#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4r s GLY 3 N -0.47 -0.01 -1.46 0.00 0.00 -1.26 -4.95 107.32 99.17 2k4r s GLY 3 Ca -0.02 2.64 -0.11 0.00 0.00 0.00 0.00 44.72 47.24 2k4r s GLY 3 CO 0.25 1.22 1.00 0.00 0.00 0.00 0.00 173.10 175.57 2k4r n ALA 4 N 0.81 -1.40 0.00 3.20 0.00 -1.26 -4.64 120.51 117.22 2k4r n ALA 4 Ca -0.05 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2k4r n ALA 4 Cb 0.58 -4.35 0.00 0.00 0.00 0.00 0.00 19.45 15.68 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 -1.73 -0.27 0.07 0.00 0.00 -1.26 -5.10 105.19 96.89 2k4r n GLY 5 Ca -0.01 -0.10 -0.05 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 0.00 -7.07 1.61 3.07 -1.82 -3.47 114.58 106.90 2k4r h GLU 6 Ca 0.00 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.36 2k4r h GLU 6 Cb 0.00 0.00 0.07 0.00 -0.84 0.00 0.00 28.75 27.98 2k4r h GLU 6 CO 0.00 0.22 0.45 -2.14 -1.40 0.00 0.00 179.01 176.13 2k4r s PRO 7 N -1.95 3.43 0.00 2.33 0.02 -1.24 -4.65 135.00 132.94 2k4r s PRO 7 Ca -0.10 1.66 0.16 0.00 0.02 0.00 0.00 61.00 62.74 2k4r s PRO 7 Cb 0.01 -2.09 0.15 0.00 0.02 0.00 0.00 34.50 32.59 2k4r s PRO 7 CO 0.22 -0.80 1.05 1.87 -0.33 0.00 0.00 177.00 179.01 2k4r n TRP 8 N -1.13 0.05 0.00 6.54 -0.00 -1.24 -4.97 117.44 116.69 2k4r n TRP 8 Ca 0.11 -0.04 0.00 0.00 -0.00 0.00 0.00 57.50 57.57 2k4r n TRP 8 Cb 0.50 -0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.81 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 0.93 1.29 1.91 5.87 0.00 -1.26 -4.27 105.19 109.66 2k4r n GLY 9 Ca 0.10 -0.54 -0.12 0.00 0.00 0.00 0.00 46.02 45.46 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 3.82 4.01 -3.68 1.61 5.03 -1.26 -2.08 115.26 122.71 2k4r n ASN 10 Ca 0.00 -3.45 -0.13 0.00 0.87 0.00 0.00 54.58 51.87 2k4r n ASN 10 Cb 0.00 -0.76 -0.09 0.00 -1.02 0.00 0.00 39.78 37.92 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 -3.15 -1.38 -0.24 5.41 0.00 -1.26 0.55 121.76 121.71 2k4r s ALA 11 Ca 0.54 1.58 -0.32 0.00 0.00 0.00 0.00 51.96 53.76 2k4r s ALA 11 Cb 0.45 -0.92 -0.08 0.00 0.00 0.00 0.00 23.12 22.56 2k4r s ALA 11 CO 0.10 -0.26 2.15 0.25 0.00 0.00 0.00 175.76 178.00 2k4r n THR 12 N 2.85 0.34 0.31 0.00 -2.24 0.15 -3.60 114.28 112.09 2k4r n THR 12 Ca -0.14 -0.33 0.12 0.00 -2.27 0.00 0.00 64.05 61.43 2k4r n THR 12 Cb 0.56 -2.13 0.62 0.00 -2.10 0.00 0.00 70.33 67.28 2k4r n THR 12 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2k4r h ASN 13 N 13.10 0.00 0.01 3.42 -1.07 -1.84 0.64 115.58 129.83 2k4r h ASN 13 Ca -0.38 0.00 -0.00 0.00 0.07 0.00 0.00 56.30 55.99 2k4r h ASN 13 Cb 