#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kt8 n GLU 2 N 0.00 -1.71 -4.42 0.00 4.71 -1.26 -3.95 120.64 114.01 2kt8 n GLU 2 Ca 0.00 1.57 -0.27 0.00 -0.01 0.00 0.00 57.16 58.45 2kt8 n GLU 2 Cb 0.00 -1.73 -0.11 0.00 -1.01 0.00 0.00 31.44 28.58 2kt8 n GLU 2 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 2kt8 s LYS 3 N -0.39 1.57 -0.09 3.49 1.02 -1.09 -2.22 119.74 122.03 2kt8 s LYS 3 Ca -0.05 -1.54 0.01 0.00 0.02 0.00 0.00 55.97 54.41 2kt8 s LYS 3 Cb 0.00 -1.86 0.02 0.00 -0.52 0.00 0.00 37.83 35.47 2kt8 s LYS 3 CO 0.16 0.39 -0.11 0.95 -0.92 0.00 0.00 175.35 175.83 2kt8 s THR 4 N -1.78 1.16 -0.14 2.17 -4.23 -1.13 0.47 115.64 112.16 2kt8 s THR 4 Ca 0.22 -0.43 -0.08 0.00 -1.18 0.00 0.00 61.69 60.22 2kt8 s THR 4 Cb -0.08 -1.10 -0.04 0.00 1.34 0.00 0.00 72.50 72.62 2kt8 s THR 4 CO 0.11 0.38 0.14 -0.83 -0.54 0.00 0.00 174.62 173.87 2kt8 s GLY 5 N 1.18 2.13 -0.28 3.99 0.00 -0.88 -2.51 107.32 110.95 2kt8 s GLY 5 Ca -0.04 -0.65 -0.17 0.00 0.00 0.00 0.00 44.72 43.86 2kt8 s GLY 5 CO -0.03 -0.23 0.46 -0.42 0.00 0.00 0.00 173.10 172.88 2kt8 s ILE 6 N -0.65 5.10 0.09 0.90 1.09 -1.03 -2.61 121.20 124.09 2kt8 s ILE 6 Ca 0.13 0.66 -0.30 0.00 -1.10 0.00 0.00 60.65 60.05 2kt8 s ILE 6 Cb -0.12 -3.80 -0.05 0.00 -1.06 0.00 0.00 42.46 37.43 2kt8 s ILE 6 CO 0.02 0.07 1.00 -0.69 -0.10 0.00 0.00 174.94 175.24 2kt8 s VAL 7 N 2.22 4.49 -0.21 2.92 1.01 -0.99 -2.51 120.40 127.34 2kt8 s VAL 7 Ca 0.18 1.97 -0.05 0.00 0.00 0.00 0.00 61.98 64.09 2kt8 s VAL 7 Cb -0.16 -4.26 0.07 0.00 0.00 0.00 0.00 36.38 32.03 2kt8 s VAL 7 CO 0.10 0.26 0.11 0.21 0.00 0.00 0.00 175.10 175.78 2kt8 s ASN 8 N 0.33 2.63 0.04 3.32 2.47 -0.89 -0.83 114.94 122.01 2kt8 s ASN 8 Ca 0.49 -0.79 0.01 0.00 0.42 0.00 0.00 52.86 52.99 2kt8 s ASN 8 Cb -0.24 -0.23 -0.02 0.00 -1.45 0.00 0.00 41.25 39.31 2kt8 s ASN 8 CO 0.30 -0.38 -0.05 0.68 -3.72 0.00 0.00 177.10 173.93 2kt8 s VAL 9 N 2.14 0.31 0.07 -5.21 -7.23 -1.26 -4.79 120.40 104.43 2kt8 s VAL 9 Ca 0.04 -1.13 -0.16 0.00 -1.81 0.00 0.00 61.98 58.92 2kt8 s VAL 9 Cb -0.16 -0.61 -0.15 0.00 0.56 0.00 0.00 36.38 36.03 2kt8 s VAL 9 CO -0.18 -0.53 1.30 0.28 -0.31 0.00 0.00 175.10 175.66 2kt8 h SER 10 N 4.33 0.69 0.00 4.85 0.02 -2.02 -3.43 113.55 117.99 2kt8 h SER 10 Ca -0.34 -0.59 0.00 0.00 -0.84 0.00 0.00 61.79 60.03 2kt8 h SER 10 Cb 1.20 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.54 2kt8 h SER 10 CO 0.45 1.16 0.00 -1.20 -1.14 0.00 0.00 176.83 176.10 2kt8 n SER 11 N -4.21 0.00 -3.78 3.07 7.64 -1.26 -5.04 113.62 110.03 