#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 1.19 0.61 0.39 0.00 0.00 -1.26 -4.26 105.19 101.86 2k4r n GLY 3 Ca 0.53 -1.33 0.11 0.00 0.00 0.00 0.00 46.02 45.33 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 0.76 2.56 -3.62 4.61 0.00 -1.26 -4.73 120.51 118.83 2k4r n ALA 4 Ca 0.00 -0.41 -0.35 0.00 0.00 0.00 0.00 53.44 52.69 2k4r n ALA 4 Cb 0.00 -1.18 -0.14 0.00 0.00 0.00 0.00 19.45 18.13 2k4r n ALA 4 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2k4r s GLY 5 N -1.70 1.66 0.50 0.00 0.00 -1.26 -5.10 107.32 101.43 2k4r s GLY 5 Ca 0.34 -1.46 0.01 0.00 0.00 0.00 0.00 44.72 43.60 2k4r s GLY 5 CO 0.28 0.54 0.07 -1.84 0.00 0.00 0.00 173.10 172.15 2k4r n GLU 6 N 4.70 0.78 -1.02 2.90 0.00 -1.26 -0.15 120.64 126.59 2k4r n GLU 6 Ca -0.16 -3.58 -0.46 0.00 0.00 0.00 0.00 57.16 52.96 2k4r n GLU 6 Cb 0.47 0.86 -0.10 0.00 0.00 0.00 0.00 31.44 32.68 2k4r n GLU 6 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2k4r n PRO 7 N -1.33 0.00 -2.74 3.44 -0.02 -1.12 -4.36 135.00 128.88 2k4r n PRO 7 Ca -0.18 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.00 2k4r n PRO 7 Cb 0.63 -1.20 -0.02 0.00 -0.02 0.00 0.00 33.50 32.89 2k4r n PRO 7 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 2k4r n TRP 8 N 6.24 3.62 0.00 6.00 -0.00 -1.20 -5.00 117.44 127.11 2k4r n TRP 8 Ca 0.45 -3.44 0.00 0.00 -0.00 0.00 0.00 57.50 54.51 2k4r n TRP 8 Cb -0.03 -0.62 0.00 0.00 -0.00 0.00 0.00 31.31 30.66 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 -0.26 1.46 0.06 5.87 0.00 -1.26 -1.94 105.19 109.11 2k4r n GLY 9 Ca 0.37 0.17 0.01 0.00 0.00 0.00 0.00 46.02 46.57 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 7.29 2.09 -3.62 1.61 5.03 -1.26 -2.21 115.26 124.20 2k4r n ASN 10 Ca 0.00 -2.06 -0.27 0.00 0.87 0.00 0.00 54.58 53.13 2k4r n ASN 10 Cb 0.00 -0.04 -0.17 0.00 -1.02 0.00 0.00 39.78 38.55 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 -1.10 0.52 0.61 5.41 0.00 -0.82 0.53 121.76 126.92 2k4r s ALA 11 Ca 0.03 -0.44 -0.18 0.00 0.00 0.00 0.00 51.96 51.38 2k4r s ALA 11 Cb 0.02 -1.09 -0.06 0.00 0.00 0.00 0.00 23.12 21.99 2k4r s ALA 11 CO 0.01 -1.22 0.68 0.25 0.00 0.00 0.00 175.76 175.48 2k4r n THR 12 N 5.25 2.70 0.31 0.00 -2.24 0.20 -4.02 114.28 116.47 2k4r n THR 12 Ca -0.07 -0.48 0.19 0.00 -2.27 0.00 0.00 64.05 61.42 2k4r n THR 12 Cb 0.48 -0.85 1.00 0.00 -2.10 0.00 0.00 70.33 68.86 2k4r n THR 12 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 2k4r h ASN 13 N 0.18 0.00 1.50 3.42 -1.24 -0.97 0.64 115.58 119.10 2k4r h ASN 13 Ca -0.47 