#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1don n PRO 2 N 0.00 1.06 0.00 3.69 -0.02 -1.26 -5.04 135.00 133.43 1don n PRO 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1don n PRO 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1don n PRO 2 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1don n ASP 3 N 0.00 0.00 0.00 2.55 5.68 -1.26 -5.04 116.55 118.48 1don n ASP 3 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1don n ASP 3 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1don n ASP 3 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1don n ALA 4 N 0.00 0.00 0.45 2.12 0.00 -1.26 -5.00 120.51 116.82 1don n ALA 4 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1don n ALA 4 Cb 0.00 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.57 1don n ALA 4 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1don h ILE 5 N 0.00 0.00 -1.04 0.00 2.04 -2.04 -3.36 117.51 113.11 1don h ILE 5 Ca 0.00 -0.62 -0.73 0.00 1.00 0.00 0.00 64.86 64.51 1don h ILE 5 Cb 0.00 1.18 -0.11 0.00 -0.74 0.00 0.00 36.82 37.15 1don h ILE 5 CO 0.00 0.00 2.51 -0.46 0.00 0.00 0.00 178.15 180.20 1don n ASN 6 N -2.26 8.09 -4.66 1.72 6.94 -1.26 -4.93 115.26 118.90 1don n ASN 6 Ca 0.02 -3.09 -0.35 0.00 -0.02 0.00 0.00 54.58 51.15 1don n ASN 6 Cb 0.47 -1.38 -0.10 0.00 -2.36 0.00 0.00 39.78 36.41 1don n ASN 6 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1don s ALA 7 N -0.87 3.22 -0.55 -2.53 0.00 -1.26 -5.03 121.76 114.74 1don s ALA 7 Ca 0.56 -0.82 -0.27 0.00 0.00 0.00 0.00 51.96 51.43 1don s ALA 7 Cb 0.19 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.84 1don s ALA 7 CO -0.09 0.58 1.96 -1.25 0.00 0.00 0.00 175.76 176.95 1don s PRO 8 N -0.84 2.62 -0.82 0.00 0.04 -1.26 -4.90 135.00 129.84 1don s PRO 8 Ca 0.13 0.86 -0.21 0.00 0.04 0.00 0.00 61.00 61.82 1don s PRO 8 Cb -0.11 -4.40 0.09 0.00 0.04 0.00 0.00 34.50 30.12 1don s PRO 8 CO 0.02 -2.73 1.09 0.54 0.04 0.00 0.00 177.00 175.97 1don s VAL 9 N 9.38 4.45 -0.24 -0.36 0.11 -1.26 -4.97 120.40 127.51 1don s VAL 9 Ca 0.74 -0.92 -0.29 0.00 -2.93 0.00 0.00 61.98 58.59 1don s VAL 9 Cb -0.15 -4.77 -0.06 0.00 -1.53 0.00 0.00 36.38 29.88 1don s VAL 9 CO 0.23 -1.54 2.23 0.41 -3.33 0.00 0.00 175.10 173.11 1don n THR 10 N 5.84 0.31 -3.59 5.04 -1.04 -1.26 -4.89 114.28 114.70 1don n THR 10 Ca 0.12 -0.46 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 1don n THR 10 Cb 0.48 -2.48 0.00 0.00 -1.82 0.00 0.00 70.33 66.51 1don n THR 10 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1don n TYR 13 N -0.08 -0.01 -4.19 0.00 4.01 -1.26 -4.96 117.16 110.67 1don n TYR 13 Ca -0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.65 1don n TYR 13 Cb 0.06 0.06 -0.02 0.00 -0.31 0.00 0.00 39.34 39.13 1don n TYR 13 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1don