#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 4.34 0.04 0.00 2.02 -1.26 -4.87 118.70 118.97 2kt8 s GLU 2 Ca 0.00 2.21 0.02 0.00 0.02 0.00 0.00 54.97 57.22 2kt8 s GLU 2 Cb 0.00 -3.11 -0.03 0.00 0.10 0.00 0.00 34.13 31.10 2kt8 s GLU 2 CO 0.00 -0.27 -0.07 0.15 0.02 0.00 0.00 175.26 175.09 2kt8 s LYS 3 N -1.03 0.53 -0.10 1.61 1.02 -1.07 -4.85 119.74 115.86 2kt8 s LYS 3 Ca 0.54 -0.81 0.03 0.00 0.02 0.00 0.00 55.97 55.74 2kt8 s LYS 3 Cb -0.40 -0.21 0.01 0.00 -0.52 0.00 0.00 37.83 36.71 2kt8 s LYS 3 CO 0.47 0.02 -0.19 0.95 -0.92 0.00 0.00 175.35 175.69 2kt8 s THR 4 N -1.70 1.68 -0.16 2.17 -4.23 -1.24 0.34 115.64 112.49 2kt8 s THR 4 Ca -0.08 -0.78 -0.04 0.00 -1.18 0.00 0.00 61.69 59.60 2kt8 s THR 4 Cb -0.08 -1.49 -0.03 0.00 1.34 0.00 0.00 72.50 72.24 2kt8 s THR 4 CO -0.01 0.48 -0.02 -0.83 -0.54 0.00 0.00 174.62 173.70 2kt8 s GLY 5 N 0.61 1.76 -0.09 3.99 0.00 -1.09 -1.29 107.32 111.21 2kt8 s GLY 5 Ca -0.14 -0.81 -0.29 0.00 0.00 0.00 0.00 44.72 43.48 2kt8 s GLY 5 CO 0.04 -0.04 1.00 -0.42 0.00 0.00 0.00 173.10 173.68 2kt8 s ILE 6 N 0.37 4.80 0.02 0.90 1.09 -0.87 -2.27 121.20 125.24 2kt8 s ILE 6 Ca -0.03 2.04 -0.28 0.00 -1.10 0.00 0.00 60.65 61.28 2kt8 s ILE 6 Cb -0.14 -4.31 -0.04 0.00 -1.06 0.00 0.00 42.46 36.91 2kt8 s ILE 6 CO 0.02 0.04 0.90 -0.69 -0.10 0.00 0.00 174.94 175.11 2kt8 s VAL 7 N 1.81 4.80 -0.34 2.92 1.01 -0.93 -1.62 120.40 128.05 2kt8 s VAL 7 Ca 0.49 1.90 0.04 0.00 0.00 0.00 0.00 61.98 64.41 2kt8 s VAL 7 Cb -0.19 -4.25 0.10 0.00 0.00 0.00 0.00 36.38 32.05 2kt8 s VAL 7 CO 0.20 0.24 0.05 0.20 0.00 0.00 0.00 175.10 175.78 2kt8 s ASN 8 N 0.61 4.76 -0.02 3.32 0.02 -1.05 -1.34 114.94 121.23 2kt8 s ASN 8 Ca 0.47 -2.15 -0.01 0.00 -1.02 0.00 0.00 52.86 50.15 2kt8 s ASN 8 Cb -0.21 -1.62 0.01 0.00 0.02 0.00 0.00 41.25 39.46 2kt8 s ASN 8 CO 0.26 -0.38 0.05 0.68 0.02 0.00 0.00 177.10 177.73 2kt8 s VAL 9 N 0.91 -0.02 0.15 1.60 -7.23 -1.26 -4.85 120.40 109.70 2kt8 s VAL 9 Ca 0.11 0.08 -0.15 0.00 -1.81 0.00 0.00 61.98 60.21 2kt8 s VAL 9 Cb -0.19 -0.08 0.02 0.00 0.56 0.00 0.00 36.38 36.69 2kt8 s VAL 9 CO -0.08 0.03 1.74 -1.28 -0.31 0.00 0.00 175.10 175.20 2kt8 h SER 10 N 6.54 0.58 0.00 4.85 0.87 -2.03 -3.40 113.55 120.96 2kt8 h SER 10 Ca -0.32 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 2kt8 h SER 10 Cb 1.18 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 2kt8 h SER 10 CO 0.48 0.53 0.00 -1.20 -0.53 0.00 0.00 176.83 176.10 2kt8 n SER 11 N -4.67 0.00 -3.64 6.23 7.64 -1.26 -5.01 113.62 112.91 2kt8 n SER 11 Ca 0.01 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.81 2kt8 n SER 11 Cb 0.10 -0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.27 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 -1.08 -0.15 -0.11 6.43 0.01 -1.26 -4.38 113.70 113.16 2kt8 s SER 12 Ca 0.00 -0.79 0.02 0.00 1.31 0.00 0.00 55.95 56.49 2kt8 s SER 12 Cb 0.00 0.74 -0.01 0.00 0.21 0.00 0.00 66.02 66.96 2kt8 s SER 12 CO 0.00 -1.41 -0.17 -0.22 0.41 0.00 0.00 173.24 171.85 2kt8 s LEU 13 N -2.97 2.49 0.30 2.44 2.96 -1.09 -4.92 118.68 117.89 2kt8 s LEU 13 Ca 0.14 -0.40 -0.07 0.00 -0.22 0.00 0.00 54.13 53.58 2kt8 s LEU 13 Cb -0.05 -1.53 -0.06 0.00 0.50 0.00 0.00 46.19 45.05 2kt8 s LEU 13 CO 0.09 0.19 0.59 0.54 -1.32 0.00 0.00 176.35 176.44 2kt8 s ASN 14 N 0.19 6.49 -0.17 3.68 2.20 -1.26 -0.85 114.94 125.22 2kt8 s ASN 14 Ca -0.10 0.83 -0.06 0.00 -0.94 0.00 0.00 52.86 52.58 2kt8 s ASN 14 Cb -0.16 -2.19 -0.04 0.00 -2.00 0.00 0.00 41.25 36.86 2kt8 s ASN 14 CO 0.06 -0.21 0.03 -0.69 -2.94 0.00 0.00 177.10 173.35 2kt8 s VAL 15 N -2.09 4.52 -0.08 3.54 1.01 -0.94 -4.92 120.40 121.45 2kt8 s VAL 15 Ca 0.46 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.32 2kt8 s VAL 15 Cb -0.11 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 2kt8 s VAL 15 CO 0.29 0.48 -0.10 -0.13 0.00 0.00 0.00 175.10 175.63 2kt8 s ARG 16 N 0.32 2.81 0.03 2.72 0.52 -1.08 -3.26 118.95 121.02 2kt8 s ARG 16 Ca 0.01 -0.62 0.11 0.00 -0.52 0.00 0.00 55.73 54.72 2kt8 s ARG 16 Cb -0.13 -2.54 -0.20 0.00 0.52 0.00 0.00 34.95 32.60 2kt8 s ARG 16 CO 0.01 0.56 0.91 0.93 0.02 0.00 0.00 175.30 177.73 2kt8 h GLU 17 N 5.58 0.00 -5.95 3.54 4.39 -1.79 0.28 114.58 120.62 2kt8 h GLU 17 Ca -0.44 0.00 -0.61 0.00 0.34 0.00 0.00 59.36 58.65 2kt8 h GLU 17 Cb 1.17 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.78 2kt8 h GLU 17 CO 0.53 0.63 -0.43 0.20 -1.16 0.00 0.00 179.01 178.78 2kt8 s GLY 18 N -4.92 2.21 -1.37 -3.84 0.00 -1.26 -4.77 107.32 93.37 2kt8 s GLY 18 Ca -0.02 -0.71 -0.14 0.00 0.00 0.00 0.00 44.72 43.85 2kt8 s GLY 18 CO 0.82 -0.63 1.98 0.00 0.00 0.00 0.00 173.10 175.27 2kt8 n ALA 19 N 0.50 4.91 -3.00 3.20 0.00 -1.26 -4.52 120.51 120.34 2kt8 n ALA 19 Ca -0.06 -3.99 0.00 0.00 0.00 0.00 0.00 53.44 49.39 2kt8 n ALA 19 Cb 0.52 -3.41 0.00 0.00 0.00 0.00 0.00 19.45 16.56 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 6.16 0.00 -4.55 0.00 7.64 -1.26 -5.05 113.62 116.56 2kt8 n SER 20 Ca 0.48 -0.94 -0.41 0.00 1.01 0.00 