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.54 2k4r h ASN 13 Cb 1.38 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.43 2k4r h ASN 13 CO 0.47 0.00 0.00 0.25 -1.29 0.00 0.00 177.43 176.86 2k4r h LEU 14 N 0.00 0.00 0.00 0.34 5.85 -0.54 -3.46 115.31 117.50 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 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 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 0.89 1.27 2.95 3.75 0.00 0.22 -5.09 105.19 109.19 2k4r n GLY 15 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 0.96 0.16 1.61 1.01 -1.23 -4.89 120.40 116.02 2k4r s VAL 16 Ca 0.00 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 2k4r s VAL 16 Cb 0.00 -0.93 -0.07 0.00 0.00 0.00 0.00 36.38 35.38 2k4r s VAL 16 CO 0.00 0.33 1.00 -2.16 0.00 0.00 0.00 175.10 174.27 2k4r s PRO 17 N 1.10 4.70 0.12 2.72 0.04 -1.26 -0.63 135.00 141.79 2k4r s PRO 17 Ca -0.07 1.54 -0.31 0.00 0.04 0.00 0.00 61.00 62.21 2k4r s PRO 17 Cb -0.14 -3.33 -0.07 0.00 0.04 0.00 0.00 34.50 31.00 2k4r s PRO 17 CO -0.01 0.24 1.25 0.00 0.04 0.00 0.00 177.00 178.52 2k4r n LEU 19 N 3.46 0.00 -3.59 0.00 7.94 0.45 -4.82 117.00 120.45 2k4r n LEU 19 Ca 0.08 0.00 -0.16 0.00 -1.11 0.00 0.00 56.01 54.82 2k4r n LEU 19 Cb 0.45 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.33 2k4r n LEU 19 CO 0.56 0.00 0.41 -1.00 -1.11 0.00 0.00 177.39 176.25 2k4r s HIS 20 N 0.00 -0.71 0.31 1.96 3.76 -1.26 -4.54 115.29 114.81 2k4r s HIS 20 Ca 0.00 1.53 0.24 0.00 -0.15 0.00 0.00 55.06 56.68 2k4r s HIS 20 Cb 0.00 0.32 1.16 0.00 1.11 0.00 0.00 32.58 35.17 2k4r s HIS 20 CO 0.00 -0.47 1.95 -1.49 -0.85 0.00 0.00 174.74 173.88 2k4r h TRP 21 N 4.16 0.00 0.00 1.40 4.06 -1.48 -1.63 115.95 122.45 2k4r h TRP 21 Ca -0.28 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.67 2k4r h TRP 21 Cb 1.15 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.31 2k4r h TRP 21 CO 0.39 0.20 -0.30 -3.47 -3.56 0.00 0.00 178.44 171.70 2k4r n ASP 22 N -3.59 0.37 -1.95 -3.49 2.03 -1.08 -3.87 116.55 104.96 2k4r n ASP 22 Ca -0.01 0.13 -0.08 0.00 0.52 0.00 0.00 54.79 55.34 2k4r n ASP 22 Cb 0.33 -0.11 0.28 0.00 -0.72 0.00 0.00 41.12 40.90 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 -1.63 3.34 -3.54 -0.67 1.02 -0.61 -4.86 120.64 113.69 2k4r n GLU 23 Ca 0.06 -3.08 -0.41 0.00 -0.02 0.00 0.00 57.16 53.71 2k4r n GLU 23 Cb 0.36 -2.18 -0.11 0.00 -0.02 0.00 0.00 31.44 29.50 2k4r n GLU 23 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2k4r s VAL 24 N -3.06 5.01 0.59 2.62 1.01 -1.25 -4.86 120.40 