#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfa n ASN 56 N 0.00 0.17 -3.88 -3.46 5.15 -1.26 -4.77 115.26 107.21 1rfa n ASN 56 Ca 0.00 -1.93 -0.14 0.00 -0.60 0.00 0.00 54.58 51.92 1rfa n ASN 56 Cb 0.00 -0.07 -0.14 0.00 -0.53 0.00 0.00 39.78 39.03 1rfa n ASN 56 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1rfa s THR 57 N 0.00 0.13 0.04 -0.44 -4.23 -1.26 -2.91 115.64 106.97 1rfa s THR 57 Ca 0.17 -0.04 0.01 0.00 -1.18 0.00 0.00 61.69 60.64 1rfa s THR 57 Cb 0.19 -0.14 -0.03 0.00 1.34 0.00 0.00 72.50 73.87 1rfa s THR 57 CO -0.08 0.05 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.37 1rfa s ILE 58 N 0.13 0.31 0.19 2.99 1.01 0.47 -0.90 121.20 125.40 1rfa s ILE 58 Ca -0.01 -1.27 0.05 0.00 0.00 0.00 0.00 60.65 59.42 1rfa s ILE 58 Cb -0.03 -0.79 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 1rfa s ILE 58 CO -0.00 -0.63 0.22 -0.13 0.00 0.00 0.00 174.94 174.40 1rfa s ARG 59 N -2.31 3.12 -0.15 2.79 3.00 -1.07 -0.21 118.95 124.12 1rfa s ARG 59 Ca -0.06 -0.82 -0.01 0.00 0.00 0.00 0.00 55.73 54.83 1rfa s ARG 59 Cb -0.04 -2.75 0.04 0.00 0.00 0.00 0.00 34.95 32.21 1rfa s ARG 59 CO -0.03 0.47 -0.02 0.08 0.00 0.00 0.00 175.30 175.80 1rfa s VAL 60 N -1.87 0.79 -0.01 3.52 1.01 0.47 0.10 120.40 124.42 1rfa s VAL 60 Ca 0.33 -0.46 -0.06 0.00 0.00 0.00 0.00 61.98 61.79 1rfa s VAL 60 Cb -0.10 -1.06 -0.05 0.00 0.00 0.00 0.00 36.38 35.18 1rfa s VAL 60 CO 0.26 0.05 0.25 -0.36 0.00 0.00 0.00 175.10 175.30 1rfa s PHE 61 N 1.77 3.58 0.56 5.22 0.40 0.12 -1.35 117.98 128.27 1rfa s PHE 61 Ca 0.01 0.54 0.01 0.00 -0.60 0.00 0.00 56.93 56.89 1rfa s PHE 61 Cb -0.15 -1.96 0.03 0.00 0.51 0.00 0.00 43.02 41.45 1rfa s PHE 61 CO -0.07 0.63 0.79 -0.51 0.70 0.00 0.00 175.22 176.75 1rfa s LEU 62 N -1.72 3.25 0.04 -0.37 2.01 0.20 -0.98 118.68 121.11 1rfa s LEU 62 Ca 0.26 0.01 0.27 0.00 0.01 0.00 0.00 54.13 54.69 1rfa s LEU 62 Cb -0.13 -2.88 0.91 0.00 0.01 0.00 0.00 46.19 44.10 1rfa s LEU 62 CO 0.15 -1.16 1.72 -2.65 1.01 0.00 0.00 176.35 175.43 1rfa n PRO 63 N -2.37 0.06 -0.83 1.29 -0.02 -1.20 -1.47 135.00 130.46 1rfa n PRO 63 Ca 0.08 0.04 -0.11 0.00 -2.02 0.00 0.00 63.50 61.49 1rfa n PRO 63 Cb 0.60 -1.56 0.18 0.00 -0.02 0.00 0.00 33.50 32.70 1rfa n PRO 63 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1rfa n ASN 64 N -1.66 3.82 0.00 2.55 6.94 -1.26 -4.84 115.26 120.81 1rfa n ASN 64 Ca 0.06 -3.03 0.00 0.00 -0.02 0.00 0.00 54.58 51.59 1rfa n ASN 64 Cb 0.36 -0.72 0.00 0.00 -2.36 0.00 0.00 39.78 37.06 1rfa n ASN 64 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1rfa