0.00 58.87 59.00 2kt8 n SER 20 Cb 0.40 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.57 2kt8 n SER 20 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2kt8 s THR 21 N -2.95 3.85 -1.22 0.44 -4.23 -1.26 -4.01 115.64 106.25 2kt8 s THR 21 Ca 0.00 0.47 -0.03 0.00 -1.18 0.00 0.00 61.69 60.95 2kt8 s THR 21 Cb 0.00 -4.85 -0.01 0.00 1.34 0.00 0.00 72.50 68.98 2kt8 s THR 21 CO 0.00 -1.70 0.84 -0.24 -0.54 0.00 0.00 174.62 172.99 2kt8 n SER 22 N 9.00 -2.64 -0.22 3.99 2.88 -1.26 -4.89 113.62 120.49 2kt8 n SER 22 Ca 0.04 -0.75 -0.07 0.00 -1.33 0.00 0.00 58.87 56.76 2kt8 n SER 22 Cb 0.49 -4.55 0.03 0.00 -0.75 0.00 0.00 64.21 59.43 2kt8 n SER 22 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2kt8 h SER 23 N -1.76 0.79 -0.75 -3.46 4.64 -1.79 -3.44 113.55 107.78 2kt8 h SER 23 Ca -0.61 -0.13 0.19 0.00 -0.47 0.00 0.00 61.79 60.78 2kt8 h SER 23 Cb 1.34 -0.20 -0.23 0.00 -0.31 0.00 0.00 62.40 63.00 2kt8 h SER 23 CO 0.52 0.70 0.17 -0.75 -0.87 0.00 0.00 176.83 176.59 2kt8 s LYS 24 N -5.72 0.27 -0.10 4.77 2.20 -1.26 -4.86 119.74 115.04 2kt8 s LYS 24 Ca -0.13 0.60 -0.20 0.00 -0.36 0.00 0.00 55.97 55.89 2kt8 s LYS 24 Cb 0.13 0.35 -0.04 0.00 -1.51 0.00 0.00 37.83 36.76 2kt8 s LYS 24 CO 0.78 -0.17 0.54 0.08 -0.36 0.00 0.00 175.35 176.22 2kt8 s VAL 25 N 2.63 5.14 -0.11 4.02 1.01 -1.26 -2.50 120.40 129.34 2kt8 s VAL 25 Ca 0.00 1.08 0.03 0.00 0.00 0.00 0.00 61.98 63.09 2kt8 s VAL 25 Cb -0.08 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 2kt8 s VAL 25 CO -0.16 0.31 0.11 2.30 0.00 0.00 0.00 175.10 177.66 2kt8 n ILE 26 N 3.66 0.00 -3.18 2.22 -5.35 -1.20 -5.05 119.36 110.45 2kt8 n ILE 26 Ca -0.06 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 2kt8 n ILE 26 Cb 0.52 0.91 0.00 0.00 -1.74 0.00 0.00 39.64 39.32 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 1.27 -0.73 3.65 3.28 0.00 -1.26 -5.05 105.19 106.36 2kt8 n GLY 27 Ca 0.00 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 2kt8 n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kt8 s SER 28 N -4.00 -0.19 0.12 1.61 0.15 -1.26 -2.22 113.70 107.90 2kt8 s SER 28 Ca 0.00 -0.70 0.07 0.00 0.70 0.00 0.00 55.95 56.02 2kt8 s SER 28 Cb 0.00 0.63 -0.04 0.00 -1.71 0.00 0.00 66.02 64.90 2kt8 s SER 28 CO 0.00 -1.18 -0.17 -0.76 1.20 0.00 0.00 173.24 172.33 2kt8 s LEU 29 N -2.95 2.36 0.59 3.45 1.43 -0.03 -4.94 118.68 118.60 2kt8 s LEU 29 Ca 0.15 -0.76 -0.17 0.00 -1.03 0.00 0.00 54.13 52.32 2kt8 s LEU 29 Cb -0.02 -0.71 -0.03 0.00 0.03 0.00 