#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 1.45 2.34 0.26 0.00 0.00 -1.26 -4.80 107.32 105.30 2k4r s GLY 3 Ca 0.06 -0.26 -0.31 0.00 0.00 0.00 0.00 44.72 44.22 2k4r s GLY 3 CO -0.16 -0.07 1.61 0.00 0.00 0.00 0.00 173.10 174.47 2k4r s ALA 4 N -1.67 3.79 0.00 3.20 0.00 -1.26 -1.63 121.76 124.19 2k4r s ALA 4 Ca 0.43 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.93 2k4r s ALA 4 Cb -0.13 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.34 2k4r s ALA 4 CO 0.20 -0.93 0.00 0.41 0.00 0.00 0.00 175.76 175.45 2k4r n GLY 5 N 2.77 2.20 3.50 0.00 0.00 -1.26 -5.03 105.19 107.36 2k4r n GLY 5 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2k4r n GLY 5 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k4r s GLU 6 N -0.84 3.24 0.63 1.61 0.41 -0.64 -4.65 118.70 118.46 2k4r s GLU 6 Ca 0.00 -0.77 -0.16 0.00 -0.41 0.00 0.00 54.97 53.63 2k4r s GLU 6 Cb 0.00 -3.90 -0.02 0.00 -1.78 0.00 0.00 34.13 28.44 2k4r s GLU 6 CO 0.00 -0.64 1.10 -2.14 -0.49 0.00 0.00 175.26 173.09 2k4r s PRO 7 N 1.81 3.01 0.20 0.39 0.02 -1.12 -4.31 135.00 135.00 2k4r s PRO 7 Ca 0.07 1.36 0.26 0.00 0.02 0.00 0.00 61.00 62.71 2k4r s PRO 7 Cb -0.18 -1.98 0.70 0.00 0.02 0.00 0.00 34.50 33.06 2k4r s PRO 7 CO 0.11 -1.08 1.68 1.87 -0.33 0.00 0.00 177.00 179.25 2k4r n TRP 8 N -2.19 0.88 0.00 6.54 -0.00 -1.26 -5.00 117.44 116.42 2k4r n TRP 8 Ca 0.10 0.26 0.00 0.00 -0.00 0.00 0.00 57.50 57.86 2k4r n TRP 8 Cb 0.52 -0.90 0.00 0.00 -0.00 0.00 0.00 31.31 30.93 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 1.31 1.97 2.34 5.87 0.00 -1.26 -4.66 105.19 110.76 2k4r n GLY 9 Ca 0.05 -0.71 -0.24 0.00 0.00 0.00 0.00 46.02 45.11 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 1.16 4.53 -3.68 1.61 5.03 -1.26 -2.17 115.26 120.48 2k4r n ASN 10 Ca 0.00 -3.63 -0.12 0.00 0.87 0.00 0.00 54.58 51.70 2k4r n ASN 10 Cb 0.00 -0.42 -0.12 0.00 -1.02 0.00 0.00 39.78 38.22 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 -3.55 -0.75 -0.43 5.41 0.00 -1.26 -0.92 121.76 120.26 2k4r s ALA 11 Ca 0.47 1.16 -0.27 0.00 0.00 0.00 0.00 51.96 53.33 2k4r s ALA 11 Cb 0.40 -0.96 -0.07 0.00 0.00 0.00 0.00 23.12 22.50 2k4r s ALA 11 CO -0.10 -0.48 2.38 0.25 0.00 0.00 0.00 175.76 177.81 2k4r n THR 12 N 4.88 0.02 0.00 0.00 -2.24 0.11 -4.25 114.28 112.80 2k4r n THR 12 Ca -0.14 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 60.92 2k4r n THR 12 Cb 0.51 -2.72 0.00 0.00 -2.10 0.00 0.00 70.33 66.03 2k4r n THR 12 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2k4r n ASN 13 N 14.87 0.00 -0.61 3.42 2.85 -0.13 -1.62 115.26 134.04 2k4r n ASN 13 Ca 0.36 0.00 -0.00 0.00 -0.11 0.00 0.00 54.58 54.82 2k4r n ASN 13 Cb 0.52 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.53 2k4r n ASN 13 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2k4r n LEU 14 N 0.00 -0.04 0.00 1.20 7.94 -1.26 -2.41 117.00 122.43 2k4r n LEU 14 Ca 0.00 -1.17 0.00 0.00 -1.11 0.00 0.00 56.01 53.73 2k4r n LEU 14 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2k4r n LEU 14 CO 0.00 0.79 0.00 0.61 -1.11 0.00 0.00 177.39 177.68 2k4r n GLY 15 N 0.03 0.72 3.74 -3.96 0.00 -0.64 -5.10 105.19 99.99 2k4r n GLY 15 Ca -0.03 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 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 0.21 5.17 0.44 1.61 1.01 -1.26 -4.72 120.40 122.86 2k4r s VAL 16 Ca 0.00 0.87 -0.24 0.00 0.00 0.00 0.00 61.98 62.61 2k4r s VAL 16 Cb 0.00 -3.77 -0.09 0.00 0.00 0.00 0.00 36.38 32.51 2k4r s VAL 16 CO 0.00 0.38 1.15 -2.65 0.00 0.00 0.00 175.10 173.98 2k4r n PRO 17 N 3.33 1.62 -2.39 2.72 -0.02 -1.25 0.10 135.00 139.10 2k4r n PRO 17 Ca -0.09 0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 61.55 2k4r n PRO 17 Cb 0.52 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 2k4r n PRO 17 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k4r s LEU 19 N 1.79 2.80 0.31 0.00 2.96 0.15 -4.82 118.68 121.87 2k4r s LEU 19 Ca 0.59 0.79 -0.28 0.00 -0.22 0.00 0.00 54.13 55.01 2k4r s LEU 19 Cb -0.28 -3.45 -0.09 0.00 0.50 0.00 0.00 46.19 42.87 2k4r s LEU 19 CO 0.26 -1.55 1.05 -1.00 -1.32 0.00 0.00 176.35 173.79 2k4r s HIS 20 N -3.35 3.55 0.39 5.38 3.76 -1.26 -4.57 115.29 119.20 2k4r s HIS 20 Ca 0.59 1.72 0.12 0.00 -0.15 0.00 0.00 55.06 57.34 2k4r s HIS 20 Cb -0.11 -3.17 0.81 0.00 1.11 0.00 0.00 32.58 31.22 2k4r s HIS 20 CO 0.48 -0.39 1.89 -1.49 -0.85 0.00 0.00 174.74 174.38 2k4r h TRP 21 N 3.43 0.07 -0.00 1.40 4.06 -1.40 0.96 115.95 124.47 2k4r h TRP 21 Ca -0.47 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.47 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 0.59 0.32 -0.25 -3.47 -3.56 0.00 0.00 178.44 172.07 2k4r n ASP 22 N -4.21 0.26 -1.37 -3.49 2.03 -0.45 -3.51 116.55 105.82 2k4r n ASP 22 Ca -0.02 0.11 0.10 0.00 0.52 0.00 0.00 54.79 55.51 2k4r n ASP 22 Cb 0.33 -0.12 0.32 0.00 -0.72 0.00 0.00 41.12 40.93 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 -1.49 3.10 -2.62 -0.67 -0.58 0.30 -4.88 120.64 113.79 2k4r n GLU 23 Ca 0.06 -2.70 -0.43 0.00 -0.42 0.00 0.00 57.16 53.68 2k4r n GLU 23 Cb 0.34 -1.66 -0.02 0.00 -0.57 0.00 0.00 31.44 29.52 