#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 2.11 -0.39 -1.09 0.05 -1.26 -4.82 135.00 129.60 1don s PRO 2 Ca 0.00 1.08 -0.04 0.00 0.05 0.00 0.00 61.00 62.09 1don s PRO 2 Cb 0.00 -4.60 -0.02 0.00 0.05 0.00 0.00 34.50 29.93 1don s PRO 2 CO 0.00 -3.39 2.96 -3.47 0.05 0.00 0.00 177.00 173.16 1don n ASP 3 N 15.81 6.27 0.00 6.66 2.03 -1.26 -4.28 116.55 141.78 1don n ASP 3 Ca 0.36 -3.03 0.00 0.00 0.52 0.00 0.00 54.79 52.64 1don n ASP 3 Cb 0.52 -1.29 0.00 0.00 -0.72 0.00 0.00 41.12 39.64 1don n ASP 3 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1don n ALA 4 N 1.32 0.00 0.53 -1.67 0.00 -1.26 -5.02 120.51 114.41 1don n ALA 4 Ca 0.48 0.00 0.11 0.00 0.00 0.00 0.00 53.44 54.03 1don n ALA 4 Cb 0.62 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.04 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 0.12 -1.91 0.00 5.41 -1.26 -4.35 119.36 117.37 1don n ILE 5 Ca 0.00 -0.26 -0.40 0.00 1.00 0.00 0.00 62.75 63.10 1don n ILE 5 Cb 0.00 0.29 -0.01 0.00 -0.71 0.00 0.00 39.64 39.21 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 -1.96 8.12 -4.67 4.38 6.94 -1.26 -4.93 115.26 121.88 1don n ASN 6 Ca 0.01 -3.08 -0.35 0.00 -0.02 0.00 0.00 54.58 51.14 1don n ASN 6 Cb 0.45 -1.38 -0.09 0.00 -2.36 0.00 0.00 39.78 36.39 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 -0.80 3.36 -0.20 -2.53 0.00 -1.26 -5.04 121.76 115.29 1don s ALA 7 Ca 0.56 -0.77 -0.29 0.00 0.00 0.00 0.00 51.96 51.47 1don s ALA 7 Cb 0.19 -1.68 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 1don s ALA 7 CO -0.09 0.42 1.94 -2.14 0.00 0.00 0.00 175.76 175.89 1don s PRO 8 N -0.37 3.50 -0.42 0.00 0.02 -1.26 -4.93 135.00 131.55 1don s PRO 8 Ca 0.08 1.91 -0.12 0.00 0.02 0.00 0.00 61.00 62.89 1don s PRO 8 Cb -0.12 -4.22 0.05 0.00 0.02 0.00 0.00 34.50 30.23 1don s PRO 8 CO 0.02 -1.67 0.28 0.54 -0.33 0.00 0.00 177.00 175.84 1don s VAL 9 N 6.62 4.71 -0.25 3.83 0.11 -1.26 -5.02 120.40 129.15 1don s VAL 9 Ca 0.87 -1.05 -0.28 0.00 -2.93 0.00 0.00 61.98 58.59 1don s VAL 9 Cb -0.30 -3.75 -0.04 0.00 -1.53 0.00 0.00 36.38 30.75 1don s VAL 9 CO 0.34 -0.41 2.14 -0.89 -3.33 0.00 0.00 175.10 172.96 1don s THR 10 N 1.55 3.10 0.11 5.04 2.01 -1.26 -4.94 115.64 121.25 1don s THR 10 Ca 0.03 0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.16 1don s THR 10 Cb -0.22 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.12 1don s THR 10 CO 0.06 -0.08 -0.08 0.00 -0.69 0.00 0.00 174.62 173.82 1don n TYR 13 N -1.20 0.00 -4.01 0.00 0.18 -1.26 -4.43 117.16 106.44 1don n TYR 13 Ca -0.02 -0.17 -0.12 0.00 1.88 0.00 0.00 57.90 59.47 1don n TYR 13 Cb 0.63 -0.02 -0.03 0.00 -0.38 0.00 0.00 39.34 39.53 1don n TYR 13 CO 0.00 0.00 