#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kt8 s GLU 2 N 0.00 4.45 0.05 0.00 2.02 -1.26 -4.53 118.70 119.44 2kt8 s GLU 2 Ca 0.00 1.36 -0.05 0.00 0.02 0.00 0.00 54.97 56.30 2kt8 s GLU 2 Cb 0.00 -3.52 -0.02 0.00 0.10 0.00 0.00 34.13 30.69 2kt8 s GLU 2 CO 0.00 -0.23 0.07 0.15 0.02 0.00 0.00 175.26 175.27 2kt8 s LYS 3 N 1.71 0.65 -0.13 1.61 1.02 -1.07 -3.61 119.74 119.92 2kt8 s LYS 3 Ca 0.48 -0.96 0.02 0.00 0.02 0.00 0.00 55.97 55.54 2kt8 s LYS 3 Cb -0.19 0.25 0.01 0.00 -0.52 0.00 0.00 37.83 37.38 2kt8 s LYS 3 CO 0.20 -0.16 -0.20 0.95 -0.92 0.00 0.00 175.35 175.22 2kt8 s THR 4 N -3.33 1.91 -0.13 2.17 -4.23 -1.06 -0.03 115.64 110.95 2kt8 s THR 4 Ca 0.01 -0.89 -0.06 0.00 -1.18 0.00 0.00 61.69 59.57 2kt8 s THR 4 Cb 0.03 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 72.13 2kt8 s THR 4 CO -0.08 0.52 0.08 -0.83 -0.54 0.00 0.00 174.62 173.77 2kt8 s GLY 5 N 0.85 2.01 -0.27 3.99 0.00 -0.97 -2.60 107.32 110.34 2kt8 s GLY 5 Ca -0.07 -0.71 -0.15 0.00 0.00 0.00 0.00 44.72 43.78 2kt8 s GLY 5 CO -0.02 -0.32 0.38 -0.42 0.00 0.00 0.00 173.10 172.73 2kt8 s ILE 6 N -0.61 5.17 0.14 0.90 -1.09 -1.00 -2.63 121.20 122.07 2kt8 s ILE 6 Ca 0.12 0.59 -0.30 0.00 -2.23 0.00 0.00 60.65 58.82 2kt8 s ILE 6 Cb -0.12 -3.71 -0.07 0.00 -1.58 0.00 0.00 42.46 36.99 2kt8 s ILE 6 CO 0.02 0.15 1.11 -0.69 -1.23 0.00 0.00 174.94 174.31 2kt8 s VAL 7 N 2.07 3.99 -0.29 2.92 1.01 -1.00 -2.43 120.40 126.66 2kt8 s VAL 7 Ca 0.15 1.62 -0.03 0.00 0.00 0.00 0.00 61.98 63.72 2kt8 s VAL 7 Cb -0.16 -4.04 0.10 0.00 0.00 0.00 0.00 36.38 32.29 2kt8 s VAL 7 CO 0.10 0.24 0.13 0.54 0.00 0.00 0.00 175.10 176.10 2kt8 s ASN 8 N 0.21 3.60 -0.02 3.32 4.22 -0.61 -0.72 114.94 124.95 2kt8 s ASN 8 Ca 0.51 -1.37 0.02 0.00 -2.14 0.00 0.00 52.86 49.88 2kt8 s ASN 8 Cb -0.29 -0.43 0.01 0.00 1.28 0.00 0.00 41.25 41.82 2kt8 s ASN 8 CO 0.33 -0.43 -0.05 0.68 -2.04 0.00 0.00 177.10 175.58 2kt8 s VAL 9 N 2.00 0.50 0.21 3.54 -7.23 -1.26 -4.81 120.40 113.35 2kt8 s VAL 9 Ca 0.09 -0.20 -0.08 0.00 -1.81 0.00 0.00 61.98 59.98 2kt8 s VAL 9 Cb -0.16 -0.47 0.16 0.00 0.56 0.00 0.00 36.38 36.48 2kt8 s VAL 9 CO -0.34 0.17 1.80 0.77 -0.31 0.00 0.00 175.10 177.19 2kt8 h SER 10 N 6.48 1.07 0.00 4.85 4.64 -2.02 -3.40 113.55 125.17 2kt8 h SER 10 Ca -0.33 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2kt8 h SER 10 Cb 1.17 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2kt8 h SER 10 CO 0.49 0.91 0.00 -1.20 -0.87 0.00 0.00 176.83 176.16 2kt8 n SER 11 