0.00 46.19 45.45 2kt8 s LEU 29 CO 0.05 -0.05 1.09 -0.44 0.23 0.00 0.00 176.35 177.24 2kt8 s SER 30 N -2.24 5.58 0.90 2.29 0.01 -1.26 -2.66 113.70 116.33 2kt8 s SER 30 Ca 0.08 2.00 -0.10 0.00 1.31 0.00 0.00 55.95 59.24 2kt8 s SER 30 Cb -0.07 -2.56 0.14 0.00 0.21 0.00 0.00 66.02 63.74 2kt8 s SER 30 CO 0.04 -1.31 1.13 -0.83 0.41 0.00 0.00 173.24 172.69 2kt8 s GLY 31 N -2.33 1.68 0.00 3.44 0.00 -1.26 -2.49 107.32 106.35 2kt8 s GLY 31 Ca 0.68 0.51 0.00 0.00 0.00 0.00 0.00 44.72 45.91 2kt8 s GLY 31 CO 0.34 0.93 0.00 -2.01 0.00 0.00 0.00 173.10 172.36 2kt8 n ASN 32 N -4.16 -2.80 -4.72 1.64 5.15 -0.45 -4.93 115.26 104.99 2kt8 n ASN 32 Ca 0.11 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.68 2kt8 n ASN 32 Cb 0.52 -2.71 -0.04 0.00 -0.53 0.00 0.00 39.78 37.03 2kt8 n ASN 32 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2kt8 s THR 33 N -1.21 4.89 0.26 -0.44 2.01 -1.04 -4.60 115.64 115.51 2kt8 s THR 33 Ca 0.00 1.81 -0.16 0.00 0.31 0.00 0.00 61.69 63.65 2kt8 s THR 33 Cb 0.00 -4.20 -0.08 0.00 0.01 0.00 0.00 72.50 68.22 2kt8 s THR 33 CO 0.00 0.22 0.69 -1.59 -0.69 0.00 0.00 174.62 173.25 2kt8 s LYS 34 N 0.75 4.07 -0.07 4.92 -2.85 -1.26 -2.20 119.74 123.10 2kt8 s LYS 34 Ca 0.45 0.68 0.04 0.00 -1.00 0.00 0.00 55.97 56.14 2kt8 s LYS 34 Cb -0.20 -2.67 -0.00 0.00 -2.06 0.00 0.00 37.83 32.90 2kt8 s LYS 34 CO 0.24 0.29 -0.20 0.14 0.10 0.00 0.00 175.35 175.93 2kt8 s VAL 35 N -1.74 1.71 0.12 1.79 -7.23 -0.96 -4.93 120.40 109.15 2kt8 s VAL 35 Ca 0.48 -0.85 -0.31 0.00 -1.81 0.00 0.00 61.98 59.49 2kt8 s VAL 35 Cb -0.13 -1.47 -0.08 0.00 0.56 0.00 0.00 36.38 35.26 2kt8 s VAL 35 CO 0.19 0.48 1.35 -0.89 -0.31 0.00 0.00 175.10 175.92 2kt8 s THR 36 N 0.18 3.40 -0.16 5.32 2.01 -1.26 -2.68 115.64 122.44 2kt8 s THR 36 Ca -0.10 1.02 -0.04 0.00 0.31 0.00 0.00 61.69 62.89 2kt8 s THR 36 Cb -0.15 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 2kt8 s THR 36 CO 0.05 0.09 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.40 2kt8 s ILE 37 N 0.94 3.84 0.00 1.82 1.01 0.15 -2.71 121.20 126.26 2kt8 s ILE 37 Ca 0.62 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.90 2kt8 s ILE 37 Cb -0.36 -2.69 0.00 0.00 0.01 0.00 0.00 42.46 39.43 2kt8 s ILE 37 CO 0.31 0.49 0.75 1.33 0.00 0.00 0.00 174.94 177.82 2kt8 n VAL 38 N 3.63 0.51 -3.88 2.92 0.24 -1.15 -2.59 118.33 118.01 2kt8 n VAL 38 Ca -0.17 -0.74 -0.00 0.00 -2.04 0.00 0.00 64.34 61.39 2kt8 n VAL 38 Cb 0.52 0.76 0.01 0.00 -1.47 0.00 0.00 33.84 33.66 