#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k5v s PRO 11 N 0.00 2.04 0.26 1.97 0.04 -1.26 -4.69 135.00 133.36 1k5v s PRO 11 Ca 0.00 1.26 -0.07 0.00 0.04 0.00 0.00 61.00 62.23 1k5v s PRO 11 Cb 0.00 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.66 1k5v s PRO 11 CO 0.00 -1.82 0.38 0.15 0.04 0.00 0.00 177.00 175.75 1k5v s LYS 12 N -4.80 1.54 -0.07 4.56 1.02 0.18 -4.09 119.74 118.08 1k5v s LYS 12 Ca 0.63 -1.48 0.02 0.00 0.02 0.00 0.00 55.97 55.16 1k5v s LYS 12 Cb -0.19 0.41 -0.02 0.00 -0.52 0.00 0.00 37.83 37.51 1k5v s LYS 12 CO 0.56 -0.61 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.74 1k5v s LEU 13 N -3.11 2.82 -0.51 3.17 1.43 0.13 -0.50 118.68 122.11 1k5v s LEU 13 Ca 0.29 -0.19 -0.14 0.00 -1.03 0.00 0.00 54.13 53.06 1k5v s LEU 13 Cb 0.02 -1.60 0.12 0.00 0.03 0.00 0.00 46.19 44.76 1k5v s LEU 13 CO 0.13 0.31 0.44 -0.76 0.23 0.00 0.00 176.35 176.70 1k5v s LEU 14 N -0.49 5.96 -0.45 1.79 1.43 -1.26 -0.44 118.68 125.23 1k5v s LEU 14 Ca 0.06 -1.72 -0.24 0.00 -1.03 0.00 0.00 54.13 51.20 1k5v s LEU 14 Cb -0.12 -2.16 0.03 0.00 0.03 0.00 0.00 46.19 43.97 1k5v s LEU 14 CO 0.02 -0.78 0.82 -0.47 0.23 0.00 0.00 176.35 176.17 1k5v s TYR 15 N 1.56 2.98 -0.26 0.29 5.04 -0.09 -0.43 117.35 126.43 1k5v s TYR 15 Ca 0.04 0.22 -0.28 0.00 -2.44 0.00 0.00 57.07 54.61 1k5v s TYR 15 Cb -0.28 -3.73 0.01 0.00 0.35 0.00 0.00 41.96 38.31 1k5v s TYR 15 CO 0.03 -1.01 1.03 0.00 -1.34 0.00 0.00 175.55 174.26 1k5v h SER 17 N 7.71 0.00 0.03 0.00 4.64 -1.58 -1.07 113.55 123.27 1k5v h SER 17 Ca -0.20 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1k5v h SER 17 Cb 1.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1k5v h SER 17 CO 0.99 0.00 -0.02 -1.13 -0.87 0.00 0.00 176.83 175.79 1k5v h ASN 18 N 0.00 -0.06 -0.08 4.97 -1.24 -1.80 -3.36 115.58 114.01 1k5v h ASN 18 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1k5v h ASN 18 Cb 0.08 0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.15 1k5v h ASN 18 CO 0.00 -0.03 0.00 0.61 -1.29 0.00 0.00 177.43 176.72 1k5v n GLY 19 N -1.03 0.42 2.06 1.57 0.00 -1.24 -4.84 105.19 102.12 1k5v n GLY 19 Ca -0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 46.02 45.76 1k5v n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k5v n GLY 20 N 0.35 0.39 3.95 -0.02 0.00 -0.41 -4.99 105.19 104.46 1k5v n GLY 20 Ca 0.05 -0.86 -0.23 0.00 0.00 0.00 0.00 46.02 44.99 1k5v n GLY 20 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1k5v s HIS 21 N -2.11 3.24 -0.12 1.61 3.76 -1.21 -4.67 115.29 115.79 1k5v s HIS 21 Ca 0.00 0.24 -0.04 0.00 -0.15 0.00 0.00 55.06 55.11 1k5v s HIS 21 Cb 0.00 -2.29 -0.04 0.00 1.11 0.00 0.00 32.58 31.36 1k5v s HIS 21 CO 0.00 -0.33 0.05 -0.06 -0.85 0.00 0.00 174.74 173.55 1k5v s PHE 22 N -2.54 3.28 0.18 1.40 0.08 0.57 0.32 117.98 121.28 1k5v s PHE 22 Ca 0.48 0.23 -0.32 0.00 0.12 0.00 0.00 56.93 57.44 1k5v s PHE 22 Cb -0.10 -1.90 -0.11 0.00 -0.57 0.00 0.00 43.02 40.34 1k5v s PHE 22 CO 0.38 0.45 1.67 -1.17 -0.10 0.00 0.00 175.22 176.45 1k5v s LEU 23 N -0.59 4.37 -0.04 -0.37 2.96 0.43 -2.14 118.68 123.30 1k5v s LEU 23 Ca 0.11 2.77 0.03 0.00 -0.22 0.00 0.00 54.13 56.81 1k5v s LEU 23 Cb -0.12 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 42.98 1k5v s LEU 23 CO 0.02 -0.92 -0.11 -0.60 -1.32 0.00 0.00 176.35 173.42 1k5v s ARG 24 N 1.30 1.21 -0.32 1.98 3.52 0.26 -4.47 118.95 122.43 1k5v s ARG 24 Ca 0.74 -0.36 -0.03 0.00 -0.13 0.00 0.00 55.73 55.94 1k5v s ARG 24 Cb -0.47 -1.09 0.05 0.00 -1.56 0.00 0.00 34.95 31.88 1k5v s ARG 24 CO 0.32 0.11 0.05 0.42 -0.81 0.00 0.00 175.30 175.39 1k5v s ILE 25 N 0.28 3.29 0.56 4.11 1.01 -0.89 0.33 121.20 129.89 1k5v s ILE 25 Ca -0.05 -1.34 -0.15 0.00 0.00 0.00 0.00 60.65 59.10 1k5v s ILE 25 Cb -0.11 -2.90 -0.05 0.00 0.01 0.00 0.00 42.46 39.41 1k5v s ILE 25 CO 0.01 -0.17 1.02 -0.76 0.00 0.00 0.00 174.94 175.05 1k5v s LEU 26 N 1.30 3.51 0.60 2.97 1.43 0.37 -4.73 118.68 124.13 1k5v s LEU 26 Ca -0.03 1.66 0.35 0.00 -1.03 0.00 0.00 54.13 55.08 1k5v s LEU 26 Cb -0.20 -4.51 1.92 0.00 0.03 0.00 0.00 46.19 43.43 1k5v s LEU 26 CO 0.00 -0.89 2.24 -0.65 0.23 0.00 0.00 176.35 177.28 1k5v h PRO 27 N 0.53 0.00 -0.03 1.29 0.10 -1.99 0.97 132.00 132.88 1k5v h PRO 27 Ca -0.46 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.64 1k5v h PRO 27 Cb 1.20 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.30 1k5v h PRO 27 CO 0.60 0.03 0.00 -0.40 0.10 0.00 0.00 178.00 178.32 1k5v n ASP 28 N -3.47 0.79 0.00 -2.05 5.75 -1.26 -4.86 116.55 111.46 1k5v n ASP 28 Ca -0.02 -1.34 0.00 0.00 -0.01 0.00 0.00 54.79 53.41 1k5v n ASP 28 Cb 0.13 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 1k5v n ASP 28 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1k5v n GLY 29 N 1.06 0.72 3.73 6.12 0.00 0.33 -4.99 105.19 112.17 1k5v n GLY 29 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1k5v n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k5v s THR 30 N -2.74 4.33 -0.13 2.61 2.01 -1.24 -1.78 115.64 118.70 1k5v s THR 30 Ca 0.00 1.99 -0.03 0.00 0.31 0.00 0.00 61.69 63.96 1k5v s THR 30 Cb 0.00 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.21 1k5v s THR 30 CO 0.00 0.33 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.55 1k5v s VAL 31 N -0.20 4.01 0.00 3.82 1.01 -1.26 0.14 120.40 127.92 1k5v s VAL 31 Ca 0.47 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1k5v s VAL 31 Cb -0.25 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1k5v s VAL 31 CO 0.31 0.53 0.00 -0.90 0.00 0.00 0.00 175.10 175.04 1k5v n ASP 32 N 3.05 0.00 -3.92 3.32 5.68 0.15 -4.34 116.55 120.49 1k5v n ASP 32 Ca -0.18 0.00 -0.10 0.00 -0.50 0.00 0.00 54.79 54.01 1k5v n ASP 32 Cb 0.53 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.39 1k5v n ASP 32 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1k5v s GLY 33 N -0.02 0.12 0.04 6.12 0.00 -0.31 0.89 107.32 114.15 1k5v s GLY 33 Ca 0.00 -0.28 0.05 0.00 0.00 0.00 0.00 44.72 44.48 1k5v s GLY 33 CO 0.00 -0.34 -0.13 -1.08 0.00 0.00 0.00 173.10 171.54 1k5v s THR 34 N -0.93 1.05 -1.47 0.90 -1.32 -0.91 -4.75 115.64 108.21 1k5v s THR 34 Ca -0.10 -0.97 0.26 0.00 -1.21 0.00 0.00 61.69 59.67 1k5v s THR 34 Cb -0.06 -0.96 0.17 0.00 -1.51 0.00 0.00 72.50 70.14 1k5v s THR 34 CO -0.00 -0.01 1.51 0.54 -2.21 0.00 0.00 174.62 174.45 1k5v n ARG 35 N 1.93 0.52 -2.83 7.08 1.74 -1.26 -0.32 116.66 123.51 1k5v n ARG 35 Ca -0.18 -0.30 -0.43 0.00 -0.77 0.00 0.00 57.85 56.17 1k5v n ARG 35 Cb 0.55 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.45 1k5v n ARG 35 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1k5v s ASP 36 N -2.69 6.30 0.00 0.55 2.15 -1.26 -4.89 116.67 116.82 1k5v s ASP 36 Ca 0.19 -0.49 0.01 0.00 0.43 0.00 0.00 52.55 52.69 1k5v s ASP 36 Cb 0.19 -2.44 0.03 0.00 -0.30 0.00 0.00 42.92 40.40 1k5v s ASP 36 CO 0.59 -1.29 0.94 -1.14 -0.17 0.00 0.00 175.17 174.10 1k5v n ARG 37 N 7.58 0.00 -0.06 4.34 0.63 -1.26 -1.18 116.66 126.72 1k5v n ARG 37 Ca 0.01 0.41 0.11 0.00 -0.92 0.00 0.00 57.85 57.45 1k5v n ARG 37 Cb 0.47 -1.50 0.12 0.00 0.45 0.00 0.00 32.46 32.00 1k5v n ARG 37 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1k5v n SER 38 N -1.42 2.95 -4.73 6.15 3.41 -1.26 -4.98 113.62 113.74 1k5v n SER 38 Ca 0.00 -1.91 -0.35 0.00 -0.26 0.00 0.00 58.87 56.35 1k5v n SER 38 Cb 0.01 -0.07 0.08 0.00 -0.26 0.00 0.00 64.21 63.96 1k5v n SER 38 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1k5v s ASP 39 N -1.65 4.42 0.20 4.04 -1.08 -0.32 -4.95 116.67 117.33 1k5v s ASP 39 Ca 0.28 2.41 0.18 0.00 -0.52 0.00 0.00 52.55 54.91 1k5v s ASP 39 Cb 0.19 -2.60 0.01 0.00 -1.46 0.00 0.00 42.92 39.06 1k5v s ASP 39 CO 0.27 -2.12 1.15 1.56 0.52 0.00 0.00 175.17 176.56 1k5v h GLN 40 N 0.04 0.00 -0.64 4.34 4.20 -1.94 -3.37 115.11 117.74 1k5v h GLN 40 Ca -0.49 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.22 1k5v h GLN 40 Cb 1.