#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ctr s SER 2 N 0.00 7.15 0.24 1.61 0.15 -1.26 -4.03 113.70 117.56 2ctr s SER 2 Ca 0.00 1.61 -0.29 0.00 0.70 0.00 0.00 55.95 57.97 2ctr s SER 2 Cb 0.00 -2.49 -0.15 0.00 -1.71 0.00 0.00 66.02 61.66 2ctr s SER 2 CO 0.00 -0.05 0.83 -1.20 1.20 0.00 0.00 173.24 174.02 2ctr n SER 3 N 0.49 0.26 -3.09 5.45 7.64 -1.26 -4.84 113.62 118.28 2ctr n SER 3 Ca 0.01 1.16 -0.36 0.00 1.01 0.00 0.00 58.87 60.68 2ctr n SER 3 Cb 0.51 -1.14 0.02 0.00 -1.01 0.00 0.00 64.21 62.58 2ctr n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ctr n GLY 4 N 1.59 5.82 3.82 0.23 0.00 -1.26 -5.03 105.19 110.37 2ctr n GLY 4 Ca 0.14 -2.61 -0.32 0.00 0.00 0.00 0.00 46.02 43.23 2ctr n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ctr s SER 5 N -1.92 6.03 -0.08 1.61 0.01 -1.26 -4.98 113.70 113.10 2ctr s SER 5 Ca 0.47 1.67 -0.25 0.00 1.31 0.00 0.00 55.95 59.15 2ctr s SER 5 Cb 0.33 -2.51 -0.29 0.00 0.21 0.00 0.00 66.02 63.75 2ctr s SER 5 CO -0.25 -1.00 0.84 0.77 0.41 0.00 0.00 173.24 174.02 2ctr h SER 6 N 0.35 0.29 0.00 2.44 4.64 -2.02 -3.48 113.55 115.77 2ctr h SER 6 Ca -0.46 -0.97 0.00 0.00 -0.47 0.00 0.00 61.79 59.89 2ctr h SER 6 Cb 1.20 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2ctr h SER 6 CO 0.59 1.25 0.00 0.61 -0.87 0.00 0.00 176.83 178.41 2ctr n GLY 7 N 1.65 1.37 3.36 -0.77 0.00 -1.26 -4.35 105.19 105.18 2ctr n GLY 7 Ca -0.13 0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 2ctr n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ctr s SER 8 N -4.00 2.85 0.09 1.61 0.01 -1.26 -4.99 113.70 108.01 2ctr s SER 8 Ca 0.00 -0.88 -0.30 0.00 1.31 0.00 0.00 55.95 56.08 2ctr s SER 8 Cb 0.00 -0.18 -0.13 0.00 0.21 0.00 0.00 66.02 65.92 2ctr s SER 8 CO 0.00 -0.01 1.49 1.88 0.41 0.00 0.00 173.24 177.00 2ctr h TYR 9 N 3.14 -1.37 -1.12 2.43 0.05 -1.91 -0.30 116.97 117.89 2ctr h TYR 9 Ca -0.42 0.04 0.40 0.00 0.05 0.00 0.00 58.73 58.79 2ctr h TYR 9 Cb 1.21 0.59 -0.12 0.00 1.01 0.00 0.00 36.73 39.42 2ctr h TYR 9 CO 0.69 -0.52 0.71 0.66 -1.05 0.00 0.00 178.16 178.65 2ctr n TYR 10 N -5.10 0.65 0.05 4.88 4.01 -1.26 0.21 117.16 120.60 2ctr n TYR 10 Ca -0.07 0.66 -0.20 0.00 -0.16 0.00 0.00 57.90 58.13 2ctr n TYR 10 Cb 0.36 -1.07 -0.13 0.00 -0.31 0.00 0.00 39.34 38.18 2ctr n TYR 10 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2ctr h ASP 11 N 0.00 0.62 -0.21 7.72 3.32 -1.32 0.28 116.42 126.83 2ctr h ASP 11 Ca 0.74 -0.86 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 2ctr h ASP 11 Cb 2.33 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 41.67 2ctr h ASP 11 CO -0.43 1.42 0.11 0.40 -1.72 0.00 0.00 179.24 179.02 2ctr h ILE 12 N -0.10 1.12 -0.01 0.35 2.04 0.37 -3.03 117.51 118.25 2ctr h ILE 12 Ca -0.14 -0.33 -0.22 0.00 1.00 0.00 0.00 64.86 65.16 2ctr h ILE 12 Cb 1.65 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 2ctr h ILE 12 CO 0.17 0.12 -0.92 -0.07 0.00 0.00 0.00 178.15 177.45 2ctr h LEU 13 N 0.23 0.56 -0.04 1.44 3.38 -0.75 -3.48 115.31 116.65 2ctr h LEU 13 Ca 0.07 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2ctr h LEU 13 Cb 0.09 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2ctr h LEU 13 CO -0.01 1.23 0.00 0.61 0.09 0.00 0.00 178.44 180.36 2ctr n GLY 14 N 0.91 1.53 3.50 0.83 0.00 -0.01 -4.59 105.19 107.36 2ctr n GLY 14 Ca -0.07 -0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 2ctr n GLY 14 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ctr s VAL 15 N -2.04 2.82 0.70 1.61 -7.23 0.79 -5.01 120.40 112.04 2ctr s VAL 15 Ca 0.00 -1.81 -0.13 0.00 -1.81 0.00 0.00 61.98 58.22 2ctr s VAL 15 Cb 0.00 -2.38 0.02 0.00 0.56 0.00 0.00 36.38 34.59 2ctr s VAL 15 CO 0.00 -0.11 1.10 -2.16 -0.31 0.00 0.00 175.10 173.63 2ctr s PRO 16 N -2.74 2.59 0.43 4.82 0.04 -1.26 -4.45 135.00 134.43 2ctr s PRO 16 Ca 0.23 1.31 0.13 0.00 0.04 0.00 0.00 61.00 62.71 2ctr s PRO 16 Cb -0.08 -1.93 1.01 0.00 0.04 0.00 0.00 34.50 33.54 2ctr s PRO 16 CO 0.13 -1.40 1.97 0.87 0.04 0.00 0.00 177.00 178.60 2ctr h LYS 17 N -0.41 0.42 -0.64 4.56 1.79 -2.00 0.11 116.57 120.39 2ctr h LYS 17 Ca -0.46 -0.03 -0.12 0.00 -2.18 0.00 0.00 60.65 57.87 2ctr h LYS 17 Cb 1.24 -0.10 -0.07 0.00 -1.58 0.00 0.00 32.23 31.72 2ctr h LYS 17 CO 0.53 0.28 0.15 0.45 -1.08 0.00 0.00 179.45 179.77 2ctr n SER 18 N -4.47 5.12 -4.73 0.86 2.88 -1.26 -5.00 113.62 107.01 2ctr n SER 18 Ca 0.10 -3.11 -0.41 0.00 -1.33 0.00 0.00 58.87 54.12 2ctr n SER 18 Cb 0.38 -0.71 0.01 0.00 -0.75 0.00 0.00 64.21 63.13 2ctr n SER 18 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ctr n ALA 19 N 0.11 1.73 -2.44 -1.46 0.00 0.37 -4.99 120.51 113.83 2ctr n ALA 19 Ca 0.35 0.30 -0.33 0.00 0.00 0.00 0.00 53.44 53.76 2ctr n ALA 19 Cb 1.29 -2.33 -0.05 0.00 0.00 0.00 0.00 19.45 18.35 2ctr n ALA 19 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2ctr s SER 20 N -0.38 6.65 0.39 0.00 0.01 -1.26 -4.83 113.70 114.27 2ctr s SER 20 Ca 0.58 0.91 0.31 0.00 1.31 0.00 0.00 55.95 59.06 2ctr s SER 20 Cb -0.50 -2.22 1.27 0.00 0.21 0.00 0.00 66.02 64.78 2ctr s SER 20 CO 0.60 -0.01 1.27 1.21 0.41 0.00 0.00 173.24 176.71 2ctr n GLU 21 N 0.12 -0.02 -0.00 12.44 2.13 -1.26 0.18 120.64 134.23 2ctr n GLU 21 Ca -0.01 0.98 -0.13 0.00 0.66 0.00 0.00 57.16 58.66 2ctr n GLU 21 Cb 0.52 -2.02 -0.09 0.00 0.27 0.00 0.00 31.44 30.13 2ctr n GLU 21 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2ctr h ARG 22 N 0.00 0.03 -0.57 5.31 2.43 -1.99 -2.12 114.38 117.47 2ctr h ARG 22 Ca 0.73 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.82 2ctr h ARG 22 Cb 2.54 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 32.06 2ctr h ARG 22 CO -0.27 0.35 0.06 1.96 -1.51 0.00 0.00 179.97 180.56 2ctr h GLN 23 N -0.30 0.95 0.62 0.20 4.20 0.15 0.92 115.11 121.84 2ctr h GLN 23 Ca 0.00 -0.25 -0.03 0.00 0.06 0.00 0.00 58.65 58.44 2ctr h GLN 23 Cb 0.34 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.01 2ctr h GLN 23 CO 0.00 0.90 -0.33 0.82 -0.67 0.00 0.00 178.83 179.55 2ctr h ILE 24 N 0.89 0.33 -0.13 2.54 2.04 -1.08 0.22 117.51 122.31 2ctr h ILE 24 Ca 0.18 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.95 2ctr h ILE 24 Cb 0.44 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 2ctr h ILE 24 CO 0.01 0.00 -0.29 0.07 0.00 0.00 0.00 178.15 177.94 2ctr h LYS 25 N -0.87 0.25 -0.02 2.37 2.10 -1.35 -1.26 116.57 117.78 2ctr h LYS 25 Ca -0.08 -0.09 -0.00 0.00 -2.00 0.00 0.00 60.65 58.48 2ctr h LYS 25 Cb 0.69 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 32.00 2ctr h LYS 25 CO 0.12 0.52 0.00 0.87 -2.00 0.00 0.00 179.45 178.96 2ctr h LYS 26 N 0.22 0.04 -0.38 0.07 1.57 -0.57 0.09 116.57 117.61 2ctr h LYS 26 Ca 0.03 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 2ctr h LYS 26 Cb 0.64 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2ctr h LYS 26 CO 0.05 0.32 0.02 0.00 -0.57 0.00 0.00 179.45 179.27 2ctr h ALA 27 N 0.72 0.51 0.54 3.86 0.00 -0.49 -3.01 119.26 121.39 2ctr h ALA 27 Ca 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2ctr h ALA 27 Cb 0.30 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.96 2ctr h ALA 27 CO 0.00 0.26 -0.26 0.35 0.00 0.00 0.00 179.25 179.60 2ctr h PHE 28 N 0.48 -0.67 -0.81 0.00 3.57 -1.23 -2.27 116.94 116.01 2ctr h PHE 28 Ca 0.11 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.68 2ctr h PHE 28 Cb 0.43 0.22 -0.10 0.00 2.79 0.00 0.00 35.95 39.29 2ctr h PHE 28 CO 0.03 -0.42 -0.45 0.72 -2.23 0.00 0.00 178.31 175.97 2ctr n HIS 29 N -4.14 -0.28 -0.19 0.41 8.25 0.01 0.95 115.22 120.24 2ctr n HIS 29 Ca -0.09 1.01 -0.00 0.00 -0.26 0.00 0.00 57.72 58.38 2ctr n HIS 29 Cb 0.28 -0.61 0.10 0.00 1.12 0.00 0.00 29.99 30.88 2ctr n HIS 29 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 2ctr h LYS 30 N 0.00 0.27 0.90 -0.41 1.57 -1.55 -2.75 116.57 114.61 2ctr h LYS 30 Ca 0.16 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 2ctr h LYS 30 Cb 0.36 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2ctr h LYS 30 CO -0.77 0.18 -0.47 -0.07 -0.57 0.00 0.00 179.45 177.75 2ctr h LEU 31 N 0.28 -1.15 -1.23 2.94 3.38 0.12 -2.46 115.31 117.19 2ctr h LEU 31 Ca 0.29 0.05 0.40 0.00 0.09 0.00 0.00 57.88 58.72 2ctr h LEU 31 Cb 0.41 0.31 -0.10 0.00 0.09 0.00 0.00 40.66 41.38 2ctr h LEU 31 CO -0.36 -0.77 0.82 0.00 0.09 0.00 0.00 178.44 178.22 2ctr n ALA 32 N -2.68 1.21 -0.06 1.53 0.00 0.61 0.23 120.51 121.35 2ctr n ALA 32 Ca -0.16 0.65 -0.13 0.00 0.00 0.00 0.00 53.44 53.81 2ctr n ALA 32 Cb 0.51 -0.87 -0.06 0.00 0.00 0.00 0.00 19.45 19.03 2ctr n ALA 32 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2ctr h MET 33 N 0.00 0.39 0.00 0.00 2.86 -1.27 1.53 114.93 118.45 2ctr h MET 33 Ca 0.72 -0.18 -0.06 0.00 -2.06 0.00 0.00 59.70 58.12 2ctr h MET 33 Cb 2.47 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 34.12 2ctr h MET 33 CO -0.28 0.72 -0.28 -0.22 1.06 0.00 0.00 176.91 177.90 2ctr h LYS 34 N 0.06 0.00 -0.07 1.72 3.64 0.30 -2.84 116.57 119.37 2ctr h LYS 34 Ca 0.04 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2ctr