1.27 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.52 2k4r h ASN 13 CO 0.98 0.00 -0.00 0.25 0.07 0.00 0.00 177.43 178.73 2k4r h LEU 14 N 0.00 0.00 0.00 6.14 5.85 -1.81 -3.45 115.31 122.04 2k4r h LEU 14 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2k4r h LEU 14 Cb 0.89 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.92 2k4r h LEU 14 CO 0.00 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.71 2k4r n GLY 15 N -1.28 0.92 2.96 3.75 0.00 0.21 -5.13 105.19 106.62 2k4r n GLY 15 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.92 1.01 0.55 1.61 1.01 -0.54 -4.99 120.40 118.14 2k4r s VAL 16 Ca 0.00 -0.36 -0.21 0.00 0.00 0.00 0.00 61.98 61.41 2k4r s VAL 16 Cb 0.00 -0.98 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 2k4r s VAL 16 CO 0.00 0.34 1.25 -2.16 0.00 0.00 0.00 175.10 174.54 2k4r s PRO 17 N 1.10 3.21 -0.06 2.72 0.04 -1.26 0.34 135.00 141.09 2k4r s PRO 17 Ca -0.07 1.96 -0.23 0.00 0.04 0.00 0.00 61.00 62.71 2k4r s PRO 17 Cb -0.14 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 2k4r s PRO 17 CO -0.01 -1.05 0.68 0.00 0.04 0.00 0.00 177.00 176.66 2k4r s LEU 19 N 0.68 3.26 0.22 0.00 2.96 0.20 -4.85 118.68 121.15 2k4r s LEU 19 Ca 0.36 0.75 -0.30 0.00 -0.22 0.00 0.00 54.13 54.73 2k4r s LEU 19 Cb -0.18 -3.59 -0.08 0.00 0.50 0.00 0.00 46.19 42.84 2k4r s LEU 19 CO 0.18 -1.03 1.01 -1.00 -1.32 0.00 0.00 176.35 174.19 2k4r s HIS 20 N -2.98 3.80 0.36 5.38 3.76 -1.26 -4.52 115.29 119.82 2k4r s HIS 20 Ca 0.53 1.79 0.11 0.00 -0.15 0.00 0.00 55.06 57.35 2k4r s HIS 20 Cb -0.11 -3.12 0.69 0.00 1.11 0.00 0.00 32.58 31.15 2k4r s HIS 20 CO 0.45 -0.01 1.82 -1.49 -0.85 0.00 0.00 174.74 174.66 2k4r h TRP 21 N 4.41 0.09 -0.00 1.40 4.06 -1.31 -0.40 115.95 124.20 2k4r h TRP 21 Ca -0.45 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.48 2k4r h TRP 21 Cb 1.21 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 29.35 2k4r h TRP 21 CO 0.61 0.41 -0.10 -3.47 -3.56 0.00 0.00 178.44 172.33 2k4r n ASP 22 N -4.11 0.59 -0.90 -3.49 2.03 0.52 -3.57 116.55 107.62 2k4r n ASP 22 Ca -0.02 -0.74 0.07 0.00 0.52 0.00 0.00 54.79 54.62 2k4r n ASP 22 Cb 0.40 -0.04 0.22 0.00 -0.72 0.00 0.00 41.12 40.98 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 -0.81 2.98 -2.56 -0.67 -0.58 -0.17 -4.96 120.64 113.87 2k4r n GLU 23 Ca 0.16 -2.38 -0.43 0.00 -0.42 0.00 0.00 57.16 54.09 2k4r n GLU 23 Cb 0.28 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.64 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 -1.42 4.51 0.39 2.62 1.01 -1.15 -4.88 120.40 121.47 2k4r s VAL 24 Ca 0.33 