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.08 1k5v h GLN 40 CO 0.51 0.24 0.00 0.72 -0.67 0.00 0.00 178.83 179.63 1k5v n HIS 41 N -2.96 1.55 0.86 2.96 8.25 -1.26 -4.21 115.22 120.41 1k5v n HIS 41 Ca -0.02 -0.57 0.09 0.00 -0.26 0.00 0.00 57.72 56.96 1k5v n HIS 41 Cb 0.70 -0.34 -0.06 0.00 1.12 0.00 0.00 29.99 31.41 1k5v n HIS 41 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1k5v n ILE 42 N 0.73 0.00 -2.78 1.59 -5.35 -1.26 -2.10 119.36 110.19 1k5v n ILE 42 Ca 0.23 -0.16 -0.43 0.00 -0.27 0.00 0.00 62.75 62.12 1k5v n ILE 42 Cb 0.93 1.09 -0.04 0.00 -1.74 0.00 0.00 39.64 39.89 1k5v n ILE 42 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1k5v s GLN 43 N -2.50 3.78 0.03 6.28 -0.21 -1.26 -4.42 119.66 121.36 1k5v s GLN 43 Ca 0.11 0.51 0.06 0.00 0.02 0.00 0.00 55.36 56.06 1k5v s GLN 43 Cb 0.14 -3.84 -0.03 0.00 1.00 0.00 0.00 33.01 30.29 1k5v s GLN 43 CO 0.64 -1.05 -0.14 -0.51 -2.12 0.00 0.00 175.29 172.12 1k5v s LEU 44 N 3.64 2.83 -0.40 2.90 1.43 0.35 -2.94 118.68 126.49 1k5v s LEU 44 Ca 0.39 -0.32 -0.06 0.00 -1.03 0.00 0.00 54.13 53.11 1k5v s LEU 44 Cb -0.11 -1.64 0.08 0.00 0.03 0.00 0.00 46.19 44.55 1k5v s LEU 44 CO 0.21 0.26 0.20 -1.58 0.23 0.00 0.00 176.35 175.68 1k5v s GLN 45 N -1.46 2.40 0.01 1.70 0.74 0.21 0.48 119.66 123.74 1k5v s GLN 45 Ca 0.16 -1.53 -0.21 0.00 0.05 0.00 0.00 55.36 53.83 1k5v s GLN 45 Cb -0.11 -3.62 -0.06 0.00 1.10 0.00 0.00 33.01 30.32 1k5v s GLN 45 CO 0.06 -0.93 0.61 -0.51 -0.55 0.00 0.00 175.29 173.97 1k5v s LEU 46 N 1.31 4.44 0.06 3.68 1.02 -1.26 -1.62 118.68 126.31 1k5v s LEU 46 Ca 0.03 1.20 0.03 0.00 0.02 0.00 0.00 54.13 55.42 1k5v s LEU 46 Cb -0.22 -2.95 -0.03 0.00 0.02 0.00 0.00 46.19 43.01 1k5v s LEU 46 CO -0.00 0.12 -0.09 -0.94 0.02 0.00 0.00 176.35 175.46 1k5v s SER 47 N -0.33 1.11 0.05 2.29 1.04 -0.42 -4.91 113.70 112.53 1k5v s SER 47 Ca 0.31 -0.62 -0.07 0.00 0.48 0.00 0.00 55.95 56.05 1k5v s SER 47 Cb -0.19 0.02 -0.05 0.00 0.10 0.00 0.00 66.02 65.90 1k5v s SER 47 CO 0.18 -0.20 0.32 0.00 0.98 0.00 0.00 173.24 174.52 1k5v s ALA 48 N -1.61 3.81 0.00 5.32 0.00 -1.26 -0.37 121.76 127.65 1k5v s ALA 48 Ca -0.05 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.39 1k5v s ALA 48 Cb -0.08 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.91 1k5v s ALA 48 CO 0.00 0.63 0.00 -1.91 0.00 0.00 0.00 175.76 174.49 1k5v n GLU 49 N 0.87 0.00 -2.42 0.00 4.07 -0.80 -4.93 120.64 117.44 1k5v n GLU 49 Ca -0.09 0.00 -0.24 0.00 -0.06 0.00 0.00 57.16 56.77 1k5v n GLU 49 Cb 0.52 0.00 0.05 0.00 -0.06 0.00 0.00 31.44 31.95 1k5v n GLU 49 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1k5v s SER 50 N -0.69 5.14 0.04 4.31 0.15 -1.26 -4.91 113.70 116.48 1k5v s SER 50 Ca 0.00 0.32 -0.37 0.00 0.70 0.00 0.00 55.95 56.60 1k5v s SER 50 Cb 0.00 -1.13 -0.16 0.00 -1.71 0.00 0.00 66.02 63.01 1k5v s SER 50 CO 0.00 -1.32 1.44 0.52 1.20 0.00 0.00 173.24 175.08 1k5v n VAL 51 N -2.63 0.06 -0.58 4.45 0.31 -1.26 -0.57 118.33 118.12 1k5v n VAL 51 Ca 0.07 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1k5v n VAL 51 Cb 0.60 -0.99 0.00 0.00 -0.91 0.00 0.00 33.84 32.53 1k5v n VAL 51 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1k5v n GLY 52 N 2.90 1.69 3.64 2.92 0.00 -1.26 -5.02 105.19 110.07 1k5v n GLY 52 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1k5v n GLY 52 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k5v s GLU 53 N -0.06 2.79 0.04 1.61 2.02 0.27 -1.45 118.70 123.92 1k5v s GLU 53 Ca 0.00 -0.56 -0.02 0.00 0.02 0.00 0.00 54.97 54.40 1k5v s GLU 53 Cb 0.00 -2.66 -0.02 0.00 0.10 0.00 0.00 34.13 31.55 1k5v s GLU 53 CO 0.00 0.65 0.02 0.14 0.02 0.00 0.00 175.26 176.09 1k5v s VAL 54 N -0.95 0.16 0.02 2.63 -7.23 -0.32 -1.90 120.40 112.81 1k5v s VAL 54 Ca 0.16 -1.33 0.04 0.00 -1.81 0.00 0.00 61.98 59.04 1k5v s VAL 54 Cb -0.11 -0.99 -0.04 0.00 0.56 0.00 0.00 36.38 35.80 1k5v s VAL 54 CO 0.06 -0.73 -0.06 -0.31 -0.31 0.00 0.00 175.10 173.75 1k5v s TYR 55 N -2.87 2.90 -0.17 2.82 2.02 0.51 -1.94 117.35 120.62 1k5v s TYR 55 Ca -0.03 -0.04 -0.01 0.00 -0.37 0.00 0.00 57.07 56.63 1k5v s TYR 55 Cb 0.00 -1.59 0.05 0.00 -0.40 0.00 0.00 41.96 40.02 1k5v s TYR 55 CO -0.06 0.40 -0.04 0.42 -1.57 0.00 0.00 175.55 174.70 1k5v s ILE 56 N -1.06 1.02 0.06 2.71 1.01 -1.26 -1.30 121.20 122.38 1k5v s ILE 56 Ca 0.19 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.26 1k5v s ILE 56 Cb -0.11 -1.26 -0.03 0.00 0.01 0.00 0.00 42.46 41.08 1k5v s ILE 56 CO 0.10 0.06 -0.17 -0.75 0.00 0.00 0.00 174.94 174.18 1k5v s LYS 57 N 1.66 1.02 -0.21 2.79 2.20 -0.64 -1.09 119.74 125.48 1k5v s LYS 57 Ca -0.00 -0.92 -0.27 0.00 -0.36 0.00 0.00 55.97 54.42 1k5v s LYS 57 Cb -0.16 -1.11 -0.00 0.00 -1.51 0.00 0.00 37.83 35.05 1k5v s LYS 57 CO -0.07 0.27 0.93 0.45 -0.36 0.00 0.00 175.35 176.56 1k5v s SER 58 N -1.46 7.00 