h LYS 34 Cb 0.62 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 2ctr h LYS 34 CO 0.03 0.28 -0.16 0.66 -2.27 0.00 0.00 179.45 177.99 2ctr n TYR 35 N -3.90 0.23 -2.02 1.91 4.01 -0.32 -4.87 117.16 112.20 2ctr n TYR 35 Ca -0.02 -1.20 -0.42 0.00 -0.16 0.00 0.00 57.90 56.10 2ctr n TYR 35 Cb 0.36 -0.24 -0.03 0.00 -0.31 0.00 0.00 39.34 39.12 2ctr n TYR 35 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 2ctr s HIS 36 N -3.02 2.28 -1.96 -0.72 2.46 0.52 -4.27 115.29 110.58 2ctr s HIS 36 Ca 0.36 0.35 0.15 0.00 0.47 0.00 0.00 55.06 56.39 2ctr s HIS 36 Cb 0.33 -3.89 0.91 0.00 -0.13 0.00 0.00 32.58 29.80 2ctr s HIS 36 CO 0.00 -3.61 1.34 -0.35 -2.47 0.00 0.00 174.74 169.66 2ctr n PRO 37 N 6.30 0.46 -0.08 2.88 -0.04 -1.26 0.07 135.00 143.33 2ctr n PRO 37 Ca 0.16 0.01 -0.09 0.00 -0.04 0.00 0.00 63.50 63.54 2ctr n PRO 37 Cb 0.42 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.27 2ctr n PRO 37 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ctr n ASP 38 N -1.02 1.71 -0.08 3.54 9.92 -1.26 -4.67 116.55 124.68 2ctr n ASP 38 Ca 0.11 -0.03 -0.19 0.00 -0.53 0.00 0.00 54.79 54.15 2ctr n ASP 38 Cb 0.06 0.49 -0.13 0.00 -0.64 0.00 0.00 41.12 40.90 2ctr n ASP 38 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2ctr n LYS 39 N -2.72 0.69 -2.44 -1.24 4.76 -1.04 -4.87 118.16 111.30 2ctr n LYS 39 Ca -0.27 0.18 -0.43 0.00 -2.87 0.00 0.00 58.31 54.92 2ctr n LYS 39 Cb 0.95 -1.59 -0.02 0.00 -1.84 0.00 0.00 35.03 32.52 2ctr n LYS 39 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2ctr s ASN 40 N -6.65 6.73 -0.23 4.39 3.84 0.11 -4.90 114.94 118.23 2ctr s ASN 40 Ca -0.29 1.25 -0.02 0.00 0.21 0.00 0.00 52.86 54.02 2ctr s ASN 40 Cb 0.08 -2.54 0.10 0.00 -0.55 0.00 0.00 41.25 38.34 2ctr s ASN 40 CO 0.67 -1.02 2.25 1.17 -2.79 0.00 0.00 177.10 177.37 2ctr n LYS 41 N 7.19 1.70 -4.57 0.43 3.00 -1.26 -4.71 118.16 119.93 2ctr n LYS 41 Ca 0.14 -1.23 -0.22 0.00 -0.00 0.00 0.00 58.31 57.01 2ctr n LYS 41 Cb 0.46 -1.56 -0.14 0.00 0.00 0.00 0.00 35.03 33.79 2ctr n LYS 41 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2ctr s SER 42 N 0.81 1.77 0.45 3.14 0.15 -1.26 -5.03 113.70 113.72 2ctr s SER 42 Ca 0.30 -0.35 0.23 0.00 0.70 0.00 0.00 55.95 56.83 2ctr s SER 42 Cb 0.21 -0.17 1.00 0.00 -1.71 0.00 0.00 66.02 65.35 2ctr s SER 42 CO -0.03 0.13 1.87 1.55 1.20 0.00 0.00 173.24 177.96 2ctr h PRO 43 N 5.43 0.00 -0.07 5.44 0.13 -2.02 -2.97 132.00 137.94 2ctr h PRO 43 Ca -0.36 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.58 2ctr h PRO 43 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 2ctr h PRO 43 CO 0.47 0.24 -0.75 0.38 -0.23 0.00 0.00 178.00 178.11 2ctr h ASP 44 N 0.00 0.49 -0.96 1.44 3.04 -1.97 -3.20 116.42 115.26 2ctr h ASP 44 Ca -0.00 -0.33 0.10 0.00 -3.24 0.00 0.00 57.03 53.57 2ctr h ASP 44 Cb 0.67 -0.14 -0.08 0.00 -1.04 0.00 0.00 39.33 38.74 2ctr h ASP 44 CO 0.03 1.07 0.59 0.00 -2.04 0.00 0.00 179.24 178.89 2ctr h ALA 45 N 0.92 1.41 -0.86 4.15 0.00 -1.86 -1.09 119.26 121.93 