#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b2t n GLN 1 N 0.00 0.38 0.00 2.12 1.13 -1.26 -5.07 117.38 114.68 1b2t n GLN 1 Ca 0.00 0.16 0.00 0.00 -1.94 0.00 0.00 57.00 55.22 1b2t n GLN 1 Cb 0.00 -1.13 0.00 0.00 0.11 0.00 0.00 30.24 29.22 1b2t n GLN 1 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 1b2t n HIS 2 N -3.84 0.00 -2.89 1.08 -0.00 -1.26 -5.09 115.22 103.22 1b2t n HIS 2 Ca -0.33 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 56.96 1b2t n HIS 2 Cb 0.71 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.65 1b2t n HIS 2 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1b2t s HIS 3 N 0.00 2.80 0.03 1.57 3.76 -1.26 -4.95 115.29 117.24 1b2t s HIS 3 Ca 0.00 -0.25 0.00 0.00 -0.15 0.00 0.00 55.06 54.66 1b2t s HIS 3 Cb 0.00 -4.06 0.00 0.00 1.11 0.00 0.00 32.58 29.63 1b2t s HIS 3 CO 0.00 -1.39 0.00 0.41 -0.85 0.00 0.00 174.74 172.91 1b2t n GLY 4 N 5.19 -0.44 3.40 -2.22 0.00 -1.26 -4.58 105.19 105.29 1b2t n GLY 4 Ca -0.01 -0.38 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 1b2t n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b2t s VAL 5 N -0.37 4.34 0.49 1.61 0.11 -1.26 -4.61 120.40 120.71 1b2t s VAL 5 Ca 0.00 -0.52 0.08 0.00 -2.93 0.00 0.00 61.98 58.61 1b2t s VAL 5 Cb 0.00 -3.21 0.03 0.00 -1.53 0.00 0.00 36.38 31.66 1b2t s VAL 5 CO 0.00 0.08 0.51 0.42 -3.33 0.00 0.00 175.10 172.79 1b2t s THR 6 N 1.57 2.31 0.00 5.04 -4.23 -1.26 -5.05 115.64 114.02 1b2t s THR 6 Ca 0.04 -1.25 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1b2t s THR 6 Cb -0.17 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.11 1b2t s THR 6 CO 0.05 0.00 0.00 1.17 -0.54 0.00 0.00 174.62 175.30 1b2t n LYS 7 N -1.82 0.00 -4.18 3.99 4.81 -1.26 -4.99 118.16 114.71 1b2t n LYS 7 Ca 0.06 0.00 -0.35 0.00 -0.87 0.00 0.00 58.31 57.15 1b2t n LYS 7 Cb 0.62 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.57 1b2t n LYS 7 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1b2t n ASN 9 N 3.06 -0.32 -3.84 0.00 0.23 -1.26 -3.86 115.26 109.27 1b2t n ASN 9 Ca -0.17 1.21 -0.26 0.00 -0.53 0.00 0.00 54.58 54.83 1b2t n ASN 9 Cb 0.53 -0.34 -0.17 0.00 -2.08 0.00 0.00 39.78 37.72 1b2t n ASN 9 CO 0.00 0.00 0.00 -0.51 -0.93 0.00 0.00 177.26 175.82 1b2t s ILE 10 N -5.82 0.79 -0.54 1.53 2.07 -1.26 -5.10 121.20 112.88 1b2t s ILE 10 Ca -0.10 -0.31 -0.11 0.00 -1.41 0.00 0.00 60.65 58.72 1b2t s ILE 10 Cb 0.18 -0.97 0.14 0.00 0.13 0.00 0.00 42.46 41.94 1b2t s ILE 10 CO 0.53 0.18 0.44 0.28 -1.91 0.00 0.00 174.94 174.47 1b2t s THR 11 N 1.78 4.58 -0.78 4.00 -1.32 -1.25 -4.78 115.64 117.87 1b2t s THR 11 Ca 0.03 -1.88 -0.27 0.00 -1.21 0.00 0.00 61.69 58.36 1b2t s THR 11 Cb -0.14 -3.97 -0.24 0.00 -1.51 0.00 0.00 72.50 66.64 1b2t s THR 11 CO -0.07 -0.84 1.92 0.00 -2.21 0.00 0.00 174.62 173.42 1b2t h SER 13 N 10.44 -0.02 -4.24 0.00 4.64 -1.94 -2.74 113.55 119.69 1b2t h SER 13 Ca 0.16 -0.70 -0.38 0.00 -0.47 0.00 0.00 61.79 60.40 1b2t h SER 13 Cb 0.87 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.90 1b2t h SER 13 CO 1.43 0.71 -0.27 0.29 -0.87 0.00 0.00 176.83 178.12 1b2t n LYS 14 N -4.75 1.26 -5.13 4.77 4.01 -1.26 -4.87 118.16 112.19 1b2t n LYS 14 Ca -0.09 -2.15 -0.32 0.00 -0.51 0.00 0.00 58.31 55.24 1b2t n LYS 14 Cb 0.35 0.55 -0.16 0.00 -0.51 0.00 0.00 35.03 35.26 1b2t n LYS 14 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1b2t s MET 15 N -3.09 2.97 0.08 1.97 -1.94 -1.26 -4.77 119.30 113.25 1b2t s MET 15 Ca 0.02 -0.84 -0.01 0.00 -1.71 0.00 0.00 55.69 53.14 1b2t s MET 15 Cb -0.00 -2.34 0.02 0.00 2.01 0.00 0.00 34.83 34.52 1b2t s MET 15 CO 0.01 0.26 0.08 -2.37 -0.01 0.00 0.00 175.02 172.98 1b2t n THR 16 N 3.33 0.00 -3.70 2.05 5.66 -1.25 -5.06 114.28 115.30 1b2t n THR 16 Ca -0.18 -0.04 -0.21 0.00 -3.05 0.00 0.00 64.05 60.57 1b2t n THR 16 Cb 0.53 -1.24 -0.03 0.00 -1.55 0.00 0.00 70.33 68.04 1b2t n THR 16 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1b2t s SER 17 N -1.61 5.37 0.25 1.09 0.01 -1.26 -5.01 113.70 112.54 1b2t s SER 17 Ca 0.05 -0.48 -0.31 0.00 1.31 0.00 0.00 55.95 56.52 1b2t s SER 17 Cb -0.00 -0.95 -0.13 0.00 0.21 0.00 0.00 66.02 65.15 1b2t s SER 17 CO 0.04 -0.42 1.53 1.17 0.41 0.00 0.00 173.24 175.97 1b2t n LYS 18 N -1.45 2.41 -4.35 12.44 4.81 -1.26 -5.00 118.16 125.75 1b2t n LYS 18 Ca -0.01 0.86 -0.19 0.00 -0.87 0.00 0.00 58.31 58.11 1b2t n LYS 18 Cb 0.60 -2.60 -0.14 0.00 0.02 0.00 0.00 35.03 32.91 1b2t n LYS 18 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1b2t s ILE 19 N 0.16 0.80 0.30 3.15 1.01 -1.26 -5.13 121.20 120.23 1b2t s ILE 19 Ca 0.68 -0.59 -0.30 0.00 0.00 0.00 0.00 60.65 60.44 1b2t s ILE 19 Cb -0.57 -0.70 -0.13 0.00 0.01 0.00 0.00 42.46 41.07 1b2t s ILE 19 CO 0.47 0.11 1.40 -2.65 0.00 0.00 0.00 174.94 174.26 1b2t n PRO 20 N 2.51 2.22 0.25 2.79 -0.02 -1.26 -4.88 135.00 136.61 1b2t n PRO 20 Ca -0.15 0.78 0.13 0.00 -2.02 0.00 0.00 63.50 62.24 1b2t n PRO 20 Cb 0.56 -2.44 0.61 0.00 -0.02 0.00 0.00 33.50 32.21 1b2t n PRO 20 