#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x1v s ILE 5 N 0.00 1.87 -0.11 0.00 1.01 -1.26 -5.09 121.20 117.62 1x1v s ILE 5 Ca 0.00 -1.92 0.03 0.00 0.00 0.00 0.00 60.65 58.76 1x1v s ILE 5 Cb 0.00 -2.31 -0.00 0.00 0.01 0.00 0.00 42.46 40.16 1x1v s ILE 5 CO 0.00 -0.48 -0.21 -0.54 0.00 0.00 0.00 174.94 173.71 1x1v s LYS 6 N 1.14 3.14 -0.04 2.79 1.02 -1.26 -0.92 119.74 125.61 1x1v s LYS 6 Ca 0.06 -0.82 0.03 0.00 0.02 0.00 0.00 55.97 55.26 1x1v s LYS 6 Cb -0.19 -2.40 0.00 0.00 -0.52 0.00 0.00 37.83 34.72 1x1v s LYS 6 CO -0.11 0.18 -0.13 0.08 -0.92 0.00 0.00 175.35 174.45 1x1v s VAL 7 N 0.37 1.15 0.00 3.17 1.01 -0.01 -5.00 120.40 121.09 1x1v s VAL 7 Ca -0.16 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1x1v s VAL 7 Cb -0.17 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.20 1x1v s VAL 7 CO 0.08 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1x1v n GLY 8 N 3.27 1.88 2.41 4.51 0.00 -1.26 -1.26 105.19 114.73 1x1v n GLY 8 Ca -0.19 -0.61 -0.01 0.00 0.00 0.00 0.00 46.02 45.22 1x1v n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x1v n ALA 9 N 7.21 -3.42 -3.08 4.61 0.00 -1.06 -4.88 120.51 119.89 1x1v n ALA 9 Ca 0.00 0.71 -0.35 0.00 0.00 0.00 0.00 53.44 53.80 1x1v n ALA 9 Cb 0.00 -1.39 -0.13 0.00 0.00 0.00 0.00 19.45 17.93 1x1v n ALA 9 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1x1v s TRP 10 N -1.09 3.03 -5.00 0.00 0.51 0.28 -4.88 118.94 111.79 1x1v s TRP 10 Ca -0.05 -0.45 0.00 0.00 -2.12 0.00 0.00 56.10 53.49 1x1v s TRP 10 Cb 0.00 -2.05 0.00 0.00 -0.81 0.00 0.00 33.47 30.62 1x1v s TRP 10 CO 0.60 -0.20 0.00 0.41 -0.51 0.00 0.00 176.95 177.25 1x1v n GLY 11 N 4.08 0.52 2.19 0.98 0.00 -1.26 -1.40 105.19 110.30 1x1v n GLY 11 Ca -0.17 -1.50 -0.16 0.00 0.00 0.00 0.00 46.02 44.19 1x1v n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1v n GLY 12 N 0.00 3.02 0.35 -0.02 0.00 0.24 -4.93 105.19 103.86 1x1v n GLY 12 Ca 0.00 -2.25 0.12 0.00 0.00 0.00 0.00 46.02 43.88 1x1v n GLY 12 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1x1v n ASN 13 N -1.79 1.56 -3.08 1.61 3.02 -1.26 -4.52 115.26 110.80 1x1v n ASN 13 Ca -0.03 -1.22 -0.16 0.00 -0.03 0.00 0.00 54.58 53.14 1x1v n ASN 13 Cb 0.36 0.41 0.14 0.00 -0.61 0.00 0.00 39.78 40.08 1x1v n ASN 13 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x1v n GLY 14 N 1.41 -2.79 7.00 7.41 0.00 -1.26 -4.88 105.19 112.07 1x1v n GLY 14 Ca 0.10 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.67 1x1v n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1v n GLY 15 N -1.65 -0.48 3.50 -0.02 0.00 -1.26 -4.62 105.19 100.65 1x1v n GLY 15 Ca 0.08 -0.95 -0.25 0.00 0.00 0.00 0.00 46.02 44.90 1x1v n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x1v s SER 16 N -4.00 3.58 0.43 1.61 1.04 -0.57 -4.81 113.70 110.97 1x1v s SER 16 Ca 0.00 -1.11 -0.24 0.00 0.48 0.00 0.00 55.95 55.08 1x1v s SER 16 Cb 0.00 -0.31 -0.08 0.00 0.10 0.00 0.00 66.02 65.73 1x1v s SER 16 CO 0.00 -0.10 1.15 0.00 0.98 0.00 0.00 173.24 175.27 1x1v s ALA 17 N -2.60 3.06 0.17 5.32 0.00 -1.26 -0.88 121.76 125.58 1x1v s ALA 17 Ca 0.31 0.91 0.03 0.00 0.00 0.00 0.00 51.96 53.21 1x1v s ALA 17 Cb -0.01 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.70 1x1v s ALA 17 CO 0.15 -0.54 -0.04 -0.59 0.00 0.00 0.00 175.76 174.75 1x1v s PHE 18 N -1.51 1.29 -0.30 0.00 -0.71 0.33 -4.85 117.98 112.23 1x1v s PHE 18 Ca 0.60 -0.91 -0.10 0.00 -1.04 0.00 0.00 56.93 55.48 1x1v s PHE 18 Cb -0.28 -0.72 0.18 0.00 -1.21 0.00 0.00 43.02 40.99 1x1v s PHE 18 CO 0.35 -0.07 0.96 0.34 -1.34 0.00 0.00 175.22 175.46 1x1v s ASP 19 N -3.20 -0.64 0.00 1.98 -1.08 -1.26 -1.60 116.67 110.86 1x1v s ASP 19 Ca 0.22 0.33 0.25 0.00 -0.52 0.00 0.00 52.55 52.83 1x1v s ASP 19 Cb 0.05 1.51 0.59 0.00 -1.46 0.00 0.00 42.92 43.61 1x1v s ASP 19 CO 0.03 -0.12 1.46 1.15 0.52 0.00 0.00 175.17 178.22 1x1v n MET 20 N 5.41 0.36 -0.70 4.34 0.00 -0.80 -5.01 117.12 120.73 1x1v n MET 20 Ca -0.03 -0.22 0.09 0.00 0.00 0.00 0.00 57.70 57.55 1x1v n MET 20 Cb 0.54 -1.50 -0.02 0.00 0.00 0.00 0.00 33.22 32.24 1x1v n MET 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1x1v n GLY 21 N 1.43 -1.92 3.82 3.17 0.00 -1.25 -4.85 105.19 105.59 1x1v n GLY 21 Ca 0.08 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 1x1v n GLY 21 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x1v s PRO 22 N -1.38 3.97 0.41 1.61 0.04 -1.26 -4.01 135.00 134.36 1x1v s PRO 22 Ca 0.00 1.09 0.07 0.00 0.04 0.00 0.00 61.00 62.21 1x1v s PRO 22 Cb 0.00 -2.14 