0.00 -0.80 -2.08 0.00 0.00 176.86 173.98 1don s ASN 14 N -0.45 0.45 -0.24 9.48 0.01 -1.26 -5.16 114.94 117.77 1don s ASN 14 Ca 0.01 -1.26 -0.07 0.00 -0.71 0.00 0.00 52.86 50.83 1don s ASN 14 Cb 0.01 0.68 0.11 0.00 0.41 0.00 0.00 41.25 42.47 1don s ASN 14 CO 0.00 -1.34 0.49 -0.36 -1.51 0.00 0.00 177.10 174.38 1don s PHE 15 N -3.17 -1.01 -0.77 2.20 0.08 -1.26 -4.69 117.98 109.37 1don s PHE 15 Ca 0.25 1.67 -0.24 0.00 0.12 0.00 0.00 56.93 58.72 1don s PHE 15 Cb -0.01 0.42 -0.17 0.00 -0.57 0.00 0.00 43.02 42.69 1don s PHE 15 CO 0.15 -0.59 2.44 -2.37 -0.10 0.00 0.00 175.22 174.75 1don n THR 16 N 5.41 -0.03 0.77 0.64 5.66 -0.38 -4.70 114.28 121.65 1don n THR 16 Ca -0.08 -0.49 0.05 0.00 -3.05 0.00 0.00 64.05 60.48 1don n THR 16 Cb 0.50 -1.61 0.16 0.00 -1.55 0.00 0.00 70.33 67.83 1don n THR 16 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1don n ASN 17 N 13.67 2.08 -4.77 1.09 0.23 -1.26 -4.60 115.26 121.70 1don n ASN 17 Ca 0.51 -2.07 -0.36 0.00 -0.53 0.00 0.00 54.58 52.13 1don n ASN 17 Cb 0.33 -0.29 -0.07 0.00 -2.08 0.00 0.00 39.78 37.67 1don n ASN 17 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1don s ARG 18 N -1.58 4.03 -0.81 -3.83 0.52 -1.26 -4.96 118.95 111.06 1don s ARG 18 Ca 0.24 -0.04 -0.22 0.00 -0.52 0.00 0.00 55.73 55.19 1don s ARG 18 Cb 0.13 -3.36 -0.19 0.00 0.52 0.00 0.00 34.95 32.06 1don s ARG 18 CO 0.14 0.41 2.38 1.63 0.02 0.00 0.00 175.30 179.88 1don n LYS 19 N 3.08 0.44 -2.82 3.54 5.02 -1.26 -4.85 118.16 121.31 1don n LYS 19 Ca -0.15 -0.41 -0.42 0.00 -2.02 0.00 0.00 58.31 55.31 1don n LYS 19 Cb 0.53 -2.75 -0.04 0.00 -0.02 0.00 0.00 35.03 32.75 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 10.03 4.81 0.41 -0.18 1.01 -1.26 -4.98 121.20 131.04 1don s ILE 20 Ca 1.08 1.72 -0.22 0.00 0.00 0.00 0.00 60.65 63.24 1don s ILE 20 Cb -0.43 -4.18 -0.14 0.00 0.01 0.00 0.00 42.46 37.72 1don s ILE 20 CO 0.28 -0.07 0.31 -0.24 0.00 0.00 0.00 174.94 175.22 1don n SER 21 N 5.81 -1.91 0.23 3.58 2.88 -1.26 -4.81 113.62 118.14 1don n SER 21 Ca 0.07 0.86 0.09 0.00 -1.33 0.00 0.00 58.87 58.56 1don n SER 21 Cb 0.48 -0.99 0.53 0.00 -0.75 0.00 0.00 64.21 63.48 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 0.54 0.72 0.00 2.46 3.04 -1.95 -0.98 116.25 120.07 1don h VAL 22 Ca -0.38 -0.97 -0.04 0.00 -1.01 0.00 0.00 66.70 64.30 1don h VAL 22 Cb 1.42 1.61 -0.01 0.00 -2.01 0.00 0.00 31.29 32.31 1don h VAL 22 CO 0.49 0.22 -0.20 0.06 -1.01 0.00 0.00 177.57 177.14 1don h GLN 23 N 0.00 0.00 -0.91 4.17 3.07 -2.02 -1.03 115.11 118.40 1don h GLN 23 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 1don h GLN 23 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.14 1don