#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 6.52 0.06 1.61 0.01 -1.26 -5.00 113.70 115.65 2ctr s SER 2 Ca 0.00 -1.70 0.05 0.00 1.31 0.00 0.00 55.95 55.61 2ctr s SER 2 Cb 0.00 -2.46 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 2ctr s SER 2 CO 0.00 -1.27 -0.06 -0.55 0.41 0.00 0.00 173.24 171.77 2ctr s SER 3 N 4.05 4.64 0.00 2.44 0.15 -1.26 -5.03 113.70 118.69 2ctr s SER 3 Ca 0.36 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.77 2ctr s SER 3 Cb -0.05 -1.02 0.00 0.00 -1.71 0.00 0.00 66.02 63.24 2ctr s SER 3 CO -0.07 0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.21 2ctr n GLY 4 N 1.05 1.36 3.83 9.45 0.00 -1.26 -5.15 105.19 114.47 2ctr n GLY 4 Ca -0.14 -0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 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 0.00 6.22 0.66 1.61 0.01 -1.26 -5.10 113.70 115.84 2ctr s SER 5 Ca 0.00 0.39 -0.11 0.00 1.31 0.00 0.00 55.95 57.54 2ctr s SER 5 Cb 0.00 -2.01 -0.02 0.00 0.21 0.00 0.00 66.02 64.21 2ctr s SER 5 CO 0.00 0.37 1.06 -0.94 0.41 0.00 0.00 173.24 174.14 2ctr s SER 6 N -0.79 5.87 0.00 2.44 1.04 -1.26 -4.92 113.70 116.07 2ctr s SER 6 Ca 0.14 1.30 0.00 0.00 0.48 0.00 0.00 55.95 57.87 2ctr s SER 6 Cb -0.12 -2.24 0.00 0.00 0.10 0.00 0.00 66.02 63.76 2ctr s SER 6 CO 0.03 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.77 2ctr n GLY 7 N -2.83 -2.29 3.96 7.32 0.00 -1.26 -5.09 105.19 104.99 2ctr n GLY 7 Ca 0.06 0.76 -0.23 0.00 0.00 0.00 0.00 46.02 46.61 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 0.32 6.33 0.10 1.61 0.01 -1.26 -4.97 113.70 115.84 2ctr s SER 8 Ca 0.00 0.15 -0.34 0.00 1.31 0.00 0.00 55.95 57.07 2ctr s SER 8 Cb 0.00 -1.90 -0.14 0.00 0.21 0.00 0.00 66.02 64.19 2ctr s SER 8 CO 0.00 -0.05 1.54 1.88 0.41 0.00 0.00 173.24 177.02 2ctr h TYR 9 N 1.49 -1.51 -1.62 2.43 0.05 -1.96 0.10 116.97 115.95 2ctr h TYR 9 Ca -0.50 0.04 0.51 0.00 0.05 0.00 0.00 58.73 58.83 2ctr h TYR 9 Cb 1.22 0.65 -0.11 0.00 1.01 0.00 0.00 36.73 39.50 2ctr h TYR 9 CO 0.49 -0.58 1.11 0.66 -1.05 0.00 0.00 178.16 178.79 2ctr n TYR 10 N -5.41 0.35 0.04 4.88 4.01 -1.26 0.14 117.16 119.91 2ctr n TYR 10 Ca -0.08 0.35 -0.20 0.00 -0.16 0.00 0.00 57.90 57.81 2ctr n TYR 10 Cb 0.40 -0.81 -0.15 0.00 -0.31 0.00 0.00 39.34 38.48 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 0.43 -0.72 7.72 5.19 -1.27 0.16 116.42 127.93 2ctr h ASP 11 Ca 0.88 -0.96 -0.01 0.00 -0.62 0.00 0.00 57.03 56.32 2ctr h ASP 11 Cb 3.20 -0.14 -0.03 0.00 0.18 0.00 0.00 39.33 42.53 2ctr h ASP 11 CO -0.24 1.37 0.40 0.40 -3.12 0.00 0.00 179.24 178.05 2ctr h ILE 12 N -0.42 1.22 0.15 0.35 2.04 0.24 -3.01 117.51 118.09 2ctr h ILE 12 Ca -0.14 -0.55 -0.30 0.00 1.00 0.00 0.00 64.86 64.87 2ctr h ILE 12 Cb 1.60 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 2ctr h ILE 12 CO 0.14 0.24 -1.44 -0.07 0.00 0.00 0.00 178.15 177.02 2ctr h LEU 13 N 1.00 0.48 -0.23 1.44 3.38 -0.73 -3.47 115.31 117.18 2ctr h