#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4r n GLY 3 N 1.25 -0.66 0.93 0.00 0.00 -1.26 -4.96 105.19 100.49 2k4r n GLY 3 Ca 0.02 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 45.64 2k4r n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k4r n ALA 4 N 0.00 2.47 -3.64 4.61 0.00 -1.26 -4.55 120.51 118.14 2k4r n ALA 4 Ca 0.00 -0.68 -0.27 0.00 0.00 0.00 0.00 53.44 52.49 2k4r n ALA 4 Cb 0.00 -0.83 -0.10 0.00 0.00 0.00 0.00 19.45 18.52 2k4r n ALA 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4r n GLY 5 N 1.34 4.42 0.05 0.00 0.00 -1.26 -4.94 105.19 104.79 2k4r n GLY 5 Ca 0.14 -2.67 -0.01 0.00 0.00 0.00 0.00 46.02 43.48 2k4r n GLY 5 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2k4r h GLU 6 N 4.75 0.00 -6.25 1.61 4.39 -1.86 -3.45 114.58 113.76 2k4r h GLU 6 Ca 0.18 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.31 2k4r h GLU 6 Cb 0.71 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 2k4r h GLU 6 CO 0.78 0.00 1.18 -1.25 -1.16 0.00 0.00 179.01 178.55 2k4r s PRO 7 N -1.62 3.80 -0.19 2.33 0.04 -1.03 -4.07 135.00 134.25 2k4r s PRO 7 Ca -0.04 1.87 -0.15 0.00 0.04 0.00 0.00 61.00 62.72 2k4r s PRO 7 Cb 0.01 -4.08 -0.10 0.00 0.04 0.00 0.00 34.50 30.36 2k4r s PRO 7 CO 0.06 -1.30 -0.11 1.87 0.04 0.00 0.00 177.00 177.55 2k4r n TRP 8 N 8.58 0.65 0.00 0.56 -0.00 -1.24 -5.04 117.44 120.94 2k4r n TRP 8 Ca 0.20 0.28 0.00 0.00 -0.00 0.00 0.00 57.50 57.98 2k4r n TRP 8 Cb 0.44 -0.87 0.00 0.00 -0.00 0.00 0.00 31.31 30.89 2k4r n TRP 8 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2k4r n GLY 9 N 1.47 0.38 1.44 5.87 0.00 -1.26 -4.83 105.19 108.26 2k4r n GLY 9 Ca -0.24 -0.05 -0.04 0.00 0.00 0.00 0.00 46.02 45.68 2k4r n GLY 9 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k4r n ASN 10 N 0.00 3.54 -3.64 1.61 5.03 -1.26 -1.95 115.26 118.59 2k4r n ASN 10 Ca 0.00 -3.44 -0.15 0.00 0.87 0.00 0.00 54.58 51.86 2k4r n ASN 10 Cb 0.00 -0.67 -0.07 0.00 -1.02 0.00 0.00 39.78 38.02 2k4r n ASN 10 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k4r s ALA 11 N -3.10 -1.34 0.65 5.41 0.00 -1.25 0.50 121.76 122.63 2k4r s ALA 11 Ca 0.48 1.00 -0.16 0.00 0.00 0.00 0.00 51.96 53.28 2k4r s ALA 11 Cb 0.41 -0.14 -0.00 0.00 0.00 0.00 0.00 23.12 23.38 2k4r s ALA 11 CO 0.07 -0.31 1.17 0.95 0.00 0.00 0.00 175.76 177.64 2k4r s THR 12 N -0.96 2.76 -1.17 0.00 -4.23 -0.19 -3.89 115.64 107.97 2k4r s THR 12 Ca -0.10 0.41 0.13 0.00 -1.18 0.00 0.00 61.69 60.95 2k4r s THR 12 Cb -0.03 -3.01 0.16 0.00 1.34 0.00 0.00 72.50 70.96 2k4r s THR 12 CO 0.06 -0.17 1.40 -0.46 -0.54 0.00 0.00 174.62 174.91 2k4r n ASN 13 N -2.17 0.00 -0.10 3.99 0.23 0.41 0.29 115.26 117.91 2k4r n ASN 13 