#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 -4.06 -4.05 0.00 1.02 -1.26 -4.89 120.64 107.40 2kt8 n GLU 2 Ca 0.00 3.09 -0.09 0.00 -0.02 0.00 0.00 57.16 60.14 2kt8 n GLU 2 Cb 0.00 -3.72 -0.11 0.00 -0.02 0.00 0.00 31.44 27.60 2kt8 n GLU 2 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2kt8 s LYS 3 N -4.38 0.49 -0.15 3.49 1.02 -1.08 -4.65 119.74 114.48 2kt8 s LYS 3 Ca 0.00 -0.92 -0.01 0.00 0.02 0.00 0.00 55.97 55.06 2kt8 s LYS 3 Cb 0.00 0.07 -0.01 0.00 -0.52 0.00 0.00 37.83 37.38 2kt8 s LYS 3 CO 0.00 -0.06 -0.12 0.99 -0.92 0.00 0.00 175.35 175.24 2kt8 s THR 4 N -2.56 2.98 -0.08 2.17 2.01 -1.26 -0.16 115.64 118.75 2kt8 s THR 4 Ca -0.04 -0.67 -0.08 0.00 0.31 0.00 0.00 61.69 61.21 2kt8 s THR 4 Cb -0.02 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 2kt8 s THR 4 CO -0.05 0.50 0.21 -0.83 -0.69 0.00 0.00 174.62 173.77 2kt8 s GLY 5 N 0.71 2.24 -0.33 4.40 0.00 -0.99 -2.07 107.32 111.29 2kt8 s GLY 5 Ca -0.06 -0.55 -0.17 0.00 0.00 0.00 0.00 44.72 43.94 2kt8 s GLY 5 CO 0.02 -0.28 0.47 -0.42 0.00 0.00 0.00 173.10 172.89 2kt8 s ILE 6 N -1.08 5.07 0.06 0.90 -1.09 -1.13 -2.57 121.20 121.35 2kt8 s ILE 6 Ca 0.19 0.39 -0.30 0.00 -2.23 0.00 0.00 60.65 58.71 2kt8 s ILE 6 Cb -0.13 -3.89 -0.05 0.00 -1.58 0.00 0.00 42.46 36.82 2kt8 s ILE 6 CO 0.08 -0.11 0.95 -0.69 -1.23 0.00 0.00 174.94 173.95 2kt8 s VAL 7 N 2.28 4.67 -0.23 2.92 1.01 -1.08 -2.22 120.40 127.75 2kt8 s VAL 7 Ca 0.17 2.03 -0.02 0.00 0.00 0.00 0.00 61.98 64.17 2kt8 s VAL 7 Cb -0.16 -4.31 0.07 0.00 0.00 0.00 0.00 36.38 31.99 2kt8 s VAL 7 CO 0.12 0.25 0.05 0.21 0.00 0.00 0.00 175.10 175.73 2kt8 s ASN 8 N 0.43 3.36 0.00 3.32 2.47 -0.98 0.40 114.94 123.94 2kt8 s ASN 8 Ca 0.48 -1.11 0.00 0.00 0.42 0.00 0.00 52.86 52.66 2kt8 s ASN 8 Cb -0.22 -0.73 0.00 0.00 -1.45 0.00 0.00 41.25 38.85 2kt8 s ASN 8 CO 0.29 -0.33 0.00 1.33 -3.72 0.00 0.00 177.10 174.66 2kt8 n VAL 9 N 4.96 0.00 -0.91 -5.21 0.24 -1.26 -4.84 118.33 111.30 2kt8 n VAL 9 Ca -0.07 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.20 2kt8 n VAL 9 Cb 0.45 0.30 -0.01 0.00 -1.47 0.00 0.00 33.84 33.11 2kt8 n VAL 9 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2kt8 n SER 10 N 0.00 -1.09 -2.11 -1.34 3.41 -1.26 -4.49 113.62 106.74 2kt8 n SER 10 Ca 0.00 0.08 -0.02 0.00 -0.26 0.00 0.00 58.87 58.67 2kt8 n SER 10 Cb 0.00 -1.29 0.04 0.00 -0.26 0.00 0.00 64.21 62.70 2kt8 n SER 10 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2kt8 n SER 11 N 0.91 -0.17 -1.63 