2kt8 n SER 11 Ca -0.07 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.73 2kt8 n SER 11 Cb 0.57 -0.13 -0.02 0.00 -1.01 0.00 0.00 64.21 63.62 2kt8 n SER 11 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2kt8 s SER 12 N -1.81 -0.31 -0.12 6.43 0.15 -1.26 -4.62 113.70 112.16 2kt8 s SER 12 Ca 0.00 -0.50 0.02 0.00 0.70 0.00 0.00 55.95 56.16 2kt8 s SER 12 Cb 0.00 0.71 -0.01 0.00 -1.71 0.00 0.00 66.02 65.01 2kt8 s SER 12 CO 0.00 -1.28 -0.18 -0.22 1.20 0.00 0.00 173.24 172.76 2kt8 s LEU 13 N -2.89 2.45 0.00 3.45 2.96 -0.94 -4.94 118.68 118.78 2kt8 s LEU 13 Ca 0.09 -0.42 -0.17 0.00 -0.22 0.00 0.00 54.13 53.41 2kt8 s LEU 13 Cb -0.05 -1.53 -0.06 0.00 0.50 0.00 0.00 46.19 45.06 2kt8 s LEU 13 CO 0.04 0.17 0.46 0.20 -1.32 0.00 0.00 176.35 175.90 2kt8 s ASN 14 N 0.32 6.86 -0.09 3.68 0.01 -1.26 0.11 114.94 124.56 2kt8 s ASN 14 Ca -0.14 1.03 -0.21 0.00 -0.71 0.00 0.00 52.86 52.83 2kt8 s ASN 14 Cb -0.17 -2.29 -0.04 0.00 0.41 0.00 0.00 41.25 39.17 2kt8 s ASN 14 CO 0.07 0.26 0.58 -0.69 -1.51 0.00 0.00 177.10 175.81 2kt8 s VAL 15 N -0.81 5.13 -0.15 1.60 1.01 -0.46 -4.90 120.40 121.81 2kt8 s VAL 15 Ca 0.26 1.17 -0.04 0.00 0.00 0.00 0.00 61.98 63.37 2kt8 s VAL 15 Cb -0.17 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2kt8 s VAL 15 CO 0.14 0.29 -0.01 -0.13 0.00 0.00 0.00 175.10 175.40 2kt8 s ARG 16 N 0.70 3.66 0.12 2.72 1.81 -0.91 -2.55 118.95 124.50 2kt8 s ARG 16 Ca 0.31 -0.47 -0.12 0.00 -1.72 0.00 0.00 55.73 53.73 2kt8 s ARG 16 Cb -0.16 -2.96 -0.09 0.00 -0.45 0.00 0.00 34.95 31.28 2kt8 s ARG 16 CO 0.14 0.30 1.40 1.49 -0.68 0.00 0.00 175.30 177.96 2kt8 h GLU 17 N 6.51 0.88 -6.99 3.54 4.57 -1.71 0.50 114.58 121.88 2kt8 h GLU 17 Ca -0.35 -0.55 -0.47 0.00 -1.18 0.00 0.00 59.36 56.81 2kt8 h GLU 17 Cb 1.18 0.06 0.07 0.00 -0.16 0.00 0.00 28.75 29.91 2kt8 h GLU 17 CO 0.64 1.19 0.05 0.20 -1.18 0.00 0.00 179.01 179.90 2kt8 s GLY 18 N -3.94 1.76 -0.24 1.92 0.00 -1.26 -4.62 107.32 100.94 2kt8 s GLY 18 Ca -0.11 -1.77 -0.01 0.00 0.00 0.00 0.00 44.72 42.83 2kt8 s GLY 18 CO 0.89 -1.26 1.98 0.00 0.00 0.00 0.00 173.10 174.71 2kt8 n ALA 19 N -2.66 4.80 -3.10 3.20 0.00 -1.26 -4.59 120.51 116.90 2kt8 n ALA 19 Ca 0.14 -1.27 -0.12 0.00 0.00 0.00 0.00 53.44 52.20 2kt8 n ALA 19 Cb 0.61 -1.28 -0.07 0.00 0.00 0.00 0.00 19.45 18.71 2kt8 n ALA 19 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2kt8 s SER 20 N 0.57 -0.22 0.34 0.00 1.04 -1.26 -4.96 113.70 109.21 2kt8 s SER 20 Ca 0.24 -0.08 0.15 0.00 0.48 0.00 0.00 55.95 56.74 2kt8 s SER 20 Cb 0.19 