2ctr h ALA 45 Ca -0.03 0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2ctr h ALA 45 Cb 1.33 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 2ctr h ALA 45 CO 0.13 0.24 0.52 1.49 0.00 0.00 0.00 179.25 181.62 2ctr h GLU 46 N 0.98 0.89 0.03 0.00 4.81 -1.65 -1.22 114.58 118.42 2ctr h GLU 46 Ca 0.46 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.63 2ctr h GLU 46 Cb 0.40 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2ctr h GLU 46 CO -0.24 0.59 -0.02 0.00 -0.73 0.00 0.00 179.01 178.61 2ctr h ALA 47 N 1.43 -0.04 -0.22 2.92 0.00 -1.36 -2.93 119.26 119.06 2ctr h ALA 47 Ca 0.39 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 55.12 2ctr h ALA 47 Cb 0.25 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 2ctr h ALA 47 CO -0.20 -0.28 -0.35 0.87 0.00 0.00 0.00 179.25 179.29 2ctr h LYS 48 N -0.53 -0.36 -0.94 0.00 1.79 -0.97 -0.02 116.57 115.54 2ctr h LYS 48 Ca -0.00 0.02 0.18 0.00 -2.18 0.00 0.00 60.65 58.67 2ctr h LYS 48 Cb 0.49 0.08 -0.08 0.00 -1.58 0.00 0.00 32.23 31.14 2ctr h LYS 48 CO 0.01 -0.24 0.60 0.35 -1.08 0.00 0.00 179.45 179.09 2ctr h PHE 49 N -0.37 0.84 -0.09 -1.35 3.57 -1.30 0.34 116.94 118.57 2ctr h PHE 49 Ca 0.11 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.67 2ctr h PHE 49 Cb 0.56 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 2ctr h PHE 49 CO -0.47 0.24 0.23 -0.09 -2.23 0.00 0.00 178.31 175.99 2ctr h ARG 50 N 0.65 0.00 0.01 1.11 9.65 -0.79 -0.16 114.38 124.85 2ctr h ARG 50 Ca 0.50 0.00 -0.36 0.00 -1.10 0.00 0.00 59.98 59.03 2ctr h ARG 50 Cb 0.91 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 29.43 2ctr h ARG 50 CO -0.26 0.00 -2.25 0.39 2.80 0.00 0.00 179.97 180.65 2ctr n GLU 51 N -3.26 0.68 -0.10 0.20 -0.58 0.11 -3.90 120.64 113.78 2ctr n GLU 51 Ca -0.00 0.08 -0.11 0.00 -0.42 0.00 0.00 57.16 56.70 2ctr n GLU 51 Cb 0.31 -1.58 -0.03 0.00 -0.57 0.00 0.00 31.44 29.57 2ctr n GLU 51 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2ctr h ILE 52 N 0.00 1.28 0.22 -3.67 2.04 -0.39 -2.72 117.51 114.27 2ctr h ILE 52 Ca -0.50 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 64.26 2ctr h ILE 52 Cb 2.15 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 39.60 2ctr h ILE 52 CO 0.03 0.35 -0.11 0.00 0.00 0.00 0.00 178.15 178.42 2ctr h ALA 53 N 0.80 -0.88 -1.00 1.87 0.00 -1.31 -2.66 119.26 116.08 2ctr h ALA 53 Ca 0.08 -0.06 0.41 0.00 0.00 0.00 0.00 54.91 55.33 2ctr h ALA 53 Cb 0.55 0.11 -0.18 0.00 0.00 0.00 0.00 17.79 18.27 2ctr h ALA 53 CO 0.03 -0.86 0.53 1.49 0.00 0.00 0.00 179.25 180.44 2ctr h GLU 54 N -0.35 0.02 -0.46 0.00 4.81 -1.68 1.00 114.58 117.93 2ctr h GLU 54 Ca -0.03 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2ctr h GLU 54 Cb 0.23 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2ctr h GLU 54 CO 0.05 0.01 0.28 0.00 -0.73 0.00 0.00 179.01 178.62 2ctr h ALA 55 N 1.99 0.58 0.44 2.92 0.00 -1.41 -2.93 119.26 120.85 2ctr h ALA 55 Ca 0.84 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.66 