4.04 7.64 -1.26 -4.99 113.62 118.15 2kt8 n SER 11 Ca -0.03 -2.08 0.00 0.00 1.01 0.00 0.00 58.87 57.77 2kt8 n SER 11 Cb 0.13 0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 2kt8 n SER 11 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2kt8 n SER 12 N -0.59 -8.77 -4.35 6.43 2.88 -1.26 -4.95 113.62 103.02 2kt8 n SER 12 Ca -0.10 1.62 -0.32 0.00 -1.33 0.00 0.00 58.87 58.74 2kt8 n SER 12 Cb 0.86 -5.13 -0.15 0.00 -0.75 0.00 0.00 64.21 59.05 2kt8 n SER 12 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2kt8 s LEU 13 N -4.52 2.50 0.17 2.46 2.96 0.11 -4.88 118.68 117.47 2kt8 s LEU 13 Ca 0.00 -0.37 -0.29 0.00 -0.22 0.00 0.00 54.13 53.25 2kt8 s LEU 13 Cb 0.00 -1.52 -0.07 0.00 0.50 0.00 0.00 46.19 45.10 2kt8 s LEU 13 CO 0.00 0.22 0.92 0.54 -1.32 0.00 0.00 176.35 176.71 2kt8 s ASN 14 N 0.02 7.54 -0.09 3.68 2.20 -1.26 0.27 114.94 127.29 2kt8 s ASN 14 Ca -0.06 1.82 -0.19 0.00 -0.94 0.00 0.00 52.86 53.50 2kt8 s ASN 14 Cb -0.15 -2.58 -0.04 0.00 -2.00 0.00 0.00 41.25 36.48 2kt8 s ASN 14 CO 0.05 0.06 0.51 -0.69 -2.94 0.00 0.00 177.10 174.09 2kt8 s VAL 15 N -0.60 5.13 -0.06 3.54 1.01 -0.32 -4.90 120.40 124.20 2kt8 s VAL 15 Ca 0.43 1.04 -0.12 0.00 0.00 0.00 0.00 61.98 63.33 2kt8 s VAL 15 Cb -0.24 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 2kt8 s VAL 15 CO 0.30 0.35 0.30 -0.13 0.00 0.00 0.00 175.10 175.92 2kt8 s ARG 16 N 0.43 3.79 0.11 2.72 0.52 -0.93 -3.47 118.95 122.12 2kt8 s ARG 16 Ca 0.28 0.19 -0.15 0.00 -0.52 0.00 0.00 55.73 55.53 2kt8 s ARG 16 Cb -0.16 -3.23 -0.05 0.00 0.52 0.00 0.00 34.95 32.02 2kt8 s ARG 16 CO 0.12 0.67 1.51 1.49 0.02 0.00 0.00 175.30 179.11 2kt8 h GLU 17 N 5.03 0.66 0.00 3.54 4.57 -1.67 -1.14 114.58 125.56 2kt8 h GLU 17 Ca -0.52 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.41 2kt8 h GLU 17 Cb 1.22 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 2kt8 h GLU 17 CO 0.62 0.83 0.00 0.41 -1.18 0.00 0.00 179.01 179.69 2kt8 n GLY 18 N -0.17 5.36 2.75 1.92 0.00 -1.26 -4.67 105.19 109.13 2kt8 n GLY 18 Ca -0.02 -2.15 -0.40 0.00 0.00 0.00 0.00 46.02 43.45 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 6.21 -3.28 4.61 0.00 -1.26 -4.63 120.51 119.15 2kt8 n ALA 19 Ca 0.00 -4.42 -0.14 0.00 0.00 0.00 0.00 53.44 48.88 2kt8 n ALA 19 Cb 0.00 -2.06 -0.07 0.00 0.00 0.00 0.00 19.45 17.31 2kt8 n ALA 19 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2kt8 s SER 20 N -1.32 -0.32 0.51 0.00 0.15 -1.26 -5.02 113.70 106.44 2kt8 s SER 20 Ca 0.44 