Ca 0.12 0.34 0.14 0.00 -0.53 0.00 0.00 54.58 54.65 2k4r n ASN 13 Cb 0.51 -0.42 0.54 0.00 -2.08 0.00 0.00 39.78 38.33 2k4r n ASN 13 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2k4r n LEU 14 N -1.42 0.47 -0.56 -4.53 7.94 -0.80 -4.92 117.00 113.19 2k4r n LEU 14 Ca 0.04 0.04 0.00 0.00 -1.11 0.00 0.00 56.01 54.98 2k4r n LEU 14 Cb 0.14 -0.22 0.00 0.00 0.53 0.00 0.00 43.42 43.86 2k4r n LEU 14 CO 0.12 0.09 0.00 0.61 -1.11 0.00 0.00 177.39 177.10 2k4r n GLY 15 N 1.34 0.83 2.79 -3.96 0.00 0.14 -5.11 105.19 101.22 2k4r n GLY 15 Ca 0.12 -0.54 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 2k4r n GLY 15 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k4r s VAL 16 N -2.28 0.46 0.27 1.61 1.01 -1.20 -4.91 120.40 115.35 2k4r s VAL 16 Ca 0.00 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.75 2k4r s VAL 16 Cb 0.00 -0.60 -0.09 0.00 0.00 0.00 0.00 36.38 35.68 2k4r s VAL 16 CO 0.00 0.27 1.19 -2.16 0.00 0.00 0.00 175.10 174.41 2k4r s PRO 17 N 1.94 4.51 -0.00 2.72 0.04 -1.26 -1.02 135.00 141.93 2k4r s PRO 17 Ca 0.05 1.95 -0.27 0.00 0.04 0.00 0.00 61.00 62.78 2k4r s PRO 17 Cb -0.12 -3.17 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 2k4r s PRO 17 CO -0.06 0.01 0.84 0.00 0.04 0.00 0.00 177.00 177.82 2k4r s LEU 19 N 0.59 3.06 0.22 0.00 2.96 0.17 -4.85 118.68 120.84 2k4r s LEU 19 Ca 0.44 0.23 -0.30 0.00 -0.22 0.00 0.00 54.13 54.28 2k4r s LEU 19 Cb -0.20 -3.00 -0.08 0.00 0.50 0.00 0.00 46.19 43.41 2k4r s LEU 19 CO 0.24 -1.35 1.08 -1.00 -1.32 0.00 0.00 176.35 174.00 2k4r s HIS 20 N -2.99 3.64 0.42 5.38 3.76 -1.26 -4.57 115.29 119.67 2k4r s HIS 20 Ca 0.58 1.68 0.13 0.00 -0.15 0.00 0.00 55.06 57.30 2k4r s HIS 20 Cb -0.11 -3.24 0.91 0.00 1.11 0.00 0.00 32.58 31.25 2k4r s HIS 20 CO 0.41 -0.44 1.94 -1.49 -0.85 0.00 0.00 174.74 174.32 2k4r h TRP 21 N 4.57 0.03 -0.00 1.40 4.06 -1.49 -0.89 115.95 123.63 2k4r h TRP 21 Ca -0.45 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.49 2k4r h TRP 21 Cb 1.21 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.36 2k4r h TRP 21 CO 0.61 0.25 -0.10 -3.47 -3.56 0.00 0.00 178.44 172.17 2k4r n ASP 22 N -4.26 0.50 -0.90 -3.49 2.03 -0.95 -3.50 116.55 105.98 2k4r n ASP 22 Ca -0.02 -0.63 0.11 0.00 0.52 0.00 0.00 54.79 54.76 2k4r n ASP 22 Cb 0.29 -0.06 0.11 0.00 -0.72 0.00 0.00 41.12 40.73 2k4r n ASP 22 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2k4r n GLU 23 N -0.91 2.07 -2.00 -0.67 -0.58 -0.34 -4.94 120.64 113.27 2k4r n GLU 23 Ca 0.15 -1.87 -0.42 0.00 -0.42 0.00 0.00 57.16 54.60 2k4r n GLU 23 Cb 0.27 -1.42 -0.03 0.00 -0.57 0.00 0.00 31.44 29.69 2k4r n GLU 23 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2k4r