#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yt2 s SER 2 N 0.00 2.35 -0.02 1.61 0.15 -1.26 -5.17 113.70 111.37 2yt2 s SER 2 Ca 0.00 -1.44 -0.03 0.00 0.70 0.00 0.00 55.95 55.18 2yt2 s SER 2 Cb 0.00 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.37 2yt2 s SER 2 CO 0.00 -0.68 0.07 -0.55 1.20 0.00 0.00 173.24 173.28 2yt2 s SER 3 N -3.50 -0.03 -0.29 5.45 0.15 -1.26 -5.16 113.70 109.07 2yt2 s SER 3 Ca 0.34 0.02 -0.24 0.00 0.70 0.00 0.00 55.95 56.77 2yt2 s SER 3 Cb 0.07 0.16 0.15 0.00 -1.71 0.00 0.00 66.02 64.70 2yt2 s SER 3 CO 0.15 -0.11 1.18 -0.83 1.20 0.00 0.00 173.24 174.83 2yt2 s GLY 4 N -0.36 0.07 0.11 9.45 0.00 -1.26 -5.03 107.32 110.30 2yt2 s GLY 4 Ca -0.04 3.05 -0.25 0.00 0.00 0.00 0.00 44.72 47.48 2yt2 s GLY 4 CO 0.00 1.96 0.61 -0.56 0.00 0.00 0.00 173.10 175.11 2yt2 s SER 5 N 0.26 -0.58 -0.10 1.64 0.01 -1.26 -5.16 113.70 108.51 2yt2 s SER 5 Ca 0.03 0.16 0.02 0.00 1.31 0.00 0.00 55.95 57.48 2yt2 s SER 5 Cb -0.05 0.58 -0.01 0.00 0.21 0.00 0.00 66.02 66.75 2yt2 s SER 5 CO -0.10 -0.88 -0.17 -0.44 0.41 0.00 0.00 173.24 172.06 2yt2 s SER 6 N -2.38 3.72 -0.65 2.44 0.01 -1.26 -5.06 113.70 110.53 2yt2 s SER 6 Ca -0.02 -0.37 0.06 0.00 1.31 0.00 0.00 55.95 56.93 2yt2 s SER 6 Cb -0.01 -1.32 0.25 0.00 0.21 0.00 0.00 66.02 65.15 2yt2 s SER 6 CO -0.07 0.21 0.75 0.61 0.41 0.00 0.00 173.24 175.15 2yt2 n GLY 7 N 3.20 4.80 3.26 3.44 0.00 -1.26 -5.07 105.19 113.57 2yt2 n GLY 7 Ca -0.18 -2.77 -0.59 0.00 0.00 0.00 0.00 46.02 42.48 2yt2 n GLY 7 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2yt2 n LEU 8 N 0.89 1.05 -4.69 0.99 -0.00 -1.26 -4.92 117.00 109.05 2yt2 n LEU 8 Ca 0.30 1.03 -0.26 0.00 -0.00 0.00 0.00 56.01 57.08 2yt2 n LEU 8 Cb 0.41 -0.77 -0.07 0.00 -0.00 0.00 0.00 43.42 42.99 2yt2 n LEU 8 CO 0.41 -0.73 -0.30 0.21 -0.00 0.00 0.00 177.39 176.97 2yt2 s ASN 9 N 2.66 4.90 0.18 1.96 3.84 -1.26 -5.03 114.94 122.19 2yt2 s ASN 9 Ca 0.92 -0.38 -0.27 0.00 0.21 0.00 0.00 52.86 53.34 2yt2 s ASN 9 Cb -1.31 -1.08 0.03 0.00 -0.55 0.00 0.00 41.25 38.34 2yt2 s ASN 9 CO 0.71 0.07 1.54 0.54 -2.79 0.00 0.00 177.10 177.17 2yt2 n ARG 10 N -0.31 -0.37 -0.87 0.43 1.74 -1.26 -4.47 116.66 111.54 2yt2 n ARG 10 Ca -0.09 1.52 -0.31 0.00 -0.77 0.00 0.00 57.85 58.20 2yt2 n ARG 10 Cb 0.56 -2.24 0.15 0.00 -1.02 0.00 0.00 32.46 29.91 2yt2 n ARG 10 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2yt2 s ASP 11 N -5.45 3.22 -1.10 0.55 1.01 -1.26 -4.94 116.67 108.71 2yt2 s ASP 11 Ca -0.13 1.99 -0.04 0.00 0.71 0.00 0.00 52.55 55.09 2yt2 s ASP 11 Cb 0.14 -2.51 0.29 0.00 1.01 0.00 0.00 42.92 41.85 2yt2 s ASP 11 CO 0.65 -2.88 1.65 -1.20 0.21 0.00 0.00 175.17 173.60 2yt2 n SER 12 N -4.08 6.63 -3.76 0.27 7.64 -1.26 -4.94 113.62 114.12 2yt2 n SER 12 Ca 0.10 -3.45 -0.15 0.00 1.01 0.00 0.00 58.87 56.38 2yt2 n SER 12 Cb 0.53 -1.27 -0.16 0.00 -1.01 0.00 0.00 64.21 62.30 2yt2 n SER 12 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2yt2 s VAL 13 N -2.84 -0.06 -0.25 0.44 0.11 -1.26 -5.12 120.40 111.42 2yt2 s VAL 13 Ca 0.35 0.23 -0.29 0.00 -2.93 0.00 0.00 61.98 59.34 2yt2 s VAL 13 Cb 0.10 -0.11 -0.02 0.00 -1.53 0.00 0.00 36.38 34.81 2yt2 s VAL 13 CO 0.03 0.09 1.63 -2.16 -3.33 0.00 0.00 175.10 171.37 2yt2 s PRO 14 N 1.17 3.70 0.26 1.54 0.04 -1.26 -4.84 135.00 135.61 2yt2 s PRO 14 Ca -0.08 1.57 0.15 0.00 0.04 0.00 0.00 61.00 62.68 2yt2 s PRO 14 Cb -0.13 -4.06 0.79 