120.46 2k4r s VAL 24 Ca 0.54 -0.58 -0.18 0.00 0.00 0.00 0.00 61.98 61.77 2k4r s VAL 24 Cb 0.44 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2k4r s VAL 24 CO 0.12 -0.17 1.16 -2.16 0.00 0.00 0.00 175.10 174.05 2k4r s PRO 25 N 1.65 3.06 0.59 2.72 0.04 -1.26 -4.92 135.00 136.87 2k4r s PRO 25 Ca 0.04 1.67 0.29 0.00 0.04 0.00 0.00 61.00 63.04 2k4r s PRO 25 Cb -0.18 -1.96 1.79 0.00 0.04 0.00 0.00 34.50 34.18 2k4r s PRO 25 CO 0.09 -1.10 2.24 -1.00 0.04 0.00 0.00 177.00 177.28 2k4r h PRO 26 N 0.82 0.00 -4.04 0.56 0.13 -2.00 -3.25 132.00 124.22 2k4r h PRO 26 Ca -0.50 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 63.91 2k4r h PRO 26 Cb 1.27 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.09 2k4r h PRO 26 CO 0.55 0.00 -0.34 -0.06 -0.23 0.00 0.00 178.00 177.93 2k4r s PHE 27 N -4.66 3.49 0.17 1.56 0.08 -1.26 -5.08 117.98 112.29 2k4r s PHE 27 Ca -0.05 -2.24 0.03 0.00 0.12 0.00 0.00 56.93 54.80 2k4r s PHE 27 Cb 0.15 -3.41 -0.03 0.00 -0.57 0.00 0.00 43.02 39.16 2k4r s PHE 27 CO 0.55 -0.94 0.28 -1.17 -0.10 0.00 0.00 175.22 173.84 2k4r s LEU 28 N 0.71 4.25 0.04 -0.37 2.96 -1.23 -5.03 118.68 120.01 2k4r s LEU 28 Ca 0.11 0.10 -0.27 0.00 -0.22 0.00 0.00 54.13 53.85 2k4r s LEU 28 Cb -0.22 -2.82 -0.17 0.00 0.50 0.00 0.00 46.19 43.49 2k4r s LEU 28 CO -0.03 0.03 1.44 -0.33 -1.32 0.00 0.00 176.35 176.13 2k4r h GLU 29 N 1.95 -0.45 -5.80 1.98 4.39 -1.93 -3.43 114.58 111.29 2k4r h GLU 29 Ca -0.49 0.03 -0.64 0.00 0.34 0.00 0.00 59.36 58.60 2k4r h GLU 29 Cb 1.20 0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.90 2k4r h GLU 29 CO 0.66 -0.19 -0.43 1.03 -1.16 0.00 0.00 179.01 178.91 2k4r s ARG 30 N -5.33 3.52 -0.21 2.33 1.81 -1.26 -5.08 118.95 114.72 2k4r s ARG 30 Ca -0.15 -0.13 -0.19 0.00 -1.72 0.00 0.00 55.73 53.53 2k4r s ARG 30 Cb 0.03 -3.13 -0.03 0.00 -0.45 0.00 0.00 34.95 31.38 2k4r s ARG 30 CO 0.59 0.70 0.56 0.45 -0.68 0.00 0.00 175.30 176.92 2k4r s SER 31 N -1.52 6.58 0.33 0.23 0.15 -1.26 -4.87 113.70 113.34 2k4r s SER 31 Ca 0.23 0.70 -0.29 0.00 0.70 0.00 0.00 55.95 57.30 2k4r s SER 31 Cb -0.13 -2.31 -0.10 0.00 -1.71 0.00 0.00 66.02 61.77 2k4r s SER 31 CO 0.13 -0.24 1.32 -2.16 1.20 0.00 0.00 173.24 173.49 2k4r s PRO 32 N 1.90 4.34 0.51 5.44 0.04 -1.26 -4.93 135.00 141.03 2k4r s PRO 32 Ca 0.25 2.24 0.29 0.00 0.04 0.00 0.00 61.00 63.82 2k4r s PRO 32 Cb -0.16 -3.07 1.26 0.00 0.04 0.00 0.00 34.50 32.58 2k4r s PRO 32 CO 0.10 -0.22 1.96 -1.00 0.04 0.00 0.00 177.00 177.88 2k4r h PRO 33 N 3.45 0.00 -4.77 0.56 0.13 -2.02 -3.45 132.00 125.91 2k4r h