s VAL 24 N -1.70 3.49 0.59 2.62 1.01 -1.21 -4.97 120.40 120.24 2k4r s VAL 24 Ca 0.27 0.68 -0.19 0.00 0.00 0.00 0.00 61.98 62.74 2k4r s VAL 24 Cb 0.19 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 2k4r s VAL 24 CO 0.27 -0.05 1.26 -2.16 0.00 0.00 0.00 175.10 174.42 2k4r s PRO 25 N 3.72 2.91 0.54 2.72 0.04 -1.26 -4.91 135.00 138.76 2k4r s PRO 25 Ca 0.73 1.97 0.21 0.00 0.04 0.00 0.00 61.00 63.95 2k4r s PRO 25 Cb -0.34 -1.98 1.44 0.00 0.04 0.00 0.00 34.50 33.65 2k4r s PRO 25 CO 0.30 -1.29 2.15 -1.00 0.04 0.00 0.00 177.00 177.21 2k4r h PRO 26 N 0.94 0.00 -4.25 0.56 0.13 -2.01 -3.32 132.00 124.05 2k4r h PRO 26 Ca -0.51 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 63.89 2k4r h PRO 26 Cb 1.31 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.17 2k4r h PRO 26 CO 0.55 0.00 -0.34 -0.06 -0.23 0.00 0.00 178.00 177.92 2k4r s PHE 27 N -4.93 3.34 -0.15 1.56 0.08 -1.26 -5.06 117.98 111.55 2k4r s PHE 27 Ca -0.05 -1.53 -0.12 0.00 0.12 0.00 0.00 56.93 55.34 2k4r s PHE 27 Cb 0.17 -3.48 -0.05 0.00 -0.57 0.00 0.00 43.02 39.09 2k4r s PHE 27 CO 0.64 -0.96 0.25 -1.17 -0.10 0.00 0.00 175.22 173.88 2k4r s LEU 28 N 1.48 4.27 0.06 -0.37 2.96 -1.25 -5.00 118.68 120.83 2k4r s LEU 28 Ca 0.04 0.48 -0.22 0.00 -0.22 0.00 0.00 54.13 54.22 2k4r s LEU 28 Cb -0.27 -2.30 -0.13 0.00 0.50 0.00 0.00 46.19 43.99 2k4r s LEU 28 CO 0.02 0.16 1.52 -0.33 -1.32 0.00 0.00 176.35 176.40 2k4r h GLU 29 N 6.37 0.21 -6.25 1.98 5.08 -1.94 -3.44 114.58 116.58 2k4r h GLU 29 Ca -0.43 -0.06 -0.52 0.00 -1.00 0.00 0.00 59.36 57.35 2k4r h GLU 29 Cb 1.17 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.38 2k4r h GLU 29 CO 0.73 0.40 -0.33 1.03 -1.00 0.00 0.00 179.01 179.85 2k4r s ARG 30 N -5.15 3.51 -0.39 2.33 1.81 -1.26 -5.08 118.95 114.72 2k4r s ARG 30 Ca -0.14 -0.38 -0.13 0.00 -1.72 0.00 0.00 55.73 53.36 2k4r s ARG 30 Cb 0.06 -2.82 0.02 0.00 -0.45 0.00 0.00 34.95 31.75 2k4r s ARG 30 CO 0.70 0.37 0.26 0.45 -0.68 0.00 0.00 175.30 176.41 2k4r s SER 31 N -3.33 5.99 0.59 0.23 0.15 -1.26 -4.91 113.70 111.16 2k4r s SER 31 Ca 0.38 -0.84 -0.19 0.00 0.70 0.00 0.00 55.95 56.00 2k4r s SER 31 Cb -0.11 -2.12 -0.04 0.00 -1.71 0.00 0.00 66.02 62.05 2k4r s SER 31 CO 0.30 -0.39 1.23 -2.16 1.20 0.00 0.00 173.24 173.42 2k4r s PRO 32 N 1.65 2.98 0.58 5.44 0.04 -1.26 -4.91 135.00 139.51 2k4r s PRO 32 Ca 0.04 1.90 0.35 0.00 0.04 0.00 0.00 61.00 63.33 2k4r s PRO 32 Cb -0.19 -1.98 1.75 0.00 0.04 0.00 0.00 34.50 34.13 2k4r s PRO 32 CO 0.09 -1.22 2.15 -1.00 0.04 0.00 0.00 177.00 177.06 2k4r h PRO 33 N 0.96 0.00 -3.03 0.56 0.13 -2.01 -3.44 132.00 125.16 2k4r h PRO 33 Ca -0.51 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.67 