0.40 0.60 0.00 0.10 0.00 0.00 66.02 67.30 2kt8 s SER 20 CO -0.00 -0.65 1.72 0.71 0.98 0.00 0.00 173.24 176.00 2kt8 h THR 21 N 3.08 1.13 -0.00 2.02 1.35 -1.98 -2.23 112.91 116.28 2kt8 h THR 21 Ca -0.31 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 63.88 2kt8 h THR 21 Cb 1.20 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 69.57 2kt8 h THR 21 CO 0.44 0.44 -0.04 -1.54 -0.25 0.00 0.00 175.52 174.58 2kt8 n SER 22 N -3.72 0.27 0.00 5.36 3.41 -1.26 -4.53 113.62 113.15 2kt8 n SER 22 Ca -0.01 -0.58 0.00 0.00 -0.26 0.00 0.00 58.87 58.02 2kt8 n SER 22 Cb 0.52 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 2kt8 n SER 22 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2kt8 n SER 23 N -1.01 0.00 -3.64 4.04 2.88 -0.84 -4.97 113.62 110.08 2kt8 n SER 23 Ca 0.17 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.68 2kt8 n SER 23 Cb 0.23 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.63 2kt8 n SER 23 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2kt8 s LYS 24 N 0.00 0.39 0.03 -1.46 2.20 -1.26 -4.92 119.74 114.72 2kt8 s LYS 24 Ca 0.00 0.64 -0.28 0.00 -0.36 0.00 0.00 55.97 55.96 2kt8 s LYS 24 Cb 0.00 0.10 -0.04 0.00 -1.51 0.00 0.00 37.83 36.37 2kt8 s LYS 24 CO 0.00 -0.08 0.90 0.08 -0.36 0.00 0.00 175.35 175.90 2kt8 s VAL 25 N 1.16 4.76 -0.12 4.02 1.01 -1.26 -2.12 120.40 127.85 2kt8 s VAL 25 Ca -0.07 1.91 0.03 0.00 0.00 0.00 0.00 61.98 63.84 2kt8 s VAL 25 Cb -0.04 -4.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 2kt8 s VAL 25 CO -0.14 0.25 0.11 2.30 0.00 0.00 0.00 175.10 177.62 2kt8 n ILE 26 N 3.36 0.00 -1.70 2.22 -5.35 -1.06 -4.99 119.36 111.84 2kt8 n ILE 26 Ca 0.02 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 62.08 2kt8 n ILE 26 Cb 0.50 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.39 2kt8 n ILE 26 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2kt8 n GLY 27 N 1.10 -1.58 3.18 3.28 0.00 -1.26 -5.02 105.19 104.89 2kt8 n GLY 27 Ca 0.00 -1.06 -0.14 0.00 0.00 0.00 0.00 46.02 44.82 2kt8 n GLY 27 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kt8 s SER 28 N -2.00 1.47 0.09 1.61 0.01 -1.26 -1.35 113.70 112.27 2kt8 s SER 28 Ca 0.00 -0.85 0.09 0.00 1.31 0.00 0.00 55.95 56.50 2kt8 s SER 28 Cb 0.00 0.01 -0.03 0.00 0.21 0.00 0.00 66.02 66.21 2kt8 s SER 28 CO 0.00 -0.28 -0.23 -0.76 0.41 0.00 0.00 173.24 172.37 2kt8 s LEU 29 N -2.57 2.25 0.65 2.44 1.43 0.12 -4.93 118.68 118.07 2kt8 s LEU 29 Ca 0.07 -0.65 -0.13 0.00 -1.03 0.00 0.00 54.13 52.40 2kt8 s LEU 29 Cb -0.02 -1.05 -0.01 