1.81 -0.27 0.00 0.00 0.00 0.00 61.98 63.86 2k4r s VAL 24 Cb 0.20 -4.20 -0.09 0.00 0.00 0.00 0.00 36.38 32.30 2k4r s VAL 24 CO 0.18 -0.19 1.31 -2.16 0.00 0.00 0.00 175.10 174.24 2k4r s PRO 25 N 3.36 4.05 0.49 2.72 0.04 -1.26 -4.93 135.00 139.47 2k4r s PRO 25 Ca 0.48 2.17 0.14 0.00 0.04 0.00 0.00 61.00 63.84 2k4r s PRO 25 Cb -0.17 -2.82 1.16 0.00 0.04 0.00 0.00 34.50 32.71 2k4r s PRO 25 CO 0.10 -0.43 2.11 -1.00 0.04 0.00 0.00 177.00 177.82 2k4r h PRO 26 N 2.82 0.09 -3.88 0.56 0.13 -2.02 -3.28 132.00 126.42 2k4r h PRO 26 Ca -0.49 -0.01 -0.78 0.00 -0.87 0.00 0.00 66.00 63.84 2k4r h PRO 26 Cb 1.24 -0.02 -0.26 0.00 0.13 0.00 0.00 31.00 32.10 2k4r h PRO 26 CO 0.63 0.09 0.04 -0.06 -0.23 0.00 0.00 178.00 178.47 2k4r s PHE 27 N -5.08 3.67 -0.07 1.56 0.08 -1.26 -5.04 117.98 111.85 2k4r s PHE 27 Ca -0.05 -1.86 -0.04 0.00 0.12 0.00 0.00 56.93 55.09 2k4r s PHE 27 Cb 0.17 -3.82 -0.04 0.00 -0.57 0.00 0.00 43.02 38.76 2k4r s PHE 27 CO 0.68 -1.00 0.11 -1.17 -0.10 0.00 0.00 175.22 173.75 2k4r s LEU 28 N 0.43 4.15 0.08 -0.37 2.96 -1.24 -5.02 118.68 119.67 2k4r s LEU 28 Ca 0.15 0.32 -0.26 0.00 -0.22 0.00 0.00 54.13 54.13 2k4r s LEU 28 Cb -0.14 -2.19 -0.16 0.00 0.50 0.00 0.00 46.19 44.20 2k4r s LEU 28 CO -0.07 0.34 1.67 -0.33 -1.32 0.00 0.00 176.35 176.65 2k4r h GLU 29 N 4.58 -0.23 -6.01 1.98 5.08 -1.92 -3.42 114.58 114.63 2k4r h GLU 29 Ca -0.52 0.02 -0.61 0.00 -1.00 0.00 0.00 59.36 57.25 2k4r h GLU 29 Cb 1.20 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 30.46 2k4r h GLU 29 CO 0.61 -0.12 -0.35 1.03 -1.00 0.00 0.00 179.01 179.18 2k4r s ARG 30 N -6.01 3.62 -0.17 2.33 1.81 -1.26 -5.08 118.95 114.20 2k4r s ARG 30 Ca -0.14 -0.05 -0.12 0.00 -1.72 0.00 0.00 55.73 53.70 2k4r s ARG 30 Cb 0.05 -3.00 -0.05 0.00 -0.45 0.00 0.00 34.95 31.50 2k4r s ARG 30 CO 0.65 0.58 0.21 0.45 -0.68 0.00 0.00 175.30 176.51 2k4r s SER 31 N -1.96 6.34 0.49 0.23 0.15 -1.26 -4.85 113.70 112.84 2k4r s SER 31 Ca 0.33 0.39 -0.21 0.00 0.70 0.00 0.00 55.95 57.15 2k4r s SER 31 Cb -0.13 -2.13 -0.07 0.00 -1.71 0.00 0.00 66.02 61.98 2k4r s SER 31 CO 0.20 0.17 1.13 -2.16 1.20 0.00 0.00 173.24 173.77 2k4r s PRO 32 N 0.25 3.63 0.47 5.44 0.04 -1.26 -4.96 135.00 138.61 2k4r s PRO 32 Ca 0.13 1.65 0.27 0.00 0.04 0.00 0.00 61.00 63.09 2k4r s PRO 32 Cb -0.12 -2.22 0.98 0.00 0.04 0.00 0.00 34.50 33.18 2k4r s PRO 32 CO 0.01 -0.63 1.84 -1.00 0.04 0.00 0.00 177.00 177.27 2k4r h PRO 33 N 1.69 0.00 -3.62 0.56 0.13 -2.02 -3.46 132.00 125.27 2k4r h PRO 33 Ca -0.50 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.56 2k4r h PRO 33 Cb 1.25 