#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1don s PRO 2 N 0.00 2.02 -0.34 2.61 0.02 -1.26 -4.82 135.00 133.23 1don s PRO 2 Ca 0.00 1.19 -0.04 0.00 0.02 0.00 0.00 61.00 62.17 1don s PRO 2 Cb 0.00 -4.62 -0.01 0.00 0.02 0.00 0.00 34.50 29.89 1don s PRO 2 CO 0.00 -3.49 2.96 -3.47 -0.33 0.00 0.00 177.00 172.66 1don n ASP 3 N 16.35 6.17 -2.83 2.53 -0.08 -1.26 -4.52 116.55 132.92 1don n ASP 3 Ca 0.38 -3.03 -0.03 0.00 -1.51 0.00 0.00 54.79 50.60 1don n ASP 3 Cb 0.53 -1.27 0.01 0.00 2.34 0.00 0.00 41.12 42.72 1don n ASP 3 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1don s ALA 4 N -1.07 -2.37 -0.27 -1.67 0.00 -1.26 -4.99 121.76 110.12 1don s ALA 4 Ca 0.60 -0.21 0.22 0.00 0.00 0.00 0.00 51.96 52.57 1don s ALA 4 Cb 0.36 -2.75 -0.21 0.00 0.00 0.00 0.00 23.12 20.53 1don s ALA 4 CO -0.17 -2.26 0.71 -0.89 0.00 0.00 0.00 175.76 173.15 1don n ILE 5 N 3.17 0.13 -1.84 0.00 2.08 -1.26 -4.41 119.36 117.23 1don n ILE 5 Ca 0.16 -0.41 -0.40 0.00 0.56 0.00 0.00 62.75 62.66 1don n ILE 5 Cb 0.57 0.10 -0.01 0.00 -0.75 0.00 0.00 39.64 39.55 1don n ILE 5 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 1don n ASN 6 N -2.19 7.84 -4.63 4.38 6.94 -1.26 -4.92 115.26 121.43 1don n ASN 6 Ca -0.01 -2.98 -0.34 0.00 -0.02 0.00 0.00 54.58 51.22 1don n ASN 6 Cb 0.52 -1.43 -0.10 0.00 -2.36 0.00 0.00 39.78 36.40 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 -0.04 3.15 -0.56 -2.53 0.00 -1.26 -5.03 121.76 115.49 1don s ALA 7 Ca 0.57 -0.83 -0.26 0.00 0.00 0.00 0.00 51.96 51.43 1don s ALA 7 Cb 0.17 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 1don s ALA 7 CO -0.08 0.53 2.04 -1.25 0.00 0.00 0.00 175.76 177.00 1don s PRO 8 N -0.67 2.47 -0.44 0.00 0.04 -1.26 -4.91 135.00 130.23 1don s PRO 8 Ca 0.11 0.89 -0.23 0.00 0.04 0.00 0.00 61.00 61.80 1don s PRO 8 Cb -0.12 -4.45 0.02 0.00 0.04 0.00 0.00 34.50 30.00 1don s PRO 8 CO 0.02 -2.89 0.80 0.54 0.04 0.00 0.00 177.00 175.51 1don s VAL 9 N 10.03 4.64 -0.40 -0.36 0.11 -1.26 -4.99 120.40 128.17 1don s VAL 9 Ca 0.77 0.54 -0.28 0.00 -2.93 0.00 0.00 61.98 60.08 1don s VAL 9 Cb -0.14 -4.32 -0.00 0.00 -1.53 0.00 0.00 36.38 30.39 1don s VAL 9 CO 0.23 -0.69 1.59 -0.89 -3.33 0.00 0.00 175.10 172.01 1don s THR 10 N 3.32 3.69 0.21 5.04 2.01 -1.26 -4.95 115.64 123.70 1don s THR 10 Ca 0.31 0.68 0.02 0.00 0.31 0.00 0.00 61.69 63.01 1don s THR 10 Cb -0.12 -3.99 -0.01 0.00 0.01 0.00 0.00 72.50 68.39 1don s THR 10 CO 0.22 -0.67 0.08 0.00 -0.69 0.00 0.00 174.62 173.56 1don n TYR 13 N -0.72 0.00 -4.09 0.00 4.01 -1.26 -4.93 117.16 110.17 1don n TYR 13 Ca -0.10 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.60 1don n TYR 13 Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.42 