#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k51 n GLY 3 N -0.37 2.28 3.57 0.00 0.00 -1.26 -4.96 105.19 104.44 2k51 n GLY 3 Ca 0.00 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 2k51 n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k51 s ALA 4 N 0.00 2.43 -0.61 4.61 0.00 -1.26 -2.49 121.76 124.43 2k51 s ALA 4 Ca 0.00 -0.40 -0.00 0.00 0.00 0.00 0.00 51.96 51.56 2k51 s ALA 4 Cb 0.00 -4.20 -0.00 0.00 0.00 0.00 0.00 23.12 18.92 2k51 s ALA 4 CO 0.00 -3.44 0.51 0.41 0.00 0.00 0.00 175.76 173.24 2k51 n GLY 5 N 5.57 0.01 3.54 0.00 0.00 -1.26 -4.97 105.19 108.08 2k51 n GLY 5 Ca 0.20 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2k51 n GLY 5 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k51 s GLU 6 N -4.61 3.38 -0.66 1.61 2.56 -0.85 -4.57 118.70 115.56 2k51 s GLU 6 Ca 0.02 -0.10 -0.27 0.00 0.00 0.00 0.00 54.97 54.61 2k51 s GLU 6 Cb -0.00 -4.05 0.02 0.00 2.00 0.00 0.00 34.13 32.10 2k51 s GLU 6 CO 0.38 -1.57 1.35 -1.25 -0.56 0.00 0.00 175.26 173.60 2k51 s PRO 7 N 4.32 3.23 0.00 4.30 0.04 -1.25 -3.44 135.00 142.20 2k51 s PRO 7 Ca 0.34 0.09 0.16 0.00 0.04 0.00 0.00 61.00 61.63 2k51 s PRO 7 Cb -0.11 -4.15 0.90 0.00 0.04 0.00 0.00 34.50 31.18 2k51 s PRO 7 CO 0.21 -2.07 1.59 1.87 0.04 0.00 0.00 177.00 178.64 2k51 n TRP 8 N 9.56 0.02 0.00 0.56 -0.00 -1.26 -4.96 117.44 121.36 2k51 n TRP 8 Ca 0.08 -0.01 0.00 0.00 -0.00 0.00 0.00 57.50 57.57 2k51 n TRP 8 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.80 2k51 n TRP 8 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2k51 n GLY 9 N 0.77 0.81 1.67 5.87 0.00 -1.26 -4.31 105.19 108.74 2k51 n GLY 9 Ca 0.12 -1.10 -0.05 0.00 0.00 0.00 0.00 46.02 44.99 2k51 n GLY 9 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k51 n ASN 10 N 0.00 4.14 -3.70 1.61 5.03 -1.26 -2.16 115.26 118.92 2k51 n ASN 10 Ca 0.00 -3.33 -0.14 0.00 0.87 0.00 0.00 54.58 51.99 2k51 n ASN 10 Cb 0.00 -0.70 -0.09 0.00 -1.02 0.00 0.00 39.78 37.97 2k51 n ASN 10 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k51 s ALA 11 N -3.04 -1.26 0.28 5.41 0.00 -1.26 0.51 121.76 122.40 2k51 s ALA 11 Ca 0.51 1.39 -0.30 0.00 0.00 0.00 0.00 51.96 53.57 2k51 s ALA 11 Cb 0.42 -0.78 -0.10 0.00 0.00 0.00 0.00 23.12 22.66 2k51 s ALA 11 CO 0.10 -0.25 1.47 0.95 0.00 0.00 0.00 175.76 178.04 2k51 s THR 12 N 0.16 2.46 0.52 0.00 -4.23 0.14 -4.16 115.64 110.53 2k51 s THR 12 Ca -0.01 0.40 0.21 0.00 -1.18 0.00 0.00 61.69 61.10 2k51 s THR 12 Cb -0.04 -3.25 0.34 0.00 1.34 0.00 0.00 72.50 70.89 2k51 s THR 12 CO 0.01 0.07 2.06 -0.55 -0.54 0.00 0.00 174.62 175.67 2k51 h ASN 13 N 4.65 0.03 -0.05 3.99 7.08 -1.86 0.56 115.58 129.98 2k51 h ASN 13 Ca -0.47 0.00 0.02 0.00 -3.08 0.00 0.00 56.30 52.77 2k51 h ASN 13 Cb 1.22 -0.01 -0.00 0.00 -2.08 0.00 0.00 38.32 37.45 2k51 h ASN 13 CO 0.76 0.02 0.13 0.25 -2.08 0.00 0.00 177.43 176.50 2k51 h LEU 14 N 0.03 0.00 0.00 6.14 5.85 -1.90 -3.46 115.31 121.97 2k51 h LEU 14 Ca 0.15 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.87 2k51 h LEU 14 Cb 0.56 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.59 2k51 h LEU 14 CO -0.01 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.70 2k51 n GLY 15 N -1.24 0.94 2.76 3.75 0.00 0.19 -5.00 105.19 106.59 2k51 n GLY 15 Ca -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 2k51 n GLY 15 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k51 s VAL 16 N -1.44 0.20 0.28 1.61 1.01 -0.95 -4.96 120.40 116.15 2k51 s VAL 16 Ca 0.00 0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 2k51 s VAL 16 Cb 0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 36.38 35.91 2k51 s VAL 16 CO 0.00 0.21 1.36 -2.16 0.00 0.00 0.00 175.10 174.51 2k51 s PRO 17 N 1.77 4.32 0.25 2.72 0.04 -1.26 0.28 135.00 143.12 2k51 s PRO 17 Ca 0.01 2.23 -0.30 0.00 0.04 0.00 0.00 61.00 62.98 2k51 s PRO 17 Cb -0.13 -3.10 -0.09 0.00 0.04 0.00 0.00 34.50 31.22 2k51 s PRO 17 CO -0.04 -0.29 1.01 0.00 0.04 0.00 0.00 177.00 177.72 2k51 s LEU 19 N -1.18 3.51 0.27 0.00 2.96 0.19 -4.78 118.68 119.64 2k51 s LEU 19 Ca 0.43 0.20 -0.29 0.00 -0.22 0.00 0.00 54.13 54.25 2k51 s LEU 19 Cb -0.28 -3.08 -0.09 0.00 0.50 0.00 0.00 46.19 43.23 2k51 s LEU 19 CO 0.36 -0.86 1.04 -1.00 -1.32 0.00 0.00 176.35 174.57 2k51 s HIS 20 N -2.64 3.71 0.42 5.38 3.76 -1.26 -4.58 115.29 120.07 2k51 s HIS 20 Ca 0.51 1.77 0.15 0.00 -0.15 0.00 0.00 55.06 57.35 2k51 s HIS 20 Cb -0.10 -3.17 0.95 0.00 1.11 0.00 0.00 32.58 31.36 2k51 s HIS 20 CO 0.38 -0.21 1.94 -1.49 -0.85 0.00 0.00 174.74 174.52 2k51 h TRP 21 N 3.88 0.00 -0.00 1.40 4.06 -1.41 0.10 115.95 123.98 2k51 h TRP 21 Ca -0.46 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.49 2k51 h TRP 21 Cb 1.21 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.37 2k51 h TRP 21 CO 0.59 0.24 -0.20 -3.47 -3.56 0.00 0.00 178.44 172.05 2k51 n ASP 22 N -4.19 0.43 -1.19 -3.49 2.03 -0.63 -3.52 116.55 106.00 2k51 n ASP 22 Ca -0.02 -0.30 0.11 0.00 0.52 0.00 0.00 54.79 55.10 2k51 n ASP 22 Cb 0.30 -0.06 0.27 0.00 -0.72 0.00 0.00 41.12 40.91 2k51 n ASP 22 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2k51 n GLU 23 N -1.17 2.65 -2.19 -0.67 1.02 0.33 -4.92 120.64 115.69 2k51 n GLU 23 Ca 0.10 -2.46 -0.43 0.00 -0.02 0.00 0.00 57.16 54.36 2k51 n GLU 23 Cb 0.31 -1.51 -0.02 0.00 -0.02 0.00 0.00 31.44 30.20 2k51 n GLU 23 