2k4r h PRO 33 Cb 1.30 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.36 2k4r h PRO 33 CO 0.55 0.04 0.21 0.00 -0.23 0.00 0.00 178.00 178.57 2k4r s ALA 34 N -4.02 -1.26 -0.01 -0.56 0.00 -1.26 -5.12 121.76 109.54 2k4r s ALA 34 Ca -0.02 -0.15 -0.30 0.00 0.00 0.00 0.00 51.96 51.48 2k4r s ALA 34 Cb 0.12 0.87 -0.07 0.00 0.00 0.00 0.00 23.12 24.03 2k4r s ALA 34 CO 0.51 -0.97 1.74 0.45 0.00 0.00 0.00 175.76 177.49 2k4r s SER 35 N -2.89 6.60 -0.02 0.00 0.15 -1.26 -4.87 113.70 111.41 2k4r s SER 35 Ca 0.09 2.40 0.20 0.00 0.70 0.00 0.00 55.95 59.35 2k4r s SER 35 Cb -0.05 -2.54 0.62 0.00 -1.71 0.00 0.00 66.02 62.35 2k4r s SER 35 CO 0.02 -0.95 1.52 -2.67 1.20 0.00 0.00 173.24 172.36 2k4r n TRP 36 N 6.94 1.01 0.22 3.44 4.27 -1.26 -4.12 117.44 127.94 2k4r n TRP 36 Ca 0.18 -0.48 0.06 0.00 -3.89 0.00 0.00 57.50 53.36 2k4r n TRP 36 Cb 0.42 -0.05 0.52 0.00 -1.36 0.00 0.00 31.31 30.84 2k4r n TRP 36 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2k4r h ALA 37 N 4.22 1.75 0.00 -1.67 0.00 -2.01 -0.90 119.26 120.65 2k4r h ALA 37 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2k4r h ALA 37 Cb 1.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2k4r h ALA 37 CO 0.04 0.19 0.00 1.05 0.00 0.00 0.00 179.25 180.53 2k4r h GLU 38 N 0.03 0.00 -0.04 0.00 4.11 -2.00 -2.86 114.58 113.83 2k4r h GLU 38 Ca 0.01 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.39 2k4r h GLU 38 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2k4r h GLU 38 CO 0.02 0.00 -0.20 -0.07 0.07 0.00 0.00 179.01 178.83 2k4r h LEU 39 N 0.00 0.06 1.57 3.06 3.38 -1.44 -3.46 115.31 118.47 2k4r h LEU 39 Ca 0.00 -0.01 -0.39 0.00 0.09 0.00 0.00 57.88 57.57 2k4r h LEU 39 Cb 0.48 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 41.24 2k4r h LEU 39 CO 0.00 0.26 -0.56 0.54 0.09 0.00 0.00 178.44 178.77 2k4r n ARG 40 N -4.28 -3.71 -0.91 1.13 5.12 -1.08 -4.85 116.66 108.07 2k4r n ARG 40 Ca -0.02 0.86 -0.05 0.00 -1.93 0.00 0.00 57.85 56.71 2k4r n ARG 40 Cb 0.27 -5.63 0.27 0.00 -1.16 0.00 0.00 32.46 26.21 2k4r n ARG 40 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k4r n GLY 41 N -1.30 4.00 0.39 -0.13 0.00 -1.26 -4.80 105.19 102.09 2k4r n GLY 41 Ca -0.14 -1.05 -0.11 0.00 0.00 0.00 0.00 46.02 44.72 2k4r n GLY 41 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2k4r h GLN 42 N 2.12 -0.41 -0.00 1.61 1.08 -1.88 -1.68 115.11 115.95 2k4r h GLN 42 Ca 0.25 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.47 2k4r h GLN 42 Cb 2.13 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 29.65 2k4r h GLN 42 CO 0.63 -0.27 0.20 -1.00 -0.95 0.00 0.00 178.83 177.44 2k4r h PRO 43 N -0.42 0.00 0.00 1.46 0.13 -1.96 -2.51 132.00 128.69 2k4r h PRO 43 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2k4r h PRO 43 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 2k4r h PRO 43 CO -0.46 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 174.92 2k4r n HIS 44 N -2.97 0.00 -4.67 1.56 1.44 -0.63 -4.99 115.22 104.96 2k4r n HIS 44 Ca -0.02 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.44 2k4r n HIS 44 Cb 0.26 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.20 2k4r n HIS 44 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2k4r s ASN 45 N -0.98 1.86 0.00 4.39 4.22 -1.26 -1.87 114.94 121.30 2k4r s ASN 45 Ca 0.00 -0.30 0.00 0.00 -2.14 0.00 0.00 52.86 50.42 2k4r s ASN 45 Cb 0.00 -0.62 0.00 0.00 1.28 0.00 0.00 41.25 41.91 2k4r s ASN 45 CO 0.00 0.10 0.00 0.33 -2.04 0.00 0.00 177.10 175.49 2k4r n PHE 46 N 3.37 0.00 -1.55 1.54 7.35 -1.26 -4.84 117.46 122.07 2k4r n PHE 46 Ca -0.19 0.00 -0.54 0.00 -0.76 0.00 0.00 57.45 55.96 2k4r n PHE 46 Cb 0.53 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 40.30 2k4r n PHE 46 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k4r s ARG 48 N 0.10 2.48 -0.34 0.00 1.81 0.35 -4.81 118.95 118.54 2k4r s ARG 48 Ca 0.84 -0.66 -0.03 0.00 -1.72 0.00 0.00 55.73 54.15 2k4r s ARG 48 Cb -1.04 -2.01 0.07 0.00 -0.45 0.00 0.00 34.95 31.52 2k4r s ARG 48 CO 0.52 0.01 0.08 0.45 -0.68 0.00 0.00 175.30 175.68 2k4r s SER 49 N 0.78 5.08 0.41 0.23 0.15 -1.26 -1.64 113.70 117.45 2k4r s SER 49 Ca -0.10 -1.52 0.23 0.00 0.70 0.00 0.00 55.95 55.26 2k4r s SER 49 Cb -0.16 -1.77 0.56 0.00 -1.71 0.00 0.00 66.02 62.94 2k4r s SER 49 CO 0.01 -0.37 1.67 1.55 1.20 0.00 0.00 173.24 177.31 2k4r h PRO 50 N 8.04 0.00 -2.26 5.44 0.13 -1.94 -3.46 132.00 137.96 2k4r h PRO 50 Ca -0.18 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.87 2k4r h PRO 50 Cb 1.06 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 31.98 2k4r h PRO 50 CO 0.60 0.19 0.04 0.34 -0.23 0.00 0.00 178.00 178.94 2k4r s ASP 51 N -6.19 -0.59 0.46 1.44 2.15 -1.26 -5.02 116.67 107.66 2k4r s ASP 51 Ca 0.04 0.89 0.17 0.00 0.43 0.00 0.00 52.55 54.08 2k4r s ASP 51 Cb 0.08 0.86 1.10 0.00 -0.30 0.00 0.00 42.92 44.65 2k4r s ASP 51 CO 0.66 -0.40 2.00 1.23 -0.17 0.00 0.00 175.17 178.50 2k4r h GLY 52 N 4.16 0.00 0.77 2.66 0.00 -1.95 -0.57 103.07 108.15 2k4r h GLY 52 Ca -0.28 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.73 2k4r h GLY 52 CO 0.26 0.00 -1.86 0.00 0.00 0.00 0.00 176.54 174.93 2k4r n ALA 53 N -2.45 1.31 0.29 3.60 0.00 -1.26 -3.94 120.51 118.06 2k4r n ALA 53 Ca -0.02 -0.76 0.14 0.00 0.00 0.00 0.00 53.44 52.80 2k4r n ALA 53 Cb 0.25 -0.73 0.86 0.00 0.00 0.00 0.00 19.45 19.83 2k4r n ALA 53 