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 -1.61 1.98 -3.66 7.72 3.02 -1.26 -5.15 115.26 116.29 1don n ASN 14 Ca 0.00 -1.28 -0.08 0.00 -0.03 0.00 0.00 54.58 53.19 1don n ASN 14 Cb 0.08 0.06 -0.09 0.00 -0.61 0.00 0.00 39.78 39.21 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 -1.31 -0.80 -0.69 3.10 0.40 -1.26 -4.70 117.98 112.72 1don s PHE 15 Ca 0.00 1.53 -0.30 0.00 -0.60 0.00 0.00 56.93 57.56 1don s PHE 15 Cb 0.00 0.31 -0.14 0.00 0.51 0.00 0.00 43.02 43.70 1don s PHE 15 CO 0.00 -0.48 2.50 -2.37 0.70 0.00 0.00 175.22 175.57 1don n THR 16 N 5.35 -0.01 0.79 0.64 5.66 -0.59 -4.72 114.28 121.41 1don n THR 16 Ca -0.09 -0.37 0.09 0.00 -3.05 0.00 0.00 64.05 60.63 1don n THR 16 Cb 0.50 -1.62 0.27 0.00 -1.55 0.00 0.00 70.33 67.93 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 12.60 2.29 -4.94 1.09 2.85 -1.26 -4.56 115.26 123.32 1don n ASN 17 Ca 0.50 -1.88 -0.24 0.00 -0.11 0.00 0.00 54.58 52.85 1don n ASN 17 Cb 0.27 -0.21 0.04 0.00 1.24 0.00 0.00 39.78 41.12 1don n ASN 17 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 1don s ARG 18 N -1.58 2.62 -1.38 1.20 3.52 -1.26 -4.96 118.95 117.12 1don s ARG 18 Ca 0.32 -0.41 -0.08 0.00 -0.13 0.00 0.00 55.73 55.44 1don s ARG 18 Cb 0.18 -2.36 0.09 0.00 -1.56 0.00 0.00 34.95 31.30 1don s ARG 18 CO 0.25 -0.78 2.32 1.63 -0.81 0.00 0.00 175.30 177.91 1don n LYS 19 N -2.52 4.00 -1.64 5.12 5.02 -1.26 -4.96 118.16 121.93 1don n LYS 19 Ca 0.06 -3.18 -0.52 0.00 -2.02 0.00 0.00 58.31 52.64 1don n LYS 19 Cb 0.59 -2.81 -0.06 0.00 -0.02 0.00 0.00 35.03 32.74 1don n LYS 19 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1don n ILE 20 N 2.81 0.12 -1.62 -0.18 5.41 -1.26 -4.76 119.36 119.88 1don n ILE 20 Ca 0.58 -0.02 -0.55 0.00 1.00 0.00 0.00 62.75 63.75 1don n ILE 20 Cb 0.29 -1.09 -0.07 0.00 -0.71 0.00 0.00 39.64 38.06 1don n ILE 20 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1don n SER 21 N 3.64 1.56 0.31 4.38 2.88 -1.26 -4.75 113.62 120.38 1don n SER 21 Ca 0.21 1.12 0.18 0.00 -1.33 0.00 0.00 58.87 59.04 1don n SER 21 Cb 0.20 -1.12 0.93 0.00 -0.75 0.00 0.00 64.21 63.47 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 3.86 0.09 -0.21 2.46 3.04 -1.95 0.11 116.25 123.64 1don h VAL 22 Ca -0.48 0.00 -0.07 0.00 -1.01 0.00 0.00 66.70 65.15 1don h VAL 22 Cb 1.35 0.78 -0.00 0.00 -2.01 0.00 0.00 31.29 31.41 1don h VAL 22 CO 0.82 0.00 -0.12 0.06 -1.01 0.00 0.00 177.57 177.31 1don h GLN 23 N 0.00 0.45 -0.59 4.17 3.07 -2.00 -2.70 115.11 117.51 1don h GLN 23 Ca 0.02 -0.21 0.13 0.00 0.09 0.00 0.00 58.65 58.69 1don h GLN 23 Cb 0.48 -0.01 -0.03 0.00 0.08 0.00 0.00 27.48 28.00 1don h GLN 23 CO -0.00 0.75 0.41 0.00 0.09 0.00 0.00 178.83 