0.00 0.04 0.00 0.00 34.50 31.14 2yt2 s PRO 14 CO -0.03 -1.41 1.39 -0.40 0.04 0.00 0.00 177.00 176.59 2yt2 n ASP 15 N 8.79 0.38 -1.78 6.66 5.75 -1.26 0.27 116.55 135.36 2yt2 n ASP 15 Ca 0.19 0.62 0.06 0.00 -0.01 0.00 0.00 54.79 55.66 2yt2 n ASP 15 Cb 0.46 -0.63 0.38 0.00 -1.03 0.00 0.00 41.12 40.30 2yt2 n ASP 15 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2yt2 n ASN 16 N -2.03 5.48 -4.68 -1.12 6.94 -1.26 -4.99 115.26 113.61 2yt2 n ASN 16 Ca -0.01 -2.97 -0.45 0.00 -0.02 0.00 0.00 54.58 51.13 2yt2 n ASN 16 Cb 0.15 -0.67 -0.04 0.00 -2.36 0.00 0.00 39.78 36.86 2yt2 n ASN 16 CO 0.00 0.00 0.00 1.57 -1.03 0.00 0.00 177.26 177.80 2yt2 n HIS 17 N 0.43 2.41 -0.11 -2.53 -0.00 0.14 -4.89 115.22 110.67 2yt2 n HIS 17 Ca 0.28 0.04 -0.13 0.00 0.46 0.00 0.00 57.72 58.38 2yt2 n HIS 17 Cb 1.18 -2.64 -0.01 0.00 -0.12 0.00 0.00 29.99 28.39 2yt2 n HIS 17 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2yt2 h PRO 18 N 7.79 0.91 0.00 1.57 0.13 -1.94 -3.39 132.00 137.08 2yt2 h PRO 18 Ca -0.46 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.18 2yt2 h PRO 18 Cb 1.25 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2yt2 h PRO 18 CO 0.93 1.14 -0.36 -2.37 -0.23 0.00 0.00 178.00 177.10 2yt2 n THR 19 N -4.05 0.71 -1.72 1.56 5.66 -1.26 -4.89 114.28 110.29 2yt2 n THR 19 Ca -0.02 0.34 -0.41 0.00 -3.05 0.00 0.00 64.05 60.91 2yt2 n THR 19 Cb 0.55 -1.93 0.01 0.00 -1.55 0.00 0.00 70.33 67.41 2yt2 n THR 19 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2yt2 n LYS 20 N -3.44 2.12 -3.28 1.09 5.02 -1.26 -4.08 118.16 114.33 2yt2 n LYS 20 Ca -0.05 0.75 -0.05 0.00 -2.02 0.00 0.00 58.31 56.94 2yt2 n LYS 20 Cb 0.19 -2.44 -0.05 0.00 -0.02 0.00 0.00 35.03 32.70 2yt2 n LYS 20 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2yt2 s PHE 21 N -1.16 -1.11 -0.17 2.13 0.08 -0.72 -4.53 117.98 112.50 2yt2 s PHE 21 Ca 0.59 0.94 -0.29 0.00 0.12 0.00 0.00 56.93 58.29 2yt2 s PHE 21 Cb -0.51 0.13 -0.06 0.00 -0.57 0.00 0.00 43.02 42.01 2yt2 s PHE 21 CO 0.60 -0.84 2.11 0.15 -0.10 0.00 0.00 175.22 177.14 2yt2 s LYS 22 N 2.64 3.41 0.31 0.44 3.01 -1.26 -2.62 119.74 125.66 2yt2 s LYS 22 Ca 0.14 2.11 0.06 0.00 -1.01 0.00 0.00 55.97 57.26 2yt2 s LYS 22 Cb -0.14 -4.30 -0.06 0.00 -1.01 0.00 0.00 37.83 32.32 2yt2 s LYS 22 CO -0.21 -1.79 -0.01 0.14 0.51 0.00 0.00 175.35 174.00 2yt2 s VAL 23 N 7.18 1.54 -0.13 3.17 -7.23 -1.16 -4.72 120.40 119.06 2yt2 s VAL 23 Ca 0.95 -2.07 -0.04 0.00 -1.81 0.00 0.00 61.98 59.02 2yt2 s VAL 23 Cb -0.34 -2.65 0.05 0.00 0.56 0.00 0.00 36.38 34.01 2yt2 s VAL 23 CO 0.36 -0.16 0.11 -0.89 -0.31 0.00 0.00 175.10 174.22 2yt2 s THR 24 N -3.06 -0.15 0.31 5.32 2.01 -0.89 -2.57 115.64 116.61 2yt2 s THR 24 Ca 0.33 0.07 -0.29 0.00 0.31 0.00 0.00 61.69 62.11 2yt2 s THR 24 Cb 0.06 -0.44 -0.11 0.00 0.01 0.00 0.00 72.50 72.03 2yt2 s THR 24 CO 0.14 -0.09 1.49 0.21 -0.69 0.00 0.00 174.62 175.68 2yt2 s ASN 25 N 2.19 6.48 0.27 3.53 3.84 -1.05 -0.51 114.94 129.70 2yt2 s ASN 25 Ca 0.04 2.88 0.01 0.00 0.21 0.00 0.00 52.86 56.00 2yt2 s ASN 25 Cb -0.14 -2.64 -0.05 0.00 -0.55 0.00 0.00 41.25 37.86 2yt2 s ASN 25 CO -0.07 -0.80 0.11 0.68 -2.79 0.00 0.00 177.10 174.23 2yt2 s VAL 26 N -0.50 0.48 0.66 -5.21 -7.23 -0.95 -1.91 120.40 105.74 2yt2 s VAL 26 Ca 0.57 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.79 2yt2 s VAL 26 Cb -0.45 -2.60 0.12 0.00 0.56 0.00 0.00 36.38 34.00 