N -4.33 0.00 -3.72 4.97 7.64 -1.26 -5.06 113.62 111.86 2kt8 n SER 11 Ca 0.08 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.88 2kt8 n SER 11 Cb 0.15 -0.04 -0.02 0.00 -1.01 0.00 0.00 64.21 63.29 2kt8 n SER 11 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2kt8 s SER 12 N -1.09 -0.32 -0.11 6.43 0.01 -1.26 -4.68 113.70 112.67 2kt8 s SER 12 Ca 0.00 -0.40 0.02 0.00 1.31 0.00 0.00 55.95 56.88 2kt8 s SER 12 Cb 0.00 0.64 -0.01 0.00 0.21 0.00 0.00 66.02 66.86 2kt8 s SER 12 CO 0.00 -1.14 -0.18 -0.22 0.41 0.00 0.00 173.24 172.10 2kt8 s LEU 13 N -2.86 2.41 0.08 2.44 2.96 -1.01 -4.93 118.68 117.77 2kt8 s LEU 13 Ca 0.09 -0.44 -0.15 0.00 -0.22 0.00 0.00 54.13 53.40 2kt8 s LEU 13 Cb -0.04 -1.51 -0.06 0.00 0.50 0.00 0.00 46.19 45.08 2kt8 s LEU 13 CO 0.01 0.17 0.50 0.20 -1.32 0.00 0.00 176.35 175.91 2kt8 s ASN 14 N 0.33 6.87 -0.12 3.68 0.02 -1.26 -0.31 114.94 124.14 2kt8 s ASN 14 Ca -0.14 1.07 -0.21 0.00 -1.02 0.00 0.00 52.86 52.56 2kt8 s ASN 14 Cb -0.17 -2.29 -0.03 0.00 0.02 0.00 0.00 41.25 38.78 2kt8 s ASN 14 CO 0.07 0.22 0.61 -0.69 0.02 0.00 0.00 177.10 177.33 2kt8 s VAL 15 N -1.26 5.08 -0.14 1.60 1.01 0.13 -4.88 120.40 121.94 2kt8 s VAL 15 Ca 0.31 1.22 -0.04 0.00 0.00 0.00 0.00 61.98 63.48 2kt8 s VAL 15 Cb -0.17 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 2kt8 s VAL 15 CO 0.18 0.23 -0.01 -0.13 0.00 0.00 0.00 175.10 175.37 2kt8 s ARG 16 N 1.07 3.50 0.22 2.72 0.52 -1.02 -2.13 118.95 123.84 2kt8 s ARG 16 Ca 0.31 -0.46 -0.00 0.00 -0.52 0.00 0.00 55.73 55.07 2kt8 s ARG 16 Cb -0.16 -2.92 0.20 0.00 0.52 0.00 0.00 34.95 32.59 2kt8 s ARG 16 CO 0.13 0.39 1.56 1.05 0.02 0.00 0.00 175.30 178.46 2kt8 h GLU 17 N 6.21 0.46 0.00 3.54 4.11 -1.81 0.43 114.58 127.51 2kt8 h GLU 17 Ca -0.38 -0.27 0.00 0.00 0.07 0.00 0.00 59.36 58.78 2kt8 h GLU 17 Cb 1.19 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2kt8 h GLU 17 CO 0.62 0.86 0.00 0.41 0.07 0.00 0.00 179.01 180.97 2kt8 n GLY 18 N 0.14 5.08 2.46 1.06 0.00 -1.26 -4.68 105.19 107.99 2kt8 n GLY 18 Ca -0.02 -1.75 -0.18 0.00 0.00 0.00 0.00 46.02 44.06 2kt8 n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kt8 n ALA 19 N -3.00 1.08 -2.74 4.61 0.00 -1.26 -4.63 120.51 114.57 2kt8 n ALA 19 Ca 0.00 -2.51 -0.04 0.00 0.00 0.00 0.00 53.44 50.89 2kt8 n ALA 19 Cb 0.00 -1.01 0.05 0.00 0.00 0.00 0.00 19.45 18.49 2kt8 n ALA 19 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2kt8 n SER 20 N 2.19 1.21 0.00 0.00 7.64 -1.26 -5.05 113.62 118.36 2kt8 