PRO 33 Ca -0.49 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.31 2k4r h PRO 33 Cb 1.23 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 2k4r h PRO 33 CO 0.66 0.12 -0.60 0.00 -0.23 0.00 0.00 178.00 177.96 2k4r s ALA 34 N -3.81 1.57 -0.17 -0.56 0.00 -1.26 -5.12 121.76 112.41 2k4r s ALA 34 Ca -0.00 -1.79 -0.25 0.00 0.00 0.00 0.00 51.96 49.92 2k4r s ALA 34 Cb 0.11 1.23 -0.02 0.00 0.00 0.00 0.00 23.12 24.44 2k4r s ALA 34 CO 0.58 -0.53 0.82 0.45 0.00 0.00 0.00 175.76 177.08 2k4r s SER 35 N -3.27 6.94 -0.08 0.00 0.15 -1.26 -4.93 113.70 111.26 2k4r s SER 35 Ca 0.38 1.16 0.15 0.00 0.70 0.00 0.00 55.95 58.34 2k4r s SER 35 Cb 0.07 -2.45 0.51 0.00 -1.71 0.00 0.00 66.02 62.44 2k4r s SER 35 CO 0.15 -0.39 1.43 -2.67 1.20 0.00 0.00 173.24 172.96 2k4r n TRP 36 N 5.21 0.93 0.30 3.44 4.27 -1.26 -4.51 117.44 125.81 2k4r n TRP 36 Ca 0.04 -0.63 0.18 0.00 -3.89 0.00 0.00 57.50 53.21 2k4r n TRP 36 Cb 0.49 -0.16 0.89 0.00 -1.36 0.00 0.00 31.31 31.17 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 1.06 -0.52 -1.67 0.00 -2.02 -1.09 119.26 117.78 2k4r h ALA 37 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2k4r h ALA 37 Cb 1.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2k4r h ALA 37 CO 0.13 0.03 0.00 -0.85 0.00 0.00 0.00 179.25 178.56 2k4r n GLU 38 N -3.20 2.89 0.23 0.00 0.28 -1.26 -4.23 120.64 115.34 2k4r n GLU 38 Ca -0.01 -2.39 0.09 0.00 -0.16 0.00 0.00 57.16 54.68 2k4r n GLU 38 Cb 0.21 -1.46 0.54 0.00 1.43 0.00 0.00 31.44 32.16 2k4r n GLU 38 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2k4r h LEU 39 N 3.09 0.00 2.15 -1.84 3.38 -1.50 -3.46 115.31 117.13 2k4r h LEU 39 Ca 0.00 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.65 2k4r h LEU 39 Cb 0.92 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2k4r h LEU 39 CO 0.03 0.23 -0.42 -1.14 0.09 0.00 0.00 178.44 177.23 2k4r n ARG 40 N -3.75 -1.50 -0.78 1.13 0.63 -1.26 -4.86 116.66 106.26 2k4r n ARG 40 Ca -0.01 0.77 0.02 0.00 -0.92 0.00 0.00 57.85 57.71 2k4r n ARG 40 Cb 0.34 -5.17 0.30 0.00 0.45 0.00 0.00 32.46 28.37 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 -1.04 3.80 0.40 5.14 0.00 -1.26 -4.77 105.19 107.45 2k4r n GLY 41 Ca -0.18 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.68 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 2.46 -0.52 0.00 1.61 1.08 -1.89 -1.63 115.11 116.22 2k4r h GLN 42 Ca 0.12 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2k4r h GLN 42 Cb 1.90 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 29.45 2k4r h GLN 42 CO 