#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 2.05 -0.40 -1.09 0.02 -1.26 -4.82 135.00 129.50 1don s PRO 2 Ca 0.00 1.08 -0.04 0.00 0.02 0.00 0.00 61.00 62.05 1don s PRO 2 Cb 0.00 -4.63 -0.01 0.00 0.02 0.00 0.00 34.50 29.89 1don s PRO 2 CO 0.00 -3.50 2.95 -3.47 -0.33 0.00 0.00 177.00 172.65 1don n ASP 3 N 16.19 6.28 -2.94 2.53 -0.08 -1.26 -4.55 116.55 132.73 1don n ASP 3 Ca 0.37 -3.04 -0.02 0.00 -1.51 0.00 0.00 54.79 50.59 1don n ASP 3 Cb 0.52 -1.28 0.00 0.00 2.34 0.00 0.00 41.12 42.70 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 -1.09 -2.46 -0.33 -1.67 0.00 -1.26 -5.00 121.76 109.96 1don s ALA 4 Ca 0.61 -0.03 0.22 0.00 0.00 0.00 0.00 51.96 52.76 1don s ALA 4 Cb 0.36 -2.76 -0.24 0.00 0.00 0.00 0.00 23.12 20.48 1don s ALA 4 CO -0.17 -2.26 0.68 -0.89 0.00 0.00 0.00 175.76 173.12 1don n ILE 5 N 3.55 0.06 -1.86 0.00 2.08 -1.26 -4.43 119.36 117.51 1don n ILE 5 Ca 0.14 -0.36 -0.40 0.00 0.56 0.00 0.00 62.75 62.69 1don n ILE 5 Cb 0.57 0.22 -0.01 0.00 -0.75 0.00 0.00 39.64 39.68 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 -2.08 7.87 -4.68 4.38 6.94 -1.26 -4.93 115.26 121.49 1don n ASN 6 Ca -0.01 -3.00 -0.35 0.00 -0.02 0.00 0.00 54.58 51.20 1don n ASN 6 Cb 0.50 -1.42 -0.09 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 -0.14 3.28 -0.56 -2.53 0.00 -1.26 -5.03 121.76 115.53 1don s ALA 7 Ca 0.56 -0.82 -0.27 0.00 0.00 0.00 0.00 51.96 51.44 1don s ALA 7 Cb 0.17 -1.46 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 1don s ALA 7 CO -0.08 0.60 1.94 -1.25 0.00 0.00 0.00 175.76 176.97 1don s PRO 8 N -0.96 2.62 -0.84 0.00 0.04 -1.26 -4.89 135.00 129.71 1don s PRO 8 Ca 0.14 0.84 -0.21 0.00 0.04 0.00 0.00 61.00 61.81 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 0.03 -2.72 1.14 0.54 0.04 0.00 0.00 177.00 176.03 1don s VAL 9 N 9.34 4.38 -0.27 -0.36 0.11 -1.26 -4.96 120.40 127.38 1don s VAL 9 Ca 0.74 -0.89 -0.28 0.00 -2.93 0.00 0.00 61.98 58.62 1don s VAL 9 Cb -0.15 -4.81 -0.06 0.00 -1.53 0.00 0.00 36.38 29.84 1don s VAL 9 CO 0.23 -1.59 2.25 0.41 -3.33 0.00 0.00 175.10 173.07 1don n THR 10 N 5.95 0.27 -3.76 5.04 -1.04 -1.26 -4.87 114.28 114.61 1don n THR 10 Ca 0.15 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 1don n THR 10 Cb 0.48 -2.55 0.00 0.00 -1.82 0.00 0.00 70.33 66.45 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 -0.53 0.00 -4.62 0.00 4.01 -1.26 -4.93 117.16 109.83 1don n TYR 13 Ca -0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.42 1don n TYR 13 Cb 0.37 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.33 1don n TYR 13 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1don s ASN 14 N -2.86 3.38 -0.11 7.72 0.01 -1.26 -5.15 114.94 116.67 1don s ASN 14 Ca 0.00 -1.73 -0.04 0.00 -0.71 0.00 0.00 52.86 50.38 1don s ASN 14 Cb 0.00 0.63 0.06 0.00 0.41 0.00 0.00 41.25 42.35 1don s ASN 14 CO 0.00 -0.97 0.21 -0.36 -1.51 0.00 0.00 177.10 174.48 1don s PHE 15 N -3.07 -0.31 -0.76 2.20 0.08 -1.26 -4.65 117.98 110.22 1don s PHE 15 Ca 0.14 0.80 -0.27 0.00 0.12 0.00 0.00 56.93 57.73 1don s PHE 15 Cb 0.01 -0.14 -0.16 0.00 -0.57 0.00 0.00 43.02 42.16 1don s PHE 15 CO 0.10 -0.31 2.51 -2.37 -0.10 0.00 0.00 175.22 175.04 1don n THR 16 N 5.32 -0.04 1.27 0.64 5.66 -0.54 -4.70 114.28 121.89 1don n THR 16 Ca -0.06 -0.44 0.11 0.00 -3.05 0.00 0.00 64.05 60.61 1don n THR 16 Cb 0.50 -1.62 0.40 0.00 -1.55 0.00 0.00 70.33 68.06 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 13.28 1.64 -4.75 1.09 2.85 -1.26 -4.62 115.26 123.49 1don n ASN 17 Ca 0.52 -1.67 -0.39 0.00 -0.11 0.00 0.00 54.58 52.93 1don n ASN 17 Cb 0.30 -0.09 -0.06 0.00 1.24 0.00 0.00 39.78 41.18 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 -1.82 4.32 -0.81 1.20 0.52 -1.26 -4.93 118.95 116.16 1don s ARG 18 Ca 0.33 0.63 -0.22 0.00 -0.52 0.00 0.00 55.73 55.95 1don s ARG 18 Cb 0.18 -3.38 -0.19 0.00 0.52 0.00 0.00 34.95 32.08 1don s ARG 18 CO 0.27 0.27 2.39 1.63 0.02 0.00 0.00 175.30 179.89 1don n LYS 19 N 3.16 0.44 -2.47 3.54 5.02 -1.26 -4.83 118.16 121.75 1don n LYS 19 Ca -0.07 -0.32 -0.43 0.00 -2.02 0.00 0.00 58.31 55.47 1don n LYS 19 Cb 0.51 -2.64 -0.02 0.00 -0.02 0.00 0.00 35.03 32.86 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 9.71 4.33 0.22 -0.18 1.01 -1.26 -4.95 121.20 130.08 1don s ILE 20 Ca 1.10 1.59 -0.29 0.00 0.00 0.00 0.00 60.65 63.05 1don s ILE 20 Cb -0.49 -4.10 -0.16 0.00 0.01 0.00 0.00 42.46 37.72 1don s ILE 20 CO 0.31 -0.23 0.86 -0.24 0.00 0.00 0.00 174.94 175.63 1don n SER 21 N 6.78 0.30 0.30 3.58 2.88 -1.26 -4.79 113.62 121.41 1don n SER 21 Ca 0.14 1.15 0.16 0.00 -1.33 0.00 0.00 58.87 58.99 1don n SER 21 Cb 0.45 -1.13 0.97 0.00 -0.75 0.00 0.00 64.21 63.75 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 1.78 0.44 -0.15 2.46 3.04 -1.93 0.11 116.25 122.00 1don h VAL 22 Ca -0.36 -0.01 -0.14 0.00 -1.01 0.00 0.00 66.70 65.18 1don h VAL 22 Cb 1.38 1.00 -0.01 0.00 -2.01 0.00 0.00 31.29 31.66 1don h VAL 22 CO 0.61 0.00 -0.50 0.06 -1.01 0.00 0.00 177.57 176.73 1don h GLN 23 N 0.00 0.40 0.00 4.17 3.07 -2.01 -2.07 115.11 118.67 1don h GLN 23 Ca -0.00 -0.23 0.00 0.00 0.09 0.00 0.00 58.65 58.51 1don h GLN 23 Cb 0.00 0.02 0.00 0.00 0.08 0.00 0.00 27.48 27.58 1don h GLN 23 CO 0.00 0.81 0.00 -2.13 0.09 0.00 0.00 178.83 177.60 1don n ARG 24 N -3.97 0.99 -3.97 0.06 3.00 0.37 -4.55 116.66 108.60 1don n ARG 24 Ca -0.02 