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2k51 s VAL 24 N -1.11 3.86 0.56 2.62 1.01 -1.09 -4.88 120.40 121.37 2k51 s VAL 24 Ca 0.42 1.02 -0.20 0.00 0.00 0.00 0.00 61.98 63.22 2k51 s VAL 24 Cb 0.23 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 2k51 s VAL 24 CO 0.30 -0.19 1.19 -2.16 0.00 0.00 0.00 175.10 174.24 2k51 s PRO 25 N 4.10 3.20 0.53 2.72 0.04 -1.26 -4.93 135.00 139.40 2k51 s PRO 25 Ca 0.66 1.77 0.23 0.00 0.04 0.00 0.00 61.00 63.70 2k51 s PRO 25 Cb -0.26 -2.03 1.45 0.00 0.04 0.00 0.00 34.50 33.70 2k51 s PRO 25 CO 0.25 -1.01 2.14 -1.00 0.04 0.00 0.00 177.00 177.42 2k51 h PRO 26 N 1.16 0.00 -4.23 0.56 0.13 -2.01 -3.30 132.00 124.31 2k51 h PRO 26 Ca -0.50 0.00 -0.75 0.00 -0.87 0.00 0.00 66.00 63.88 2k51 h PRO 26 Cb 1.28 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.18 2k51 h PRO 26 CO 0.56 0.06 0.16 -0.06 -0.23 0.00 0.00 178.00 178.49 2k51 s PHE 27 N -4.68 3.42 -0.06 1.56 0.40 -1.26 -5.03 117.98 112.33 2k51 s PHE 27 Ca -0.04 -1.57 -0.11 0.00 -0.60 0.00 0.00 56.93 54.60 2k51 s PHE 27 Cb 0.15 -3.93 -0.05 0.00 0.51 0.00 0.00 43.02 39.71 2k51 s PHE 27 CO 0.62 -1.13 0.28 -1.17 0.70 0.00 0.00 175.22 174.52 2k51 s LEU 28 N 1.31 4.42 -0.00 -0.37 2.96 -1.25 -5.00 118.68 120.76 2k51 s LEU 28 Ca 0.16 0.72 -0.04 0.00 -0.22 0.00 0.00 54.13 54.75 2k51 s LEU 28 Cb -0.16 -2.35 -0.28 0.00 0.50 0.00 0.00 46.19 43.90 2k51 s LEU 28 CO -0.04 0.35 0.83 -0.33 -1.32 0.00 0.00 176.35 175.84 2k51 h GLU 29 N 4.97 0.27 -6.16 1.98 5.08 -1.94 -3.44 114.58 115.34 2k51 h GLU 29 Ca -0.52 -0.46 -0.67 0.00 -1.00 0.00 0.00 59.36 56.70 2k51 h GLU 29 Cb 1.22 0.17 -0.16 0.00 0.50 0.00 0.00 28.75 30.48 2k51 h GLU 29 CO 0.61 1.14 -0.66 1.03 -1.00 0.00 0.00 179.01 180.12 2k51 s ARG 30 N -2.61 2.75 -0.14 2.33 1.81 -1.26 -5.05 118.95 116.77 2k51 s ARG 30 Ca -0.10 -0.60 -0.20 0.00 -1.72 0.00 0.00 55.73 53.12 2k51 s ARG 30 Cb 0.07 -2.63 -0.04 0.00 -0.45 0.00 0.00 34.95 31.90 2k51 s ARG 30 CO 0.85 0.64 0.56 0.45 -0.68 0.00 0.00 175.30 177.12 2k51 s SER 31 N -1.27 6.71 0.56 0.23 0.15 -1.26 -4.82 113.70 114.00 2k51 s SER 31 Ca 0.17 0.85 -0.18 0.00 0.70 0.00 0.00 55.95 57.49 2k51 s SER 31 Cb -0.11 -2.32 -0.05 0.00 -1.71 0.00 0.00 66.02 61.82 2k51 s SER 31 CO 0.07 -0.12 1.06 -2.16 1.20 0.00 0.00 173.24 173.29 2k51 s PRO 32 N 1.14 3.44 0.57 5.44 0.04 -1.26 -4.95 135.00 139.43 2k51 s PRO 32 Ca 0.28 1.32 0.28 0.00 0.04 0.00 0.00 61.00 62.91 2k51 s PRO 32 Cb -0.16 -2.04 1.70 0.00 0.04 0.00 0.00 34.50 34.04 2k51 s PRO 32 CO 0.11 -0.73 2.22 -1.35 0.04 0.00 0.00 177.00 177.29 2k51 h PRO 33 N 0.86 0.00 0.00 0.56 0.11 -2.03 -3.45 132.00 128.05 2k51 h PRO 33 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2k51 