0.44 1.43 0.15 -0.13 0.64 113.70 121.77 1k5v s SER 58 Ca 0.03 1.24 0.24 0.00 0.70 0.00 0.00 55.95 58.16 1k5v s SER 58 Cb -0.09 -2.49 0.85 0.00 -1.71 0.00 0.00 66.02 62.58 1k5v s SER 58 CO 0.02 -0.55 1.79 0.71 1.20 0.00 0.00 173.24 176.41 1k5v h THR 59 N 5.37 0.45 0.00 6.45 1.35 -1.86 0.98 112.91 125.64 1k5v h THR 59 Ca -0.23 -1.13 -0.03 0.00 -0.55 0.00 0.00 66.41 64.47 1k5v h THR 59 Cb 1.09 1.82 -0.00 0.00 -1.73 0.00 0.00 68.15 69.32 1k5v h THR 59 CO 0.91 0.19 -0.35 -0.08 -0.25 0.00 0.00 175.52 175.94 1k5v h GLU 60 N 0.00 0.00 0.00 4.72 4.57 -1.82 -3.39 114.58 118.66 1k5v h GLU 60 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1k5v h GLU 60 Cb 0.80 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.39 1k5v h GLU 60 CO 0.03 0.10 -0.43 0.25 -1.18 0.00 0.00 179.01 177.77 1k5v n THR 61 N -3.03 0.00 -0.78 0.32 -2.24 -1.15 -5.01 114.28 102.39 1k5v n THR 61 Ca 0.02 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1k5v n THR 61 Cb 0.58 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1k5v n THR 61 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k5v n GLY 62 N 1.11 1.03 3.76 3.38 0.00 0.34 -5.00 105.19 109.80 1k5v n GLY 62 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1k5v n GLY 62 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k5v s GLN 63 N -0.16 4.57 0.01 1.61 -0.21 -1.25 -4.75 119.66 119.49 1k5v s GLN 63 Ca 0.00 1.89 -0.02 0.00 0.02 0.00 0.00 55.36 57.25 1k5v s GLN 63 Cb 0.00 -3.16 -0.04 0.00 1.00 0.00 0.00 33.01 30.81 1k5v s GLN 63 CO 0.00 0.12 0.18 0.71 -2.12 0.00 0.00 175.29 174.18 1k5v s TYR 64 N -1.16 3.51 0.20 0.91 1.51 0.40 -0.96 117.35 121.76 1k5v s TYR 64 Ca 0.46 0.31 -0.30 0.00 -1.01 0.00 0.00 57.07 56.52 1k5v s TYR 64 Cb -0.34 -1.80 -0.08 0.00 -0.11 0.00 0.00 41.96 39.64 1k5v s TYR 64 CO 0.43 0.62 1.12 -1.17 -1.11 0.00 0.00 175.55 175.45 1k5v s LEU 65 N -2.10 4.49 0.20 -1.29 2.96 -0.25 0.65 118.68 123.34 1k5v s LEU 65 Ca 0.29 2.16 -0.08 0.00 -0.22 0.00 0.00 54.13 56.28 1k5v s LEU 65 Cb -0.13 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 42.94 1k5v s LEU 65 CO 0.21 -0.24 0.30 0.00 -1.32 0.00 0.00 176.35 175.30 1k5v s ALA 66 N -0.36 0.20 -0.04 5.97 0.00 0.50 -4.35 121.76 123.68 1k5v s ALA 66 Ca 0.49 -1.07 -0.00 0.00 0.00 0.00 0.00 51.96 51.37 1k5v s ALA 66 Cb -0.31 1.04 0.03 0.00 0.00 0.00 0.00 23.12 23.88 1k5v s ALA 66 CO 0.36 -0.69 0.02 1.41 0.00 0.00 0.00 175.76 176.86 1k5v s MET 67 N -4.03 0.19 0.86 0.00 1.75 -1.05 0.70 119.30 117.72 1k5v s MET 67 Ca 0.24 0.17 -0.12 0.00 -1.25 0.00 0.00 55.69 54.72 1k5v s MET 67 Cb 0.03 -0.51 0.13 0.00 2.84 0.00 0.00 34.83 37.32 1k5v s MET 67 CO 0.05 -0.21 1.21 0.16 -0.65 0.00 0.00 175.02 175.59 1k5v s ASP 68 N 1.43 3.92 0.49 1.11 1.47 0.76 -4.80 116.67 121.05 1k5v s ASP 68 Ca -0.04 0.45 0.33 0.00 1.18 0.00 0.00 52.55 54.47 1k5v s ASP 68 Cb -0.13 -0.75 1.79 0.00 -0.34 0.00 0.00 42.92 43.49 1k5v s ASP 68 CO -0.03 -2.23 2.01 0.71 0.68 0.00 0.00 175.17 176.31 1k5v h THR 69 N -1.23 0.00 -0.00 2.11 1.35 -2.01 0.04 112.91 113.16 1k5v h THR 69 Ca -0.45 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1k5v h THR 69 Cb 1.28 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 1k5v h THR 69 CO 0.51 0.00 -0.62 0.47 -0.25 0.00 0.00 175.52 175.64 1k5v n ASP 70 N -2.66 0.97 0.00 5.36 8.00 -1.26 -4.96 116.55 122.00 1k5v n ASP 70 Ca -0.02 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.69 1k5v n ASP 70 Cb 0.06 0.50 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 1k5v n ASP 70 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k5v n GLY 71 N 1.46 0.93 3.82 0.44 0.00 -0.00 -4.72 105.19 107.12 1k5v n GLY 71 Ca 0.07 -0.