n LYS 65 N -0.37 0.00 -1.16 -3.83 4.76 -0.54 -4.97 118.16 112.05 1rfa n LYS 65 Ca 0.37 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.68 1rfa n LYS 65 Cb 1.24 -2.13 0.09 0.00 -1.84 0.00 0.00 35.03 32.39 1rfa n LYS 65 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1rfa n GLN 66 N -2.04 -0.31 -3.78 1.97 1.13 -1.24 -4.64 117.38 108.46 1rfa n GLN 66 Ca 0.00 -1.12 -0.08 0.00 -1.94 0.00 0.00 57.00 53.86 1rfa n GLN 66 Cb 0.00 -0.55 -0.02 0.00 0.11 0.00 0.00 30.24 29.78 1rfa n GLN 66 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 1rfa s ARG 67 N -4.17 1.68 -0.03 -1.09 3.03 -1.25 0.62 118.95 117.74 1rfa s ARG 67 Ca 0.35 -0.90 -0.31 0.00 2.03 0.00 0.00 55.73 56.91 1rfa s ARG 67 Cb -0.01 0.60 0.12 0.00 -1.03 0.00 0.00 34.95 34.63 1rfa s ARG 67 CO 0.24 -0.76 1.27 -0.08 -1.13 0.00 0.00 175.30 174.84 1rfa s THR 68 N -3.89 0.00 -0.03 4.99 -1.32 -0.46 -4.90 115.64 110.03 1rfa s THR 68 Ca 0.09 -0.22 0.08 0.00 -1.21 0.00 0.00 61.69 60.43 1rfa s THR 68 Cb -0.05 -1.91 -0.02 0.00 -1.51 0.00 0.00 72.50 69.02 1rfa s THR 68 CO 0.03 0.00 -0.25 -0.69 -2.21 0.00 0.00 174.62 171.50 1rfa s VAL 69 N -2.45 2.02 0.15 5.08 1.01 -1.26 -0.39 120.40 124.55 1rfa s VAL 69 Ca 0.14 -1.08 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1rfa s VAL 69 Cb 0.04 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 1rfa s VAL 69 CO -0.04 0.57 0.03 0.68 0.00 0.00 0.00 175.10 176.35 1rfa s VAL 70 N -0.52 0.36 0.20 2.92 -7.23 0.71 -4.96 120.40 111.88 1rfa s VAL 70 Ca 0.07 -1.94 0.05 0.00 -1.81 0.00 0.00 61.98 58.35 1rfa s VAL 70 Cb -0.11 -2.09 -0.05 0.00 0.56 0.00 0.00 36.38 34.70 1rfa s VAL 70 CO -0.00 -0.46 -0.07 0.54 -0.31 0.00 0.00 175.10 174.79 1rfa s ASN 71 N -3.11 2.05 -0.16 4.85 4.22 -1.26 -0.40 114.94 121.13 1rfa s ASN 71 Ca 0.24 -1.10 -0.09 0.00 -2.14 0.00 0.00 52.86 49.78 1rfa s ASN 71 Cb 0.07 -0.04 -0.05 0.00 1.28 0.00 0.00 41.25 42.51 1rfa s ASN 71 CO 0.03 -0.36 0.15 -0.69 -2.04 0.00 0.00 177.10 174.19 1rfa s VAL 72 N -3.26 5.44 0.00 3.54 1.01 -1.15 -4.97 120.40 121.02 1rfa s VAL 72 Ca 0.23 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.44 1rfa s VAL 72 Cb 0.03 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.96 1rfa s VAL 72 CO 0.05 0.52 0.00 -1.14 0.00 0.00 0.00 175.10 174.54 1rfa n ARG 73 N 2.77 0.00 -2.14 2.72 3.00 -1.26 -4.85 116.66 116.90 1rfa n ARG 73 Ca -0.18 0.00 -0.40 0.00 -0.00 0.00 0.00 57.85 57.27 1rfa n ARG 73 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.99 1rfa n ARG 73 