n ASN 14 N -1.62 1.97 -3.64 7.72 3.02 -1.26 -5.15 115.26 116.30 1don n ASN 14 Ca 0.00 -1.63 -0.12 0.00 -0.03 0.00 0.00 54.58 52.80 1don n ASN 14 Cb 0.00 0.16 -0.12 0.00 -0.61 0.00 0.00 39.78 39.22 1don n ASN 14 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1don s PHE 15 N -1.66 -0.57 -0.63 3.10 0.08 -1.26 -4.69 117.98 112.35 1don s PHE 15 Ca 0.02 1.14 -0.32 0.00 0.12 0.00 0.00 56.93 57.89 1don s PHE 15 Cb 0.00 0.08 -0.15 0.00 -0.57 0.00 0.00 43.02 42.38 1don s PHE 15 CO 0.01 -0.43 2.43 -2.37 -0.10 0.00 0.00 175.22 174.76 1don n THR 16 N 5.37 0.03 0.07 0.64 5.66 -0.49 -4.73 114.28 120.83 1don n THR 16 Ca -0.07 -0.30 0.10 0.00 -3.05 0.00 0.00 64.05 60.74 1don n THR 16 Cb 0.50 -1.47 0.27 0.00 -1.55 0.00 0.00 70.33 68.08 1don n THR 16 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1don n ASN 17 N 11.57 3.29 -4.82 1.09 5.15 -1.26 -4.54 115.26 125.74 1don n ASN 17 Ca 0.50 -1.99 -0.37 0.00 -0.60 0.00 0.00 54.58 52.12 1don n ASN 17 Cb 0.23 -0.40 -0.07 0.00 -0.53 0.00 0.00 39.78 39.01 1don n ASN 17 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1don s ARG 18 N -1.20 3.81 -0.76 1.20 0.52 -1.26 -4.97 118.95 116.28 1don s ARG 18 Ca 0.41 -0.04 -0.24 0.00 -0.52 0.00 0.00 55.73 55.34 1don s ARG 18 Cb 0.22 -3.28 -0.16 0.00 0.52 0.00 0.00 34.95 32.24 1don s ARG 18 CO 0.28 0.57 2.40 1.63 0.02 0.00 0.00 175.30 180.20 1don n LYS 19 N 2.57 0.56 -2.74 3.54 5.02 -1.26 -4.86 118.16 120.98 1don n LYS 19 Ca -0.17 -0.52 -0.42 0.00 -2.02 0.00 0.00 58.31 55.18 1don n LYS 19 Cb 0.53 -3.19 -0.03 0.00 -0.02 0.00 0.00 35.03 32.32 1don n LYS 19 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1don s ILE 20 N 12.10 4.83 -0.13 -0.18 1.01 -1.26 -4.94 121.20 132.62 1don s ILE 20 Ca 1.01 1.95 -0.40 0.00 0.00 0.00 0.00 60.65 63.21 1don s ILE 20 Cb -0.29 -4.27 -0.18 0.00 0.01 0.00 0.00 42.46 37.73 1don s ILE 20 CO 0.20 0.05 1.43 -0.24 0.00 0.00 0.00 174.94 176.38 1don n SER 21 N 4.81 1.41 0.31 3.58 2.88 -1.26 -4.75 113.62 120.60 1don n SER 21 Ca 0.07 1.13 0.18 0.00 -1.33 0.00 0.00 58.87 58.92 1don n SER 21 Cb 0.49 -1.07 0.94 0.00 -0.75 0.00 0.00 64.21 63.83 1don n SER 21 CO 0.00 0.00 0.00 1.62 -1.23 0.00 0.00 175.04 175.43 1don h VAL 22 N 4.04 0.08 -0.22 2.46 3.04 -1.95 0.10 116.25 123.80 1don h VAL 22 Ca -0.47 0.00 -0.06 0.00 -1.01 0.00 0.00 66.70 65.16 1don h VAL 22 Cb 1.36 0.