h GLN 23 CO 0.03 0.20 0.02 0.54 0.09 0.00 0.00 178.83 179.70 1don n ARG 24 N -3.61 1.92 -3.68 0.06 5.12 -0.37 -4.46 116.66 111.63 1don n ARG 24 Ca -0.01 -0.78 -0.29 0.00 -1.93 0.00 0.00 57.85 54.84 1don n ARG 24 Cb 0.33 -1.66 -0.12 0.00 -1.16 0.00 0.00 32.46 29.85 1don n ARG 24 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1don s LEU 25 N -0.70 2.80 0.44 0.55 1.43 -0.39 -3.89 118.68 118.91 1don s LEU 25 Ca 0.14 -2.91 0.30 0.00 -1.03 0.00 0.00 54.13 50.63 1don s LEU 25 Cb 0.11 -1.02 1.54 0.00 0.03 0.00 0.00 46.19 46.84 1don s LEU 25 CO 0.04 -0.22 1.91 0.00 0.23 0.00 0.00 176.35 178.31 1don h ALA 26 N 6.31 1.00 -2.06 4.21 0.00 0.14 -3.46 119.26 125.41 1don h ALA 26 Ca 0.07 0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.20 1don h ALA 26 Cb 0.89 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1don h ALA 26 CO 0.50 0.00 0.62 -1.13 0.00 0.00 0.00 179.25 179.23 1don n SER 27 N -2.58 -1.07 -3.72 0.00 3.41 -0.24 -4.97 113.62 104.45 1don n SER 27 Ca -0.01 -1.37 -0.14 0.00 -0.26 0.00 0.00 58.87 57.09 1don n SER 27 Cb 0.10 1.69 -0.09 0.00 -0.26 0.00 0.00 64.21 65.65 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 -2.51 -0.35 -0.40 7.33 6.14 -1.25 -1.62 117.35 124.68 1don s TYR 28 Ca 0.21 0.72 0.03 0.00 0.64 0.00 0.00 57.07 58.68 1don s TYR 28 Cb -0.01 0.16 0.16 0.00 0.42 0.00 0.00 41.96 42.69 1don s TYR 28 CO 0.01 -0.35 0.36 1.03 0.64 0.00 0.00 175.55 177.25 1don s ARG 29 N -0.68 0.79 -0.22 4.97 0.52 0.19 -4.88 118.95 119.64 1don s ARG 29 Ca -0.08 -1.58 -0.40 0.00 -0.52 0.00 0.00 55.73 53.16 1don s ARG 29 Cb -0.04 -1.10 -0.16 0.00 0.52 0.00 0.00 34.95 34.18 1don s ARG 29 CO 0.03 -1.31 1.67 -2.13 0.02 0.00 0.00 175.30 173.59 1don n ARG 30 N 3.39 1.12 -3.14 3.54 0.63 -1.26 -1.82 116.66 119.11 1don n ARG 30 Ca 0.21 0.41 -0.41 0.00 -0.92 0.00 0.00 57.85 57.14 1don n ARG 30 Cb 0.46 -2.08 -0.07 0.00 0.45 0.00 0.00 32.46 31.22 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 2.98 4.97 -0.35 5.15 1.01 -0.53 -4.87 121.20 129.56 1don s ILE 31 Ca 0.96 0.87 0.13 0.00 0.00 0.00 0.00 60.65 62.61 1don s ILE 31 Cb -1.06 -3.96 0.42 0.00 0.01 0.00 0.00 42.46 37.87 1don s ILE 31 CO 0.63 -0.08 1.36 0.35 0.00 0.00 0.00 174.94 177.20 1don n THR 32 N 5.33 0.25 0.00 2.92 -2.24 -1.26 -2.89 114.28 116.39 1don n THR 32 Ca -0.02 -1.64 0.00 0.00 -2.27 0.00 0.00 64.05 60.13 1don n THR 32 Cb 0.49 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 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 -0.91 0.00 0.11 3.42 2.88 -1.26 -4.95 113.62 112.91 1don n SER 33 Ca -0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 1don n SER 33 Cb 0.85 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.31 