n SER 20 Ca 0.21 -2.36 0.00 0.00 1.01 0.00 0.00 58.87 57.73 2kt8 n SER 20 Cb 0.54 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 2kt8 n SER 20 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2kt8 n THR 21 N -0.40 0.00 -0.41 0.44 -2.24 -1.26 -3.27 114.28 107.14 2kt8 n THR 21 Ca 0.06 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.81 2kt8 n THR 21 Cb 0.82 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.00 2kt8 n THR 21 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2kt8 n SER 22 N 1.25 3.02 -4.86 3.42 2.88 -1.26 -4.85 113.62 113.21 2kt8 n SER 22 Ca 0.00 -1.92 -0.30 0.00 -1.33 0.00 0.00 58.87 55.33 2kt8 n SER 22 Cb 0.00 -0.72 0.06 0.00 -0.75 0.00 0.00 64.21 62.81 2kt8 n SER 22 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2kt8 s SER 23 N 2.19 5.06 0.23 -3.46 1.04 -1.20 -5.02 113.70 112.54 2kt8 s SER 23 Ca 0.17 1.14 -0.30 0.00 0.48 0.00 0.00 55.95 57.44 2kt8 s SER 23 Cb 0.08 -1.89 -0.09 0.00 0.10 0.00 0.00 66.02 64.23 2kt8 s SER 23 CO 0.00 -1.59 1.03 -0.75 0.98 0.00 0.00 173.24 172.91 2kt8 s LYS 24 N -5.33 4.72 -0.14 4.02 2.20 -1.26 -4.96 119.74 119.00 2kt8 s LYS 24 Ca 0.59 1.63 -0.17 0.00 -0.36 0.00 0.00 55.97 57.67 2kt8 s LYS 24 Cb -0.12 -3.26 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 2kt8 s LYS 24 CO 0.52 0.30 0.41 0.08 -0.36 0.00 0.00 175.35 176.30 2kt8 s VAL 25 N -0.85 5.23 -0.85 4.02 1.01 -1.26 -2.80 120.40 124.90 2kt8 s VAL 25 Ca 0.44 0.80 0.12 0.00 0.00 0.00 0.00 61.98 63.34 2kt8 s VAL 25 Cb -0.28 -3.75 -0.06 0.00 0.00 0.00 0.00 36.38 32.29 2kt8 s VAL 25 CO 0.35 0.35 0.61 2.30 0.00 0.00 0.00 175.10 178.71 2kt8 n ILE 26 N 3.66 0.00 -1.97 2.22 -5.35 -0.91 -4.99 119.36 112.03 2kt8 n ILE 26 Ca -0.09 -0.31 0.00 0.00 -0.27 0.00 0.00 62.75 62.08 2kt8 n ILE 26 Cb 0.52 1.08 0.00 0.00 -1.74 0.00 0.00 39.64 39.50 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 1.11 -1.22 3.12 3.28 0.00 -1.25 -5.01 105.19 105.22 2kt8 n GLY 27 Ca 0.04 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.59 0.15 0.09 1.61 0.01 -1.26 0.21 113.70 111.92 2kt8 s SER 28 Ca 0.00 -0.48 0.08 0.00 1.31 0.00 0.00 55.95 56.86 2kt8 s SER 28 Cb 0.00 0.23 -0.03 0.00 0.21 0.00 0.00 66.02 66.42 2kt8 s SER 28 CO 0.00 -0.49 -0.21 -0.76 0.41 0.00 0.00 173.24 172.19 2kt8 s LEU 29 N -2.01 2.27 0.73 2.44 1.43 0.58 -4.87 118.68 119.25 2kt8 s LEU 29 Ca -0.07 -0.65 -0.12 0.00 -1.03 0.00 0.00 54.13 52.27 2kt8 s LEU 29 Cb -0.02 -0.91 0.03 0.00 0.03 0.00 0.00 46.19 45.32 2kt8 