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2k4r h GLY 54 N 2.79 0.00 -0.74 0.00 0.00 -1.85 -3.49 103.07 99.78 2k4r h GLY 54 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2k4r h GLY 54 CO 0.07 0.00 -0.18 -2.13 0.00 0.00 0.00 176.54 174.30 2k4r n ARG 55 N -3.79 -0.92 -2.04 4.80 0.63 -0.26 -4.89 116.66 110.18 2k4r n ARG 55 Ca -0.03 0.68 -0.42 0.00 -0.92 0.00 0.00 57.85 57.17 2k4r n ARG 55 Cb 0.13 -0.77 -0.03 0.00 0.45 0.00 0.00 32.46 32.24 2k4r n ARG 55 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2k4r s PRO 56 N -5.22 4.25 0.15 -0.14 0.04 -1.26 -4.61 135.00 128.20 2k4r s PRO 56 Ca 0.00 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.25 2k4r s PRO 56 Cb 0.00 -3.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.08 2k4r s PRO 56 CO 0.00 -0.60 0.03 1.67 0.04 0.00 0.00 177.00 178.13 2k4r s TRP 57 N 1.90 1.02 0.23 0.56 1.48 -0.65 -1.78 118.94 121.69 2k4r s TRP 57 Ca 0.69 -1.12 0.01 0.00 -1.06 0.00 0.00 56.10 54.61 2k4r s TRP 57 Cb -0.38 -0.58 -0.04 0.00 -1.16 0.00 0.00 33.47 31.31 2k4r s TRP 57 CO 0.30 -0.37 0.16 0.00 -4.06 0.00 0.00 176.95 172.99 2k4r s PHE 59 N -3.98 3.29 0.11 0.00 0.08 -1.26 -0.50 117.98 115.72 2k4r s PHE 59 Ca 0.39 0.60 0.02 0.00 0.12 0.00 0.00 56.93 58.07 2k4r s PHE 59 Cb 0.06 -2.65 -0.04 0.00 -0.57 0.00 0.00 43.02 39.82 2k4r s PHE 59 CO 0.15 -0.21 0.17 1.52 -0.10 0.00 0.00 175.22 176.76 2k4r s TYR 60 N 2.02 3.34 -0.11 0.36 -0.85 0.20 0.44 117.35 122.76 2k4r s TYR 60 Ca 0.20 0.12 0.01 0.00 -0.52 0.00 0.00 57.07 56.87 2k4r s TYR 60 Cb -0.15 -1.65 -0.02 0.00 0.38 0.00 0.00 41.96 40.52 2k4r s TYR 60 CO 0.09 0.54 -0.13 0.50 -1.52 0.00 0.00 175.55 175.03 2k4r s ARG 61 N -2.75 3.18 0.40 -3.49 3.52 -0.82 -1.65 118.95 117.35 2k4r s ARG 61 Ca 0.32 -0.69 0.08 0.00 -0.13 0.00 0.00 55.73 55.31 2k4r s ARG 61 Cb -0.12 -2.57 -0.05 0.00 -1.56 0.00 0.00 34.95 30.65 2k4r s ARG 61 CO 0.25 0.31 0.20 0.54 -0.81 0.00 0.00 175.30 175.79 2k4r s ASN 62 N 0.10 4.56 -0.03 -2.12 2.20 -0.80 -4.51 114.94 114.34 2k4r s ASN 62 Ca -0.06 -0.97 0.01 0.00 -0.94 0.00 0.00 52.86 50.90 2k4r s ASN 62 Cb -0.15 -0.54 0.07 0.00 -2.00 0.00 0.00 41.25 38.64 2k4r s ASN 62 CO 0.05 -0.51 0.78 0.00 -2.94 0.00 0.00 177.10 174.48 2k4r n ALA 63 N -1.26 2.69 0.42 3.54 0.00 -1.26 -1.96 120.51 122.67 2k4r n ALA 63 Ca -0.01 -0.21 0.04 0.00 0.00 0.00 0.00 53.44 53.27 2k4r n ALA 63 Cb 0.63 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.02 2k4r n ALA 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2k4r n GLN 64 N 0.16 3.63 -0.18 0.00 6.02 -1.26 -4.99 117.38 120.78 2k4r n GLN 64 Ca 0.04 -0.12 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 2k4r n GLN 64 