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 -1.33 4.61 0.32 2.62 1.01 -0.98 -4.80 120.40 121.86 2k4r s VAL 24 Ca 0.48 1.94 -0.29 0.00 0.00 0.00 0.00 61.98 64.10 2k4r s VAL 24 Cb 0.27 -4.25 -0.11 0.00 0.00 0.00 0.00 36.38 32.29 2k4r s VAL 24 CO 0.28 -0.14 1.50 -2.16 0.00 0.00 0.00 175.10 174.59 2k4r s PRO 25 N 3.02 4.17 0.46 2.72 0.04 -1.26 -4.91 135.00 139.24 2k4r s PRO 25 Ca 0.47 2.48 0.14 0.00 0.04 0.00 0.00 61.00 64.13 2k4r s PRO 25 Cb -0.17 -3.03 1.09 0.00 0.04 0.00 0.00 34.50 32.43 2k4r s PRO 25 CO 0.10 -0.51 2.03 -1.00 0.04 0.00 0.00 177.00 177.66 2k4r h PRO 26 N 4.13 0.30 -4.10 0.56 0.13 -1.98 -3.27 132.00 127.78 2k4r h PRO 26 Ca -0.48 -0.02 -0.76 0.00 -0.87 0.00 0.00 66.00 63.87 2k4r h PRO 26 Cb 1.23 -0.07 -0.24 0.00 0.13 0.00 0.00 31.00 32.05 2k4r h PRO 26 CO 0.73 0.20 -0.20 -0.06 -0.23 0.00 0.00 178.00 178.44 2k4r s PHE 27 N -5.30 3.26 0.02 1.56 0.08 -1.26 -5.05 117.98 111.29 2k4r s PHE 27 Ca -0.07 -1.31 -0.01 0.00 0.12 0.00 0.00 56.93 55.67 2k4r s PHE 27 Cb 0.19 -3.81 -0.04 0.00 -0.57 0.00 0.00 43.02 38.79 2k4r s PHE 27 CO 0.73 -1.03 0.13 -1.17 -0.10 0.00 0.00 175.22 173.78 2k4r s LEU 28 N 1.57 4.10 0.05 -0.37 2.96 -1.24 -5.02 118.68 120.73 2k4r s LEU 28 Ca 0.04 0.20 -0.15 0.00 -0.22 0.00 0.00 54.13 54.00 2k4r s LEU 28 Cb -0.29 -2.51 -0.25 0.00 0.50 0.00 0.00 46.19 43.64 2k4r s LEU 28 CO 0.03 0.24 1.15 -0.33 -1.32 0.00 0.00 176.35 176.11 2k4r h GLU 29 N 3.73 0.63 -6.07 1.98 5.08 -1.92 -3.44 114.58 114.57 2k4r h GLU 29 Ca -0.48 -0.72 -0.59 0.00 -1.00 0.00 0.00 59.36 56.57 2k4r h GLU 29 Cb 1.18 0.21 -0.04 0.00 0.50 0.00 0.00 28.75 30.60 2k4r h GLU 29 CO 0.67 1.30 -0.39 1.03 -1.00 0.00 0.00 179.01 180.62 2k4r s ARG 30 N -3.21 3.54 -0.21 2.33 1.81 -1.26 -5.08 118.95 116.88 2k4r s ARG 30 Ca -0.10 -0.24 -0.17 0.00 -1.72 0.00 0.00 55.73 53.50 2k4r s ARG 30 Cb 0.06 -2.92 -0.03 0.00 -0.45 0.00 0.00 34.95 31.60 2k4r s ARG 30 CO 0.91 0.52 0.47 0.45 -0.68 0.00 0.00 175.30 176.97 2k4r s SER 31 N -2.49 6.50 0.28 0.23 0.15 -1.26 -4.94 113.70 112.17 2k4r s SER 31 Ca 0.39 0.60 -0.29 0.00 0.70 0.00 0.00 55.95 57.34 2k4r s SER 31 Cb -0.12 -2.27 -0.10 0.00 -1.71 0.00 0.00 66.02 61.82 2k4r s SER 31 CO 0.26 -0.15 1.14 -2.16 1.20 0.00 0.00 173.24 173.53 2k4r s PRO 32 N 1.57 4.59 0.50 5.44 0.04 -1.26 -4.95 135.00 140.93 2k4r s PRO 32 Ca 0.22 1.87 0.29 0.00 0.04 0.00 0.00 61.00 63.42 2k4r s PRO 32 Cb -0.15 -3.18 1.23 0.00 0.04 0.00 0.00 34.50 32.44 2k4r s PRO 32 CO 0.09 0.13 1.94 -1.00 0.04 0.00 0.00 177.00 178.21 2k4r h PRO 33 N 3.85 0.00 -4.40 0.56 0.13 -2.03 -3.45 132.00 