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1b2t h VAL 21 N 2.90 0.43 0.00 -1.45 2.07 -1.95 -2.36 116.25 115.89 1b2t h VAL 21 Ca -0.46 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.26 1b2t h VAL 21 Cb 1.27 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 1b2t h VAL 21 CO 0.71 0.14 0.00 0.00 0.02 0.00 0.00 177.57 178.44 1b2t n ALA 22 N -2.21 1.48 0.09 1.67 0.00 -1.26 -1.53 120.51 118.75 1b2t n ALA 22 Ca -0.00 -0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.48 1b2t n ALA 22 Cb 0.34 -1.15 -0.13 0.00 0.00 0.00 0.00 19.45 18.51 1b2t n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1b2t n LEU 23 N -1.43 0.10 -4.81 0.00 4.77 -0.89 -4.98 117.00 109.76 1b2t n LEU 23 Ca 0.03 -0.06 -0.34 0.00 -0.03 0.00 0.00 56.01 55.61 1b2t n LEU 23 Cb 0.10 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1b2t n LEU 23 CO 0.08 0.02 0.67 -0.76 -1.33 0.00 0.00 177.39 176.08 1b2t s LEU 24 N -3.99 3.95 0.00 2.23 1.43 -0.58 -1.49 118.68 120.23 1b2t s LEU 24 Ca -0.05 1.79 0.00 0.00 -1.03 0.00 0.00 54.13 54.84 1b2t s LEU 24 Cb 0.11 -4.49 0.00 0.00 0.03 0.00 0.00 46.19 41.84 1b2t s LEU 24 CO 0.69 -0.47 0.00 2.30 0.23 0.00 0.00 176.35 179.11 1b2t n ILE 25 N -0.61 0.00 -3.73 -0.59 -5.35 0.17 -4.76 119.36 104.49 1b2t n ILE 25 Ca 0.07 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.45 1b2t n ILE 25 Cb 0.53 -0.49 -0.06 0.00 -1.74 0.00 0.00 39.64 37.88 1b2t n ILE 25 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 1b2t s HIS 26 N -1.73 -0.05 0.03 4.28 3.76 -0.95 -5.02 115.29 115.61 1b2t s HIS 26 Ca 0.00 -0.32 0.04 0.00 -0.15 0.00 0.00 55.06 54.63 1b2t s HIS 26 Cb 0.00 0.12 -0.02 0.00 1.11 0.00 0.00 32.58 33.79 1b2t s HIS 26 CO 0.00 -0.63 -0.11 1.52 -0.85 0.00 0.00 174.74 174.67 1b2t s TYR 27 N -3.81 0.94 0.13 1.40 1.13 -1.26 -0.34 117.35 115.53 1b2t s TYR 27 Ca 0.04 -0.33 -0.07 0.00 -1.41 0.00 0.00 57.07 55.30 1b2t s TYR 27 Cb 0.03 -0.57 -0.02 0.00 -1.10 0.00 0.00 41.96 40.31 1b2t s TYR 27 CO -0.11 -0.00 0.18 1.14 -2.51 0.00 0.00 175.55 174.24 1b2t s GLN 28 N -0.99 0.97 0.29 -3.49 0.00 0.28 -5.00 119.66 111.72 1b2t s GLN 28 Ca -0.01 -1.17 0.02 0.00 -0.00 0.00 0.00 55.36 54.21 1b2t s GLN 28 Cb -0.07 0.33 -0.03 0.00 0.00 0.00 0.00 33.01 33.23 1b2t s GLN 28 CO 0.01 -0.32 0.45 -0.65 0.00 0.00 0.00 175.29 174.78 1b2t s GLN 29 N -3.95 3.47 0.52 9.60 1.11 -1.26 0.14 119.66 129.29 1b2t s GLN 29 Ca 0.14 -0.53 -0.06 0.00 0.01 0.00 0.00 55.36 54.92 1b2t s GLN 29 Cb 0.05 -2.78 -0.03 0.00 -1.01 0.00 0.00 33.01 29.24 1b2t s GLN 29 CO -0.04 0.30 0.84 1.21 0.01 0.00 0.00 175.29 177.61 1b2t s ASN 30 N -3.94 6.11 -0.22 5.90 2.47 -1.19 -4.73 114.94 119.33 1b2t s ASN 30 Ca 0.37 0.94 -0.23 0.00 0.42 0.00 0.00 52.86 54.36 1b2t s ASN 30 Cb -0.09 -2.15 -0.01 0.00 -1.45 0.00 0.00 41.25 37.54 1b2t s ASN 30 CO 0.32 -0.72 0.75 -1.10 -3.72 0.00 0.00 177.10 172.63 1b2t s GLN 31 N -4.85 4.20 -0.86 0.43 -0.21 -1.26 -4.95 119.66 112.16 1b2t s GLN 31 Ca 0.50 0.81 -0.23 0.00 0.02 0.00 0.00 55.36 56.45 1b2t s GLN 31 Cb -0.10 -3.62 -0.18 0.00 1.00 0.00 0.00 33.01 30.11 1b2t s GLN 31 CO 0.46 -0.41 2.24 0.00 -2.12 0.00 0.00 175.29 175.46 1b2t n ALA 32 N 5.61 0.37 0.00 6.09 0.00 -1.26 -1.42 120.51 129.90 1b2t n ALA 32 Ca 0.03 -1.56 0.00 0.00 0.00 0.00 0.00 53.44 51.91 1b2t n ALA 32 Cb 0.48 -3.09 0.00 0.00 0.00 0.00 0.00 19.45 16.85 1b2t n ALA 32 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1b2t n SER 33 N 17.21 0.00 -4.61 0.00 3.41 -1.26 -5.13 113.62 123.24 1b2t n SER 33 Ca 0.45 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.72 1b2t n SER 33 Cb 0.42 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.27 1b2t n SER 33 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b2t n GLY 35 N 3.41 0.61 3.89 0.00 0.00 -1.26 -4.49 105.19 107.35 1b2t n GLY 35 Ca -0.17 -0.85 -0.29 0.00 0.00 0.00 0.00 46.02 44.71 1b2t n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b2t s LYS 36 N 0.00 3.62 -0.92 1.61 3.01 -1.04 -4.89 119.74 121.14 1b2t s LYS 36 Ca 0.00 0.43 -0.25 0.00 -1.01 0.00 0.00 55.97 55.14 1b2t s LYS 36 Cb 0.00 -2.29 -0.10 0.00 -1.01 0.00 0.00 37.83 34.43 1b2t s LYS 36 CO 0.00 -0.27 2.13 0.50 0.51 0.00 0.00 175.35 178.22 1b2t s ARG 37 N -4.66 2.05 0.00 1.68 3.52 -1.26 -4.72 118.95 115.56 1b2t s ARG 37 Ca 0.51 -0.13 0.00 0.00 -0.13 0.00 0.00 55.73 55.98 1b2t s ARG 37 Cb -0.10 -4.97 0.00 0.00 -1.56 0.00 0.00 34.95 28.31 1b2t s ARG 37 CO 0.44 -4.08 0.00 0.00 -0.81 0.00 0.00 175.30 170.85 1b2t n ALA 38 N 16.38 0.00 -2.50 6.12 0.00 -1.26 -4.63 120.51 134.62 1b2t n ALA 38 Ca 0.43 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.66 1b2t n ALA 38 Cb 0.45 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.79 1b2t n ALA 38 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1b2t s ILE 39 N 0.19 1.61 -0.23 0.00 -1.09 0.16 -3.19 121.20 118.64 1b2t s ILE 39 Ca 0.00 -1.75 -0.06 0.00 -2.23 0.00 0.00 60.65 56.62 1b2t s ILE 39 Cb 0.00 -1.65 -0.02 0.00 -1.58 0.00 