s LEU 29 CO -0.04 0.08 1.10 -0.94 0.23 0.00 0.00 176.35 176.79 2kt8 s SER 30 N -1.74 5.19 0.72 2.29 1.04 -1.26 -2.42 113.70 117.52 2kt8 s SER 30 Ca 0.07 1.13 -0.14 0.00 0.48 0.00 0.00 55.95 57.49 2kt8 s SER 30 Cb -0.10 -1.89 0.03 0.00 0.10 0.00 0.00 66.02 64.17 2kt8 s SER 30 CO 0.04 -1.51 1.15 -0.83 0.98 0.00 0.00 173.24 173.07 2kt8 s GLY 31 N -4.30 2.18 -1.55 7.32 0.00 -1.26 -3.05 107.32 106.67 2kt8 s GLY 31 Ca 0.59 0.68 -0.02 0.00 0.00 0.00 0.00 44.72 45.98 2kt8 s GLY 31 CO 0.52 1.06 0.18 0.70 0.00 0.00 0.00 173.10 175.56 2kt8 n ASN 32 N -2.75 -5.40 -4.72 1.64 5.03 0.10 -4.95 115.26 104.22 2kt8 n ASN 32 Ca 0.12 -0.06 -0.38 0.00 0.87 0.00 0.00 54.58 55.13 2kt8 n ASN 32 Cb 0.51 -4.47 -0.06 0.00 -1.02 0.00 0.00 39.78 34.74 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 -2.98 5.19 0.08 3.41 2.01 -1.17 -4.79 115.64 117.39 2kt8 s THR 33 Ca 0.10 0.96 -0.30 0.00 0.31 0.00 0.00 61.69 62.76 2kt8 s THR 33 Cb -0.05 -3.82 -0.05 0.00 0.01 0.00 0.00 72.50 68.59 2kt8 s THR 33 CO 0.12 0.32 0.96 -0.75 -0.69 0.00 0.00 174.62 174.59 2kt8 s LYS 34 N 0.64 4.66 -0.05 4.92 2.20 -1.26 -2.38 119.74 128.46 2kt8 s LYS 34 Ca 0.26 1.43 0.03 0.00 -0.36 0.00 0.00 55.97 57.34 2kt8 s LYS 34 Cb -0.15 -3.40 0.00 0.00 -1.51 0.00 0.00 37.83 32.77 2kt8 s LYS 34 CO 0.10 0.14 -0.14 0.14 -0.36 0.00 0.00 175.35 175.24 2kt8 s VAL 35 N 0.28 1.21 0.01 4.02 -7.23 -1.08 -5.01 120.40 112.59 2kt8 s VAL 35 Ca 0.48 -0.56 -0.28 0.00 -1.81 0.00 0.00 61.98 59.80 2kt8 s VAL 35 Cb -0.23 -1.07 -0.04 0.00 0.56 0.00 0.00 36.38 35.61 2kt8 s VAL 35 CO 0.29 0.36 0.91 -0.89 -0.31 0.00 0.00 175.10 175.46 2kt8 s THR 36 N 0.31 4.82 -0.21 5.32 2.01 -1.26 -2.28 115.64 124.35 2kt8 s THR 36 Ca -0.08 1.92 -0.07 0.00 0.31 0.00 0.00 61.69 63.77 2kt8 s THR 36 Cb -0.13 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.09 2kt8 s THR 36 CO 0.03 0.22 0.06 -0.63 -0.69 0.00 0.00 174.62 173.61 2kt8 s ILE 37 N 0.70 4.56 -1.40 1.82 1.01 0.96 -2.49 121.20 126.36 2kt8 s ILE 37 Ca 0.47 -0.11 0.12 0.00 0.00 0.00 0.00 60.65 61.14 2kt8 s ILE 37 Cb -0.21 -3.08 0.07 0.00 0.01 0.00 0.00 42.46 39.25 2kt8 s ILE 37 CO 0.26 0.41 0.83 1.33 0.00 0.00 0.00 174.94 177.77 2kt8 n VAL 38 N 4.09 0.00 -0.67 2.92 0.24 -1.18 -2.60 118.33 121.13 2kt8 n VAL 38 Ca -0.16 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 2kt8 n VAL 38 Cb 0.52 1.22 0.00 0.00 -1.47 0.00 0.00 33.84 34.11 2kt8 n VAL 38 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2kt8 n GLY 39 N 0.78 -1.16 3.14 7.63 0.00 -1.25 -4.54 105.19 109.79 2kt8 n GLY 39 Ca 0.07 -0.97 -0.08 0.00 0.00 0.00 0.00 46.02 45.03 2kt8 n GLY 39 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2kt8 s GLU 40 N -1.57 0.73 -0.24 1.61 -1.05 -1.26 -2.26 118.70 114.67 2kt8 s GLU 40 Ca 0.00 -1.17 -0.04 0.00 -0.15 0.00 0.00 54.97 53.61 2kt8 s GLU 40 Cb 0.00 0.26 0.13 0.00 -0.44 0.00 0.00 34.13 34.08 2kt8 s GLU 40 CO 0.00 -0.18 0.42 -2.00 0.95 0.00 0.00 175.26 174.45 2kt8 s GLU 41 N -3.92 0.38 5.30 -4.83 2.12 -0.22 -4.82 118.70 112.70 2kt8 s GLU 41 Ca 0.09 0.74 0.00 0.00 0.36 0.00 0.00 54.97 56.15 2kt8 s GLU 41 Cb 0.07 -0.12 0.00 0.00 0.26 0.00 0.00 34.13 34.34 2kt8 s GLU 41 CO -0.09 -0.54 0.00 0.41 -0.54 0.00 0.00 175.26 174.51 2kt8 n GLY 42 N 5.38 2.96 1.44 -1.50 0.00 -1.26 -0.97 105.19 111.25 2kt8 n GLY 42 Ca -0.05 -0.21 -0.06 0.00 0.00 0.00 0.00 46.02 45.71 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 9.38 3.69 -2.69 4.61 0.00 -1.26 -4.85 120.51 129.39 2kt8 n ALA 43 Ca 0.00 -1.23 -0.16 0.00 0.00 0.00 0.00 53.44 52.05 2kt8 n ALA 43 Cb 0.00 -1.16 -0.12 0.00 0.00 0.00 0.00 19.45 18.18 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 -1.72 1.06 -0.08 0.00 0.08 -0.14 -2.66 117.98 114.51 2kt8 s PHE 44 Ca 0.28 -0.51 -0.01 0.00 0.12 0.00 0.00 56.93 56.80 2kt8 s PHE 44 Cb 0.22 -0.60 -0.03 0.00 -0.57 0.00 0.00 43.02 42.05 2kt8 s PHE 44 CO 0.06 0.01 -0.02 0.71 -0.10 0.00 0.00 175.22 175.89 2kt8 s TYR 45 N -1.58 3.10 -0.09 0.36 2.02 -0.26 -1.05 117.35 119.85 2kt8 s TYR 45 Ca -0.02 0.13 -0.17 0.00 -0.37 0.00 0.00 57.07 56.64 2kt8 s TYR 45 Cb -0.08 -1.78 -0.05 0.00 -0.40 0.00 0.00 41.96 39.65 2kt8 s TYR 45 CO 0.01 0.41 0.45 0.21 -1.57 0.00 0.00 175.55 175.07 2kt8 s LYS 46 N -0.80 4.24 0.15 -0.62 2.20 -0.96 -2.61 119.74 121.34 2kt8 s LYS 46 Ca 0.12 0.42 0.06 0.00 -0.36 0.00 0.00 55.97 56.22 2kt8 s LYS 46 Cb -0.11 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.79 2kt8 s LYS 46 CO 0.02 0.30 -0.14 0.96 -0.36 0.00 0.00 175.35 176.13 2kt8 s ILE 47 N 0.16 1.48 -0.79 5.43 -4.36 -0.42 -3.12 121.20 119.59 2kt8 s ILE 47 Ca 0.25 -1.92 -0.25 0.00 -0.26 0.00 0.00 60.65 58.47 2kt8 s ILE 47 Cb -0.15 -1.75 0.05 0.00 1.25 0.00 0.00 42.46 41.85 2kt8 s ILE 47 CO 0.11 -0.50 1.24 -0.70 0.24 0.00 0.00 174.94 175.33 2kt8 s GLU 48 N -3.10 3.27 0.54 0.37 2.12 -1.04 -1.43 118.70 119.44 2kt8 s GLU 48 Ca 0.14 -0.61 -0.07 0.00 0.36 0.00 0.00 54.97 54.80 2kt8 s GLU 48 Cb -0.03 -4.45 -0.02 0.00 0.26 0.00 0.00 34.13 29.89 