#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y1v n THR 3 N 0.00 0.00 -1.95 12.58 -1.04 -1.26 -4.86 114.28 117.75 1y1v n THR 3 Ca 0.00 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.73 1y1v n THR 3 Cb 0.00 0.00 0.19 0.00 -1.82 0.00 0.00 70.33 68.70 1y1v n THR 3 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 1y1v n PHE 4 N -0.01 -3.91 -3.97 -1.42 1.16 -1.26 -5.11 117.46 102.94 1y1v n PHE 4 Ca 0.00 -1.18 -0.09 0.00 -1.87 0.00 0.00 57.45 54.31 1y1v n PHE 4 Cb 0.00 -0.97 -0.08 0.00 -1.61 0.00 0.00 39.48 36.82 1y1v n PHE 4 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 1y1v s ARG 5 N -5.73 0.92 0.22 3.97 3.52 -1.26 -5.14 118.95 115.45 1y1v s ARG 5 Ca 0.72 -1.14 0.11 0.00 -0.13 0.00 0.00 55.73 55.28 1y1v s ARG 5 Cb -0.02 0.32 -0.05 0.00 -1.56 0.00 0.00 34.95 33.64 1y1v s ARG 5 CO 0.50 -0.29 -0.17 -0.06 -0.81 0.00 0.00 175.30 174.48 1y1v s PHE 6 N -3.93 2.43 0.00 5.12 0.40 -1.26 -3.53 117.98 117.20 1y1v s PHE 6 Ca 0.12 -0.30 0.00 0.00 -0.60 0.00 0.00 56.93 56.15 1y1v s PHE 6 Cb 0.05 -1.14 0.00 0.00 0.51 0.00 0.00 43.02 42.44 1y1v s PHE 6 CO -0.05 0.58 0.00 0.00 0.70 0.00 0.00 175.22 176.45 1y1v n ARG 8 N 0.00 1.50 0.00 0.00 1.74 -1.26 -4.54 116.66 114.10 1y1v n ARG 8 Ca 0.00 -1.31 0.00 0.00 -0.77 0.00 0.00 57.85 55.77 1y1v n ARG 8 Cb 0.00 0.32 0.00 0.00 -1.02 0.00 0.00 32.46 31.76 1y1v n ARG 8 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1y1v n ASP 9 N -1.24 0.00 -1.27 0.55 5.75 -1.26 -2.71 116.55 116.37 1y1v n ASP 9 Ca -0.06 0.00 0.04 0.00 -0.01 0.00 0.00 54.79 54.76 1y1v n ASP 9 Cb 0.23 0.00 0.28 0.00 -1.03 0.00 0.00 41.12 40.60 1y1v n ASP 9 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1y1v n ASN 11 N -0.37 0.00 0.00 0.00 2.85 -1.10 -4.91 115.26 111.73 1y1v n ASN 11 Ca 0.27 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.74 1y1v n ASN 11 Cb 1.05 0.00 0.00 0.00 1.24 0.00 0.00 39.78 42.07 1y1v n ASN 11 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1y1v n ASN 12 N 0.00 0.00 -4.91 1.20 5.03 -1.26 -4.94 115.26 110.38 1y1v n ASN 12 Ca 0.00 0.00 -0.25 0.00 0.87 0.00 0.00 54.58 55.20 1y1v n ASN 12 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 38.73 1y1v n ASN 12 CO 0.00 0.00 0.00 -0.32 -1.83 0.00 0.00 177.26 175.11 1y1v s MET 13 N 4.36 3.27 -0.24 3.52 -2.45 -1.26 -4.41 119.30 122.10 1y1v s MET 13 Ca 0.00 -0.73 0.00 0.00 -1.25 0.00 0.00 55.69 53.71 1y1v s MET 13 Cb 0.00 -2.84 0.04 0.00 1.25 0.00 0.00 34.83 33.27 1y1v s MET 13 CO 0.00 0.49 -0.10 -0.51 1.05 0.00 0.00 175.02 175.94 1y1v s LEU 14 N -3.40 3.08 -0.18 4.11 1.43 -1.23 -4.60 118.68 117.89 1y1v s LEU 14 Ca 0.33 -1.02 -0.09 0.00 -1.03 0.00 0.00 54.13 52.33 1y1v s LEU 14 Cb -0.10 -1.59 -0.05 0.00 0.03 0.00 0.00 46.19 44.48 1y1v s LEU 14 CO 0.27 -0.13 0.11 -0.31 0.23 0.00 0.00 176.35 176.53 1y1v s TYR 15 N 1.24 3.40 0.43 0.29 1.51 -1.03 -4.64 117.35 118.56 1y1v s TYR 15 Ca -0.02 0.31 -0.23 0.00 -1.01 0.00 0.00 57.07 56.12 1y1v s TYR 15 Cb -0.17 -2.09 -0.09 0.00 -0.11 0.00 0.00 41.96 39.50 1y1v s TYR 15 CO -0.06 0.35 1.05 -1.25 -1.11 0.00 0.00 175.55 174.53 1y1v s PRO 16 N 0.06 4.03 0.07 -1.71 0.04 -1.26 -0.60 135.00 135.63 1y1v s PRO 16 Ca 0.08 1.46 -0.04 0.00 0.04 0.00 0.00 61.00 62.55 1y1v s PRO 16 Cb -0.11 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 32.02 1y1v s PRO 16 CO -0.00 -0.25 0.06 1.03 0.04 0.00 0.00 177.00 177.88 1y1v s ARG 17 N -2.76 0.71 -0.11 4.56 0.52 0.33 -4.95 118.95 117.25 1y1v s ARG 17 Ca 0.61 -1.12 -0.03 0.00 -0.52 0.00 0.00 55.73 54.67 1y1v s ARG 17 Cb -0.20 0.26 -0.03 0.00 0.52 0.00 0.00 34.95 35.50 1y1v s ARG 17 CO 0.25 -0.18 0.00 -2.00 0.02 0.00 0.00 175.30 173.39 1y1v s GLU 18 N -3.90 3.27 -0.65 3.54 2.12 -1.26 -1.54 118.70 120.27 1y1v s GLU 18 Ca 0.07 -0.42 -0.20 0.00 0.36 0.00 0.00 54.97 54.77 