180.08 1don h ARG 24 N 0.15 0.23 -5.84 0.06 2.47 -1.12 -3.35 114.38 106.97 1don h ARG 24 Ca 0.04 -0.01 -0.38 0.00 -1.26 0.00 0.00 59.98 58.37 1don h ARG 24 Cb 0.63 -0.05 -0.05 0.00 -1.65 0.00 0.00 29.97 28.85 1don h ARG 24 CO 0.04 0.15 0.97 -0.51 0.56 0.00 0.00 179.97 181.18 1don s LEU 25 N -9.10 3.23 0.50 3.04 1.43 -1.02 -0.64 118.68 116.11 1don s LEU 25 Ca -0.07 -0.49 0.32 0.00 -1.03 0.00 0.00 54.13 52.86 1don s LEU 25 Cb 0.20 -2.55 1.27 0.00 0.03 0.00 0.00 46.19 45.14 1don s LEU 25 CO 0.74 -2.50 1.93 0.00 0.23 0.00 0.00 176.35 176.75 1don h ALA 26 N 12.01 1.00 -2.24 4.21 0.00 0.69 -3.47 119.26 131.46 1don h ALA 26 Ca 0.00 0.00 0.24 0.00 0.00 0.00 0.00 54.91 55.16 1don h ALA 26 Cb 1.05 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1don h ALA 26 CO 1.24 0.00 0.71 -1.12 0.00 0.00 0.00 179.25 180.07 1don s SER 27 N -5.46 -0.02 -0.19 0.00 0.01 -0.05 -4.96 113.70 103.03 1don s SER 27 Ca 0.02 -0.43 -0.08 0.00 1.31 0.00 0.00 55.95 56.77 1don s SER 27 Cb 0.09 0.34 0.08 0.00 0.21 0.00 0.00 66.02 66.74 1don s SER 27 CO 0.52 -0.67 0.43 -0.47 0.41 0.00 0.00 173.24 173.46 1don s TYR 28 N -2.27 -0.73 -0.65 2.43 6.14 -1.25 -0.18 117.35 120.84 1don s TYR 28 Ca 0.22 1.46 0.05 0.00 0.64 0.00 0.00 57.07 59.44 1don s TYR 28 Cb -0.01 0.31 0.19 0.00 0.42 0.00 0.00 41.96 42.87 1don s TYR 28 CO 0.02 -0.42 0.53 0.54 0.64 0.00 0.00 175.55 176.86 1don n ARG 29 N 4.83 1.75 -1.28 4.97 1.74 -0.69 -4.86 116.66 123.12 1don n ARG 29 Ca -0.16 -4.33 -0.58 0.00 -0.77 0.00 0.00 57.85 52.01 1don n ARG 29 Cb 0.52 -2.17 -0.12 0.00 -1.02 0.00 0.00 32.46 29.68 1don n ARG 29 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1don n ARG 30 N 1.79 0.09 -1.40 5.56 0.63 -1.26 -3.04 116.66 119.03 1don n ARG 30 Ca 0.23 0.02 -0.31 0.00 -0.92 0.00 0.00 57.85 56.88 1don n ARG 30 Cb 0.39 -1.58 0.09 0.00 0.45 0.00 0.00 32.46 31.80 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 6.26 3.40 0.00 5.15 1.01 0.26 -4.89 121.20 132.39 1don s ILE 31 Ca 1.20 0.45 0.00 0.00 0.00 0.00 0.00 60.65 62.30 1don s ILE 31 Cb -1.43 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 37.97 1don s ILE 31 CO 0.64 -0.59 0.00 0.35 0.00 0.00 0.00 174.94 175.33 1don n THR 32 N -3.44 0.00 -1.87 2.92 -2.24 -1.26 -3.08 114.28 105.31 1don n THR 32 Ca 0.08 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.48 1don n THR 32 Cb 0.54 0.00 0.04 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 5.23 0.18 3.42 0.15 -1.26 -4.84 113.70 116.57 1don s SER 33 Ca 0.00 2.63 0.17 0.00 0.70 0.00 0.00 55.95 59.45 1don s SER 33 Cb 0.00 -2.62 0.79 0.00 -1.71 0.00 0.00 66.02 62.48 1don s SER 33 CO 0.00 -1.59 1.52 -1.20 1.20 0.00 0.00 173.24 173.18 1don n SER 34 N -1.23 0.39 -0.00 5.45 7.64 -1.26 -1.67 113.62 122.94 1don n SER 34 Ca 0.12 0.63 0.10 0.00 1.01 0.00 0.00 58.87 60.73 1don n SER 34 Cb 0.47 -0.70 -0.14 0.00 -1.01 0.00 0.00 64.21 62.83 1don n SER 34 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1don n LYS 35 N -1.96 0.27 -2.44 1.43 0.00 -1.26 -4.93 118.16 109.27 1don n LYS 35 Ca 0.01 -0.08 -0.42 0.00 0.00 0.00 0.00 58.31 57.82 1don n LYS 35 Cb 0.12 -1.51 -0.03 0.00 0.00 0.00 0.00 35.03 33.61 1don n LYS 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1don h PRO 37 N 6.58 0.00 -2.76 0.00 0.13 -1.91 -3.43 132.00 130.61 1don h PRO 37 Ca -0.42 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.59 1don h PRO 37 Cb 1.21 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.10 1don h PRO 37 CO 0.80 0.00 -0.27 0.15 -0.23 0.00 0.00 178.00 178.45 1don s LYS 38 N -3.89 0.44 1.17 0.86 1.02 -1.26 -5.16 119.74 112.92 1don s LYS 38 Ca -0.02 0.59 -0.19 0.00 0.02 0.00 0.00 55.97 56.37 1don s LYS 38 Cb 0.11 0.18 0.28 0.00 -0.52 0.00 0.00 37.83 37.87 1don s LYS 38 CO 0.46 -0.07 1.18 -1.21 -0.92 0.00 0.00 175.35 174.79 1don s GLU 39 N 0.43 -0.98 -0.08 1.68 2.02 -1.26 -4.63 118.70 115.88 1don s GLU 39 Ca -0.02 -0.26 -0.30 0.00 0.02 0.00 0.00 54.97 54.41 1don s GLU 39 Cb -0.04 -1.64 0.10 0.00 0.10 0.00 0.00 34.13 32.65 1don s GLU 39 CO -0.02 -3.52 1.36 0.00 0.02 0.00 0.00 175.26 173.10 1don s ALA 40 N -3.27 -2.71 -0.15 5.21 0.00 -1.18 -4.91 121.76 114.74 1don s ALA 40 Ca 0.73 0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.88 1don s ALA 40 Cb -0.06 0.90 0.02 0.00 0.00 0.00 0.00 23.12 23.98 1don s ALA 40 CO 0.55 -1.17 -0.20 0.08 0.00 0.00 0.00 175.76 175.03 1don s VAL 41 N -2.01 1.94 -1.29 0.00 1.01 -0.57 -0.57 120.40 118.91 1don s VAL 41 Ca 0.31 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 61.26 1don s VAL 41 Cb 0.00 -1.75 0.11 0.00 0.00 0.00 0.00 36.38 34.75 1don s VAL 41 CO -0.03 0.52 1.75 -0.38 0.00 0.00 0.00 175.10 176.96 1don n ILE 42 N 4.40 4.03 -1.88 2.22 2.08 -1.17 -0.87 119.36 128.16 1don n ILE 42 Ca -0.20 -4.18 -0.22 0.00 0.56 0.00 0.00 62.75 58.71 1don n ILE 42 Cb 0.51 -2.43 -0.07 0.00 -0.75 0.00 0.00 39.64 36.89 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 2.54 1.62 -0.56 1.39 0.08 -0.67 -1.71 117.98 120.67 1don s PHE 43 Ca 0.47 1.15 -0.26 0.00 0.12 0.00 0.00 56.93 58.41 1don s PHE 43 Cb 0.04 -3.78 -0.06 0.00 -0.57 0.00 0.00 43.02 38.65 1don s PHE 43 CO 0.01 -1.31 2.26 0.15 -0.10 0.00 0.00 175.22 176.23 1don s LYS 44 N 7.45 2.20 0.00 0.44 1.02 0.74 -2.12 119.74 129.47 1don s LYS 44 Ca 0.76 1.07 0.00 0.00 0.02 0.00 0.00 55.97 57.82 1don s LYS 44 Cb -0.05 -4.57 0.00 0.00 -0.52 0.00 0.00 37.83 32.69 1don s LYS 44 CO 