#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u4r n SER 5 N 0.00 3.96 -4.89 4.04 2.88 -1.26 -4.95 113.62 113.40 1u4r n SER 5 Ca 0.00 -2.01 -0.29 0.00 -1.33 0.00 0.00 58.87 55.24 1u4r n SER 5 Cb 0.00 -0.49 -0.02 0.00 -0.75 0.00 0.00 64.21 62.96 1u4r n SER 5 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1u4r s ASP 6 N -1.00 6.41 0.63 -3.46 1.01 -1.26 -5.04 116.67 113.95 1u4r s ASP 6 Ca 0.48 1.04 -0.18 0.00 0.71 0.00 0.00 52.55 54.60 1u4r s ASP 6 Cb 0.25 -2.29 -0.03 0.00 1.01 0.00 0.00 42.92 41.87 1u4r s ASP 6 CO 0.33 -0.47 1.12 0.35 0.21 0.00 0.00 175.17 176.70 1u4r n THR 7 N -1.69 4.30 -4.52 -1.27 -2.24 -1.26 -5.00 114.28 102.60 1u4r n THR 7 Ca 0.02 -0.50 -0.33 0.00 -2.27 0.00 0.00 64.05 60.96 1u4r n THR 7 Cb 0.54 -1.31 -0.15 0.00 -2.10 0.00 0.00 70.33 67.31 1u4r n THR 7 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1u4r s THR 8 N -1.46 2.67 0.00 4.28 2.01 -1.26 -5.02 115.64 116.87 1u4r s THR 8 Ca 0.79 -0.77 -0.30 0.00 0.31 0.00 0.00 61.69 61.72 1u4r s THR 8 Cb -0.40 -2.13 -0.05 0.00 0.01 0.00 0.00 72.50 69.93 1u4r s THR 8 CO 0.44 0.51 1.36 -2.16 -0.69 0.00 0.00 174.62 174.08 1u4r s PRO 9 N 0.82 4.30 0.21 4.92 0.04 -1.26 -5.01 135.00 139.02 1u4r s PRO 9 Ca -0.05 1.92 0.07 0.00 0.04 0.00 0.00 61.00 62.99 1u4r s PRO 9 Cb -0.15 -3.54 -0.05 0.00 0.04 0.00 0.00 34.50 30.80 1u4r s PRO 9 CO -0.00 -0.53 -0.13 0.00 0.04 0.00 0.00 177.00 176.38 1u4r n PHE 12 N 1.81 0.00 -3.53 0.00 3.72 -1.26 -4.52 117.46 113.67 1u4r n PHE 12 Ca -0.16 -0.36 -0.10 0.00 -0.05 0.00 0.00 57.45 56.78 1u4r n PHE 12 Cb 0.52 -0.05 -0.04 0.00 -0.94 0.00 0.00 39.48 38.97 1u4r n PHE 12 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1u4r s ALA 13 N -0.88 -1.86 -0.01 4.37 0.00 -1.26 -5.18 121.76 116.94 1u4r s ALA 13 Ca 0.06 1.28 0.08 0.00 0.00 0.00 0.00 51.96 53.38 1u4r s ALA 13 Cb 0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 1u4r s ALA 13 CO 0.01 -0.50 -0.25 0.71 0.00 0.00 0.00 175.76 175.72 1u4r s TYR 14 N -2.09 2.27 0.55 0.00 2.02 -1.26 -4.56 117.35 114.27 1u4r s TYR 14 Ca 0.00 -0.42 -0.21 0.00 -0.37 0.00 0.00 57.07 56.07 1u4r s TYR 14 Cb -0.01 -1.44 -0.06 0.00 -0.40 0.00 0.00 41.96 40.05 1u4r s TYR 14 CO -0.03 -0.01 1.13 1.51 -1.57 0.00 0.00 175.55 176.59 1u4r n ILE 15 N 2.34 3.57 0.73 2.71 0.13 -0.33 -4.90 119.36 123.62 1u4r n ILE 15 Ca -0.16 -0.50 0.13 0.00 -1.10 0.00 0.00 62.75 61.11 1u4r n ILE 15 Cb 0.51 -1.36 0.31 0.00 -0.84 0.00 0.00 39.64 38.26 1u4r n ILE 15 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1u4r n ALA 16 N -1.25 2.81 -2.40 1.51 0.00 -1.26 -4.76 120.51 115.16 1u4r n ALA 16 Ca 0.12 -0.20 -0.08 0.00 0.00 