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.42 1don h VAL 22 CO 0.83 0.00 -0.08 0.06 -1.01 0.00 0.00 177.57 177.37 1don h GLN 23 N 0.00 0.45 -0.64 4.17 3.07 -2.01 -2.66 115.11 117.48 1don h GLN 23 Ca 0.02 -0.19 0.11 0.00 0.09 0.00 0.00 58.65 58.68 1don h GLN 23 Cb 0.45 -0.02 -0.04 0.00 0.08 0.00 0.00 27.48 27.96 1don h GLN 23 CO -0.00 0.71 0.43 0.00 0.09 0.00 0.00 178.83 180.06 1don h ARG 24 N 0.17 0.42 -5.70 0.06 2.47 -1.13 -3.35 114.38 107.32 1don h ARG 24 Ca 0.05 -0.03 -0.29 0.00 -1.26 0.00 0.00 59.98 58.46 1don h ARG 24 Cb 0.56 -0.09 -0.05 0.00 -1.65 0.00 0.00 29.97 28.74 1don h ARG 24 CO 0.03 0.28 0.74 -0.51 0.56 0.00 0.00 179.97 181.06 1don s LEU 25 N -9.37 3.16 0.59 3.04 1.43 -1.00 -0.70 118.68 115.83 1don s LEU 25 Ca -0.08 -0.71 0.35 0.00 -1.03 0.00 0.00 54.13 52.67 1don s LEU 25 Cb 0.20 -2.56 1.84 0.00 0.03 0.00 0.00 46.19 45.70 1don s LEU 25 CO 0.75 -2.77 2.19 0.00 0.23 0.00 0.00 176.35 176.75 1don h ALA 26 N 11.24 1.15 -2.36 4.21 0.00 0.14 -3.46 119.26 130.17 1don h ALA 26 Ca 0.10 -0.03 0.26 0.00 0.00 0.00 0.00 54.91 55.23 1don h ALA 26 Cb 1.00 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 1don h ALA 26 CO 1.21 0.05 0.76 -1.13 0.00 0.00 0.00 179.25 180.13 1don n SER 27 N -3.34 -1.48 -3.68 0.00 3.41 -0.34 -4.96 113.62 103.23 1don n SER 27 Ca -0.02 -1.58 -0.10 0.00 -0.26 0.00 0.00 58.87 56.92 1don n SER 27 Cb 0.17 2.35 -0.10 0.00 -0.26 0.00 0.00 64.21 66.37 1don n SER 27 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1don s TYR 28 N -2.04 -0.68 -0.64 7.33 6.14 -1.25 -0.53 117.35 125.68 1don s TYR 28 Ca 0.27 1.40 0.05 0.00 0.64 0.00 0.00 57.07 59.43 1don s TYR 28 Cb -0.02 0.30 0.17 0.00 0.42 0.00 0.00 41.96 42.83 1don s TYR 28 CO 0.02 -0.39 0.46 1.03 0.64 0.00 0.00 175.55 177.31 1don s ARG 29 N 1.74 2.13 -0.46 4.97 0.52 -0.69 -4.86 118.95 122.30 1don s ARG 29 Ca -0.08 -3.08 -0.42 0.00 -0.52 0.00 0.00 55.73 51.63 1don s ARG 29 Cb -0.09 -2.99 -0.17 0.00 0.52 0.00 0.00 34.95 32.21 1don s ARG 29 CO -0.13 -1.31 2.07 -2.13 0.02 0.00 0.00 175.30 173.82 1don n ARG 30 N 2.17 0.28 -2.01 3.54 0.63 -1.26 -2.78 116.66 117.23 1don n ARG 30 Ca 0.22 0.08 -0.32 0.00 -0.92 0.00 0.00 57.85 56.91 1don n ARG 30 Cb 0.38 -1.73 0.01 0.00 0.45 0.00 0.00 32.46 31.57 1don n ARG 30 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1don s ILE 31 N 5.81 3.88 0.00 5.15 1.01 0.06 -4.89 121.20 132.22 1don s ILE 31 Ca 1.15 0.85 0.00 0.00 0.00 0.00 0.00 60.65 62.66 1don s ILE 31 Cb -1.34 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 37.72 1don s ILE 31 CO 0.64 -0.56 0.00 0.35 0.00 0.00 0.00 174.94 175.38 1don n THR 32 N -2.14 0.00 -1.84 2.92 -2.24 -1.26 -2.83 114.28 106.90 1don n THR 32 Ca 0.08 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.50 1don n THR 32 Cb 0.53 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.81 1don n THR 32 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1don s SER 33 N 0.00 4.83 0.05 3.42 0.15 -1.26 -4.85 113.70 116.04 1don s SER 33 Ca 0.00 2.49 0.12 0.00 0.70 0.00 0.00 55.95 59.26 1don s SER 33 Cb 0.00 -2.61 0.54 0.00 -1.71 0.00 0.00 66.02 62.24 1don s SER 33 CO 0.00 -1.84 1.39 -1.54 1.20 0.00 0.00 173.24 172.44 1don n SER 34 N -1.84 