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1k5v n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k5v s LEU 72 N 0.00 4.40 0.24 0.99 2.01 -1.25 -0.18 118.68 124.88 1k5v s LEU 72 Ca 0.00 0.72 -0.25 0.00 0.01 0.00 0.00 54.13 54.60 1k5v s LEU 72 Cb 0.00 -2.39 -0.09 0.00 0.01 0.00 0.00 46.19 43.72 1k5v s LEU 72 CO 0.00 0.29 0.85 -0.76 1.01 0.00 0.00 176.35 177.74 1k5v s LEU 73 N -0.69 4.49 0.25 1.79 1.43 -1.25 -0.17 118.68 124.52 1k5v s LEU 73 Ca 0.20 1.72 -0.09 0.00 -1.03 0.00 0.00 54.13 54.92 1k5v s LEU 73 Cb -0.14 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.44 1k5v s LEU 73 CO 0.09 0.09 0.41 -0.72 0.23 0.00 0.00 176.35 176.44 1k5v s TYR 74 N -1.36 0.59 -0.27 0.29 1.13 0.22 -4.55 117.35 113.40 1k5v s TYR 74 Ca 0.42 -0.92 -0.11 0.00 -1.41 0.00 0.00 57.07 55.06 1k5v s TYR 74 Cb -0.21 0.02 -0.05 0.00 -1.10 0.00 0.00 41.96 40.61 1k5v s TYR 74 CO 0.26 -0.94 0.19 0.20 -2.51 0.00 0.00 175.55 172.74 1k5v s GLY 75 N -3.07 1.94 -0.22 5.49 0.00 -0.73 -0.37 107.32 110.36 1k5v s GLY 75 Ca 0.27 -1.03 -0.09 0.00 0.00 0.00 0.00 44.72 43.87 1k5v s GLY 75 CO 0.11 0.59 0.12 -0.45 0.00 0.00 0.00 173.10 173.47 1k5v s SER 76 N 1.57 5.89 0.09 1.64 0.15 0.21 -4.83 113.70 118.41 1k5v s SER 76 Ca 0.07 0.09 0.22 0.00 0.70 0.00 0.00 55.95 57.03 1k5v s SER 76 Cb -0.15 -2.04 0.90 0.00 -1.71 0.00 0.00 66.02 63.01 1k5v s SER 76 CO 0.09 0.10 1.70 1.67 1.20 0.00 0.00 173.24 178.00 1k5v n GLN 77 N 4.02 0.08 -4.00 5.44 -0.06 -1.26 0.15 117.38 121.76 1k5v n GLN 77 Ca -0.16 0.21 -0.12 0.00 -2.00 0.00 0.00 57.00 54.94 1k5v n GLN 77 Cb 0.52 -1.63 -0.12 0.00 -4.06 0.00 0.00 30.24 24.95 1k5v n GLN 77 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 1k5v s THR 78 N -3.08 0.24 0.25 1.69 -4.23 -1.26 -4.83 115.64 104.41 1k5v s THR 78 Ca 0.09 -0.65 -0.30 0.00 -1.18 0.00 0.00 61.69 59.66 1k5v s THR 78 Cb 0.13 -0.30 -0.09 0.00 1.34 0.00 0.00 72.50 73.57 1k5v s THR 78 CO 0.42 -0.27 1.02 -2.16 -0.54 0.00 0.00 174.62 173.09 1k5v s PRO 79 N -0.96 4.74 0.34 3.99 0.04 -1.26 -4.84 135.00 137.04 1k5v s PRO 79 Ca -0.08 1.64 -0.17 0.00 0.04 0.00 0.00 61.00 62.43 1k5v s PRO 79 Cb -0.07 -3.24 0.06 0.00 0.04 0.00 0.00 34.50 31.29 1k5v s PRO 79 CO -0.00 0.34 0.87 0.54 0.04 0.00 0.00 177.00 178.78 1k5v s ASN 80 N -0.91 0.03 0.33 6.66 2.20 -1.26 -5.03 114.94 116.95 1k5v s ASN 80 Ca 0.43 -1.07 0.10 0.00 -0.94 0.00 0.00 52.86 51.39 1k5v s ASN 80 Cb -0.29 0.77 0.92 0.00 -2.00 0.00 0.00 41.25 40.65 1k5v s ASN 80 CO 0.36 -1.53 1.73 1.05 -2.94 0.00 0.00 177.10 175.76 1k5v h GLU 81 N 2.00 0.53 0.00 3.55 4.11 -1.99 0.25 114.58 123.04 1k5v h GLU 81 Ca -0.32 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.08 1k5v h GLU 81 Cb 1.24 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1k5v h GLU 81 CO 0.41 0.35 0.00 0.39 0.07 0.00 0.00 179.01 180.23 1k5v n GLU 82 N -4.89 0.06 0.00 1.06 1.02 -1.26 -2.58 120.64 114.05 1k5v n GLU 82 Ca 0.27 0.42 0.12 0.00 -0.02 0.00 0.00 57.16 57.96 1k5v n GLU 82 Cb 0.78 -1.64 0.22 0.00 -0.02 0.00 0.00 31.44 30.78 1k5v n GLU 82 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1k5v s LEU 84 N -2.43 4.39 0.07 0.00 1.43 -1.07 -4.54 118.68 116.53 1k5v s LEU 84 Ca 0.23 1.20 0.05 0.00 -1.03 0.00 0.00 54.13 54.58 1k5v s LEU 84 Cb 0.19 -3.00 -0.03 0.00 0.03 0.00 0.00 46.19 43.38 1k5v s LEU 84 CO 0.52 0.02 -0.14 -0.36 0.23 0.00 0.00 176.35 176.62 1k5v s PHE 85 N 0.14 1.22 -0.41 0.29 0.08 -0.82 -1.65 117.98 116.83 1k5v s PHE 85 Ca 0.34 -0.46 -0.16 0.00 0.12 0.00 0.00 56.93 56.77 1k5v s PHE 85 Cb -0.18 -0.69 0.02 0.00 -0.57 0.00 0.00 43.02 41.60 1k5v s PHE 85 CO 0.18 0.06 0.34 -0.51 -0.10 0.00 0.00 175.22 175.18 1k5v s LEU 86 N -1.72 5.02 -0.24 -0.37 1.43 -0.42 -1.18 118.68 121.20 1k5v s LEU 86 Ca -0.02 -0.82 -0.29 0.00 -1.03 0.00 0.00 54.13 51.97 1k5v s LEU 86 Cb -0.10 -2.22 0.01 0.00 0.03 0.00 0.00 46.19 43.91 1k5v s LEU 86 CO 0.02 -0.48 1.06 -0.70 0.23 0.00 0.00 176.35 176.48 1k5v s GLU 87 N 1.81 4.24 -0.12 1.70 2.12 -0.53 -2.69 118.70 125.23 1k5v s GLU 87 Ca 0.07 1.35 0.02 0.00 0.36 0.00 0.00 54.97 56.77 1k5v s GLU 87 Cb -0.18 -3.66 0.01 0.00 0.26 0.00 0.00 34.13 30.56 1k5v s GLU 87 CO 0.11 -0.66 -0.18 1.03 -0.54 0.00 0.00 175.26 175.02 1k5v s ARG 88 N 3.26 2.49 -0.19 4.30 1.81 -0.26 -4.86 118.95 125.51 1k5v s ARG 88 Ca 0.45 -0.66 -0.15 0.00 -1.72 0.00 0.00 55.73 53.65 1k5v s ARG 88 Cb -0.15 -2.07 -0.04 0.00 -0.45 0.00 0.00 34.95 32.24 1k5v s ARG 88 CO 0.07 -0.04 0.34 -1.17 -0.68 0.00 0.00 175.30 173.82 1k5v s LEU 89 N 0.91 4.19 0.26 2.53 2.96 -1.26 -0.48 118.68 127.80 1k5v s LEU 89 Ca -0.07 0.49 -0.10 0.00 -0.22 0.00 0.00 54.13 54.22 1k5v s LEU 89 Cb -0.15 -2.43 -0.07 0.00 0.50 0.00 0.00 46.19 44.03 1k5v s LEU 89 CO -0.01 0.00 0.60 -1.61 -1.32 0.00 0.00 176.35 174.01 1k5v s GLU 90 N 0.96 