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 1x1v s PRO 22 CO 0.00 -0.26 0.18 0.00 0.04 0.00 0.00 177.00 176.96 1x1v s ALA 23 N -2.36 3.59 -0.06 8.56 0.00 0.21 -4.96 121.76 126.74 1x1v s ALA 23 Ca 0.62 -2.08 -0.25 0.00 0.00 0.00 0.00 51.96 50.24 1x1v s ALA 23 Cb -0.11 -0.43 -0.23 0.00 0.00 0.00 0.00 23.12 22.35 1x1v s ALA 23 CO 0.24 -0.15 1.02 -0.92 0.00 0.00 0.00 175.76 175.95 1x1v h TYR 24 N 1.43 0.17 -3.23 0.00 3.20 -1.58 -3.47 116.97 113.49 1x1v h TYR 24 Ca -0.43 -0.09 -0.21 0.00 3.14 0.00 0.00 58.73 61.14 1x1v h TYR 24 Cb 1.25 -0.02 -0.29 0.00 1.54 0.00 0.00 36.73 39.21 1x1v h TYR 24 CO 0.63 0.88 -0.55 0.50 -1.64 0.00 0.00 178.16 177.98 1x1v s ARG 25 N -3.15 0.15 -0.05 1.82 3.52 -1.23 -5.00 118.95 115.02 1x1v s ARG 25 Ca -0.16 0.35 -0.30 0.00 -0.13 0.00 0.00 55.73 55.49 1x1v s ARG 25 Cb 0.00 -0.06 -0.03 0.00 -1.56 0.00 0.00 34.95 33.30 1x1v s ARG 25 CO 0.72 -0.11 1.09 0.42 -0.81 0.00 0.00 175.30 176.61 1x1v s ILE 26 N 0.78 4.54 -0.16 4.11 -1.09 -1.26 -1.32 121.20 126.80 1x1v s ILE 26 Ca -0.06 1.83 -0.12 0.00 -2.23 0.00 0.00 60.65 60.06 1x1v s ILE 26 Cb -0.07 -4.17 -0.23 0.00 -1.58 0.00 0.00 42.46 36.41 1x1v s ILE 26 CO -0.04 0.05 0.28 -0.38 -1.23 0.00 0.00 174.94 173.61 1x1v n ILE 27 N 4.36 1.68 -3.51 2.92 5.41 0.11 -4.72 119.36 125.61 1x1v n ILE 27 Ca 0.09 -0.41 -0.17 0.00 1.00 0.00 0.00 62.75 63.27 1x1v n ILE 27 Cb 0.48 -1.85 -0.05 0.00 -0.71 0.00 0.00 39.64 37.51 1x1v n ILE 27 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1x1v s SER 28 N -6.98 -0.63 -0.08 4.38 1.04 -0.84 -1.51 113.70 109.08 1x1v s SER 28 Ca -0.26 0.58 0.01 0.00 0.48 0.00 0.00 55.95 56.77 1x1v s SER 28 Cb 0.07 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.74 1x1v s SER 28 CO 0.69 -0.66 -0.09 -0.69 0.98 0.00 0.00 173.24 173.47 1x1v s VAL 29 N -1.62 1.00 -0.27 5.02 1.01 0.30 -1.80 120.40 124.04 1x1v s VAL 29 Ca -0.08 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.57 1x1v s VAL 29 Cb -0.00 -0.96 0.07 0.00 0.00 0.00 0.00 36.38 35.48 1x1v s VAL 29 CO 0.06 0.34 -0.07 -0.75 0.00 0.00 0.00 175.10 174.67 1x1v s LYS 30 N 1.07 2.01 -0.28 2.72 2.20 0.21 0.50 119.74 128.18 1x1v s LYS 30 Ca -0.07 -1.38 -0.17 0.00 -0.36 0.00 0.00 55.97 53.98 1x1v s LYS 30 Cb -0.14 -2.89 -0.03 0.00 -1.51 0.00 0.00 37.83 33.26 1x1v s LYS 30 CO -0.01 -0.64 0.48 0.42 -0.36 0.00 0.00 175.35 175.24 1x1v s ILE 31 N 1.12 5.08 -0.15 5.43 1.09 -0.55 -0.60 121.20 132.62 1x1v s ILE 31 Ca -0.05 0.71 -0.20 0.00 -1.10 0.00 0.00 60.65 60.01 1x1v s ILE 31 Cb -0.20 -3.82 -0.03 0.00 -1.06 0.00 0.00 42.46 37.35 1x1v s ILE 31 CO -0.06 0.05 0.57 -0.36 -0.10 0.00 0.00 174.94 175.04 1x1v s PHE 32 N 2.27 3.45 -0.02 3.97 0.08 0.52 -0.13 117.98 128.12 1x1v s PHE 32 Ca 0.19 0.93 -0.15 0.00 0.12 0.00 0.00 56.93 58.03 1x1v s PHE 32 Cb -0.16 -2.70 0.02 0.00 -0.57 0.00 0.00 43.02 39.62 1x1v s PHE 32 CO 0.10 -0.01 0.31 -1.54 -0.10 0.00 0.00 175.22 173.97 1x1v s SER 33 N 0.95 -0.19 0.00 1.36 1.04 -0.58 -0.50 113.70 115.78 1x1v s SER 33 Ca 0.28 0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.81 1x1v s SER 33 Cb -0.16 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.28 1x1v s SER 33 CO 0.11 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.51 1x1v n GLY 34 N 1.32 1.82 0.07 7.32 0.00 -1.26 -1.26 105.19 113.19 1x1v n GLY 34 Ca -0.21 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 45.90 1x1v n GLY 34 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1x1v n ASP 35 N 0.00 0.52 -4.34 1.61 5.68 -1.26 -3.40 116.55 115.36 1x1v n ASP 35 Ca 0.00 0.54 -0.18 0.00 -0.50 0.00 0.00 54.79 54.66 1x1v n ASP 35 Cb 0.00 -0.68 -0.10 0.00 -1.14 0.00 0.00 41.12 39.20 1x1v n ASP 35 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1x1v s VAL 36 N -3.06 0.99 -0.48 2.12 1.01 -1.26 -1.05 120.40 118.65 1x1v s VAL 36 Ca 0.12 -2.02 -0.28 0.00 0.00 0.00 0.00 61.98 59.80 1x1v s VAL 36 Cb 0.15 -2.44 0.03 0.00 0.00 0.00 0.00 36.38 34.12 1x1v s VAL 36 CO 0.57 -0.24 1.07 -0.69 0.00 0.00 0.00 175.10 175.81 1x1v s VAL 37 N -3.45 4.28 -0.06 2.92 1.01 -0.59 -4.37 120.40 120.15 1x1v s VAL 37 Ca 0.31 1.01 -0.23 0.00 0.00 0.00 0.00 61.98 63.06 1x1v s VAL 37 Cb 0.06 -4.56 -0.27 0.00 0.00 0.00 0.00 36.38 31.61 1x1v s VAL 37 CO 0.10 -0.99 0.94 0.44 0.00 0.00 0.00 175.10 175.59 1x1v h ASP 38 N 9.22 0.33 -5.12 3.32 5.19 -1.09 -1.13 116.42 127.14 1x1v h ASP 38 Ca -0.24 -0.89 0.12 0.00 -0.62 0.00 0.00 57.03 55.41 1x1v h ASP 38 Cb 1.07 -0.10 -0.08 0.00 0.18 0.00 0.00 39.33 40.39 1x1v h ASP 38 CO 1.10 1.18 0.39 0.00 -3.12 