0.12 -0.00 5.45 3.41 -1.26 -1.84 113.62 117.66 1don n SER 34 Ca 0.15 0.54 0.09 0.00 -0.26 0.00 0.00 58.87 59.38 1don n SER 34 Cb 0.49 -0.56 -0.11 0.00 -0.26 0.00 0.00 64.21 63.77 1don n SER 34 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1don n LYS 35 N -1.64 0.79 -2.60 4.33 4.81 -1.26 -4.94 118.16 117.65 1don n LYS 35 Ca 0.02 -0.01 -0.41 0.00 -0.87 0.00 0.00 58.31 57.04 1don n LYS 35 Cb 0.13 -1.39 -0.04 0.00 0.02 0.00 0.00 35.03 33.75 1don n LYS 35 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1don h PRO 37 N 6.02 0.00 -2.84 0.00 0.13 -1.92 -3.44 132.00 129.95 1don h PRO 37 Ca -0.42 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.59 1don h PRO 37 Cb 1.21 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.13 1don h PRO 37 CO 0.75 0.00 -0.21 0.15 -0.23 0.00 0.00 178.00 178.46 1don s LYS 38 N -3.67 0.66 0.70 0.86 1.02 -1.26 -5.16 119.74 112.89 1don s LYS 38 Ca -0.00 0.05 -0.09 0.00 0.02 0.00 0.00 55.97 55.94 1don s LYS 38 Cb 0.09 0.30 0.03 0.00 -0.52 0.00 0.00 37.83 37.74 1don s LYS 38 CO 0.41 -0.17 1.06 -2.00 -0.92 0.00 0.00 175.35 173.72 1don s GLU 39 N -0.92 2.57 0.05 1.68 2.12 -1.26 -4.74 118.70 118.20 1don s GLU 39 Ca -0.10 0.16 -0.16 0.00 0.36 0.00 0.00 54.97 55.23 1don s GLU 39 Cb -0.04 -2.09 0.05 0.00 0.26 0.00 0.00 34.13 32.31 1don s GLU 39 CO 0.04 -1.11 0.73 0.00 -0.54 0.00 0.00 175.26 174.38 1don n ALA 40 N -2.96 -1.99 -3.80 6.30 0.00 -1.13 -4.85 120.51 112.08 1don n ALA 40 Ca 0.07 -0.57 -0.29 0.00 0.00 0.00 0.00 53.44 52.64 1don n ALA 40 Cb 0.59 0.23 -0.17 0.00 0.00 0.00 0.00 19.45 20.10 1don n ALA 40 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1don s VAL 41 N -2.16 1.47 -1.27 0.00 1.01 -0.59 -0.76 120.40 118.11 1don s VAL 41 Ca 0.17 -0.60 -0.16 0.00 0.00 0.00 0.00 61.98 61.39 1don s VAL 41 Cb -0.01 -1.37 0.11 0.00 0.00 0.00 0.00 36.38 35.11 1don s VAL 41 CO 0.02 0.44 1.65 -0.38 0.00 0.00 0.00 175.10 176.83 1don n ILE 42 N 4.46 4.06 -1.96 2.22 2.08 -1.12 -0.85 119.36 128.25 1don n ILE 42 Ca -0.18 -4.31 -0.25 0.00 0.56 0.00 0.00 62.75 58.57 1don n ILE 42 Cb 0.51 -2.41 -0.06 0.00 -0.75 0.00 0.00 39.64 36.92 1don n ILE 42 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1don s PHE 43 N 2.91 1.74 -0.54 1.39 0.08 -0.70 -1.70 117.98 121.17 1don s PHE 43 Ca 0.48 0.88 -0.26 0.00 0.12 0.00 0.00 56.93 58.15 1don s PHE 43 Cb 0.02 -3.88 -0.06 0.00 -0.57 0.00 0.00 43.02 38.52 1don s PHE 43 CO 0.04 -1.35 2.30 0.21 -0.10 0.00 0.00 175.22 176.31 1don s LYS 44 N 7.11 2.17 0.00 0.44 2.20 0.31 -2.07 119.74 129.90 1don s LYS 44 Ca 0.73 1.18 0.00 0.00 -0.36 0.00 0.00 55.97 57.51 1don s LYS 44 Cb -0.04 -4.57 0.00 0.00 -1.51 0.00 0.00 37.83 31.71 1don s LYS 44 CO 0.09 -3.25 0.00 0.25 -0.36 0.00 0.00 175.35 172.07 1don n THR 45 N 7.89 0.00 -0.01 3.43 -2.24 -1.21 