#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 1.83 -0.36 2.61 0.02 -1.26 -4.80 135.00 133.04 1don s PRO 2 Ca 0.00 0.77 -0.04 0.00 0.02 0.00 0.00 61.00 61.74 1don s PRO 2 Cb 0.00 -4.72 0.00 0.00 0.02 0.00 0.00 34.50 29.80 1don s PRO 2 CO 0.00 -3.98 2.92 -0.25 -0.33 0.00 0.00 177.00 175.36 1don n ASP 3 N 17.42 6.22 -2.70 2.53 8.00 -1.26 -4.34 116.55 142.43 1don n ASP 3 Ca 0.42 -3.06 -0.06 0.00 0.71 0.00 0.00 54.79 52.81 1don n ASP 3 Cb 0.47 -1.26 0.07 0.00 -0.02 0.00 0.00 41.12 40.38 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 1.18 -2.69 0.59 2.24 0.00 -1.26 -4.99 120.51 115.58 1don n ALA 4 Ca 0.47 -0.74 0.11 0.00 0.00 0.00 0.00 53.44 53.28 1don n ALA 4 Cb 0.62 -2.49 -0.01 0.00 0.00 0.00 0.00 19.45 17.58 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 1.44 0.13 -1.98 0.00 5.41 -1.26 -4.34 119.36 118.76 1don n ILE 5 Ca 0.04 -0.22 -0.40 0.00 1.00 0.00 0.00 62.75 63.16 1don n ILE 5 Cb 0.68 0.30 -0.01 0.00 -0.71 0.00 0.00 39.64 39.91 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 -1.91 7.80 -4.58 4.38 6.94 -1.26 -4.93 115.26 121.70 1don n ASN 6 Ca 0.02 -3.10 -0.34 0.00 -0.02 0.00 0.00 54.58 51.14 1don n ASN 6 Cb 0.43 -1.39 -0.11 0.00 -2.36 0.00 0.00 39.78 36.35 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 3.09 -0.55 -2.53 0.00 -1.26 -5.03 121.76 114.70 1don s ALA 7 Ca 0.54 -0.83 -0.26 0.00 0.00 0.00 0.00 51.96 51.40 1don s ALA 7 Cb 0.18 -1.45 -0.05 0.00 0.00 0.00 0.00 23.12 21.79 1don s ALA 7 CO -0.08 0.42 2.19 -2.14 0.00 0.00 0.00 175.76 176.15 1don s PRO 8 N -0.32 2.30 -0.62 0.00 0.02 -1.26 -4.89 135.00 130.23 1don s PRO 8 Ca 0.06 1.05 -0.23 0.00 0.02 0.00 0.00 61.00 61.90 1don s PRO 8 Cb -0.12 -4.52 0.06 0.00 0.02 0.00 0.00 34.50 29.94 1don s PRO 8 CO 0.02 -3.10 0.94 0.54 -0.33 0.00 0.00 177.00 175.08 1don s VAL 9 N 11.02 4.37 -0.31 3.83 0.11 -1.26 -4.98 120.40 133.18 1don s VAL 9 Ca 0.85 -0.16 -0.28 0.00 -2.93 0.00 0.00 61.98 59.46 1don s VAL 9 Cb -0.15 -4.62 -0.02 0.00 -1.53 0.00 0.00 36.38 30.06 1don s VAL 9 CO 0.23 -1.31 1.85 -0.89 -3.33 0.00 0.00 175.10 171.65 1don s THR 10 N 3.96 3.41 0.00 5.04 2.01 -1.26 -4.92 115.64 123.88 1don s THR 10 Ca 0.24 0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.67 1don s THR 10 Cb -0.16 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 68.80 1don s THR 10 CO 0.13 -0.35 0.00 0.00 -0.69 0.00 0.00 174.62 173.71 1don n TYR 13 N -0.21 0.00 -4.08 0.00 4.01 -1.26 -4.95 117.16 110.66 1don n TYR 13 Ca 0.01 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.71 1don n TYR 13 Cb 0.18 0.11 -0.01 0.00 -0.31 0.00 0.00 39.34 39.31 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 -1.80 2.15 -3.66 7.72 3.02 -1.26 -5.15 115.26 116.28 1don n ASN 14 Ca 0.00 -1.25 -0.08 0.00 -0.03 0.00 0.00 54.58 53.22 1don n ASN 14 Cb 0.04 0.04 -0.09 0.00 -0.61 0.00 0.00 39.78 39.16 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 -1.20 -0.82 -0.77 3.10 0.40 -1.26 -4.71 117.98 112.72 1don s PHE 15 Ca 0.00 1.57 -0.26 0.00 -0.60 0.00 0.00 56.93 57.64 1don s PHE 15 Cb -0.00 0.34 -0.17 0.00 0.51 0.00 0.00 43.02 43.70 1don s PHE 15 CO 0.00 -0.48 2.49 -2.37 0.70 0.00 0.00 175.22 175.55 1don n THR 16 N 5.29 -0.04 1.11 0.64 5.66 -0.63 -4.69 114.28 121.62 1don n THR 16 Ca -0.10 -0.45 0.09 0.00 -3.05 0.00 0.00 64.05 60.55 1don n THR 16 Cb 0.50 -1.55 0.31 0.00 -1.55 0.00 0.00 70.33 68.04 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 13.17 1.77 -4.76 1.09 2.85 -1.26 -4.66 115.26 123.46 1don n ASN 17 Ca 0.52 -1.79 -0.37 0.00 -0.11 0.00 0.00 54.58 52.83 1don n ASN 17 Cb 0.30 -0.15 -0.06 0.00 1.24 0.00 0.00 39.78 41.11 1don n ASN 17 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 1don s ARG 18 N -1.71 4.17 -0.78 1.20 3.00 -1.26 -4.95 118.95 118.62 1don s ARG 18 Ca 0.30 0.34 -0.23 0.00 0.00 0.00 0.00 55.73 56.14 1don s ARG 18 Cb 0.16 -3.36 -0.17 0.00 0.00 0.00 0.00 34.95 31.58 1don s ARG 18 CO 0.24 0.36 2.39 1.63 0.00 0.00 0.00 175.30 179.92 1don n LYS 19 N 3.03 0.52 -2.71 3.54 5.02 -1.26 -4.86 118.16 121.44 1don n LYS 19 Ca -0.11 -0.44 -0.42 0.00 -2.02 0.00 0.00 58.31 55.32 1don n LYS 19 Cb 0.52 -2.97 -0.03 0.00 -0.02 0.00 0.00 35.03 32.53 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 11.11 4.83 -0.09 -0.18 1.01 -1.26 -4.95 121.20 131.67 1don s ILE 20 Ca 1.05 2.03 -0.39 0.00 0.00 0.00 0.00 60.65 63.34 1don s ILE 20 Cb -0.36 -4.31 -0.17 0.00 0.01 0.00 0.00 42.46 37.63 1don s ILE 20 CO 0.24 0.07 1.46 -0.24 0.00 0.00 0.00 174.94 176.48 1don n SER 21 N 4.53 1.66 0.30 3.58 2.88 -1.26 -4.75 113.62 120.56 1don n SER 21 Ca 0.07 1.11 0.18 0.00 -1.33 0.00 0.00 58.87 58.91 1don n SER 21 Cb 0.50 -1.12 0.92 0.00 -0.75 0.00 0.00 64.21 63.76 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 4.03 0.09 -0.22 2.46 3.04 -1.95 0.11 116.25 123.82 1don h VAL 22 Ca -0.47 0.00 -0.06 0.00 -1.01 0.00 0.00 66.70 65.15 1don h VAL 22 Cb 1.34 0.77 -0.01 0.00 -2.01 0.00 0.00 31.29 31.39 1don h VAL 22 CO 0.84 0.00 -0.11 0.06 -1.01 0.00 0.00 177.57 177.34 1don h GLN 23 N 0.00 0.46 -0.53 4.17 3.07 -2.01 -2.67 115.11 117.59 1don h GLN 23 Ca 0.03 -0.20 0.11 0.00 0.09 0.00 0.00 58.65 58.68 1don h GLN 23 Cb 0.50 -0.01 -0.03 0.00 0.08 0.00 0.00 27.48 28.02 1don h GLN 23 CO -0.00 0.74 0.37 0.00 0.09 0.00 0.00 178.83 180.03 1don h ARG 24 N 0.16 0.21 -5.85 0.06 2.47 -1.11 -3.36 114.38 106.97 1don h ARG 24 Ca 0.05 -0.01 -0.39 0.00 -1.26 0.00 0.00 59.98 58.37 1don h ARG 24 Cb 0.61 -0.05 -0.05 0.00 -1.65 0.00 0.00 29.97 28.83 1don h ARG 24 CO 0.03 0.14 0.98 -0.51 0.56 0.00 0.00 179.97 181.17 1don s LEU 25 N -9.10 3.24 0.56 3.04 1.43 -1.01 -0.72 118.68 116.12 1don s LEU 25 Ca -0.06 -0.58 0.36 0.00 -1.03 0.00 0.00 54.13 52.81 1don s LEU 25 Cb 0.20 -2.56 1.64 0.00 0.03 0.00 0.00 46.19 45.50 1don s LEU 25 CO 0.74 -2.46 2.07 0.00 0.23 0.00 0.00 176.35 176.93 1don h ALA 26 N 11.72 1.00 -2.22 4.21 0.00 0.86 -3.47 119.26 131.37 1don h ALA 26 Ca 0.03 0.00 0.27 0.00 0.00 0.00 0.00 54.91 55.21 1don h ALA 26 Cb 1.04 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 1don h ALA 26 CO 1.25 0.00 0.78 -1.12 0.00 0.00 0.00 179.25 180.15 1don s SER 27 N -5.38 -0.00 -0.17 0.00 0.01 -0.31 -4.95 113.70 102.89 1don s SER 27 Ca -0.00 -0.37 -0.12 0.00 1.31 0.00 0.00 55.95 56.76 1don s SER 27 Cb 0.10 0.28 0.05 0.00 0.21 0.00 0.00 66.02 66.66 1don s SER 27 CO 0.48 -0.55 0.43 -0.47 0.41 0.00 0.00 173.24 173.54 1don s TYR 28 N -2.13 -0.57 -0.51 2.43 6.14 -1.25 -0.83 117.35 120.63 1don s TYR 28 Ca 0.25 1.28 0.03 0.00 0.64 0.00 0.00 57.07 59.27 1don s TYR 28 Cb -0.01 0.24 0.15 0.00 0.42 0.00 0.00 41.96 42.77 1don s TYR 28 CO 0.01 -0.31 0.34 0.50 0.64 0.00 0.00 175.55 176.74 1don s ARG 29 N 0.93 1.50 -0.36 4.97 3.52 -0.53 -4.85 118.95 124.14 1don s ARG 29 Ca -0.06 -2.41 -0.41 0.00 -0.13 0.00 0.00 55.73 52.72 1don s ARG 29 Cb -0.06 -2.37 -0.16 0.00 -1.56 0.00 0.00 34.95 30.80 1don s ARG 29 CO -0.08 -1.26 1.83 -2.13 -0.81 0.00 0.00 175.30 172.85 1don n ARG 30 N 2.91 0.79 -2.95 5.12 0.63 -1.26 -1.78 116.66 120.12 1don n ARG 30 Ca 0.18 0.28 -0.35 0.00 -0.92 0.00 0.00 57.85 57.03 1don n ARG 30 Cb 0.38 -1.97 -0.06 0.00 0.45 0.00 0.00 32.46 31.26 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 4.28 4.43 -0.03 5.15 1.01 -0.39 -4.88 121.20 130.77 1don s ILE 31 Ca 1.04 1.46 0.01 0.00 0.00 0.00 0.00 60.65 63.16 1don s ILE 31 Cb -1.17 -3.83 0.04 0.00 0.01 0.00 0.00 42.46 37.51 1don s ILE 31 CO 0.67 0.04 0.48 0.35 0.00 0.00 0.00 174.94 176.47 1don n THR 32 N 0.28 0.00 -1.79 2.92 -2.24 -1.26 -2.06 114.28 110.13 1don n THR 32 Ca 0.02 -0.10 -0.38 0.00 -2.27 0.00 0.00 64.05 61.32 1don n THR 32 Cb 0.52 0.31 0.05 0.00 -2.10 0.00 0.00 70.33 69.10 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 -0.33 5.12 0.17 3.42 0.15 -1.26 -4.83 113.70 116.13 1don s SER 33 Ca 0.01 2.72 0.16 0.00 0.70 0.00 0.00 55.95 59.53 1don s SER 33 Cb 0.04 -2.63 0.74 0.00 -1.71 0.00 0.00 66.02 62.47 1don s SER 33 CO -0.01 -1.67 1.49 -0.24 1.20 0.00 0.00 