2yt2 s VAL 26 CO 0.52 0.00 0.91 -1.81 -0.31 0.00 0.00 175.10 174.41 2yt2 s ASP 27 N -3.32 4.65 0.57 4.85 1.11 -1.23 -4.66 116.67 118.64 2yt2 s ASP 27 Ca 0.37 -0.64 0.30 0.00 0.18 0.00 0.00 52.55 52.76 2yt2 s ASP 27 Cb 0.07 0.22 1.44 0.00 1.07 0.00 0.00 42.92 45.73 2yt2 s ASP 27 CO 0.14 -1.66 1.85 -0.78 1.18 0.00 0.00 175.17 175.90 2yt2 h ASP 28 N -0.22 0.00 0.66 0.27 3.58 -1.95 0.45 116.42 119.21 2yt2 h ASP 28 Ca -0.32 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 56.88 2yt2 h ASP 28 Cb 1.28 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.28 2yt2 h ASP 28 CO 0.39 0.00 -1.48 -0.33 -2.88 0.00 0.00 179.24 174.94 2yt2 h GLU 29 N 0.00 0.00 0.00 0.28 5.08 -2.04 -3.48 114.58 114.42 2yt2 h GLU 29 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2yt2 h GLU 29 Cb 1.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.78 2yt2 h GLU 29 CO -0.00 0.56 0.00 0.41 -1.00 0.00 0.00 179.01 178.98 2yt2 n GLY 30 N 1.48 1.60 3.54 -3.84 0.00 0.16 -5.08 105.19 103.05 2yt2 n GLY 30 Ca -0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 2yt2 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yt2 s VAL 31 N -2.00 4.85 -0.05 1.61 1.01 -1.26 -4.75 120.40 119.81 2yt2 s VAL 31 Ca 0.00 0.30 -0.36 0.00 0.00 0.00 0.00 61.98 61.91 2yt2 s VAL 31 Cb 0.00 -4.15 -0.14 0.00 0.00 0.00 0.00 36.38 32.08 2yt2 s VAL 31 CO 0.00 -0.49 1.67 -0.62 0.00 0.00 0.00 175.10 175.66 2yt2 n GLU 32 N 6.18 1.68 -0.04 2.72 1.02 -1.26 -3.52 120.64 127.42 2yt2 n GLU 32 Ca -0.01 0.61 -0.07 0.00 -0.02 0.00 0.00 57.16 57.67 2yt2 n GLU 32 Cb 0.48 -2.36 -0.02 0.00 -0.02 0.00 0.00 31.44 29.52 2yt2 n GLU 32 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2yt2 n LEU 33 N 4.74 1.61 -3.76 -4.62 4.77 -0.80 -5.02 117.00 113.92 2yt2 n LEU 33 Ca 0.22 0.26 -0.13 0.00 -0.03 0.00 0.00 56.01 56.32 2yt2 n LEU 33 Cb 0.23 -0.59 -0.09 0.00 -2.33 0.00 0.00 43.42 40.63 2yt2 n LEU 33 CO 0.71 -0.37 0.02 -0.83 -1.33 0.00 0.00 177.39 175.59 2yt2 s GLY 34 N -4.65 -0.20 0.21 -0.72 0.00 -1.25 -4.78 107.32 95.93 2yt2 s GLY 34 Ca -0.19 0.59 -0.05 0.00 0.00 0.00 0.00 44.72 45.07 2yt2 s GLY 34 CO 0.28 0.41 0.46 -1.35 0.00 0.00 0.00 173.10 172.90 2yt2 s SER 35 N -0.73 6.48 0.29 1.64 1.04 -1.26 -2.53 113.70 118.63 2yt2 s SER 35 Ca -0.08 0.64 -0.19 0.00 0.48 0.00 0.00 55.95 56.80 2yt2 s SER 35 Cb -0.04 -2.11 0.02 0.00 0.10 0.00 0.00 66.02 63.99 2yt2 s SER 35 CO 0.03 -0.06 0.69 -0.83 0.98 0.00 0.00 173.24 174.05 2yt2 s GLY 36 N -2.78 0.05 -0.28 7.32 0.00 -1.06 -4.54 107.32 106.03 2yt2 s GLY 36 Ca 0.42 -0.44 -0.11 0.00 0.00 0.00 0.00 44.72 44.60 2yt2 s GLY 36 CO 0.26 -0.19 0.18 0.14 0.00 0.00 0.00 173.10 173.49 2yt2 s VAL 37 N -3.75 5.12 -0.51 1.40 1.01 -0.99 -3.00 120.40 119.68 2yt2 s VAL 37 Ca 0.13 0.04 -0.19 0.00 0.00 0.00 0.00 61.98 61.96 2yt2 s VAL 37 Cb -0.05 -3.46 0.06 0.00 0.00 0.00 0.00 36.38 32.92 2yt2 s VAL 37 CO 0.08 0.22 0.64 -0.32 0.00 0.00 0.00 175.10 175.72 2yt2 s MET 38 N 1.73 3.12 -0.07 2.72 1.75 -1.08 -0.75 119.30 126.73 2yt2 s MET 38 Ca 0.07 -0.90 -0.01 0.00 -1.25 0.00 0.00 55.69 53.59 2yt2 s MET 38 Cb -0.16 -4.11 -0.03 0.00 2.84 0.00 0.00 34.83 33.37 2yt2 s MET 38 CO 0.10 -1.25 0.00 -2.00 -0.65 0.00 0.00 175.02 171.21 2yt2 s GLU 39 N 2.67 2.94 -0.15 4.11 2.12 -0.27 -1.75 118.70 128.38 2yt2 s GLU 39 Ca 0.15 -0.44 0.01 0.00 0.36 0.00 0.00 54.97 55.04 2yt2 s GLU 39 Cb -0.19 -2.77 0.02 