h PRO 33 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2k51 h PRO 33 CO 0.58 0.02 0.28 0.00 -0.21 0.00 0.00 178.00 178.67 2k51 n ALA 34 N -2.34 -1.64 -1.83 -0.75 0.00 -1.26 -5.13 120.51 107.55 2k51 n ALA 34 Ca -0.03 -1.04 -0.41 0.00 0.00 0.00 0.00 53.44 51.96 2k51 n ALA 34 Cb 0.11 0.79 -0.02 0.00 0.00 0.00 0.00 19.45 20.33 2k51 n ALA 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k51 s SER 35 N -2.80 6.56 -0.07 0.00 0.15 -1.26 -4.91 113.70 111.37 2k51 s SER 35 Ca 0.14 2.77 0.13 0.00 0.70 0.00 0.00 55.95 59.69 2k51 s SER 35 Cb -0.04 -2.63 0.39 0.00 -1.71 0.00 0.00 66.02 62.03 2k51 s SER 35 CO 0.09 -0.77 1.32 -2.67 1.20 0.00 0.00 173.24 172.41 2k51 n TRP 36 N 2.13 0.64 -0.16 3.44 4.27 -1.26 -4.59 117.44 121.92 2k51 n TRP 36 Ca 0.07 -0.64 0.10 0.00 -3.89 0.00 0.00 57.50 53.13 2k51 n TRP 36 Cb 0.39 -0.13 0.41 0.00 -1.36 0.00 0.00 31.31 30.62 2k51 n TRP 36 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2k51 h ALA 37 N 1.93 1.85 -0.34 -1.67 0.00 -2.01 -0.05 119.26 118.96 2k51 h ALA 37 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2k51 h ALA 37 Cb 1.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2k51 h ALA 37 CO 0.08 0.01 0.00 0.39 0.00 0.00 0.00 179.25 179.73 2k51 n GLU 38 N -4.49 2.47 0.18 0.00 1.02 -1.26 -3.08 120.64 115.48 2k51 n GLU 38 Ca 0.11 -1.51 0.03 0.00 -0.02 0.00 0.00 57.16 55.78 2k51 n GLU 38 Cb 0.32 -1.61 0.32 0.00 -0.02 0.00 0.00 31.44 30.46 2k51 n GLU 38 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2k51 h LEU 39 N 2.15 0.00 1.30 -4.62 3.38 -1.32 -3.47 115.31 112.72 2k51 h LEU 39 Ca 0.00 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.57 2k51 h LEU 39 Cb 0.90 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.69 2k51 h LEU 39 CO 0.13 0.43 -0.59 0.54 0.09 0.00 0.00 178.44 179.04 2k51 n ARG 40 N -3.73 -4.26 -0.93 1.13 5.12 -1.18 -4.85 116.66 107.96 2k51 n ARG 40 Ca -0.01 0.89 -0.07 0.00 -1.93 0.00 0.00 57.85 56.73 2k51 n ARG 40 Cb 0.50 -5.71 0.18 0.00 -1.16 0.00 0.00 32.46 26.28 2k51 n ARG 40 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k51 n GLY 41 N -1.41 5.09 0.44 -0.13 0.00 -1.26 -4.89 105.19 103.04 2k51 n GLY 41 Ca -0.13 -1.40 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 2k51 n GLY 41 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2k51 h GLN 42 N 1.14 -0.46 -0.01 1.61 1.08 -1.90 -1.75 115.11 114.82 2k51 h GLN 42 Ca 0.24 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.48 2k51 h GLN 42 Cb 1.59 0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 29.12 2k51 h GLN 42 CO 0.45 -0.31 0.03 -1.00 -0.95 0.00 0.00 178.83 177.06 2k51 h PRO 43 N -0.48 0.00 0.00 1.46 