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.30 2k4r h PRO 33 CO 0.59 0.14 -0.08 0.00 -0.23 0.00 0.00 178.00 178.42 2k4r s ALA 34 N -3.59 -0.22 -0.10 -0.56 0.00 -1.26 -5.11 121.76 110.92 2k4r s ALA 34 Ca 0.01 -0.91 -0.29 0.00 0.00 0.00 0.00 51.96 50.77 2k4r s ALA 34 Cb 0.09 1.04 -0.05 0.00 0.00 0.00 0.00 23.12 24.20 2k4r s ALA 34 CO 0.61 -0.87 1.74 0.45 0.00 0.00 0.00 175.76 177.70 2k4r s SER 35 N -3.04 6.44 0.00 0.00 0.15 -1.26 -4.86 113.70 111.12 2k4r s SER 35 Ca 0.22 2.09 0.14 0.00 0.70 0.00 0.00 55.95 59.10 2k4r s SER 35 Cb -0.01 -2.53 0.15 0.00 -1.71 0.00 0.00 66.02 61.92 2k4r s SER 35 CO 0.10 -1.14 1.00 -2.67 1.20 0.00 0.00 173.24 171.74 2k4r n TRP 36 N 8.00 0.08 0.29 3.44 4.27 -1.26 -4.22 117.44 128.04 2k4r n TRP 36 Ca 0.19 -0.07 0.14 0.00 -3.89 0.00 0.00 57.50 53.87 2k4r n TRP 36 Cb 0.43 -0.00 0.86 0.00 -1.36 0.00 0.00 31.31 31.24 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 2.76 1.63 0.00 -1.67 0.00 -1.99 0.22 119.26 120.21 2k4r h ALA 37 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k4r h ALA 37 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2k4r h ALA 37 CO 0.00 -0.00 -0.06 0.39 0.00 0.00 0.00 179.25 179.57 2k4r n GLU 38 N -4.00 0.10 -0.00 0.00 4.71 -1.26 -2.30 120.64 117.90 2k4r n GLU 38 Ca -0.03 0.08 0.00 0.00 -0.01 0.00 0.00 57.16 57.20 2k4r n GLU 38 Cb 0.09 -1.61 0.31 0.00 -1.01 0.00 0.00 31.44 29.21 2k4r n GLU 38 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2k4r h LEU 39 N 0.00 0.49 2.61 -4.62 3.38 -1.20 -3.46 115.31 112.51 2k4r h LEU 39 Ca 0.00 -0.08 -0.28 0.00 0.09 0.00 0.00 57.88 57.61 2k4r h LEU 39 Cb 0.59 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2k4r h LEU 39 CO 0.00 0.53 -0.36 -1.14 0.09 0.00 0.00 178.44 177.57 2k4r n ARG 40 N -4.30 -2.18 -1.09 1.13 0.63 -0.97 -4.79 116.66 105.08 2k4r n ARG 40 Ca 0.02 0.66 -0.22 0.00 -0.92 0.00 0.00 57.85 57.39 2k4r n ARG 40 Cb 0.22 -5.28 0.15 0.00 0.45 0.00 0.00 32.46 28.00 2k4r n ARG 40 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k4r n GLY 41 N -0.85 4.35 0.32 5.14 0.00 -1.26 -4.81 105.19 108.08 2k4r n GLY 41 Ca -0.16 -1.09 -0.09 0.00 0.00 0.00 0.00 46.02 44.67 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 1.00 -0.23 -0.01 1.61 1.08 -1.88 -1.32 115.11 115.38 2k4r h GLN 42 Ca 0.56 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.77 2k4r h GLN 42 Cb 2.41 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 29.89 2k4r h GLN 42 CO 1.03 -0.15 0.02 -1.00 -0.95 0.00 0.00 178.83 177.77 2k4r h PRO 43 N -0.23 0.00 0.00 1.46 0.13 -1.94 0.15 132.00 131.57 