0.48 -0.35 0.22 -1.35 -0.95 0.00 0.00 178.83 176.88 2k4r h PRO 43 N -0.54 0.00 0.00 1.46 0.11 -1.96 -2.87 132.00 128.20 2k4r h PRO 43 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 2k4r h PRO 43 Cb 0.64 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.75 2k4r h PRO 43 CO -0.34 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 175.06 2k4r n HIS 44 N -2.93 -0.01 -4.18 0.65 1.44 -0.61 -4.99 115.22 104.59 2k4r n HIS 44 Ca -0.02 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.53 2k4r n HIS 44 Cb 0.27 0.00 -0.14 0.00 0.12 0.00 0.00 29.99 30.24 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 0.50 0.68 0.00 4.39 4.22 -1.26 -1.72 114.94 121.76 2k4r s ASN 45 Ca 0.00 -0.13 0.00 0.00 -2.14 0.00 0.00 52.86 50.59 2k4r s ASN 45 Cb 0.00 -0.07 0.00 0.00 1.28 0.00 0.00 41.25 42.46 2k4r s ASN 45 CO 0.00 0.05 0.00 0.33 -2.04 0.00 0.00 177.10 175.44 2k4r n PHE 46 N 2.84 0.00 -1.49 1.54 7.35 -1.26 -4.84 117.46 121.60 2k4r n PHE 46 Ca -0.14 0.00 -0.44 0.00 -0.76 0.00 0.00 57.45 56.11 2k4r n PHE 46 Cb 0.58 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.40 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 -1.44 0.17 -0.30 0.00 1.81 -0.06 -4.83 118.95 114.30 2k4r s ARG 48 Ca 0.62 0.50 -0.01 0.00 -1.72 0.00 0.00 55.73 55.11 2k4r s ARG 48 Cb -0.71 -0.14 0.19 0.00 -0.45 0.00 0.00 34.95 33.84 2k4r s ARG 48 CO 0.58 -0.17 0.72 -1.54 -0.68 0.00 0.00 175.30 174.21 2k4r s SER 49 N 1.30 -1.23 0.01 0.23 1.04 -1.26 -2.11 113.70 111.68 2k4r s SER 49 Ca -0.09 0.38 -0.23 0.00 0.48 0.00 0.00 55.95 56.49 2k4r s SER 49 Cb -0.11 1.88 -0.17 0.00 0.10 0.00 0.00 66.02 67.71 2k4r s SER 49 CO -0.08 -0.23 1.31 1.55 0.98 0.00 0.00 173.24 176.77 2k4r h PRO 50 N 7.88 0.17 -2.05 4.02 0.13 -1.99 -3.46 132.00 136.70 2k4r h PRO 50 Ca -0.10 -0.09 -0.02 0.00 -0.87 0.00 0.00 66.00 64.93 2k4r h PRO 50 Cb 1.18 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.10 2k4r h PRO 50 CO 0.11 0.60 0.04 0.34 -0.23 0.00 0.00 178.00 178.87 2k4r s ASP 51 N -5.89 -0.83 0.19 1.44 2.15 -1.26 -5.04 116.67 107.43 2k4r s ASP 51 Ca -0.15 1.44 0.00 0.00 0.43 0.00 0.00 52.55 54.27 2k4r s ASP 51 Cb 0.03 1.38 0.00 0.00 -0.30 0.00 0.00 42.92 44.03 2k4r s ASP 51 CO 0.71 -0.24 0.00 0.61 -0.17 0.00 0.00 175.17 176.08 2k4r n GLY 52 N 3.58 -1.72 1.10 2.66 0.00 -1.26 -4.99 105.19 104.57 2k4r n GLY 52 Ca -0.17 0.51 -0.03 0.00 0.00 0.00 0.00 46.02 46.33 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 -2.95 3.19 -3.27 4.61 0.00 -1.26 -4.97 120.51 115.85 2k4r n ALA 53 Ca 0.00 -1.15 -0.24 