0.00 0.00 179.24 178.79 1x1v s ALA 39 N -2.70 -1.54 -0.04 3.45 0.00 -0.96 -2.15 121.76 117.83 1x1v s ALA 39 Ca -0.15 0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.95 1x1v s ALA 39 Cb 0.01 0.70 0.01 0.00 0.00 0.00 0.00 23.12 23.84 1x1v s ALA 39 CO 0.78 -0.98 -0.07 0.08 0.00 0.00 0.00 175.76 175.57 1x1v s VAL 40 N -3.50 0.69 -0.15 0.00 1.01 -0.74 -0.35 120.40 117.35 1x1v s VAL 40 Ca 0.10 -0.25 -0.10 0.00 0.00 0.00 0.00 61.98 61.73 1x1v s VAL 40 Cb -0.03 -0.66 -0.05 0.00 0.00 0.00 0.00 36.38 35.64 1x1v s VAL 40 CO 0.01 0.25 0.18 -1.81 0.00 0.00 0.00 175.10 173.73 1x1v s ASP 41 N 0.63 6.35 -0.12 3.32 1.01 0.23 -0.75 116.67 127.34 1x1v s ASP 41 Ca -0.10 0.41 0.02 0.00 0.71 0.00 0.00 52.55 53.60 1x1v s ASP 41 Cb -0.13 -2.11 0.01 0.00 1.01 0.00 0.00 42.92 41.70 1x1v s ASP 41 CO 0.01 0.25 -0.19 -0.69 0.21 0.00 0.00 175.17 174.76 1x1v s VAL 42 N -0.19 1.83 -0.08 -1.27 1.01 -1.26 -0.62 120.40 119.83 1x1v s VAL 42 Ca 0.13 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.28 1x1v s VAL 42 Cb -0.12 -1.64 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1x1v s VAL 42 CO 0.02 0.51 -0.12 0.42 0.00 0.00 0.00 175.10 175.93 1x1v s THR 43 N 0.84 3.23 0.17 3.92 -4.23 -0.75 -2.45 115.64 116.37 1x1v s THR 43 Ca -0.08 -0.64 -0.16 0.00 -1.18 0.00 0.00 61.69 59.62 1x1v s THR 43 Cb -0.15 -2.30 0.03 0.00 1.34 0.00 0.00 72.50 71.41 1x1v s THR 43 CO -0.01 0.57 0.46 0.72 -0.54 0.00 0.00 174.62 175.83 1x1v s PHE 44 N -0.46 -0.10 0.13 3.99 -0.71 -0.37 0.06 117.98 120.52 1x1v s PHE 44 Ca 0.06 -0.23 -0.02 0.00 -1.04 0.00 0.00 56.93 55.70 1x1v s PHE 44 Cb -0.12 0.31 -0.05 0.00 -1.21 0.00 0.00 43.02 41.95 1x1v s PHE 44 CO 0.02 -0.83 0.32 0.95 -1.34 0.00 0.00 175.22 174.35 1x1v s THR 45 N -3.86 5.26 -0.29 -4.49 -4.23 -0.43 -0.54 115.64 107.06 1x1v s THR 45 Ca 0.08 -0.26 0.03 0.00 -1.18 0.00 0.00 61.69 60.36 1x1v s THR 45 Cb 0.00 -3.66 0.18 0.00 1.34 0.00 0.00 72.50 70.36 1x1v s THR 45 CO -0.06 0.00 0.53 -0.47 -0.54 0.00 0.00 174.62 174.09 1x1v s TYR 46 N -1.67 -1.52 -1.31 3.99 6.14 0.14 -1.56 117.35 121.56 1x1v s TYR 46 Ca 0.38 1.03 -0.05 0.00 0.64 0.00 0.00 57.07 59.07 1x1v s TYR 46 Cb -0.12 0.24 -0.00 0.00 0.42 0.00 0.00 41.96 42.50 1x1v s TYR 46 CO 0.27 -0.99 0.60 0.66 0.64 0.00 0.00 175.55 176.74 1x1v n TYR 47 N 5.40 -1.81 -0.56 4.97 4.02 -1.26 -1.91 117.16 126.02 1x1v n TYR 47 Ca 0.02 0.72 0.00 0.00 -0.01 0.00 0.00 57.90 58.62 1x1v n TYR 47 Cb 0.52 -3.91 0.00 0.00 -0.02 0.00 0.00 39.34 35.93 1x1v n TYR 47 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1x1v n GLY 48 N -1.76 0.89 3.38 2.72 0.00 -1.26 -5.05 105.19 104.11 1x1v n GLY 48 Ca -0.26 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.49 1x1v n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x1v s LYS 49 N -0.39 1.38 -0.13 1.61 1.02 -0.80 -5.13 119.74 117.29 1x1v s LYS 49 Ca 0.00 -1.36 -0.08 0.00 0.02 0.00 0.00 55.97 54.56 1x1v s LYS 49 Cb 0.00 -1.80 -0.04 0.00 -0.52 0.00 0.00 37.83 35.47 1x1v s LYS 49 CO 0.00 0.42 0.14 0.95 -0.92 0.00 0.00 175.35 175.94 1x1v s THR 50 N -1.21 5.49 0.06 2.17 -4.23 -1.26 0.23 115.64 116.88 1x1v s THR 50 Ca 0.14 0.21 0.02 0.00 -1.18 0.00 0.00 61.69 60.89 1x1v s THR 50 Cb -0.09 -3.42 -0.03 0.00 1.34 0.00 0.00 72.50 70.30 1x1v s THR 50 CO 0.06 0.58 -0.08 -1.61 -0.54 0.00 0.00 174.62 173.04 1x1v s GLU 51 N -0.76 0.65 0.02 3.99 0.41 0.30 -4.98 118.70 118.33 1x1v s GLU 51 Ca 0.14 -0.94 0.02 0.00 -0.41 0.00 0.00 54.97 53.78 1x1v s GLU 51 Cb -0.12 -0.34 -0.01 0.00 -1.78 0.00 0.00 34.13 31.88 1x1v s GLU 51 CO 0.03 0.05 -0.07 0.95 -0.49 0.00 0.00 175.26 175.72 1x1v s THR 52 N -1.97 0.56 -0.06 3.63 -4.23 -1.26 -1.23 115.64 111.07 1x1v s THR 52 Ca -0.03 -0.66 -0.06 0.00 -1.18 0.00 0.00 61.69 59.76 1x1v s THR 52 Cb -0.06 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.21 1x1v s THR 52 CO -0.01 -0.09 -0.14 0.54 -0.54 0.00 0.00 174.62 174.39 1x1v n ARG 53 N 2.24 0.22 -2.52 3.99 5.12 -1.03 -5.02 116.66 119.67 1x1v n ARG 53 Ca -0.17 0.09 -0.02 0.00 -1.93 0.00 0.00 57.85 55.81 1x1v n ARG 53 Cb 0.56 -0.87 -0.02 0.00 -1.16 0.00 0.00 32.46 30.97 1x1v n ARG 53 CO 0.00 0.00 0.00 1.58 -1.93 0.00 0.00 177.63 177.28 1x1v n HIS 54 N -3.67 -3.59 -4.06 -1.55 -0.00 -1.25 -4.98 115.22 96.12 1x1v n HIS 54 Ca -0.14 2.11 -0.35 0.00 -0.00 0.00 0.00 57.72 59.35 1x1v n HIS 54 Cb 0.43 -3.22 -0.13 0.00 -0.00 0.00 0.00 29.99 27.07 1x1v n HIS 54 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1x1v s PHE 55 N -0.49 3.00 0.00 1.57 2.99 0.07 -4.94 117.98 120.19 