3.82 0.42 1.98 0.41 0.56 -4.97 118.70 121.88 1k5v s GLU 90 Ca 0.17 0.33 0.14 0.00 -0.41 0.00 0.00 54.97 55.21 1k5v s GLU 90 Cb -0.14 -2.59 1.02 0.00 -1.78 0.00 0.00 34.13 30.64 1k5v s GLU 90 CO 0.06 0.25 1.93 1.05 -0.49 0.00 0.00 175.26 178.07 1k5v h GLU 91 N 2.32 0.43 0.00 1.61 4.11 -1.98 0.32 114.58 121.39 1k5v h GLU 91 Ca -0.47 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.93 1k5v h GLU 91 Cb 1.17 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1k5v h GLU 91 CO 0.68 0.29 0.00 0.27 0.07 0.00 0.00 179.01 180.31 1k5v n ASN 92 N -4.48 0.00 0.00 3.06 0.23 -1.26 -4.78 115.26 108.03 1k5v n ASN 92 Ca 0.13 0.18 0.00 0.00 -0.53 0.00 0.00 54.58 54.36 1k5v n ASN 92 Cb 0.48 -0.25 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 1k5v n ASN 92 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1k5v n HIS 93 N -1.25 0.00 -2.12 -2.53 8.25 0.10 -5.04 115.22 112.63 1k5v n HIS 93 Ca 0.02 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.16 1k5v n HIS 93 Cb 0.03 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.14 1k5v n HIS 93 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1k5v s TYR 94 N -2.39 3.24 0.20 4.41 1.51 -1.25 -4.68 117.35 118.39 1k5v s TYR 94 Ca 0.00 1.47 0.09 0.00 -1.01 0.00 0.00 57.07 57.61 1k5v s TYR 94 Cb 0.00 -2.89 -0.05 0.00 -0.11 0.00 0.00 41.96 38.92 1k5v s TYR 94 CO 0.00 -0.80 -0.17 -0.80 -1.11 0.00 0.00 175.55 172.67 1k5v s ASN 95 N -3.11 2.80 0.15 2.29 0.02 0.13 -0.32 114.94 116.89 1k5v s ASN 95 Ca 0.60 -0.97 0.10 0.00 -1.02 0.00 0.00 52.86 51.58 1k5v s ASN 95 Cb -0.13 -0.17 -0.04 0.00 0.02 0.00 0.00 41.25 40.93 1k5v s ASN 95 CO 0.38 -0.09 -0.22 0.42 0.02 0.00 0.00 177.10 177.61 1k5v s THR 96 N -2.58 2.51 -0.34 1.60 -4.23 0.37 -0.67 115.64 112.30 1k5v s THR 96 Ca 0.22 -1.75 0.00 0.00 -1.18 0.00 0.00 61.69 58.98 1k5v s THR 96 Cb -0.03 -2.16 0.11 0.00 1.34 0.00 0.00 72.50 71.76 1k5v s THR 96 CO 0.08 0.02 0.13 -0.31 -0.54 0.00 0.00 174.62 174.00 1k5v s TYR 97 N -1.29 1.96 0.15 3.99 1.51 -1.26 -1.10 117.35 121.32 1k5v s TYR 97 Ca 0.18 -2.02 -0.15 0.00 -1.01 0.00 0.00 57.07 54.06 1k5v s TYR 97 Cb -0.10 -1.87 -0.07 0.00 -0.11 0.00 0.00 41.96 39.82 1k5v s TYR 97 CO 0.09 -0.86 0.58 -1.50 -1.11 0.00 0.00 175.55 172.74 1k5v s ILE 98 N 1.25 4.80 0.06 2.71 2.07 -1.09 -0.60 121.20 130.40 1k5v s ILE 98 Ca 0.12 0.93 -0.30 0.00 -1.41 0.00 0.00 60.65 59.98 1k5v s ILE 98 Cb -0.19 -3.77 -0.08 0.00 0.13 0.00 0.00 42.46 38.55 1k5v s ILE 98 CO -0.17 0.26 1.73 -0.55 -1.91 0.00 0.00 174.94 174.30 1k5v s SER 99 N -1.66 6.56 0.18 4.50 0.15 0.32 -1.31 113.70 122.45 1k5v s SER 99 Ca 0.38 2.53 -0.10 0.00 0.70 0.00 0.00 55.95 59.46 1k5v s SER 99 Cb -0.16 -2.55 0.08 0.00 -1.71 0.00 0.00 66.02 61.68 1k5v s SER 99 CO 0.19 -0.94 1.68 0.50 1.20 0.00 0.00 173.24 175.88 1k5v h LYS 100 N 8.87 1.05 -0.48 5.44 3.64 -1.64 -0.18 116.57 133.28 1k5v h LYS 100 Ca -0.44 -0.27 -0.07 0.00 -1.27 0.00 0.00 60.65 58.60 1k5v h LYS 100 Cb 1.21 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 1k5v h LYS 100 CO 0.94 0.96 0.03 -0.22 -2.27 0.00 0.00 179.45 178.89 1k5v h LYS 101 N 0.97 0.77 -0.34 1.90 3.64 -1.81 -3.20 116.57 118.51 1k5v h LYS 101 Ca 0.20 -0.19 -0.23 0.00 -1.27 0.00 0.00 60.65 59.16 1k5v h LYS 101 Cb 0.41 -0.10 -0.16 0.00 -0.41 0.00 0.00 32.23 31.97 1k5v h LYS 101 CO 0.01 0.76 -0.42 0.72 -2.27 0.00 0.00 179.45 178.25 1k5v n HIS 102 N -4.23 1.18 -0.06 1.91 8.25 -1.16 -4.79 115.22 116.32 1k5v n HIS 102 Ca 0.03 -1.80 0.10 0.00 -0.26 0.00 0.00 57.72 55.79 1k5v n HIS 102 Cb 0.28 -0.39 0.49 0.00 1.12 0.00 0.00 29.99 31.49 1k5v n HIS 102 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1k5v h ALA 103 N 1.37 1.97 -0.10 -1.41 0.00 -1.02 -1.23 119.26 118.84 1k5v h ALA 103 Ca 0.19 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1k5v h ALA 103 Cb 1.