0.00 0.26 0.00 0.00 34.13 31.45 2yt2 s GLU 39 CO 0.12 0.69 -0.15 -0.51 -0.54 0.00 0.00 175.26 174.87 2yt2 s LEU 40 N -1.00 1.74 0.03 2.70 1.02 -1.26 -0.73 118.68 121.19 2yt2 s LEU 40 Ca 0.14 -0.50 0.07 0.00 0.02 0.00 0.00 54.13 53.87 2yt2 s LEU 40 Cb -0.11 -1.21 -0.02 0.00 0.02 0.00 0.00 46.19 44.87 2yt2 s LEU 40 CO 0.04 -0.04 -0.21 0.42 0.02 0.00 0.00 176.35 176.58 2yt2 s THR 41 N 1.41 1.65 0.51 5.49 -4.23 -1.10 -4.87 115.64 114.48 2yt2 s THR 41 Ca 0.04 -1.14 0.42 0.00 -1.18 0.00 0.00 61.69 59.83 2yt2 s THR 41 Cb -0.13 -1.42 0.63 0.00 1.34 0.00 0.00 72.50 72.92 2yt2 s THR 41 CO -0.10 0.24 1.58 1.56 -0.54 0.00 0.00 174.62 177.36 2yt2 h GLN 42 N 5.00 0.00 0.00 3.99 4.20 -2.00 -1.28 115.11 125.02 2yt2 h GLN 42 Ca -0.42 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.29 2yt2 h GLN 42 Cb 1.16 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.94 2yt2 h GLN 42 CO 0.44 0.00 0.00 0.43 -0.67 0.00 0.00 178.83 179.04 2yt2 n SER 43 N -4.31 0.00 -3.34 1.46 7.64 -1.26 -4.90 113.62 108.92 2yt2 n SER 43 Ca 0.43 0.78 -0.10 0.00 1.01 0.00 0.00 58.87 60.98 2yt2 n SER 43 Cb 1.81 -0.40 -0.01 0.00 -1.01 0.00 0.00 64.21 64.60 2yt2 n SER 43 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2yt2 s GLU 44 N -2.15 1.96 -0.02 1.43 1.03 -0.48 -4.64 118.70 115.84 2yt2 s GLU 44 Ca 0.00 -1.44 -0.28 0.00 0.03 0.00 0.00 54.97 53.28 2yt2 s GLU 44 Cb 0.00 0.54 -0.03 0.00 -0.80 0.00 0.00 34.13 33.84 2yt2 s GLU 44 CO 0.00 -0.87 0.91 -1.17 -1.33 0.00 0.00 175.26 172.80 2yt2 s LEU 45 N -3.09 4.36 0.15 1.83 0.20 0.33 -2.73 118.68 119.73 2yt2 s LEU 45 Ca 0.20 1.55 0.11 0.00 0.69 0.00 0.00 54.13 56.68 2yt2 s LEU 45 Cb -0.03 -3.45 -0.04 0.00 -0.43 0.00 0.00 46.19 42.24 2yt2 s LEU 45 CO 0.13 -0.22 -0.24 -0.69 -0.29 0.00 0.00 176.35 175.03 2yt2 s VAL 46 N 0.95 2.39 -0.24 1.68 1.01 0.10 0.16 120.40 126.45 2yt2 s VAL 46 Ca 0.48 -1.83 -0.03 0.00 0.00 0.00 0.00 61.98 60.61 2yt2 s VAL 46 Cb -0.20 -2.10 0.12 0.00 0.00 0.00 0.00 36.38 34.20 2yt2 s VAL 46 CO 0.26 0.01 0.30 -0.22 0.00 0.00 0.00 175.10 175.44 2yt2 s LEU 47 N -2.32 -0.34 0.52 3.92 0.20 -0.72 -1.11 118.68 118.82 2yt2 s LEU 47 Ca 0.17 -0.19 -0.17 0.00 0.69 0.00 0.00 54.13 54.64 2yt2 s LEU 47 Cb -0.09 0.69 -0.07 0.00 -0.43 0.00 0.00 46.19 46.29 2yt2 s LEU 47 CO 0.08 -0.33 1.00 -1.00 -0.29 0.00 0.00 176.35 175.81 2yt2 s HIS 48 N 2.42 3.36 -0.07 5.38 3.76 0.07 -2.45 115.29 127.76 2yt2 s HIS 48 Ca 0.10 1.48 -0.15 0.00 -0.15 0.00 0.00 55.06 56.34 2yt2 s HIS 48 Cb -0.15 -2.84 0.03 0.00 1.11 0.00 0.00 32.58 30.73 2yt2 s HIS 48 CO -0.19 -0.49 0.35 -0.51 -0.85 0.00 0.00 174.74 173.05 2yt2 s LEU 49 N -4.10 0.66 0.35 0.89 1.43 -1.26 -2.35 118.68 114.30 2yt2 s LEU 49 Ca 0.60 0.42 -0.27 0.00 -1.03 0.00 0.00 54.13 53.85 2yt2 s LEU 49 Cb -0.11 1.32 -0.09 0.00 0.03 0.00 0.00 46.19 47.34 2yt2 s LEU 49 CO 0.31 -0.31 1.10 -1.00 0.23 0.00 0.00 176.35 176.68 2yt2 s HIS 50 N -0.61 3.36 -1.74 0.29 3.76 -1.26 -3.43 115.29 115.66 2yt2 s HIS 50 Ca -0.07 1.65 -0.17 0.00 -0.15 0.00 0.00 55.06 56.32 2yt2 s HIS 50 Cb -0.04 -3.25 0.16 0.00 1.11 0.00 0.00 32.58 30.56 2yt2 s HIS 50 CO 0.03 -0.74 0.57 0.54 -0.85 0.00 0.00 174.74 174.29 2yt2 n ARG 51 N 0.52 -1.78 -3.64 1.40 5.12 -1.26 -4.89 116.66 112.14 2yt2 n ARG 51 Ca 0.02 0.23 -0.09 0.00 -1.93 0.00 0.00 57.85 56.08 2yt2 n ARG 51 Cb 0.47 -4.67 -0.07 0.00 -1.16 0.00 0.00 32.46 27.02 2yt2 n ARG 51 