2k4r h PRO 43 Ca 0.06 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.74 2k4r h PRO 43 Cb 0.40 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.44 2k4r h PRO 43 CO -0.46 0.00 -0.33 -2.39 -0.23 0.00 0.00 178.00 174.59 2k4r n HIS 44 N -3.37 0.74 -4.69 1.56 1.44 -0.50 -4.91 115.22 105.50 2k4r n HIS 44 Ca -0.03 -1.74 -0.24 0.00 -2.01 0.00 0.00 57.72 53.70 2k4r n HIS 44 Cb 0.09 -0.21 -0.15 0.00 0.12 0.00 0.00 29.99 29.85 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 -2.91 1.96 0.00 4.39 4.22 -1.26 -1.89 114.94 119.45 2k4r s ASN 45 Ca 0.01 -0.36 0.00 0.00 -2.14 0.00 0.00 52.86 50.38 2k4r s ASN 45 Cb 0.00 -0.20 0.00 0.00 1.28 0.00 0.00 41.25 42.33 2k4r s ASN 45 CO 0.01 0.17 0.00 0.33 -2.04 0.00 0.00 177.10 175.57 2k4r n PHE 46 N 2.43 0.00 -1.54 1.54 7.35 -1.26 -4.88 117.46 121.10 2k4r n PHE 46 Ca -0.15 0.00 -0.47 0.00 -0.76 0.00 0.00 57.45 56.07 2k4r n PHE 46 Cb 0.54 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.34 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 -1.05 0.41 -0.30 0.00 1.81 -0.11 -4.85 118.95 114.86 2k4r s ARG 48 Ca 0.65 0.04 0.05 0.00 -1.72 0.00 0.00 55.73 54.75 2k4r s ARG 48 Cb -0.81 -0.56 0.20 0.00 -0.45 0.00 0.00 34.95 33.33 2k4r s ARG 48 CO 0.57 -0.13 0.63 0.45 -0.68 0.00 0.00 175.30 176.14 2k4r s SER 49 N 1.02 -1.52 0.01 0.23 0.15 -1.26 -1.95 113.70 110.38 2k4r s SER 49 Ca -0.10 0.11 -0.18 0.00 0.70 0.00 0.00 55.95 56.48 2k4r s SER 49 Cb -0.14 1.96 -0.30 0.00 -1.71 0.00 0.00 66.02 65.83 2k4r s SER 49 CO -0.01 -0.27 1.03 -0.65 1.20 0.00 0.00 173.24 174.53 2k4r h PRO 50 N 7.85 0.49 0.00 5.44 0.11 -1.96 -3.46 132.00 140.47 2k4r h PRO 50 Ca -0.01 -0.70 0.00 0.00 0.11 0.00 0.00 66.00 65.40 2k4r h PRO 50 Cb 1.19 0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.54 2k4r h PRO 50 CO 0.12 1.31 0.00 -0.40 -0.21 0.00 0.00 178.00 178.83 2k4r n ASP 51 N -3.94 2.88 0.00 -2.05 5.75 -1.26 -4.81 116.55 113.12 2k4r n ASP 51 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.64 2k4r n ASP 51 Cb 0.91 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.00 2k4r n ASP 51 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k4r n GLY 52 N 0.00 1.63 0.00 6.12 0.00 -1.26 -2.09 105.19 109.58 2k4r n GLY 52 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2k4r n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k4r n ALA 53 N 0.00 0.00 -1.02 4.61 0.00 -1.26 -4.99 120.51 117.85 2k4r n ALA 53 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2k4r n ALA 53 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2k4r