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.51 1don n ARG 24 Cb 0.56 -1.06 -0.14 0.00 0.00 0.00 0.00 32.46 31.81 1don n ARG 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1don s LEU 25 N -1.13 4.85 0.46 6.15 1.43 -0.78 -3.65 118.68 126.01 1don s LEU 25 Ca 0.06 -2.11 0.25 0.00 -1.03 0.00 0.00 54.13 51.30 1don s LEU 25 Cb 0.03 -1.67 0.68 0.00 0.03 0.00 0.00 46.19 45.26 1don s LEU 25 CO 0.05 -0.41 1.73 0.00 0.23 0.00 0.00 176.35 177.94 1don h ALA 26 N 7.71 0.97 -2.12 4.21 0.00 0.13 -3.47 119.26 126.70 1don h ALA 26 Ca -0.06 -0.07 0.29 0.00 0.00 0.00 0.00 54.91 55.07 1don h ALA 26 Cb 1.03 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 1don h ALA 26 CO 0.56 0.10 0.78 -1.13 0.00 0.00 0.00 179.25 179.55 1don n SER 27 N -3.14 -1.16 -3.71 0.00 3.41 -0.06 -4.96 113.62 104.00 1don n SER 27 Ca 0.02 -1.32 -0.13 0.00 -0.26 0.00 0.00 58.87 57.19 1don n SER 27 Cb 0.47 1.82 -0.10 0.00 -0.26 0.00 0.00 64.21 66.14 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 -2.17 -0.54 -0.51 7.33 5.04 -1.25 -0.26 117.35 124.99 1don s TYR 28 Ca 0.26 1.28 0.05 0.00 -2.44 0.00 0.00 57.07 56.22 1don s TYR 28 Cb -0.01 0.21 0.18 0.00 0.35 0.00 0.00 41.96 42.68 1don s TYR 28 CO 0.00 -0.27 0.41 -2.13 -1.34 0.00 0.00 175.55 172.22 1don n ARG 29 N 3.14 0.79 -1.30 4.97 0.63 -0.87 -4.85 116.66 119.17 1don n ARG 29 Ca -0.15 -3.62 -0.55 0.00 -0.92 0.00 0.00 57.85 52.60 1don n ARG 29 Cb 0.57 -1.85 -0.13 0.00 0.45 0.00 0.00 32.46 31.50 1don n ARG 29 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1don n ARG 30 N 2.43 0.00 -1.37 -0.14 0.63 -1.26 -2.89 116.66 114.06 1don n ARG 30 Ca 0.26 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.89 1don n ARG 30 Cb 0.44 -1.49 0.09 0.00 0.45 0.00 0.00 32.46 31.95 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 6.66 3.32 0.00 5.15 1.01 0.26 -4.89 121.20 132.70 1don s ILE 31 Ca 1.23 0.43 0.00 0.00 0.00 0.00 0.00 60.65 62.31 1don s ILE 31 Cb -1.44 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 38.02 1don s ILE 31 CO 0.62 -0.56 0.00 0.35 0.00 0.00 0.00 174.94 175.35 1don n THR 32 N -3.49 0.00 -0.17 2.92 -2.24 -1.26 -3.10 114.28 106.94 1don n THR 32 Ca 0.08 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.75 1don n THR 32 Cb 0.54 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.88 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 -2.51 0.07 3.42 2.88 -1.26 -4.91 113.62 111.31 1don n SER 33 Ca 0.00 -0.31 0.09 0.00 -1.33 0.00 0.00 58.87 57.32 1don n SER 33 Cb 0.00 -0.42 -0.04 0.00 -0.75 0.00 0.00 64.21 63.00 1don n SER 33 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1don n SER 34 N -2.85 0.70 -0.40 -3.46 2.88 -1.26 -4.08 113.62 105.15 