0.14 114.28 122.28 1don n THR 45 Ca 0.34 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 62.08 1don n THR 45 Cb 0.54 -0.03 -0.12 0.00 -2.10 0.00 0.00 70.33 68.61 1don n THR 45 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1don n ILE 46 N -0.64 1.35 0.51 2.28 -0.00 0.13 -2.80 119.36 120.18 1don n ILE 46 Ca 0.00 -0.75 0.04 0.00 -0.00 0.00 0.00 62.75 62.04 1don n ILE 46 Cb 0.00 -0.81 0.16 0.00 -0.00 0.00 0.00 39.64 39.00 1don n ILE 46 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 176.55 177.10 1don n VAL 47 N -2.91 0.88 -1.24 7.28 3.14 -1.26 -4.83 118.33 119.38 1don n VAL 47 Ca -0.15 -0.53 -0.08 0.00 -2.96 0.00 0.00 64.34 60.61 1don n VAL 47 Cb 0.96 -0.15 -0.04 0.00 -1.06 0.00 0.00 33.84 33.55 1don n VAL 47 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1don n ALA 48 N 0.34 -0.13 -2.64 1.55 0.00 -1.24 -4.91 120.51 113.48 1don n ALA 48 Ca 0.11 0.14 -0.43 0.00 0.00 0.00 0.00 53.44 53.26 1don n ALA 48 Cb 0.50 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.80 1don n ALA 48 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1don n LYS 49 N -2.54 3.23 -1.56 0.00 4.81 -1.26 -4.77 118.16 116.07 1don n LYS 49 Ca -0.08 -3.38 -0.50 0.00 -0.87 0.00 0.00 58.31 53.47 1don n LYS 49 Cb 0.30 -3.42 -0.06 0.00 0.02 0.00 0.00 35.03 31.88 1don n LYS 49 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1don n GLU 50 N 7.89 1.46 -3.73 1.64 1.02 -1.26 -3.32 120.64 124.34 1don n GLU 50 Ca 0.47 0.46 -0.38 0.00 -0.02 0.00 0.00 57.16 57.69 1don n GLU 50 Cb 0.45 -2.54 -0.12 0.00 -0.02 0.00 0.00 31.44 29.21 1don n GLU 50 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1don s ILE 51 N 6.10 3.74 0.12 -3.67 1.01 -0.88 -4.84 121.20 122.77 1don s ILE 51 Ca 1.03 -1.38 -0.31 0.00 0.00 0.00 0.00 60.65 59.99 1don s ILE 51 Cb -0.79 -3.23 -0.10 0.00 0.01 0.00 0.00 42.46 38.35 1don s ILE 51 CO 0.51 -0.34 1.79 0.00 0.00 0.00 0.00 174.94 176.90 1don s ALA 53 N 2.62 1.38 -0.19 0.00 0.00 -0.03 -1.39 121.76 124.14 1don s ALA 53 Ca 0.79 -0.93 -0.29 0.00 0.00 0.00 0.00 51.96 51.53 1don s ALA 53 Cb -0.45 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 1don s ALA 53 CO 0.35 0.27 1.73 0.34 0.00 0.00 0.00 175.76 178.46 1don s ASP 54 N -1.24 6.27 0.34 0.00 2.15 -1.26 -1.54 116.67 121.39 1don s ASP 54 Ca 0.03 1.78 0.25 0.00 0.43 0.00 0.00 52.55 55.04 1don s ASP 54 Cb -0.08 -2.53 1.23 0.00 -0.30 0.00 0.00 42.92 41.23 1don s ASP 54 CO 0.02 -1.33 1.75 1.55 -0.17 0.00 0.00 175.17 176.99 1don h PRO 55 N 11.27 0.00 -0.61 4.34 0.13 -1.89 -1.59 132.00 143.65 1don h PRO 55 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1don h PRO 55 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1don h PRO 55 CO 0.99 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.39 1don n LYS 56 N -2.36 2.30 -2.43 