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2yt2 s ARG 52 N -7.11 0.58 1.10 5.56 0.52 -1.22 -5.17 118.95 113.21 2yt2 s ARG 52 Ca 0.63 0.74 -0.20 0.00 -0.52 0.00 0.00 55.73 56.38 2yt2 s ARG 52 Cb -0.36 0.25 0.07 0.00 0.52 0.00 0.00 34.95 35.44 2yt2 s ARG 52 CO 0.98 -0.08 -0.22 -0.85 0.02 0.00 0.00 175.30 175.16 2yt2 n GLU 53 N 2.65 -1.46 -3.76 3.54 0.00 -1.26 -4.22 120.64 116.12 2yt2 n GLU 53 Ca -0.14 -0.41 -0.35 0.00 0.00 0.00 0.00 57.16 56.25 2yt2 n GLU 53 Cb 0.56 -1.58 -0.08 0.00 0.00 0.00 0.00 31.44 30.35 2yt2 n GLU 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2yt2 s ALA 54 N -2.19 3.73 0.26 -1.84 0.00 -1.26 -4.38 121.76 116.08 2yt2 s ALA 54 Ca 0.52 -0.68 -0.07 0.00 0.00 0.00 0.00 51.96 51.72 2yt2 s ALA 54 Cb -0.08 -2.13 -0.06 0.00 0.00 0.00 0.00 23.12 20.85 2yt2 s ALA 54 CO 0.64 0.26 0.55 0.08 0.00 0.00 0.00 175.76 177.29 2yt2 s VAL 55 N 0.05 4.98 -0.05 0.00 1.01 -1.03 -4.95 120.40 120.41 2yt2 s VAL 55 Ca 0.10 0.28 -0.02 0.00 0.00 0.00 0.00 61.98 62.34 2yt2 s VAL 55 Cb -0.11 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.63 2yt2 s VAL 55 CO -0.01 -0.19 0.06 -0.13 0.00 0.00 0.00 175.10 174.83 2yt2 s ARG 56 N -3.16 -0.03 -0.27 2.72 0.52 -1.26 -1.76 118.95 115.70 2yt2 s ARG 56 Ca 0.46 0.33 -0.02 0.00 -0.52 0.00 0.00 55.73 55.97 2yt2 s ARG 56 Cb -0.11 -0.64 0.03 0.00 0.52 0.00 0.00 34.95 34.75 2yt2 s ARG 56 CO 0.26 -0.36 -0.02 -1.58 0.02 0.00 0.00 175.30 173.61 2yt2 s TRP 57 N 2.16 3.14 0.26 -0.53 0.51 0.12 -4.63 118.94 119.97 2yt2 s TRP 57 Ca 0.05 -1.59 -0.30 0.00 -2.12 0.00 0.00 56.10 52.14 2yt2 s TRP 57 Cb -0.12 -2.10 -0.09 0.00 -0.81 0.00 0.00 33.47 30.35 2yt2 s TRP 57 CO -0.04 -0.74 1.27 -1.25 -0.51 0.00 0.00 176.95 175.68 2yt2 s PRO 58 N 1.32 4.43 0.04 4.98 0.04 -1.26 -0.52 135.00 144.03 2yt2 s PRO 58 Ca -0.01 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 62.85 2yt2 s PRO 58 Cb -0.18 -3.16 -0.15 0.00 0.04 0.00 0.00 34.50 31.05 2yt2 s PRO 58 CO -0.03 -0.14 1.44 1.88 0.04 0.00 0.00 177.00 180.20 2yt2 h TYR 59 N 4.44 0.16 -0.23 0.56 0.05 -1.94 -2.53 116.97 117.47 2yt2 h TYR 59 Ca -0.46 -0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.35 2yt2 h TYR 59 Cb 1.22 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.91 2yt2 h TYR 59 CO 0.59 0.44 0.72 1.37 -1.05 0.00 0.00 178.16 180.23 2yt2 h LEU 60 N -0.16 0.00 0.00 3.88 8.10 -1.93 1.19 115.31 126.40 2yt2 h LEU 60 Ca 0.02 0.00 -0.29 0.00 0.11 0.00 0.00 57.88 57.72 2yt2 h LEU 60 Cb 0.38 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 40.54 2yt2 h LEU 60 CO 0.01 0.00 -2.01 0.00 -4.11 0.00 0.00 178.44 172.33 2yt2 n LEU 62 N -2.83 0.76 0.06 0.00 4.77 0.41 -4.13 117.00 116.04 2yt2 n LEU 62 Ca -0.23 -1.53 -0.13 0.00 -0.03 0.00 0.00 56.01 54.09 2yt2 n LEU 62 Cb 1.04 -1.38 -0.06 0.00 -2.33 0.00 0.00 43.42 40.69 2yt2 n LEU 62 CO 0.44 -2.57 0.62 -0.09 -1.33 0.00 0.00 177.39 174.46 2yt2 h ARG 63 N 11.84 -0.50 -4.62 3.23 2.43 -1.81 -3.39 114.38 121.55 2yt2 h ARG 63 Ca 0.01 0.03 -0.25 0.00 -0.81 0.00 0.00 59.98 58.96 2yt2 h ARG 63 Cb 1.02 0.11 -0.15 0.00 -0.42 0.00 0.00 29.97 30.54 2yt2 h ARG 63 CO 1.12 -0.34 -0.62 -0.98 -1.51 0.00 0.00 179.97 177.64 2yt2 s ARG 64 N -5.96 1.21 -0.02 0.20 1.70 -1.26 -3.74 118.95 111.09 2yt2 s ARG 64 Ca -0.16 -1.64 -0.30 0.00 -0.47 0.00 0.00 55.73 53.17 2yt2 s ARG 64 Cb 0.09 0.20 0.11 0.00 -0.57 0.00 0.00 34.95 34.77 2yt2 s