1x1v s PHE 55 Ca -0.12 -0.61 0.00 0.00 0.00 0.00 0.00 56.93 56.20 1x1v s PHE 55 Cb 0.01 -2.08 0.00 0.00 0.00 0.00 0.00 43.02 40.95 1x1v s PHE 55 CO 0.33 -0.33 0.00 0.41 -0.00 0.00 0.00 175.22 175.63 1x1v n GLY 56 N 4.40 0.68 0.19 4.36 0.00 -1.26 -1.80 105.19 111.75 1x1v n GLY 56 Ca -0.17 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1x1v n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1v n GLY 57 N -0.42 -3.01 3.35 -0.02 0.00 -0.89 -3.70 105.19 100.50 1x1v n GLY 57 Ca 0.00 -1.21 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 1x1v n GLY 57 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x1v n SER 58 N -1.45 -2.17 0.00 1.61 7.64 -1.26 -4.46 113.62 113.53 1x1v n SER 58 Ca 0.00 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.72 1x1v n SER 58 Cb 0.04 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.17 1x1v n SER 58 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x1v n GLY 59 N 1.63 2.37 0.89 0.23 0.00 -1.26 -4.78 105.19 104.27 1x1v n GLY 59 Ca 0.01 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1x1v n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1v n GLY 60 N 1.63 -2.36 3.69 -0.02 0.00 -1.26 -4.55 105.19 102.32 1x1v n GLY 60 Ca 0.00 -1.56 -0.35 0.00 0.00 0.00 0.00 46.02 44.11 1x1v n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x1v s THR 61 N -0.86 4.44 0.26 2.61 2.01 -0.39 -4.74 115.64 118.96 1x1v s THR 61 Ca 0.00 -0.20 -0.29 0.00 0.31 0.00 0.00 61.69 61.51 1x1v s THR 61 Cb 0.00 -2.88 -0.09 0.00 0.01 0.00 0.00 72.50 69.53 1x1v s THR 61 CO 0.00 0.59 0.99 -2.16 -0.69 0.00 0.00 174.62 173.36 1x1v s PRO 62 N -0.77 4.75 -0.25 4.92 0.04 -1.26 -1.53 135.00 140.90 1x1v s PRO 62 Ca 0.12 1.58 -0.00 0.00 0.04 0.00 0.00 61.00 62.73 1x1v s PRO 62 Cb -0.12 -3.19 0.07 0.00 0.04 0.00 0.00 34.50 31.30 1x1v s PRO 62 CO 0.02 0.38 0.00 -1.01 0.04 0.00 0.00 177.00 176.44 1x1v s HIS 63 N -1.22 2.06 -0.22 0.56 3.76 0.81 -4.96 115.29 116.07 1x1v s HIS 63 Ca 0.43 -1.64 -0.19 0.00 -0.15 0.00 0.00 55.06 53.52 1x1v s HIS 63 Cb -0.27 -1.58 -0.03 0.00 1.11 0.00 0.00 32.58 31.81 1x1v s HIS 63 CO 0.34 -0.77 0.54 -2.00 -0.85 0.00 0.00 174.74 172.00 1x1v s GLU 64 N 1.51 4.15 -0.27 1.40 2.12 -1.26 -1.48 118.70 124.86 1x1v s GLU 64 Ca -0.01 0.41 -0.12 0.00 0.36 0.00 0.00 54.97 55.62 1x1v s GLU 64 Cb -0.18 -3.60 -0.05 0.00 0.26 0.00 0.00 34.13 30.56 1x1v s GLU 64 CO -0.10 -0.24 0.23 0.42 -0.54 0.00 0.00 175.26 175.03 1x1v s ILE 65 N 1.94 5.28 -0.16 -3.70 1.01 0.18 -4.98 121.20 120.76 1x1v s ILE 65 Ca 0.24 0.27 -0.01 0.00 0.00 0.00 0.00 60.65 61.15 1x1v s ILE 65 Cb -0.15 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.74 1x1v s ILE 65 CO 0.09 0.23 -0.12 -0.69 0.00 0.00 0.00 174.94 174.46 1x1v s VAL 66 N 1.79 2.94 -0.24 2.92 1.01 -1.26 -0.54 120.40 127.02 1x1v s VAL 66 Ca 0.09 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.21 1x1v s VAL 66 Cb -0.16 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 1x1v s VAL 66 CO 0.10 0.50 0.56 -0.76 0.00 0.00 0.00 175.10 175.50 1x1v s LEU 67 N 0.82 4.08 0.00 3.92 1.43 -0.57 -5.01 118.68 123.35 1x1v s LEU 67 Ca -0.04 0.63 0.00 0.00 -1.03 0.00 0.00 54.13 53.69 1x1v s LEU 67 Cb -0.15 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.32 1x1v s LEU 67 CO 0.00 -0.29 0.00 0.00 0.23 0.00 0.00 176.35 176.29 1x1v n GLN 68 N 5.42 0.02 0.00 1.70 6.02 -1.26 -4.91 117.38 124.37 1x1v n GLN 68 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 1x1v n GLN 68 Cb 0.50 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.76 1x1v n GLN 68 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1x1v n GLU 69 N -0.91 0.00 -1.31 -1.09 4.07 -1.26 -2.54 120.64 117.60 1x1v n GLU 69 Ca 0.00 0.74 -0.31 0.00 -0.06 0.00 0.00 57.16 57.53 1x1v n GLU 69 Cb 0.00 -1.32 0.11 0.00 -0.06 0.00 0.00 31.44 30.17 1x1v n GLU 69 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1x1v n GLY 70 N -0.97 5.45 3.67 8.31 0.00 -1.26 -4.96 105.19 115.42 1x1v n GLY 70 Ca 0.00 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 1x1v n GLY 70 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x1v s GLU 71 N -3.65 3.45 0.03 1.61 2.12 -1.05 -4.94 118.70 116.26 1x1v s GLU 71 Ca 0.62 -0.36 0.00 0.00 0.36 0.00 0.00 54.97 55.59 1x1v s GLU 71 Cb 0.50 -3.00 -0.02 0.00 0.26 0.00 0.00 34.13 31.87 1x1v s GLU 71 CO 0.03 0.52 -0.04 0.71 -0.54 0.00 0.00 175.26 175.94 1x1v s TYR 72 N -0.34 0.35 -0.27 5.30 1.51 -1.26 -4.69 117.35 117.94 1x1v s TYR 72 Ca 0.08 -0.54 -0.29 0.00 -1.01 0.00 0.00 57.07 55.31 1x1v