0.00 0.00 53.44 53.28 1u4r n ALA 16 Cb 0.45 -1.27 -0.08 0.00 0.00 0.00 0.00 19.45 18.54 1u4r n ALA 16 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1u4r s ARG 17 N -3.09 0.74 0.39 0.00 1.81 -1.26 -5.13 118.95 112.40 1u4r s ARG 17 Ca 0.09 -1.04 -0.26 0.00 -1.72 0.00 0.00 55.73 52.81 1u4r s ARG 17 Cb 0.15 0.28 -0.11 0.00 -0.45 0.00 0.00 34.95 34.82 1u4r s ARG 17 CO 0.66 -0.20 1.08 -2.30 -0.68 0.00 0.00 175.30 173.87 1u4r n PRO 18 N 0.07 1.54 -2.60 3.54 -0.02 -1.26 -4.96 135.00 131.31 1u4r n PRO 18 Ca -0.15 0.55 -0.32 0.00 -2.02 0.00 0.00 63.50 61.56 1u4r n PRO 18 Cb 0.62 -2.10 -0.04 0.00 -0.02 0.00 0.00 33.50 31.95 1u4r n PRO 18 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1u4r s LEU 19 N -0.60 3.75 -0.13 2.45 1.43 -1.26 -4.94 118.68 119.38 1u4r s LEU 19 Ca 0.61 1.54 -0.29 0.00 -1.03 0.00 0.00 54.13 54.96 1u4r s LEU 19 Cb -0.57 -4.44 -0.06 0.00 0.03 0.00 0.00 46.19 41.15 1u4r s LEU 19 CO 0.58 -0.49 1.97 -2.16 0.23 0.00 0.00 176.35 176.48 1u4r s PRO 20 N -3.75 3.65 0.22 1.29 0.04 -1.26 -4.86 135.00 130.33 1u4r s PRO 20 Ca 0.59 2.12 -0.12 0.00 0.04 0.00 0.00 61.00 63.63 1u4r s PRO 20 Cb -0.10 -4.21 0.29 0.00 0.04 0.00 0.00 34.50 30.52 1u4r s PRO 20 CO 0.26 -1.50 1.62 -0.09 0.04 0.00 0.00 177.00 177.33 1u4r h ARG 21 N 12.36 0.02 0.00 4.56 9.65 -1.98 -1.98 114.38 137.02 1u4r h ARG 21 Ca -0.42 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.46 1u4r h ARG 21 Cb 1.21 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.79 1u4r h ARG 21 CO 0.97 0.01 0.12 0.00 2.80 0.00 0.00 179.97 183.87 1u4r h ALA 22 N 1.67 1.12 0.00 2.80 0.00 -2.05 -0.95 119.26 121.85 1u4r h ALA 22 Ca 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1u4r h ALA 22 Cb 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1u4r h ALA 22 CO -0.68 -0.12 -0.45 0.45 0.00 0.00 0.00 179.25 178.46 1u4r h HIS 23 N 0.00 0.00 -2.98 0.00 3.86 -1.74 -3.45 115.15 110.83 1u4r h HIS 23 Ca 0.00 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.67 1u4r h HIS 23 Cb 0.25 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.72 1u4r h HIS 23 CO 0.00 0.02 0.75 0.42 0.86 0.00 0.00 177.93 179.98 1u4r s ILE 24 N -3.27 3.58 -0.17 2.45 -1.09 -0.36 -4.56 121.20 117.78 1u4r s ILE 24 Ca 0.04 1.07 -0.10 0.00 -2.23 0.00 0.00 60.65 59.43 1u4r s ILE 24 Cb 0.07 -3.69 -0.07 0.00 -1.58 0.00 0.00 42.46 37.19 1u4r s ILE 24 CO 0.72 0.05 -0.25 1.17 -1.23 0.00 0.00 174.94 175.40 1u4r n LYS 25 N 4.58 0.40 -3.87 2.79 4.81 0.11 -5.03 118.16 121.94 1u4r n LYS 25 Ca 0.12 0.17 -0.14 0.00 -0.87 0.00 0.00 58.31 57.59 1u4r n LYS 25 Cb 0.43 -1.17 -0.03 0.00 0.02 0.00 0.00 35.03 34.28 1u4r n LYS 