0.21 0.29 0.00 0.70 0.00 0.00 55.95 57.59 2kt8 s SER 20 Cb 0.29 0.39 1.31 0.00 -1.71 0.00 0.00 66.02 66.30 2kt8 s SER 20 CO -0.24 -0.54 1.99 0.71 1.20 0.00 0.00 173.24 176.36 2kt8 h THR 21 N 3.47 0.40 -0.01 6.45 1.35 -2.04 -1.54 112.91 120.99 2kt8 h THR 21 Ca -0.29 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.86 2kt8 h THR 21 Cb 1.17 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 69.10 2kt8 h THR 21 CO 0.41 0.12 -0.01 -1.54 -0.25 0.00 0.00 175.52 174.25 2kt8 n SER 22 N -3.39 0.53 -4.72 5.36 3.41 -1.26 -4.89 113.62 108.66 2kt8 n SER 22 Ca -0.01 -1.12 -0.31 0.00 -0.26 0.00 0.00 58.87 57.18 2kt8 n SER 22 Cb 0.31 -0.01 0.13 0.00 -0.26 0.00 0.00 64.21 64.38 2kt8 n SER 22 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2kt8 s SER 23 N -2.05 3.75 0.02 4.04 1.04 -0.58 -5.00 113.70 114.91 2kt8 s SER 23 Ca 0.43 2.04 -0.15 0.00 0.48 0.00 0.00 55.95 58.75 2kt8 s SER 23 Cb 0.21 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.73 2kt8 s SER 23 CO 0.37 -2.55 0.44 -1.59 0.98 0.00 0.00 173.24 170.89 2kt8 s LYS 24 N -4.69 3.96 -0.07 4.02 -2.85 -1.26 -4.81 119.74 114.05 2kt8 s LYS 24 Ca 0.65 0.46 -0.23 0.00 -1.00 0.00 0.00 55.97 55.85 2kt8 s LYS 24 Cb -0.21 -3.21 -0.04 0.00 -2.06 0.00 0.00 37.83 32.31 2kt8 s LYS 24 CO 0.56 0.68 0.70 0.08 0.10 0.00 0.00 175.35 177.46 2kt8 s VAL 25 N -1.10 5.05 -1.34 1.79 1.01 -1.26 -1.91 120.40 122.64 2kt8 s VAL 25 Ca 0.25 1.43 0.19 0.00 0.00 0.00 0.00 61.98 63.86 2kt8 s VAL 25 Cb -0.17 -4.04 -0.11 0.00 0.00 0.00 0.00 36.38 32.07 2kt8 s VAL 25 CO 0.15 0.25 0.89 2.30 0.00 0.00 0.00 175.10 178.68 2kt8 n ILE 26 N 3.80 0.00 -3.41 2.22 -5.35 -1.23 -4.99 119.36 110.40 2kt8 n ILE 26 Ca -0.01 -0.17 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 2kt8 n ILE 26 Cb 0.51 1.11 0.00 0.00 -1.74 0.00 0.00 39.64 39.53 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 1.37 -0.75 3.43 3.28 0.00 -1.26 -5.05 105.19 106.21 2kt8 n GLY 27 Ca 0.06 -0.86 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 2kt8 n GLY 27 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kt8 s SER 28 N -4.00 -0.16 0.09 1.61 1.04 -1.26 -1.18 113.70 109.84 2kt8 s SER 28 Ca 0.00 -0.58 0.08 0.00 0.48 0.00 0.00 55.95 55.94 2kt8 s SER 28 Cb 0.00 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.60 2kt8 s SER 28 CO 0.00 -0.97 -0.22 -0.76 0.98 0.00 0.00 173.24 172.27 2kt8 s LEU 29 N -2.89 2.26 0.59 2.42 1.43 0.14 -4.89 118.68 117.75 2kt8 s LEU 29 Ca 0.10 -0.65 -0.18 