0.00 0.03 0.00 0.00 46.19 45.14 2kt8 s LEU 29 CO -0.00 0.14 1.06 -0.55 0.23 0.00 0.00 176.35 177.23 2kt8 s SER 30 N -1.67 5.55 0.74 2.29 0.15 -1.26 -2.22 113.70 117.28 2kt8 s SER 30 Ca 0.09 1.69 -0.13 0.00 0.70 0.00 0.00 55.95 58.30 2kt8 s SER 30 Cb -0.10 -2.51 0.04 0.00 -1.71 0.00 0.00 66.02 61.74 2kt8 s SER 30 CO 0.04 -1.32 1.14 -0.83 1.20 0.00 0.00 173.24 173.46 2kt8 s GLY 31 N -3.39 2.04 -1.52 9.45 0.00 -1.26 -3.15 107.32 109.48 2kt8 s GLY 31 Ca 0.60 0.58 -0.03 0.00 0.00 0.00 0.00 44.72 45.87 2kt8 s GLY 31 CO 0.48 0.95 0.34 0.70 0.00 0.00 0.00 173.10 175.57 2kt8 n ASN 32 N -2.98 -5.46 -4.67 1.64 5.03 -0.01 -4.94 115.26 103.88 2kt8 n ASN 32 Ca 0.11 -0.16 -0.38 0.00 0.87 0.00 0.00 54.58 55.02 2kt8 n ASN 32 Cb 0.52 -4.48 -0.08 0.00 -1.02 0.00 0.00 39.78 34.72 2kt8 n ASN 32 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2kt8 s THR 33 N -3.03 5.20 0.06 3.41 2.01 -1.19 -4.83 115.64 117.26 2kt8 s THR 33 Ca 0.19 0.70 -0.30 0.00 0.31 0.00 0.00 61.69 62.59 2kt8 s THR 33 Cb -0.09 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 2kt8 s THR 33 CO 0.24 0.25 1.00 -0.75 -0.69 0.00 0.00 174.62 174.66 2kt8 s LYS 34 N 1.34 4.60 -0.04 4.92 2.20 -1.26 -2.35 119.74 129.15 2kt8 s LYS 34 Ca 0.19 1.48 0.03 0.00 -0.36 0.00 0.00 55.97 57.31 2kt8 s LYS 34 Cb -0.15 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.77 2kt8 s LYS 34 CO 0.08 0.04 -0.12 0.14 -0.36 0.00 0.00 175.35 175.13 2kt8 s VAL 35 N 0.55 1.06 -0.04 4.02 -7.23 -1.07 -5.01 120.40 112.67 2kt8 s VAL 35 Ca 0.50 -0.49 -0.30 0.00 -1.81 0.00 0.00 61.98 59.88 2kt8 s VAL 35 Cb -0.23 -0.94 -0.02 0.00 0.56 0.00 0.00 36.38 35.74 2kt8 s VAL 35 CO 0.29 0.32 1.03 -0.89 -0.31 0.00 0.00 175.10 175.55 2kt8 s THR 36 N 0.27 4.71 -0.23 5.32 2.01 -1.26 -2.07 115.64 124.39 2kt8 s THR 36 Ca -0.06 1.96 -0.09 0.00 0.31 0.00 0.00 61.69 63.81 2kt8 s THR 36 Cb -0.11 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 2kt8 s THR 36 CO 0.02 0.08 0.11 -0.63 -0.69 0.00 0.00 174.62 173.51 2kt8 s ILE 37 N 1.55 4.90 -1.17 1.82 1.01 0.18 -2.69 121.20 126.79 2kt8 s ILE 37 Ca 0.51 0.02 0.10 0.00 0.00 0.00 0.00 60.65 61.28 2kt8 s ILE 37 Cb -0.21 -3.27 0.06 0.00 0.01 0.00 0.00 42.46 39.05 2kt8 s ILE 37 CO 0.23 0.36 0.78 1.33 0.00 0.00 0.00 174.94 177.64 2kt8 n VAL 38 N 4.38 0.00 -3.85 2.92 0.24 -1.08 -2.67 118.33 118.26 2kt8 n VAL 38 Ca -0.16 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 2kt8 n VAL 38 Cb 0.52 1.19 0.01 0.00 -1.47 0.00 0.00 33.84 34.09 2kt8 n VAL 38 