0.86 4.76 -1.26 -4.67 118.16 115.36 1don n LYS 56 Ca -0.00 -1.27 -0.23 0.00 -2.87 0.00 0.00 58.31 53.93 1don n LYS 56 Cb 0.11 -1.59 0.05 0.00 -1.84 0.00 0.00 35.03 31.76 1don n LYS 56 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1don s GLN 57 N -1.68 2.36 0.06 1.97 -1.52 -0.60 -5.00 119.66 115.25 1don s GLN 57 Ca 0.23 -0.54 0.23 0.00 -1.95 0.00 0.00 55.36 53.33 1don s GLN 57 Cb 0.15 -2.33 -0.00 0.00 -0.22 0.00 0.00 33.01 30.61 1don s GLN 57 CO 0.10 -0.98 0.97 1.17 -0.25 0.00 0.00 175.29 176.30 1don n LYS 58 N -2.63 0.37 -0.03 2.91 3.00 -1.26 -3.53 118.16 116.99 1don n LYS 58 Ca 0.08 -0.01 -0.03 0.00 -0.00 0.00 0.00 58.31 58.36 1don n LYS 58 Cb 0.60 -1.62 -0.13 0.00 0.00 0.00 0.00 35.03 33.87 1don n LYS 58 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.40 174.73 1don n TRP 59 N -2.10 0.43 0.92 5.64 4.27 -1.26 -3.82 117.44 121.52 1don n TRP 59 Ca 0.01 0.15 0.14 0.00 -3.89 0.00 0.00 57.50 53.90 1don n TRP 59 Cb 0.47 -0.97 0.58 0.00 -1.36 0.00 0.00 31.31 30.03 1don n TRP 59 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68 1don n VAL 60 N -2.75 0.13 0.09 -1.67 0.31 -1.26 -1.77 118.33 111.42 1don n VAL 60 Ca -0.19 -0.03 -0.01 0.00 -0.01 0.00 0.00 64.34 64.10 1don n VAL 60 Cb 0.94 -0.53 -0.04 0.00 -0.91 0.00 0.00 33.84 33.30 1don n VAL 60 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1don h GLN 61 N 0.00 0.00 0.05 5.55 4.20 -1.66 -0.54 115.11 122.72 1don h GLN 61 Ca 0.00 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.38 1don h GLN 61 Cb 0.52 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.27 1don h GLN 61 CO 0.00 0.60 -1.91 -0.25 -0.67 0.00 0.00 178.83 176.60 1don n ASP 62 N -3.20 1.40 -0.01 1.46 9.92 -1.13 -3.66 116.55 121.33 1don n ASP 62 Ca -0.01 0.28 -0.09 0.00 -0.53 0.00 0.00 54.79 54.43 1don n ASP 62 Cb 0.82 -0.35 -0.07 0.00 -0.64 0.00 0.00 41.12 40.88 1don n ASP 62 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1don h SER 63 N 0.03 -0.08 -0.54 -2.24 0.02 -1.43 -2.07 113.55 107.24 1don h SER 63 Ca -0.37 -0.47 0.16 0.00 -0.84 0.00 0.00 61.79 60.26 1don h SER 63 Cb 2.03 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 64.57 1don h SER 63 CO 0.07 0.61 0.61 -0.03 -1.14 0.00 0.00 176.83 176.95 1don h MET 64 N -0.94 0.00 0.17 3.45 1.85 -1.29 0.46 114.93 118.63 1don h MET 64 Ca -0.01 0.00 -0.34 0.00 -0.61 0.00 0.00 59.70 58.74 1don h MET 64 Cb 0.54 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.58 1don h MET 64 CO 0.02 0.00 -1.66 -0.44 -0.40 0.00 0.00 176.91 174.42 1don h ASP 65 N 0.00 0.58 -0.03 1.39 3.32 -1.62 0.02 116.42 120.08 1don h ASP 65 Ca 0.26 -0.82 0.01 0.00 0.02 0.00 0.00 57.03 56.50 1don h ASP 65 Cb 1.47 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.83 1don h ASP 65 CO -0.00 1.68 0.03 -0.74 -1.72 0.00 0.00 179.24 