#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 2.21 -1.37 -1.09 0.05 -1.26 -4.85 135.00 128.69 1don s PRO 2 Ca 0.00 1.35 -0.09 0.00 0.05 0.00 0.00 61.00 62.31 1don s PRO 2 Cb 0.00 -4.55 0.09 0.00 0.05 0.00 0.00 34.50 30.09 1don s PRO 2 CO 0.00 -3.15 2.24 -0.25 0.05 0.00 0.00 177.00 175.88 1don n ASP 3 N 15.33 6.22 0.00 6.66 8.00 -1.26 -4.26 116.55 147.25 1don n ASP 3 Ca 0.34 -2.99 0.00 0.00 0.71 0.00 0.00 54.79 52.85 1don n ASP 3 Cb 0.54 -1.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.15 1don n ASP 3 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1don n ALA 4 N 3.62 0.00 0.70 2.24 0.00 -1.26 -5.02 120.51 120.79 1don n ALA 4 Ca 0.54 0.00 0.12 0.00 0.00 0.00 0.00 53.44 54.10 1don n ALA 4 Cb 0.32 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.92 1don n ALA 4 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1don n ILE 5 N 0.00 0.20 -1.95 0.00 5.41 -1.26 -4.19 119.36 117.57 1don n ILE 5 Ca 0.00 -0.18 -0.40 0.00 1.00 0.00 0.00 62.75 63.17 1don n ILE 5 Cb 0.00 0.08 -0.01 0.00 -0.71 0.00 0.00 39.64 39.00 1don n ILE 5 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1don n ASN 6 N -1.89 7.97 -4.63 4.38 6.94 -1.26 -4.93 115.26 121.84 1don n ASN 6 Ca 0.04 -3.09 -0.35 0.00 -0.02 0.00 0.00 54.58 51.16 1don n ASN 6 Cb 0.41 -1.38 -0.10 0.00 -2.36 0.00 0.00 39.78 36.34 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 -0.78 3.25 -0.53 -2.53 0.00 -1.26 -5.02 121.76 114.89 1don s ALA 7 Ca 0.55 -0.79 -0.26 0.00 0.00 0.00 0.00 51.96 51.45 1don s ALA 7 Cb 0.18 -1.59 -0.05 0.00 0.00 0.00 0.00 23.12 21.66 1don s ALA 7 CO -0.09 0.42 2.14 -1.25 0.00 0.00 0.00 175.76 176.99 1don s PRO 8 N -0.36 2.41 -0.78 0.00 0.05 -1.26 -4.88 135.00 130.18 1don s PRO 8 Ca 0.07 1.09 -0.21 0.00 0.05 0.00 0.00 61.00 62.00 1don s PRO 8 Cb -0.12 -4.48 0.09 0.00 0.05 0.00 0.00 34.50 30.04 1don s PRO 8 CO 0.02 -2.95 1.06 0.54 0.05 0.00 0.00 177.00 175.73 1don s VAL 9 N 10.52 4.42 -0.27 -0.36 0.11 -1.26 -4.97 120.40 128.59 1don s VAL 9 Ca 0.84 -0.80 -0.28 0.00 -2.93 0.00 0.00 61.98 58.81 1don s VAL 9 Cb -0.16 -4.75 -0.05 0.00 -1.53 0.00 0.00 36.38 29.89 1don s VAL 9 CO 0.24 -1.52 2.23 -0.89 -3.33 0.00 0.00 175.10 171.84 1don s THR 10 N 3.68 3.03 0.00 5.04 2.01 -1.26 -4.88 115.64 123.26 1don s THR 10 Ca 0.28 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.30 1don s THR 10 Cb -0.11 -3.04 0.00 0.00 0.01 0.00 0.00 72.50 69.36 1don s THR 10 CO 0.02 -0.03 0.00 0.00 -0.69 0.00 0.00 174.62 173.92 1don n TYR 13 N -0.15 -0.03 -4.15 0.00 4.01 -1.26 -4.93 117.16 110.66 1don n TYR 13 Ca 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.68 1don n TYR 13 Cb 0.12 0.07 -0.01 0.00 -0.31 0.00 0.00 39.34 39.21 