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2kt8 s GLY 39 N -0.90 -0.14 0.04 7.63 0.00 -1.24 -5.00 107.32 107.72 2kt8 s GLY 39 Ca 0.11 0.10 -0.06 0.00 0.00 0.00 0.00 44.72 44.87 2kt8 s GLY 39 CO 0.14 2.96 0.10 -1.83 0.00 0.00 0.00 173.10 174.48 2kt8 s GLU 40 N -2.26 0.61 -0.27 2.90 -1.05 -1.26 -1.63 118.70 115.74 2kt8 s GLU 40 Ca 0.22 -0.77 -0.01 0.00 -0.15 0.00 0.00 54.97 54.26 2kt8 s GLU 40 Cb 0.00 0.24 0.15 0.00 -0.44 0.00 0.00 34.13 34.08 2kt8 s GLU 40 CO 0.00 -0.15 0.43 -2.00 0.95 0.00 0.00 175.26 174.49 2kt8 s GLU 41 N -2.72 0.41 6.78 -4.83 2.12 -0.50 -4.87 118.70 115.09 2kt8 s GLU 41 Ca -0.04 0.52 0.00 0.00 0.36 0.00 0.00 54.97 55.81 2kt8 s GLU 41 Cb -0.00 -0.24 0.00 0.00 0.26 0.00 0.00 34.13 34.15 2kt8 s GLU 41 CO -0.05 -0.75 0.00 0.41 -0.54 0.00 0.00 175.26 174.33 2kt8 n GLY 42 N 5.37 3.22 1.43 -1.50 0.00 -1.26 -1.75 105.19 110.71 2kt8 n GLY 42 Ca -0.02 -0.26 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 2kt8 n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kt8 n ALA 43 N 10.19 3.66 -2.85 4.61 0.00 -1.26 -4.84 120.51 130.03 2kt8 n ALA 43 Ca 0.00 -1.13 -0.13 0.00 0.00 0.00 0.00 53.44 52.18 2kt8 n ALA 43 Cb 0.00 -1.16 -0.11 0.00 0.00 0.00 0.00 19.45 18.17 2kt8 n ALA 43 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2kt8 s PHE 44 N -1.43 0.66 0.02 0.00 0.40 -0.71 -2.36 117.98 114.56 2kt8 s PHE 44 Ca 0.23 -0.51 0.02 0.00 -0.60 0.00 0.00 56.93 56.07 2kt8 s PHE 44 Cb 0.19 -0.40 -0.04 0.00 0.51 0.00 0.00 43.02 43.29 2kt8 s PHE 44 CO 0.05 -0.09 0.02 0.71 0.70 0.00 0.00 175.22 176.61 2kt8 s TYR 45 N -1.44 3.11 -0.23 0.36 2.02 -0.58 -1.41 117.35 119.17 2kt8 s TYR 45 Ca -0.10 0.09 -0.12 0.00 -0.37 0.00 0.00 57.07 56.57 2kt8 s TYR 45 Cb -0.10 -1.66 -0.05 0.00 -0.40 0.00 0.00 41.96 39.76 2kt8 s TYR 45 CO 0.00 0.48 0.22 0.21 -1.57 0.00 0.00 175.55 174.89 2kt8 s LYS 46 N -1.77 4.09 0.15 -0.62 2.20 -0.65 -2.54 119.74 120.59 2kt8 s LYS 46 Ca 0.22 -0.16 0.06 0.00 -0.36 0.00 0.00 55.97 55.72 2kt8 s LYS 46 Cb -0.12 -3.55 -0.04 0.00 -1.51 0.00 0.00 37.83 32.62 2kt8 s LYS 46 CO 0.13 0.02 -0.13 0.96 -0.36 0.00 0.00 175.35 175.98 2kt8 s ILE 47 N 1.16 1.34 -0.63 5.43 -4.36 -0.55 -2.65 121.20 120.95 2kt8 s ILE 47 Ca 0.10 -1.95 -0.23 0.00 -0.26 0.00 0.00 60.65 58.31 2kt8 s ILE 47 Cb -0.14 -1.75 0.06 0.00 1.25 0.00 0.00 42.46 41.88 2kt8 s ILE 47 CO 0.06 -0.58 0.96 -0.70 0.24 0.00 0.00 174.94 174.91 2kt8 s GLU 48 N -3.28 3.17 -0.25 0.37 2.12 -1.10 -0.83 118.70 118.91 2kt8 s GLU 48 Ca 0.15 -0.66 -0.05 0.00 0.36 0.00 0.00 54.97 54.77 2kt8 