LEU 13 Ca 0.25 -0.59 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2ctr h LEU 13 Cb 0.04 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2ctr h LEU 13 CO -0.04 1.48 0.00 0.61 0.09 0.00 0.00 178.44 180.58 2ctr n GLY 14 N 1.64 1.13 3.40 0.83 0.00 0.31 -4.71 105.19 107.80 2ctr n GLY 14 Ca -0.14 -0.26 -0.26 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.23 2.24 0.77 1.61 -7.23 0.14 -5.01 120.40 110.69 2ctr s VAL 15 Ca 0.00 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.11 2ctr s VAL 15 Cb 0.00 -2.04 0.05 0.00 0.56 0.00 0.00 36.38 34.95 2ctr s VAL 15 CO 0.00 -0.10 1.09 -2.16 -0.31 0.00 0.00 175.10 173.62 2ctr s PRO 16 N -2.55 2.28 0.61 4.82 0.04 -1.26 -4.57 135.00 134.36 2ctr s PRO 16 Ca 0.18 1.17 0.34 0.00 0.04 0.00 0.00 61.00 62.74 2ctr s PRO 16 Cb -0.08 -1.90 1.96 0.00 0.04 0.00 0.00 34.50 34.53 2ctr s PRO 16 CO 0.09 -1.63 2.27 0.87 0.04 0.00 0.00 177.00 178.64 2ctr h LYS 17 N -1.09 0.00 -0.31 4.56 1.79 -2.00 -0.24 116.57 119.28 2ctr h LYS 17 Ca -0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 2ctr h LYS 17 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2ctr h LYS 17 CO 0.51 0.01 0.00 0.45 -1.08 0.00 0.00 179.45 179.34 2ctr n SER 18 N -3.60 4.08 -4.69 0.86 2.88 -1.26 -5.02 113.62 106.87 2ctr n SER 18 Ca -0.03 -2.94 -0.45 0.00 -1.33 0.00 0.00 58.87 54.12 2ctr n SER 18 Cb 0.09 -0.55 -0.04 0.00 -0.75 0.00 0.00 64.21 62.97 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 -0.29 1.90 -1.74 -1.46 0.00 -0.10 -4.96 120.51 113.86 2ctr n ALA 19 Ca 0.22 0.42 -0.33 0.00 0.00 0.00 0.00 53.44 53.75 2ctr n ALA 19 Cb 0.91 -2.43 -0.01 0.00 0.00 0.00 0.00 19.45 17.91 2ctr n ALA 19 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2ctr s SER 20 N 1.25 6.15 0.21 0.00 0.15 -1.26 -4.72 113.70 115.48 2ctr s SER 20 Ca 0.78 1.73 -0.13 0.00 0.70 0.00 0.00 55.95 59.04 2ctr s SER 20 Cb -0.61 -2.53 0.26 0.00 -1.71 0.00 0.00 66.02 61.43 2ctr s SER 20 CO 0.36 -0.91 1.34 1.21 1.20 0.00 0.00 173.24 176.44 2ctr n GLU 21 N -1.76 -0.17 -0.30 5.44 2.13 -1.26 0.17 120.64 124.89 2ctr n GLU 21 Ca 0.08 1.33 0.04 0.00 0.66 0.00 0.00 57.16 59.27 2ctr n GLU 21 Cb 0.53 -1.98 0.18 0.00 0.27 0.00 0.00 31.44 30.44 2ctr n GLU 21 CO 0.00 0.00 0.00 0.07 -0.41 0.00 0.00 177.13 176.79 2ctr h ARG 22 N 0.00 0.78 -0.54 5.31 0.11 -1.98 0.22 114.38 118.28 2ctr h ARG 22 Ca 0.33 -0.05 -0.03 0.00 0.10 0.00 0.00 59.98 60.33 2ctr h ARG 22 Cb 0.54 -0.18 -0.02 0.00 1.11 0.00 0.00 29.97 31.42 2ctr h ARG 22 CO -0.86 0.52 0.23 1.96 0.10 0.00 0.00 179.97 181.91 2ctr h GLN 23 N 0.81 0.79 -0.30 0.08 4.20 0.14 0.18 115.11 121.01 2ctr h GLN 23 Ca 0.41 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.91 2ctr h GLN 23 Cb 0.40 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2ctr h GLN 23 CO -0.26 0.68 -0.10 0.82 -0.67 0.00 0.00 178.83 179.30 2ctr h ILE 24 N 0.72 1.29 -0.52 2.54 2.04 -0.10 0.47 117.51 123.95 2ctr h ILE 24 Ca 0.18 -1.17 -0.09 