Cb 0.44 -0.95 0.00 0.00 1.02 0.00 0.00 30.24 30.74 2k4r n GLN 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2k4r n GLY 65 N 1.14 0.91 3.92 1.08 0.00 -0.83 -5.08 105.19 106.33 2k4r n GLY 65 Ca 0.02 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2k4r n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k4r s LYS 66 N -0.77 3.54 -0.30 1.61 1.02 -1.25 -4.96 119.74 118.63 2k4r s LYS 66 Ca 0.00 -0.26 -0.02 0.00 0.02 0.00 0.00 55.97 55.71 2k4r s LYS 66 Cb 0.00 -2.86 0.10 0.00 -0.52 0.00 0.00 37.83 34.54 2k4r s LYS 66 CO 0.00 0.45 0.10 0.08 -0.92 0.00 0.00 175.35 175.05 2k4r s VAL 67 N -1.76 0.67 0.28 3.17 1.01 -1.26 -1.90 120.40 120.61 2k4r s VAL 67 Ca 0.39 -1.21 0.04 0.00 0.00 0.00 0.00 61.98 61.20 2k4r s VAL 67 Cb -0.12 -1.48 -0.06 0.00 0.00 0.00 0.00 36.38 34.72 2k4r s VAL 67 CO 0.27 -0.65 0.04 -1.81 0.00 0.00 0.00 175.10 172.95 2k4r s ASP 68 N 1.73 2.05 0.05 3.32 1.01 -0.66 -4.27 116.67 119.90 2k4r s ASP 68 Ca 0.09 -1.32 -0.05 0.00 0.71 0.00 0.00 52.55 51.98 2k4r s ASP 68 Cb -0.17 -0.02 -0.05 0.00 1.01 0.00 0.00 42.92 43.69 2k4r s ASP 68 CO -0.26 -0.58 0.28 -1.66 0.21 0.00 0.00 175.17 173.17 2k4r s TRP 69 N -3.38 3.54 -0.06 4.23 1.48 -1.26 0.62 118.94 124.11 2k4r s TRP 69 Ca 0.34 0.51 -0.18 0.00 -1.06 0.00 0.00 56.10 55.71 2k4r s TRP 69 Cb 0.07 -1.95 0.04 0.00 -1.16 0.00 0.00 33.47 30.47 2k4r s TRP 69 CO 0.13 0.57 0.41 0.20 -4.06 0.00 0.00 176.95 174.19 2k4r s GLY 70 N -2.02 -0.27 0.35 3.67 0.00 0.35 -4.89 107.32 104.50 2k4r s GLY 70 Ca 0.32 0.74 -0.28 0.00 0.00 0.00 0.00 44.72 45.50 2k4r s GLY 70 CO 0.20 0.52 1.25 -0.19 0.00 0.00 0.00 173.10 174.87 2k4r s TYR 71 N -0.88 3.11 -0.94 1.90 2.02 -1.26 -1.70 117.35 119.59 2k4r s TYR 71 Ca -0.09 1.49 -0.08 0.00 -0.37 0.00 0.00 57.07 58.02 2k4r s TYR 71 Cb -0.04 -3.56 -0.14 0.00 -0.40 0.00 0.00 41.96 37.83 2k4r s TYR 71 CO 0.04 -1.57 2.94 0.00 -1.57 0.00 0.00 175.55 175.40 2k4r n ASP 73 N 3.32 0.00 0.00 0.00 5.75 -1.26 -2.46 116.55 121.90 2k4r n ASP 73 Ca 0.59 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.37 2k4r n ASP 73 Cb 0.42 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 2k4r n ASP 73 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k4r n GLY 75 N -0.02 0.64 3.84 0.00 0.00 -1.26 -4.86 105.19 103.52 2k4r n GLY 75 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2k4r n GLY 75 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k4r s GLN 76 N 0.00 4.00 0.00 1.61 0.74 -1.26 -4.52 119.66 120.24 2k4r s GLN 76 Ca 0.00 0.51 0.00 0.00 0.05 0.00 0.00 55.36 55.92 2k4r s GLN 76 Cb 0.00 -3.01 0.00 0.00 1.10 0.00 0.00 33.01 31.10 2k4r s GLN 76 CO 0.00 0.53 0.00 0.41 -0.55 0.00 0.00 175.29 175.68