1don n SER 34 Ca 0.05 0.28 0.07 0.00 -1.33 0.00 0.00 58.87 57.93 1don n SER 34 Cb 0.21 0.66 0.02 0.00 -0.75 0.00 0.00 64.21 64.36 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 -2.64 1.52 -1.97 -1.46 4.76 -1.26 -4.97 118.16 112.14 1don n LYS 35 Ca -0.03 -0.95 -0.42 0.00 -2.87 0.00 0.00 58.31 54.04 1don n LYS 35 Cb 0.61 -1.22 -0.03 0.00 -1.84 0.00 0.00 35.03 32.55 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 8.41 0.00 -2.71 0.00 0.13 -1.93 -3.43 132.00 132.47 1don h PRO 37 Ca -0.42 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.59 1don h PRO 37 Cb 1.20 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.09 1don h PRO 37 CO 0.93 0.01 -0.23 0.15 -0.23 0.00 0.00 178.00 178.63 1don s LYS 38 N -4.03 0.48 1.12 0.86 1.02 -1.26 -5.16 119.74 112.78 1don s LYS 38 Ca -0.03 0.60 -0.19 0.00 0.02 0.00 0.00 55.97 56.37 1don s LYS 38 Cb 0.12 0.22 0.27 0.00 -0.52 0.00 0.00 37.83 37.92 1don s LYS 38 CO 0.47 -0.07 1.24 -1.21 -0.92 0.00 0.00 175.35 174.86 1don s GLU 39 N 0.31 -0.63 0.00 1.68 8.01 -1.26 -4.61 118.70 122.20 1don s GLU 39 Ca -0.01 -0.38 0.00 0.00 0.01 0.00 0.00 54.97 54.59 1don s GLU 39 Cb -0.03 -1.69 0.00 0.00 -4.31 0.00 0.00 34.13 28.09 1don s GLU 39 CO -0.00 -3.27 0.00 0.00 0.01 0.00 0.00 175.26 172.00 1don n ALA 40 N -4.38 0.00 -3.69 5.21 0.00 -1.18 -4.90 120.51 111.57 1don n ALA 40 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.32 1don n ALA 40 Cb 0.59 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.88 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 -2.47 1.50 -1.29 0.00 1.01 -0.75 -0.58 120.40 117.82 1don s VAL 41 Ca 0.00 -0.64 -0.13 0.00 0.00 0.00 0.00 61.98 61.21 1don s VAL 41 Cb 0.00 -1.38 0.13 0.00 0.00 0.00 0.00 36.38 35.13 1don s VAL 41 CO 0.00 0.44 1.76 -0.38 0.00 0.00 0.00 175.10 176.92 1don n ILE 42 N 4.26 4.09 -1.79 2.22 2.08 -1.14 -0.85 119.36 128.23 1don n ILE 42 Ca -0.19 -4.23 -0.20 0.00 0.56 0.00 0.00 62.75 58.70 1don n ILE 42 Cb 0.51 -2.43 -0.07 0.00 -0.75 0.00 0.00 39.64 36.90 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 2.03 1.47 -0.63 1.39 0.08 -0.57 -2.05 117.98 119.68 1don s PHE 43 Ca 0.45 1.44 -0.26 0.00 0.12 0.00 0.00 56.93 58.68 1don s PHE 43 Cb 0.05 -3.67 -0.03 0.00 -0.57 0.00 0.00 43.02 38.80 1don s PHE 43 CO 0.00 -1.39 1.94 0.15 -0.10 0.00 0.00 175.22 175.82 1don s LYS 44 N 7.91 2.55 0.00 0.44 1.02 0.65 -2.24 119.74 130.06 1don s LYS 44 Ca 0.80 0.59 0.00 0.00 0.02 0.00 0.00 55.97 57.39 1don s LYS 44 Cb -0.08 -4.49 0.00 0.00 -0.52 0.00 0.00 37.83 32.75 1don s LYS 44 CO 0.08 -2.89 0.00 0.25 -0.92 0.00 0.00 175.35 171.87 1don n THR 45 N 7.39 0.00 0.04 2.17 -2.24 -1.24 0.49 114.28 120.89 1don n THR 45 Ca 