173.24 174.01 1don n SER 34 N -1.24 0.35 0.01 5.45 2.88 -1.26 -1.66 113.62 118.15 1don n SER 34 Ca 0.12 0.62 0.11 0.00 -1.33 0.00 0.00 58.87 58.39 1don n SER 34 Cb 0.46 -0.68 -0.08 0.00 -0.75 0.00 0.00 64.21 63.15 1don n SER 34 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1don n LYS 35 N -1.93 0.40 -2.44 -1.46 4.01 -1.26 -4.91 118.16 110.57 1don n LYS 35 Ca 0.01 -0.07 -0.42 0.00 -0.51 0.00 0.00 58.31 57.32 1don n LYS 35 Cb 0.11 -1.56 -0.03 0.00 -0.51 0.00 0.00 35.03 33.04 1don n LYS 35 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1don h PRO 37 N 6.85 0.00 -2.70 0.00 0.13 -1.91 -3.43 132.00 130.94 1don h PRO 37 Ca -0.41 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.59 1don h PRO 37 Cb 1.21 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.08 1don h PRO 37 CO 0.81 0.00 -0.30 0.15 -0.23 0.00 0.00 178.00 178.43 1don s LYS 38 N -3.91 0.39 1.20 0.86 1.02 -1.26 -5.15 119.74 112.89 1don s LYS 38 Ca -0.02 0.71 -0.20 0.00 0.02 0.00 0.00 55.97 56.48 1don s LYS 38 Cb 0.11 0.02 0.31 0.00 -0.52 0.00 0.00 37.83 37.75 1don s LYS 38 CO 0.47 -0.14 0.85 0.39 -0.92 0.00 0.00 175.35 176.01 1don n GLU 39 N 3.94 -3.83 -3.01 1.68 4.71 -1.26 -4.67 120.64 118.20 1don n GLU 39 Ca -0.21 -1.40 0.00 0.00 -0.01 0.00 0.00 57.16 55.54 1don n GLU 39 Cb 0.55 -1.57 0.00 0.00 -1.01 0.00 0.00 31.44 29.42 1don n GLU 39 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1don n ALA 40 N -5.13 0.00 -3.68 0.62 0.00 -0.87 -4.90 120.51 106.55 1don n ALA 40 Ca -0.18 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.10 1don n ALA 40 Cb 0.52 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.82 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 -3.00 -0.22 -1.27 0.00 1.01 -0.81 -1.27 120.40 114.85 1don s VAL 41 Ca 0.00 0.34 -0.17 0.00 0.00 0.00 0.00 61.98 62.15 1don s VAL 41 Cb 0.00 -0.27 0.09 0.00 0.00 0.00 0.00 36.38 36.20 1don s VAL 41 CO 0.00 0.14 1.66 -0.63 0.00 0.00 0.00 175.10 176.27 1don s ILE 42 N 2.14 4.32 -1.11 2.22 -1.09 -0.73 -1.14 121.20 125.81 1don s ILE 42 Ca 0.02 -2.04 -0.23 0.00 -2.23 0.00 0.00 60.65 56.17 1don s ILE 42 Cb -0.12 -5.13 -0.06 0.00 -1.58 0.00 0.00 42.46 35.57 1don s ILE 42 CO -0.06 -1.93 1.90 -0.36 -1.23 0.00 0.00 174.94 173.27 1don s PHE 43 N 3.65 2.00 -0.55 3.97 0.08 -0.68 -1.45 117.98 124.99 1don s PHE 43 Ca 0.51 0.30 -0.26 0.00 0.12 0.00 0.00 56.93 57.60 1don s PHE 43 Cb 0.02 -4.10 -0.07 0.00 -0.57 0.00 0.00 43.02 38.30 1don s PHE 43 CO 0.06 -1.44 2.32 0.21 -0.10 0.00 0.00 175.22 176.27 1don s LYS 44 N 6.39 2.12 0.00 0.44 2.20 -0.01 -2.03 119.74 128.85 1don s LYS 44 Ca 0.67 1.14 0.00 0.00 -0.36 0.00 0.00 55.97 