s TYR 72 Cb -0.12 -0.24 0.00 0.00 -0.11 0.00 0.00 41.96 41.49 1x1v s TYR 72 CO 0.02 -0.17 1.24 -0.51 -1.11 0.00 0.00 175.55 175.01 1x1v s LEU 73 N -1.52 3.96 -0.10 -1.29 1.43 -1.26 -2.56 118.68 117.34 1x1v s LEU 73 Ca -0.14 1.28 0.15 0.00 -1.03 0.00 0.00 54.13 54.38 1x1v s LEU 73 Cb -0.10 -3.54 0.22 0.00 0.03 0.00 0.00 46.19 42.81 1x1v s LEU 73 CO -0.01 -0.96 1.12 1.33 0.23 0.00 0.00 176.35 178.06 1x1v n VAL 74 N 5.94 1.69 -3.64 -1.59 0.24 -0.38 -0.94 118.33 119.65 1x1v n VAL 74 Ca 0.14 -1.98 -0.08 0.00 -2.04 0.00 0.00 64.34 60.38 1x1v n VAL 74 Cb 0.46 -0.07 -0.07 0.00 -1.47 0.00 0.00 33.84 32.69 1x1v n VAL 74 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1x1v s GLY 75 N -2.44 -0.08 -0.01 7.63 0.00 -1.00 -1.73 107.32 109.70 1x1v s GLY 75 Ca 0.25 2.81 0.02 0.00 0.00 0.00 0.00 44.72 47.80 1x1v s GLY 75 CO 0.02 1.87 -0.07 -0.29 0.00 0.00 0.00 173.10 174.64 1x1v s MET 76 N 0.24 0.53 -0.04 2.90 1.75 -0.81 -1.37 119.30 122.50 1x1v s MET 76 Ca 0.03 -0.23 -0.11 0.00 -1.25 0.00 0.00 55.69 54.13 1x1v s MET 76 Cb -0.05 -0.51 0.02 0.00 2.84 0.00 0.00 34.83 37.12 1x1v s MET 76 CO -0.08 0.14 0.25 0.21 -0.65 0.00 0.00 175.02 174.89 1x1v s LYS 77 N -0.15 0.50 0.00 4.11 2.20 -0.57 0.50 119.74 126.34 1x1v s LYS 77 Ca 0.02 -0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.56 1x1v s LYS 77 Cb -0.03 0.22 0.00 0.00 -1.51 0.00 0.00 37.83 36.52 1x1v s LYS 77 CO -0.00 -0.12 0.00 0.41 -0.36 0.00 0.00 175.35 175.28 1x1v n GLY 78 N 1.85 1.25 2.92 5.54 0.00 -0.96 0.90 105.19 116.69 1x1v n GLY 78 Ca -0.19 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 44.93 1x1v n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x1v s GLU 79 N -0.51 0.21 0.08 1.61 2.02 -0.53 -1.47 118.70 120.12 1x1v s GLU 79 Ca 0.00 -0.13 0.10 0.00 0.02 0.00 0.00 54.97 54.96 1x1v s GLU 79 Cb 0.00 -0.18 -0.03 0.00 0.10 0.00 0.00 34.13 34.01 1x1v s GLU 79 CO 0.00 0.05 -0.25 -0.59 0.02 0.00 0.00 175.26 174.48 1x1v s PHE 80 N -0.16 2.35 0.06 1.61 -0.12 -0.22 -0.52 117.98 120.98 1x1v s PHE 80 Ca -0.00 -0.38 -0.26 0.00 -0.05 0.00 0.00 56.93 56.24 1x1v s PHE 80 Cb -0.02 -1.34 0.09 0.00 -0.63 0.00 0.00 43.02 41.12 1x1v s PHE 80 CO -0.00 0.23 1.18 0.20 -0.05 0.00 0.00 175.22 176.78 1x1v s GLY 81 N -1.61 -0.06 -0.45 1.99 0.00 -0.54 0.43 107.32 107.08 1x1v s GLY 81 Ca 0.13 -0.06 -0.26 0.00 0.00 0.00 0.00 44.72 44.53 1x1v s GLY 81 CO 0.04 3.83 0.97 0.21 0.00 0.00 0.00 173.10 178.16 1x1v s ASN 82 N -3.57 6.56 -0.54 1.64 3.84 -1.26 -1.34 114.94 120.27 1x1v s ASN 82 Ca 0.25 0.27 -0.07 0.00 0.21 0.00 0.00 52.86 53.52 1x1v s ASN 82 Cb -0.01 -2.48 0.14 0.00 -0.55 0.00 0.00 41.25 38.36 1x1v s ASN 82 CO 0.01 -1.07 0.39 -0.47 -2.79 0.00 0.00 177.10 173.17 1x1v s TYR 83 N 3.87 3.49 -1.55 0.43 5.04 -0.52 -4.71 117.35 123.39 1x1v s TYR 83 Ca 0.40 -2.23 -0.13 0.00 -2.44 0.00 0.00 57.07 52.67 1x1v s TYR 83 Cb -0.10 -3.40 0.09 0.00 0.35 0.00 0.00 41.96 38.91 1x1v s TYR 83 CO 0.26 -0.95 0.89 0.72 -1.34 0.00 0.00 175.55 175.14 1x1v n HIS 84 N 4.36 -2.12 0.00 4.97 8.25 -1.26 -2.98 115.22 126.44 1x1v n HIS 84 Ca -0.00 0.87 0.00 0.00 -0.26 0.00 0.00 57.72 58.33 1x1v n HIS 84 Cb 0.41 -3.77 0.00 0.00 1.12 0.00 0.00 29.99 27.75 1x1v n HIS 84 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x1v n GLY 85 N -1.63 0.68 3.02 -1.41 0.00 -1.26 -5.08 105.19 99.50 1x1v n GLY 85 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 1x1v n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x1v s VAL 86 N -2.00 1.07 -0.50 1.61 1.01 -1.16 -5.09 120.40 115.34 1x1v s VAL 86 Ca 0.00 -0.46 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 1x1v s VAL 86 Cb 0.00 -0.97 0.03 0.00 0.00 0.00 0.00 36.38 35.43 1x1v s VAL 86 CO 0.00 0.34 1.21 -0.69 0.00 0.00 0.00 175.10 175.95 1x1v s VAL 87 N 0.55 4.09 0.22 2.92 1.01 -1.26 -1.44 120.40 126.48 1x1v s VAL 87 Ca -0.12 1.07 0.02 0.00 0.00 0.00 0.00 61.98 62.95 1x1v s VAL 87 Cb -0.14 -4.57 -0.05 0.00 0.00 0.00 0.00 36.38 31.62 1x1v s VAL 87 CO 0.03 -1.07 0.05 0.68 0.00 0.00 0.00 175.10 174.80 1x1v s VAL 88 N 4.82 0.63 -0.49 2.92 -7.23 -0.45 -2.88 120.40 117.72 1x1v s VAL 88 Ca 0.49 -1.99 -0.28 0.00 -1.81 0.00 0.00 61.98 58.39 1x1v s VAL 88 Cb -0.08 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.42 1x1v s VAL 88 CO 0.30 -0.20 1.73 -0.69 -0.31 0.00 0.00 175.10 175.93 1x1v s VAL 89 N -3.70 3.52 0.12 1.32 1.01 -0.12 -1.47 120.40 121.08 1x1v s VAL 89 Ca 0.32 0.44 0.06 0.00 0.00 0.00 0.00 61.98 62.80 1x1v s VAL 89 Cb 0.07 -3.94 -0.22 0.00 0.00 0.00 0.00 36.38 