0.00 42.46 39.21 1b2t s ILE 39 CO 0.00 -0.29 0.02 -0.63 -1.23 0.00 0.00 174.94 172.80 1b2t s ILE 40 N -1.86 3.91 -0.20 2.92 -1.09 0.12 -0.41 121.20 124.58 1b2t s ILE 40 Ca 0.11 -0.31 -0.06 0.00 -2.23 0.00 0.00 60.65 58.15 1b2t s ILE 40 Cb -0.07 -2.80 -0.03 0.00 -1.58 0.00 0.00 42.46 37.98 1b2t s ILE 40 CO 0.05 0.39 0.04 -0.76 -1.23 0.00 0.00 174.94 173.42 1b2t s LEU 41 N 1.42 3.49 -0.19 2.97 1.43 -0.04 -0.55 118.68 127.21 1b2t s LEU 41 Ca 0.05 -0.10 -0.07 0.00 -1.03 0.00 0.00 54.13 52.98 1b2t s LEU 41 Cb -0.15 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 1b2t s LEU 41 CO 0.01 0.08 0.05 -0.70 0.23 0.00 0.00 176.35 176.02 1b2t s GLU 42 N 0.92 3.90 0.47 1.70 2.12 0.54 -1.30 118.70 127.05 1b2t s GLU 42 Ca 0.03 -0.38 0.08 0.00 0.36 0.00 0.00 54.97 55.05 1b2t s GLU 42 Cb -0.14 -3.19 0.02 0.00 0.26 0.00 0.00 34.13 31.08 1b2t s GLU 42 CO 0.02 0.22 0.51 0.95 -0.54 0.00 0.00 175.26 176.42 1b2t s THR 43 N 0.51 2.45 -0.58 -1.70 -4.23 -0.69 0.45 115.64 111.85 1b2t s THR 43 Ca 0.02 -1.22 0.16 0.00 -1.18 0.00 0.00 61.69 59.47 1b2t s THR 43 Cb -0.13 -2.68 0.16 0.00 1.34 0.00 0.00 72.50 71.19 1b2t s THR 43 CO 0.01 0.00 1.49 0.54 -0.54 0.00 0.00 174.62 176.12 1b2t n ARG 44 N -1.79 0.10 -0.65 3.99 1.74 -0.56 -1.08 116.66 118.41 1b2t n ARG 44 Ca 0.06 0.50 0.08 0.00 -0.77 0.00 0.00 57.85 57.71 1b2t n ARG 44 Cb 0.62 -1.76 0.33 0.00 -1.02 0.00 0.00 32.46 30.63 1b2t n ARG 44 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1b2t n GLN 45 N -1.96 3.90 -3.40 5.56 6.02 -1.26 -4.94 117.38 121.30 1b2t n GLN 45 Ca 0.01 -2.95 -0.18 0.00 -0.01 0.00 0.00 57.00 53.86 1b2t n GLN 45 Cb 0.09 -2.01 0.08 0.00 1.02 0.00 0.00 30.24 29.43 1b2t n GLN 45 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1b2t n HIS 46 N 0.27 -2.28 -3.96 1.08 8.25 -0.24 -4.99 115.22 113.34 1b2t n HIS 46 Ca 0.24 0.90 -0.35 0.00 -0.26 0.00 0.00 57.72 58.25 1b2t n HIS 46 Cb 1.00 -4.83 -0.11 0.00 1.12 0.00 0.00 29.99 27.18 1b2t n HIS 46 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1b2t s ARG 47 N -5.62 3.87 -0.33 -0.41 3.00 -1.25 -4.86 118.95 113.34 1b2t s ARG 47 Ca 0.21 -0.39 -0.07 0.00 -1.00 0.00 0.00 55.73 54.47 1b2t s ARG 47 Cb -0.09 -3.24 0.03 0.00 0.00 0.00 0.00 34.95 31.65 1b2t s ARG 47 CO 0.68 0.13 0.12 -0.51 0.00 0.00 0.00 175.30 175.72 1b2t s LEU 48 N 0.76 4.26 -0.12 -0.88 1.43 -1.22 -1.70 118.68 121.20 1b2t s LEU 48 Ca 0.03 -0.99 -0.03 0.00 -1.03 0.00 0.00 54.13 52.12 1b2t s LEU 48 Cb -0.13 