0.00 0.00 0.00 0.00 53.44 52.05 2k4r n ALA 53 Cb 0.00 -0.44 0.02 0.00 0.00 0.00 0.00 19.45 19.03 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 0.15 -0.51 3.10 0.00 0.00 -1.26 -4.95 105.19 101.72 2k4r n GLY 54 Ca -0.15 0.13 0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 -5.95 0.52 0.60 1.61 3.52 -1.26 -5.05 118.95 112.94 2k4r s ARG 55 Ca 0.39 0.82 -0.18 0.00 -0.13 0.00 0.00 55.73 56.63 2k4r s ARG 55 Cb -0.19 0.29 -0.03 0.00 -1.56 0.00 0.00 34.95 33.45 2k4r s ARG 55 CO 0.48 -0.70 1.13 -1.25 -0.81 0.00 0.00 175.30 174.15 2k4r s PRO 56 N 2.78 3.08 0.06 5.12 0.04 -1.26 -4.83 135.00 139.99 2k4r s PRO 56 Ca 0.17 1.55 -0.03 0.00 0.04 0.00 0.00 61.00 62.73 2k4r s PRO 56 Cb -0.14 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2k4r s PRO 56 CO -0.21 -1.06 0.04 1.67 0.04 0.00 0.00 177.00 177.48 2k4r s TRP 57 N -1.98 0.39 0.24 0.56 1.48 -0.89 -1.66 118.94 117.07 2k4r s TRP 57 Ca 0.71 -0.88 0.02 0.00 -1.06 0.00 0.00 56.10 54.89 2k4r s TRP 57 Cb -0.23 -0.27 -0.04 0.00 -1.16 0.00 0.00 33.47 31.77 2k4r s TRP 57 CO 0.33 -0.42 0.18 0.00 -4.06 0.00 0.00 176.95 172.98 2k4r s PHE 59 N -3.91 3.25 0.07 0.00 0.08 -1.26 -0.67 117.98 115.54 2k4r s PHE 59 Ca 0.39 0.57 0.03 0.00 0.12 0.00 0.00 56.93 58.04 2k4r s PHE 59 Cb 0.06 -2.73 -0.04 0.00 -0.57 0.00 0.00 43.02 39.74 2k4r s PHE 59 CO 0.17 -0.30 0.07 1.52 -0.10 0.00 0.00 175.22 176.57 2k4r s TYR 60 N 2.30 3.17 -0.11 0.36 -0.85 0.21 -0.41 117.35 122.01 2k4r s TYR 60 Ca 0.20 0.07 0.01 0.00 -0.52 0.00 0.00 57.07 56.84 2k4r s TYR 60 Cb -0.16 -1.62 -0.01 0.00 0.38 0.00 0.00 41.96 40.55 2k4r s TYR 60 CO 0.10 0.52 -0.16 0.50 -1.52 0.00 0.00 175.55 174.99 2k4r s ARG 61 N -2.31 3.22 0.43 -3.49 3.52 -0.88 -1.16 118.95 118.28 2k4r s ARG 61 Ca 0.28 -0.73 0.08 0.00 -0.13 0.00 0.00 55.73 55.23 2k4r s ARG 61 Cb -0.12 -2.53 0.00 0.00 -1.56 0.00 0.00 34.95 30.74 2k4r s ARG 61 CO 0.21 0.25 0.51 0.54 -0.81 0.00 0.00 175.30 176.00 2k4r s ASN 62 N 0.23 5.41 -0.01 -2.12 2.20 -0.45 -4.63 114.94 115.58 2k4r s ASN 62 Ca -0.10 -0.56 0.01 0.00 -0.94 0.00 0.00 52.86 51.26 2k4r s ASN 62 Cb -0.16 -0.57 0.03 0.00 -2.00 0.00 0.00 41.25 38.55 2k4r s ASN 62 CO 0.06 -0.76 0.65 0.00 -2.94 0.00 0.00 177.10 174.11 2k4r n ALA 63 N -1.76 2.54 0.28 3.54 0.00 -1.26 -1.96 120.51 121.88 2k4r n ALA 63 Ca 0.07 -0.07 0.03 0.00 0.00 0.00 0.00 53.44 53.47 2k4r n ALA 63 Cb 0.60 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.04 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 -0.07 2.96 0.00 0.00 6.02 -1.26 -5.00 117.38 120.03 2k4r n