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1rfa n ASN 74 N 0.00 7.89 -0.06 6.15 4.13 -1.26 -4.32 115.26 127.79 1rfa n ASN 74 Ca 0.00 -3.27 0.00 0.00 1.68 0.00 0.00 54.58 52.99 1rfa n ASN 74 Cb 0.00 -1.31 0.00 0.00 -1.54 0.00 0.00 39.78 36.93 1rfa n ASN 74 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1rfa n GLY 75 N 1.29 0.79 3.87 7.41 0.00 -1.26 -5.08 105.19 112.20 1rfa n GLY 75 Ca 0.59 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1rfa n GLY 75 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rfa s MET 76 N -1.20 3.70 0.57 1.61 -1.94 -1.26 -5.07 119.30 115.70 1rfa s MET 76 Ca 0.00 0.61 0.08 0.00 -1.71 0.00 0.00 55.69 54.68 1rfa s MET 76 Cb 0.00 -2.22 0.07 0.00 2.01 0.00 0.00 34.83 34.69 1rfa s MET 76 CO 0.00 -0.31 0.68 -1.12 -0.01 0.00 0.00 175.02 174.26 1rfa s SER 77 N -3.71 4.95 0.12 3.03 0.01 -1.26 -4.32 113.70 112.52 1rfa s SER 77 Ca 0.53 -0.98 -0.26 0.00 1.31 0.00 0.00 55.95 56.55 1rfa s SER 77 Cb -0.10 0.36 -0.07 0.00 0.21 0.00 0.00 66.02 66.42 1rfa s SER 77 CO 0.42 -1.29 1.64 -0.07 0.41 0.00 0.00 173.24 174.35 1rfa h LEU 78 N 0.33 -0.73 0.31 2.44 -0.00 -1.17 1.01 115.31 117.50 1rfa h LEU 78 Ca -0.32 0.09 -0.01 0.00 -0.00 0.00 0.00 57.88 57.65 1rfa h LEU 78 Cb 1.29 0.29 -0.01 0.00 -0.00 0.00 0.00 40.66 42.23 1rfa h LEU 78 CO 0.45 -0.33 -0.24 0.45 -0.00 0.00 0.00 178.44 178.78 1rfa h HIS 79 N -0.42 -0.62 0.00 1.13 3.86 -0.98 0.88 115.15 118.99 1rfa h HIS 79 Ca 0.05 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1rfa h HIS 79 Cb 0.48 0.23 -0.00 0.00 1.06 0.00 0.00 27.41 29.18 1rfa h HIS 79 CO -0.26 -0.36 -0.11 -0.44 0.86 0.00 0.00 177.93 177.62 1rfa h ASP 80 N -0.55 0.00 0.30 2.45 3.32 -1.75 0.95 116.42 121.13 1rfa h ASP 80 Ca -0.02 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.70 1rfa h ASP 80 Cb 0.48 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.07 1rfa h ASP 80 CO -0.00 0.11 -1.44 0.00 -1.72 0.00 0.00 179.24 176.19 1rfa n LEU 82 N -3.70 2.10 0.20 0.00 7.99 0.30 -3.27 117.00 120.60 1rfa n LEU 82 Ca -0.16 0.11 0.18 0.00 -0.01 0.00 0.00 56.01 56.14 1rfa n LEU 82 Cb 1.09 -0.63 0.80 0.00 -0.11 0.00 0.00 43.42 44.57 1rfa n LEU 82 CO 0.60 0.76 1.16 -0.03 -1.51 0.00 0.00 177.39 178.36 1rfa h MET 83 N 0.03 0.00 0.12 3.23 4.05 0.76 0.86 114.93 123.98 1rfa h MET 83 Ca -0.46 0.00 -0.28 0.00 -0.28 0.00 0.00 59.70 58.67 1rfa h MET 83 Cb 2.02 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.82 1rfa h MET 83 CO 0.03 0.00 -1.33 -0.22 0.23 0.00 0.00 176.91 175.61 1rfa h LYS 84 N 0.00 0.25 0.00 0.39 3.64 -1.61 0.14 