2kt8 s GLU 48 CO 0.04 -2.07 0.87 -0.47 -0.54 0.00 0.00 175.26 173.09 2kt8 s TYR 49 N 5.09 3.48 -0.42 5.30 5.04 0.18 -4.85 117.35 131.17 2kt8 s TYR 49 Ca 0.34 0.86 -0.28 0.00 -2.44 0.00 0.00 57.07 55.55 2kt8 s TYR 49 Cb -0.08 -2.52 -0.01 0.00 0.35 0.00 0.00 41.96 39.70 2kt8 s TYR 49 CO 0.08 -0.53 1.67 0.15 -1.34 0.00 0.00 175.55 175.58 2kt8 s LYS 50 N -4.91 3.28 0.00 4.97 1.02 -1.26 -2.16 119.74 120.68 2kt8 s LYS 50 Ca 0.51 1.07 0.00 0.00 0.02 0.00 0.00 55.97 57.57 2kt8 s LYS 50 Cb -0.10 -4.18 0.00 0.00 -0.52 0.00 0.00 37.83 33.03 2kt8 s LYS 50 CO 0.47 -1.93 0.00 0.41 -0.92 0.00 0.00 175.35 173.37 2kt8 n GLY 51 N 5.36 1.64 0.00 -3.33 0.00 -1.26 -4.98 105.19 102.63 2kt8 n GLY 51 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2kt8 n GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2kt8 n SER 52 N 0.00 0.00 -4.22 1.61 3.41 -0.92 -5.14 113.62 108.36 2kt8 n SER 52 Ca 0.00 -0.16 -0.34 0.00 -0.26 0.00 0.00 58.87 58.11 2kt8 n SER 52 Cb 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.80 2kt8 n SER 52 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2kt8 s HIS 53 N -3.03 2.84 0.50 7.33 0.09 -1.26 0.48 115.29 122.23 2kt8 s HIS 53 Ca 0.00 -1.26 -0.03 0.00 -0.00 0.00 0.00 55.06 53.78 2kt8 s HIS 53 Cb 0.00 -1.97 -0.01 0.00 -0.00 0.00 0.00 32.58 30.60 2kt8 s HIS 53 CO 0.00 -0.63 0.76 0.20 -0.00 0.00 0.00 174.74 175.07 2kt8 s GLY 54 N 1.22 1.56 -0.02 -2.22 0.00 -0.51 -4.75 107.32 102.60 2kt8 s GLY 54 Ca 0.02 -0.83 0.03 0.00 0.00 0.00 0.00 44.72 43.94 2kt8 s GLY 54 CO -0.06 -0.63 -0.09 -0.19 0.00 0.00 0.00 173.10 172.12 2kt8 s TYR 55 N -2.73 0.93 0.05 1.90 1.51 0.15 -1.30 117.35 117.87 2kt8 s TYR 55 Ca 0.50 -0.21 0.00 0.00 -1.01 0.00 0.00 57.07 56.35 2kt8 s TYR 55 Cb -0.10 -0.64 -0.03 0.00 -0.11 0.00 0.00 41.96 41.07 2kt8 s TYR 55 CO 0.41 -0.07 -0.04 0.14 -1.11 0.00 0.00 175.55 174.88 2kt8 s VAL 56 N 0.04 0.32 0.39 0.71 -7.23 -1.07 -2.42 120.40 111.14 2kt8 s VAL 56 Ca -0.01 -1.54 -0.24 0.00 -1.81 0.00 0.00 61.98 58.38 2kt8 s VAL 56 Cb -0.07 -1.15 -0.09 0.00 0.56 0.00 0.00 36.38 35.63 2kt8 s VAL 56 CO 0.00 -0.79 1.06 0.00 -0.31 0.00 0.00 175.10 175.06 2kt8 s ALA 57 N -2.99 3.11 -0.55 1.32 0.00 -1.26 -1.10 121.76 120.28 2kt8 s ALA 57 Ca 0.01 0.73 0.21 0.00 0.00 0.00 0.00 51.96 52.91 2kt8 s ALA 57 Cb 0.01 -3.28 0.92 0.00 0.00 0.00 0.00 23.12 20.76 2kt8 s ALA 57 CO -0.06 -0.23 1.65 0.36 0.00 0.00 0.00 175.76 177.48 2kt8 n LYS 58 N 0.01 0.15 -0.04 0.00 2.85 -1.09 -2.68 118.16 