n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4r n GLY 54 N 0.00 0.34 3.23 0.00 0.00 -0.89 -4.99 105.19 102.88 2k4r n GLY 54 Ca 0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 2k4r n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k4r s ARG 55 N -0.95 3.17 0.51 1.61 3.52 -1.26 -5.01 118.95 120.54 2k4r s ARG 55 Ca 0.00 -0.76 -0.23 0.00 -0.13 0.00 0.00 55.73 54.61 2k4r s ARG 55 Cb 0.00 -2.66 -0.06 0.00 -1.56 0.00 0.00 34.95 30.67 2k4r s ARG 55 CO 0.00 -0.08 1.37 -2.14 -0.81 0.00 0.00 175.30 173.64 2k4r s PRO 56 N 1.05 3.33 0.01 5.12 0.02 -1.26 -4.76 135.00 138.50 2k4r s PRO 56 Ca -0.01 2.28 -0.12 0.00 0.02 0.00 0.00 61.00 63.16 2k4r s PRO 56 Cb -0.15 -2.39 0.02 0.00 0.02 0.00 0.00 34.50 32.00 2k4r s PRO 56 CO -0.04 -1.05 0.26 1.67 -0.33 0.00 0.00 177.00 177.51 2k4r s TRP 57 N -1.28 -0.09 0.35 6.54 1.48 -0.82 0.50 118.94 125.62 2k4r s TRP 57 Ca 0.68 0.04 0.04 0.00 -1.06 0.00 0.00 56.10 55.80 2k4r s TRP 57 Cb -0.41 0.05 -0.03 0.00 -1.16 0.00 0.00 33.47 31.92 2k4r s TRP 57 CO 0.50 -0.41 0.15 0.00 -4.06 0.00 0.00 176.95 173.13 2k4r s PHE 59 N -3.41 3.28 -0.17 0.00 0.08 -1.26 -0.31 117.98 116.19 2k4r s PHE 59 Ca 0.32 0.73 -0.09 0.00 0.12 0.00 0.00 56.93 58.00 2k4r s PHE 59 Cb 0.04 -2.77 -0.05 0.00 -0.57 0.00 0.00 43.02 39.68 2k4r s PHE 59 CO 0.17 -0.29 0.14 1.52 -0.10 0.00 0.00 175.22 176.66 2k4r s TYR 60 N 2.34 3.47 -0.09 0.36 -0.85 0.18 0.62 117.35 123.37 2k4r s TYR 60 Ca 0.24 0.41 0.01 0.00 -0.52 0.00 0.00 57.07 57.21 2k4r s TYR 60 Cb -0.16 -2.10 -0.02 0.00 0.38 0.00 0.00 41.96 40.07 2k4r s TYR 60 CO 0.09 0.43 -0.13 0.50 -1.52 0.00 0.00 175.55 174.91 2k4r s ARG 61 N -0.08 2.99 -0.13 -3.49 3.52 -0.70 -1.02 118.95 120.05 2k4r s ARG 61 Ca 0.11 -0.69 -0.03 0.00 -0.13 0.00 0.00 55.73 54.99 2k4r s ARG 61 Cb -0.11 -2.52 -0.03 0.00 -1.56 0.00 0.00 34.95 30.73 2k4r s ARG 61 CO 0.00 0.40 -0.03 -0.80 -0.81 0.00 0.00 175.30 174.06 2k4r s ASN 62 N -0.14 4.86 0.00 -2.12 0.01 0.17 -4.38 114.94 113.34 2k4r s ASN 62 Ca -0.01 -0.06 0.02 0.00 -0.71 0.00 0.00 52.86 52.11 2k4r s ASN 62 Cb -0.14 -1.62 0.12 0.00 0.41 0.00 0.00 41.25 40.03 2k4r s ASN 62 CO 0.03 0.24 0.69 0.00 -1.51 0.00 0.00 177.10 176.56 2k4r n ALA 63 N 3.04 2.11 0.80 0.60 0.00 -1.26 -1.00 120.51 124.80 2k4r n ALA 63 Ca -0.18 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.36 2k4r n ALA 63 Cb 0.53 -1.03 0.01 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.55 0.13 0.00 0.00 3.00 -1.26 -4.94 117.38 113.76 2k4r n GLN 64 Ca 0.02 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2k4r n GLN 64 Cb 0.01 -1.53 0.00 0.00 0.00 