116.57 119.39 1rfa h LYS 84 Ca 0.11 -0.43 -0.19 0.00 -1.27 0.00 0.00 60.65 58.87 1rfa h LYS 84 Cb 0.80 0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.75 1rfa h LYS 84 CO -0.00 1.17 -0.90 0.00 -2.27 0.00 0.00 179.45 177.44 1rfa h ALA 85 N 0.58 0.51 0.00 5.00 0.00 0.45 -3.06 119.26 122.73 1rfa h ALA 85 Ca -0.17 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 53.93 1rfa h ALA 85 Cb 1.98 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1rfa h ALA 85 CO 0.19 1.11 -1.64 1.28 0.00 0.00 0.00 179.25 180.19 1rfa n LEU 86 N -3.48 0.36 -0.04 0.00 4.77 0.18 -3.69 117.00 115.10 1rfa n LEU 86 Ca -0.01 -0.18 -0.09 0.00 -0.03 0.00 0.00 56.01 55.70 1rfa n LEU 86 Cb 0.85 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.92 1rfa n LEU 86 CO 0.46 0.09 0.92 0.50 -1.33 0.00 0.00 177.39 178.02 1rfa h LYS 87 N 0.00 0.17 0.00 3.23 3.11 -0.69 1.39 116.57 123.78 1rfa h LYS 87 Ca 0.00 -0.01 -0.05 0.00 -2.81 0.00 0.00 60.65 57.78 1rfa h LYS 87 Cb 0.82 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 32.00 1rfa h LYS 87 CO 0.00 0.11 -0.24 -0.24 -2.81 0.00 0.00 179.45 176.28 1rfa h VAL 88 N 0.18 0.93 0.14 2.00 3.04 -1.64 -2.20 116.25 118.69 1rfa h VAL 88 Ca 0.08 -0.89 -0.23 0.00 -1.01 0.00 0.00 66.70 64.66 1rfa h VAL 88 Cb 0.04 1.51 0.01 0.00 -2.01 0.00 0.00 31.29 30.85 1rfa h VAL 88 CO -0.08 0.23 -1.06 0.03 -1.01 0.00 0.00 177.57 175.69 1rfa h ARG 89 N 0.00 0.29 0.00 4.17 2.47 -1.52 -3.48 114.38 116.32 1rfa h ARG 89 Ca -0.00 -0.50 0.00 0.00 -1.26 0.00 0.00 59.98 58.21 1rfa h ARG 89 Cb 0.50 0.19 0.00 0.00 -1.65 0.00 0.00 29.97 29.00 1rfa h ARG 89 CO 0.03 1.24 0.00 0.41 0.56 0.00 0.00 179.97 182.21 1rfa n GLY 90 N 1.69 1.49 3.87 0.04 0.00 0.42 -5.09 105.19 107.61 1rfa n GLY 90 Ca -0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 1rfa n GLY 90 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rfa s LEU 91 N 0.00 3.09 -0.11 0.99 2.01 0.22 -5.00 118.68 119.87 1rfa s LEU 91 Ca 0.00 -0.98 -0.00 0.00 0.01 0.00 0.00 54.13 53.15 1rfa s LEU 91 Cb 0.00 -1.63 -0.02 0.00 0.01 0.00 0.00 46.19 44.55 1rfa s LEU 91 CO 0.00 -0.83 -0.09 -1.10 1.01 0.00 0.00 176.35 175.34 1rfa s GLN 92 N -4.17 3.17 -0.14 1.70 -1.52 -1.26 -4.60 119.66 112.84 1rfa s GLN 92 Ca 0.43 -0.60 0.19 0.00 -1.95 0.00 0.00 55.36 53.42 1rfa s GLN 92 Cb -0.02 -2.66 -0.27 0.00 -0.22 0.00 0.00 33.01 29.84 1rfa s GLN 92 CO 0.25 0.40 0.22 -2.30 -0.25 0.00 0.00 175.29 173.61 1rfa n PRO 93 N 3.01 0.68 0.00 2.91 -0.02 -1.26 -4.02 135.00 136.30 1rfa n PRO 93 Ca -0.18 -0.05 0.11 0.00 -2.02 0.00 