117.36 2kt8 n LYS 58 Ca 0.05 0.42 -0.05 0.00 -1.05 0.00 0.00 58.31 57.67 2kt8 n LYS 58 Cb 0.49 -1.81 0.15 0.00 -0.65 0.00 0.00 35.03 33.21 2kt8 n LYS 58 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 2kt8 h GLU 59 N 0.00 0.63 -0.08 -1.58 4.57 -1.91 -2.53 114.58 113.68 2kt8 h GLU 59 Ca 0.00 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 2kt8 h GLU 59 Cb 0.30 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 2kt8 h GLU 59 CO 0.00 0.79 0.00 0.66 -1.18 0.00 0.00 179.01 179.28 2kt8 n TYR 60 N -4.13 0.08 -4.39 0.92 4.01 -1.09 -4.81 117.16 107.75 2kt8 n TYR 60 Ca 0.00 -0.04 -0.34 0.00 -0.16 0.00 0.00 57.90 57.36 2kt8 n TYR 60 Cb 0.40 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.29 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 -1.92 3.11 0.21 -0.72 -1.09 -0.95 -1.57 121.20 118.26 2kt8 s ILE 61 Ca 0.35 -0.62 -0.03 0.00 -2.23 0.00 0.00 60.65 58.12 2kt8 s ILE 61 Cb 0.20 -2.35 -0.03 0.00 -1.58 0.00 0.00 42.46 38.70 2kt8 s ILE 61 CO 0.31 0.49 0.20 -1.59 -1.23 0.00 0.00 174.94 173.12 2kt8 s LYS 62 N 0.84 1.26 -1.03 2.79 -2.85 -1.02 -4.87 119.74 114.86 2kt8 s LYS 62 Ca -0.03 -1.55 -0.01 0.00 -1.00 0.00 0.00 55.97 53.38 2kt8 s LYS 62 Cb -0.15 0.31 -0.01 0.00 -2.06 0.00 0.00 37.83 35.92 2kt8 s LYS 62 CO 0.01 -0.44 0.87 -3.47 0.10 0.00 0.00 175.35 172.42 2kt8 n ASP 63 N -0.29 -3.01 -4.72 0.03 -0.08 -1.26 -2.39 116.55 104.84 2kt8 n ASP 63 Ca 0.01 -0.57 -0.42 0.00 -1.51 0.00 0.00 54.79 52.30 2kt8 n ASP 63 Cb 0.65 -4.62 -0.03 0.00 2.34 0.00 0.00 41.12 39.46 2kt8 n ASP 63 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2kt8 s ILE 64 N -3.33 4.04 -0.09 5.18 1.01 -1.26 -4.39 121.20 122.36 2kt8 s ILE 64 Ca 0.10 1.51 0.01 0.00 0.00 0.00 0.00 60.65 62.27 2kt8 s ILE 64 Cb -0.01 -3.97 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 2kt8 s ILE 64 CO 0.65 0.14 -0.13 -0.54 0.00 0.00 0.00 174.94 175.06 2kt8 s LYS 65 N 0.80 3.01 -0.21 2.79 1.02 -1.07 -4.95 119.74 121.12 2kt8 s LYS 65 Ca 0.57 -0.69 -0.08 0.00 0.02 0.00 0.00 55.97 55.80 2kt8 s LYS 65 Cb -0.29 -2.53 -0.04 0.00 -0.52 0.00 0.00 37.83 34.46 2kt8 s LYS 65 CO 0.30 0.40 0.07 0.16 -0.92 0.00 0.00 175.35 175.36 2kt8 s ASP 66 N -0.13 5.48 -0.00 2.83 -4.77 -1.26 -2.56 116.67 116.26 2kt8 s ASP 66 Ca -0.01 -0.03 0.22 0.00 -3.30 0.00 0.00 52.55 49.43 2kt8 s ASP 66 Cb -0.14 -1.96 -0.25 0.00 -1.09 0.00 0.00 42.92 39.48 2kt8 s ASP 66 CO 0.03 0.08 0.69 -0.62 0.70 0.00 0.00 175.17 176.06 2kt8 n GLU 67 N 4.13 0.42 -3.55 2.11 