2ctr h ALA 55 Cb 2.20 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.81 2ctr h ALA 55 CO -0.76 0.07 -0.21 -0.92 0.00 0.00 0.00 179.25 177.43 2ctr h TYR 56 N 0.61 -0.55 -0.72 0.00 5.03 0.13 -2.65 116.97 118.81 2ctr h TYR 56 Ca 0.16 -0.01 0.16 0.00 2.58 0.00 0.00 58.73 61.62 2ctr h TYR 56 Cb -0.00 0.18 -0.14 0.00 1.55 0.00 0.00 36.73 38.32 2ctr h TYR 56 CO -0.03 -0.26 -0.14 0.39 -1.32 0.00 0.00 178.16 176.80 2ctr n GLU 57 N -5.19 -0.06 -0.01 1.82 -0.58 -0.19 0.19 120.64 116.61 2ctr n GLU 57 Ca -0.09 1.12 -0.13 0.00 -0.42 0.00 0.00 57.16 57.65 2ctr n GLU 57 Cb 0.28 -1.70 -0.08 0.00 -0.57 0.00 0.00 31.44 29.37 2ctr n GLU 57 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2ctr h THR 58 N 0.00 1.27 0.00 2.62 2.02 -1.55 -2.61 112.91 114.66 2ctr h THR 58 Ca 0.37 -0.83 0.00 0.00 0.77 0.00 0.00 66.41 66.71 2ctr h THR 58 Cb 0.61 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.78 2ctr h THR 58 CO -0.73 0.22 0.00 0.18 0.37 0.00 0.00 175.52 175.56 2ctr n LEU 59 N -4.88 0.00 -0.11 2.58 4.77 0.28 -1.71 117.00 117.94 2ctr n LEU 59 Ca -0.07 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.66 2ctr n LEU 59 Cb 0.20 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.18 2ctr n LEU 59 CO 0.34 0.00 -1.00 -0.24 -1.33 0.00 0.00 177.39 175.16 2ctr n SER 60 N -0.68 1.94 -4.85 -1.43 2.88 0.49 -4.90 113.62 107.08 2ctr n SER 60 Ca 0.08 0.31 -0.32 0.00 -1.33 0.00 0.00 58.87 57.62 2ctr n SER 60 Cb 0.04 -0.85 -0.01 0.00 -0.75 0.00 0.00 64.21 62.64 2ctr n SER 60 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2ctr s ASP 61 N -7.10 6.30 -0.01 -3.46 1.11 -1.09 -4.98 116.67 107.42 2ctr s ASP 61 Ca -0.33 1.54 -0.04 0.00 0.18 0.00 0.00 52.55 53.90 2ctr s ASP 61 Cb 0.10 -2.49 -0.02 0.00 1.07 0.00 0.00 42.92 41.57 2ctr s ASP 61 CO 0.57 -0.82 0.40 0.00 1.18 0.00 0.00 175.17 176.51 2ctr h ALA 62 N 0.26 -0.38 -0.66 5.23 0.00 -1.93 -2.45 119.26 119.33 2ctr h ALA 62 Ca -0.45 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 54.55 2ctr h ALA 62 Cb 1.19 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.95 2ctr h ALA 62 CO 0.61 -0.37 0.20 -0.91 0.00 0.00 0.00 179.25 178.77 2ctr h ASN 63 N -0.34 0.12 0.38 0.00 2.35 -1.95 0.42 115.58 116.55 2ctr h ASN 63 Ca -0.01 0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2ctr h ASN 63 Cb 0.11 0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 2ctr h ASN 63 CO 0.02 0.05 -0.40 0.03 -1.65 0.00 0.00 177.43 175.49 2ctr h ARG 64 N 0.34 -0.78 -0.26 0.81 3.08 -1.82 -1.19 114.38 114.55 2ctr h ARG 64 Ca 0.35 0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.43 2ctr h ARG 64 Cb 0.52 0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 2ctr h ARG 64 CO -0.40 -0.52 0.05 -0.09 -1.07 0.00 0.00 179.97 177.94 2ctr h ARG 65 N -0.81 0.38 -0.71 0.04 2.43 -0.78 -1.04 114.38 113.90 2ctr h ARG 65 Ca -0.03 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 2ctr h ARG 65 Cb 0.73 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 2ctr h ARG 65 