0.13 -1.95 -1.68 132.00 129.48 2k51 h PRO 43 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2k51 h PRO 43 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2k51 h PRO 43 CO -0.50 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 174.88 2k51 n HIS 44 N -3.28 0.00 -4.30 1.56 1.44 -0.66 -4.92 115.22 105.05 2k51 n HIS 44 Ca -0.03 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.44 2k51 n HIS 44 Cb 0.11 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.09 2k51 n HIS 44 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2k51 s ASN 45 N -0.87 2.65 0.00 4.39 4.22 -1.26 -1.63 114.94 122.45 2k51 s ASN 45 Ca 0.00 -0.70 0.00 0.00 -2.14 0.00 0.00 52.86 50.02 2k51 s ASN 45 Cb 0.00 -0.15 0.00 0.00 1.28 0.00 0.00 41.25 42.38 2k51 s ASN 45 CO 0.00 0.07 0.00 0.33 -2.04 0.00 0.00 177.10 175.46 2k51 n PHE 46 N 1.05 0.00 -1.64 1.54 7.35 -1.26 -4.80 117.46 119.71 2k51 n PHE 46 Ca -0.19 0.00 -0.49 0.00 -0.76 0.00 0.00 57.45 56.01 2k51 n PHE 46 Cb 0.53 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 40.31 2k51 n PHE 46 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k51 s ARG 48 N 0.82 1.17 -0.29 0.00 1.81 0.10 -4.74 118.95 117.82 2k51 s ARG 48 Ca 0.82 -0.39 0.03 0.00 -1.72 0.00 0.00 55.73 54.47 2k51 s ARG 48 Cb -0.80 -1.07 0.20 0.00 -0.45 0.00 0.00 34.95 32.82 2k51 s ARG 48 CO 0.42 0.15 0.64 0.45 -0.68 0.00 0.00 175.30 176.29 2k51 s SER 49 N 0.13 -1.46 -0.07 0.23 0.15 -1.26 -1.85 113.70 109.57 2k51 s SER 49 Ca -0.03 0.31 -0.25 0.00 0.70 0.00 0.00 55.95 56.68 2k51 s SER 49 Cb -0.09 1.98 -0.25 0.00 -1.71 0.00 0.00 66.02 65.95 2k51 s SER 49 CO 0.01 -0.27 0.96 -0.65 1.20 0.00 0.00 173.24 174.49 2k51 h PRO 50 N 7.94 0.16 0.00 5.44 0.11 -1.93 -3.46 132.00 140.26 2k51 h PRO 50 Ca -0.06 -0.20 -0.10 0.00 0.11 0.00 0.00 66.00 65.74 2k51 h PRO 50 Cb 1.18 0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 2k51 h PRO 50 CO 0.14 0.99 -0.09 -0.25 -0.21 0.00 0.00 178.00 178.58 2k51 n ASP 51 N -4.46 -0.25 0.00 -2.05 8.00 -1.26 -4.93 116.55 111.60 2k51 n ASP 51 Ca -0.10 -1.53 0.00 0.00 0.71 0.00 0.00 54.79 53.87 2k51 n ASP 51 Cb 0.55 0.52 0.00 0.00 -0.02 0.00 0.00 41.12 42.17 2k51 n ASP 51 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k51 n GLY 52 N -0.16 2.36 0.88 0.44 0.00 -1.26 -4.58 105.19 102.88 2k51 n GLY 52 Ca 0.01 -0.75 -0.02 0.00 0.00 0.00 0.00 46.02 45.26 2k51 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k51 n ALA 53 N 0.00 2.81 -3.75 4.61 0.00 -1.26 -4.99 120.51 117.94 2k51 n ALA 53 Ca 0.00 -0.80 -0.25 0.00 0.00 0.00 0.00 53.44 52.38 2k51 n ALA 53 Cb 0.00 -0.32 0.05 0.00 0.00 0.00 0.00 19.45 19.17 2k51 