0.25 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 62.03 1don n THR 45 Cb 0.52 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.67 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 -0.75 0.56 -0.27 2.28 -2.65 -1.85 -3.08 117.51 111.74 1don h ILE 46 Ca 0.00 -2.04 0.00 0.00 1.03 0.00 0.00 64.86 63.85 1don h ILE 46 Cb 0.00 2.09 0.00 0.00 -2.05 0.00 0.00 36.82 36.86 1don h ILE 46 CO 0.00 0.32 0.00 0.55 0.03 0.00 0.00 178.15 179.05 1don n VAL 47 N -2.93 0.80 -1.66 0.16 3.14 -1.26 -4.83 118.33 111.74 1don n VAL 47 Ca -0.08 -0.50 -0.14 0.00 -2.96 0.00 0.00 64.34 60.66 1don n VAL 47 Cb 0.83 -0.12 -0.04 0.00 -1.06 0.00 0.00 33.84 33.45 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 0.32 -0.27 -2.56 1.55 0.00 -1.22 -4.89 120.51 113.44 1don n ALA 48 Ca 0.11 0.19 -0.43 0.00 0.00 0.00 0.00 53.44 53.31 1don n ALA 48 Cb 0.46 -1.56 0.00 0.00 0.00 0.00 0.00 19.45 18.35 1don n ALA 48 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1don n LYS 49 N -2.52 3.22 -1.50 0.00 5.02 -1.26 -4.80 118.16 116.33 1don n LYS 49 Ca -0.15 -3.35 -0.52 0.00 -2.02 0.00 0.00 58.31 52.27 1don n LYS 49 Cb 0.51 -3.33 -0.07 0.00 -0.02 0.00 0.00 35.03 32.11 1don n LYS 49 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1don n GLU 50 N 7.22 1.12 -3.86 1.97 1.02 -1.26 -3.60 120.64 123.24 1don n GLU 50 Ca 0.46 0.34 -0.36 0.00 -0.02 0.00 0.00 57.16 57.58 1don n GLU 50 Cb 0.44 -2.37 -0.13 0.00 -0.02 0.00 0.00 31.44 29.35 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 6.40 3.23 0.15 -3.67 1.01 -0.95 -4.88 121.20 122.49 1don s ILE 51 Ca 1.07 -1.26 -0.31 0.00 0.00 0.00 0.00 60.65 60.14 1don s ILE 51 Cb -0.91 -2.83 -0.10 0.00 0.01 0.00 0.00 42.46 38.64 1don s ILE 51 CO 0.53 -0.10 1.58 0.00 0.00 0.00 0.00 174.94 176.95 1don s ALA 53 N 1.33 1.11 -0.16 0.00 0.00 -0.03 -1.46 121.76 122.55 1don s ALA 53 Ca 0.70 -0.55 -0.29 0.00 0.00 0.00 0.00 51.96 51.82 1don s ALA 53 Cb -0.43 -0.30 -0.05 0.00 0.00 0.00 0.00 23.12 22.33 1don s ALA 53 CO 0.31 0.26 2.04 0.34 0.00 0.00 0.00 175.76 178.71 1don s ASP 54 N -0.22 5.86 0.42 0.00 2.15 -1.26 -1.81 116.67 121.81 1don s ASP 54 Ca 0.03 2.01 0.29 0.00 0.43 0.00 0.00 52.55 55.32 1don s ASP 54 Cb -0.06 -2.52 1.47 0.00 -0.30 0.00 0.00 42.92 41.51 1don s ASP 54 CO -0.00 -1.62 1.89 1.55 -0.17 0.00 0.00 175.17 176.82 1don h PRO 55 N 13.19 0.00 -0.71 4.34 0.13 -1.90 -1.53 132.00 145.52 1don h PRO 55 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1don h PRO 55 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1don h PRO 55 CO 0.97 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.37 1don n LYS 56 N -2.57 2.81 -2.43 0.86 4.01 -1.26 -4.71 118.16 114.88 1don