126.67 2k4r h PRO 33 Ca -0.47 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.50 2k4r h PRO 33 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.19 2k4r h PRO 33 CO 0.67 0.12 -0.69 0.00 -0.23 0.00 0.00 178.00 177.87 2k4r s ALA 34 N -3.76 0.69 -0.43 -0.56 0.00 -1.26 -5.10 121.76 111.34 2k4r s ALA 34 Ca 0.00 -1.25 -0.28 0.00 0.00 0.00 0.00 51.96 50.43 2k4r s ALA 34 Cb 0.10 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.45 2k4r s ALA 34 CO 0.59 -0.31 1.50 0.45 0.00 0.00 0.00 175.76 177.99 2k4r s SER 35 N -2.92 6.18 0.00 0.00 0.15 -1.26 -4.86 113.70 110.99 2k4r s SER 35 Ca 0.08 0.81 0.23 0.00 0.70 0.00 0.00 55.95 57.77 2k4r s SER 35 Cb 0.06 -2.54 0.47 0.00 -1.71 0.00 0.00 66.02 62.31 2k4r s SER 35 CO -0.08 -1.56 1.42 -2.67 1.20 0.00 0.00 173.24 171.55 2k4r n TRP 36 N 9.36 0.43 0.22 3.44 4.27 -1.26 -4.17 117.44 129.73 2k4r n TRP 36 Ca 0.17 -0.21 0.14 0.00 -3.89 0.00 0.00 57.50 53.71 2k4r n TRP 36 Cb 0.48 0.00 0.77 0.00 -1.36 0.00 0.00 31.31 31.20 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 4.45 1.00 -0.37 -1.67 0.00 -2.00 0.46 119.26 121.13 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 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2k4r h ALA 37 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.64 2k4r n GLU 38 N -2.49 2.34 0.20 0.00 1.02 -1.26 -4.11 120.64 116.34 2k4r n GLU 38 Ca -0.02 -2.07 0.05 0.00 -0.02 0.00 0.00 57.16 55.10 2k4r n GLU 38 Cb 0.05 -1.38 0.42 0.00 -0.02 0.00 0.00 31.44 30.50 2k4r n GLU 38 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2k4r h LEU 39 N 3.14 0.00 -1.19 -4.62 3.38 -1.18 -3.46 115.31 111.38 2k4r h LEU 39 Ca 0.00 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.48 2k4r h LEU 39 Cb 0.80 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.48 2k4r h LEU 39 CO 0.00 0.33 -0.80 0.54 0.09 0.00 0.00 178.44 178.60 2k4r n ARG 40 N -3.96 -4.61 -1.05 1.13 1.74 -1.26 -4.83 116.66 103.82 2k4r n ARG 40 Ca -0.02 0.52 -0.10 0.00 -0.77 0.00 0.00 57.85 57.49 2k4r n ARG 40 Cb 0.39 -5.26 0.16 0.00 -1.02 0.00 0.00 32.46 26.73 2k4r n ARG 40 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k4r n GLY 41 N -1.63 5.27 0.37 -0.13 0.00 -1.26 -4.90 105.19 102.91 2k4r n GLY 41 Ca -0.02 -1.57 -0.11 0.00 0.00 0.00 0.00 46.02 44.32 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 1.29 -0.41 -0.03 1.61 1.08 -1.89 -1.58 115.11 115.18 2k4r h GLN 42 Ca 0.27 0.03 0.01 0.00 -1.45 0.00 0.00 58.65 57.50 2k4r h GLN 42 Cb 1.53 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 29.05 2k4r h GLN 42 CO 