0.00 1.00 0.00 0.00 64.86 64.78 2ctr h ILE 24 Cb 0.17 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 2ctr h ILE 24 CO -0.02 0.37 -0.03 0.11 0.00 0.00 0.00 178.15 178.58 2ctr h LYS 25 N 0.36 0.91 -0.06 2.37 1.57 -0.47 -0.91 116.57 120.34 2ctr h LYS 25 Ca 0.07 -0.28 -0.04 0.00 -1.87 0.00 0.00 60.65 58.53 2ctr h LYS 25 Cb 0.61 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 2ctr h LYS 25 CO 0.04 0.93 -0.10 0.87 -0.57 0.00 0.00 179.45 180.62 2ctr h LYS 26 N 0.84 0.18 -0.81 3.15 1.57 -0.57 0.34 116.57 121.26 2ctr h LYS 26 Ca 0.15 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 2ctr h LYS 26 Cb 0.54 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.82 2ctr h LYS 26 CO 0.03 0.67 0.54 0.00 -0.57 0.00 0.00 179.45 180.12 2ctr h ALA 27 N 0.51 1.03 0.19 3.86 0.00 -0.86 -2.51 119.26 121.48 2ctr h ALA 27 Ca 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2ctr h ALA 27 Cb 0.65 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2ctr h ALA 27 CO 0.02 0.44 -0.09 0.35 0.00 0.00 0.00 179.25 179.97 2ctr h PHE 28 N 1.10 -0.24 -0.08 0.00 3.57 -1.19 -3.02 116.94 117.08 2ctr h PHE 28 Ca 0.30 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.80 2ctr h PHE 28 Cb -0.12 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 2ctr h PHE 28 CO -0.02 0.18 -0.06 0.45 -2.23 0.00 0.00 178.31 176.63 2ctr h HIS 29 N -0.81 -0.20 -0.82 0.41 3.86 -0.86 0.26 115.15 117.00 2ctr h HIS 29 Ca -0.03 0.01 0.16 0.00 -1.16 0.00 0.00 60.37 59.35 2ctr h HIS 29 Cb 0.52 0.10 -0.15 0.00 1.06 0.00 0.00 27.41 28.93 2ctr h HIS 29 CO 0.07 -0.05 -0.25 1.57 0.86 0.00 0.00 177.93 180.13 2ctr h LYS 30 N -0.02 -0.02 0.25 2.45 2.10 -1.59 -1.77 116.57 117.97 2ctr h LYS 30 Ca 0.01 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.66 2ctr h LYS 30 Cb 0.06 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.38 2ctr h LYS 30 CO -0.08 -0.02 -0.29 -0.07 -2.00 0.00 0.00 179.45 176.99 2ctr h LEU 31 N -0.03 -0.81 -1.28 7.07 3.38 -1.05 -1.66 115.31 120.95 2ctr h LEU 31 Ca 0.37 0.07 0.42 0.00 0.09 0.00 0.00 57.88 58.82 2ctr h LEU 31 Cb 0.60 0.27 -0.10 0.00 0.09 0.00 0.00 40.66 41.52 2ctr h LEU 31 CO -0.85 -0.37 0.86 0.00 0.09 0.00 0.00 178.44 178.17 2ctr n ALA 32 N -2.59 1.25 -0.04 1.53 0.00 0.78 0.21 120.51 121.64 2ctr n ALA 32 Ca -0.07 0.66 -0.14 0.00 0.00 0.00 0.00 53.44 53.90 2ctr n ALA 32 Cb 0.26 -0.89 -0.08 0.00 0.00 0.00 0.00 19.45 18.74 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 0.30 0.00 0.00 2.86 -0.89 1.46 114.93 118.66 2ctr h MET 33 Ca 0.74 -0.18 -0.04 0.00 -2.06 0.00 0.00 59.70 58.16 2ctr h MET 33 Cb 2.56 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 34.23 2ctr h MET 33 CO -0.27 0.76 -0.18 -0.22 1.06 0.00 0.00 176.91 178.05 2ctr h LYS 34 N -0.13 0.00 -0.01 1.72 3.64 0.29 -2.67 116.57 119.41 2ctr h LYS 34 Ca 0.01 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2ctr h LYS 34 Cb 0.74 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.55 