57.42 1don s LYS 44 Cb -0.02 -4.59 0.00 0.00 -1.51 0.00 0.00 37.83 31.71 1don s LYS 44 CO 0.08 -3.35 0.00 0.25 -0.36 0.00 0.00 175.35 171.97 1don n THR 45 N 7.98 0.00 0.01 3.43 -2.24 -1.21 0.11 114.28 122.36 1don n THR 45 Ca 0.36 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 62.10 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 0.16 -0.57 0.00 0.00 175.07 174.66 1don h ILE 46 N -0.83 0.68 -0.29 2.28 -2.65 -1.24 -3.06 117.51 112.41 1don h ILE 46 Ca 0.00 -2.34 0.00 0.00 1.03 0.00 0.00 64.86 63.55 1don h ILE 46 Cb 0.00 2.22 0.00 0.00 -2.05 0.00 0.00 36.82 36.99 1don h ILE 46 CO 0.00 0.38 0.00 0.55 0.03 0.00 0.00 178.15 179.11 1don n VAL 47 N -2.97 0.91 -1.25 0.16 3.14 -1.26 -4.83 118.33 112.23 1don n VAL 47 Ca -0.13 -0.55 -0.08 0.00 -2.96 0.00 0.00 64.34 60.62 1don n VAL 47 Cb 0.94 -0.15 -0.04 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 -0.13 -2.68 1.55 0.00 -1.23 -4.92 120.51 113.46 1don n ALA 48 Ca 0.12 0.14 -0.43 0.00 0.00 0.00 0.00 53.44 53.26 1don n ALA 48 Cb 0.51 -1.15 -0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 -2.59 4.02 -0.25 0.00 2.20 -1.26 -4.76 119.74 117.09 1don s LYS 49 Ca 0.00 -2.16 -0.36 0.00 -0.36 0.00 0.00 55.97 53.10 1don s LYS 49 Cb 0.00 -5.41 -0.12 0.00 -1.51 0.00 0.00 37.83 30.80 1don s LYS 49 CO 0.00 -2.12 2.01 0.39 -0.36 0.00 0.00 175.35 175.26 1don n GLU 50 N 7.63 1.49 -3.81 4.03 1.02 -1.26 -3.30 120.64 126.44 1don n GLU 50 Ca 0.45 0.49 -0.37 0.00 -0.02 0.00 0.00 57.16 57.72 1don n GLU 50 Cb 0.45 -2.49 -0.13 0.00 -0.02 0.00 0.00 31.44 29.25 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 5.61 3.44 0.14 -3.67 1.01 -0.86 -4.83 121.20 122.03 1don s ILE 51 Ca 1.02 -1.35 -0.31 0.00 0.00 0.00 0.00 60.65 60.01 1don s ILE 51 Cb -0.82 -3.01 -0.10 0.00 0.01 0.00 0.00 42.46 38.53 1don s ILE 51 CO 0.53 -0.23 1.75 0.00 0.00 0.00 0.00 174.94 176.99 1don s ALA 53 N 2.25 1.27 -0.18 0.00 0.00 -0.29 -1.60 121.76 123.21 1don s ALA 53 Ca 0.77 -0.70 -0.29 0.00 0.00 0.00 0.00 51.96 51.74 1don s ALA 53 Cb -0.45 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1don s ALA 53 CO 0.34 0.30 1.78 0.34 0.00 0.00 0.00 175.76 178.52 1don s ASP 54 N -0.53 6.23 0.36 0.00 2.15 -1.26 -1.92 116.67 121.70 1don s ASP 54 Ca 0.05 1.85 0.26 0.00 0.43 0.00 0.00 52.55 55.14 1don s ASP 54 Cb -0.06 -2.53 1.28 0.00 -0.30 0.00 0.00 42.92 41.31 1don s ASP 54 CO -0.00 -1.35 1.79 1.55 -0.17 0.00 0.00 175.17 176.99 1don h PRO 55 N 11.46 0.00 -0.43 4.34 0.13 -1.90 -1.66 132.00 143.94 1don h PRO 55 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1don h PRO 55 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 