1y1v s GLU 18 Cb 0.07 -2.87 0.10 0.00 0.26 0.00 0.00 34.13 31.68 1y1v s GLU 18 CO -0.10 0.54 0.84 0.34 -0.54 0.00 0.00 175.26 176.34 1y1v s ASP 19 N -0.44 6.24 0.06 -1.70 -1.08 -0.29 -4.92 116.67 114.52 1y1v s ASP 19 Ca 0.08 -1.37 -0.33 0.00 -0.52 0.00 0.00 52.55 50.41 1y1v s ASP 19 Cb -0.12 -2.35 -0.18 0.00 -1.46 0.00 0.00 42.92 38.81 1y1v s ASP 19 CO 0.02 -1.21 1.49 0.11 0.52 0.00 0.00 175.17 176.10 1y1v h LYS 20 N 9.25 -1.10 -0.25 4.34 1.57 -1.97 0.23 116.57 128.64 1y1v h LYS 20 Ca -0.24 0.07 0.06 0.00 -1.87 0.00 0.00 60.65 58.67 1y1v h LYS 20 Cb 1.07 0.25 -0.08 0.00 0.08 0.00 0.00 32.23 33.56 1y1v h LYS 20 CO 1.12 -0.73 -0.40 1.49 -0.57 0.00 0.00 179.45 180.36 1y1v h GLU 21 N -1.14 -0.38 -0.07 3.15 4.81 -1.99 -2.30 114.58 116.66 1y1v h GLU 21 Ca -0.11 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1y1v h GLU 21 Cb 0.89 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.35 1y1v h GLU 21 CO 0.16 -0.25 0.00 0.09 -0.73 0.00 0.00 179.01 178.28 1y1v n ASN 22 N -5.42 1.28 -3.36 1.04 3.02 -1.24 -4.99 115.26 105.59 1y1v n ASN 22 Ca -0.02 -1.52 -0.12 0.00 -0.03 0.00 0.00 54.58 52.89 1y1v n ASN 22 Cb 0.35 -0.04 0.01 0.00 -0.61 0.00 0.00 39.78 39.49 1y1v n ASN 22 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1y1v n ASN 23 N 0.03 -6.58 -3.90 6.41 4.13 0.78 -5.02 115.26 111.10 1y1v n ASN 23 Ca 0.18 -0.50 -0.09 0.00 1.68 0.00 0.00 54.58 55.85 1y1v n ASN 23 Cb 0.30 -4.10 -0.04 0.00 -1.54 0.00 0.00 39.78 34.39 1y1v n ASN 23 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1y1v s ARG 24 N -4.08 1.55 -0.15 3.52 1.70 -0.96 -4.99 118.95 115.53 1y1v s ARG 24 Ca 0.12 -1.09 -0.15 0.00 -0.47 0.00 0.00 55.73 54.15 1y1v s ARG 24 Cb -0.03 0.51 -0.05 0.00 -0.57 0.00 0.00 34.95 34.82 1y1v s ARG 24 CO 0.80 -0.66 0.33 -1.17 -1.08 0.00 0.00 175.30 173.51 1y1v s LEU 25 N -2.96 4.25 0.01 -1.89 2.96 -1.26 -1.14 118.68 118.65 1y1v s LEU 25 Ca 0.16 0.56 0.03 0.00 -0.22 0.00 0.00 54.13 54.66 1y1v s LEU 25 Cb -0.02 -2.43 -0.01 0.00 0.50 0.00 0.00 46.19 44.23 1y1v s LEU 25 CO 0.05 0.08 -0.10 -0.76 -1.32 0.00 0.00 176.35 174.30 1y1v s LEU 26 N 0.50 2.08 0.46 -0.68 1.43 -0.59 -0.03 118.68 121.85 1y1v s LEU 26 Ca 0.18 -0.28 0.08 0.00 -1.03 0.00 0.00 54.13 53.09 1y1v s LEU 26 Cb -0.13 -0.48 0.02 0.00 0.03 0.00 0.00 46.19 45.62 1y1v s LEU 26 CO 0.05 0.07 0.56 -0.36 0.23 0.00 0.00 176.35 176.90 1y1v s PHE 27 N -0.48 2.41 0.05 0.29 2.99 -0.31 0.12 117.98 123.05 1y1v s PHE 27 Ca 0.02 -0.52 -0.08 0.00 0.00 0.00 0.00 56.93 56.35 1y1v s PHE 27 Cb -0.05 -2.27 0.03 0.00 0.00 0.00 0.00 43.02 40.73 1y1v s PHE 27 CO 0.00 -0.51 0.38 -0.85 -0.00 0.00 0.00 175.22 174.24 1y1v n GLU 28 N -1.86 0.21 -4.72 0.44 0.28 0.23 -3.15 120.64 112.07 1y1v n GLU 28 Ca 0.08 -0.49 -0.30 0.00 -0.16 0.00 0.00 57.16 56.29 1y1v n GLU 28 Cb 0.61 0.68 -0.17 0.00 1.43 0.00 0.00 31.44 33.98 1y1v n GLU 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1y1v n ARG 30 N 3.96 1.34 -0.03 0.00 1.74 -1.26 -4.24 116.66 118.16 1y1v n ARG 30 Ca -0.20 -0.88 -0.04 0.00 -0.77 0.00 0.00 57.85 55.96 1y1v n ARG 30 Cb 0.52 -1.48 -0.01 0.00 -1.02 0.00 0.00 32.46 30.46 1y1v n ARG 30 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1y1v n THR 31 N -0.06 0.66 0.00 0.55 -1.04 -1.26 -5.02 114.28 108.10 1y1v n THR 31 Ca 0.14 0.32 0.00 0.00 -2.04 0.00 0.00 64.05 62.48 1y1v n THR 31 Cb 0.39 -1.82 0.00 0.00 -1.82 0.00 0.00 70.33 67.08 1y1v n THR 31 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1y1v n SER 33 N 0.00 2.24 -2.97 0.00 7.64 -1.26 -4.82 113.62 114.44 1y1v n SER 33 Ca 0.00 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.61 1y1v n SER 33 Cb 0.00 0.34 0.02 0.00 -1.01 0.00 0.00 64.21 63.55 1y1v n SER 33 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y1v n TYR 34 N -0.92 -2.93 -3.66 1.43 -0.00 -1.26 -4.71 117.16 105.11 1y1v n TYR 34 Ca 0.00 0.15 -0.08 0.00 -0.00 0.00 0.00 57.90 57.98 1y1v n TYR 34 Cb 0.11 -1.12 -0.08 0.00 -0.00 0.00 0.00 39.34 38.25 1y1v n TYR 34 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 1y1v s VAL 35 N -1.44 -0.11 0.09 2.97 1.01 -1.26 -3.18 120.40 118.48 1y1v s VAL 35 Ca 0.35 0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.43 1y1v s VAL 35 Cb -0.24 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 1y1v s VAL 35 CO 0.54 0.01 -0.16 -1.83 0.00 0.00 0.00 175.10 173.66 1y1v s GLU 36 N 1.71 0.95 0.70 2.72 -1.05 -1.19 -4.99 118.70 117.55 1y1v s GLU 36 Ca -0.09 -1.06 -0.15 0.00 -0.15 0.00 0.00 54.97 53.51 1y1v s GLU 36 Cb -0.07 -1.03 0.03 0.00 -0.44 0.00 0.00 34.13 32.62 1y1v s GLU 36 CO -0.18 0.23 1.19 -1.83 0.95 0.00 0.00 175.26 175.63 1y1v s GLU 37 N -1.91 2.33 0.93 -4.83 -1.05 -1.26 -1.16 118.70 111.75 1y1v s GLU 37 Ca 0.02 1.71 -0.11 0.00 -0.15 0.00 0.00 54.97 56.44 1y1v s GLU 37 Cb -0.09 -1.86 0.11 0.00 -0.44 0.00 0.00 34.13 31.84 1y1v s GLU 37 CO 0.03 -1.68 0.86 0.00 0.95 0.00 0.00 175.26 175.42 1y1v n ALA 38 N -2.55 -1.52 -0.03 -0.84 0.00 0.95 -4.71 120.51 111.81 1y1v n ALA 38 Ca 0.13 -0.58 -0.01 0.00 0.00 0.00 0.00 53.44 52.98 1y1v n ALA 38 Cb 0.50 -2.04 -0.09 0.00 0.00 0.00 0.00 19.45 17.83 1y1v n ALA 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y1v n GLY 39 N 0.75 -0.52 3.51 0.00 0.00 -1.26 -5.05 105.19 102.62 1y1v n GLY 39 Ca 0.10 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.82 1y1v n GLY 39 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y1v s SER 40 N -3.94 -0.35 0.00 1.61 1.04 -1.26 -5.05 113.70 105.76 1y1v s SER 40 Ca -0.05 0.00 0.25 0.00 0.48 0.00 0.00 55.95 56.63 1y1v s SER 40 Cb 0.05 0.37 1.22 0.00 0.10 0.00 0.00 66.02 67.75 1y1v s SER 40 CO 0.45 -0.59 1.82 -0.81 0.98 0.00 0.00 173.24 175.09 1y1v n PRO 41 N -0.22 0.29 -2.55 4.02 -0.04 -1.26 -4.73 135.00 130.52 1y1v n PRO 41 Ca -0.08 0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 63.02 1y1v n PRO 41 Cb 0.61 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.55 1y1v n PRO 41 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1y1v s LEU 42 N -2.65 3.41 -0.01 1.53 2.96 -1.26 -4.89 118.68 117.77 1y1v s LEU 42 Ca 0.21 0.08 0.21 0.00 -0.22 0.00 0.00 54.13 54.41 1y1v s LEU 42 Cb 0.17 -3.08 -0.26 0.00 0.50 0.00 0.00 46.19 43.52 1y1v s LEU 42 CO 0.39 -1.56 0.75 0.52 -1.32 0.00 0.00 176.35 175.13 1y1v n VAL 43 N 6.67 0.00 -3.62 1.68 0.31 -1.26 -5.01 118.33 117.11 1y1v n VAL 43 Ca 0.09 -0.16 -0.09 0.00 -0.01 0.00 0.00 64.34 64.17 1y1v n VAL 43 Cb 0.49 0.69 -0.06 0.00 -0.91 0.00 0.00 33.84 34.05 1y1v n VAL 43 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 1y1v s TYR 44 N -3.11 -0.37 -0.09 3.52 5.04 -1.26 -5.11 117.35 115.97 1y1v s TYR 44 Ca 0.03 0.81 -0.04 0.00 -2.44 0.00 0.00 57.07 55.43 1y1v s TYR 44 Cb 0.15 0.41 0.04 0.00 0.35 0.00 0.00 41.96 42.92 1y1v s TYR 44 CO 0.86 -0.24 0.20 0.50 -1.34 0.00 0.00 175.55 175.52 1y1v s ARG 45 N -0.36 0.15 -0.67 4.97 3.52 -1.26 -5.09 118.95 120.22 1y1v s ARG 45 Ca 0.02 0.47 0.05 0.00 -0.13 0.00 0.00 55.73 56.13 1y1v s ARG 45 Cb -0.03 -0.15 0.29 0.00 -1.56 0.00 0.00 34.95 33.50 1y1v s ARG 45 CO -0.04 -0.17 0.92 1.58 -0.81 0.00 0.00 175.30 176.77 1y1v n HIS 46 N 4.26 3.66 -1.58 5.12 -0.00 -1.26 -5.07 115.22 120.35 1y1v n HIS 46 Ca -0.25 -3.92 -0.46 0.00 0.46 0.00 0.00 57.72 53.54 1y1v n HIS 46 Cb 0.52 -0.61 -0.04 0.00 -0.12 0.00 0.00 29.99 29.74 1y1v n HIS 46 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1y1v n GLU 47 N 0.47 1.86 0.00 1.57 1.02 -1.26 -4.88 120.64 119.42 1y1v n GLU 47 Ca 0.31 0.57 0.00 0.00 -0.02 0.00 0.00 57.16 58.02 1y1v n GLU 47 Cb 0.39 -2.90 0.00 0.00 -0.02 0.00 0.00 31.44 28.91 1y1v n GLU 47 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1y1v