GLN 64 Ca 0.01 -0.37 0.00 0.00 -0.01 0.00 0.00 57.00 56.63 2k4r n GLN 64 Cb 0.23 -0.92 0.00 0.00 1.02 0.00 0.00 30.24 30.57 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 0.83 0.87 3.92 1.08 0.00 -0.83 -5.09 105.19 105.97 2k4r n GLY 65 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.71 3.56 -0.33 1.61 1.02 -1.26 -4.93 119.74 118.71 2k4r s LYS 66 Ca 0.00 -0.19 -0.01 0.00 0.02 0.00 0.00 55.97 55.79 2k4r s LYS 66 Cb 0.00 -2.73 0.11 0.00 -0.52 0.00 0.00 37.83 34.69 2k4r s LYS 66 CO 0.00 0.29 0.15 0.08 -0.92 0.00 0.00 175.35 174.94 2k4r s VAL 67 N -2.02 0.57 0.40 3.17 1.01 -1.26 -1.34 120.40 120.93 2k4r s VAL 67 Ca 0.41 -1.44 0.06 0.00 0.00 0.00 0.00 61.98 61.01 2k4r s VAL 67 Cb -0.11 -1.43 -0.08 0.00 0.00 0.00 0.00 36.38 34.76 2k4r s VAL 67 CO 0.30 -0.77 0.02 -1.81 0.00 0.00 0.00 175.10 172.84 2k4r s ASP 68 N 1.48 3.63 -0.01 3.32 1.01 -0.31 -4.36 116.67 121.44 2k4r s ASP 68 Ca 0.12 -1.37 -0.04 0.00 0.71 0.00 0.00 52.55 51.96 2k4r s ASP 68 Cb -0.19 -0.34 -0.04 0.00 1.01 0.00 0.00 42.92 43.36 2k4r s ASP 68 CO -0.20 -0.48 0.21 -1.66 0.21 0.00 0.00 175.17 173.25 2k4r s TRP 69 N -2.81 3.56 -0.05 4.23 1.48 -1.26 0.67 118.94 124.76 2k4r s TRP 69 Ca 0.35 0.44 -0.17 0.00 -1.06 0.00 0.00 56.10 55.66 2k4r s TRP 69 Cb 0.10 -1.89 0.03 0.00 -1.16 0.00 0.00 33.47 30.55 2k4r s TRP 69 CO 0.17 0.64 0.39 0.20 -4.06 0.00 0.00 176.95 174.29 2k4r s GLY 70 N -1.83 -0.25 0.62 3.67 0.00 0.15 -4.91 107.32 104.78 2k4r s GLY 70 Ca 0.27 0.65 -0.17 0.00 0.00 0.00 0.00 44.72 45.48 2k4r s GLY 70 CO 0.17 0.43 1.14 -0.19 0.00 0.00 0.00 173.10 174.65 2k4r s TYR 71 N -0.98 2.54 -1.32 1.90 2.02 -1.26 -1.82 117.35 118.44 2k4r s TYR 71 Ca -0.10 1.55 0.10 0.00 -0.37 0.00 0.00 57.07 58.25 2k4r s TYR 71 Cb -0.04 -3.28 0.40 0.00 -0.40 0.00 0.00 41.96 38.65 2k4r s TYR 71 CO 0.04 -1.82 1.24 0.00 -1.57 0.00 0.00 175.55 173.45 2k4r n ASP 73 N 0.52 0.00 0.00 0.00 5.68 -1.26 -1.36 116.55 120.14 2k4r n ASP 73 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.43 2k4r n ASP 73 Cb 0.55 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.53 2k4r n ASP 73 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2k4r n GLY 75 N 1.63 0.00 3.27 0.00 0.00 -1.26 -4.96 105.19 103.87 2k4r n GLY 75 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 2.71 0.00 1.61 0.74 -1.26 -5.17 119.66 118.29 2k4r s GLN 76 Ca 0.00 -1.11 0.00 0.00 0.05 0.00 0.00 55.36 54.30 2k4r s GLN 76 Cb 0.00 -3.36 0.00 0.00 1.10 0.00 0.00 33.01 30.75 2k4r s GLN 76 CO 0.00 -0.59 0.10 0.41 -0.55 0.00 0.00 175.29 174.66