s MET 101 CO 0.66 -0.44 1.83 -1.25 0.00 0.00 0.00 175.02 175.81 2edy s PRO 102 N -1.31 2.77 0.00 3.16 0.04 -1.26 -3.56 135.00 134.84 2edy s PRO 102 Ca 0.55 0.74 0.00 0.00 0.04 0.00 0.00 61.00 62.33 2edy s PRO 102 Cb -0.44 -4.35 0.00 0.00 0.04 0.00 0.00 34.50 29.75 2edy s PRO 102 CO 0.53 -2.56 0.00 1.55 0.04 0.00 0.00 177.00 176.56