32.29 1x1v s VAL 89 CO 0.10 -0.76 1.27 1.23 0.00 0.00 0.00 175.10 176.93 1x1v h GLY 90 N 14.55 0.03 -4.91 4.51 0.00 -0.99 -1.55 103.07 114.72 1x1v h GLY 90 Ca -0.29 -0.08 -0.24 0.00 0.00 0.00 0.00 47.33 46.72 1x1v h GLY 90 CO 1.13 0.07 -0.72 0.54 0.00 0.00 0.00 176.54 177.56 1x1v s LYS 91 N -2.72 0.42 -0.22 4.80 1.02 -0.88 -3.18 119.74 118.99 1x1v s LYS 91 Ca 0.00 -0.64 -0.13 0.00 0.02 0.00 0.00 55.97 55.22 1x1v s LYS 91 Cb 0.10 -0.15 0.07 0.00 -0.52 0.00 0.00 37.83 37.33 1x1v s LYS 91 CO 0.83 0.02 0.55 -1.17 -0.92 0.00 0.00 175.35 174.66 1x1v s LEU 92 N -1.38 -0.49 0.13 3.17 0.20 0.32 -1.45 118.68 119.17 1x1v s LEU 92 Ca -0.11 1.20 -0.02 0.00 0.69 0.00 0.00 54.13 55.89 1x1v s LEU 92 Cb -0.09 1.89 -0.03 0.00 -0.43 0.00 0.00 46.19 47.52 1x1v s LEU 92 CO -0.00 -0.21 0.08 -0.83 -0.29 0.00 0.00 176.35 175.10 1x1v s GLY 93 N 1.39 0.86 0.04 7.98 0.00 0.26 0.67 107.32 118.50 1x1v s GLY 93 Ca -0.09 -1.35 -0.00 0.00 0.00 0.00 0.00 44.72 43.28 1x1v s GLY 93 CO -0.15 -1.27 -0.04 -1.36 0.00 0.00 0.00 173.10 170.29 1x1v s PHE 94 N -4.02 0.42 0.02 1.90 0.40 -0.84 -1.51 117.98 114.35 1x1v s PHE 94 Ca 0.21 -0.73 0.05 0.00 -0.60 0.00 0.00 56.93 55.86 1x1v s PHE 94 Cb 0.07 -0.30 -0.02 0.00 0.51 0.00 0.00 43.02 43.29 1x1v s PHE 94 CO 0.00 -0.24 -0.14 -1.54 0.70 0.00 0.00 175.22 174.00 1x1v s SER 95 N -2.06 1.65 0.50 1.36 1.04 -0.47 -0.50 113.70 115.22 1x1v s SER 95 Ca -0.06 -0.37 0.06 0.00 0.48 0.00 0.00 55.95 56.06 1x1v s SER 95 Cb -0.03 -0.14 0.06 0.00 0.10 0.00 0.00 66.02 66.02 1x1v s SER 95 CO -0.04 0.09 0.54 0.35 0.98 0.00 0.00 173.24 175.16 1x1v n THR 96 N 2.25 0.00 0.35 2.02 -2.24 0.45 -1.25 114.28 115.86 1x1v n THR 96 Ca -0.16 -1.83 0.12 0.00 -2.27 0.00 0.00 64.05 59.90 1x1v n THR 96 Cb 0.55 -0.32 0.52 0.00 -2.10 0.00 0.00 70.33 68.98 1x1v n THR 96 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1x1v n ASN 97 N -2.12 0.69 -0.10 3.42 6.94 -1.06 -3.63 115.26 119.40 1x1v n ASN 97 Ca 0.06 0.69 -0.13 0.00 -0.02 0.00 0.00 54.58 55.19 1x1v n ASN 97 Cb 0.55 -0.83 -0.10 0.00 -2.36 0.00 0.00 39.78 37.04 1x1v n ASN 97 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1x1v n LYS 98 N -2.29 0.61 -3.86 -3.83 4.76 -1.26 -5.07 118.16 107.21 1x1v n LYS 98 Ca 0.01 0.10 -0.07 0.00 -2.87 0.00 0.00 58.31 55.48 1x1v n LYS 98 Cb 0.20 -1.40 -0.02 0.00 -1.84 0.00 0.00 35.03 31.97 1x1v n LYS 98 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1x1v s LYS 99 N -2.40 1.82 -0.06 1.97 -2.85 -1.24 -5.17 119.74 111.82 1x1v s LYS 99 Ca -0.25 -1.05 -0.02 0.00 -1.00 0.00 0.00 55.97 53.66 1x1v s LYS 99 Cb 0.07 0.60 -0.04 0.00 -2.06 0.00 0.00 37.83 36.41 1x1v s LYS 99 CO 0.48 -0.83 0.03 0.45 0.10 0.00 0.00 175.35 175.58 1x1v s SER 100 N -2.94 5.41 -0.05 0.03 0.15 -1.26 -0.41 113.70 114.63 1x1v s SER 100 Ca 0.12 0.16 0.04 0.00 0.70 0.00 0.00 55.95 56.96 1x1v s SER 100 Cb -0.06 -1.54 -0.00 0.00 -1.71 0.00 0.00 66.02 62.71 1x1v s SER 100 CO 0.08 0.35 -0.16 -0.31 1.20 0.00 0.00 173.24 174.40 1x1v s TYR 101 N -0.98 1.62 0.00 3.44 1.51 0.34 -5.00 117.35 118.27 1x1v s TYR 101 Ca 0.16 -0.49 0.00 0.00 -1.01 0.00 0.00 57.07 55.73 1x1v s TYR 101 Cb -0.12 -1.11 0.00 0.00 -0.11 0.00 0.00 41.96 40.63 1x1v s TYR 101 CO 0.06 -0.18 0.00 0.41 -1.11 0.00 0.00 175.55 174.72 1x1v n GLY 102 N 3.27 -0.85 3.82 0.71 0.00 -1.26 -1.99 105.19 108.89 1x1v n GLY 102 Ca -0.19 -1.20 -0.30 0.00 0.00 0.00 0.00 46.02 44.34 1x1v n GLY 102 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x1v s PRO 103 N 0.00 2.03 -0.01 1.61 0.04 -1.26 -4.96 135.00 132.44 1x1v s PRO 103 Ca 0.00 0.52 0.05 0.00 0.04 0.00 0.00 61.00 61.61 1x1v s PRO 103 Cb 0.00 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 1x1v s PRO 103 CO 0.00 -1.63 -0.17 -0.06 0.04 0.00 0.00 177.00 175.18 1x1v s PHE 104 N -3.23 2.60 0.00 0.56 0.40 0.21 -4.84 117.98 113.68 1x1v s PHE 104 Ca 0.61 -0.23 0.00 0.00 -0.60 0.00 0.00 56.93 56.71 1x1v s PHE 104 Cb -0.14 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 41.84 1x1v s PHE 104 CO 0.53 0.19 0.00 0.41 0.70 0.00 0.00 175.22 177.05 1x1v n GLY 105 N 2.02 2.45 0.09 4.36 0.00 -1.26 -0.52 105.19 112.33 1x1v n GLY 105 Ca -0.17 -1.74 0.06 0.00 0.00 0.00 0.00 46.02 44.18 1x1v n GLY 105 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1x1v n ASN 106 N 0.00 1.97 -4.19 1.61 3.02 -0.66 -4.71 115.26 112.29 1x1v n ASN 106 Ca 0.00 -2.65 -0.36 0.00 -0.03 0.00 0.00 54.58 51.54 1x1v n ASN 106 Cb 0.00 -0.29 -0.13 0.00 -0.61 0.00 0.00 39.78 38.75 1x1v n ASN 106 