CO -0.07 0.37 0.39 -0.22 -1.51 0.00 0.00 179.97 178.93 2ctr h LYS 66 N 0.38 0.98 0.14 0.20 3.64 0.43 -0.93 116.57 121.40 2ctr h LYS 66 Ca 0.09 -0.10 -0.19 0.00 -1.27 0.00 0.00 60.65 59.18 2ctr h LYS 66 Cb 0.18 -0.20 0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2ctr h LYS 66 CO -0.00 0.71 -0.83 0.93 -2.27 0.00 0.00 179.45 177.99 2ctr h GLU 67 N 0.99 0.32 0.00 1.90 5.08 -0.58 -1.69 114.58 120.59 2ctr h GLU 67 Ca 0.25 -0.53 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2ctr h GLU 67 Cb 0.01 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2ctr h GLU 67 CO -0.04 1.25 0.00 -0.92 -1.00 0.00 0.00 179.01 178.29 2ctr h TYR 68 N -0.33 0.00 0.06 4.33 3.20 -1.05 0.58 116.97 123.75 2ctr h TYR 68 Ca -0.14 0.00 -0.38 0.00 3.14 0.00 0.00 58.73 61.35 2ctr h TYR 68 Cb 1.65 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.87 2ctr h TYR 68 CO 0.19 0.00 -2.26 -3.47 -1.64 0.00 0.00 178.16 170.98 2ctr n ASP 69 N -2.96 2.05 0.18 -2.11 -0.08 -0.37 -1.92 116.55 111.34 2ctr n ASP 69 Ca -0.02 0.02 0.07 0.00 -1.51 0.00 0.00 54.79 53.35 2ctr n ASP 69 Cb 0.11 -0.62 0.19 0.00 2.34 0.00 0.00 41.12 43.15 2ctr n ASP 69 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ctr h THR 70 N 0.02 0.54 0.00 5.18 1.03 -0.85 -3.36 112.91 115.48 2ctr h THR 70 Ca -0.51 -1.58 -0.30 0.00 -0.01 0.00 0.00 66.41 64.01 2ctr h THR 70 Cb 1.96 2.12 -0.04 0.00 -1.07 0.00 0.00 68.15 71.11 2ctr h THR 70 CO -0.01 0.29 -1.95 0.18 -0.01 0.00 0.00 175.52 174.01 2ctr n LEU 71 N -3.23 1.60 0.00 0.00 4.77 0.20 -5.06 117.00 115.28 2ctr n LEU 71 Ca 0.02 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 2ctr n LEU 71 Cb 0.59 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2ctr n LEU 71 CO 0.37 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 2ctr n GLY 72 N 1.66 0.30 0.02 -0.72 0.00 -0.81 -4.43 105.19 101.21 2ctr n GLY 72 Ca -0.37 -1.92 0.01 0.00 0.00 0.00 0.00 46.02 43.74 2ctr n GLY 72 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2ctr n HIS 73 N 1.41 0.00 -0.03 1.61 -0.00 -1.26 -3.99 115.22 112.96 2ctr n HIS 73 Ca 0.00 0.00 -0.01 0.00 0.46 0.00 0.00 57.72 58.17 2ctr n HIS 73 Cb 0.00 -0.24 -0.14 0.00 -0.12 0.00 0.00 29.99 29.49 2ctr n HIS 73 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2ctr n SER 74 N -1.96 0.31 -0.11 0.26 3.41 -1.26 -4.03 113.62 110.24 2ctr n SER 74 Ca -0.05 0.13 -0.23 0.00 -0.26 0.00 0.00 58.87 58.46 2ctr n SER 74 Cb 0.41 0.96 -0.11 0.00 -0.26 0.00 0.00 64.21 65.20 2ctr n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ctr n ALA 75 N -2.50 0.83 0.09 7.33 0.00 -1.26 -3.77 120.51 121.23 2ctr n ALA 75 Ca -0.17 -0.56 -0.10 0.00 0.00 0.00 0.00 53.44 52.61 2ctr n ALA 75 Cb 0.90 -0.49 -0.06 0.00 0.00 0.00 0.00 19.45 19.80 2ctr n ALA 75 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2ctr h PHE 76 N -0.98 -0.87 -2.82 0.00 3.04 -1.79 -3.24 116.94 110.28 2ctr h PHE 76 Ca -0.39 0.02 -0.75 0.00 3.98 0.00 0.00 57.97 60.82 2ctr h PHE 76 Cb 1.36 0.36 -0.32 0.00 2.56 