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 -0.51 -0.08 0.13 7.63 0.00 -1.25 -5.05 107.32 108.20 2kt8 s GLY 39 Ca 0.00 -0.01 0.07 0.00 0.00 0.00 0.00 44.72 44.78 2kt8 s GLY 39 CO 0.00 3.29 -0.17 -0.54 0.00 0.00 0.00 173.10 175.68 2kt8 s GLU 40 N -2.21 1.14 -0.35 2.90 2.02 -1.26 -2.39 118.70 118.55 2kt8 s GLU 40 Ca 0.23 -1.28 0.03 0.00 0.02 0.00 0.00 54.97 53.97 2kt8 s GLU 40 Cb -0.01 -1.18 0.16 0.00 0.10 0.00 0.00 34.13 33.20 2kt8 s GLU 40 CO 0.01 0.25 0.42 -2.00 0.02 0.00 0.00 175.26 173.96 2kt8 s GLU 41 N -2.53 0.59 4.40 1.61 -6.30 -0.07 -4.75 118.70 111.65 2kt8 s GLU 41 Ca 0.11 -0.46 0.00 0.00 -2.50 0.00 0.00 54.97 52.12 2kt8 s GLU 41 Cb -0.07 -0.47 0.00 0.00 0.00 0.00 0.00 34.13 33.59 2kt8 s GLU 41 CO 0.05 -1.14 0.00 0.41 0.02 0.00 0.00 175.26 174.60 2kt8 n GLY 42 N 4.63 2.90 1.15 -1.50 0.00 -1.26 -0.15 105.19 110.96 2kt8 n GLY 42 Ca 0.07 -0.14 -0.03 0.00 0.00 0.00 0.00 46.02 45.92 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 9.14 3.17 -3.30 4.61 0.00 -1.26 -4.76 120.51 128.12 2kt8 n ALA 43 Ca 0.00 -0.71 -0.15 0.00 0.00 0.00 0.00 53.44 52.57 2kt8 n ALA 43 Cb 0.00 -1.09 -0.15 0.00 0.00 0.00 0.00 19.45 18.21 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 -1.22 0.25 0.17 0.00 0.40 0.79 -2.41 117.98 115.96 2kt8 s PHE 44 Ca 0.16 -0.01 -0.16 0.00 -0.60 0.00 0.00 56.93 56.33 2kt8 s PHE 44 Cb 0.13 -0.27 -0.07 0.00 0.51 0.00 0.00 43.02 43.32 2kt8 s PHE 44 CO 0.04 -0.07 0.60 0.71 0.70 0.00 0.00 175.22 177.20 2kt8 s TYR 45 N 0.51 3.61 -0.12 0.36 2.02 0.33 -0.89 117.35 123.18 2kt8 s TYR 45 Ca -0.05 1.14 -0.19 0.00 -0.37 0.00 0.00 57.07 57.60 2kt8 s TYR 45 Cb -0.08 -2.43 -0.04 0.00 -0.40 0.00 0.00 41.96 39.01 2kt8 s TYR 45 CO -0.01 0.40 0.52 0.21 -1.57 0.00 0.00 175.55 175.10 2kt8 s LYS 46 N -1.97 4.35 0.13 -0.62 2.20 -1.01 -2.53 119.74 120.28 2kt8 s LYS 46 Ca 0.39 0.52 0.06 0.00 -0.36 0.00 0.00 55.97 56.59 2kt8 s LYS 46 Cb -0.15 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 32.68 2kt8 s LYS 46 CO 0.20 0.11 -0.15 0.96 -0.36 0.00 0.00 175.35 176.11 2kt8 s ILE 47 N 0.75 1.42 -0.84 5.43 -4.36 -0.60 -2.93 121.20 120.06 2kt8 s ILE 47 Ca 0.28 -1.72 -0.21 0.00 -0.26 0.00 0.00 60.65 58.74 2kt8 s ILE 47 Cb -0.16 -1.56 0.10 0.00 1.25 0.00 0.00 42.46 42.09 2kt8 s ILE 47 CO 0.12 -0.37 1.12 -1.83 0.24 0.00 0.00 174.94 174.21 2kt8 s GLU 48 N -2.61 3.42 0.24 0.37 -1.05 -1.10 -0.73 118.70 117.25 2kt8 s GLU 48 Ca 0.09 -1.32 -0.06 0.00 -0.15 0.00 0.00 54.97 53.54 2kt8 s GLU 48 Cb -0.06 -4.72 -0.06 0.00 -0.44 0.00 0.00 34.13 28.86 2kt8 s GLU 48 CO 0.04 -1.86 0.51 -0.47 0.95 0.00 0.00 175.26 174.43 2kt8 s TYR 49 N 3.55 3.46 -0.09 4.83 5.04 -0.36 -4.87 117.35 128.91 2kt8 s TYR 49 Ca 0.31 0.65 -0.34 0.00 -2.44 0.00 0.00 57.07 55.25 2kt8 s TYR 49 Cb -0.08 -2.10 -0.11 0.00 0.35 0.00 0.00 41.96 40.01 2kt8 s TYR 49 CO -0.02 0.26 1.90 1.17 -1.34 0.00 0.00 175.55 177.52 2kt8 n LYS 50 N -0.54 2.22 0.00 4.97 4.81 -1.26 -1.59 118.16 126.77 2kt8 n LYS 50 Ca -0.02 0.81 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 2kt8 n LYS 50 Cb 0.53 -2.68 0.00 0.00 0.02 0.00 0.00 35.03 32.90 2kt8 n LYS 50 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2kt8 n GLY 51 N 4.46 3.06 3.83 3.14 0.00 -1.26 -4.98 105.19 113.44 2kt8 n GLY 51 Ca 0.23 -0.85 -0.06 0.00 0.00 0.00 0.00 46.02 45.33 2kt8 n GLY 51 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kt8 s SER 52 N 0.00 -0.02 -0.24 1.61 1.04 -0.62 -5.12 113.70 110.35 2kt8 s SER 52 Ca 0.00 -0.91 -0.28 0.00 0.48 0.00 0.00 55.95 55.24 2kt8 s SER 52 Cb 0.00 0.70 0.01 0.00 0.10 0.00 0.00 66.02 66.83 2kt8 s SER 52 CO 0.00 -1.38 1.00 -1.00 0.98 0.00 0.00 173.24 172.84 2kt8 s HIS 53 N -2.39 3.32 0.54 5.02 0.09 -1.26 -1.23 115.29 119.37 2kt8 s HIS 53 Ca 0.17 1.38 -0.03 0.00 -0.00 0.00 0.00 55.06 56.58 2kt8 s HIS 53 Cb -0.04 -3.25 0.01 0.00 -0.00 0.00 0.00 32.58 29.30 2kt8 s HIS 53 CO 0.08 -0.48 0.80 0.20 -0.00 0.00 0.00 174.74 175.34 2kt8 s GLY 54 N 1.26 1.62 -0.03 -2.22 0.00 0.09 -4.82 107.32 103.23 2kt8 s GLY 54 Ca 0.42 -0.92 0.06 0.00 0.00 0.00 0.00 44.72 44.28 2kt8 s GLY 54 CO 0.07 -0.67 -0.21 -0.19 0.00 0.00 0.00 173.10 172.09 2kt8 s TYR 55 N -2.81 1.97 0.00 1.90 2.02 0.98 -1.56 117.35 119.85 2kt8 s TYR 55 Ca 0.52 -0.45 0.01 0.00 -0.37 0.00 0.00 57.07 56.78 2kt8 s TYR 55 Cb -0.10 -1.28 -0.00 0.00 -0.40 0.00 0.00 41.96 40.17 2kt8 s TYR 55 CO 0.42 -0.09 -0.04 0.14 -1.57 0.00 0.00 175.55 174.41 2kt8 s VAL 56 N -0.33 0.28 0.58 0.71 -7.23 -1.05 -2.63 120.40 110.73 2kt8 s VAL 56 Ca 0.04 -0.21 -0.18 0.00 -1.81 0.00 0.00 61.98 59.81 2kt8 s VAL 56 Cb -0.10 -0.25 -0.04 0.00 0.56 0.00 0.00 36.38 36.55 2kt8 s VAL 56 CO 0.01 0.04 1.15 0.00 -0.31 0.00 0.00 175.10 175.98 2kt8 s ALA 57 N -0.18 2.60 0.47 1.32 0.00 -1.26 -0.51 121.76 124.20 2kt8 s ALA 57 Ca 0.00 0.82 0.18 0.00 0.00 0.00 0.00 51.96 52.97 2kt8 s ALA 57 Cb -0.02 -3.38 1.20 0.00 0.00 0.00 0.00 23.12 20.92 2kt8 s ALA 57 CO -0.00 -0.99 2.06 0.87 0.00 0.00 0.00 175.76 177.70 2kt8 h LYS 