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 -0.00 -0.73 -2.19 -3.46 7.64 -1.26 -4.93 113.62 108.68 1don n SER 34 Ca 0.00 0.40 -0.29 0.00 1.01 0.00 0.00 58.87 59.99 1don n SER 34 Cb 0.00 0.84 0.05 0.00 -1.01 0.00 0.00 64.21 64.08 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 -3.17 3.19 -2.16 1.43 4.76 -1.26 -5.00 118.16 115.95 1don n LYS 35 Ca 0.00 -3.78 -0.42 0.00 -2.87 0.00 0.00 58.31 51.24 1don n LYS 35 Cb 0.00 -2.28 -0.03 0.00 -1.84 0.00 0.00 35.03 30.88 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 8.51 0.00 -2.49 0.00 0.11 -1.95 -3.39 132.00 132.80 1don h PRO 37 Ca -0.37 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.66 1don h PRO 37 Cb 1.17 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.02 1don h PRO 37 CO 0.93 0.00 -0.26 0.15 -0.21 0.00 0.00 178.00 178.61 1don s LYS 38 N -4.93 0.43 1.49 1.05 1.02 -1.26 -5.10 119.74 112.43 1don s LYS 38 Ca -0.05 0.94 -0.25 0.00 0.02 0.00 0.00 55.97 56.63 1don s LYS 38 Cb 0.21 0.12 0.39 0.00 -0.52 0.00 0.00 37.83 38.03 1don s LYS 38 CO 0.76 -0.18 0.87 0.39 -0.92 0.00 0.00 175.35 176.27 1don n GLU 39 N 4.59 -4.91 -3.04 1.68 4.71 -1.26 -4.14 120.64 118.27 1don n GLU 39 Ca -0.19 -1.46 0.00 0.00 -0.01 0.00 0.00 57.16 55.50 1don n GLU 39 Cb 0.54 -1.92 0.00 0.00 -1.01 0.00 0.00 31.44 29.05 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 -5.86 0.00 -3.61 0.62 0.00 -1.14 -4.81 120.51 105.71 1don n ALA 40 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.31 1don n ALA 40 Cb 0.60 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.89 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 -0.08 -1.02 0.00 1.01 -1.02 -1.45 120.40 114.84 1don s VAL 41 Ca 0.00 -0.21 -0.23 0.00 0.00 0.00 0.00 61.98 61.54 1don s VAL 41 Cb 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 36.38 35.78 1don s VAL 41 CO 0.00 -0.31 1.71 -0.63 0.00 0.00 0.00 175.10 175.86 1don s ILE 42 N 2.13 3.73 -1.29 2.22 1.01 -0.76 -1.08 121.20 127.16 1don s ILE 42 Ca 0.03 -0.73 -0.18 0.00 0.00 0.00 0.00 60.65 59.76 1don s ILE 42 Cb -0.16 -4.63 0.05 0.00 0.01 0.00 0.00 42.46 37.73 1don s ILE 42 CO -0.11 -1.49 1.80 0.49 0.00 0.00 0.00 174.94 175.63 1don n PHE 43 N 11.25 4.34 -1.54 3.97 3.72 -0.62 -0.64 117.46 137.94 1don n PHE 43 Ca 0.38 -2.68 -0.39 0.00 -0.05 0.00 0.00 57.45 54.71 1don n PHE 43 Cb 0.49 -2.62 -0.06 0.00 -0.94 0.00 0.00 39.48 36.35 1don n PHE 43 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1don n LYS 44 N 8.21 0.95 0.00 -1.08 5.02 -0.64 -2.85 118.16 127.77 1don n LYS 44 Ca 0.49 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 1don n LYS 44 Cb 0.46 -2.99 0.00 0.00 -0.02 0.00 0.00 