0.00 0.00 35.95 39.91 2ctr h PHE 76 CO 0.08 -0.36 0.38 -2.37 -2.02 0.00 0.00 178.31 174.02 2ctr n THR 77 N -4.19 4.44 -2.98 4.41 5.66 -1.26 -5.04 114.28 115.33 2ctr n THR 77 Ca -0.05 -5.68 -0.23 0.00 -3.05 0.00 0.00 64.05 55.03 2ctr n THR 77 Cb 0.25 -2.14 0.01 0.00 -1.55 0.00 0.00 70.33 66.90 2ctr n THR 77 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2ctr s SER 78 N -1.61 5.87 0.00 1.09 0.15 -1.22 -4.41 113.70 113.56 2ctr s SER 78 Ca 0.33 0.33 0.00 0.00 0.70 0.00 0.00 55.95 57.31 2ctr s SER 78 Cb 0.05 -1.59 0.00 0.00 -1.71 0.00 0.00 66.02 62.77 2ctr s SER 78 CO 0.05 -0.68 0.00 0.61 1.20 0.00 0.00 173.24 174.42 2ctr n GLY 79 N -2.08 2.86 0.27 9.45 0.00 -1.26 -4.84 105.19 109.58 2ctr n GLY 79 Ca 0.01 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 45.19 2ctr n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ctr h LYS 80 N 0.00 -0.60 0.00 1.61 1.79 -1.99 -3.48 116.57 113.90 2ctr h LYS 80 Ca 0.00 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2ctr h LYS 80 Cb 0.00 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 2ctr h LYS 80 CO 0.00 -0.31 0.00 0.41 -1.08 0.00 0.00 179.45 178.47 2ctr n GLY 81 N -0.17 0.65 3.45 3.86 0.00 -1.26 -4.90 105.19 106.81 2ctr n GLY 81 Ca -0.10 -0.76 -0.16 0.00 0.00 0.00 0.00 46.02 45.00 2ctr n GLY 81 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ctr s GLN 82 N 0.00 0.94 -0.01 1.61 -2.07 -1.26 -5.09 119.66 113.78 2ctr s GLN 82 Ca 0.00 0.18 -0.09 0.00 -1.82 0.00 0.00 55.36 53.63 2ctr s GLN 82 Cb 0.00 0.44 -0.05 0.00 -1.09 0.00 0.00 33.01 32.31 2ctr s GLN 82 CO 0.00 -0.28 0.68 0.77 -1.32 0.00 0.00 175.29 175.14 2ctr h SER 83 N 3.36 -0.28 0.00 12.60 0.02 -2.05 -3.49 113.55 123.72 2ctr h SER 83 Ca -0.28 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 2ctr h SER 83 Cb 1.15 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2ctr h SER 83 CO 0.38 -0.10 0.00 0.61 -1.14 0.00 0.00 176.83 176.58 2ctr n GLY 84 N 0.17 0.01 3.58 -3.77 0.00 -1.26 -5.17 105.19 98.74 2ctr n GLY 84 Ca -0.04 0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2ctr n GLY 84 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ctr s PRO 85 N 0.00 -1.58 0.31 1.61 0.04 -1.26 -5.02 135.00 129.10 2ctr s PRO 85 Ca 0.00 -0.19 -0.23 0.00 0.04 0.00 0.00 61.00 60.62 2ctr s PRO 85 Cb 0.00 -1.57 -0.10 0.00 0.04 0.00 0.00 34.50 32.88 2ctr s PRO 85 CO 0.00 -3.93 0.87 0.45 0.04 0.00 0.00 177.00 174.44 2ctr s SER 86 N -3.99 7.17 0.12 6.66 0.15 -1.26 -5.08 113.70 117.47 2ctr s SER 86 Ca 0.72 1.67 0.05 0.00 0.70 0.00 0.00 55.95 59.09 2ctr s SER 86 Cb -0.08 -2.52 -0.04 0.00 -1.71 0.00 0.00 66.02 61.68 2ctr s SER 86 CO 0.56 -0.09 -0.11 -0.55 1.20 0.00 0.00 173.24 174.24 2ctr s SER 87 N -1.74 1.72 0.00 5.45 0.15 -1.26 -4.09 113.70 113.92 2ctr s SER 87 Ca 0.50 -0.86 0.00 0.00 0.70 0.00 0.00 55.95 56.29 2ctr s SER 87 Cb -0.16 -0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.13 2ctr s SER 87 CO 0.21 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.02