n LEU 48 N 9.84 0.28 -4.74 -4.62 4.77 -1.26 -4.87 117.00 116.40 1y1v n LEU 48 Ca 0.31 0.20 -0.41 0.00 -0.03 0.00 0.00 56.01 56.07 1y1v n LEU 48 Cb 0.36 -0.40 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 1y1v n LEU 48 CO 0.70 -0.40 0.97 -0.63 -1.33 0.00 0.00 177.39 176.69 1y1v s ILE 49 N -0.81 3.21 -0.08 -0.08 1.01 -1.26 -5.01 121.20 118.18 1y1v s ILE 49 Ca 0.00 1.02 -0.00 0.00 0.00 0.00 0.00 60.65 61.67 1y1v s ILE 49 Cb 0.00 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.84 1y1v s ILE 49 CO 0.00 0.17 -0.05 -0.89 0.00 0.00 0.00 174.94 174.17 1y1v s THR 50 N -0.08 0.71 -0.54 2.92 2.01 -1.26 -5.10 115.64 114.30 1y1v s THR 50 Ca 0.55 -0.14 -0.17 0.00 0.31 0.00 0.00 61.69 62.24 1y1v s THR 50 Cb -0.36 -0.76 0.10 0.00 0.01 0.00 0.00 72.50 71.49 1y1v s THR 50 CO 0.40 0.30 0.56 0.20 -0.69 0.00 0.00 174.62 175.39 1y1v s ASN 51 N 1.48 6.18 -0.22 3.53 0.01 -1.26 -5.04 114.94 119.63 1y1v s ASN 51 Ca -0.01 -1.50 0.02 0.00 -0.71 0.00 0.00 52.86 50.65 1y1v s ASN 51 Cb -0.13 -2.24 0.04 0.00 0.41 0.00 0.00 41.25 39.32 1y1v s ASN 51 CO -0.04 -0.91 -0.15 -0.63 -1.51 0.00 0.00 177.10 173.86 1y1v s ILE 52 N 2.07 2.17 -0.33 0.60 1.01 -1.26 -5.05 121.20 120.42 1y1v s ILE 52 Ca 0.07 -1.24 0.00 0.00 0.00 0.00 0.00 60.65 59.49 1y1v s ILE 52 Cb -0.26 -2.09 0.10 0.00 0.01 0.00 0.00 42.46 40.23 1y1v s ILE 52 CO 0.06 0.27 0.11 -0.83 0.00 0.00 0.00 174.94 174.55 1y1v s GLY 53 N 1.21 1.28 0.38 6.18 0.00 -1.26 -5.01 107.32 110.11 1y1v s GLY 53 Ca -0.01 -1.92 0.08 0.00 0.00 0.00 0.00 44.72 42.86 1y1v s GLY 53 CO -0.09 1.50 0.06 -0.54 0.00 0.00 0.00 173.10 174.03 1y1v s GLU 54 N 1.35 2.09 0.33 2.90 2.02 -1.26 -5.10 118.70 121.03 1y1v s GLU 54 Ca 0.11 -1.86 0.08 0.00 0.02 0.00 0.00 54.97 53.32 1y1v s GLU 54 Cb -0.18 -1.87 -0.06 0.00 0.10 0.00 0.00 34.13 32.11 1y1v s GLU 54 CO -0.19 0.02 -0.07 0.99 0.02 0.00 0.00 175.26 176.03 1y1v s THR 55 N -2.59 2.02 -0.13 3.63 2.01 -1.26 -4.26 115.64 115.07 1y1v s THR 55 Ca 0.37 -2.16 -0.08 0.00 0.31 0.00 0.00 61.69 60.13 1y1v s THR 55 Cb 0.03 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.86 1y1v s THR 55 CO 0.20 -0.20 0.16 0.00 -0.69 0.00 0.00 174.62 174.09 1y1v s ALA 56 N -2.75 3.83 -0.25 7.40 0.00 -1.26 -4.81 121.76 123.92 1y1v s ALA 56 Ca 0.32 -0.62 -0.28 0.00 0.00 0.00 0.00 51.96 51.38 1y1v s ALA 56 Cb 0.04 -2.04 -0.06 0.00 0.00 0.00 0.00 23.12 21.06 1y1v s ALA 56 CO 0.15 0.52 2.24 0.41 0.00 0.00 0.00 175.76 179.08 1y1v n GLY 57 N 2.27 0.92 3.67 0.00 0.00 -1.26 -4.90 105.19 105.89 1y1v n GLY 57 Ca -0.19 0.78 -0.43 0.00 0.00 0.00 0.00 46.02 46.19 1y1v n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y1v s VAL 58 N 8.57 4.41 -1.98 1.61 1.01 -1.26 -4.87 120.40 127.89 1y1v s VAL 58 Ca 1.02 1.70 0.21 0.00 0.00 0.00 0.00 61.98 64.91 1y1v s VAL 58 Cb -0.36 -4.10 0.58 0.00 0.00 0.00 0.00 36.38 32.50 1y1v s VAL 58 CO 0.36 -0.11 1.63 0.52 0.00 0.00 0.00 175.10 177.49 1y1v n VAL 59 N 5.17 0.02 0.00 2.92 0.31 -1.26 -4.83 118.33 120.66 1y1v n VAL 59 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 1y1v n VAL 59 Cb 0.46 -0.68 0.00 0.00 -0.91 0.00 0.00 33.84 32.71 1y1v n VAL 59 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1y1v n GLN 60 N -1.01 0.00 -0.33 5.55 6.02 -1.26 -4.79 117.38 121.56 1y1v n GLN 60 Ca 0.15 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.22 1y1v n GLN 60 Cb 0.08 -0.58 0.24 0.00 1.02 0.00 0.00 30.24 31.00 1y1v n GLN 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1y1v n ASP 61 N 0.00 3.08 -0.61 1.08 8.00 -1.26 -4.42 116.55 122.42 1y1v n ASP 61 Ca 0.00 -2.10 0.00 0.00 0.71 0.00 0.00 54.79 53.40 1y1v n ASP 61 Cb 0.00 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 1y1v n ASP 61 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1y1v n ILE 62 N 0.96 0.07 