35.03 32.47 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 7.82 0.00 -0.04 -0.18 -2.24 -1.23 0.12 114.28 118.53 1don n THR 45 Ca 0.42 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 62.13 1don n THR 45 Cb 0.42 -0.05 -0.14 0.00 -2.10 0.00 0.00 70.33 68.46 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 -0.26 1.39 0.54 2.28 -0.00 -1.25 -2.16 119.36 119.89 1don n ILE 46 Ca 0.00 -0.79 0.04 0.00 -0.00 0.00 0.00 62.75 62.01 1don n ILE 46 Cb 0.00 -0.74 0.17 0.00 -0.00 0.00 0.00 39.64 39.07 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 -2.88 0.85 -1.20 7.28 3.14 -1.26 -4.84 118.33 119.43 1don n VAL 47 Ca -0.21 -0.54 -0.07 0.00 -2.96 0.00 0.00 64.34 60.56 1don n VAL 47 Cb 1.03 -0.09 -0.03 0.00 -1.06 0.00 0.00 33.84 33.69 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 0.38 -0.10 -2.61 1.55 0.00 -1.25 -4.91 120.51 113.58 1don n ALA 48 Ca 0.12 0.11 -0.43 0.00 0.00 0.00 0.00 53.44 53.24 1don n ALA 48 Cb 0.48 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.88 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 -2.32 3.21 -1.63 0.00 4.81 -1.26 -4.76 118.16 116.22 1don n LYS 49 Ca -0.07 -3.33 -0.54 0.00 -0.87 0.00 0.00 58.31 53.50 1don n LYS 49 Cb 0.28 -3.45 -0.07 0.00 0.02 0.00 0.00 35.03 31.82 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 8.06 1.35 -3.99 1.64 1.02 -1.26 -3.52 120.64 123.93 1don n GLU 50 Ca 0.48 0.47 -0.33 0.00 -0.02 0.00 0.00 57.16 57.75 1don n GLU 50 Cb 0.46 -2.31 -0.14 0.00 -0.02 0.00 0.00 31.44 29.42 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 4.75 2.51 0.20 -3.67 1.01 -1.13 -4.87 121.20 120.00 1don s ILE 51 Ca 1.01 -1.69 -0.31 0.00 0.00 0.00 0.00 60.65 59.66 1don s ILE 51 Cb -0.94 -2.54 -0.10 0.00 0.01 0.00 0.00 42.46 38.89 1don s ILE 51 CO 0.58 -0.18 1.57 0.00 0.00 0.00 0.00 174.94 176.92 1don s ALA 53 N 0.83 1.27 -0.14 0.00 0.00 -0.24 -1.25 121.76 122.23 1don s ALA 53 Ca 0.68 -0.64 -0.29 0.00 0.00 0.00 0.00 51.96 51.71 1don s ALA 53 Cb -0.45 -0.33 -0.06 0.00 0.00 0.00 0.00 23.12 22.28 1don s ALA 53 CO 0.35 0.30 2.12 0.34 0.00 0.00 0.00 175.76 178.87 1don s ASP 54 N -0.31 5.80 0.33 0.00 2.15 -1.26 -2.44 116.67 120.94 1don s ASP 54 Ca 0.05 2.14 0.24 0.00 0.43 0.00 0.00 52.55 55.40 1don s ASP 54 Cb -0.06 -2.52 1.20 0.00 -0.30 0.00 0.00 42.92 41.23 1don s ASP 54 CO -0.00 -1.65 1.73 1.55 -0.17 0.00 0.00 175.17 176.63 1don h PRO 55 N 13.49 0.00 -0.33 4.34 0.13 -1.92 -1.57 132.00 146.14 1don h PRO 55 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1don h PRO 55 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1don h PRO 55 CO 0.96 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.36 1don n LYS 56 