n LYS 56 Ca -0.01 -1.58 -0.23 0.00 -0.51 0.00 0.00 58.31 55.98 1don n LYS 56 Cb 0.12 -1.79 0.06 0.00 -0.51 0.00 0.00 35.03 32.91 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 -1.83 2.27 0.04 1.97 -1.52 -0.58 -5.00 119.66 115.01 1don s GLN 57 Ca 0.28 -0.58 0.23 0.00 -1.95 0.00 0.00 55.36 53.34 1don s GLN 57 Cb 0.20 -2.32 -0.01 0.00 -0.22 0.00 0.00 33.01 30.66 1don s GLN 57 CO 0.10 -1.04 0.97 1.17 -0.25 0.00 0.00 175.29 176.23 1don n LYS 58 N -2.67 0.28 -0.04 2.91 0.00 -1.26 -3.68 118.16 113.70 1don n LYS 58 Ca 0.09 -0.02 -0.04 0.00 0.00 0.00 0.00 58.31 58.34 1don n LYS 58 Cb 0.60 -1.57 -0.14 0.00 0.00 0.00 0.00 35.03 33.92 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 -1.92 0.38 0.30 5.64 4.27 -1.26 -3.92 117.44 120.93 1don n TRP 59 Ca 0.02 0.13 0.14 0.00 -3.89 0.00 0.00 57.50 53.90 1don n TRP 59 Cb 0.43 -0.96 0.39 0.00 -1.36 0.00 0.00 31.31 29.81 1don n TRP 59 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68 1don h VAL 60 N 0.00 0.00 -0.01 -1.67 2.07 -1.85 -1.81 116.25 112.97 1don h VAL 60 Ca -0.33 -0.72 -0.12 0.00 0.82 0.00 0.00 66.70 66.36 1don h VAL 60 Cb 1.84 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 33.30 1don h VAL 60 CO 0.04 0.00 -0.54 1.56 0.02 0.00 0.00 177.57 178.65 1don h GLN 61 N 0.00 0.03 0.00 1.57 4.20 -1.68 -0.07 115.11 119.16 1don h GLN 61 Ca 0.00 -0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 1don h GLN 61 Cb 0.76 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 1don h GLN 61 CO 0.00 0.56 -0.71 -0.44 -0.67 0.00 0.00 178.83 177.57 1don h ASP 62 N 0.02 0.00 0.43 1.46 3.32 -1.65 -3.25 116.42 116.75 1don h ASP 62 Ca -0.00 -0.48 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 1don h ASP 62 Cb 0.96 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.50 1don h ASP 62 CO 0.07 1.15 -0.36 0.28 -1.72 0.00 0.00 179.24 178.66 1don h SER 63 N -1.00 -0.94 0.00 6.45 0.02 -1.40 -1.06 113.55 115.62 1don h SER 63 Ca -0.17 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1don h SER 63 Cb 0.96 0.31 0.00 0.00 0.14 0.00 0.00 62.40 63.81 1don h SER 63 CO -0.10 -0.52 0.21 -0.03 -1.14 0.00 0.00 176.83 175.25 1don h MET 64 N -0.79 0.00 0.15 3.45 1.85 -1.20 0.45 114.93 118.85 1don h MET 64 Ca -0.04 0.00 -0.30 0.00 -0.61 0.00 0.00 59.70 58.75 1don h MET 64 Cb 0.68 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.72 1don h MET 64 CO -0.02 0.00 -1.43 0.22 -0.40 0.00 0.00 176.91 175.28 1don h ASP 65 N 0.00 0.50 0.54 1.39 1.82 -1.23 0.04 116.42 119.47 1don h ASP 65 Ca 0.00 -0.60 -0.13 0.00 -0.39 0.00 0.00 57.03 55.91 1don h ASP 65 Cb 0.42 -0.16 -0.02 0.00 0.68 0.00 0.00 39.33 40.25 1don h ASP 65 CO 0.00 1.48 -0.61 1.12 -1.61 