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 -1.64 2.20 -3.64 7.72 3.02 -1.26 -5.15 115.26 116.50 1don n ASN 14 Ca 0.00 -1.44 -0.09 0.00 -0.03 0.00 0.00 54.58 53.02 1don n ASN 14 Cb 0.00 0.08 -0.10 0.00 -0.61 0.00 0.00 39.78 39.15 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 -1.39 -0.77 -0.78 3.10 0.40 -1.26 -4.68 117.98 112.60 1don s PHE 15 Ca 0.00 1.45 -0.25 0.00 -0.60 0.00 0.00 56.93 57.53 1don s PHE 15 Cb 0.00 0.27 -0.17 0.00 0.51 0.00 0.00 43.02 43.63 1don s PHE 15 CO 0.00 -0.49 2.47 -2.37 0.70 0.00 0.00 175.22 175.54 1don n THR 16 N 5.39 -0.03 1.30 0.64 5.66 -0.57 -4.69 114.28 121.98 1don n THR 16 Ca -0.08 -0.45 0.11 0.00 -3.05 0.00 0.00 64.05 60.57 1don n THR 16 Cb 0.49 -1.54 0.40 0.00 -1.55 0.00 0.00 70.33 68.13 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 13.21 1.52 -4.73 1.09 4.05 -1.26 -4.66 115.26 124.49 1don n ASN 17 Ca 0.52 -1.67 -0.39 0.00 0.45 0.00 0.00 54.58 53.50 1don n ASN 17 Cb 0.31 -0.09 -0.05 0.00 1.23 0.00 0.00 39.78 41.17 1don n ASN 17 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 1don s ARG 18 N -1.82 4.35 -0.81 1.20 0.52 -1.26 -4.93 118.95 116.21 1don s ARG 18 Ca 0.32 0.65 -0.22 0.00 -0.52 0.00 0.00 55.73 55.97 1don s ARG 18 Cb 0.17 -3.41 -0.19 0.00 0.52 0.00 0.00 34.95 32.04 1don s ARG 18 CO 0.26 0.20 2.38 1.63 0.02 0.00 0.00 175.30 179.79 1don n LYS 19 N 3.42 0.44 -2.50 3.54 5.02 -1.26 -4.83 118.16 121.99 1don n LYS 19 Ca -0.05 -0.39 -0.43 0.00 -2.02 0.00 0.00 58.31 55.42 1don n LYS 19 Cb 0.51 -2.73 -0.02 0.00 -0.02 0.00 0.00 35.03 32.78 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 9.94 4.38 0.09 -0.18 1.01 -1.26 -4.94 121.20 130.24 1don s ILE 20 Ca 1.09 1.66 -0.36 0.00 0.00 0.00 0.00 60.65 63.03 1don s ILE 20 Cb -0.44 -4.12 -0.17 0.00 0.01 0.00 0.00 42.46 37.74 1don s ILE 20 CO 0.28 -0.20 1.26 -0.24 0.00 0.00 0.00 174.94 176.05 1don n SER 21 N 6.65 1.32 0.27 3.58 2.88 -1.26 -4.76 113.62 122.30 1don n SER 21 Ca 0.13 1.13 0.16 0.00 -1.33 0.00 0.00 58.87 58.96 1don n SER 21 Cb 0.45 -1.15 0.76 0.00 -0.75 0.00 0.00 64.21 63.52 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 3.14 0.09 -0.17 2.46 3.04 -1.93 0.12 116.25 123.00 1don h VAL 22 Ca -0.47 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.17 1don h VAL 22 Cb 1.35 0.62 -0.00 0.00 -2.01 0.00 0.00 31.29 31.25 1don h VAL 22 CO 0.74 0.00 -0.10 0.06 -1.01 0.00 0.00 177.57 177.26 1don h GLN 23 N 0.00 0.37 0.00 4.17 3.07 -2.02 -2.75 115.11 117.95 1don h GLN 23 Ca 0.05 -0.17 -0.02 0.00 0.09 0.00 0.00 58.65 58.61 1don h GLN 23 Cb 0.86 -0.01 -0.00 0.00 0.08 0.00 0.00 27.48 28.41 1don h GLN 23 CO -0.00 0.69 -0.08 0.00 0.09 0.00 0.00 178.83 179.53 1don h ARG 24 N 0.04 0.00 -6.27 