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 -2.42 1.77 -2.45 0.86 4.01 -1.26 -4.64 118.16 114.04 1don n LYS 56 Ca -0.00 -0.91 -0.23 0.00 -0.51 0.00 0.00 58.31 56.65 1don n LYS 56 Cb 0.12 -1.36 0.05 0.00 -0.51 0.00 0.00 35.03 33.33 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 -1.65 2.44 0.05 1.97 -1.52 -0.62 -5.00 119.66 115.33 1don s GLN 57 Ca 0.17 -0.50 0.23 0.00 -1.95 0.00 0.00 55.36 53.31 1don s GLN 57 Cb 0.10 -2.34 0.04 0.00 -0.22 0.00 0.00 33.01 30.59 1don s GLN 57 CO 0.09 -0.92 1.02 1.17 -0.25 0.00 0.00 175.29 176.40 1don n LYS 58 N -2.59 0.30 -0.05 2.91 3.00 -1.26 -3.40 118.16 117.07 1don n LYS 58 Ca 0.07 -0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.32 1don n LYS 58 Cb 0.60 -1.60 -0.14 0.00 0.00 0.00 0.00 35.03 33.89 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 -1.99 0.45 0.87 5.64 4.27 -1.26 -3.84 117.44 121.58 1don n TRP 59 Ca 0.02 0.16 0.14 0.00 -3.89 0.00 0.00 57.50 53.92 1don n TRP 59 Cb 0.44 -1.02 0.53 0.00 -1.36 0.00 0.00 31.31 29.91 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 -2.81 0.21 0.12 -1.67 0.31 -1.26 -1.77 118.33 111.46 1don n VAL 60 Ca -0.22 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 1don n VAL 60 Cb 1.02 -0.51 -0.01 0.00 -0.91 0.00 0.00 33.84 33.43 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 0.06 5.55 4.20 -1.66 -0.45 115.11 122.81 1don h GLN 61 Ca 0.00 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.36 1don h GLN 61 Cb 0.58 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.33 1don h GLN 61 CO 0.00 0.59 -1.99 -3.47 -0.67 0.00 0.00 178.83 173.28 1don n ASP 62 N -3.23 1.56 0.01 1.46 2.03 -1.14 -3.68 116.55 113.55 1don n ASP 62 Ca 0.01 0.22 -0.10 0.00 0.52 0.00 0.00 54.79 55.44 1don n ASP 62 Cb 0.78 -0.42 -0.08 0.00 -0.72 0.00 0.00 41.12 40.69 1don n ASP 62 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1don h SER 63 N 0.04 -0.11 -0.47 1.67 0.02 -1.43 -1.91 113.55 111.36 1don h SER 63 Ca -0.41 -0.44 0.14 0.00 -0.84 0.00 0.00 61.79 60.24 1don h SER 63 Cb 2.03 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 64.58 1don h SER 63 CO 0.06 0.54 0.56 -0.03 -1.14 0.00 0.00 176.83 176.82 1don h MET 64 N -0.92 0.00 0.17 3.45 1.85 -1.28 0.45 114.93 118.65 1don h MET 64 Ca -0.01 0.00 -0.33 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 -1.63 0.22 -0.40 0.00 0.00 176.91 175.12 1don h ASP 65 N 0.00 0.56 -0.10 1.39 1.82 -1.62 -0.48 116.42 117.99 1don h ASP 65 Ca 0.22 -0.77 0.02 0.00 -0.39 0.00 0.00 57.03 56.11 1don h ASP 65 Cb 1.34 -0.18 -0.00 0.00 0.68 0.00 0.00 39.33 41.16 1don h ASP 65 CO -0.00 1.64 0.07 -0.74 -1.61 0.00 0.00 179.24 178.60 1don h HIS 