N -2.33 1.61 -2.55 0.86 5.02 -1.26 -4.75 118.16 114.76 1don n LYS 56 Ca -0.00 -0.80 -0.24 0.00 -2.02 0.00 0.00 58.31 55.25 1don n LYS 56 Cb 0.10 -1.26 0.04 0.00 -0.02 0.00 0.00 35.03 33.89 1don n LYS 56 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1don s GLN 57 N -1.68 2.68 0.05 1.97 1.11 -0.59 -5.00 119.66 118.21 1don s GLN 57 Ca 0.15 -0.39 0.23 0.00 0.01 0.00 0.00 55.36 55.35 1don s GLN 57 Cb 0.08 -2.38 0.10 0.00 -1.01 0.00 0.00 33.01 29.81 1don s GLN 57 CO 0.09 -0.73 1.08 1.17 0.01 0.00 0.00 175.29 176.91 1don n LYS 58 N -2.48 0.26 0.01 2.91 0.00 -1.26 -3.75 118.16 113.86 1don n LYS 58 Ca 0.06 0.01 0.03 0.00 0.00 0.00 0.00 58.31 58.40 1don n LYS 58 Cb 0.59 -1.59 -0.10 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 -1.93 0.61 0.98 5.64 4.27 -1.26 -3.75 117.44 122.00 1don n TRP 59 Ca 0.02 0.20 0.14 0.00 -3.89 0.00 0.00 57.50 53.97 1don n TRP 59 Cb 0.43 -0.93 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 -2.70 0.03 0.08 -1.67 0.31 -1.26 -2.45 118.33 110.68 1don n VAL 60 Ca -0.11 -0.01 -0.00 0.00 -0.01 0.00 0.00 64.34 64.21 1don n VAL 60 Cb 0.79 -0.44 -0.04 0.00 -0.91 0.00 0.00 33.84 33.24 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 0.10 5.55 4.20 -1.65 -0.72 115.11 122.59 1don h GLN 61 Ca 0.00 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.42 1don h GLN 61 Cb 0.51 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1don h GLN 61 CO 0.00 0.51 -1.48 0.22 -0.67 0.00 0.00 178.83 177.42 1don h ASP 62 N 0.00 0.33 0.03 1.46 1.82 -1.66 -3.22 116.42 115.18 1don h ASP 62 Ca -0.07 -0.45 -0.00 0.00 -0.39 0.00 0.00 57.03 56.12 1don h ASP 62 Cb 1.55 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 41.45 1don h ASP 62 CO 0.07 1.37 -0.01 0.28 -1.61 0.00 0.00 179.24 179.34 1don h SER 63 N 0.06 -0.03 -1.07 2.28 0.02 -1.55 -2.29 113.55 110.97 1don h SER 63 Ca -0.22 -0.69 0.30 0.00 -0.84 0.00 0.00 61.79 60.34 1don h SER 63 Cb 1.99 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 64.48 1don h SER 63 CO 0.16 0.77 0.75 0.24 -1.14 0.00 0.00 176.83 177.60 1don h MET 64 N -0.92 0.11 0.14 3.45 2.86 -1.29 0.38 114.93 119.66 1don h MET 64 Ca -0.00 -0.01 -0.30 0.00 -2.06 0.00 0.00 59.70 57.33 1don h MET 64 Cb 0.72 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.36 1don h MET 64 CO 0.01 0.07 -1.43 -0.44 1.06 0.00 0.00 176.91 176.18 1don h ASP 65 N 0.11 0.46 0.16 1.22 3.32 -1.58 0.30 116.42 120.41 1don h ASP 65 Ca 0.54 -0.56 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 1don h ASP 65 Cb 1.91 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 41.31 1don h ASP 65 CO -0.09 1.45 -0.11 -0.74 -1.72 0.00 0.00 179.24 178.04 1don h HIS 66 N 0.08 