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.15 1b2t s LEU 48 CO 0.02 -0.30 -0.01 -0.36 0.23 0.00 0.00 176.35 175.93 1b2t s PHE 49 N 1.46 3.10 -1.01 0.29 0.08 -0.42 -4.85 117.98 116.63 1b2t s PHE 49 Ca 0.00 -0.03 -0.16 0.00 0.12 0.00 0.00 56.93 56.86 1b2t s PHE 49 Cb -0.19 -1.88 0.16 0.00 -0.57 0.00 0.00 43.02 40.54 1b2t s PHE 49 CO 0.03 0.22 1.17 0.00 -0.10 0.00 0.00 175.22 176.55 1b2t s ALA 51 N 1.76 3.37 0.39 0.00 0.00 0.45 -3.77 121.76 123.95 1b2t s ALA 51 Ca 0.34 -0.75 -0.27 0.00 0.00 0.00 0.00 51.96 51.28 1b2t s ALA 51 Cb -0.05 -1.82 -0.09 0.00 0.00 0.00 0.00 23.12 21.16 1b2t s ALA 51 CO -0.06 0.27 1.28 0.34 0.00 0.00 0.00 175.76 177.58 1b2t s ASP 52 N 0.12 6.46 0.63 0.00 -1.08 -1.26 0.35 116.67 121.89 1b2t s ASP 52 Ca 0.04 2.61 0.30 0.00 -0.52 0.00 0.00 52.55 54.98 1b2t s ASP 52 Cb -0.12 -2.64 1.65 0.00 -1.46 0.00 0.00 42.92 40.35 1b2t s ASP 52 CO 0.01 -0.74 1.92 -0.65 0.52 0.00 0.00 175.17 176.23 1b2t h PRO 53 N 2.85 0.00 0.00 4.34 0.11 -1.88 0.45 132.00 137.86 1b2t h PRO 53 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1b2t h PRO 53 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1b2t h PRO 53 CO 0.63 0.00 -0.01 0.36 -0.21 0.00 0.00 178.00 178.77 1b2t n LYS 54 N -2.83 0.03 -2.32 1.05 2.85 -1.26 -4.51 118.16 111.17 1b2t n LYS 54 Ca -0.02 0.02 -0.42 0.00 -1.05 0.00 0.00 58.31 56.85 1b2t n LYS 54 Cb 0.33 -1.54 -0.03 0.00 -0.65 0.00 0.00 35.03 33.14 1b2t n LYS 54 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1b2t s GLU 55 N -3.01 4.40 0.08 -1.58 2.02 0.16 -4.95 118.70 115.82 1b2t s GLU 55 Ca 0.14 1.91 -0.34 0.00 0.02 0.00 0.00 54.97 56.69 1b2t s GLU 55 Cb 0.18 -3.28 -0.16 0.00 0.10 0.00 0.00 34.13 30.97 1b2t s GLU 55 CO 0.54 -0.28 1.59 0.37 0.02 0.00 0.00 175.26 177.50 1b2t h GLN 56 N 6.40 -0.92 0.00 1.61 -0.00 -1.87 -0.99 115.11 119.33 1b2t h GLN 56 Ca -0.43 0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.29 1b2t h GLN 56 Cb 1.21 0.21 0.00 0.00 0.00 0.00 0.00 27.48 28.90 1b2t h GLN 56 CO 0.81 -0.61 0.25 0.11 0.00 0.00 0.00 178.83 179.39 1b2t h TRP 57 N -0.95 0.00 0.11 3.99 5.08 -1.92 -0.02 115.95 122.23 1b2t h TRP 57 Ca -0.06 0.00 -0.31 0.00 1.08 0.00 0.00 58.89 59.60 1b2t h TRP 57 Cb 0.81 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.96 1b2t h TRP 57 CO -0.18 0.00 -1.66 0.28 -1.28 0.00 0.00 178.44 175.60 1b2t h VAL 58 N 0.00 0.84 0.18 0.12 2.07 -1.56 -2.23 116.25 115.66 1b2t h VAL 58 Ca 0.00 -2.36 -0.01 0.00 0.82 0.00 0.00 66.70 65.15 1b2t