s GLU 48 Cb -0.01 -4.17 -0.01 0.00 0.26 0.00 0.00 34.13 30.20 2kt8 s GLU 48 CO 0.03 -1.72 0.01 -0.47 -0.54 0.00 0.00 175.26 172.57 2kt8 s TYR 49 N 4.05 3.04 -1.03 5.30 5.04 0.17 -4.53 117.35 129.38 2kt8 s TYR 49 Ca 0.25 -0.85 0.00 0.00 -2.44 0.00 0.00 57.07 54.03 2kt8 s TYR 49 Cb -0.15 -2.17 0.00 0.00 0.35 0.00 0.00 41.96 39.99 2kt8 s TYR 49 CO 0.13 -0.51 0.00 1.63 -1.34 0.00 0.00 175.55 175.45 2kt8 n LYS 50 N 4.84 -2.23 0.00 4.97 4.76 -1.26 0.64 118.16 129.88 2kt8 n LYS 50 Ca -0.17 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 55.86 2kt8 n LYS 50 Cb 0.50 -5.18 0.00 0.00 -1.84 0.00 0.00 35.03 28.52 2kt8 n LYS 50 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2kt8 n GLY 51 N -0.79 3.10 3.92 0.72 0.00 -1.26 -5.02 105.19 105.86 2kt8 n GLY 51 Ca -0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 2kt8 n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kt8 s SER 52 N -0.47 5.52 -0.57 1.61 0.01 0.21 -5.00 113.70 115.01 2kt8 s SER 52 Ca 0.00 0.66 -0.19 0.00 1.31 0.00 0.00 55.95 57.73 2kt8 s SER 52 Cb 0.00 -1.63 0.09 0.00 0.21 0.00 0.00 66.02 64.69 2kt8 s SER 52 CO 0.00 -1.10 0.68 -1.00 0.41 0.00 0.00 173.24 172.23 2kt8 s HIS 53 N -3.00 3.01 0.22 2.43 3.76 -1.26 0.43 115.29 120.88 2kt8 s HIS 53 Ca 0.54 -0.83 -0.13 0.00 -0.15 0.00 0.00 55.06 54.49 2kt8 s HIS 53 Cb -0.11 -3.88 -0.08 0.00 1.11 0.00 0.00 32.58 29.63 2kt8 s HIS 53 CO 0.45 -1.22 0.61 0.20 -0.85 0.00 0.00 174.74 173.92 2kt8 s GLY 54 N 3.36 2.38 -0.09 -2.22 0.00 -0.01 -4.86 107.32 105.88 2kt8 s GLY 54 Ca 0.13 -0.12 0.02 0.00 0.00 0.00 0.00 44.72 44.75 2kt8 s GLY 54 CO 0.08 0.10 -0.16 -0.19 0.00 0.00 0.00 173.10 172.92 2kt8 s TYR 55 N -1.72 2.70 -0.01 1.90 1.51 0.17 -1.48 117.35 120.42 2kt8 s TYR 55 Ca 0.45 -0.53 0.02 0.00 -1.01 0.00 0.00 57.07 56.00 2kt8 s TYR 55 Cb -0.13 -1.72 -0.00 0.00 -0.11 0.00 0.00 41.96 40.00 2kt8 s TYR 55 CO 0.20 -0.10 -0.05 0.14 -1.11 0.00 0.00 175.55 174.63 2kt8 s VAL 56 N -0.08 0.39 0.48 0.71 -7.23 -1.05 -2.15 120.40 111.47 2kt8 s VAL 56 Ca -0.03 -0.21 -0.24 0.00 -1.81 0.00 0.00 61.98 59.70 2kt8 s VAL 56 Cb -0.14 -0.34 -0.07 0.00 0.56 0.00 0.00 36.38 36.39 2kt8 s VAL 56 CO 0.04 0.11 1.35 0.00 -0.31 0.00 0.00 175.10 176.29 2kt8 s ALA 57 N -0.07 3.03 0.28 1.32 0.00 -1.26 -1.53 121.76 123.53 2kt8 s ALA 57 Ca 0.01 1.31 -0.01 0.00 0.00 0.00 0.00 51.96 53.28 2kt8 s ALA 57 Cb -0.02 -3.54 0.41 0.00 0.00 0.00 0.00 23.12 19.97 2kt8 s ALA 57 CO -0.00 -1.15 1.83 0.87 0.00 0.00 0.00 175.76 177.31 2kt8 h LYS 58 N 1.98 0.81 0.00 0.00 