0.09 -3.25 0.00 0.25 -0.92 0.00 0.00 175.35 171.52 1don n THR 45 N 7.86 0.00 0.00 2.17 -2.24 -1.19 0.91 114.28 121.80 1don n THR 45 Ca 0.34 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 62.07 1don n THR 45 Cb 0.53 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.65 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 -0.70 1.41 0.44 2.28 -0.00 0.18 -2.85 119.36 120.13 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 -0.90 0.17 0.00 -0.00 0.00 0.00 39.64 38.91 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 -2.97 0.95 -1.19 7.28 3.14 -1.26 -4.83 118.33 119.45 1don n VAL 47 Ca -0.14 -0.55 -0.07 0.00 -2.96 0.00 0.00 64.34 60.62 1don n VAL 47 Cb 0.95 -0.19 -0.03 0.00 -1.06 0.00 0.00 33.84 33.51 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 -0.10 -2.54 1.55 0.00 -1.23 -4.91 120.51 113.62 1don n ALA 48 Ca 0.12 0.11 -0.41 0.00 0.00 0.00 0.00 53.44 53.25 1don n ALA 48 Cb 0.53 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.91 1don n ALA 48 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1don s LYS 49 N -2.20 3.77 -0.24 0.00 2.20 -1.26 -4.74 119.74 117.26 1don s LYS 49 Ca 0.00 -1.68 -0.34 0.00 -0.36 0.00 0.00 55.97 53.59 1don s LYS 49 Cb 0.00 -5.47 -0.10 0.00 -1.51 0.00 0.00 37.83 30.75 1don s LYS 49 CO 0.00 -2.36 2.08 0.39 -0.36 0.00 0.00 175.35 175.10 1don n GLU 50 N 8.54 1.60 -3.75 4.03 1.02 -1.26 -3.17 120.64 127.64 1don n GLU 50 Ca 0.44 0.50 -0.38 0.00 -0.02 0.00 0.00 57.16 57.71 1don n GLU 50 Cb 0.47 -2.66 -0.12 0.00 -0.02 0.00 0.00 31.44 29.11 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 6.37 3.71 0.10 -3.67 1.01 -0.90 -4.85 121.20 122.97 1don s ILE 51 Ca 1.02 -1.25 -0.31 0.00 0.00 0.00 0.00 60.65 60.11 1don s ILE 51 Cb -0.71 -3.15 -0.09 0.00 0.01 0.00 0.00 42.46 38.51 1don s ILE 51 CO 0.48 -0.24 1.73 0.00 0.00 0.00 0.00 174.94 176.90 1don s ALA 53 N 2.59 1.27 -0.18 0.00 0.00 -0.05 -1.54 121.76 123.86 1don s ALA 53 Ca 0.77 -0.77 -0.29 0.00 0.00 0.00 0.00 51.96 51.67 1don s ALA 53 Cb -0.43 -0.26 -0.05 0.00 0.00 0.00 0.00 23.12 22.39 1don s ALA 53 CO 0.34 0.28 1.87 0.34 0.00 0.00 0.00 175.76 178.59 1don s ASP 54 N -0.80 6.09 0.35 0.00 2.15 -1.26 -1.51 116.67 121.70 1don s ASP 54 Ca 0.04 1.89 0.25 0.00 0.43 0.00 0.00 52.55 55.16 1don s ASP 54 Cb -0.07 -2.53 1.26 0.00 -0.30 0.00 0.00 42.92 41.29 1don s ASP 54 CO 0.01 -1.45 1.77 1.55 -0.17 0.00 0.00 175.17 176.87 1don h PRO 55 N 12.10 0.00 -0.76 4.34 0.13 -1.91 -1.42 132.00 144.49 1don h PRO 55 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1don h PRO 55 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1don h PRO 55 CO 0.98 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.38 1don