h VAL 58 Cb 0.50 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1b2t h VAL 58 CO 0.00 0.74 -0.08 0.11 0.02 0.00 0.00 177.57 178.36 1b2t h LYS 59 N -0.21 -0.23 -0.19 1.57 1.57 0.20 -1.91 116.57 117.37 1b2t h LYS 59 Ca -0.36 0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.37 1b2t h LYS 59 Cb 1.84 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 34.20 1b2t h LYS 59 CO 0.04 -0.11 -0.14 0.22 -0.57 0.00 0.00 179.45 178.89 1b2t h ASP 60 N -0.29 0.45 -1.05 0.86 3.58 -1.53 -2.30 116.42 116.14 1b2t h ASP 60 Ca -0.02 -0.45 0.27 0.00 0.42 0.00 0.00 57.03 57.25 1b2t h ASP 60 Cb 0.22 -0.12 -0.10 0.00 1.72 0.00 0.00 39.33 41.05 1b2t h ASP 60 CO 0.04 0.80 0.66 0.00 -2.88 0.00 0.00 179.24 177.87 1b2t h ALA 61 N 0.66 2.18 0.20 -0.78 0.00 -1.33 0.82 119.26 121.00 1b2t h ALA 61 Ca 0.04 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1b2t h ALA 61 Cb 0.66 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1b2t h ALA 61 CO 0.04 -0.61 -0.09 0.52 0.00 0.00 0.00 179.25 179.10 1b2t h MET 62 N 0.41 -0.25 -1.10 0.00 2.86 -1.20 -2.28 114.93 113.36 1b2t h MET 62 Ca 0.62 0.02 0.32 0.00 -2.06 0.00 0.00 59.70 58.60 1b2t h MET 62 Cb 1.52 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 33.20 1b2t h MET 62 CO -0.34 -0.17 1.01 1.96 1.06 0.00 0.00 176.91 180.43 1b2t h GLN 63 N -0.86 0.00 0.19 1.72 4.20 -0.87 0.21 115.11 119.70 1b2t h GLN 63 Ca -0.03 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 1b2t h GLN 63 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1b2t h GLN 63 CO 0.04 0.00 -0.09 1.25 -0.67 0.00 0.00 178.83 179.36 1b2t h HIS 64 N 0.00 -0.24 -0.88 2.96 2.76 -0.86 -3.27 115.15 115.62 1b2t h HIS 64 Ca 0.52 -0.01 0.12 0.00 -2.20 0.00 0.00 60.37 58.81 1b2t h HIS 64 Cb 2.54 0.08 -0.07 0.00 1.55 0.00 0.00 27.41 31.51 1b2t h HIS 64 CO 0.00 -0.05 0.57 -0.07 -1.30 0.00 0.00 177.93 177.07 1b2t h LEU 65 N -1.04 0.71 -2.61 0.26 3.38 -0.12 0.17 115.31 116.05 1b2t h LEU 65 Ca -0.03 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1b2t h LEU 65 Cb 0.30 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1b2t h LEU 65 CO 0.04 0.39 0.07 0.44 0.09 0.00 0.00 178.44 179.48 1b2t h ASP 66 N 0.77 0.00 0.51 -0.43 3.32 -0.87 0.18 116.42 119.91 1b2t h ASP 66 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1b2t h ASP 66 Cb 0.57 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1b2t h ASP 66 CO -0.19 0.00 -0.97 -1.14 -1.72 0.00 0.00 179.24 175.22 1b2t n ARG 67 N -3.38 0.30 0.06 