0.53 -0.28 0.11 -1.00 -0.95 0.00 0.00 178.83 177.24 2k4r h PRO 43 N -0.43 0.00 -5.06 1.46 0.13 -1.95 -1.18 132.00 124.96 2k4r h PRO 43 Ca 0.09 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.61 2k4r h PRO 43 Cb 0.59 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.59 2k4r h PRO 43 CO -0.40 0.00 -0.50 -3.38 -0.23 0.00 0.00 178.00 173.49 2k4r s HIS 44 N -4.25 1.78 -0.10 1.56 -3.43 -0.59 -4.93 115.29 105.33 2k4r s HIS 44 Ca -0.05 -1.23 0.03 0.00 -0.80 0.00 0.00 55.06 53.02 2k4r s HIS 44 Cb 0.12 -1.28 0.00 0.00 -1.43 0.00 0.00 32.58 30.00 2k4r s HIS 44 CO 0.41 -0.18 -0.21 0.54 -2.00 0.00 0.00 174.74 173.30 2k4r s ASN 45 N -3.71 2.80 0.00 7.38 4.22 -1.26 -1.92 114.94 122.45 2k4r s ASN 45 Ca 0.16 -0.51 0.00 0.00 -2.14 0.00 0.00 52.86 50.37 2k4r s ASN 45 Cb 0.01 -1.28 0.00 0.00 1.28 0.00 0.00 41.25 41.26 2k4r s ASN 45 CO 0.11 0.11 0.00 0.33 -2.04 0.00 0.00 177.10 175.61 2k4r n PHE 46 N 3.71 0.00 -1.55 1.54 7.35 -1.26 -4.85 117.46 122.39 2k4r n PHE 46 Ca -0.20 0.00 -0.46 0.00 -0.76 0.00 0.00 57.45 56.04 2k4r n PHE 46 Cb 0.52 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.33 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 -1.35 1.40 -0.43 0.00 1.81 -0.46 -4.83 118.95 115.08 2k4r s ARG 48 Ca 0.61 -1.66 0.02 0.00 -1.72 0.00 0.00 55.73 52.98 2k4r s ARG 48 Cb -0.76 -1.05 0.13 0.00 -0.45 0.00 0.00 34.95 32.82 2k4r s ARG 48 CO 0.59 0.10 0.23 0.45 -0.68 0.00 0.00 175.30 175.98 2k4r s SER 49 N -3.35 3.65 0.42 0.23 0.15 -1.26 0.24 113.70 113.77 2k4r s SER 49 Ca 0.25 -2.56 0.23 0.00 0.70 0.00 0.00 55.95 54.57 2k4r s SER 49 Cb 0.02 -1.01 0.45 0.00 -1.71 0.00 0.00 66.02 63.77 2k4r s SER 49 CO 0.08 -0.28 1.64 -0.65 1.20 0.00 0.00 173.24 175.24 2k4r h PRO 50 N 6.80 0.00 -5.80 5.44 0.11 -1.93 -3.45 132.00 133.18 2k4r h PRO 50 Ca -0.01 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.51 2k4r h PRO 50 Cb 0.93 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 31.96 2k4r h PRO 50 CO 0.47 0.11 0.28 -0.51 -0.21 0.00 0.00 178.00 178.14 2k4r s ASP 51 N -6.19 6.82 0.00 -2.05 1.01 -1.26 -4.92 116.67 110.07 2k4r s ASP 51 Ca 0.05 1.00 0.07 0.00 0.71 0.00 0.00 52.55 54.39 2k4r s ASP 51 Cb 0.06 -2.40 0.43 0.00 1.01 0.00 0.00 42.92 42.02 2k4r s ASP 51 CO 0.67 -0.36 0.84 0.61 0.21 0.00 0.00 175.17 177.14 2k4r n GLY 52 N 3.65 -0.32 0.30 0.21 0.00 -1.26 -1.46 105.19 106.32 2k4r n GLY 52 Ca 0.02 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.85 2.59 -1.16 4.61 0.00 -1.26 -4.89 120.51 119.54 2k4r n ALA 53 Ca 0.05 -0.35 -0.03 0.00 0.00 0.00 0.00 53.44 53.11 