0.04 0.53 5.41 -1.26 0.13 119.36 125.23 1y1v n ILE 62 Ca 0.18 0.00 0.02 0.00 1.00 0.00 0.00 62.75 63.95 1y1v n ILE 62 Cb 0.52 -0.27 -0.03 0.00 -0.71 0.00 0.00 39.64 39.15 1y1v n ILE 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1y1v n GLY 63 N 0.46 -0.05 0.09 7.39 0.00 -1.26 -4.55 105.19 107.27 1y1v n GLY 63 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 1y1v n GLY 63 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1y1v h SER 64 N 0.00 0.00 -2.28 1.61 4.64 -0.67 -3.44 113.55 113.42 1y1v h SER 64 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 1y1v h SER 64 Cb 0.19 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.24 1y1v h SER 64 CO 0.00 0.67 1.25 -0.62 -0.87 0.00 0.00 176.83 177.27 1y1v s ASP 65 N -5.95 5.63 0.53 4.97 -1.08 -1.21 -4.87 116.67 114.69 1y1v s ASP 65 Ca -0.02 0.32 0.35 0.00 -0.52 0.00 0.00 52.55 52.67 1y1v s ASP 65 Cb 0.08 -2.54 1.69 0.00 -1.46 0.00 0.00 42.92 40.69 1y1v s ASP 65 CO 0.81 -2.10 2.05 1.55 0.52 0.00 0.00 175.17 178.00 1y1v h PRO 66 N 13.27 0.00 0.00 4.34 0.13 -1.95 -3.17 132.00 144.61 1y1v h PRO 66 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1y1v h PRO 66 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1y1v h PRO 66 CO 1.20 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 179.22 1y1v n THR 67 N -2.87 1.47 -3.74 1.56 -2.24 -1.26 -4.73 114.28 102.47 1y1v n THR 67 Ca -0.01 0.45 -0.24 0.00 -2.27 0.00 0.00 64.05 61.98 1y1v n THR 67 Cb 0.17 -1.38 -0.02 0.00 -2.10 0.00 0.00 70.33 67.00 1y1v n THR 67 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1y1v s LEU 68 N -3.40 4.22 0.45 3.22 1.43 -1.20 -5.11 118.68 118.29 1y1v s LEU 68 Ca 0.02 0.28 -0.06 0.00 -1.03 0.00 0.00 54.13 53.33 1y1v s LEU 68 Cb 0.04 -3.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.15 1y1v s LEU 68 CO 0.14 -0.10 0.76 -2.16 0.23 0.00 0.00 176.35 175.23 1y1v s PRO 69 N -3.74 3.61 0.11 1.29 0.04 -1.26 -5.04 135.00 130.01 1y1v s PRO 69 Ca 0.37 0.25 0.08 0.00 0.04 0.00 0.00 61.00 61.73 1y1v s PRO 69 Cb -0.10 -2.40 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 1y1v s PRO 69 CO 0.30 -0.13 -0.11 1.03 0.04 0.00 0.00 177.00 178.13 1y1v s ARG 70 N -4.44 2.06 0.11 4.56 1.81 -1.26 -3.68 118.95 118.11 1y1v s ARG 70 Ca 0.48 -1.07 0.04 0.00 -1.72 0.00 0.00 55.73 53.47 1y1v s ARG 70 Cb -0.10 -2.26 -0.04 0.00 -0.45 0.00 0.00 34.95 32.10 1y1v s ARG 70 CO 0.40 0.50 -0.11 -1.54 -0.68 0.00 0.00 175.30 173.87 1y1v s SER 71 N -2.23 1.65 -0.28 0.23 1.04 -1.23 -4.96 113.70 107.91 1y1v s SER 71 Ca 0.21 -0.86 0.11 0.00 0.48 0.00 0.00 55.95 55.89 1y1v s SER 71 Cb -0.11 -0.01 0.64 0.00 0.10 0.00 0.00 66.02 66.64 1y1v s SER 71 CO 0.13 -0.25 1.64 -0.90 0.98 0.00 0.00 173.24 174.83 1y1v n ASP 72 N 0.37 4.07 -3.49 7.02 5.75 -1.26 -3.13 116.55 125.88 1y1v n ASP 72 Ca -0.15 -3.29 0.00 0.00 -0.01 0.00 0.00 54.79 51.34 1y1v n ASP 72 Cb 0.58 -0.67 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1y1v n ASP 72 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1y1v n ARG 73 N -0.48 0.80 -3.68 0.11 1.74 -1.26 -4.91 116.66 108.98 1y1v n ARG 73 Ca 0.35 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 57.30 1y1v n ARG 73 Cb 1.19 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 32.50 1y1v n ARG 73 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1y1v s GLU 74 N -0.28 0.17 1.08 5.56 -1.05 -1.26 -4.37 118.70 118.55 1y1v s GLU 74 Ca 0.00 0.72 -0.15 0.00 -0.15 0.00 0.00 54.97 55.39 1y1v s GLU 74 Cb 0.00 -0.04 0.14 0.00 -0.44 0.00 0.00 34.13 33.79 1y1v s GLU 74 CO 0.00 -0.26 0.42 0.00 0.95 0.00 0.00 175.26 176.38 1y1v h PRO 76 N -2.11 0.00 0.00 0.00 0.11 -1.98 -3.34 132.00 124.68 1y1v h PRO 76 Ca -0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1y1v h PRO 76 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1y1v