n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k51 n GLY 54 N 0.08 -0.45 2.73 0.00 0.00 -1.26 -4.98 105.19 101.31 2k51 n GLY 54 Ca -0.11 0.19 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 2k51 n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k51 s ARG 55 N -6.28 0.09 0.57 1.61 3.52 -1.26 -4.60 118.95 112.60 2k51 s ARG 55 Ca 0.43 0.23 -0.19 0.00 -0.13 0.00 0.00 55.73 56.06 2k51 s ARG 55 Cb -0.21 -1.11 -0.04 0.00 -1.56 0.00 0.00 34.95 32.03 2k51 s ARG 55 CO 0.79 -0.55 1.20 -2.14 -0.81 0.00 0.00 175.30 173.80 2k51 s PRO 56 N 2.25 3.11 0.06 5.12 0.02 -1.26 -4.74 135.00 139.55 2k51 s PRO 56 Ca 0.04 1.82 -0.11 0.00 0.02 0.00 0.00 61.00 62.78 2k51 s PRO 56 Cb -0.15 -2.01 0.01 0.00 0.02 0.00 0.00 34.50 32.38 2k51 s PRO 56 CO -0.09 -1.10 0.24 1.67 -0.33 0.00 0.00 177.00 177.39 2k51 s TRP 57 N -1.59 0.01 0.24 6.54 1.48 -0.77 0.56 118.94 125.41 2k51 s TRP 57 Ca 0.75 -0.25 0.01 0.00 -1.06 0.00 0.00 56.10 55.55 2k51 s TRP 57 Cb -0.30 0.02 -0.05 0.00 -1.16 0.00 0.00 33.47 31.98 2k51 s TRP 57 CO 0.33 -0.49 0.10 0.00 -4.06 0.00 0.00 176.95 172.83 2k51 s PHE 59 N -3.84 3.32 0.07 0.00 0.08 -1.26 -0.30 117.98 116.06 2k51 s PHE 59 Ca 0.37 0.72 0.03 0.00 0.12 0.00 0.00 56.93 58.17 2k51 s PHE 59 Cb 0.08 -2.70 -0.04 0.00 -0.57 0.00 0.00 43.02 39.79 2k51 s PHE 59 CO 0.12 -0.18 0.04 1.52 -0.10 0.00 0.00 175.22 176.62 2k51 s TYR 60 N 1.95 3.10 -0.14 0.36 -0.85 0.23 0.53 117.35 122.53 2k51 s TYR 60 Ca 0.23 0.04 0.01 0.00 -0.52 0.00 0.00 57.07 56.83 2k51 s TYR 60 Cb -0.15 -1.59 -0.00 0.00 0.38 0.00 0.00 41.96 40.59 2k51 s TYR 60 CO 0.09 0.50 -0.17 0.50 -1.52 0.00 0.00 175.55 174.95 2k51 s ARG 61 N -2.25 3.20 0.41 -3.49 3.52 -0.76 -1.31 118.95 118.27 2k51 s ARG 61 Ca 0.27 -0.77 0.07 0.00 -0.13 0.00 0.00 55.73 55.16 2k51 s ARG 61 Cb -0.12 -2.56 0.01 0.00 -1.56 0.00 0.00 34.95 30.72 2k51 s ARG 61 CO 0.19 0.07 0.57 0.54 -0.81 0.00 0.00 175.30 175.86 2k51 s ASN 62 N 0.67 5.71 -0.01 -2.12 2.20 -0.15 -4.52 114.94 116.73 2k51 s ASN 62 Ca -0.08 -0.28 0.01 0.00 -0.94 0.00 0.00 52.86 51.57 2k51 s ASN 62 Cb -0.16 -0.88 0.04 0.00 -2.00 0.00 0.00 41.25 38.26 2k51 s ASN 62 CO 0.02 -0.71 0.68 0.00 -2.94 0.00 0.00 177.10 174.15 2k51 n ALA 63 N -1.86 2.56 0.36 3.54 0.00 -1.26 -1.72 120.51 122.13 2k51 n ALA 63 Ca 0.05 -0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.44 2k51 n ALA 63 Cb 0.59 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 19.07 2k51 n ALA 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2k51 n GLN 64 N -0.06 0.28 0.00 0.00 6.02 -1.26 -4.99 117.38 117.37 2k51 n GLN 64 Ca 0.02 -0.99 0.00 0.00 -0.01 0.00 0.00 57.00 56.02 2k51 n GLN 64 Cb 0.24 -1.16 0.00 0.00 1.02 0.00 