2k4r n ALA 53 Cb 0.03 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 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 1.06 0.60 3.49 0.00 0.00 -0.53 -5.00 105.19 104.80 2k4r n GLY 54 Ca 0.19 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.41 3.17 0.38 1.61 6.06 -1.23 -4.64 118.95 121.89 2k4r s ARG 55 Ca 0.00 -0.65 -0.23 0.00 -2.50 0.00 0.00 55.73 52.34 2k4r s ARG 55 Cb 0.00 -4.00 -0.10 0.00 0.06 0.00 0.00 34.95 30.91 2k4r s ARG 55 CO 0.00 -1.01 0.96 -1.25 -2.50 0.00 0.00 175.30 171.50 2k4r s PRO 56 N 2.52 4.37 0.08 5.12 0.04 -1.26 -4.36 135.00 141.50 2k4r s PRO 56 Ca 0.17 1.25 -0.25 0.00 0.04 0.00 0.00 61.00 62.21 2k4r s PRO 56 Cb -0.17 -2.48 0.07 0.00 0.04 0.00 0.00 34.50 31.96 2k4r s PRO 56 CO 0.15 0.08 0.60 1.67 0.04 0.00 0.00 177.00 179.55 2k4r s TRP 57 N -1.89 -0.54 0.33 0.56 1.48 0.14 0.52 118.94 119.54 2k4r s TRP 57 Ca 0.57 0.56 0.05 0.00 -1.06 0.00 0.00 56.10 56.21 2k4r s TRP 57 Cb -0.14 0.47 -0.03 0.00 -1.16 0.00 0.00 33.47 32.60 2k4r s TRP 57 CO 0.19 -0.74 0.20 0.00 -4.06 0.00 0.00 176.95 172.53 2k4r s PHE 59 N -3.51 3.42 -0.04 0.00 0.08 -1.26 -0.61 117.98 116.06 2k4r s PHE 59 Ca 0.35 0.58 -0.02 0.00 0.12 0.00 0.00 56.93 57.97 2k4r s PHE 59 Cb 0.04 -2.40 -0.04 0.00 -0.57 0.00 0.00 43.02 40.05 2k4r s PHE 59 CO 0.20 0.15 0.08 1.52 -0.10 0.00 0.00 175.22 177.06 2k4r s TYR 60 N 0.78 3.32 -0.17 0.36 1.13 0.21 0.33 117.35 123.32 2k4r s TYR 60 Ca 0.17 0.26 -0.01 0.00 -1.41 0.00 0.00 57.07 56.08 2k4r s TYR 60 Cb -0.14 -1.79 -0.00 0.00 -1.10 0.00 0.00 41.96 38.93 2k4r s TYR 60 CO 0.05 0.57 -0.12 0.50 -2.51 0.00 0.00 175.55 174.04 2k4r s ARG 61 N -1.44 3.28 0.53 -3.49 3.52 -0.93 -1.45 118.95 118.97 2k4r s ARG 61 Ca 0.20 -0.71 0.07 0.00 -0.13 0.00 0.00 55.73 55.16 2k4r s ARG 61 Cb -0.12 -2.72 0.04 0.00 -1.56 0.00 0.00 34.95 30.60 2k4r s ARG 61 CO 0.10 -0.01 0.53 0.54 -0.81 0.00 0.00 175.30 175.65 2k4r s ASN 62 N 0.91 4.89 -0.01 -2.12 2.20 -0.23 -4.60 114.94 115.98 2k4r s ASN 62 Ca -0.03 -1.00 0.03 0.00 -0.94 0.00 0.00 52.86 50.92 2k4r s ASN 62 Cb -0.15 0.17 0.10 0.00 -2.00 0.00 0.00 41.25 39.38 2k4r s ASN 62 CO -0.01 -1.09 0.96 0.00 -2.94 0.00 0.00 177.10 174.02 2k4r n ALA 63 N -1.89 2.55 1.08 3.54 0.00 -1.26 -1.85 120.51 122.68 2k4r n ALA 63 Ca 0.05 -0.21 0.12 0.00 0.00 0.00 0.00 53.44 53.40 2k4r n ALA 63 Cb 0.63 -1.00 0.12 0.00 0.00 0.00 0.00 19.45 19.20 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 -0.11 0.97 -0.45 0.00 6.02 -1.26 -4.93 117.38 117.62 2k4r n GLN 64 Ca 0.04 -0.74 0.00 0.00 -0.01 0.00 0.00 57.00 56.29 2k4r