25 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1u4r n GLU 26 N -3.92 0.64 -3.95 1.64 1.02 -0.82 -5.02 120.64 110.23 1u4r n GLU 26 Ca -0.32 -2.69 -0.09 0.00 -0.02 0.00 0.00 57.16 54.04 1u4r n GLU 26 Cb 0.68 2.55 -0.05 0.00 -0.02 0.00 0.00 31.44 34.60 1u4r n GLU 26 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 1u4r s TYR 27 N -3.05 0.27 -0.14 -0.32 1.13 -1.26 -0.29 117.35 113.69 1u4r s TYR 27 Ca 0.28 -0.63 -0.30 0.00 -1.41 0.00 0.00 57.07 55.01 1u4r s TYR 27 Cb -0.01 0.20 0.11 0.00 -1.10 0.00 0.00 41.96 41.17 1u4r s TYR 27 CO 0.20 -0.95 0.90 -0.59 -2.51 0.00 0.00 175.55 172.61 1u4r s PHE 28 N -3.98 -0.46 -0.12 -3.49 -0.12 -0.93 -4.95 117.98 103.92 1u4r s PHE 28 Ca 0.19 0.82 -0.21 0.00 -0.05 0.00 0.00 56.93 57.68 1u4r s PHE 28 Cb -0.00 0.43 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 1u4r s PHE 28 CO 0.06 -0.41 0.62 0.71 -0.05 0.00 0.00 175.22 176.15 1u4r s TYR 29 N -1.05 3.50 0.61 3.49 1.51 -1.26 -0.12 117.35 124.03 1u4r s TYR 29 Ca -0.04 1.06 -0.19 0.00 -1.01 0.00 0.00 57.07 56.89 1u4r s TYR 29 Cb -0.01 -2.74 -0.03 0.00 -0.11 0.00 0.00 41.96 39.07 1u4r s TYR 29 CO 0.04 0.02 1.27 0.95 -1.11 0.00 0.00 175.55 176.71 1u4r s THR 30 N 1.12 2.29 0.40 -0.71 -4.23 -0.32 -4.90 115.64 109.29 1u4r s THR 30 Ca 0.32 0.18 -0.23 0.00 -1.18 0.00 0.00 61.69 60.79 1u4r s THR 30 Cb -0.16 -3.08 -0.13 0.00 1.34 0.00 0.00 72.50 70.47 1u4r s THR 30 CO 0.14 -0.03 0.47 -0.24 -0.54 0.00 0.00 174.62 174.41 1u4r n SER 31 N -1.65 -1.22 0.28 3.99 2.88 -1.26 -4.73 113.62 111.91 1u4r n SER 31 Ca 0.14 0.91 0.17 0.00 -1.33 0.00 0.00 58.87 58.76 1u4r n SER 31 Cb 0.48 -1.07 0.76 0.00 -0.75 0.00 0.00 64.21 63.64 1u4r n SER 31 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1u4r h GLY 32 N 0.75 0.00 2.00 0.46 0.00 -1.95 -2.04 103.07 102.29 1u4r h GLY 32 Ca -0.39 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 1u4r h GLY 32 CO 0.51 0.00 -0.07 0.50 0.00 0.00 0.00 176.54 177.48 1u4r h LYS 33 N 0.00 0.00 -7.19 4.80 1.57 -1.97 -3.43 116.57 110.35 1u4r h LYS 33 Ca -0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 1u4r h LYS 33 Cb 0.43 0.00 0.13 0.00 0.08 0.00 0.00 32.23 32.87 1u4r h LYS 33 CO 0.00 0.07 0.38 0.00 -0.57 0.00 0.00 179.45 179.33 1u4r h SER 35 N -0.20 0.00 -3.52 0.00 4.64 -1.88 -3.44 113.55 109.15 1u4r h SER 35 Ca -0.47 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.18 1u4r h SER 35 Cb 1.27 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.17 1u4r h SER 35 CO 0.51 0.66 -0.68 0.20 -0.87 0.00 0.00 176.83 176.65 1u4r s ASN 36 N -6.57 4.74 0.22 4.97 0.02 -1.26 -5.10 114.94 111.96 1u4r s ASN 36 Ca 0.02 -0.04 -0.24 