66 N 0.10 0.06 0.01 0.28 2.76 0.68 -0.86 115.15 118.17 1don h HIS 66 Ca -0.29 0.00 -0.30 0.00 -2.20 0.00 0.00 60.37 57.58 1don h HIS 66 Cb 2.08 -0.02 -0.05 0.00 1.55 0.00 0.00 27.41 30.97 1don h HIS 66 CO 0.09 0.04 -1.76 1.28 -1.30 0.00 0.00 177.93 176.28 1don n LEU 67 N -4.52 0.94 0.17 0.26 4.77 -0.52 -2.92 117.00 115.18 1don n LEU 67 Ca -0.01 0.38 0.12 0.00 -0.03 0.00 0.00 56.01 56.48 1don n LEU 67 Cb 0.14 0.11 0.61 0.00 -2.33 0.00 0.00 43.42 41.95 1don n LEU 67 CO 0.34 0.42 0.87 -0.78 -1.33 0.00 0.00 177.39 176.91 1don h ASP 68 N 0.00 0.00 -0.41 -1.43 1.82 0.22 -2.13 116.42 114.49 1don h ASP 68 Ca -0.31 0.00 -0.30 0.00 -0.39 0.00 0.00 57.03 56.04 1don h ASP 68 Cb 2.03 0.00 -0.36 0.00 0.68 0.00 0.00 39.33 41.67 1don h ASP 68 CO 0.08 0.00 -0.95 2.29 -1.61 0.00 0.00 179.24 179.05 1don n LYS 69 N -2.34 2.02 -0.01 0.28 2.85 -0.47 -4.65 118.16 115.84 1don n LYS 69 Ca -0.01 -3.45 0.10 0.00 -1.05 0.00 0.00 58.31 53.90 1don n LYS 69 Cb 0.10 -1.56 -0.15 0.00 -0.65 0.00 0.00 35.03 32.76 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 -0.52 0.61 -2.61 -1.58 1.13 -0.80 -4.62 117.38 108.99 1don n GLN 70 Ca 0.19 -0.16 -0.01 0.00 -1.94 0.00 0.00 57.00 55.08 1don n GLN 70 Cb 0.89 -1.46 0.08 0.00 0.11 0.00 0.00 30.24 29.86 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 -2.10 0.55 -2.71 5.09 5.66 -1.26 -4.94 114.28 114.56 1don n THR 71 Ca -0.03 -1.78 -0.09 0.00 -3.05 0.00 0.00 64.05 59.10 1don n THR 71 Cb 0.49 1.11 0.05 0.00 -1.55 0.00 0.00 70.33 70.43 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 -0.98 1.14 -3.72 1.09 6.02 -1.26 -5.00 117.38 114.66 1don n GLN 72 Ca -0.07 -2.85 -0.28 0.00 -0.01 0.00 0.00 57.00 53.80 1don n GLN 72 Cb 0.85 -0.96 -0.11 0.00 1.02 0.00 0.00 30.24 31.04 1don n GLN 72 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1don n THR 73 N -0.16 1.59 -1.64 5.09 -1.04 -1.26 -4.96 114.28 111.89 1don n THR 73 Ca 0.07 -4.85 -0.43 0.00 -2.04 0.00 0.00 64.05 56.81 1don n THR 73 Cb 0.81 -2.12 -0.03 0.00 -1.82 0.00 0.00 70.33 67.17 1don n THR 73 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1don s PRO 74 N -1.64 3.37 -0.34 -2.82 0.02 -1.26 -4.85 135.00 127.48 1don s PRO 74 Ca 0.30 2.13 0.16 0.00 0.02 0.00 0.00 61.00 63.60 1don s PRO 74 Cb 0.02 -4.32 0.43 0.00 0.02 0.00 0.00 34.50 30.66 1don s PRO 74 CO -0.13 -1.84 0.92 1.17 -0.33 0.00 0.00 177.00 176.79 1don n LYS 75 N 8.46 1.27 0.00 5.54 4.81 -1.26 -5.31 118.16 131.67 1don n LYS 75 Ca 0.27 -3.37 0.00 0.00 -0.87 0.00 0.00 58.31 54.34 1don n LYS 75 Cb 0.44 -1.40 0.00 0.00 0.02 0.00 0.00 35.03 34.09 1don n LYS 75 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82