4.71 -1.24 -4.92 120.64 122.31 2kt8 n GLU 67 Ca -0.16 -0.11 -0.38 0.00 -0.01 0.00 0.00 57.16 56.50 2kt8 n GLU 67 Cb 0.52 -1.53 -0.06 0.00 -1.01 0.00 0.00 31.44 29.36 2kt8 n GLU 67 CO 0.00 0.00 0.00 0.14 0.09 0.00 0.00 177.13 177.36 2kt8 s VAL 68 N -3.32 5.08 -2.08 2.62 -7.23 -1.26 -4.96 120.40 109.26 2kt8 s VAL 68 Ca -0.02 0.76 0.30 0.00 -1.81 0.00 0.00 61.98 61.21 2kt8 s VAL 68 Cb 0.14 -3.68 0.64 0.00 0.56 0.00 0.00 36.38 34.05 2kt8 s VAL 68 CO 0.88 0.58 1.94 0.18 -0.31 0.00 0.00 175.10 178.37 2kt8 n LEU 69 N 1.81 0.69 0.00 1.32 4.32 -1.26 -4.93 117.00 118.95 2kt8 n LEU 69 Ca -0.14 -0.18 0.00 0.00 -0.02 0.00 0.00 56.01 55.66 2kt8 n LEU 69 Cb 0.53 -0.05 0.00 0.00 -1.62 0.00 0.00 43.42 42.27 2kt8 n LEU 69 CO 0.37 0.12 0.00 1.21 -1.22 0.00 0.00 177.39 177.87 2kt8 n GLU 70 N -0.56 0.00 -3.93 3.23 2.13 -1.26 -4.47 120.64 115.78 2kt8 n GLU 70 Ca 0.19 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.92 2kt8 n GLU 70 Cb 0.25 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 31.86 2kt8 n GLU 70 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 2kt8 s HIS 71 N 0.00 0.19 0.69 4.31 3.76 -1.26 -5.16 115.29 117.83 2kt8 s HIS 71 Ca 0.00 -0.46 -0.11 0.00 -0.15 0.00 0.00 55.06 54.34 2kt8 s HIS 71 Cb 0.00 -0.14 0.01 0.00 1.11 0.00 0.00 32.58 33.55 2kt8 s HIS 71 CO 0.00 -0.32 1.07 -1.58 -0.85 0.00 0.00 174.74 173.06 2kt8 s HIS 72 N -2.24 3.29 0.15 1.40 2.46 -1.26 -4.99 115.29 114.10 2kt8 s HIS 72 Ca -0.08 1.21 -0.30 0.00 0.47 0.00 0.00 55.06 56.35 2kt8 s HIS 72 Cb -0.03 -2.94 -0.08 0.00 -0.13 0.00 0.00 32.58 29.40 2kt8 s HIS 72 CO -0.03 -1.15 1.30 -1.01 -2.47 0.00 0.00 174.74 171.38 2kt8 s HIS 73 N -3.21 3.30 -0.73 3.88 0.09 -1.26 -4.90 115.29 112.47 2kt8 s HIS 73 Ca 0.58 1.18 0.25 0.00 -0.00 0.00 0.00 55.06 57.07 2kt8 s HIS 73 Cb -0.12 -3.57 0.59 0.00 -0.00 0.00 0.00 32.58 29.47 2kt8 s HIS 73 CO 0.53 -1.84 1.53 -2.39 -0.00 0.00 0.00 174.74 172.58 2kt8 n HIS 74 N 3.18 0.61 -0.21 1.40 1.44 -1.26 -3.71 115.22 116.66 2kt8 n HIS 74 Ca 0.08 0.18 -0.09 0.00 -2.01 0.00 0.00 57.72 55.88 2kt8 n HIS 74 Cb 0.43 -0.72 0.04 0.00 0.12 0.00 0.00 29.99 29.87 2kt8 n HIS 74 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2kt8 h HIS 75 N 0.00 1.16 -0.00 -1.40 3.86 -2.04 -3.58 115.15 113.14 2kt8 h HIS 75 Ca 0.00 -0.19 0.00 0.00 -1.16 0.00 0.00 60.37 59.02 2kt8 h HIS 75 Cb 0.71 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.87 2kt8 h HIS 75 CO 0.00 1.01 0.00 0.72 0.86 0.00 0.00 177.93 180.52