ARG 64 CO 0.65 -0.37 1.01 1.52 -1.08 0.00 0.00 175.30 177.03 2yt2 s TYR 65 N -4.10 -0.23 0.08 5.89 1.13 -1.12 -2.12 117.35 116.89 2yt2 s TYR 65 Ca 0.38 0.08 -0.04 0.00 -1.41 0.00 0.00 57.07 56.08 2yt2 s TYR 65 Cb 0.07 0.55 0.02 0.00 -1.10 0.00 0.00 41.96 41.50 2yt2 s TYR 65 CO 0.12 -0.49 0.21 0.41 -2.51 0.00 0.00 175.55 173.28 2yt2 n GLY 66 N -0.28 1.61 3.57 5.49 0.00 -0.67 -0.24 105.19 114.68 2yt2 n GLY 66 Ca -0.06 -1.05 -0.02 0.00 0.00 0.00 0.00 46.02 44.89 2yt2 n GLY 66 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2yt2 s TYR 67 N -6.82 -0.88 0.45 1.61 1.13 -1.25 -3.36 117.35 108.23 2yt2 s TYR 67 Ca 0.04 1.62 0.02 0.00 -1.41 0.00 0.00 57.07 57.34 2yt2 s TYR 67 Cb -0.01 0.53 0.02 0.00 -1.10 0.00 0.00 41.96 41.40 2yt2 s TYR 67 CO 0.03 -0.43 0.18 -0.25 -2.51 0.00 0.00 175.55 172.56 2yt2 n ASP 68 N 4.60 2.83 -3.65 -0.18 9.92 -0.97 -4.75 116.55 124.35 2yt2 n ASP 68 Ca -0.15 -2.74 -0.52 0.00 -0.53 0.00 0.00 54.79 50.86 2yt2 n ASP 68 Cb 0.54 0.13 -0.09 0.00 -0.64 0.00 0.00 41.12 41.06 2yt2 n ASP 68 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2yt2 n SER 69 N -1.57 0.78 -3.85 -2.24 7.64 -1.26 0.52 113.62 113.64 2yt2 n SER 69 Ca -0.10 0.74 -0.24 0.00 1.01 0.00 0.00 58.87 60.28 2yt2 n SER 69 Cb 0.54 -0.73 -0.07 0.00 -1.01 0.00 0.00 64.21 62.94 2yt2 n SER 69 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2yt2 n ASN 70 N 4.83 0.46 -3.86 6.43 4.13 -1.26 -4.89 115.26 121.11 2yt2 n ASN 70 Ca 0.36 -0.96 -0.11 0.00 1.68 0.00 0.00 54.58 55.55 2yt2 n ASN 70 Cb -0.04 -1.19 -0.11 0.00 -1.54 0.00 0.00 39.78 36.90 2yt2 n ASN 70 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2yt2 s LEU 71 N -6.21 1.57 -0.20 3.41 2.96 0.18 -2.64 118.68 117.75 2yt2 s LEU 71 Ca 0.08 -0.04 -0.03 0.00 -0.22 0.00 0.00 54.13 53.92 2yt2 s LEU 71 Cb -0.05 0.56 0.06 0.00 0.50 0.00 0.00 46.19 47.27 2yt2 s LEU 71 CO 0.75 -0.25 0.04 0.12 -1.32 0.00 0.00 176.35 175.69 2yt2 s PHE 72 N -0.84 1.08 -0.02 5.38 5.36 -0.57 -2.29 117.98 126.07 2yt2 s PHE 72 Ca -0.09 -0.91 0.03 0.00 -0.96 0.00 0.00 56.93 55.00 2yt2 s PHE 72 Cb -0.05 -1.06 -0.00 0.00 -0.34 0.00 0.00 43.02 41.56 2yt2 s PHE 72 CO 0.01 -0.62 -0.11 0.45 -1.46 0.00 0.00 175.22 173.48 2yt2 s SER 73 N 1.84 1.39 0.07 6.13 0.15 -1.21 -1.03 113.70 121.03 2yt2 s SER 73 Ca -0.01 -0.22 -0.05 0.00 0.70 0.00 0.00 55.95 56.38 2yt2 s SER 73 Cb -0.17 -0.28 -0.02 0.00 -1.71 0.00 0.00 66.02 63.83 2yt2 s SER 73 CO -0.09 0.11 0.07 0.72 1.20 0.00 0.00 173.24 175.25 2yt2 s PHE 74 N -0.02 0.35 -0.22 3.44 -0.71 -1.01 -1.67 117.98 118.13 2yt2 s PHE 74 Ca 0.00 -0.83 -0.04 0.00 -1.04 0.00 0.00 56.93 55.02 2yt2 s PHE 74 Cb -0.07 -0.23 -0.01 0.00 -1.21 0.00 0.00 43.02 41.49 2yt2 s PHE 74 CO 0.00 -0.45 -0.03 -2.00 -1.34 0.00 0.00 175.22 171.40 2yt2 s GLU 75 N -3.83 3.40 -0.12 1.99 2.12 -0.90 -2.86 118.70 118.50 2yt2 s GLU 75 Ca 0.06 -0.61 -0.03 0.00 0.36 0.00 0.00 54.97 54.75 2yt2 s GLU 75 Cb 0.06 -3.05 -0.03 0.00 0.26 0.00 0.00 34.13 31.37 2yt2 s GLU 75 CO -0.10 -0.20 -0.02 0.45 -0.54 0.00 0.00 175.26 174.85 2yt2 s SER 76 N 1.49 5.03 0.00 -1.70 0.15 -1.21 -3.51 113.70 113.95 2yt2 s SER 76 Ca 0.06 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2yt2 s SER 76 Cb -0.14 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.59 2yt2 s SER 76 CO -0.03 0.29 0.00 0.61 1.20 0.00 0.00 173.24 175.31 2yt2 n GLY 77 N 2.75 -3.41 0.01 9.45 0.00 -1.26 -3.07 105.19 109.66 2yt2 n GLY 77 Ca -0.18 -1.16 0.10 0.00 0.00 0.00 0.00 46.02 44.78 2yt2 n GLY 77 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2yt2 n ARG 78 N 0.00 0.45 -1.23 1.61 1.85 -1.26 -2.01 116.66 116.07 2yt2 n ARG 78 Ca 0.00 -0.10 -0.36 0.00 -1.00 0.00 0.00 57.85 56.39 2yt2 n ARG 78 Cb 0.00 -1.49 -0.02 0.00 -1.05 0.00 0.00 32.46 29.90 2yt2 n ARG 78 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2yt2 n ARG 79 N -1.89 3.13 -3.83 2.89 1.74 -1.26 -4.39 116.66 113.06 2yt2 n ARG 79 Ca -0.00 -2.07 -0.09 0.00 -0.77 0.00 0.00 57.85 54.91 2yt2 n ARG 79 Cb 0.44 -2.79 0.02 0.00 -1.02 0.00 0.00 32.46 29.11 2yt2 n ARG 79 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2yt2 h GLN 81 N 2.01 -1.01 -0.10 0.00 4.15 -1.87 -3.10 115.11 115.19 2yt2 h GLN 81 Ca -0.33 0.07 -0.07 0.00 0.77 0.00 0.00 58.65 59.10 2yt2 h GLN 81 Cb 1.25 0.23 -0.01 0.00 0.21 0.00 0.00 27.48 29.16 2yt2 h GLN 81 CO 0.41 -0.67 -0.24 1.79 -1.93 0.00 0.00 178.83 178.18 2yt2 h THR 82 N -1.11 1.22 0.00 2.39 1.35 -1.93 -3.49 112.91 111.35 2yt2 h THR 82 Ca -0.11 -1.04 0.00 0.00 -0.55 0.00 0.00 66.41 64.72 2yt2 h THR 82 Cb 0.81 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 2yt2 h THR 82 CO 0.18 0.31 0.00 0.61 -0.25 0.00 0.00 175.52 176.37 2yt2 n GLY 83 N -0.65 -0.78 3.72 5.82 0.00 -1.17 -4.89 105.19 107.23 2yt2 n GLY 83 Ca -0.01 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 2yt2 n GLY 83 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2yt2 s GLN 84 N 0.00 4.46 0.00 1.61 0.74 -0.85 -4.38 119.66 121.24 2yt2 s GLN 84 Ca 0.00 1.74 0.00 0.00 0.05 0.00 0.00 55.36 57.15 2yt2 s GLN 84 Cb 0.00 -3.35 0.00 0.00 1.10 0.00 0.00 33.01 30.76 2yt2 s GLN 84 CO 0.00 -0.21 0.00 0.41 -0.55 0.00 0.00 175.29 174.94 2yt2 n GLY 85 N 3.07 3.04 3.64 2.59 0.00 -1.17 -4.98 105.19 111.38 2yt2 n GLY 85 Ca 0.08 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.30 2yt2 n GLY 85 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yt2 s ILE 86 N -1.83 5.33 0.05 -0.61 1.01 -1.24 -3.36 121.20 120.55 2yt2 s ILE 86 Ca 0.00 0.22 0.04 0.00 0.00 0.00 0.00 60.65 60.91 2yt2 s ILE 86 Cb 0.00 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 2yt2 s ILE 86 CO 0.00 0.31 -0.03 -0.36 0.00 0.00 0.00 174.94 174.85 2yt2 s PHE 87 N 1.29 2.94 -0.04 3.97 0.08 -1.14 -0.64 117.98 124.44 2yt2 s PHE 87 Ca 0.08 -0.03 -0.01 0.00 0.12 0.00 0.00 56.93 57.09 2yt2 s PHE 87 Cb -0.14 -1.57 0.03 0.00 -0.57 0.00 0.00 43.02 40.77 2yt2 s PHE 87 CO 0.07 0.44 0.07 0.00 -0.10 0.00 0.00 175.22 175.69 2yt2 s ALA 88 N -1.16 0.00 0.24 5.36 0.00 -1.26 -2.41 121.76 122.54 2yt2 s ALA 88 Ca 0.21 0.40 0.10 0.00 0.00 0.00 0.00 51.96 52.67 2yt2 s ALA 88 Cb -0.11 -0.40 -0.05 0.00 0.00 0.00 0.00 23.12 22.55 2yt2 s ALA 88 CO 0.13 -0.22 -0.18 -0.06 0.00 0.00 0.00 175.76 175.43 2yt2 s PHE 89 N 1.37 2.03 -0.05 0.00 0.40 -0.20 -2.24 117.98 119.30 2yt2 s PHE 89 Ca -0.06 -0.44 -0.09 0.00 -0.60 0.00 0.00 56.93 55.74 2yt2 s PHE 89 Cb -0.12 -0.91 -0.05 0.00 0.51 0.00 0.00 43.02 42.45 2yt2 s PHE 89 CO -0.04 0.55 0.26 0.15 0.70 0.00 0.00 175.22 176.83 2yt2 s LYS 90 N -3.49 3.62 -0.18 0.44 1.02 0.33 -1.51 119.74 119.97 2yt2 s LYS 90 Ca 0.26 0.05 -0.32 0.00 0.02 0.00 0.00 55.97 55.98 2yt2 s LYS 90 Cb -0.03 -3.17 0.14 0.00 -0.52 0.00 0.00 37.83 34.25 2yt2 s LYS 90 CO 0.11 0.72 1.15 0.00 -0.92 0.00 0.00 175.35 176.41 2yt2 n SER 