0.06 2.47 -1.10 -3.39 114.38 106.19 1don h ARG 24 Ca 0.04 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.22 1don h ARG 24 Cb 0.60 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.85 1don h ARG 24 CO 0.03 0.08 1.14 -0.51 0.56 0.00 0.00 179.97 181.27 1don s LEU 25 N -8.15 3.21 0.42 3.04 1.43 -1.04 -0.98 118.68 116.62 1don s LEU 25 Ca -0.04 -0.19 0.22 0.00 -1.03 0.00 0.00 54.13 53.09 1don s LEU 25 Cb 0.15 -2.60 0.34 0.00 0.03 0.00 0.00 46.19 44.11 1don s LEU 25 CO 0.63 -1.96 1.60 0.00 0.23 0.00 0.00 176.35 176.85 1don h ALA 26 N 11.33 0.95 -2.31 4.21 0.00 -0.30 -3.47 119.26 129.67 1don h ALA 26 Ca -0.27 -0.07 0.23 0.00 0.00 0.00 0.00 54.91 54.79 1don h ALA 26 Cb 1.08 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1don h ALA 26 CO 1.26 0.10 0.69 0.43 0.00 0.00 0.00 179.25 181.72 1don n SER 27 N -3.12 -1.40 -3.71 0.00 7.64 0.04 -4.96 113.62 108.10 1don n SER 27 Ca 0.04 -1.57 -0.14 0.00 1.01 0.00 0.00 58.87 58.20 1don n SER 27 Cb 0.55 2.24 -0.08 0.00 -1.01 0.00 0.00 64.21 65.91 1don n SER 27 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1don s TYR 28 N -2.22 -0.33 -0.40 1.43 6.14 -1.25 -0.60 117.35 120.12 1don s TYR 28 Ca 0.25 0.61 0.03 0.00 0.64 0.00 0.00 57.07 58.60 1don s TYR 28 Cb -0.02 0.16 0.17 0.00 0.42 0.00 0.00 41.96 42.69 1don s TYR 28 CO 0.03 -0.39 0.32 1.03 0.64 0.00 0.00 175.55 177.18 1don s ARG 29 N -0.96 0.86 -0.75 4.97 0.52 -0.25 -4.86 118.95 118.48 1don s ARG 29 Ca -0.10 -2.01 -0.29 0.00 -0.52 0.00 0.00 55.73 52.81 1don s ARG 29 Cb -0.04 -1.41 -0.15 0.00 0.52 0.00 0.00 34.95 33.87 1don s ARG 29 CO 0.04 -1.36 2.55 -2.13 0.02 0.00 0.00 175.30 174.42 1don n ARG 30 N 3.00 0.49 -1.04 3.54 0.63 -1.26 -1.93 116.66 120.08 1don n ARG 30 Ca 0.27 0.01 -0.31 0.00 -0.92 0.00 0.00 57.85 56.91 1don n ARG 30 Cb 0.46 -2.37 0.13 0.00 0.45 0.00 0.00 32.46 31.13 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 10.27 2.79 0.00 5.15 1.01 0.69 -4.86 121.20 136.26 1don s ILE 31 Ca 1.19 0.26 0.00 0.00 0.00 0.00 0.00 60.65 62.09 1don s ILE 31 Cb -0.79 -2.57 0.00 0.00 0.01 0.00 0.00 42.46 39.11 1don s ILE 31 CO 0.40 -0.34 0.00 0.35 0.00 0.00 0.00 174.94 175.35 1don n THR 32 N -3.85 0.00 -0.27 2.92 -2.24 -1.26 -2.93 114.28 106.64 1don n THR 32 Ca 0.10 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.70 1don n THR 32 Cb 0.53 0.00 0.17 0.00 -2.10 0.00 0.00 70.33 68.93 1don n THR 32 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1don n SER 33 N 0.00 -3.11 -0.11 3.42 2.88 -1.26 -4.88 113.62 110.55 1don n SER 33 Ca 0.00 -0.49 0.12 0.00 -1.33 0.00 0.00 58.87 57.17 1don n SER 33 Cb 0.00 -0.66 0.28 0.00 -0.75 0.00 0.00 64.21 63.08 1don n SER 33 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1don