58 N 0.87 0.00 -0.51 0.00 1.57 -1.81 -2.26 116.57 114.44 2kt8 h LYS 58 Ca -0.49 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.32 2kt8 h LYS 58 Cb 1.27 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.55 2kt8 h LYS 58 CO 0.56 0.12 0.34 0.93 -0.57 0.00 0.00 179.45 180.82 2kt8 h GLU 59 N 0.00 0.56 -0.01 3.15 4.39 -1.91 0.09 114.58 120.85 2kt8 h GLU 59 Ca -0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2kt8 h GLU 59 Cb 0.22 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2kt8 h GLU 59 CO 0.02 0.37 -0.10 0.66 -1.16 0.00 0.00 179.01 178.80 2kt8 n TYR 60 N -4.47 0.00 -4.67 4.33 4.01 -0.86 -4.81 117.16 110.69 2kt8 n TYR 60 Ca 0.06 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.47 2kt8 n TYR 60 Cb 0.14 -0.05 -0.14 0.00 -0.31 0.00 0.00 39.34 38.98 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 -2.20 3.30 0.01 -0.72 -1.09 0.02 -2.52 121.20 117.99 2kt8 s ILE 61 Ca 0.33 -0.57 0.02 0.00 -2.23 0.00 0.00 60.65 58.19 2kt8 s ILE 61 Cb 0.20 -2.40 -0.01 0.00 -1.58 0.00 0.00 42.46 38.67 2kt8 s ILE 61 CO 0.41 0.52 -0.05 -0.75 -1.23 0.00 0.00 174.94 173.83 2kt8 s LYS 62 N 0.31 0.40 -0.43 2.79 2.20 -0.64 -4.87 119.74 119.50 2kt8 s LYS 62 Ca -0.08 -0.29 -0.11 0.00 -0.36 0.00 0.00 55.97 55.12 2kt8 s LYS 62 Cb -0.15 -0.33 0.01 0.00 -1.51 0.00 0.00 37.83 35.85 2kt8 s LYS 62 CO 0.05 0.09 0.54 -3.47 -0.36 0.00 0.00 175.35 172.20 2kt8 n ASP 63 N 2.64 -7.22 -4.37 1.43 2.03 -1.26 -2.05 116.55 107.76 2kt8 n ASP 63 Ca -0.15 0.37 -0.43 0.00 0.52 0.00 0.00 54.79 55.10 2kt8 n ASP 63 Cb 0.58 -4.86 0.00 0.00 -0.72 0.00 0.00 41.12 36.12 2kt8 n ASP 63 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2kt8 n ILE 64 N -0.60 3.92 -3.97 5.18 5.41 -1.26 -3.59 119.36 124.46 2kt8 n ILE 64 Ca 0.08 -4.02 -0.08 0.00 1.00 0.00 0.00 62.75 59.73 2kt8 n ILE 64 Cb 0.42 -2.42 -0.09 0.00 -0.71 0.00 0.00 39.64 36.85 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 3.44 0.64 -0.47 0.38 1.02 -0.41 -4.74 119.74 119.60 2kt8 s LYS 65 Ca 0.50 -0.95 -0.25 0.00 0.02 0.00 0.00 55.97 55.29 2kt8 s LYS 65 Cb 0.05 0.24 0.03 0.00 -0.52 0.00 0.00 37.83 37.63 2kt8 s LYS 65 CO 0.03 -0.16 0.89 0.34 -0.92 0.00 0.00 175.35 175.53 2kt8 s ASP 66 N -2.54 6.45 0.00 2.83 -1.08 -1.26 -3.65 116.67 117.42 2kt8 s ASP 66 Ca 0.01 -0.01 0.00 0.00 -0.52 0.00 0.00 52.55 52.03 2kt8 s ASP 66 Cb 0.03 -2.43 0.00 0.00 -1.46 0.00 0.00 42.92 39.06 2kt8 s ASP 66 CO -0.08 -1.03 0.00 1.21 0.52 0.00 0.00 175.17 175.79 2kt8 n GLU 67 N 7.07 