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1k5v h ALA 103 CO 0.38 -0.07 -0.11 1.05 0.00 0.00 0.00 179.25 180.49 1k5v h GLU 104 N 0.42 0.15 -0.00 0.00 9.09 -1.86 -1.62 114.58 120.75 1k5v h GLU 104 Ca 0.24 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.62 1k5v h GLU 104 Cb 0.42 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.50 1k5v h GLU 104 CO -0.06 0.28 -0.10 1.63 0.05 0.00 0.00 179.01 180.80 1k5v n LYS 105 N -4.32 0.72 -2.64 1.06 5.02 -0.48 -4.94 118.16 112.58 1k5v n LYS 105 Ca -0.01 -0.24 -0.11 0.00 -2.02 0.00 0.00 58.31 55.93 1k5v n LYS 105 Cb 0.23 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.77 1k5v n LYS 105 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k5v n GLY 106 N 1.27 0.11 3.54 0.72 0.00 -0.61 -4.94 105.19 105.27 1k5v n GLY 106 Ca 0.15 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 1k5v n GLY 106 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1k5v s TRP 107 N -2.85 2.74 0.25 1.61 0.52 -1.22 -4.56 118.94 115.42 1k5v s TRP 107 Ca 0.15 0.12 0.07 0.00 0.02 0.00 0.00 56.10 56.47 1k5v s TRP 107 Cb -0.07 -4.20 -0.04 0.00 -1.15 0.00 0.00 33.47 28.02 1k5v s TRP 107 CO 0.19 -1.41 0.18 -0.06 0.02 0.00 0.00 176.95 175.87 1k5v s PHE 108 N 4.24 3.09 0.12 -1.98 0.40 -1.26 0.12 117.98 122.71 1k5v s PHE 108 Ca 0.34 -0.11 -0.30 0.00 -0.60 0.00 0.00 56.93 56.26 1k5v s PHE 108 Cb -0.11 -1.39 -0.06 0.00 0.51 0.00 0.00 43.02 41.96 1k5v s PHE 108 CO 0.21 0.53 1.01 0.08 0.70 0.00 0.00 175.22 177.75 1k5v s VAL 109 N -2.13 4.33 0.15 -0.44 1.01 0.23 -4.58 120.40 118.97 1k5v s VAL 109 Ca 0.33 1.93 -0.24 0.00 0.00 0.00 0.00 61.98 64.00 1k5v s VAL 109 Cb -0.08 -4.23 0.07 0.00 0.00 0.00 0.00 36.38 32.14 1k5v s VAL 109 CO 0.25 0.30 0.65 -0.83 0.00 0.00 0.00 175.10 175.46 1k5v s GLY 110 N 0.04 -0.56 0.03 4.51 0.00 -1.26 -4.37 107.32 105.70 1k5v s GLY 110 Ca 0.48 0.50 0.06 0.00 0.00 0.00 0.00 44.72 45.76 1k5v s GLY 110 CO 0.31 0.16 -0.18 1.08 0.00 0.00 0.00 173.10 174.48 1k5v s LEU 111 N -2.73 2.14 0.68 0.66 1.43 -0.56 -1.06 118.68 119.23 1k5v s LEU 111 Ca 0.02 -0.45 -0.05 0.00 -1.03 0.00 0.00 54.13 52.62 1k5v s LEU 111 Cb -0.01 -0.84 0.06 0.00 0.03 0.00 0.00 46.19 45.43 1k5v s LEU 111 CO -0.11 0.13 0.97 -0.54 0.23 0.00 0.00 176.35 177.03 1k5v s LYS 112 N -0.99 2.24 0.56 1.70 1.02 0.15 -4.41 119.74 120.00 1k5v s LYS 112 Ca 0.05 -0.39 0.25 0.00 0.02 0.00 0.00 55.97 55.91 1k5v s LYS 112 Cb -0.08 -2.24 1.49 0.00 -0.52 0.00 0.00 37.83 36.48 1k5v s LYS 112 CO 0.01 -1.15 2.06 0.87 -0.92 0.00 0.00 175.35 176.23 1k5v h LYS 113 N -0.47 0.00 -0.64 1.68 1.57 -1.88 -0.74 116.57 116.08 1k5v h LYS 113 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1k5v h LYS 113 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1k5v h LYS 113 CO 0.58 0.00 0.00 0.27 -0.57 0.00 0.00 179.45 179.73 1k5v n ASN 114 N -4.14 3.07 0.00 0.86 0.23 -1.26 -4.53 115.26 109.49 1k5v n ASN 114 Ca 0.04 -2.33 0.00 0.00 -0.53 0.00 0.00 54.58 51.76 1k5v n ASN 114 Cb 0.40 -0.48 0.00 0.00 -2.08 0.00 0.00 39.78 37.61 1k5v n ASN 114 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1k5v n GLY 115 N 0.63 2.93 3.75 4.83 0.00 -0.29 -4.97 105.19 112.07 1k5v n GLY 115 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1k5v n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k5v s SER 116 N -0.53 5.25 0.31 1.61 0.01 -1.26 -1.17 113.70 117.93 1k5v s SER 116 Ca 0.00 2.60 -0.22 0.00 1.31 0.00 0.00 55.95 59.63 1k5v s SER 116 Cb 0.00 -2.62 -0.10 0.00 0.21 0.00 0.00 66.02 63.51 1k5v s SER 116 CO 0.00 -1.57 0.86 0.00 0.41 0.00 0.00 173.24 172.95 1k5v s LYS 118 N -2.34 3.77 0.05 0.00 2.20 -0.22 -4.79 119.74 118.41 1k5v s LYS 118 Ca 0.51 0.60 -0.03 0.00 -0.36 0.00 0.00 55.97 56.69 1k5v s LYS 118 Cb -0.15 -2.28 -0.05 0.00 -1.51 0.00 0.00 37.83 33.84 1k5v s LYS 118 CO 0.20 -0.20 0.25 1.03 -0.36 0.00 0.00 175.35 176.28 1k5v s ARG 119 N -4.21 3.51 0.05 4.03 0.52 -1.26 -4.61 118.95 116.98 1k5v s ARG 119 Ca 0.53 -0.26 -0.11 0.00 -0.52 0.00 0.00 55.73 55.38 1k5v s ARG 119 Cb -0.10 -3.02 -0.03 0.00 0.52 0.00 0.00 34.95 32.32 1k5v s ARG 119 CO 0.36 0.60 1.18 0.78 0.02 0.00 0.00 175.30 178.25 1k5v h GLY 120 N 3.39 -2.02 1.20 -3.53 0.00 -0.81 -0.24 103.07 101.05 1k5v h GLY 120 Ca -0.47 1.01 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1k5v h GLY 120 CO 0.72 -0.65 0.33 -2.55 0.00 0.00 0.00 176.54 174.38 1k5v h PRO 121 N -0.02 0.00 -0.01 4.80 0.11 -1.85 0.56 132.00 135.59 1k5v h PRO 121 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1k5v h PRO 121 Cb 0.