n SER 34 N -3.18 0.78 -0.01 -3.46 7.64 -1.26 -4.03 113.62 110.11 1don n SER 34 Ca 0.08 -0.58 0.01 0.00 1.01 0.00 0.00 58.87 59.38 1don n SER 34 Cb 0.34 0.24 -0.00 0.00 -1.01 0.00 0.00 64.21 63.78 1don n SER 34 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1don n LYS 35 N -1.11 5.00 -1.84 1.43 4.76 -1.26 -5.01 118.16 120.13 1don n LYS 35 Ca 0.08 -0.13 -0.42 0.00 -2.87 0.00 0.00 58.31 54.98 1don n LYS 35 Cb 0.34 -0.66 -0.03 0.00 -1.84 0.00 0.00 35.03 32.85 1don n LYS 35 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1don h PRO 37 N 8.59 0.00 -2.67 0.00 0.13 -1.94 -3.42 132.00 132.68 1don h PRO 37 Ca -0.44 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.57 1don h PRO 37 Cb 1.21 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.09 1don h PRO 37 CO 0.94 0.02 -0.26 0.15 -0.23 0.00 0.00 178.00 178.62 1don s LYS 38 N -4.30 0.44 0.66 0.86 1.02 -1.26 -5.16 119.74 112.01 1don s LYS 38 Ca -0.04 0.70 -0.11 0.00 0.02 0.00 0.00 55.97 56.53 1don s LYS 38 Cb 0.14 0.10 0.17 0.00 -0.52 0.00 0.00 37.83 37.72 1don s LYS 38 CO 0.49 -0.11 0.48 -0.85 -0.92 0.00 0.00 175.35 174.45 1don n GLU 39 N 3.59 -2.74 -3.03 1.68 0.00 -1.26 -4.57 120.64 114.31 1don n GLU 39 Ca -0.18 -0.79 0.00 0.00 0.00 0.00 0.00 57.16 56.19 1don n GLU 39 Cb 0.56 -0.87 0.00 0.00 0.00 0.00 0.00 31.44 31.13 1don n GLU 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1don n ALA 40 N -4.16 0.00 -3.76 -1.84 0.00 -1.15 -4.88 120.51 104.72 1don n ALA 40 Ca -0.10 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.08 1don n ALA 40 Cb 0.29 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.57 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 -2.37 0.55 -1.19 0.00 1.01 -0.88 -0.22 120.40 117.30 1don s VAL 41 Ca 0.00 -0.38 -0.19 0.00 0.00 0.00 0.00 61.98 61.40 1don s VAL 41 Cb 0.00 -0.93 0.07 0.00 0.00 0.00 0.00 36.38 35.53 1don s VAL 41 CO 0.00 -0.05 1.60 -0.63 0.00 0.00 0.00 175.10 176.03 1don s ILE 42 N 1.86 4.14 -1.09 2.22 1.01 -0.81 -0.67 121.20 127.85 1don s ILE 42 Ca 0.01 -1.58 -0.23 0.00 0.00 0.00 0.00 60.65 58.85 1don s ILE 42 Cb -0.16 -5.12 -0.06 0.00 0.01 0.00 0.00 42.46 37.13 1don s ILE 42 CO -0.07 -1.96 1.91 -0.36 0.00 0.00 0.00 174.94 174.46 1don s PHE 43 N 4.25 1.98 -0.55 3.97 0.08 -0.60 -1.09 117.98 126.01 1don s PHE 43 Ca 0.50 0.34 -0.26 0.00 0.12 0.00 0.00 56.93 57.63 1don s PHE 43 Cb 0.02 -4.09 -0.09 0.00 -0.57 0.00 0.00 43.02 38.30 1don s PHE 43 CO 0.01 -1.44 2.43 1.63 -0.10 0.00 0.00 175.22 177.75 1don n LYS 44 N 8.50 0.94 0.00 0.44 5.02 0.23 -2.68 118.16 130.61 1don n LYS 44 Ca 0.43 -0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.60 1don n LYS 44 Cb 0.47 -3.40 0.00 0.00 -0.02 0.00 0.00 35.03 32.07 1don n LYS 44 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1don n THR 45 N 8.08 0.00 -0.01 -0.18 -2.24 -1.21 0.06 114.28 118.78 1don n THR 45 Ca 0.40 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 62.12 1don n THR 45 Cb 0.51 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.62 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 -0.63 1.44 0.36 2.28 -0.00 -0.15 -3.06 119.36 119.60 1don n ILE 46 Ca 0.00 -0.77 0.04 0.00 -0.00 0.00 0.00 62.75 62.02 1don n ILE 46 Cb 0.00 -0.88 0.18 0.00 -0.00 0.00 0.00 39.64 38.93 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 -2.96 1.03 -1.23 7.28 3.14 -1.26 -4.83 118.33 119.50 1don n VAL 47 Ca -0.16 -0.59 -0.08 0.00 -2.96 0.00 0.00 64.34 60.55 1don n VAL 47 Cb 0.99 -0.21 -0.03 0.00 -1.06 0.00 0.00 33.84 33.53 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 0.35 -0.12 -2.49 1.55 0.00 -1.24 -4.90 120.51 113.66 1don n ALA 48 Ca 0.12 0.13 -0.40 0.00 0.00 0.00 0.00 53.44 53.29 1don n ALA 48 Cb 0.57 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.83 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 -2.43 3.65 -0.26 0.00 2.20 -1.26 -4.76 119.74 116.88 1don s LYS 49 Ca 0.00 -1.62 -0.34 0.00 -0.36 0.00 0.00 55.97 53.65 1don s LYS 49 Cb 0.00 -5.44 -0.10 0.00 -1.51 0.00 0.00 37.83 30.78 1don s LYS 49 CO 0.00 -2.52 2.10 0.39 -0.36 0.00 0.00 175.35 174.96 1don n GLU 50 N 8.51 1.52 -3.85 4.03 1.02 -1.26 -3.29 120.64 127.32 1don n GLU 50 Ca 0.45 0.46 -0.35 0.00 -0.02 0.00 0.00 57.16 57.70 1don n GLU 50 Cb 0.47 -2.65 -0.13 0.00 -0.02 0.00 0.00 31.44 29.12 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 6.58 3.14 0.22 -3.67 1.01 -1.09 -4.87 121.20 122.53 1don s ILE 51 Ca 1.03 -1.60 -0.31 0.00 0.00 0.00 0.00 60.65 59.77 1don s ILE 51 Cb -0.72 -2.93 -0.11 0.00 0.01 0.00 0.00 42.46 38.70 1don s ILE 51 CO 0.48 -0.32 1.62 0.00 0.00 0.00 0.00 174.94 176.72 1don s ALA 53 N 0.75 1.04 -0.17 0.00 0.00 0.15 -1.51 121.76 122.02 1don s ALA 53 Ca 0.69 -0.71 -0.29 0.00 0.00 0.00 0.00 51.96 51.65 1don s ALA 53 Cb -0.47 -0.18 -0.05 0.00 0.00 0.00 0.00 23.12 22.42 1don s ALA 53 CO 0.37 0.20 1.91 0.34 0.00 0.00 0.00 175.76 178.59 1don s ASP 54 N -0.89 6.03 0.58 0.00 2.15 -1.26 -2.08 116.67 121.20 1don s ASP 54 Ca 0.02 1.91 0.38 0.00 0.43 0.00 0.00 52.55 55.28 1don s ASP 54 Cb -0.07 -2.52 1.85 0.00 -0.30 0.00 0.00 42.92 41.88 1don s ASP 54 CO 0.01 -1.50 2.14 1.55 -0.17 0.00 0.00 175.17 177.20 1don h PRO 55 N 12.38 0.00 -0.59 4.34 0.13 -1.91 -1.70 132.00 144.64 1don h PRO 55 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 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 -2.99 2.25 -2.58 0.86 4.01 -1.26 -4.71 118.16 