1.57 -1.77 -2.66 116.57 116.51 2kt8 h LYS 58 Ca -0.50 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.11 2kt8 h LYS 58 Cb 1.27 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2kt8 h LYS 58 CO 0.60 0.73 0.54 0.93 -0.57 0.00 0.00 179.45 181.68 2kt8 h GLU 59 N 0.78 0.00 0.00 3.15 5.08 -1.91 0.44 114.58 122.13 2kt8 h GLU 59 Ca 0.17 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.32 2kt8 h GLU 59 Cb 0.29 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 2kt8 h GLU 59 CO -0.00 0.00 -1.81 0.66 -1.00 0.00 0.00 179.01 176.86 2kt8 n TYR 60 N -2.14 0.00 -3.33 4.33 4.01 -1.01 -4.93 117.16 114.10 2kt8 n TYR 60 Ca -0.01 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.34 2kt8 n TYR 60 Cb 0.55 -0.58 -0.08 0.00 -0.31 0.00 0.00 39.34 38.93 2kt8 n TYR 60 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2kt8 s ILE 61 N -2.29 5.15 0.30 -0.72 1.09 0.16 -2.10 121.20 122.78 2kt8 s ILE 61 Ca -0.07 0.78 -0.06 0.00 -1.10 0.00 0.00 60.65 60.20 2kt8 s ILE 61 Cb 0.04 -3.77 -0.00 0.00 -1.06 0.00 0.00 42.46 37.66 2kt8 s ILE 61 CO 0.47 0.19 0.45 -1.59 -0.10 0.00 0.00 174.94 174.36 2kt8 s LYS 62 N 1.69 1.72 -1.21 2.79 -2.85 -1.04 -4.76 119.74 116.08 2kt8 s LYS 62 Ca 0.20 -1.57 -0.01 0.00 -1.00 0.00 0.00 55.97 53.59 2kt8 s LYS 62 Cb -0.15 0.44 -0.01 0.00 -2.06 0.00 0.00 37.83 36.05 2kt8 s LYS 62 CO 0.09 -0.71 0.90 -0.25 0.10 0.00 0.00 175.35 175.49 2kt8 n ASP 63 N -0.94 -2.35 -4.73 0.03 8.00 -1.26 -2.45 116.55 112.84 2kt8 n ASP 63 Ca -0.00 -0.69 -0.41 0.00 0.71 0.00 0.00 54.79 54.39 2kt8 n ASP 63 Cb 0.62 -4.81 -0.03 0.00 -0.02 0.00 0.00 41.12 36.88 2kt8 n ASP 63 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2kt8 s ILE 64 N -3.45 3.43 -0.12 0.53 1.01 -1.26 -4.43 121.20 116.91 2kt8 s ILE 64 Ca 0.06 1.15 -0.00 0.00 0.00 0.00 0.00 60.65 61.86 2kt8 s ILE 64 Cb -0.01 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.71 2kt8 s ILE 64 CO 0.76 0.16 -0.11 -0.75 0.00 0.00 0.00 174.94 174.99 2kt8 s LYS 65 N 0.14 3.26 -0.29 2.79 2.20 -1.05 -4.95 119.74 121.84 2kt8 s LYS 65 Ca 0.57 -0.64 -0.24 0.00 -0.36 0.00 0.00 55.97 55.29 2kt8 s LYS 65 Cb -0.34 -2.64 0.00 0.00 -1.51 0.00 0.00 37.83 33.33 2kt8 s LYS 65 CO 0.36 0.32 0.81 -0.51 -0.36 0.00 0.00 175.35 175.97 2kt8 s ASP 66 N 0.10 6.71 0.30 1.43 1.01 -1.26 -2.84 116.67 122.12 2kt8 s ASP 66 Ca -0.05 0.76 -0.30 0.00 0.71 0.00 0.00 52.55 53.67 2kt8 s ASP 66 Cb -0.14 -2.42 -0.11 0.00 1.01 0.00 0.00 42.92 41.25 2kt8 s ASP 66 CO 0.04 -0.61 1.59 -1.61 0.21 0.00 0.00 175.17 174.79 2kt8 