0.00 -1.03 0.00 0.00 54.13 52.38 2kt8 s LEU 29 Cb 0.01 -0.96 -0.04 0.00 0.03 0.00 0.00 46.19 45.24 2kt8 s LEU 29 CO -0.04 0.10 1.12 -0.55 0.23 0.00 0.00 176.35 177.22 2kt8 s SER 30 N -1.71 5.50 0.90 2.29 0.15 -1.26 0.04 113.70 119.61 2kt8 s SER 30 Ca 0.08 2.10 -0.10 0.00 0.70 0.00 0.00 55.95 58.72 2kt8 s SER 30 Cb -0.10 -2.57 0.14 0.00 -1.71 0.00 0.00 66.02 61.78 2kt8 s SER 30 CO 0.04 -1.37 1.13 -0.83 1.20 0.00 0.00 173.24 173.41 2kt8 s GLY 31 N -2.11 1.68 -1.52 9.45 0.00 -1.26 -3.10 107.32 110.46 2kt8 s GLY 31 Ca 0.70 0.48 -0.04 0.00 0.00 0.00 0.00 44.72 45.87 2kt8 s GLY 31 CO 0.33 0.90 0.36 0.70 0.00 0.00 0.00 173.10 175.39 2kt8 n ASN 32 N -4.13 -5.45 -4.70 1.64 5.03 0.16 -4.95 115.26 102.86 2kt8 n ASN 32 Ca 0.11 -0.17 -0.35 0.00 0.87 0.00 0.00 54.58 55.04 2kt8 n ASN 32 Cb 0.52 -4.48 -0.09 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 -3.04 4.62 0.25 3.41 2.01 -1.18 -4.82 115.64 116.89 2kt8 s THR 33 Ca 0.20 -0.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.79 2kt8 s THR 33 Cb -0.09 -3.00 -0.09 0.00 0.01 0.00 0.00 72.50 69.33 2kt8 s THR 33 CO 0.25 0.57 0.95 -0.54 -0.69 0.00 0.00 174.62 175.15 2kt8 s LYS 34 N -0.54 4.83 -0.07 4.92 3.01 -1.26 -2.63 119.74 128.00 2kt8 s LYS 34 Ca 0.10 1.49 0.03 0.00 -1.01 0.00 0.00 55.97 56.58 2kt8 s LYS 34 Cb -0.12 -3.24 0.01 0.00 -1.01 0.00 0.00 37.83 33.47 2kt8 s LYS 34 CO 0.02 0.49 -0.15 0.14 0.51 0.00 0.00 175.35 176.36 2kt8 s VAL 35 N -1.21 1.34 -0.00 3.17 -7.23 -1.06 -4.94 120.40 110.47 2kt8 s VAL 35 Ca 0.42 -0.61 -0.30 0.00 -1.81 0.00 0.00 61.98 59.68 2kt8 s VAL 35 Cb -0.26 -1.20 -0.05 0.00 0.56 0.00 0.00 36.38 35.43 2kt8 s VAL 35 CO 0.32 0.40 1.29 -0.89 -0.31 0.00 0.00 175.10 175.91 2kt8 s THR 36 N 0.54 3.93 -0.19 5.32 2.01 -1.26 -2.35 115.64 123.64 2kt8 s THR 36 Ca -0.15 1.32 -0.05 0.00 0.31 0.00 0.00 61.69 63.12 2kt8 s THR 36 Cb -0.16 -3.85 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 2kt8 s THR 36 CO 0.05 0.02 0.01 -0.63 -0.69 0.00 0.00 174.62 173.38 2kt8 s ILE 37 N 2.01 4.16 -1.04 1.82 1.01 0.78 -2.62 121.20 127.31 2kt8 s ILE 37 Ca 0.60 -0.25 0.10 0.00 0.00 0.00 0.00 60.65 61.11 2kt8 s ILE 37 Cb -0.29 -2.87 0.02 0.00 0.01 0.00 0.00 42.46 39.33 2kt8 s ILE 37 CO 0.26 0.44 0.69 1.33 0.00 0.00 0.00 174.94 177.66 2kt8 n VAL 38 N 3.97 0.00 -1.84 2.92 0.24 -1.13 -2.63 118.33 119.87 2kt8 n VAL 38 Ca -0.17 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.70 2kt8 n VAL 38 Cb 0.52 1.15 0.00 0.00 -1.47 0.00 0.00 