113.74 1don n LYS 56 Ca -0.01 -1.26 -0.24 0.00 -0.51 0.00 0.00 58.31 56.28 1don n LYS 56 Cb 0.17 -1.56 0.03 0.00 -0.51 0.00 0.00 35.03 33.16 1don n LYS 56 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1don s GLN 57 N -1.67 2.75 0.03 1.97 -1.52 -0.64 -4.99 119.66 115.59 1don s GLN 57 Ca 0.23 -0.35 0.23 0.00 -1.95 0.00 0.00 55.36 53.52 1don s GLN 57 Cb 0.15 -2.38 0.20 0.00 -0.22 0.00 0.00 33.01 30.75 1don s GLN 57 CO 0.10 -0.67 1.17 1.17 -0.25 0.00 0.00 175.29 176.81 1don n LYS 58 N -2.45 0.15 -0.05 2.91 3.00 -1.26 -3.42 118.16 117.04 1don n LYS 58 Ca 0.05 0.01 -0.07 0.00 -0.00 0.00 0.00 58.31 58.30 1don n LYS 58 Cb 0.59 -1.56 -0.14 0.00 0.00 0.00 0.00 35.03 33.91 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 -1.76 0.49 0.65 5.64 4.27 -1.26 -3.81 117.44 121.66 1don n TRP 59 Ca 0.04 0.17 0.13 0.00 -3.89 0.00 0.00 57.50 53.95 1don n TRP 59 Cb 0.39 -1.06 0.45 0.00 -1.36 0.00 0.00 31.31 29.74 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 -2.85 0.55 0.11 -1.67 0.31 -1.26 -1.95 118.33 111.57 1don n VAL 60 Ca -0.23 -0.13 -0.02 0.00 -0.01 0.00 0.00 64.34 63.95 1don n VAL 60 Cb 1.05 -0.68 0.01 0.00 -0.91 0.00 0.00 33.84 33.31 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 0.17 5.55 4.20 -1.65 -0.12 115.11 123.26 1don h GLN 61 Ca 0.00 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.37 1don h GLN 61 Cb 0.62 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.40 1don h GLN 61 CO 0.00 0.73 -1.66 -0.44 -0.67 0.00 0.00 178.83 176.79 1don h ASP 62 N 0.00 0.56 0.18 1.46 3.32 -1.61 -3.29 116.42 117.04 1don h ASP 62 Ca -0.01 -0.80 -0.01 0.00 0.02 0.00 0.00 57.03 56.24 1don h ASP 62 Cb 1.47 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1don h ASP 62 CO 0.10 1.67 -0.09 0.28 -1.72 0.00 0.00 179.24 179.47 1don h SER 63 N 0.10 -0.21 -0.19 6.45 0.02 -1.42 -3.23 113.55 115.06 1don h SER 63 Ca -0.30 -0.27 0.06 0.00 -0.84 0.00 0.00 61.79 60.43 1don h SER 63 Cb 2.08 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 64.67 1don h SER 63 CO 0.18 0.34 0.44 0.00 -1.14 0.00 0.00 176.83 176.65 1don h MET 64 N -0.95 0.00 0.07 3.45 -0.00 -1.19 0.27 114.93 116.58 1don h MET 64 Ca -0.03 0.00 -0.27 0.00 -0.00 0.00 0.00 59.70 59.41 1don h MET 64 Cb 0.47 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.06 1don h MET 64 CO 0.04 0.00 -1.30 0.38 -0.00 0.00 0.00 176.91 176.03 1don h ASP 65 N 0.00 0.25 0.59 -0.10 3.04 -1.62 -0.20 116.42 118.37 1don h ASP 65 Ca 0.09 -0.30 -0.15 0.00 -3.24 0.00 0.00 57.03 53.43 1don h ASP 65 Cb 0.98 -0.08 -0.02 0.00 -1.04 0.00 0.00 39.33 39.17 1don h ASP 65 CO -0.00 1.24 -0.68 1.12 -2.04 0.00 0.00 179.24 178.89 1don h HIS 66 N 0.04 0.10 -0.05 4.15 2.07 -0.98 -1.56 