2ctr h LYS 34 CO 0.04 0.18 -0.22 0.66 -2.27 0.00 0.00 179.45 177.84 2ctr n TYR 35 N -4.22 0.02 -1.93 1.91 4.01 -0.32 -4.88 117.16 111.76 2ctr n TYR 35 Ca -0.02 -1.22 -0.42 0.00 -0.16 0.00 0.00 57.90 56.07 2ctr n TYR 35 Cb 0.25 -0.20 -0.03 0.00 -0.31 0.00 0.00 39.34 39.05 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 -3.04 1.98 -2.00 -0.72 2.46 0.50 -4.25 115.29 110.22 2ctr s HIS 36 Ca 0.35 0.12 0.12 0.00 0.47 0.00 0.00 55.06 56.12 2ctr s HIS 36 Cb 0.32 -3.98 0.72 0.00 -0.13 0.00 0.00 32.58 29.51 2ctr s HIS 36 CO -0.01 -4.13 1.15 -0.35 -2.47 0.00 0.00 174.74 168.92 2ctr n PRO 37 N 6.79 0.49 -0.05 2.88 -0.04 -1.26 0.10 135.00 143.90 2ctr n PRO 37 Ca 0.17 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.58 2ctr n PRO 37 Cb 0.42 -1.39 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 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 -0.89 2.35 -0.12 3.54 9.92 -1.26 -4.16 116.55 125.93 2ctr n ASP 38 Ca 0.09 -0.01 -0.17 0.00 -0.53 0.00 0.00 54.79 54.17 2ctr n ASP 38 Cb 0.04 0.70 -0.13 0.00 -0.64 0.00 0.00 41.12 41.10 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 -2.44 0.66 0.00 -1.24 4.76 -1.00 -4.47 118.16 114.43 2ctr n LYS 39 Ca -0.18 0.13 -0.12 0.00 -2.87 0.00 0.00 58.31 55.27 2ctr n LYS 39 Cb 0.85 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 32.52 2ctr n LYS 39 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 2ctr h ASN 40 N 0.00 0.70 -6.62 4.39 -0.73 -0.62 -3.47 115.58 109.23 2ctr h ASN 40 Ca -0.57 -0.43 -0.53 0.00 1.87 0.00 0.00 56.30 56.64 2ctr h ASN 40 Cb 1.94 -0.21 -0.15 0.00 0.27 0.00 0.00 38.32 40.18 2ctr h ASN 40 CO -0.07 1.18 -0.83 0.29 -0.37 0.00 0.00 177.43 177.63 2ctr n LYS 41 N -3.92 -3.57 -4.37 6.67 5.02 -1.25 -4.95 118.16 111.79 2ctr n LYS 41 Ca -0.05 0.41 -0.25 0.00 -2.02 0.00 0.00 58.31 56.41 2ctr n LYS 41 Cb 0.68 -5.04 -0.12 0.00 -0.02 0.00 0.00 35.03 30.53 2ctr n LYS 41 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2ctr s SER 42 N -3.53 3.02 0.21 4.39 0.01 -1.26 -5.05 113.70 111.49 2ctr s SER 42 Ca 0.57 -0.83 -0.02 0.00 1.31 0.00 0.00 55.95 56.98 2ctr s SER 42 Cb -0.31 -0.20 0.18 0.00 0.21 0.00 0.00 66.02 65.90 2ctr s SER 42 CO 0.90 0.06 1.57 1.55 0.41 0.00 0.00 173.24 177.73 2ctr h PRO 43 N 3.40 0.59 -0.08 12.44 0.13 -2.01 -3.03 132.00 143.44 2ctr h PRO 43 Ca -0.45 -0.31 -0.20 0.00 -0.87 0.00 0.00 66.00 64.17 2ctr h PRO 43 Cb 1.20 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2ctr h PRO 43 CO 0.47 0.91 -0.77 0.38 -0.23 0.00 0.00 178.00 178.76 2ctr h ASP 44 N 0.48 0.57 -0.20 1.44 3.04 -2.00 -3.27 116.42 116.48 2ctr h ASP 44 Ca 0.04 -0.39 0.02 0.00 -3.24 0.00 0.00 57.03 53.46 2ctr h ASP 44 Cb 0.94 -0.17 -0.02 0.00 -1.04 0.00 0.00 39.33 39.04 2ctr h ASP 44 CO 0.08 1.14 0.07 0.00 -2.04 0.00 0.00 179.24 178.50 2ctr h ALA 45 N 0.84 0.22 -0.84 4.15 0.00 -1.88 -2.35 119.26 119.40 2ctr h ALA 45 Ca -0.04 0.02 0.21 0.00 0.00 0.00 0.00 54.91 