33.84 34.04 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 0.80 -1.29 3.06 7.63 0.00 -1.24 -4.99 105.19 109.15 2kt8 n GLY 39 Ca 0.05 -0.94 -0.08 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.99 0.50 -0.23 1.61 -1.05 -1.26 -2.03 118.70 115.24 2kt8 s GLU 40 Ca 0.00 -0.88 -0.04 0.00 -0.15 0.00 0.00 54.97 53.90 2kt8 s GLU 40 Cb 0.00 0.18 0.12 0.00 -0.44 0.00 0.00 34.13 34.00 2kt8 s GLU 40 CO 0.00 -0.10 0.38 -2.00 0.95 0.00 0.00 175.26 174.49 2kt8 s GLU 41 N -2.72 0.34 4.87 -4.83 2.56 -0.66 -4.82 118.70 113.44 2kt8 s GLU 41 Ca -0.04 0.63 0.00 0.00 0.00 0.00 0.00 54.97 55.56 2kt8 s GLU 41 Cb -0.01 -0.33 0.00 0.00 2.00 0.00 0.00 34.13 35.80 2kt8 s GLU 41 CO -0.05 -0.56 0.00 0.41 -0.56 0.00 0.00 175.26 174.49 2kt8 n GLY 42 N 5.37 1.84 1.04 -1.50 0.00 -1.26 -2.01 105.19 108.67 2kt8 n GLY 42 Ca -0.05 -0.53 -0.02 0.00 0.00 0.00 0.00 46.02 45.43 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 6.98 2.99 -2.60 4.61 0.00 -1.26 -4.81 120.51 126.42 2kt8 n ALA 43 Ca 0.00 -0.53 -0.17 0.00 0.00 0.00 0.00 53.44 52.75 2kt8 n ALA 43 Cb 0.00 -1.06 -0.11 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.06 1.16 -0.11 0.00 0.40 -0.85 -2.39 117.98 115.13 2kt8 s PHE 44 Ca 0.12 -0.55 -0.05 0.00 -0.60 0.00 0.00 56.93 55.86 2kt8 s PHE 44 Cb 0.10 -0.64 -0.04 0.00 0.51 0.00 0.00 43.02 42.95 2kt8 s PHE 44 CO 0.03 0.05 0.08 0.71 0.70 0.00 0.00 175.22 176.78 2kt8 s TYR 45 N -1.84 3.39 -0.11 0.36 2.02 0.15 -1.65 117.35 119.68 2kt8 s TYR 45 Ca 0.02 0.35 -0.19 0.00 -0.37 0.00 0.00 57.07 56.88 2kt8 s TYR 45 Cb -0.07 -1.89 -0.04 0.00 -0.40 0.00 0.00 41.96 39.56 2kt8 s TYR 45 CO 0.02 0.58 0.53 0.21 -1.57 0.00 0.00 175.55 175.31 2kt8 s LYS 46 N -0.84 4.35 0.11 -0.62 2.20 -0.86 -2.58 119.74 121.50 2kt8 s LYS 46 Ca 0.13 0.54 0.05 0.00 -0.36 0.00 0.00 55.97 56.33 2kt8 s LYS 46 Cb -0.12 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.72 2kt8 s LYS 46 CO 0.03 0.12 -0.13 0.96 -0.36 0.00 0.00 175.35 175.97 2kt8 s ILE 47 N 0.71 1.18 -0.70 5.43 -4.36 -0.74 -2.82 121.20 119.90 2kt8 s ILE 47 Ca 0.28 -1.65 -0.25 0.00 -0.26 0.00 0.00 60.65 58.77 2kt8 s ILE 47 Cb -0.16 -1.43 0.05 0.00 1.25 0.00 0.00 42.46 42.17 2kt8 s ILE 47 CO 0.12 -0.45 1.15 -0.70 0.24 0.00 0.00 174.94 175.30 2kt8 s GLU 48 N -2.63 3.17 0.31 0.37 2.56 -1.08 -1.94 118.70 119.46 2kt8 s GLU 48 Ca 0.07 -0.45 -0.20 0.00 0.00 0.00 0.00 54.97 54.39 2kt8 s GLU 48 Cb -0.05 -4.19 -0.09 0.00 2.00 0.00 0.00 34.13 31.80 2kt8 s GLU 48 CO 0.02 -2.00 0.81 -0.47 -0.56 0.00 0.00 175.26 173.06 2kt8 s TYR 49 N 5.04 3.51 -0.44 5.30 5.04 0.12 -4.84 117.35 131.10 2kt8 s TYR 49 Ca 0.30 1.45 -0.27 0.00 -2.44 0.00 0.00 57.07 56.12 2kt8 s TYR 49 Cb -0.11 -2.69 -0.05 0.00 0.35 0.00 0.00 41.96 39.45 2kt8 s TYR 49 CO 0.14 0.16 2.24 0.15 -1.34 0.00 0.00 175.55 176.90 2kt8 s LYS 50 N -2.50 2.49 0.00 4.97 1.02 -1.26 -1.26 119.74 123.19 2kt8 s LYS 50 Ca 0.51 1.42 0.00 0.00 0.02 0.00 0.00 55.97 57.92 2kt8 s LYS 50 Cb -0.14 -4.48 0.00 0.00 -0.52 0.00 0.00 37.83 32.69 2kt8 s LYS 50 CO 0.19 -2.84 0.00 0.41 -0.92 0.00 0.00 175.35 172.19 2kt8 n GLY 51 N 5.86 0.21 0.00 -3.33 0.00 -1.26 -5.01 105.19 101.66 2kt8 n GLY 51 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2kt8 n GLY 51 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kt8 n SER 52 N 0.00 0.00 -4.31 1.61 7.64 -0.39 -5.13 113.62 113.04 2kt8 n SER 52 Ca 0.00 -0.61 -0.36 0.00 1.01 0.00 0.00 58.87 58.91 2kt8 n SER 52 Cb 0.00 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.07 2kt8 n SER 52 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2kt8 s HIS 53 N -4.72 3.10 0.24 1.43 0.09 -1.26 -0.70 115.29 113.47 2kt8 s HIS 53 Ca 0.00 -1.07 -0.07 0.00 -0.00 0.00 0.00 55.06 53.92 2kt8 s HIS 53 Cb 0.00 -2.19 -0.06 0.00 -0.00 0.00 0.00 32.58 30.33 2kt8 s HIS 53 CO 0.00 -0.59 0.52 0.20 -0.00 0.00 0.00 174.74 174.87 2kt8 s GLY 54 N 1.46 2.08 -0.03 -2.22 0.00 -0.82 -4.75 107.32 103.05 2kt8 s GLY 54 Ca 0.03 -0.45 0.05 0.00 0.00 0.00 0.00 44.72 44.35 2kt8 s GLY 54 CO 0.00 -0.33 -0.17 -0.19 0.00 0.00 0.00 173.10 172.41 2kt8 s TYR 55 N -1.91 1.60 -0.01 1.90 1.51 -0.43 -1.79 117.35 118.22 2kt8 s TYR 55 Ca 0.45 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 56.15 2kt8 s TYR 55 Cb -0.11 -1.06 -0.00 0.00 -0.11 0.00 0.00 41.96 40.68 2kt8 s TYR 55 CO 0.26 -0.09 -0.06 0.14 -1.11 0.00 0.00 175.55 174.69 2kt8 s VAL 56 N -0.19 0.45 0.55 0.71 -7.23 -1.06 -2.20 120.40 111.43 2kt8 s VAL 56 Ca 0.02 -0.24 -0.20 0.00 -1.81 0.00 0.00 61.98 59.75 2kt8 s VAL 56 Cb -0.09 -0.39 -0.05 0.00 0.56 0.00 0.00 36.38 36.41 2kt8 s VAL 56 CO 0.01 0.13 1.16 0.00 -0.31 0.00 0.00 175.10 176.09 2kt8 s ALA 57 N -0.09 2.68 0.38 1.32 0.00 -1.26 -0.67 121.76 124.12 2kt8 s ALA 57 Ca 0.02 0.91 0.07 0.00 0.00 0.00 0.00 51.96 52.95 2kt8 s ALA 57 Cb -0.03 -3.40 0.76 0.00 0.00 0.00 0.00 23.12 20.46 2kt8 s ALA 57 CO -0.00 -0.90 1.97 0.87 0.00 0.00 0.00 175.76 177.70 2kt8 h LYS 58 N 1.19 0.46 -0.54 0.00 1.57 -1.80 -2.16 