178.49 1don h HIS 66 N 0.10 0.00 0.00 4.55 2.76 0.61 -0.85 115.15 122.32 1don h HIS 66 Ca -0.31 0.00 -0.30 0.00 -2.20 0.00 0.00 60.37 57.57 1don h HIS 66 Cb 2.09 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.99 1don h HIS 66 CO 0.09 0.00 -2.01 1.28 -1.30 0.00 0.00 177.93 176.00 1don n LEU 67 N -4.12 0.41 0.15 0.26 4.77 -0.49 -3.06 117.00 114.92 1don n LEU 67 Ca -0.02 0.19 0.11 0.00 -0.03 0.00 0.00 56.01 56.26 1don n LEU 67 Cb 0.12 0.30 0.54 0.00 -2.33 0.00 0.00 43.42 42.05 1don n LEU 67 CO 0.30 0.39 0.84 -0.67 -1.33 0.00 0.00 177.39 176.92 1don n ASP 68 N -2.84 0.60 -2.50 -1.43 -0.08 -0.01 -2.26 116.55 108.03 1don n ASP 68 Ca -0.23 0.72 -0.05 0.00 -1.51 0.00 0.00 54.79 53.72 1don n ASP 68 Cb 1.05 -0.82 0.05 0.00 2.34 0.00 0.00 41.12 43.73 1don n ASP 68 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 1don n LYS 69 N -2.24 1.98 0.17 -0.67 2.85 -0.55 -4.80 118.16 114.90 1don n LYS 69 Ca 0.00 -3.52 0.07 0.00 -1.05 0.00 0.00 58.31 53.82 1don n LYS 69 Cb 0.12 -1.62 0.09 0.00 -0.65 0.00 0.00 35.03 32.97 1don n LYS 69 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1don h GLN 70 N 2.35 0.00 -1.26 -1.58 1.08 -1.37 -3.25 115.11 111.08 1don h GLN 70 Ca -0.04 0.00 -0.42 0.00 -1.45 0.00 0.00 58.65 56.74 1don h GLN 70 Cb 1.37 0.00 -0.19 0.00 -0.05 0.00 0.00 27.48 28.61 1don h GLN 70 CO 0.29 0.23 0.54 -2.37 -0.95 0.00 0.00 178.83 176.58 1don n THR 71 N -3.12 2.93 -2.40 -0.54 5.66 -1.26 -4.94 114.28 110.61 1don n THR 71 Ca 0.02 -1.90 -0.24 0.00 -3.05 0.00 0.00 64.05 58.89 1don n THR 71 Cb 0.63 -1.12 0.06 0.00 -1.55 0.00 0.00 70.33 68.35 1don n THR 71 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1don s GLN 72 N -2.44 2.27 -1.16 1.09 -2.07 -1.23 -4.40 119.66 111.72 1don s GLN 72 Ca 0.41 -0.53 -0.24 0.00 -1.82 0.00 0.00 55.36 53.19 1don s GLN 72 Cb 0.33 -2.30 0.03 0.00 -1.09 0.00 0.00 33.01 29.98 1don s GLN 72 CO 0.01 -1.06 0.46 -2.37 -1.32 0.00 0.00 175.29 171.01 1don n THR 73 N -2.70 -1.97 -0.16 3.63 5.66 -1.26 -4.89 114.28 112.60 1don n THR 73 Ca 0.09 -0.51 -0.20 0.00 -3.05 0.00 0.00 64.05 60.38 1don n THR 73 Cb 0.60 -1.70 0.20 0.00 -1.55 0.00 0.00 70.33 67.87 1don n THR 73 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1don n PRO 74 N -4.55 -3.85 -0.56 1.09 -0.01 -1.26 -4.96 135.00 120.90 1don n PRO 74 Ca -0.15 -0.97 -0.29 0.00 -0.01 0.00 0.00 63.50 62.09 1don n PRO 74 Cb 0.53 -1.28 0.26 0.00 -0.01 0.00 0.00 33.50 33.00 1don n PRO 74 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 175.50 175.64 1don s LYS 75 N -4.34 -1.36 0.00 -0.52 -0.14 -1.26 -5.25 119.74 106.87 1don s LYS 75 Ca 0.45 0.63 0.06 0.00 -1.36 0.00 0.00 55.97 55.74 1don s LYS 75 Cb -0.08 -1.52 0.05 0.00 -1.68 0.00 0.00 37.83 34.60 1don s LYS 75 CO 0.37 -3.96 0.69 0.25 -0.76 0.00 0.00 175.35 171.95