0.00 0.00 4.55 2.76 0.29 -1.77 115.15 121.06 1don h HIS 66 Ca -0.21 0.00 -0.23 0.00 -2.20 0.00 0.00 60.37 57.73 1don h HIS 66 Cb 2.02 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.94 1don h HIS 66 CO 0.07 0.11 -1.90 1.28 -1.30 0.00 0.00 177.93 176.19 1don n LEU 67 N -4.12 0.41 0.21 0.26 4.77 -0.37 -3.43 117.00 114.73 1don n LEU 67 Ca -0.02 0.19 0.15 0.00 -0.03 0.00 0.00 56.01 56.29 1don n LEU 67 Cb 0.19 0.23 0.73 0.00 -2.33 0.00 0.00 43.42 42.23 1don n LEU 67 CO 0.33 0.28 0.94 -0.78 -1.33 0.00 0.00 177.39 176.83 1don h ASP 68 N 0.00 0.00 -0.29 -1.43 1.82 -0.10 -1.96 116.42 114.46 1don h ASP 68 Ca -0.29 0.00 -0.24 0.00 -0.39 0.00 0.00 57.03 56.11 1don h ASP 68 Cb 1.79 0.00 -0.26 0.00 0.68 0.00 0.00 39.33 41.53 1don h ASP 68 CO 0.04 0.00 -0.79 2.29 -1.61 0.00 0.00 179.24 179.16 1don n LYS 69 N -2.54 1.92 -2.69 0.28 2.85 -0.81 -4.73 118.16 112.45 1don n LYS 69 Ca -0.01 -3.35 -0.00 0.00 -1.05 0.00 0.00 58.31 53.90 1don n LYS 69 Cb 0.12 -1.51 0.07 0.00 -0.65 0.00 0.00 35.03 33.06 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 -0.61 1.51 -2.61 -1.58 1.13 -0.74 -4.89 117.38 109.59 1don n GLN 70 Ca 0.22 -2.77 -0.01 0.00 -1.94 0.00 0.00 57.00 52.50 1don n GLN 70 Cb 0.88 -0.94 0.08 0.00 0.11 0.00 0.00 30.24 30.36 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 -0.78 0.56 -4.36 5.09 5.66 -1.25 -4.95 114.28 114.24 1don n THR 71 Ca -0.00 -1.80 -0.22 0.00 -3.05 0.00 0.00 64.05 58.98 1don n THR 71 Cb 0.84 1.11 -0.16 0.00 -1.55 0.00 0.00 70.33 70.57 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 -1.63 1.18 -0.82 1.09 -0.21 -1.26 -5.08 119.66 112.94 1don s GLN 72 Ca 0.18 -0.25 -0.01 0.00 0.02 0.00 0.00 55.36 55.30 1don s GLN 72 Cb 0.37 -1.06 0.20 0.00 1.00 0.00 0.00 33.01 33.52 1don s GLN 72 CO -0.09 -0.01 0.68 -0.08 -2.12 0.00 0.00 175.29 173.67 1don s THR 73 N 0.70 4.03 -0.48 -0.19 -1.32 -1.26 -5.03 115.64 112.10 1don s THR 73 Ca -0.12 -3.78 -0.26 0.00 -1.21 0.00 0.00 61.69 56.32 1don s THR 73 Cb -0.14 -3.54 -0.07 0.00 -1.51 0.00 0.00 72.50 67.24 1don s THR 73 CO 0.02 -1.04 2.41 -2.65 -2.21 0.00 0.00 174.62 171.15 1don n PRO 74 N 2.47 1.08 -3.51 7.08 -0.01 -1.26 -4.89 135.00 135.96 1don n PRO 74 Ca 0.19 0.03 -0.42 0.00 -0.01 0.00 0.00 63.50 63.29 1don n PRO 74 Cb 0.37 -3.40 -0.05 0.00 -0.01 0.00 0.00 33.50 30.41 1don n PRO 74 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 175.50 175.70 1don s LYS 75 N 8.17 3.19 0.00 -0.52 2.20 -1.26 -5.33 119.74 126.19 1don s LYS 75 Ca 0.99 -2.58 0.27 0.00 -0.36 0.00 0.00 55.97 54.29 1don s LYS 75 Cb -0.21 -4.12 0.80 0.00 -1.51 0.00 0.00 37.83 32.79 1don s LYS 75 CO 0.27 -1.24 1.60 0.25 -0.36 0.00 0.00 175.35 175.88