0.00 30.24 30.34 2k51 n GLN 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2k51 n GLY 65 N 0.50 0.53 3.90 1.08 0.00 -0.70 -5.07 105.19 105.43 2k51 n GLY 65 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2k51 n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k51 s LYS 66 N -0.89 3.61 -0.31 1.61 1.02 -1.25 -4.90 119.74 118.62 2k51 s LYS 66 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 55.97 55.88 2k51 s LYS 66 Cb 0.00 -2.81 0.10 0.00 -0.52 0.00 0.00 37.83 34.60 2k51 s LYS 66 CO 0.00 0.41 0.08 0.08 -0.92 0.00 0.00 175.35 175.00 2k51 s VAL 67 N -1.77 1.14 0.30 3.17 1.01 -1.26 -0.98 120.40 122.02 2k51 s VAL 67 Ca 0.41 -1.53 0.04 0.00 0.00 0.00 0.00 61.98 60.90 2k51 s VAL 67 Cb -0.12 -1.83 -0.06 0.00 0.00 0.00 0.00 36.38 34.37 2k51 s VAL 67 CO 0.26 -0.62 0.05 -1.81 0.00 0.00 0.00 175.10 172.98 2k51 s ASP 68 N 1.49 2.23 0.09 3.32 1.01 -0.43 -3.77 116.67 120.61 2k51 s ASP 68 Ca 0.09 -1.35 0.02 0.00 0.71 0.00 0.00 52.55 52.02 2k51 s ASP 68 Cb -0.18 -0.06 -0.04 0.00 1.01 0.00 0.00 42.92 43.66 2k51 s ASP 68 CO -0.21 -0.59 0.18 -1.66 0.21 0.00 0.00 175.17 173.10 2k51 s TRP 69 N -3.33 3.38 -0.03 4.23 1.48 -1.26 0.78 118.94 124.20 2k51 s TRP 69 Ca 0.35 0.15 -0.10 0.00 -1.06 0.00 0.00 56.10 55.45 2k51 s TRP 69 Cb 0.08 -1.68 0.01 0.00 -1.16 0.00 0.00 33.47 30.72 2k51 s TRP 69 CO 0.14 0.55 0.22 0.20 -4.06 0.00 0.00 176.95 174.00 2k51 s GLY 70 N -2.65 -0.08 0.07 3.67 0.00 0.59 -4.89 107.32 104.03 2k51 s GLY 70 Ca 0.33 0.24 -0.31 0.00 0.00 0.00 0.00 44.72 44.98 2k51 s GLY 70 CO 0.26 0.10 1.21 -0.19 0.00 0.00 0.00 173.10 174.47 2k51 s TYR 71 N -0.92 3.43 -1.15 1.90 2.02 -1.26 -1.84 117.35 119.52 2k51 s TYR 71 Ca -0.10 1.29 -0.16 0.00 -0.37 0.00 0.00 57.07 57.73 2k51 s TYR 71 Cb -0.05 -3.43 0.15 0.00 -0.40 0.00 0.00 41.96 38.22 2k51 s TYR 71 CO 0.02 -1.33 1.40 0.00 -1.57 0.00 0.00 175.55 174.07 2k51 n ASP 73 N 6.26 0.10 0.00 0.00 2.03 -1.22 -2.00 116.55 121.72 2k51 n ASP 73 Ca 0.35 0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.72 2k51 n ASP 73 Cb 0.45 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.85 2k51 n ASP 73 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k51 n GLY 75 N 0.00 -1.03 3.57 0.00 0.00 -1.26 -4.92 105.19 101.55 2k51 n GLY 75 Ca 0.00 0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 2k51 n GLY 75 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k51 s GLN 76 N -2.99 3.52 0.00 1.61 2.00 -1.26 -5.08 119.66 117.46 2k51 s GLN 76 Ca 0.00 0.19 0.00 0.00 -2.00 0.00 0.00 55.36 53.55 2k51 s GLN 76 Cb -0.00 -3.98 0.00 0.00 0.80 0.00 0.00 33.01 29.83 2k51 s GLN 76 CO 0.58 -1.49 0.00 0.41 -0.50 0.00 0.00 175.29 174.29