0.00 63.50 61.37 1rfa n PRO 93 Cb 0.53 -1.54 0.52 0.00 -0.02 0.00 0.00 33.50 32.99 1rfa n PRO 93 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1rfa n GLU 94 N -2.63 0.14 -0.47 -0.52 -0.58 -1.26 -0.93 120.64 114.39 1rfa n GLU 94 Ca -0.24 0.09 0.10 0.00 -0.42 0.00 0.00 57.16 56.69 1rfa n GLU 94 Cb 0.99 -1.50 0.32 0.00 -0.57 0.00 0.00 31.44 30.67 1rfa n GLU 94 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1rfa s ALA 97 N -3.81 2.33 0.17 0.00 0.00 0.66 -4.58 121.76 116.53 1rfa s ALA 97 Ca 0.38 -1.07 0.07 0.00 0.00 0.00 0.00 51.96 51.35 1rfa s ALA 97 Cb 0.06 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1rfa s ALA 97 CO 0.15 0.53 -0.02 0.54 0.00 0.00 0.00 175.76 176.96 1rfa s VAL 98 N -0.61 3.62 0.13 0.00 0.11 -1.26 0.11 120.40 122.49 1rfa s VAL 98 Ca 0.09 -1.45 -0.03 0.00 -2.93 0.00 0.00 61.98 57.66 1rfa s VAL 98 Cb -0.10 -2.81 -0.03 0.00 -1.53 0.00 0.00 36.38 31.90 1rfa s VAL 98 CO -0.00 -0.10 0.11 -0.36 -3.33 0.00 0.00 175.10 171.42 1rfa s PHE 99 N -1.70 0.67 -0.11 1.54 0.40 0.18 -2.60 117.98 116.36 1rfa s PHE 99 Ca 0.27 -1.07 -0.03 0.00 -0.60 0.00 0.00 56.93 55.49 1rfa s PHE 99 Cb -0.09 -0.35 -0.03 0.00 0.51 0.00 0.00 43.02 43.06 1rfa s PHE 99 CO 0.18 -0.55 0.02 0.50 0.70 0.00 0.00 175.22 176.07 1rfa s ARG 100 N -4.00 3.26 0.78 0.44 3.52 0.21 -0.88 118.95 122.29 1rfa s ARG 100 Ca 0.19 -0.38 -0.13 0.00 -0.13 0.00 0.00 55.73 55.28 1rfa s ARG 100 Cb 0.06 -2.92 0.18 0.00 -1.56 0.00 0.00 34.95 30.72 1rfa s ARG 100 CO -0.01 0.60 1.02 1.28 -0.81 0.00 0.00 175.30 177.37 1rfa n LEU 101 N 2.49 0.00 -4.50 -0.88 4.77 -0.59 -0.02 117.00 118.26 1rfa n LEU 101 Ca -0.18 -1.11 -0.43 0.00 -0.03 0.00 0.00 56.01 54.26 1rfa n LEU 101 Cb 0.53 -0.79 -0.02 0.00 -2.33 0.00 0.00 43.42 40.81 1rfa n LEU 101 CO 0.30 -1.31 1.29 -1.48 -1.33 0.00 0.00 177.39 174.86 1rfa s LEU 102 N 0.00 4.37 0.00 2.23 0.05 -1.26 -4.39 118.68 119.68 1rfa s LEU 102 Ca 0.58 -1.95 0.23 0.00 0.05 0.00 0.00 54.13 53.05 1rfa s LEU 102 Cb -0.02 -2.48 0.19 0.00 -2.05 0.00 0.00 46.19 41.83 1rfa s LEU 102 CO 0.41 -1.21 1.19 1.41 -0.55 0.00 0.00 176.35 177.61 1rfa n HIS 103 N 7.49 0.00 -2.28 3.48 8.25 -1.26 -4.23 115.22 126.67 1rfa n HIS 103 Ca 0.31 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.74 1rfa n HIS 103 Cb 0.49 -0.14 -0.01 0.00 1.12 0.00 0.00 29.99 31.45 1rfa n HIS 103 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1rfa n GLU 104 N -1.50 0.35 -4.31 -0.41 0.00 -1.26 -5.11 120.64 108.40 1rfa n GLU 104 Ca 0.05 -1.44 -0.20 0.00 0.00 0.00 0.00 57.16 55.57 1rfa n