0.00 0.00 179.24 179.63 1don h HIS 66 N 0.09 0.09 -0.06 0.28 2.07 -0.59 -1.63 115.15 115.39 1don h HIS 66 Ca -0.21 -0.03 -0.18 0.00 -2.85 0.00 0.00 60.37 57.10 1don h HIS 66 Cb 2.03 -0.02 -0.01 0.00 2.57 0.00 0.00 27.41 31.99 1don h HIS 66 CO 0.08 0.66 -0.72 -0.07 -3.07 0.00 0.00 177.93 174.81 1don h LEU 67 N 0.05 0.39 -0.77 6.12 3.38 -1.40 0.17 115.31 123.25 1don h LEU 67 Ca -0.01 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1don h LEU 67 Cb 1.09 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1don h LEU 67 CO 0.08 0.98 0.00 -0.67 0.09 0.00 0.00 178.44 178.93 1don n ASP 68 N -3.82 0.44 -2.70 -0.43 -0.08 -0.00 -2.36 116.55 107.59 1don n ASP 68 Ca -0.04 0.65 -0.00 0.00 -1.51 0.00 0.00 54.79 53.89 1don n ASP 68 Cb 0.70 -0.73 0.05 0.00 2.34 0.00 0.00 41.12 43.47 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 -2.03 1.66 -0.60 -0.67 2.85 -0.64 -4.83 118.16 113.90 1don n LYS 69 Ca 0.01 -3.42 0.08 0.00 -1.05 0.00 0.00 58.31 53.93 1don n LYS 69 Cb 0.11 -1.51 0.34 0.00 -0.65 0.00 0.00 35.03 33.32 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 3.64 -2.70 -1.58 1.13 0.51 -4.28 117.38 113.57 1don n GLN 70 Ca 0.08 -2.66 -0.01 0.00 -1.94 0.00 0.00 57.00 52.47 1don n GLN 70 Cb 0.83 -1.89 0.09 0.00 0.11 0.00 0.00 30.24 29.38 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 0.98 0.58 -2.65 5.09 5.66 -1.26 -4.94 114.28 117.74 1don n THR 71 Ca 0.24 -1.86 -0.10 0.00 -3.05 0.00 0.00 64.05 59.28 1don n THR 71 Cb 0.86 1.13 0.03 0.00 -1.55 0.00 0.00 70.33 70.81 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 -1.06 1.31 -0.04 1.09 6.02 -1.26 -4.91 117.38 118.54 1don n GLN 72 Ca -0.06 -3.34 -0.18 0.00 -0.01 0.00 0.00 57.00 53.41 1don n GLN 72 Cb 0.84 -1.32 -0.13 0.00 1.02 0.00 0.00 30.24 30.65 1don n GLN 72 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1don h THR 73 N 3.07 1.46 -1.65 5.09 2.02 -1.92 -3.47 112.91 117.51 1don h THR 73 Ca -0.07 -2.36 -0.08 0.00 0.77 0.00 0.00 66.41 64.66 1don h THR 73 Cb 1.17 3.03 0.05 0.00 -1.74 0.00 0.00 68.15 70.66 1don h THR 73 CO 0.51 0.59 -0.01 -0.81 0.37 0.00 0.00 175.52 176.17 1don n PRO 74 N -4.37 -2.12 -3.28 6.66 -0.05 -1.26 -5.08 135.00 125.50 1don n PRO 74 Ca -0.17 -0.35 0.03 0.00 -0.05 0.00 0.00 63.50 62.96 1don n PRO 74 Cb 0.65 -0.39 -0.02 0.00 -0.05 0.00 0.00 33.50 33.69 1don n PRO 74 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 175.50 175.60 1don s LYS 75 N -3.50 0.39 0.00 0.54 1.02 -1.26 -5.21 119.74 111.71 1don s LYS 75 Ca 0.15 0.81 0.27 0.00 0.02 0.00 0.00 55.97 57.22 1don s LYS 75 Cb -0.02 0.47 0.84 0.00 -0.52 0.00 0.00 37.83 38.59 1don s LYS 75 CO 0.12 -0.31 1.62 2.41 -0.92 0.00 0.00 175.35 178.28