3.56 0.63 0.58 -3.90 116.66 114.53 1b2t n ARG 67 Ca -0.02 0.01 0.12 0.00 -0.92 0.00 0.00 57.85 57.04 1b2t n ARG 67 Cb 0.15 -1.61 0.21 0.00 0.45 0.00 0.00 32.46 31.66 1b2t n ARG 67 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1b2t n GLN 68 N -2.01 0.27 -0.01 -0.14 3.00 0.60 -3.92 117.38 115.17 1b2t n GLN 68 Ca 0.02 0.10 -0.12 0.00 -0.01 0.00 0.00 57.00 56.99 1b2t n GLN 68 Cb 0.44 -1.69 -0.10 0.00 0.00 0.00 0.00 30.24 28.89 1b2t n GLN 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1b2t h ALA 69 N 2.54 -0.06 -0.04 -1.58 0.00 -1.56 -3.22 119.26 115.34 1b2t h ALA 69 Ca 0.00 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.61 1b2t h ALA 69 Cb 0.73 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1b2t h ALA 69 CO 0.00 -0.18 0.05 0.00 0.00 0.00 0.00 179.25 179.12 1b2t h ALA 70 N 0.06 1.55 0.00 0.00 0.00 -1.74 -0.41 119.26 118.71 1b2t h ALA 70 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1b2t h ALA 70 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1b2t h ALA 70 CO 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1b2t n ALA 71 N -2.30 1.21 -0.05 0.00 0.00 -1.21 -0.06 120.51 118.09 1b2t n ALA 71 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1b2t n ALA 71 Cb 0.14 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1b2t n ALA 71 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1b2t n LEU 72 N -1.70 0.03 -0.35 0.00 7.99 -0.16 -4.63 117.00 118.17 1b2t n LEU 72 Ca 0.01 0.88 0.00 0.00 -0.01 0.00 0.00 56.01 56.89 1b2t n LEU 72 Cb 0.06 -0.47 0.00 0.00 -0.11 0.00 0.00 43.42 42.90 1b2t n LEU 72 CO 0.06 -0.47 0.26 1.07 -1.51 0.00 0.00 177.39 176.80 1b2t n THR 73 N -1.92 0.05 -2.26 -5.08 5.66 -1.20 -4.99 114.28 104.54 1b2t n THR 73 Ca 0.00 -0.06 -0.11 0.00 -3.05 0.00 0.00 64.05 60.83 1b2t n THR 73 Cb 0.00 0.61 -0.01 0.00 -1.55 0.00 0.00 70.33 69.38 1b2t n THR 73 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 1b2t n ARG 74 N -0.04 -2.16 -3.58 1.09 0.00 0.91 -4.88 116.66 108.00 1b2t n ARG 74 Ca 0.00 0.53 -0.29 0.00 -0.00 0.00 0.00 57.85 58.10 1b2t n ARG 74 Cb 0.64 -5.05 -0.12 0.00 0.00 0.00 0.00 32.46 27.93 1b2t n ARG 74 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 1b2t s ASN 75 N -2.00 3.06 0.00 6.15 -0.87 -1.26 -5.09 114.94 114.92 1b2t s ASN 75 Ca 0.00 -2.70 0.00 0.00 -1.57 0.00 0.00 52.86 48.59 1b2t s ASN 75 Cb 0.00 -0.76 0.00 0.00 -0.02 0.00 0.00 41.25 40.47 1b2t s ASN 75 CO 0.00 -0.24 0.48 0.61 -2.57 0.00 0.00 177.10 175.37