115.15 118.92 1don h HIS 66 Ca -0.14 -0.05 -0.19 0.00 -2.85 0.00 0.00 60.37 57.14 1don h HIS 66 Cb 1.93 -0.02 -0.01 0.00 2.57 0.00 0.00 27.41 31.89 1don h HIS 66 CO 0.04 0.73 -0.77 -0.07 -3.07 0.00 0.00 177.93 174.78 1don h LEU 67 N 0.05 0.41 -0.81 6.12 3.38 -1.42 0.17 115.31 123.21 1don h LEU 67 Ca -0.01 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1don h LEU 67 Cb 1.20 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1don h LEU 67 CO 0.09 1.03 0.00 -0.67 0.09 0.00 0.00 178.44 178.98 1don n ASP 68 N -3.79 0.47 -2.46 -0.43 -0.08 -0.09 -2.36 116.55 107.82 1don n ASP 68 Ca -0.04 0.66 -0.01 0.00 -1.51 0.00 0.00 54.79 53.89 1don n ASP 68 Cb 0.73 -0.75 0.05 0.00 2.34 0.00 0.00 41.12 43.49 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 -2.07 1.58 -0.21 -0.67 2.85 -0.64 -4.81 118.16 114.19 1don n LYS 69 Ca 0.01 -3.29 0.08 0.00 -1.05 0.00 0.00 58.31 54.06 1don n LYS 69 Cb 0.12 -1.37 0.21 0.00 -0.65 0.00 0.00 35.03 33.34 1don n LYS 69 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1don n GLN 70 N -0.42 2.02 -2.75 -1.58 1.13 0.51 -4.12 117.38 112.18 1don n GLN 70 Ca 0.11 -1.58 -0.01 0.00 -1.94 0.00 0.00 57.00 53.57 1don n GLN 70 Cb 0.88 -1.35 0.09 0.00 0.11 0.00 0.00 30.24 29.96 1don n GLN 70 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 1don n THR 71 N 0.79 0.61 -2.74 5.09 5.66 -1.26 -4.94 114.28 117.48 1don n THR 71 Ca 0.15 -1.92 -0.09 0.00 -3.05 0.00 0.00 64.05 59.14 1don n THR 71 Cb 0.38 1.15 0.06 0.00 -1.55 0.00 0.00 70.33 70.37 1don n THR 71 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1don n GLN 72 N -1.09 1.13 -1.71 1.09 10.64 -1.26 -5.12 117.38 121.06 1don n GLN 72 Ca -0.06 -2.57 -0.38 0.00 -1.83 0.00 0.00 57.00 52.16 1don n GLN 72 Cb 0.84 -0.81 0.06 0.00 -0.86 0.00 0.00 30.24 29.47 1don n GLN 72 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 1don n THR 73 N -0.18 4.31 -1.76 -0.39 5.66 -1.26 -4.88 114.28 115.77 1don n THR 73 Ca 0.06 -0.50 -0.42 0.00 -3.05 0.00 0.00 64.05 60.14 1don n THR 73 Cb 0.80 -1.49 -0.03 0.00 -1.55 0.00 0.00 70.33 68.06 1don n THR 73 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 175.07 169.18 1don s PRO 74 N -3.07 4.14 -0.16 1.09 0.02 -1.26 -4.93 135.00 130.84 1don s PRO 74 Ca 0.77 2.56 -0.29 0.00 0.02 0.00 0.00 61.00 64.07 1don s PRO 74 Cb -0.40 -3.10 -0.02 0.00 0.02 0.00 0.00 34.50 31.00 1don s PRO 74 CO 0.45 -0.73 1.30 0.21 -0.33 0.00 0.00 177.00 177.90 1don s LYS 75 N 1.21 4.23 0.00 5.54 2.36 -1.26 -5.31 119.74 126.51 1don s LYS 75 Ca 0.74 1.71 0.00 0.00 -2.55 0.00 0.00 55.97 55.87 1don s LYS 75 Cb -0.49 -3.78 0.00 0.00 -1.05 0.00 0.00 37.83 32.51 1don s LYS 75 CO 0.32 -0.72 0.00 0.25 1.55 0.00 0.00 175.35 176.75