0.00 -1.02 0.00 0.00 52.86 51.59 1u4r s ASN 36 Cb 0.09 -1.37 -0.09 0.00 0.02 0.00 0.00 41.25 39.91 1u4r s ASN 36 CO 0.76 0.31 0.80 -2.16 0.02 0.00 0.00 177.10 176.84 1u4r s PRO 37 N -0.51 4.47 0.05 -0.60 0.04 -1.26 -4.72 135.00 132.48 1u4r s PRO 37 Ca 0.08 1.11 -0.27 0.00 0.04 0.00 0.00 61.00 61.96 1u4r s PRO 37 Cb -0.12 -3.03 0.09 0.00 0.04 0.00 0.00 34.50 31.48 1u4r s PRO 37 CO 0.02 0.45 0.80 0.00 0.04 0.00 0.00 177.00 178.31 1u4r s ALA 38 N -1.38 -1.74 -0.10 8.56 0.00 -1.26 -4.68 121.76 121.15 1u4r s ALA 38 Ca 0.41 0.81 0.01 0.00 0.00 0.00 0.00 51.96 53.20 1u4r s ALA 38 Cb -0.20 0.57 -0.02 0.00 0.00 0.00 0.00 23.12 23.48 1u4r s ALA 38 CO 0.24 -0.73 -0.14 0.08 0.00 0.00 0.00 175.76 175.22 1u4r s VAL 39 N -3.33 3.04 -0.30 0.00 1.01 -0.98 -1.17 120.40 118.67 1u4r s VAL 39 Ca 0.04 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 1u4r s VAL 39 Cb -0.01 -2.25 0.03 0.00 0.00 0.00 0.00 36.38 34.15 1u4r s VAL 39 CO -0.10 0.55 0.03 -0.69 0.00 0.00 0.00 175.10 174.89 1u4r s VAL 40 N 0.01 3.43 0.16 2.92 1.01 0.83 -0.70 120.40 128.06 1u4r s VAL 40 Ca -0.04 -1.04 -0.30 0.00 0.00 0.00 0.00 61.98 60.60 1u4r s VAL 40 Cb -0.14 -2.85 -0.07 0.00 0.00 0.00 0.00 36.38 33.32 1u4r s VAL 40 CO 0.04 0.00 0.94 -0.36 0.00 0.00 0.00 175.10 175.72 1u4r s PHE 41 N 1.38 3.88 -0.02 5.22 0.08 0.35 -2.19 117.98 126.66 1u4r s PHE 41 Ca -0.01 1.83 0.04 0.00 0.12 0.00 0.00 56.93 58.91 1u4r s PHE 41 Cb -0.18 -3.01 -0.03 0.00 -0.57 0.00 0.00 43.02 39.23 1u4r s PHE 41 CO 0.00 0.31 -0.14 0.08 -0.10 0.00 0.00 175.22 175.37 1u4r s VAL 42 N -0.45 3.11 0.00 -0.44 1.01 0.60 -1.01 120.40 123.22 1u4r s VAL 42 Ca 0.44 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1u4r s VAL 42 Cb -0.24 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 33.88 1u4r s VAL 42 CO 0.30 0.51 0.00 0.35 0.00 0.00 0.00 175.10 176.26 1u4r n THR 43 N 2.04 0.00 0.00 3.92 -2.24 -1.26 0.06 114.28 116.80 1u4r n THR 43 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1u4r n THR 43 Cb 0.52 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 1u4r n THR 43 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1u4r n ASN 46 N -2.23 0.00 -4.90 3.42 0.23 -1.26 -4.55 115.26 105.97 1u4r n ASN 46 Ca 0.00 0.00 -0.31 0.00 -0.53 0.00 0.00 54.58 53.74 1u4r n ASN 46 Cb 0.50 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.15 1u4r n ASN 46 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1u4r s ALA 47 N 0.00 3.79 -0.35 -2.53 0.00 -1.26 -5.05 121.76 116.37 1u4r s ALA 47 Ca 0.00 -0.57 -0.06 0.00 0.00 0.00 0.00 51.96 51.33 1u4r s ALA 47 Cb 0.00 -2.12 0.04 0.00 0.00 0.00 0.00 23.12 21.04 1u4r s ALA 