55.09 2ctr h ALA 45 Cb 1.37 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 19.01 2ctr h ALA 45 CO 0.14 -0.35 0.05 1.49 0.00 0.00 0.00 179.25 180.57 2ctr h GLU 46 N 0.17 0.10 -0.06 0.00 4.81 -1.58 0.47 114.58 118.49 2ctr h GLU 46 Ca 0.08 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2ctr h GLU 46 Cb 0.05 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 2ctr h GLU 46 CO -0.08 0.07 0.01 0.00 -0.73 0.00 0.00 179.01 178.27 2ctr h ALA 47 N 1.79 0.07 -0.12 2.92 0.00 -1.58 -2.46 119.26 119.88 2ctr h ALA 47 Ca 0.48 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.28 2ctr h ALA 47 Cb 0.91 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 2ctr h ALA 47 CO -0.73 -0.29 -0.42 0.87 0.00 0.00 0.00 179.25 178.68 2ctr h LYS 48 N -0.15 -0.42 -0.91 0.00 1.79 -0.44 -0.07 116.57 116.37 2ctr h LYS 48 Ca 0.02 0.03 0.19 0.00 -2.18 0.00 0.00 60.65 58.71 2ctr h LYS 48 Cb 0.27 0.10 -0.07 0.00 -1.58 0.00 0.00 32.23 30.94 2ctr h LYS 48 CO 0.00 -0.28 0.59 0.35 -1.08 0.00 0.00 179.45 179.03 2ctr h PHE 49 N -0.44 0.67 -0.05 -1.35 3.04 -1.31 0.38 116.94 117.88 2ctr h PHE 49 Ca 0.03 0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.01 2ctr h PHE 49 Cb 0.52 -0.20 -0.00 0.00 2.56 0.00 0.00 35.95 38.82 2ctr h PHE 49 CO -0.57 0.19 0.17 -0.09 -2.02 0.00 0.00 178.31 175.99 2ctr h ARG 50 N 0.51 0.00 0.00 1.11 9.65 -0.51 0.21 114.38 125.35 2ctr h ARG 50 Ca 0.48 0.00 -0.37 0.00 -1.10 0.00 0.00 59.98 58.99 2ctr h ARG 50 Cb 1.04 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.55 2ctr h ARG 50 CO -0.21 0.00 -2.38 0.39 2.80 0.00 0.00 179.97 180.57 2ctr n GLU 51 N -3.24 0.73 -0.04 0.20 -0.58 0.13 -4.06 120.64 113.77 2ctr n GLU 51 Ca -0.01 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.58 2ctr n GLU 51 Cb 0.25 -1.51 -0.08 0.00 -0.57 0.00 0.00 31.44 29.52 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 1.36 0.53 -3.67 2.04 -0.35 -2.94 117.51 114.48 2ctr h ILE 52 Ca -0.54 -1.73 -0.03 0.00 1.00 0.00 0.00 64.86 63.56 2ctr h ILE 52 Cb 2.21 2.11 0.01 0.00 -0.74 0.00 0.00 36.82 40.40 2ctr h ILE 52 CO 0.02 0.52 -0.25 0.00 0.00 0.00 0.00 178.15 178.44 2ctr h ALA 53 N 0.51 -1.17 -1.13 1.87 0.00 -0.86 -1.78 119.26 116.70 2ctr h ALA 53 Ca -0.02 -0.15 0.34 0.00 0.00 0.00 0.00 54.91 55.08 2ctr h ALA 53 Cb 1.05 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 18.99 2ctr h ALA 53 CO 0.09 -1.12 0.71 1.49 0.00 0.00 0.00 179.25 180.42 2ctr h GLU 54 N -0.72 0.26 -0.58 0.00 4.81 -1.71 0.76 114.58 117.41 2ctr h GLU 54 Ca -0.07 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.05 2ctr h GLU 54 Cb 0.54 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 2ctr h GLU 54 CO 0.12 0.17 0.01 0.00 -0.73 0.00 0.00 179.01 178.58 2ctr h ALA 55 N 1.67 0.92 0.03 2.92 0.00 -1.31 -3.15 119.26 120.33 2ctr h ALA 55 Ca 0.71 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 55.32 2ctr h ALA 55 Cb 1.92 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.49 