116.57 115.29 2kt8 h LYS 58 Ca -0.50 -0.07 0.14 0.00 -1.87 0.00 0.00 60.65 58.35 2kt8 h LYS 58 Cb 1.27 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.47 2kt8 h LYS 58 CO 0.57 0.42 0.38 0.93 -0.57 0.00 0.00 179.45 181.18 2kt8 h GLU 59 N 0.46 0.10 -0.01 3.15 3.07 -1.91 0.37 114.58 119.80 2kt8 h GLU 59 Ca 0.11 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 2kt8 h GLU 59 Cb 0.16 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 2kt8 h GLU 59 CO -0.01 0.07 -0.26 0.66 -1.40 0.00 0.00 179.01 178.07 2kt8 n TYR 60 N -4.41 0.00 -4.74 4.33 4.01 -0.82 -4.83 117.16 110.70 2kt8 n TYR 60 Ca 0.10 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.51 2kt8 n TYR 60 Cb 0.54 -0.07 -0.15 0.00 -0.31 0.00 0.00 39.34 39.36 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 -2.40 2.99 0.14 -0.72 -1.09 0.13 -2.32 121.20 117.93 2kt8 s ILE 61 Ca 0.25 -0.68 0.03 0.00 -2.23 0.00 0.00 60.65 58.02 2kt8 s ILE 61 Cb 0.19 -2.25 -0.01 0.00 -1.58 0.00 0.00 42.46 38.81 2kt8 s ILE 61 CO 0.49 0.52 0.13 2.29 -1.23 0.00 0.00 174.94 177.15 2kt8 n LYS 62 N 3.62 0.19 0.00 2.79 2.85 -0.94 -4.84 118.16 121.83 2kt8 n LYS 62 Ca -0.18 -1.39 0.00 0.00 -1.05 0.00 0.00 58.31 55.68 2kt8 n LYS 62 Cb 0.53 1.17 0.00 0.00 -0.65 0.00 0.00 35.03 36.07 2kt8 n LYS 62 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2kt8 n ASP 63 N -2.37 0.00 -1.54 -5.58 8.00 -1.26 -2.83 116.55 110.97 2kt8 n ASP 63 Ca 0.03 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.54 2kt8 n ASP 63 Cb 0.26 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.35 2kt8 n ASP 63 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2kt8 n ILE 64 N 0.00 -2.54 -3.99 0.53 5.41 -1.26 -4.86 119.36 112.65 2kt8 n ILE 64 Ca 0.00 1.30 -0.33 0.00 1.00 0.00 0.00 62.75 64.72 2kt8 n ILE 64 Cb 0.00 -2.16 -0.14 0.00 -0.71 0.00 0.00 39.64 36.63 2kt8 n ILE 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2kt8 s LYS 65 N -5.25 2.24 -0.38 0.38 1.02 -0.88 -4.98 119.74 111.91 2kt8 s LYS 65 Ca 0.00 -1.38 -0.22 0.00 0.02 0.00 0.00 55.97 54.39 2kt8 s LYS 65 Cb 0.00 -3.07 0.01 0.00 -0.52 0.00 0.00 37.83 34.25 2kt8 s LYS 65 CO 0.00 -0.64 0.73 -0.51 -0.92 0.00 0.00 175.35 174.01 2kt8 s ASP 66 N 1.18 6.48 0.00 2.83 1.01 -1.26 -4.11 116.67 122.80 2kt8 s ASP 66 Ca -0.05 0.19 0.28 0.00 0.71 0.00 0.00 52.55 53.69 2kt8 s ASP 66 Cb -0.20 -2.37 1.13 0.00 1.01 0.00 0.00 42.92 42.50 2kt8 s ASP 66 CO -0.04 -0.71 1.79 -0.62 0.21 0.00 0.00 175.17 175.80 2kt8 n GLU 67 N 