47 CO 0.00 0.67 0.12 -0.65 0.00 0.00 0.00 175.76 175.90 1u4r s GLN 48 N -2.67 2.60 -0.19 0.00 -0.21 -1.26 -4.23 119.66 113.69 1u4r s GLN 48 Ca 0.41 -1.22 -0.06 0.00 0.02 0.00 0.00 55.36 54.51 1u4r s GLN 48 Cb -0.12 -3.49 -0.03 0.00 1.00 0.00 0.00 33.01 30.37 1u4r s GLN 48 CO 0.25 -0.70 0.03 0.08 -2.12 0.00 0.00 175.29 172.83 1u4r s VAL 49 N 1.40 4.30 0.28 1.09 1.01 -0.18 -4.93 120.40 123.36 1u4r s VAL 49 Ca -0.01 -0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.47 1u4r s VAL 49 Cb -0.20 -2.94 -0.10 0.00 0.00 0.00 0.00 36.38 33.15 1u4r s VAL 49 CO 0.03 0.44 1.10 0.00 0.00 0.00 0.00 175.10 176.66 1u4r s ALA 51 N -1.13 -0.19 -0.19 0.00 0.00 0.12 -1.18 121.76 119.19 1u4r s ALA 51 Ca 0.45 -0.51 -0.28 0.00 0.00 0.00 0.00 51.96 51.61 1u4r s ALA 51 Cb -0.32 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.14 1u4r s ALA 51 CO 0.41 -0.40 1.00 1.21 0.00 0.00 0.00 175.76 177.97 1u4r s ASN 52 N -2.41 7.10 0.20 0.00 3.84 -1.26 -2.32 114.94 120.10 1u4r s ASN 52 Ca -0.01 1.37 0.15 0.00 0.21 0.00 0.00 52.86 54.58 1u4r s ASN 52 Cb 0.02 -2.53 0.78 0.00 -0.55 0.00 0.00 41.25 38.97 1u4r s ASN 52 CO -0.07 -0.58 1.46 -2.65 -2.79 0.00 0.00 177.10 172.48 1u4r n PRO 53 N 5.86 0.10 0.07 0.43 -0.02 -1.26 -2.51 135.00 137.67 1u4r n PRO 53 Ca 0.10 0.55 0.04 0.00 -2.02 0.00 0.00 63.50 62.18 1u4r n PRO 53 Cb 0.47 -1.79 -0.03 0.00 -0.02 0.00 0.00 33.50 32.12 1u4r n PRO 53 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1u4r h GLU 54 N 0.00 0.00 -7.14 -0.52 4.39 -1.97 -3.43 114.58 105.92 1u4r h GLU 54 Ca 0.00 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.18 1u4r h GLU 54 Cb 0.05 0.00 0.12 0.00 -0.10 0.00 0.00 28.75 28.82 1u4r h GLU 54 CO 0.00 0.20 0.43 0.15 -1.16 0.00 0.00 179.01 178.63 1u4r s LYS 55 N -3.08 2.75 0.05 2.33 -0.14 -1.04 -4.91 119.74 115.69 1u4r s LYS 55 Ca -0.01 1.72 -0.21 0.00 -1.36 0.00 0.00 55.97 56.10 1u4r s LYS 55 Cb 0.09 -1.91 -0.13 0.00 -1.68 0.00 0.00 37.83 34.19 1u4r s LYS 55 CO 0.79 -1.35 1.46 0.87 -0.76 0.00 0.00 175.35 176.36 1u4r h LYS 56 N 0.45 0.25 0.00 1.68 1.57 -1.92 -2.22 116.57 116.38 1u4r h LYS 56 Ca -0.49 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.18 1u4r h LYS 56 Cb 1.29 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.57 1u4r h LYS 56 CO 0.54 0.51 -0.12 0.11 -0.57 0.00 0.00 179.45 179.92 1u4r h TRP 57 N -0.04 0.00 0.08 -1.35 5.08 -1.96 0.30 115.95 118.06 1u4r h TRP 57 Ca 0.04 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 60.00 1u4r h TRP 57 Cb 0.41 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.57 1u4r h TRP 57 CO 0.04 0.12 -0.04 0.28 -1.28 0.00 0.00 178.44 177.56 1u4r h VAL 58 N 0.00 1.17 -0.54 0.12 2.07 -1.82 -0.16 116.25 117.09 1u4r h VAL 58 Ca -0.00 -1.