n LYS 56 N -2.38 3.17 -2.43 0.86 4.76 -1.26 -4.64 118.16 116.24 1don n LYS 56 Ca -0.01 -1.76 -0.24 0.00 -2.87 0.00 0.00 58.31 53.43 1don n LYS 56 Cb 0.11 -1.92 0.09 0.00 -1.84 0.00 0.00 35.03 31.47 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 -1.98 1.88 0.08 1.97 -1.52 -0.53 -5.01 119.66 114.55 1don s GLN 57 Ca 0.31 -0.75 0.22 0.00 -1.95 0.00 0.00 55.36 53.19 1don s GLN 57 Cb 0.23 -2.27 -0.17 0.00 -0.22 0.00 0.00 33.01 30.58 1don s GLN 57 CO 0.09 -1.35 0.76 1.17 -0.25 0.00 0.00 175.29 175.71 1don n LYS 58 N -2.85 0.62 -0.04 2.91 0.00 -1.26 -3.67 118.16 113.86 1don n LYS 58 Ca 0.12 -0.04 -0.04 0.00 0.00 0.00 0.00 58.31 58.34 1don n LYS 58 Cb 0.60 -1.66 -0.14 0.00 0.00 0.00 0.00 35.03 33.83 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 -2.43 0.37 0.80 5.64 4.27 -1.26 -3.91 117.44 120.91 1don n TRP 59 Ca -0.02 0.13 0.13 0.00 -3.89 0.00 0.00 57.50 53.84 1don n TRP 59 Cb 0.55 -0.96 0.52 0.00 -1.36 0.00 0.00 31.31 30.06 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 -2.74 0.34 0.09 -1.67 0.31 -1.26 -1.73 118.33 111.67 1don n VAL 60 Ca -0.20 -0.03 -0.02 0.00 -0.01 0.00 0.00 64.34 64.08 1don n VAL 60 Cb 0.97 -0.63 -0.06 0.00 -0.91 0.00 0.00 33.84 33.21 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 0.09 5.55 4.20 -1.68 -0.45 115.11 122.82 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 -0.02 0.00 0.30 0.00 0.00 27.48 28.27 1don h GLN 61 CO 0.00 0.72 -1.82 -0.44 -0.67 0.00 0.00 178.83 176.62 1don h ASP 62 N 0.00 0.29 0.08 1.46 3.32 -1.65 -3.27 116.42 116.65 1don h ASP 62 Ca -0.03 -0.58 -0.00 0.00 0.02 0.00 0.00 57.03 56.44 1don h ASP 62 Cb 1.60 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 41.06 1don h ASP 62 CO 0.09 1.51 -0.04 0.28 -1.72 0.00 0.00 179.24 179.37 1don h SER 63 N 0.05 -0.10 -0.77 6.45 0.02 -1.41 -1.71 113.55 116.09 1don h SER 63 Ca -0.35 -0.43 0.22 0.00 -0.84 0.00 0.00 61.79 60.40 1don h SER 63 Cb 2.03 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 64.56 1don h SER 63 CO 0.10 0.56 0.70 -0.03 -1.14 0.00 0.00 176.83 177.03 1don h MET 64 N -0.94 0.00 0.18 3.45 1.85 -1.27 0.57 114.93 118.77 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 0.52 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.56 1don h MET 64 CO 0.02 0.00 -1.64 -0.44 -0.40 0.00 0.00 176.91 174.45 1don h ASP 65 N 0.00 0.60 -0.13 1.39 3.32 -1.60 -0.44 116.42 119.56 1don h ASP 65 Ca 0.36 -0.83 0.04 0.00 0.02 0.00 0.00 57.03 56.63 1don h ASP 65 Cb 1.77 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 41.12 1don h ASP 65 CO -0.00 1.68 0.13 -0.74 -1.72 0.00 0.00 179.24 178.59 1don h HIS 66 N 0.11 0.00 0.00 4.55 2.76 0.10 -0.01 115.15 122.66 1don h HIS 66 Ca -0.30 