6.33 1.19 -3.45 8.23 1.02 -1.26 -4.73 120.64 127.97 2kt8 n GLU 67 Ca 0.01 -0.58 -0.04 0.00 -0.02 0.00 0.00 57.16 56.54 2kt8 n GLU 67 Cb 0.48 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.36 2kt8 n GLU 67 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2kt8 s VAL 68 N -2.21 -0.81 0.26 2.62 0.11 -1.26 -5.11 120.40 114.00 2kt8 s VAL 68 Ca 0.34 0.03 -0.28 0.00 -2.93 0.00 0.00 61.98 59.14 2kt8 s VAL 68 Cb 0.21 -0.87 -0.09 0.00 -1.53 0.00 0.00 36.38 34.10 2kt8 s VAL 68 CO 0.41 -0.01 0.93 -0.76 -3.33 0.00 0.00 175.10 172.33 2kt8 s LEU 69 N 2.73 4.55 0.59 2.54 1.43 -1.26 -5.05 118.68 124.20 2kt8 s LEU 69 Ca 0.07 1.88 -0.08 0.00 -1.03 0.00 0.00 54.13 54.97 2kt8 s LEU 69 Cb -0.14 -3.71 -0.01 0.00 0.03 0.00 0.00 46.19 42.36 2kt8 s LEU 69 CO -0.17 0.09 0.93 -1.61 0.23 0.00 0.00 176.35 175.82 2kt8 s GLU 70 N -1.45 3.23 0.00 1.70 2.02 -1.26 -3.75 118.70 119.19 2kt8 s GLU 70 Ca 0.43 0.30 0.00 0.00 0.02 0.00 0.00 54.97 55.72 2kt8 s GLU 70 Cb -0.23 -2.22 0.00 0.00 0.10 0.00 0.00 34.13 31.78 2kt8 s GLU 70 CO 0.29 -0.59 0.00 1.58 0.02 0.00 0.00 175.26 176.56 2kt8 n HIS 71 N -2.60 0.00 1.13 1.61 -0.00 -1.26 -4.67 115.22 109.42 2kt8 n HIS 71 Ca 0.04 0.00 0.13 0.00 0.46 0.00 0.00 57.72 58.35 2kt8 n HIS 71 Cb 0.56 -0.73 0.34 0.00 -0.12 0.00 0.00 29.99 30.04 2kt8 n HIS 71 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2kt8 n HIS 72 N -2.00 0.00 -2.34 1.57 8.25 -1.25 -4.89 115.22 114.57 2kt8 n HIS 72 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.07 2kt8 n HIS 72 Cb 0.00 -0.20 -0.03 0.00 1.12 0.00 0.00 29.99 30.88 2kt8 n HIS 72 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2kt8 s HIS 73 N -2.76 3.21 -0.41 4.41 3.76 -1.26 -5.01 115.29 117.23 2kt8 s HIS 73 Ca 0.18 1.58 0.02 0.00 -0.15 0.00 0.00 55.06 56.68 2kt8 s HIS 73 Cb 0.18 -3.38 0.14 0.00 1.11 0.00 0.00 32.58 30.63 2kt8 s HIS 73 CO 0.60 -1.14 0.23 -3.38 -0.85 0.00 0.00 174.74 170.21 2kt8 s HIS 74 N -1.33 1.58 -0.16 1.40 -3.43 -1.26 -4.98 115.29 107.11 2kt8 s HIS 74 Ca 0.53 -2.18 -0.15 0.00 -0.80 0.00 0.00 55.06 52.46 2kt8 s HIS 74 Cb -0.31 -1.57 0.02 0.00 -1.43 0.00 0.00 32.58 29.29 2kt8 s HIS 74 CO 0.40 -0.80 0.24 1.58 -2.00 0.00 0.00 174.74 174.17 2kt8 n HIS 75 N 3.68 -0.99 0.00 0.38 -0.00 -1.26 -5.30 115.22 111.73 2kt8 n HIS 75 Ca 0.10 0.41 0.00 0.00 0.46 0.00 0.00 57.72 58.70 2kt8 n HIS 75 Cb 0.36 -1.27 0.00 0.00 -0.12 0.00 0.00 29.99 28.95 2kt8 n HIS 75 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38