GLU 104 Cb 0.33 0.23 -0.08 0.00 0.00 0.00 0.00 31.44 31.92 1rfa n GLU 104 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 1rfa s HIS 105 N -0.25 1.78 -0.03 -1.84 0.09 -1.26 -5.17 115.29 108.62 1rfa s HIS 105 Ca 0.11 -1.65 -0.06 0.00 -0.00 0.00 0.00 55.06 53.47 1rfa s HIS 105 Cb 0.19 -0.76 0.01 0.00 -0.00 0.00 0.00 32.58 32.01 1rfa s HIS 105 CO -0.06 -0.83 0.13 0.15 -0.00 0.00 0.00 174.74 174.13 1rfa s LYS 106 N -3.44 0.31 0.00 1.40 -0.14 -1.26 -4.79 119.74 111.81 1rfa s LYS 106 Ca 0.39 -0.09 0.00 0.00 -1.36 0.00 0.00 55.97 54.91 1rfa s LYS 106 Cb 0.02 0.13 0.00 0.00 -1.68 0.00 0.00 37.83 36.30 1rfa s LYS 106 CO 0.27 -0.06 0.00 0.41 -0.76 0.00 0.00 175.35 175.21 1rfa n GLY 107 N 2.28 2.43 0.00 -3.33 0.00 -1.26 -4.89 105.19 100.42 1rfa n GLY 107 Ca -0.17 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1rfa n GLY 107 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rfa n LYS 108 N 0.00 3.62 -3.75 1.61 4.76 -1.26 -5.12 118.16 118.02 1rfa n LYS 108 Ca 0.00 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.31 1rfa n LYS 108 Cb 0.00 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.09 1rfa n LYS 108 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1rfa s LYS 109 N 2.39 0.51 -0.38 1.97 1.02 -1.26 -4.38 119.74 119.61 1rfa s LYS 109 Ca 0.00 0.27 -0.29 0.00 0.02 0.00 0.00 55.97 55.98 1rfa s LYS 109 Cb 0.00 0.24 0.02 0.00 -0.52 0.00 0.00 37.83 37.57 1rfa s LYS 109 CO 0.00 -0.10 1.08 0.00 -0.92 0.00 0.00 175.35 175.41 1rfa s ALA 110 N -0.32 3.36 0.06 5.17 0.00 0.98 -4.92 121.76 126.09 1rfa s ALA 110 Ca -0.05 -0.26 -0.11 0.00 0.00 0.00 0.00 51.96 51.54 1rfa s ALA 110 Cb -0.03 -3.73 -0.06 0.00 0.00 0.00 0.00 23.12 19.30 1rfa s ALA 110 CO 0.02 -1.78 0.41 0.50 0.00 0.00 0.00 175.76 174.91 1rfa s ARG 111 N 3.91 3.81 0.00 0.00 3.00 -1.26 0.68 118.95 129.09 1rfa s ARG 111 Ca 0.45 0.25 0.00 0.00 -1.00 0.00 0.00 55.73 55.44 1rfa s ARG 111 Cb -0.10 -3.06 0.00 0.00 0.00 0.00 0.00 34.95 31.79 1rfa s ARG 111 CO 0.22 0.59 0.00 1.28 0.00 0.00 0.00 175.30 177.39 1rfa n LEU 112 N 1.16 0.00 0.00 -0.88 4.77 -1.07 -4.89 117.00 116.09 1rfa n LEU 112 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1rfa n LEU 112 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1rfa n LEU 112 CO 0.41 -0.01 0.00 -0.67 -1.33 0.00 0.00 177.39 175.79 1rfa n ASP 113 N -0.11 0.24 -0.00 -1.43 2.03 -1.26 -4.89 116.55 111.12 1rfa n ASP 113 Ca 0.00 -0.83 0.03 0.00 0.52 0.00 0.00 54.79 54.50 1rfa n ASP 113 Cb 0.00 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 