0.00 0.00 30.24 28.72 2k4r n GLN 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2k4r n GLY 65 N 1.44 1.98 3.32 1.08 0.00 -0.17 -5.14 105.19 107.70 2k4r n GLY 65 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.23 1.48 -0.32 1.61 1.02 -0.86 -4.96 119.74 117.48 2k4r s LYS 66 Ca 0.00 -1.12 -0.00 0.00 0.02 0.00 0.00 55.97 54.87 2k4r s LYS 66 Cb 0.00 -1.72 0.13 0.00 -0.52 0.00 0.00 37.83 35.72 2k4r s LYS 66 CO 0.00 0.43 0.28 0.08 -0.92 0.00 0.00 175.35 175.21 2k4r s VAL 67 N -0.92 -0.26 0.05 3.17 1.01 -1.26 0.41 120.40 122.60 2k4r s VAL 67 Ca 0.10 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.28 2k4r s VAL 67 Cb -0.10 -0.93 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 2k4r s VAL 67 CO 0.03 -0.61 0.02 0.47 0.00 0.00 0.00 175.10 175.02 2k4r n ASP 68 N 4.89 0.75 -4.34 3.32 8.00 -0.19 -3.17 116.55 125.81 2k4r n ASP 68 Ca 0.02 -1.30 -0.28 0.00 0.71 0.00 0.00 54.79 53.94 2k4r n ASP 68 Cb 0.44 0.16 -0.14 0.00 -0.02 0.00 0.00 41.12 41.56 2k4r n ASP 68 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 2k4r s TRP 69 N -1.84 2.15 -0.03 1.24 1.48 -1.26 0.48 118.94 121.17 2k4r s TRP 69 Ca 0.03 -0.40 -0.13 0.00 -1.06 0.00 0.00 56.10 54.55 2k4r s TRP 69 Cb 0.00 -1.23 0.02 0.00 -1.16 0.00 0.00 33.47 31.10 2k4r s TRP 69 CO 0.02 0.21 0.28 0.20 -4.06 0.00 0.00 176.95 173.60 2k4r s GLY 70 N -1.61 -0.14 0.11 3.67 0.00 0.58 -4.84 107.32 105.09 2k4r s GLY 70 Ca 0.11 0.37 -0.30 0.00 0.00 0.00 0.00 44.72 44.89 2k4r s GLY 70 CO 0.04 0.19 1.22 -0.19 0.00 0.00 0.00 173.10 174.36 2k4r s TYR 71 N -1.03 3.41 -1.61 1.90 2.02 -1.26 -1.74 117.35 119.04 2k4r s TYR 71 Ca -0.11 1.30 -0.10 0.00 -0.37 0.00 0.00 57.07 57.79 2k4r s TYR 71 Cb -0.05 -3.46 -0.08 0.00 -0.40 0.00 0.00 41.96 37.98 2k4r s TYR 71 CO 0.03 -1.40 2.91 0.00 -1.57 0.00 0.00 175.55 175.52 2k4r n ASP 73 N 3.67 0.00 0.00 0.00 2.03 -1.26 -3.58 116.55 117.40 2k4r n ASP 73 Ca 0.77 0.00 0.00 0.00 0.52 0.00 0.00 54.79 56.08 2k4r n ASP 73 Cb 0.24 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.64 2k4r n ASP 73 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k4r n GLY 75 N 0.00 2.47 3.37 0.00 0.00 -1.26 -4.58 105.19 105.19 2k4r n GLY 75 Ca 0.00 -0.71 -0.30 0.00 0.00 0.00 0.00 46.02 45.01 2k4r n GLY 75 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k4r s GLN 76 N -1.04 1.81 0.00 1.61 -1.52 -1.26 -5.14 119.66 114.12 2k4r s GLN 76 Ca 0.43 -1.11 0.00 0.00 -1.95 0.00 0.00 55.36 52.73 2k4r s GLN 76 Cb 0.23 -2.00 0.00 0.00 -0.22 0.00 0.00 33.01 31.01 2k4r s GLN 76 CO 0.30 0.51 0.00 0.41 -0.25 0.00 0.00 175.29 176.26