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1x1v s THR 107 N -2.05 3.22 0.81 3.41 2.01 -0.22 -4.96 115.64 117.85 1x1v s THR 107 Ca 0.20 -1.41 -0.12 0.00 0.31 0.00 0.00 61.69 60.68 1x1v s THR 107 Cb 0.18 -2.89 0.08 0.00 0.01 0.00 0.00 72.50 69.88 1x1v s THR 107 CO 0.02 -0.20 1.14 -0.83 -0.69 0.00 0.00 174.62 174.06 1x1v s GLY 108 N 1.36 1.86 0.00 4.40 0.00 -1.26 -3.80 107.32 109.88 1x1v s GLY 108 Ca -0.03 0.54 0.00 0.00 0.00 0.00 0.00 44.72 45.23 1x1v s GLY 108 CO -0.00 0.92 0.00 0.61 0.00 0.00 0.00 173.10 174.63 1x1v n GLY 109 N -0.29 1.94 3.66 0.20 0.00 -1.26 -4.71 105.19 104.72 1x1v n GLY 109 Ca 0.11 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 1x1v n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x1v s THR 110 N -0.50 4.44 0.51 2.61 2.01 0.17 -4.75 115.64 120.12 1x1v s THR 110 Ca 0.00 1.72 -0.19 0.00 0.31 0.00 0.00 61.69 63.53 1x1v s THR 110 Cb 0.00 -4.16 -0.07 0.00 0.01 0.00 0.00 72.50 68.27 1x1v s THR 110 CO 0.00 -0.21 1.05 -2.16 -0.69 0.00 0.00 174.62 172.61 1x1v s PRO 111 N 3.46 3.70 0.10 4.92 0.04 -1.26 -1.06 135.00 144.90 1x1v s PRO 111 Ca 0.50 1.34 0.01 0.00 0.04 0.00 0.00 61.00 62.89 1x1v s PRO 111 Cb -0.18 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1x1v s PRO 111 CO 0.12 -0.52 -0.02 -0.59 0.04 0.00 0.00 177.00 176.03 1x1v s PHE 112 N -2.05 0.85 -0.23 0.56 -0.12 -0.54 -4.93 117.98 111.51 1x1v s PHE 112 Ca 0.67 -1.03 -0.19 0.00 -0.05 0.00 0.00 56.93 56.33 1x1v s PHE 112 Cb -0.17 -0.51 0.06 0.00 -0.63 0.00 0.00 43.02 41.78 1x1v s PHE 112 CO 0.23 -0.29 0.61 -1.54 -0.05 0.00 0.00 175.22 174.18 1x1v s SER 113 N -3.04 -0.69 -0.45 1.98 1.04 -1.26 -2.27 113.70 109.00 1x1v s SER 113 Ca 0.15 1.26 0.03 0.00 0.48 0.00 0.00 55.95 57.86 1x1v s SER 113 Cb 0.07 1.22 0.15 0.00 0.10 0.00 0.00 66.02 67.56 1x1v s SER 113 CO -0.03 -0.22 0.30 -0.22 0.98 0.00 0.00 173.24 174.05 1x1v s LEU 114 N 0.75 2.23 0.27 2.42 2.96 0.18 -4.99 118.68 122.50 1x1v s LEU 114 Ca -0.03 -2.86 -0.29 0.00 -0.22 0.00 0.00 54.13 50.72 1x1v s LEU 114 Cb -0.05 -0.80 -0.09 0.00 0.50 0.00 0.00 46.19 45.75 1x1v s LEU 114 CO -0.06 -0.22 1.00 -2.16 -1.32 0.00 0.00 176.35 173.60 1x1v s PRO 115 N 0.14 4.74 -0.36 0.98 0.04 -1.26 -1.92 135.00 137.36 1x1v s PRO 115 Ca 0.24 1.59 0.04 0.00 0.04 0.00 0.00 61.00 62.90 1x1v s PRO 115 Cb -0.12 -3.19 0.10 0.00 0.04 0.00 0.00 34.50 31.34 1x1v s PRO 115 CO -0.09 0.37 0.08 0.42 0.04 0.00 0.00 177.00 177.82 1x1v s ILE 116 N -1.22 2.20 0.25 0.56 1.01 -0.70 -4.96 121.20 118.33 1x1v s ILE 116 Ca 0.43 -2.38 0.02 0.00 0.00 0.00 0.00 60.65 58.72 1x1v s ILE 116 Cb -0.27 -2.62 0.00 0.00 0.01 0.00 0.00 42.46 39.58 1x1v s ILE 116 CO 0.34 -0.63 1.62 0.00 0.00 0.00 0.00 174.94 176.28 1x1v h ALA 117 N 7.52 0.93 -3.17 9.38 0.00 -1.96 -3.42 119.26 128.54 1x1v h ALA 117 Ca -0.05 -0.45 -0.22 0.00 0.00 0.00 0.00 54.91 54.19 1x1v h ALA 117 Cb 1.01 -0.10 -0.31 0.00 0.00 0.00 0.00 17.79 18.39 1x1v h ALA 117 CO 0.53 0.64 -0.55 0.00 0.00 0.00 0.00 179.25 179.87 1x1v s ALA 118 N -4.13 -0.39 0.00 0.00 0.00 -1.26 -5.12 121.76 110.86 1x1v s ALA 118 Ca -0.06 0.79 0.00 0.00 0.00 0.00 0.00 51.96 52.69 1x1v s ALA 118 Cb 0.13 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1x1v s ALA 118 CO 0.80 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.81 1x1v n GLY 119 N 4.14 -0.51 3.44 0.00 0.00 -1.26 -4.97 105.19 106.03 1x1v n GLY 119 Ca -0.25 -2.25 -0.10 0.00 0.00 0.00 0.00 46.02 43.42 1x1v n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x1v s LYS 120 N -0.50 1.33 -0.13 1.61 0.00 -0.48 -4.78 119.74 116.79 1x1v s LYS 120 Ca 0.00 -1.21 -0.19 0.00 0.00 0.00 0.00 55.97 54.57 1x1v s LYS 120 Cb 0.00 0.42 -0.04 0.00 0.00 0.00 0.00 37.83 38.21 1x1v s LYS 120 CO 0.00 -0.52 0.53 0.42 0.00 0.00 0.00 175.35 175.78 1x1v s ILE 121 N -3.99 5.14 -0.30 3.79 1.01 -0.11 -2.25 121.20 124.49 1x1v s ILE 121 Ca 0.20 1.05 0.03 0.00 0.00 0.00 0.00 60.65 61.93 1x1v s ILE 121 Cb 0.02 -3.87 0.04 0.00 0.01 0.00 0.00 42.46 38.66 1x1v s ILE 121 CO 0.04 0.27 0.73 -1.54 0.00 0.00 0.00 174.94 174.44 1x1v n SER 122 N 3.98 1.52 0.00 3.58 3.41 -0.89 -4.56 113.62 120.67 1x1v n SER 122 Ca -0.05 -1.38 0.00 0.00 -0.26 0.00 0.00 58.87 57.18 1x1v n SER 122 Cb 0.51 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1x1v n SER 122 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x1v n GLY 123 N 0.02 0.25 3.18 5.00 0.00 -1.26 0.65 105.19 113.04 1x1v n GLY 123 Ca 0.02 -1.11 -0.16 0.00 0.00 0.00 0.00 46.02 44.77 1x1v n GLY 123 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x1v