1rfa n ASP 113 CO 0.00 0.00 0.00 1.87 -1.92 0.00 0.00 177.20 177.15 1rfa n TRP 114 N -0.74 0.00 -1.32 -0.67 -0.00 -1.26 -4.20 117.44 109.26 1rfa n TRP 114 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.50 57.49 1rfa n TRP 114 Cb 0.00 -0.02 0.21 0.00 -0.00 0.00 0.00 31.31 31.50 1rfa n TRP 114 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1rfa n ASN 115 N -1.24 2.88 -4.77 5.87 5.15 -1.26 -0.32 115.26 121.57 1rfa n ASN 115 Ca 0.01 -3.56 -0.36 0.00 -0.60 0.00 0.00 54.58 50.07 1rfa n ASN 115 Cb 0.10 -0.62 -0.01 0.00 -0.53 0.00 0.00 39.78 38.73 1rfa n ASN 115 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1rfa s THR 116 N -3.13 3.22 -0.87 -0.44 2.01 -1.26 -4.42 115.64 110.74 1rfa s THR 116 Ca 0.44 0.84 -0.25 0.00 0.31 0.00 0.00 61.69 63.03 1rfa s THR 116 Cb 0.39 -3.38 -0.01 0.00 0.01 0.00 0.00 72.50 69.50 1rfa s THR 116 CO 0.03 -0.09 1.74 -0.62 -0.69 0.00 0.00 174.62 174.99 1rfa s ASP 117 N -1.59 5.61 0.18 3.53 2.15 -1.26 -1.02 116.67 124.26 1rfa s ASP 117 Ca 0.67 -0.69 0.19 0.00 0.43 0.00 0.00 52.55 53.15 1rfa s ASP 117 Cb -0.25 -2.56 0.83 0.00 -0.30 0.00 0.00 42.92 40.64 1rfa s ASP 117 CO 0.30 -2.28 1.58 0.00 -0.17 0.00 0.00 175.17 174.60 1rfa n ALA 118 N 12.04 1.53 1.45 3.66 0.00 -1.26 0.00 120.51 137.92 1rfa n ALA 118 Ca 0.32 0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.95 1rfa n ALA 118 Cb 0.49 -1.31 0.73 0.00 0.00 0.00 0.00 19.45 19.37 1rfa n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rfa n ALA 119 N -1.68 2.41 0.46 0.00 0.00 -1.26 -0.92 120.51 119.52 1rfa n ALA 119 Ca 0.02 -0.14 0.09 0.00 0.00 0.00 0.00 53.44 53.40 1rfa n ALA 119 Cb 0.17 -1.44 -0.12 0.00 0.00 0.00 0.00 19.45 18.06 1rfa n ALA 119 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1rfa n SER 120 N -1.18 0.81 -1.37 0.00 2.88 0.10 -3.86 113.62 111.01 1rfa n SER 120 Ca 0.16 -0.50 0.08 0.00 -1.33 0.00 0.00 58.87 57.28 1rfa n SER 120 Cb 0.17 1.39 0.32 0.00 -0.75 0.00 0.00 64.21 65.34 1rfa n SER 120 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1rfa n LEU 121 N -1.75 4.63 -4.75 2.46 7.99 -0.09 -4.99 117.00 120.50 1rfa n LEU 121 Ca 0.00 -2.76 -0.41 0.00 -0.01 0.00 0.00 56.01 52.83 1rfa n LEU 121 Cb 0.37 -0.57 -0.03 0.00 -0.11 0.00 0.00 43.42 43.08 1rfa n LEU 121 CO 0.38 0.70 0.88 -0.51 -1.51 0.00 0.00 177.39 177.32 1rfa s ILE 122 N -2.41 3.33 0.00 -0.08 1.10 -0.44 -3.08 121.20 119.63 1rfa s ILE 122 Ca 0.47 1.24 0.00 0.00 -0.51 0.00 0.00 60.65 61.85 1rfa s ILE 122 Cb 0.34 -3.79 0.00 0.00 0.15 0.00 0.00 42.46 39.17 1rfa s ILE 122 CO 