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 57.56 1don h HIS 66 Cb 2.09 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 31.00 1don h HIS 66 CO 0.10 0.00 -2.02 1.28 -1.30 0.00 0.00 177.93 175.99 1don n LEU 67 N -4.05 0.43 0.07 0.26 4.77 -0.46 -2.71 117.00 115.31 1don n LEU 67 Ca 0.00 0.20 0.08 0.00 -0.03 0.00 0.00 56.01 56.27 1don n LEU 67 Cb 0.24 0.31 0.36 0.00 -2.33 0.00 0.00 43.42 42.01 1don n LEU 67 CO 0.30 0.41 0.75 -0.67 -1.33 0.00 0.00 177.39 176.85 1don n ASP 68 N -2.87 0.31 -2.82 -1.43 -0.08 -0.17 -2.67 116.55 106.82 1don n ASP 68 Ca -0.24 0.59 -0.00 0.00 -1.51 0.00 0.00 54.79 53.64 1don n ASP 68 Cb 1.07 -0.65 0.05 0.00 2.34 0.00 0.00 41.12 43.93 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 -1.86 1.70 0.06 -0.67 2.85 -0.22 -4.83 118.16 115.19 1don n LYS 69 Ca 0.02 -3.42 0.11 0.00 -1.05 0.00 0.00 58.31 53.97 1don n LYS 69 Cb 0.14 -1.52 0.01 0.00 -0.65 0.00 0.00 35.03 33.01 1don n LYS 69 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1don n GLN 70 N -0.62 0.47 -1.12 -1.58 -0.00 -1.09 -4.08 117.38 109.37 1don n GLN 70 Ca 0.06 0.04 -0.08 0.00 -0.00 0.00 0.00 57.00 57.01 1don n GLN 70 Cb 0.81 -1.70 0.15 0.00 -0.00 0.00 0.00 30.24 29.50 1don n GLN 70 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 1don n THR 71 N -2.32 2.50 -2.92 -0.39 5.66 -1.26 -4.95 114.28 110.60 1don n THR 71 Ca 0.01 -3.35 -0.44 0.00 -3.05 0.00 0.00 64.05 57.22 1don n THR 71 Cb 0.50 -0.57 -0.03 0.00 -1.55 0.00 0.00 70.33 68.67 1don n THR 71 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 1don s GLN 72 N -3.38 3.27 0.57 1.09 -1.52 -1.26 -5.02 119.66 113.41 1don s GLN 72 Ca 0.45 -1.22 -0.20 0.00 -1.95 0.00 0.00 55.36 52.45 1don s GLN 72 Cb 0.40 -4.47 -0.06 0.00 -0.22 0.00 0.00 33.01 28.67 1don s GLN 72 CO -0.01 -1.77 0.97 -2.37 -0.25 0.00 0.00 175.29 171.86 1don n THR 73 N 5.73 3.43 -0.57 -0.19 5.66 -1.26 -4.94 114.28 122.13 1don n THR 73 Ca 0.05 -0.50 -0.28 0.00 -3.05 0.00 0.00 64.05 60.27 1don n THR 73 Cb 0.46 -1.16 0.25 0.00 -1.55 0.00 0.00 70.33 68.33 1don n THR 73 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1don s PRO 74 N -2.61 -0.92 1.17 1.09 0.04 -1.26 -4.77 135.00 127.73 1don s PRO 74 Ca 0.73 0.81 0.00 0.00 0.04 0.00 0.00 61.00 62.58 1don s PRO 74 Cb -0.44 -1.56 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1don s PRO 74 CO 0.49 -3.72 0.00 1.63 0.04 0.00 0.00 177.00 175.44 1don n LYS 75 N -4.91 -0.62 0.00 4.56 5.02 -1.26 -5.31 118.16 115.64 1don n LYS 75 Ca 0.03 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.73 1don n LYS 75 Cb 0.54 -0.76 0.00 0.00 -0.02 0.00 0.00 35.03 34.80 1don n LYS 75 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51