2ctr h ALA 55 CO -0.41 0.65 -0.01 -0.92 0.00 0.00 0.00 179.25 178.55 2ctr h TYR 56 N 0.92 -0.04 -0.89 0.00 3.20 0.13 -3.08 116.97 117.21 2ctr h TYR 56 Ca 0.17 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.24 2ctr h TYR 56 Cb 0.52 0.01 -0.17 0.00 1.54 0.00 0.00 36.73 38.64 2ctr h TYR 56 CO 0.03 0.61 -0.13 0.39 -1.64 0.00 0.00 178.16 177.43 2ctr n GLU 57 N -4.78 -0.08 -0.00 1.82 1.02 0.31 0.21 120.64 119.14 2ctr n GLU 57 Ca -0.09 1.36 -0.12 0.00 -0.02 0.00 0.00 57.16 58.29 2ctr n GLU 57 Cb 0.33 -2.08 -0.08 0.00 -0.02 0.00 0.00 31.44 29.59 2ctr n GLU 57 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2ctr h THR 58 N 0.00 1.24 -0.10 2.62 2.02 -1.62 -2.67 112.91 114.40 2ctr h THR 58 Ca 0.47 -0.73 0.00 0.00 0.77 0.00 0.00 66.41 66.92 2ctr h THR 58 Cb 0.82 1.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.92 2ctr h THR 58 CO -0.88 0.19 0.00 0.18 0.37 0.00 0.00 175.52 175.38 2ctr n LEU 59 N -4.91 0.82 -0.10 2.58 4.77 0.16 -1.37 117.00 118.95 2ctr n LEU 59 Ca -0.07 -0.41 -0.17 0.00 -0.03 0.00 0.00 56.01 55.32 2ctr n LEU 59 Cb 0.17 -0.18 -0.08 0.00 -2.33 0.00 0.00 43.42 41.00 2ctr n LEU 59 CO 0.34 0.18 -0.59 -0.24 -1.33 0.00 0.00 177.39 175.74 2ctr n SER 60 N -0.13 1.86 -3.01 -1.43 2.88 0.55 -4.90 113.62 109.44 2ctr n SER 60 Ca 0.03 0.47 -0.15 0.00 -1.33 0.00 0.00 58.87 57.89 2ctr n SER 60 Cb 0.16 -0.91 0.12 0.00 -0.75 0.00 0.00 64.21 62.83 2ctr n SER 60 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2ctr n ASP 61 N -4.46 -0.96 -0.03 -3.46 2.03 -1.21 -4.98 116.55 103.48 2ctr n ASP 61 Ca -0.27 -0.99 -0.03 0.00 0.52 0.00 0.00 54.79 54.02 2ctr n ASP 61 Cb 0.58 -0.51 -0.01 0.00 -0.72 0.00 0.00 41.12 40.46 2ctr n ASP 61 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ctr n ALA 62 N -3.76 0.27 -0.24 -1.67 0.00 -1.26 -3.77 120.51 110.08 2ctr n ALA 62 Ca -0.11 -0.36 0.01 0.00 0.00 0.00 0.00 53.44 52.98 2ctr n ALA 62 Cb 0.30 0.01 0.13 0.00 0.00 0.00 0.00 19.45 19.89 2ctr n ALA 62 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2ctr h ASN 63 N -0.42 0.48 0.33 0.00 2.35 -1.97 0.31 115.58 116.66 2ctr h ASN 63 Ca 0.00 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 2ctr h ASN 63 Cb 0.31 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 2ctr h ASN 63 CO 0.00 0.28 -0.26 0.03 -1.65 0.00 0.00 177.43 175.84 2ctr h ARG 64 N 0.62 -0.57 0.00 0.81 3.08 -1.81 -0.27 114.38 116.25 2ctr h ARG 64 Ca 0.34 0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.38 2ctr h ARG 64 Cb 0.33 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2ctr h ARG 64 CO -0.25 -0.38 -0.22 -0.09 -1.07 0.00 0.00 179.97 177.96 2ctr h ARG 65 N -0.59 0.00 -0.03 0.04 1.12 -0.81 -1.61 114.38 112.50 2ctr h ARG 65 Ca -0.02 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.84 2ctr h ARG 65 Cb 0.51 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.47 2ctr h ARG 65 CO -0.01 0.22 0.00 -0.22 -3.11 0.00 0.00 179.97 176.85 