0.16 0.25 0.00 0.61 -2.11 0.00 0.00 174.94 173.85 1rfa n GLY 123 N 1.55 0.90 0.00 1.50 0.00 -0.08 -4.65 105.19 104.42 1rfa n GLY 123 Ca 0.02 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1rfa n GLY 123 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rfa n GLU 124 N -0.53 0.05 -5.00 1.61 -0.58 -1.18 -5.01 120.64 109.99 1rfa n GLU 124 Ca 0.00 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.42 1rfa n GLU 124 Cb 0.46 0.00 -0.17 0.00 -0.57 0.00 0.00 31.44 31.17 1rfa n GLU 124 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1rfa s GLU 125 N -1.07 2.99 0.32 3.49 2.02 -1.26 -2.60 118.70 122.59 1rfa s GLU 125 Ca 0.00 -0.85 0.06 0.00 0.02 0.00 0.00 54.97 54.20 1rfa s GLU 125 Cb 0.00 -2.31 -0.01 0.00 0.10 0.00 0.00 34.13 31.90 1rfa s GLU 125 CO 0.00 0.11 0.45 -0.51 0.02 0.00 0.00 175.26 175.33 1rfa s LEU 126 N 0.52 3.99 0.06 1.80 1.43 0.28 -1.55 118.68 125.22 1rfa s LEU 126 Ca -0.15 -0.17 -0.10 0.00 -1.03 0.00 0.00 54.13 52.68 1rfa s LEU 126 Cb -0.17 -2.74 0.01 0.00 0.03 0.00 0.00 46.19 43.31 1rfa s LEU 126 CO 0.05 -0.39 0.22 -1.58 0.23 0.00 0.00 176.35 174.88 1rfa s GLN 127 N -4.15 0.77 0.04 1.70 0.74 -0.06 -0.71 119.66 117.99 1rfa s GLN 127 Ca 0.44 -0.69 0.08 0.00 0.05 0.00 0.00 55.36 55.24 1rfa s GLN 127 Cb -0.09 0.32 -0.02 0.00 1.10 0.00 0.00 33.01 34.31 1rfa s GLN 127 CO 0.31 -0.24 -0.22 0.08 -0.55 0.00 0.00 175.29 174.67 1rfa s VAL 128 N -2.93 1.79 0.00 1.34 1.01 -0.16 0.49 120.40 121.94 1rfa s VAL 128 Ca -0.02 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 60.75 1rfa s VAL 128 Cb 0.01 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.84 1rfa s VAL 128 CO -0.06 0.28 0.00 -0.67 0.00 0.00 0.00 175.10 174.66 1rfa n ASP 129 N 1.93 0.00 -4.85 3.32 -0.08 0.29 -3.24 116.55 113.92 1rfa n ASP 129 Ca -0.17 -0.97 -0.29 0.00 -1.51 0.00 0.00 54.79 51.85 1rfa n ASP 129 Cb 0.53 0.00 0.09 0.00 2.34 0.00 0.00 41.12 44.08 1rfa n ASP 129 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 1rfa s PHE 130 N -2.06 2.92 0.03 -0.67 -0.12 -1.26 -0.24 117.98 116.58 1rfa s PHE 130 Ca 0.00 0.92 -0.30 0.00 -0.05 0.00 0.00 56.93 57.49 1rfa s PHE 130 Cb 0.00 -3.30 -0.08 0.00 -0.63 0.00 0.00 43.02 39.01 1rfa s PHE 130 CO 0.00 -1.77 1.76 -0.51 -0.05 0.00 0.00 175.22 174.65 1rfa s LEU 131 N -5.67 4.38 0.00 -1.99 1.43 -1.24 -3.08 118.68 112.51 1rfa s LEU 131 Ca 0.61 2.50 0.31 0.00 -1.03 0.00 0.00 54.13 56.52 1rfa s LEU 131 Cb -0.12 -3.55 1.67 0.00 0.03 0.00 0.00 46.19 44.22 1rfa s LEU 131 CO 0.52 -0.96 2.10 -0.90 0.23 0.00 0.00 176.35 177.34