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.40 1u4r h VAL 58 Cb 0.24 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 1u4r h VAL 58 CO 0.02 0.26 0.25 0.03 0.02 0.00 0.00 177.57 178.15 1u4r h ARG 59 N -0.63 0.79 -0.36 1.57 3.08 -0.95 -2.01 114.38 115.87 1u4r h ARG 59 Ca -0.01 -0.12 -0.10 0.00 0.07 0.00 0.00 59.98 59.82 1u4r h ARG 59 Cb 0.51 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1u4r h ARG 59 CO 0.02 0.66 -0.17 0.93 -1.07 0.00 0.00 179.97 180.34 1u4r h GLU 60 N 0.73 0.67 -0.27 0.04 5.08 -0.46 -1.37 114.58 119.00 1u4r h GLU 60 Ca 0.19 -0.24 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1u4r h GLU 60 Cb 0.14 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1u4r h GLU 60 CO -0.02 0.81 0.11 1.88 -1.00 0.00 0.00 179.01 180.78 1u4r h TYR 61 N 0.60 0.42 -0.79 4.33 -1.99 -0.85 -1.17 116.97 117.52 1u4r h TYR 61 Ca 0.10 -0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.83 1u4r h TYR 61 Cb 0.63 -0.13 -0.05 0.00 2.00 0.00 0.00 36.73 39.19 1u4r h TYR 61 CO 0.03 0.43 0.51 0.82 -0.00 0.00 0.00 178.16 179.94 1u4r h ILE 62 N 0.29 1.11 -0.12 -2.88 2.04 -1.12 0.81 117.51 117.64 1u4r h ILE 62 Ca 0.09 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1u4r h ILE 62 Cb 0.19 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.31 1u4r h ILE 62 CO -0.01 0.18 0.05 0.78 0.00 0.00 0.00 178.15 179.15 1u4r h ASN 63 N 0.98 0.16 -0.59 1.72 -0.26 -0.97 -1.47 115.58 115.16 1u4r h ASN 63 Ca 0.32 -0.16 0.07 0.00 -0.56 0.00 0.00 56.30 55.97 1u4r h ASN 63 Cb 0.02 -0.04 -0.06 0.00 -1.06 0.00 0.00 38.32 37.18 1u4r h ASN 63 CO -0.12 0.28 0.28 -1.28 -1.06 0.00 0.00 177.43 175.53 1u4r h SER 64 N 0.04 0.38 -0.22 5.81 0.87 -0.86 -1.73 113.55 117.84 1u4r h SER 64 Ca 0.04 0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.66 1u4r h SER 64 Cb 0.16 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 1u4r h SER 64 CO -0.00 0.24 0.10 -0.07 -0.53 0.00 0.00 176.83 176.57 1u4r h LEU 65 N 0.52 0.14 -0.82 2.23 3.38 -0.54 -2.73 115.31 117.50 1u4r h LEU 65 Ca 0.27 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.28 1u4r h LEU 65 Cb 0.23 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 1u4r h LEU 65 CO -0.21 0.11 0.54 -0.33 0.09 0.00 0.00 178.44 178.64 1u4r h GLU 66 N 0.22 1.04 0.00 1.13 4.39 -0.88 -3.51 114.58 116.96 1u4r h GLU 66 Ca 0.09 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1u4r h GLU 66 Cb 0.03 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.45 1u4r h GLU 66 CO -0.07 0.69 0.00 -1.33 -1.16 0.00 0.00 179.01 177.14