s GLU 67 N 2.98 4.11 -0.23 8.23 0.41 -0.94 -4.97 118.70 128.28 2kt8 s GLU 67 Ca 0.34 2.59 -0.11 0.00 -0.41 0.00 0.00 54.97 57.38 2kt8 s GLU 67 Cb -0.14 -3.01 -0.05 0.00 -1.78 0.00 0.00 34.13 29.15 2kt8 s GLU 67 CO 0.12 -0.63 0.18 0.54 -0.49 0.00 0.00 175.26 174.98 2kt8 s VAL 68 N -0.14 5.35 -1.80 2.63 0.11 -1.26 -4.94 120.40 120.35 2kt8 s VAL 68 Ca 0.62 0.23 0.25 0.00 -2.93 0.00 0.00 61.98 60.15 2kt8 s VAL 68 Cb -0.48 -3.52 0.16 0.00 -1.53 0.00 0.00 36.38 31.02 2kt8 s VAL 68 CO 0.50 0.34 1.40 0.18 -3.33 0.00 0.00 175.10 174.20 2kt8 n LEU 69 N 4.24 1.31 -4.74 2.54 4.77 -1.26 -4.93 117.00 118.93 2kt8 n LEU 69 Ca -0.14 -0.41 -0.42 0.00 -0.03 0.00 0.00 56.01 55.01 2kt8 n LEU 69 Cb 0.52 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.51 2kt8 n LEU 69 CO 0.36 0.25 1.20 -0.62 -1.33 0.00 0.00 177.39 177.25 2kt8 n GLU 70 N -0.51 2.64 -0.18 3.23 1.02 -1.26 -4.89 120.64 120.69 2kt8 n GLU 70 Ca 0.11 0.94 -0.10 0.00 -0.02 0.00 0.00 57.16 58.08 2kt8 n GLU 70 Cb 0.38 -2.70 0.01 0.00 -0.02 0.00 0.00 31.44 29.11 2kt8 n GLU 70 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2kt8 h HIS 71 N 4.39 1.12 -3.99 -0.32 -0.00 -2.06 -3.43 115.15 110.86 2kt8 h HIS 71 Ca -0.47 -0.23 -0.51 0.00 -0.00 0.00 0.00 60.37 59.15 2kt8 h HIS 71 Cb 1.23 -0.28 0.07 0.00 -0.00 0.00 0.00 27.41 28.44 2kt8 h HIS 71 CO 0.57 1.05 0.52 -1.01 -0.00 0.00 0.00 177.93 179.06 2kt8 s HIS 72 N -4.85 2.83 0.20 5.26 3.76 -1.26 -5.04 115.29 116.18 2kt8 s HIS 72 Ca -0.12 1.50 0.03 0.00 -0.15 0.00 0.00 55.06 56.32 2kt8 s HIS 72 Cb 0.13 -3.47 -0.05 0.00 1.11 0.00 0.00 32.58 30.30 2kt8 s HIS 72 CO 0.86 -1.71 -0.01 -1.58 -0.85 0.00 0.00 174.74 171.45 2kt8 s HIS 73 N -1.46 1.37 0.00 1.40 2.46 -1.26 -5.08 115.29 112.72 2kt8 s HIS 73 Ca 0.63 -0.95 0.00 0.00 0.47 0.00 0.00 55.06 55.20 2kt8 s HIS 73 Cb -0.32 -0.78 0.00 0.00 -0.13 0.00 0.00 32.58 31.36 2kt8 s HIS 73 CO 0.39 -0.11 0.00 -2.39 -2.47 0.00 0.00 174.74 170.16 2kt8 n HIS 74 N -0.31 -0.08 -3.99 3.88 1.44 -1.26 -4.82 115.22 110.08 2kt8 n HIS 74 Ca -0.06 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.54 2kt8 n HIS 74 Cb 0.63 0.02 -0.12 0.00 0.12 0.00 0.00 29.99 30.64 2kt8 n HIS 74 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2kt8 s HIS 75 N 0.00 0.32 0.00 -1.40 0.09 -1.26 -5.25 115.29 107.79 2kt8 s HIS 75 Ca 0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 55.06 54.65 2kt8 s HIS 75 Cb 0.00 -0.21 0.00 0.00 -0.00 0.00 0.00 32.58 32.37 2kt8 s HIS 75 CO 0.00 -0.12 0.00 1.58 -0.00 0.00 0.00 174.74 176.20