n GLN 64 Cb 0.18 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.95 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 1.40 0.77 3.90 1.08 0.00 -0.77 -5.05 105.19 106.52 2k4r n GLY 65 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.55 3.62 -0.25 1.61 1.02 -1.25 -4.91 119.74 119.02 2k4r s LYS 66 Ca 0.00 -0.10 -0.02 0.00 0.02 0.00 0.00 55.97 55.87 2k4r s LYS 66 Cb 0.00 -2.81 0.08 0.00 -0.52 0.00 0.00 37.83 34.58 2k4r s LYS 66 CO 0.00 0.42 0.07 0.08 -0.92 0.00 0.00 175.35 175.00 2k4r s VAL 67 N -1.75 0.62 0.24 3.17 1.01 -1.26 -1.07 120.40 121.37 2k4r s VAL 67 Ca 0.41 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.48 2k4r s VAL 67 Cb -0.12 -1.30 -0.00 0.00 0.00 0.00 0.00 36.38 34.96 2k4r s VAL 67 CO 0.26 -0.45 0.05 0.47 0.00 0.00 0.00 175.10 175.43 2k4r n ASP 68 N 4.98 1.76 -4.40 3.32 8.00 -0.53 -3.94 116.55 125.75 2k4r n ASP 68 Ca -0.06 -2.17 -0.28 0.00 0.71 0.00 0.00 54.79 52.99 2k4r n ASP 68 Cb 0.44 0.41 -0.12 0.00 -0.02 0.00 0.00 41.12 41.83 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 -2.21 2.29 -0.06 1.24 1.48 -1.26 0.68 118.94 121.10 2k4r s TRP 69 Ca 0.07 -0.37 -0.17 0.00 -1.06 0.00 0.00 56.10 54.56 2k4r s TRP 69 Cb 0.00 -1.19 0.03 0.00 -1.16 0.00 0.00 33.47 31.16 2k4r s TRP 69 CO 0.05 0.41 0.39 0.20 -4.06 0.00 0.00 176.95 173.94 2k4r s GLY 70 N -2.33 -0.26 0.31 3.67 0.00 0.22 -4.90 107.32 104.03 2k4r s GLY 70 Ca 0.17 0.72 -0.29 0.00 0.00 0.00 0.00 44.72 45.32 2k4r s GLY 70 CO 0.08 0.50 1.30 -0.19 0.00 0.00 0.00 173.10 174.79 2k4r s TYR 71 N -0.84 3.10 -1.02 1.90 2.02 -1.26 -1.89 117.35 119.37 2k4r s TYR 71 Ca -0.09 1.39 -0.03 0.00 -0.37 0.00 0.00 57.07 57.97 2k4r s TYR 71 Cb -0.04 -3.65 0.30 0.00 -0.40 0.00 0.00 41.96 38.16 2k4r s TYR 71 CO 0.04 -1.81 1.33 0.00 -1.57 0.00 0.00 175.55 173.53 2k4r n ASP 73 N 1.43 0.36 -1.16 0.00 9.92 -1.26 -2.78 116.55 123.06 2k4r n ASP 73 Ca 0.26 -0.68 -0.15 0.00 -0.53 0.00 0.00 54.79 53.69 2k4r n ASP 73 Cb 0.35 0.89 -0.06 0.00 -0.64 0.00 0.00 41.12 41.66 2k4r n ASP 73 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k4r n GLY 75 N -0.20 0.00 2.77 0.00 0.00 -1.26 -4.83 105.19 101.68 2k4r n GLY 75 Ca -0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 2k4r n GLY 75 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k4r n GLN 76 N 0.00 1.54 0.00 1.61 1.13 -1.26 -5.00 117.38 115.40 2k4r n GLN 76 Ca 0.00 -2.99 0.00 0.00 -1.94 0.00 0.00 57.00 52.07 2k4r n GLN 76 Cb 0.00 -1.13 0.00 0.00 0.11 0.00 0.00 30.24 29.22 2k4r n GLN 76 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03