0.00 -3.59 4.34 4.07 -1.26 -5.02 120.64 126.26 2kt8 n GLU 67 Ca 0.04 0.06 -0.07 0.00 -0.06 0.00 0.00 57.16 57.14 2kt8 n GLU 67 Cb 0.48 -0.38 -0.04 0.00 -0.06 0.00 0.00 31.44 31.45 2kt8 n GLU 67 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2kt8 s VAL 68 N -0.27 0.00 0.46 6.31 0.11 -1.26 -5.15 120.40 120.60 2kt8 s VAL 68 Ca 0.00 0.00 -0.24 0.00 -2.93 0.00 0.00 61.98 58.81 2kt8 s VAL 68 Cb 0.00 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.78 2kt8 s VAL 68 CO 0.00 0.00 1.25 -0.76 -3.33 0.00 0.00 175.10 172.26 2kt8 s LEU 69 N -1.42 4.06 0.28 2.54 1.43 -1.26 -4.92 118.68 119.39 2kt8 s LEU 69 Ca 0.04 2.52 -0.30 0.00 -1.03 0.00 0.00 54.13 55.36 2kt8 s LEU 69 Cb -0.01 -4.12 -0.13 0.00 0.03 0.00 0.00 46.19 41.96 2kt8 s LEU 69 CO -0.03 -1.02 1.36 1.21 0.23 0.00 0.00 176.35 178.10 2kt8 n GLU 70 N -0.37 2.08 -1.95 1.70 2.13 -1.26 -4.97 120.64 118.01 2kt8 n GLU 70 Ca 0.07 0.74 -0.30 0.00 0.66 0.00 0.00 57.16 58.33 2kt8 n GLU 70 Cb 0.46 -2.36 0.05 0.00 0.27 0.00 0.00 31.44 29.86 2kt8 n GLU 70 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2kt8 s HIS 71 N -0.47 3.28 0.19 4.31 5.65 -1.26 -4.97 115.29 122.01 2kt8 s HIS 71 Ca 0.63 0.97 -0.09 0.00 0.25 0.00 0.00 55.06 56.82 2kt8 s HIS 71 Cb -0.61 -3.07 0.09 0.00 -1.18 0.00 0.00 32.58 27.80 2kt8 s HIS 71 CO 0.55 -1.20 1.66 0.45 -0.65 0.00 0.00 174.74 175.55 2kt8 h HIS 72 N -0.64 1.18 -3.18 3.88 -0.00 -2.06 -3.42 115.15 110.91 2kt8 h HIS 72 Ca -0.45 -0.19 -0.66 0.00 -0.00 0.00 0.00 60.37 59.07 2kt8 h HIS 72 Cb 1.26 -0.31 -0.14 0.00 -0.00 0.00 0.00 27.41 28.22 2kt8 h HIS 72 CO 0.48 1.02 -0.59 -1.01 -0.00 0.00 0.00 177.93 177.83 2kt8 s HIS 73 N -5.09 3.25 1.05 2.45 3.76 -1.26 -5.09 115.29 114.36 2kt8 s HIS 73 Ca -0.12 0.21 -0.19 0.00 -0.15 0.00 0.00 55.06 54.81 2kt8 s HIS 73 Cb 0.14 -1.88 0.05 0.00 1.11 0.00 0.00 32.58 32.00 2kt8 s HIS 73 CO 0.86 0.44 -0.30 0.72 -0.85 0.00 0.00 174.74 175.61 2kt8 n HIS 74 N 2.44 -1.58 -0.33 1.40 -0.00 -1.26 -4.84 115.22 111.05 2kt8 n HIS 74 Ca -0.18 0.24 -0.02 0.00 -0.00 0.00 0.00 57.72 57.76 2kt8 n HIS 74 Cb 0.54 -1.47 0.10 0.00 -0.00 0.00 0.00 29.99 29.15 2kt8 n HIS 74 CO 0.00 0.00 0.00 1.12 -0.00 0.00 0.00 176.34 177.46 2kt8 h HIS 75 N -1.97 1.09 0.00 4.41 2.07 -1.98 -3.50 115.15 115.27 2kt8 h HIS 75 Ca -0.43 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.12 2kt8 h HIS 75 Cb 1.20 -0.37 0.00 0.00 2.57 0.00 0.00 27.41 30.82 2kt8 h HIS 75 CO -0.65 0.66 0.00 1.58 -3.07 0.00 0.00 177.93 176.45