h PRO 76 CO 0.40 0.35 0.00 1.63 -0.21 0.00 0.00 178.00 180.17 1y1v n LYS 77 N -3.41 0.00 0.25 1.05 5.02 -1.26 -4.83 118.16 114.98 1y1v n LYS 77 Ca 0.00 0.00 0.18 0.00 -2.02 0.00 0.00 58.31 56.47 1y1v n LYS 77 Cb 0.53 -0.11 0.90 0.00 -0.02 0.00 0.00 35.03 36.33 1y1v n LYS 77 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y1v n HIS 79 N -3.59 -0.04 -1.18 0.00 8.25 -1.25 -4.97 115.22 112.43 1y1v n HIS 79 Ca -0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 1y1v n HIS 79 Cb 0.26 -3.45 0.24 0.00 1.12 0.00 0.00 29.99 28.15 1y1v n HIS 79 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1y1v s SER 80 N -2.73 1.10 -0.31 0.41 0.01 -1.26 -4.75 113.70 106.18 1y1v s SER 80 Ca 0.00 0.56 0.16 0.00 1.31 0.00 0.00 55.95 57.98 1y1v s SER 80 Cb 0.00 -0.75 0.47 0.00 0.21 0.00 0.00 66.02 65.95 1y1v s SER 80 CO 0.00 -4.00 1.08 0.54 0.41 0.00 0.00 173.24 171.27 1y1v n ARG 81 N -4.67 2.15 -3.72 12.44 1.74 -1.26 -3.99 116.66 119.35 1y1v n ARG 81 Ca 0.14 -3.70 -0.29 0.00 -0.77 0.00 0.00 57.85 53.23 1y1v n ARG 81 Cb 0.60 -1.72 -0.16 0.00 -1.02 0.00 0.00 32.46 30.16 1y1v n ARG 81 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1y1v s GLU 82 N -3.54 0.66 0.44 5.56 2.02 -1.26 -4.67 118.70 117.91 1y1v s GLU 82 Ca 0.34 -0.76 0.03 0.00 0.02 0.00 0.00 54.97 54.60 1y1v s GLU 82 Cb 0.39 -1.96 -0.03 0.00 0.10 0.00 0.00 34.13 32.63 1y1v s GLU 82 CO -0.02 -0.85 0.04 -0.80 0.02 0.00 0.00 175.26 173.65 1y1v s ASN 83 N 1.76 3.50 -0.38 -0.19 0.01 -1.18 -2.72 114.94 115.73 1y1v s ASN 83 Ca 0.05 -1.57 -0.03 0.00 -0.71 0.00 0.00 52.86 50.60 1y1v s ASN 83 Cb -0.17 0.27 0.20 0.00 0.41 0.00 0.00 41.25 41.96 1y1v s ASN 83 CO -0.20 -0.77 0.95 0.54 -1.51 0.00 0.00 177.10 176.11 1y1v s VAL 84 N -2.99 -0.48 1.02 1.60 0.11 -1.22 -3.53 120.40 114.92 1y1v s VAL 84 Ca 0.20 -0.28 -0.17 0.00 -2.93 0.00 0.00 61.98 58.80 1y1v s VAL 84 Cb 0.04 0.00 0.22 0.00 -1.53 0.00 0.00 36.38 35.11 1y1v s VAL 84 CO 0.10 0.00 1.26 0.72 -3.33 0.00 0.00 175.10 173.86 1y1v s PHE 85 N 1.34 1.35 0.00 1.54 -0.00 -1.24 -4.23 117.98 116.74 1y1v s PHE 85 Ca 0.21 0.38 0.00 0.00 -0.00 0.00 0.00 56.93 57.52 1y1v s PHE 85 Cb 0.05 -3.93 0.00 0.00 -0.00 0.00 0.00 43.02 39.15 1y1v s PHE 85 CO -0.10 -2.95 0.00 1.97 -0.00 0.00 0.00 175.22 174.14 1y1v n PHE 86 N -4.01 0.00 -3.99 3.49 1.16 -1.19 -4.55 117.46 108.36 1y1v n PHE 86 Ca 0.14 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.63 1y1v n PHE 86 Cb 0.59 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.41 1y1v n PHE 86 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 1y1v s GLN 87 N 4.76 1.55 -0.43 3.97 -0.21 -1.26 -3.83 119.66 124.21 1y1v s GLN 87 Ca 0.00 -1.24 -0.27 0.00 0.02 0.00 0.00 55.36 53.87 1y1v s GLN 87 Cb 0.00 0.47 -0.07 0.00 1.00 0.00 0.00 33.01 34.41 1y1v s GLN 87 CO 0.00 -0.64 2.37 0.45 -2.12 0.00 0.00 175.29 175.34 1y1v n SER 88 N -0.38 2.48 -0.38 5.90 2.88 -1.26 -4.78 113.62 118.08 1y1v n SER 88 Ca -0.02 -0.22 0.00 0.00 -1.33 0.00 0.00 58.87 57.30 1y1v n SER 88 Cb 0.62 -1.53 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 1y1v n SER 88 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1y1v n GLN 89 N 8.87 0.00 -2.96 -1.46 1.13 -1.26 -4.34 117.38 117.36 1y1v n GLN 89 Ca 0.37 0.00 -0.44 0.00 -1.94 0.00 0.00 57.00 54.99 1y1v n GLN 89 Cb 0.47 -0.99 -0.04 0.00 0.11 0.00 0.00 30.24 29.80 1y1v n GLN 89 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1y1v s GLN 90 N -1.19 3.12 -0.81 -1.09 0.74 -1.26 -4.90 119.66 114.27 1y1v s GLN 90 Ca 0.00 -0.91 -0.05 0.00 0.05 0.00 0.00 55.36 54.44 1y1v s GLN 90 Cb 0.00 -4.21 -0.05 0.00 1.10 0.00 0.00 33.01 29.86 1y1v s GLN 90 CO 0.00 -1.64 1.98 0.54 -0.55 0.00 0.00 175.29 175.62 1y1v n ARG 91 N 7.13 1.83 -4.38 1.67 5.12 -1.26 -4.80 116.66 121.97 1y1v n ARG 91 Ca -0.05 -1.36 -0.31 0.00 -1.93 0.00 0.00 57.85 54.20 1y1v n ARG 91 Cb 0.45 -2.41 -0.10 0.00 -1.16 0.00 0.00 32.46 29.24 1y1v n ARG 91 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1y1v s ARG 92 N 3.63 2.37 0.03 5.56 3.52 -1.26 -5.06 118.95 127.74 1y1v s ARG 92 Ca 0.35 -0.85 -0.28 0.00 -0.13 0.00 0.00 55.73 54.82 1y1v s ARG 92 Cb 0.09 -2.41 -0.15 0.00 -1.56 0.00 0.00 34.95 30.92 1y1v s ARG 92 CO -0.03 0.56 1.25 0.87 -0.81 0.00 0.00 175.30 177.14 1y1v h LYS 93 N 4.15 -0.96 0.00 5.12 1.57 -2.03 -3.24 116.57 121.19 1y1v h LYS 93 Ca -0.48 0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1y1v h LYS 93 Cb 1.17 0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.69 1y1v h LYS 93 CO 0.53 -0.64 0.09 0.38 -0.57 0.00 0.00 179.45 179.24 1y1v h ASP 94 N -1.14 0.00 -2.30 0.86 2.03 -1.97 -3.45 116.42 110.44 1y1v h ASP 94 Ca -0.10 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 55.64 1y1v h ASP 94 Cb 0.76 0.00 0.22 0.00 -0.83 0.00 0.00 39.33 39.49 1y1v h ASP 94 CO 0.17 0.00 -1.47 0.41 -1.03 0.00 0.00 179.24 177.32 1y1v n THR 95 N -2.46 0.12 -2.45 1.15 -1.04 -1.22 -4.99 114.28 103.38 1y1v n THR 95 Ca -0.02 -0.45 -0.19 0.00 -2.04 0.00 0.00 64.05 61.36 1y1v n THR 95 Cb 0.13 -0.15 0.10 0.00 -1.82 0.00 0.00 70.33 68.59 1y1v n THR 95 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1y1v n SER 96 N 2.36 0.98 -2.84 8.00 3.41 -1.26 -5.05 113.62 119.22 1y1v n SER 96 Ca 0.02 -1.86 -0.25 0.00 -0.26 0.00 0.00 58.87 56.51 1y1v n SER 96 Cb 0.54 -0.56 -0.02 0.00 -0.26 0.00 0.00 64.21 63.91 1y1v n SER 96 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1y1v n MET 97 N -2.58 2.89 -3.07 4.33 2.81 -1.26 -4.84 117.12 115.39 1y1v n MET 97 Ca 0.13 -4.50 -0.20 0.00 -1.81 0.00 0.00 57.70 51.32 1y1v n MET 97 Cb 0.48 -2.12 0.01 0.00 -0.71 0.00 0.00 33.22 30.88 1y1v n MET 97 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1y1v s VAL 98 N -4.41 3.60 -0.05 2.03 1.01 -1.26 -5.11 120.40 116.22 1y1v s VAL 98 Ca 0.46 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.71 1y1v s VAL 98 Cb 0.33 -3.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 1y1v s VAL 98 CO -0.13 -0.16 -0.10 -0.76 0.00 0.00 0.00 175.10 173.94 1y1v s LEU 99 N -4.45 2.96 -0.39 3.92 1.43 -1.26 -4.60 118.68 116.29 1y1v s LEU 99 Ca 0.50 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.48 1y1v s LEU 99 Cb -0.10 -1.64 0.11 0.00 0.03 0.00 0.00 46.19 44.59 1y1v s LEU 99 CO 0.35 0.34 0.15 -0.36 0.23 0.00 0.00 176.35 177.06 1y1v s PHE 100 N -0.80 3.65 0.44 0.29 0.40 -1.25 -3.40 117.98 117.31 1y1v s PHE 100 Ca 0.13 -2.74 -0.07 0.00 -0.60 0.00 0.00 56.93 53.65 1y1v s PHE 100 Cb -0.11 -3.07 0.10 0.00 0.51 0.00 0.00 43.02 40.45 1y1v s PHE 100 CO 0.02 -0.95 0.60 1.19 0.70 0.00 0.00 175.22 176.78 1y1v n PHE 101 N 4.33 -3.86 -3.64 0.36 3.01 -1.21 -3.20 117.46 113.25 1y1v n PHE 101 Ca 0.01 -0.60 -0.12 0.00 1.01 0.00 0.00 57.45 57.76 1y1v n PHE 101 Cb 0.41 -0.46 -0.07 0.00 -0.01 0.00 0.00 39.48 39.35 1y1v n PHE 101 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1y1v s VAL 102 N -2.20 -0.00 -0.01 -4.37 1.01 -1.26 -3.97 120.40 109.60 1y1v s VAL 102 Ca 0.35 0.00 -0.21 0.00 0.00 0.00 0.00 61.98 62.12 1y1v s VAL 102 Cb -0.01 -0.98 -0.05 0.00 0.00 0.00 0.00 36.38 35.34 1y1v s VAL 102 CO 0.24 0.00 0.61 0.00 0.00 0.00 0.00 175.10 175.95 1y1v n LEU 104 N 2.80 0.44 -2.41 0.00 4.77 -1.10 -2.48 117.00 119.02 1y1v n LEU 104 Ca -0.06 0.09 -0.26 0.00 -0.03 0.00 0.00 56.01 55.75 1y1v n LEU 104 Cb 0.51 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 1y1v n LEU 104 CO 0.44 0.10 0.17 -1.20 -1.33 0.00 0.00 177.39 175.57 1y1v n SER 105 N -1.32 4.59 0.00 -1.43 7.64 -1.26 -4.79 113.62 117.04 1y1v n SER 105 Ca 0.08 -3.67 0.00 0.00 1.01 0.00 0.00 58.87 56.29 1y1v n SER 105 Cb 0.33 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 