s PHE 124 N -2.00 1.15 0.16 1.61 0.08 -1.26 -1.34 117.98 116.39 1x1v s PHE 124 Ca 0.00 -0.57 -0.05 0.00 0.12 0.00 0.00 56.93 56.43 1x1v s PHE 124 Cb 0.00 -0.63 -0.03 0.00 -0.57 0.00 0.00 43.02 41.80 1x1v s PHE 124 CO 0.00 0.04 0.18 -0.59 -0.10 0.00 0.00 175.22 174.75 1x1v s PHE 125 N -2.00 0.72 -3.88 0.36 -0.12 -0.99 -1.90 117.98 110.17 1x1v s PHE 125 Ca 0.03 -1.06 0.00 0.00 -0.05 0.00 0.00 56.93 55.85 1x1v s PHE 125 Cb -0.06 -0.30 0.00 0.00 -0.63 0.00 0.00 43.02 42.04 1x1v s PHE 125 CO 0.01 -0.65 0.00 0.41 -0.05 0.00 0.00 175.22 174.94 1x1v n GLY 126 N -0.19 -0.54 3.06 1.99 0.00 -0.63 0.58 105.19 109.46 1x1v n GLY 126 Ca -0.04 -0.67 -0.16 0.00 0.00 0.00 0.00 46.02 45.15 1x1v n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x1v s ARG 127 N -1.73 0.62 -0.03 1.61 0.52 -0.87 -0.52 118.95 118.56 1x1v s ARG 127 Ca 0.00 -0.61 -0.11 0.00 -0.52 0.00 0.00 55.73 54.49 1x1v s ARG 127 Cb 0.00 -0.51 0.02 0.00 0.52 0.00 0.00 34.95 34.97 1x1v s ARG 127 CO 0.00 0.12 0.24 0.20 0.02 0.00 0.00 175.30 175.88 1x1v s GLY 128 N -1.07 -0.10 0.00 -3.53 0.00 -0.06 -2.52 107.32 100.04 1x1v s GLY 128 Ca -0.03 0.27 0.00 0.00 0.00 0.00 0.00 44.72 44.96 1x1v s GLY 128 CO 0.01 0.11 0.00 0.61 0.00 0.00 0.00 173.10 173.83 1x1v n GLY 129 N 1.72 2.49 0.18 0.20 0.00 -1.26 -1.51 105.19 107.01 1x1v n GLY 129 Ca -0.20 -0.20 -0.08 0.00 0.00 0.00 0.00 46.02 45.54 1x1v n GLY 129 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1x1v h ASP 130 N 0.00 0.46 -3.31 1.61 3.58 -1.92 -2.36 116.42 114.48 1x1v h ASP 130 Ca 0.00 -0.28 -0.53 0.00 0.42 0.00 0.00 57.03 56.64 1x1v h ASP 130 Cb 0.00 -0.14 -0.13 0.00 1.72 0.00 0.00 39.33 40.78 1x1v h ASP 130 CO 0.00 0.99 -0.54 -0.36 -2.88 0.00 0.00 179.24 176.45 1x1v s PHE 131 N -3.76 1.79 -0.86 0.28 2.99 -1.25 -4.19 117.98 112.98 1x1v s PHE 131 Ca -0.06 -1.23 -0.25 0.00 0.00 0.00 0.00 56.93 55.39 1x1v s PHE 131 Cb 0.11 -1.15 0.04 0.00 0.00 0.00 0.00 43.02 42.02 1x1v s PHE 131 CO 0.83 -0.27 1.36 0.42 -0.00 0.00 0.00 175.22 177.56 1x1v s ILE 132 N -3.27 3.80 0.26 0.64 1.01 -0.43 -4.57 121.20 118.64 1x1v s ILE 132 Ca 0.27 -0.10 -0.04 0.00 0.00 0.00 0.00 60.65 60.78 1x1v s ILE 132 Cb 0.04 -4.97 0.16 0.00 0.01 0.00 0.00 42.46 37.70 1x1v s ILE 132 CO 0.15 -1.89 1.82 0.44 0.00 0.00 0.00 174.94 175.46 1x1v h ASP 133 N 9.96 0.92 -4.88 3.58 3.32 -1.77 -0.29 116.42 127.26 1x1v h ASP 133 Ca -0.07 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.83 1x1v h ASP 133 Cb 1.03 -0.24 -0.15 0.00 0.22 0.00 0.00 39.33 40.19 1x1v h ASP 133 CO 1.34 0.84 0.27 0.00 -1.72 0.00 0.00 179.24 179.98 1x1v s ALA 134 N -5.40 -1.71 -0.06 3.45 0.00 -1.05 -0.59 121.76 116.40 1x1v s ALA 134 Ca -0.11 0.90 -0.06 0.00 0.00 0.00 0.00 51.96 52.70 1x1v s ALA 134 Cb 0.16 0.43 0.02 0.00 0.00 0.00 0.00 23.12 23.72 1x1v s ALA 134 CO 0.82 -0.60 0.17 -1.50 0.00 0.00 0.00 175.76 174.64 1x1v s ILE 135 N -2.67 -0.00 0.34 0.00 2.07 -0.49 -2.04 121.20 118.40 1x1v s ILE 135 Ca -0.02 0.01 0.06 0.00 -1.41 0.00 0.00 60.65 59.29 1x1v s ILE 135 Cb -0.01 -0.24 -0.03 0.00 0.13 0.00 0.00 42.46 42.31 1x1v s ILE 135 CO -0.04 0.01 0.23 -0.83 -1.91 0.00 0.00 174.94 172.40 1x1v s GLY 136 N 0.17 2.33 -0.08 1.50 0.00 0.20 -0.55 107.32 110.89 1x1v s GLY 136 Ca -0.01 -1.85 -0.06 0.00 0.00 0.00 0.00 44.72 42.80 1x1v s GLY 136 CO -0.00 -1.55 0.19 0.14 0.00 0.00 0.00 173.10 171.88 1x1v s VAL 137 N -3.45 -0.02 0.21 1.40 1.01 -0.39 -2.35 120.40 116.81 1x1v s VAL 137 Ca 0.37 0.06 -0.25 0.00 0.00 0.00 0.00 61.98 62.16 1x1v s VAL 137 Cb 0.03 -0.28 -0.08 0.00 0.00 0.00 0.00 36.38 36.04 1x1v s VAL 137 CO 0.24 0.03 0.82 -0.31 0.00 0.00 0.00 175.10 175.87 1x1v s TYR 138 N 0.54 3.85 0.06 5.22 1.51 -0.45 -0.83 117.35 127.27 1x1v s TYR 138 Ca -0.04 1.67 0.09 0.00 -1.01 0.00 0.00 57.07 57.79 1x1v s TYR 138 Cb -0.05 -2.80 -0.03 0.00 -0.11 0.00 0.00 41.96 38.96 1x1v s TYR 138 CO -0.03 0.44 -0.25 -0.51 -1.11 0.00 0.00 175.55 174.08 1x1v s LEU 139 N -1.41 2.26 0.05 -1.29 1.43 -0.10 -2.09 118.68 117.54 1x1v s LEU 139 Ca 0.40 -0.61 -0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1x1v s LEU 139 Cb -0.22 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 1x1v s LEU 139 CO 0.26 0.24 -0.04 -1.61 0.23 0.00 0.00 176.35 175.43 1x1v s GLU 140 N -1.46 0.54 0.00 1.70 2.02 -0.95 -4.46 118.70 116.09 1x1v s GLU 140 Ca 0.13 -1.01 0.00 0.00 0.02 0.00 0.00 54.97 54.11 1x1v s GLU 140 Cb -0.10 0.08 0.00 0.00 0.10 0.00 0.00 34.13 34.21 1x1v s GLU 140 CO 0.03 -0.06 0.34 -2.30 0.02 0.00 0.00 175.26 173.29