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.26 1k5v h PRO 121 CO -0.29 0.00 -0.53 0.54 -0.21 0.00 0.00 178.00 177.51 1k5v n ARG 122 N -2.32 0.80 -3.31 1.05 5.12 -0.12 -4.95 116.66 112.94 1k5v n ARG 122 Ca -0.01 -0.62 -0.31 0.00 -1.93 0.00 0.00 57.85 54.98 1k5v n ARG 122 Cb 0.36 -1.49 -0.04 0.00 -1.16 0.00 0.00 32.46 30.13 1k5v n ARG 122 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1k5v s THR 123 N -2.62 4.93 -0.19 0.55 -4.23 0.20 -4.94 115.64 109.33 1k5v s THR 123 Ca 0.17 0.38 -0.17 0.00 -1.18 0.00 0.00 61.69 60.89 1k5v s THR 123 Cb 0.18 -3.67 0.05 0.00 1.34 0.00 0.00 72.50 70.40 1k5v s THR 123 CO 0.63 -0.21 0.50 -2.28 -0.54 0.00 0.00 174.62 172.71 1k5v s HIS 124 N -1.98 -0.56 -0.05 3.99 2.46 -1.26 -4.83 115.29 113.07 1k5v s HIS 124 Ca 0.47 1.35 -0.35 0.00 0.47 0.00 0.00 55.06 57.00 1k5v s HIS 124 Cb -0.11 0.19 -0.13 0.00 -0.13 0.00 0.00 32.58 32.40 1k5v s HIS 124 CO 0.25 -0.27 1.73 0.98 -2.47 0.00 0.00 174.74 174.96 1k5v n TYR 125 N 2.86 2.19 0.00 3.88 9.36 -1.26 -1.41 117.16 132.78 1k5v n TYR 125 Ca -0.14 0.22 0.00 0.00 3.32 0.00 0.00 57.90 61.30 1k5v n TYR 125 Cb 0.57 -2.57 0.00 0.00 -0.63 0.00 0.00 39.34 36.71 1k5v n TYR 125 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1k5v n GLY 126 N 3.95 0.87 3.80 2.98 0.00 -1.26 -5.09 105.19 110.43 1k5v n GLY 126 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 1k5v n GLY 126 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k5v s GLN 127 N -0.57 3.82 0.45 1.61 -0.21 -0.50 -4.92 119.66 119.35 1k5v s GLN 127 Ca 0.00 1.32 0.23 0.00 0.02 0.00 0.00 55.36 56.94 1k5v s GLN 127 Cb 0.00 -2.10 1.00 0.00 1.00 0.00 0.00 33.01 32.91 1k5v s GLN 127 CO 0.00 -0.41 1.87 0.87 -2.12 0.00 0.00 175.29 175.50 1k5v h LYS 128 N 1.53 0.00 0.00 2.91 1.57 -1.96 -3.00 116.57 117.61 1k5v h LYS 128 Ca -0.49 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.26 1k5v h LYS 128 Cb 1.22 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.52 1k5v h LYS 128 CO 0.59 0.24 -0.13 0.00 -0.57 0.00 0.00 179.45 179.58 1k5v h ALA 129 N 1.76 1.71 -0.35 3.86 0.00 -1.91 -2.89 119.26 121.45 1k5v h ALA 129 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1k5v h ALA 129 Cb 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1k5v h ALA 129 CO 0.03 0.16 0.00 0.44 0.00 0.00 0.00 179.25 179.88 1k5v n ILE 130 N -4.28 0.45 -3.66 0.00 -5.35 -1.13 -1.50 119.36 103.89 1k5v n ILE 130 Ca -0.03 -0.60 -0.37 0.00 -0.27 0.00 0.00 62.75 61.49 1k5v n ILE 130 Cb 0.20 0.61 -0.10 0.00 -1.74 0.00 0.00 39.64 38.62 1k5v n ILE 130 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1k5v s LEU 131 N -1.39 4.07 -0.05 7.28 1.43 -1.10 -4.27 118.68 124.65 1k5v s LEU 131 Ca 0.36 0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.56 1k5v s LEU 131 Cb 0.20 -2.10 0.01 0.00 0.03 0.00 0.00 46.19 44.32 1k5v s LEU 131 CO 0.28 0.04 -0.14 -0.36 0.23 0.00 0.00 176.35 176.40 1k5v s PHE 132 N 1.19 1.52 -0.29 0.29 0.40 0.16 -1.95 117.98 119.30 1k5v s PHE 132 Ca 0.07 -0.50 -0.09 0.00 -0.60 0.00 0.00 56.93 55.81 1k5v s PHE 132 Cb -0.14 -1.07 -0.02 0.00 0.51 0.00 0.00 43.02 42.30 1k5v s PHE 132 CO 0.06 -0.22 0.14 -1.17 0.70 0.00 0.00 175.22 174.73 1k5v s LEU 133 N 0.36 3.95 -0.14 -0.37 2.96 -0.19 0.22 118.68 125.47 1k5v s LEU 133 Ca -0.09 -0.40 -0.29 0.00 -0.22 0.00 0.00 54.13 53.13 1k5v s LEU 133 Cb -0.13 -2.00 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 1k5v s LEU 133 CO 0.03 -0.14 1.24 -2.84 -1.32 0.00 0.00 176.35 173.31 1k5v s PRO 134 N 1.63 4.26 0.16 0.98 0.02 -1.26 -0.91 135.00 139.89 1k5v s PRO 134 Ca 0.05 1.65 0.10 0.00 0.02 0.00 0.00 61.00 62.82 1k5v s PRO 134 Cb -0.16 -3.71 -0.04 0.00 0.02 0.00 0.00 34.50 30.61 1k5v s PRO 134 CO 0.06 -0.64 -0.19 -0.51 -0.33 0.00 0.00 177.00 175.40 1k5v s LEU 135 N 3.16 2.64 0.77 -5.54 1.43 0.42 -4.90 118.68 116.67 1k5v s LEU 135 Ca 0.54 -0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 1k5v s LEU 135 Cb -0.22 -1.41 0.06 0.00 0.03 0.00 0.00 46.19 44.65 1k5v s LEU 135 CO 0.16 0.14 1.13 -2.84 0.23 0.00 0.00 176.35 175.16 1k5v s PRO 136 N -2.50 2.06 0.00 1.29 0.01 -1.26 0.20 135.00 134.80 1k5v s PRO 136 Ca 0.20 1.40 0.22 0.00 0.01 0.00 0.00 61.00 62.83 1k5v s PRO 136 Cb -0.09 -1.86 0.18 0.00 0.01 0.00 0.00 34.50 32.74 1k5v s PRO 136 CO 0.11 -1.82 1.20 0.28 0.01 0.00 0.00 177.00 176.78