2ctr h LYS 66 N 0.00 0.05 -0.40 0.20 3.64 0.20 -2.12 116.57 118.15 2ctr h LYS 66 Ca -0.00 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 2ctr h LYS 66 Cb 0.40 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 2ctr h LYS 66 CO 0.03 0.35 -0.16 0.93 -2.27 0.00 0.00 179.45 178.33 2ctr h GLU 67 N -0.24 0.73 -0.22 1.90 5.08 -0.87 0.12 114.58 121.07 2ctr h GLU 67 Ca 0.01 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.08 2ctr h GLU 67 Cb 0.32 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2ctr h GLU 67 CO 0.00 0.85 -0.01 -0.92 -1.00 0.00 0.00 179.01 177.93 2ctr h TYR 68 N 0.66 0.34 0.08 4.33 3.20 -1.24 0.33 116.97 124.67 2ctr h TYR 68 Ca 0.10 -0.02 -0.23 0.00 3.14 0.00 0.00 58.73 61.73 2ctr h TYR 68 Cb 0.63 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 2ctr h TYR 68 CO 0.03 0.36 -1.17 0.22 -1.64 0.00 0.00 178.16 175.97 2ctr h ASP 69 N 0.33 0.26 0.31 -2.11 1.82 -1.06 0.42 116.42 116.39 2ctr h ASP 69 Ca 0.07 -0.81 -0.06 0.00 -0.39 0.00 0.00 57.03 55.84 2ctr h ASP 69 Cb 0.24 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 40.16 2ctr h ASP 69 CO 0.01 1.50 -0.28 0.00 -1.61 0.00 0.00 179.24 178.86 2ctr h THR 70 N -0.53 1.13 0.00 2.25 1.03 -0.68 -3.31 112.91 112.80 2ctr h THR 70 Ca -0.26 -0.97 -0.36 0.00 -0.01 0.00 0.00 66.41 64.81 2ctr h THR 70 Cb 1.57 1.53 -0.05 0.00 -1.07 0.00 0.00 68.15 70.12 2ctr h THR 70 CO 0.00 0.27 -2.19 0.18 -0.01 0.00 0.00 175.52 173.77 2ctr n LEU 71 N -4.12 1.73 0.00 0.00 4.77 0.12 -5.06 117.00 114.43 2ctr n LEU 71 Ca -0.02 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 2ctr n LEU 71 Cb 0.33 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2ctr n LEU 71 CO 0.37 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 2ctr n GLY 72 N 1.50 0.13 0.34 -0.72 0.00 0.15 -4.52 105.19 102.07 2ctr n GLY 72 Ca -0.44 -1.66 -0.07 0.00 0.00 0.00 0.00 46.02 43.84 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 0.00 0.00 0.03 1.61 -0.00 -1.26 -4.10 115.22 111.50 2ctr n HIS 73 Ca 0.00 0.00 -0.20 0.00 0.46 0.00 0.00 57.72 57.98 2ctr n HIS 73 Cb 0.00 -0.31 -0.10 0.00 -0.12 0.00 0.00 29.99 29.46 2ctr n HIS 73 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2ctr h SER 74 N -0.14 0.92 0.01 0.26 4.64 -1.94 -2.90 113.55 114.40 2ctr h SER 74 Ca -0.20 -0.71 -0.00 0.00 -0.47 0.00 0.00 61.79 60.41 2ctr h SER 74 Cb 1.24 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 2ctr h SER 74 CO -0.08 1.50 -0.00 0.00 -0.87 0.00 0.00 176.83 177.39 2ctr h ALA 75 N 0.43 -0.01 -0.85 5.18 0.00 -1.85 -3.28 119.26 118.88 2ctr h ALA 75 Ca -0.11 -0.40 0.20 0.00 0.00 0.00 0.00 54.91 54.59 2ctr h ALA 75 Cb 1.62 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.36 2ctr h ALA 75 CO 0.19 -0.08 0.57 0.35 0.00 0.00 0.00 179.25 180.28 2ctr h PHE 76 N -0.85 0.43 -0.45 0.00 3.57 -1.71 -2.09 116.94 115.83 2ctr h PHE 76 Ca -0.00 0.01 -0.33 0.00 3.53 0.00 0.00 57.97 61.18 2ctr h PHE 76 Cb 0.81 -0.13 -0.11 0.00 2.79 0.00 0.00 35.95 39.30 2ctr h PHE 76 CO 0.21 0.13 0.01 0.25 -2.23 0.00 0.00 178.31 176.68 2ctr n THR 77 N -4.47 3.17 -3.44 4.41 -2.24 -1.09 -4.88 114.28 105.74 2ctr n THR 77 Ca 0.18 -2.16 -0.41 0.00 -2.27 0.00 0.00 64.05 59.39 2ctr n THR 77 Cb 0.69 -1.84 -0.10 0.00 -2.10 0.00 0.00 70.33 66.98 2ctr n THR 77 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2ctr s SER 78 N 1.30 6.14 0.00 3.42 0.15 -0.79 -4.45 113.70 119.47 2ctr s SER 78 Ca 0.64 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.95 2ctr s SER 78 Cb 0.34 -2.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.47 2ctr s SER 78 CO -0.09 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.63 2ctr n GLY 79 N 5.02 2.28 2.89 9.45 0.00 -1.26 -5.08 105.19 118.48 2ctr n GLY 79 Ca -0.10 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 2ctr n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ctr s LYS 80 N 0.00 1.34 0.00 1.61 -2.85 -1.26 -5.10 119.74 113.47 2ctr s LYS 80 Ca 0.00 -1.82 0.00 0.00 -1.00 0.00 0.00 55.97 53.15 2ctr s LYS 80 Cb 0.00 -2.78 0.00 0.00 -2.06 0.00 0.00 37.83 32.99 2ctr s LYS 80 CO 0.00 -1.02 0.00 0.41 0.10 0.00 0.00 175.35 174.84 2ctr n GLY 81 N 4.09 -2.76 3.67 0.59 0.00 -1.26 -4.67 105.19 104.84 2ctr n GLY 81 Ca 0.03 -0.93 -0.25 0.00 0.00 0.00 0.00 46.02 44.87 2ctr n GLY 81 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ctr n GLN 82 N 0.00 -7.31 -0.03 1.61 6.02 -1.26 -4.89 117.38 111.51 2ctr n GLN 82 Ca 0.00 0.77 -0.08 0.00 -0.01 0.00 0.00 57.00 57.69 2ctr n GLN 82 Cb 0.00 -5.78 -0.03 0.00 1.02 0.00 0.00 30.24 25.45 2ctr n GLN 82 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2ctr n SER 83 N -2.98 0.63 -0.73 1.08 2.88 -1.26 -5.10 113.62 108.13 2ctr n SER 83 Ca -0.00 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 2ctr n SER 83 Cb 0.56 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 2ctr n SER 83 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ctr n GLY 84 N 2.56 0.31 3.77 0.46 0.00 -1.26 -5.07 105.19 105.96 2ctr n GLY 84 Ca -0.14 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.49 3.07 0.09 1.61 0.04 -1.26 -5.06 135.00 131.00 2ctr s PRO 85 Ca 0.00 1.49 0.10 0.00 0.04 0.00 0.00 61.00 62.63 2ctr s PRO 85 Cb 0.00 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.53 2ctr s PRO 85 CO 0.00 -1.06 -0.26 0.45 0.04 0.00 0.00 177.00 176.17 2ctr s SER 86 N -2.21 3.31 0.09 6.66 0.15 -1.26 -5.05 113.70 115.39 2ctr s SER 86 Ca 0.70 -0.66 -0.19 0.00 0.70 0.00 0.00 55.95 56.50 2ctr s SER 86 Cb -0.22 -0.29 -0.08 0.00 -1.71 0.00 0.00 66.02 63.72 2ctr s SER 86 CO 0.35 0.22 1.54 0.77 1.20 0.00 0.00 173.24 177.32 2ctr h SER 87 N 4.29 0.41 0.00 5.45 4.64 -2.09 -3.53 113.55 122.72 2ctr h SER 87 Ca -0.49 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 60.55 2ctr h SER 87 Cb 1.16 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2ctr h SER 87 CO 0.42 0.58 0.00 0.61 -0.87 0.00 0.00 176.83 177.57