1y1v n SER 105 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y1v n SER 107 N 0.00 -1.19 -4.53 0.00 7.64 -1.03 -5.05 113.62 109.45 1y1v n SER 107 Ca 0.00 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.54 1y1v n SER 107 Cb 0.00 -0.30 -0.12 0.00 -1.01 0.00 0.00 64.21 62.79 1y1v n SER 107 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1y1v s HIS 108 N -2.31 3.08 -0.72 1.43 5.65 -1.26 -4.90 115.29 116.26 1y1v s HIS 108 Ca 0.00 -0.21 -0.22 0.00 0.25 0.00 0.00 55.06 54.88 1y1v s HIS 108 Cb 0.00 -1.99 0.08 0.00 -1.18 0.00 0.00 32.58 29.49 1y1v s HIS 108 CO 0.00 0.01 1.01 0.42 -0.65 0.00 0.00 174.74 175.53 1y1v s ILE 109 N 0.38 4.40 -0.21 0.89 1.01 -1.26 -3.40 121.20 123.00 1y1v s ILE 109 Ca -0.02 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.02 1y1v s ILE 109 Cb -0.14 -4.71 0.03 0.00 0.01 0.00 0.00 42.46 37.65 1y1v s ILE 109 CO 0.02 -1.48 -0.16 0.72 0.00 0.00 0.00 174.94 174.04 1y1v s PHE 110 N 3.81 2.90 0.60 3.97 -0.12 -1.25 -4.98 117.98 122.90 1y1v s PHE 110 Ca 0.25 -1.85 -0.10 0.00 -0.05 0.00 0.00 56.93 55.17 1y1v s PHE 110 Cb -0.14 -1.90 0.15 0.00 -0.63 0.00 0.00 43.02 40.50 1y1v s PHE 110 CO 0.06 -0.82 0.49 2.41 -0.05 0.00 0.00 175.22 177.30 1y1v n THR 111 N 4.57 0.00 -0.65 -4.49 -1.04 -1.26 -3.31 114.28 108.09 1y1v n THR 111 Ca -0.18 -0.18 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 1y1v n THR 111 Cb 0.47 -0.97 0.00 0.00 -1.82 0.00 0.00 70.33 68.01 1y1v n THR 111 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1y1v n SER 112 N -3.97 0.69 -4.18 8.00 3.41 -1.22 -4.90 113.62 111.45 1y1v n SER 112 Ca 0.07 -1.34 -0.35 0.00 -0.26 0.00 0.00 58.87 56.99 1y1v n SER 112 Cb 0.28 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.34 1y1v n SER 112 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1y1v n ASP 113 N -0.17 -2.75 -2.69 4.04 -0.08 -1.26 -4.98 116.55 108.66 1y1v n ASP 113 Ca 0.00 -0.04 -0.05 0.00 -1.51 0.00 0.00 54.79 53.19 1y1v n ASP 113 Cb 0.40 -0.81 0.12 0.00 2.34 0.00 0.00 41.12 43.17 1y1v n ASP 113 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1y1v n GLN 114 N -0.29 1.28 0.10 -0.67 6.02 -1.26 -4.97 117.38 117.59 1y1v n GLN 114 Ca -0.00 -1.69 0.00 0.00 -0.01 0.00 0.00 57.00 55.30 1y1v n GLN 114 Cb 0.66 0.05 0.00 0.00 1.02 0.00 0.00 30.24 31.97 1y1v n GLN 114 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1y1v n LYS 115 N -0.94 0.00 -2.32 -1.09 5.02 -1.26 -5.15 118.16 112.43 1y1v n LYS 115 Ca -0.08 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.96 1y1v n LYS 115 Cb 0.86 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.94 1y1v n LYS 115 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1y1v s ASN 116 N -1.83 4.83 -0.05 4.39 0.01 -1.26 -5.11 114.94 115.91 1y1v s ASN 116 Ca 0.00 0.29 -0.00 0.00 -0.71 0.00 0.00 52.86 52.43 1y1v s ASN 116 Cb 0.00 -0.95 0.03 0.00 0.41 0.00 0.00 41.25 40.74 1y1v s ASN 116 CO 0.00 -1.55 -0.01 -0.54 -1.51 0.00 0.00 177.10 173.49 1y1v s LYS 117 N -5.15 0.51 -0.02 -0.60 1.02 -1.26 -4.93 119.74 109.30 1y1v s LYS 117 Ca 0.60 0.07 0.06 0.00 0.02 0.00 0.00 55.97 56.72 1y1v s LYS 117 Cb -0.10 -0.75 -0.01 0.00 -0.52 0.00 0.00 37.83 36.45 1y1v s LYS 117 CO 0.44 -0.20 -0.21 1.03 -0.92 0.00 0.00 175.35 175.49 1y1v s ARG 118 N 1.43 1.83 -0.00 1.68 0.52 -1.26 -4.99 118.95 118.16 1y1v s ARG 118 Ca -0.04 -0.76 0.06 0.00 -0.52 0.00 0.00 55.73 54.47 1y1v s ARG 118 Cb -0.13 -1.71 -0.07 0.00 0.52 0.00 0.00 34.95 33.56 1y1v s ARG 118 CO -0.03 0.42 0.20 2.41 0.02 0.00 0.00 175.30 178.33 1y1v n THR 119 N 2.68 0.00 1.12 0.02 -1.04 -1.26 -4.94 114.28 110.85 1y1v n THR 119 Ca -0.16 -0.30 0.12 0.00 -2.04 0.00 0.00 64.05 61.68 1y1v n THR 119 Cb 0.53 0.81 0.20 0.00 -1.82 0.00 0.00 70.33 70.05 1y1v n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43