92 N 0.19 3.91 -0.34 0.00 2.88 -1.26 -3.22 113.62 115.78 2yt2 n SER 92 Ca -0.03 -2.13 0.05 0.00 -1.33 0.00 0.00 58.87 55.43 2yt2 n SER 92 Cb 0.59 -0.46 0.07 0.00 -0.75 0.00 0.00 64.21 63.66 2yt2 n SER 92 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2yt2 n ARG 93 N 1.23 0.62 -0.12 -1.46 1.74 -1.26 -4.81 116.66 112.60 2yt2 n ARG 93 Ca 0.22 -1.81 0.27 0.00 -0.77 0.00 0.00 57.85 55.75 2yt2 n ARG 93 Cb 0.65 -0.97 0.72 0.00 -1.02 0.00 0.00 32.46 31.84 2yt2 n ARG 93 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2yt2 h ALA 94 N 0.06 2.69 -0.46 7.54 0.00 -1.85 0.56 119.26 127.80 2yt2 h ALA 94 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2yt2 h ALA 94 Cb 1.22 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 2yt2 h ALA 94 CO 0.00 -1.02 0.23 1.49 0.00 0.00 0.00 179.25 179.96 2yt2 h GLU 95 N 0.00 0.66 -0.71 0.00 4.81 -1.88 0.62 114.58 118.07 2yt2 h GLU 95 Ca 0.37 -0.09 -0.06 0.00 -0.13 0.00 0.00 59.36 59.45 2yt2 h GLU 95 Cb 1.59 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.82 2yt2 h GLU 95 CO -0.00 0.54 0.21 0.93 -0.73 0.00 0.00 179.01 179.96 2yt2 h GLU 96 N 0.60 1.11 -0.34 1.92 4.39 -1.28 -1.85 114.58 119.15 2yt2 h GLU 96 Ca 0.16 -0.25 -0.08 0.00 0.34 0.00 0.00 59.36 59.53 2yt2 h GLU 96 Cb 0.09 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 2yt2 h GLU 96 CO -0.02 0.96 -0.10 0.82 -1.16 0.00 0.00 179.01 179.51 2yt2 h ILE 97 N 1.06 1.28 0.27 3.13 2.04 -1.26 -0.31 117.51 123.72 2yt2 h ILE 97 Ca 0.23 -1.17 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 2yt2 h ILE 97 Cb 0.32 1.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.74 2yt2 h ILE 97 CO -0.00 0.38 -0.17 0.15 0.00 0.00 0.00 178.15 178.51 2yt2 h PHE 98 N 0.44 -0.43 -0.36 1.37 3.57 -0.73 0.29 116.94 121.09 2yt2 h PHE 98 Ca 0.08 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 2yt2 h PHE 98 Cb 0.61 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 2yt2 h PHE 98 CO 0.05 -0.26 0.16 -0.91 -2.23 0.00 0.00 178.31 175.12 2yt2 h ASN 99 N -0.42 0.48 0.95 0.41 2.35 -1.36 -2.55 115.58 115.43 2yt2 h ASN 99 Ca -0.03 -0.14 -0.05 0.00 -0.55 0.00 0.00 56.30 55.53 2yt2 h ASN 99 Cb 0.35 -0.12 0.01 0.00 0.05 0.00 0.00 38.32 38.61 2yt2 h ASN 99 CO 0.03 0.49 -0.46 0.25 -1.65 0.00 0.00 177.43 176.09 2yt2 h LEU 100 N 0.44 -1.08 -0.88 1.61 5.85 -0.90 0.34 115.31 120.68 2yt2 h LEU 100 Ca 0.12 0.04 0.20 0.00 0.84 0.00 0.00 57.88 59.08 2yt2 h LEU 100 Cb 0.14 0.28 -0.16 0.00 0.37 0.00 0.00 40.66 41.29 2yt2 h LEU 100 CO -0.01 -0.77 -0.11 0.25 -0.34 0.00 0.00 178.44 177.46 2yt2 h LEU 101 N -1.28 -0.63 -0.80 2.25 5.85 -0.45 0.94 115.31 121.19 2yt2 h LEU 101 Ca -0.13 0.25 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 2yt2 h LEU 101 Cb 0.98 0.49 -0.02 0.00 0.37 0.00 0.00 40.66 42.48 2yt2 h LEU 101 CO 0.21 -0.28 -0.59 0.06 -0.34 0.00 0.00 178.44 177.50 2yt2 h GLN 102 N 0.03 0.03 0.00 1.25 3.07 -1.32 -2.74 115.11 115.43 2yt2 h GLN 102 Ca 0.47 -0.02 -0.00 0.00 0.09 0.00 0.00 58.65 59.19 2yt2 h GLN 102 Cb 0.81 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.37 2yt2 h GLN 102 CO -0.86 0.61 -0.00 -0.44 0.09 0.00 0.00 178.83 178.23 2yt2 h ASP 103 N 0.02 0.00 0.00 0.06 3.32 0.50 -2.53 116.42 117.79 2yt2 h ASP 103 Ca -0.01 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.97 2yt2 h ASP 103 Cb 1.05 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.59 2yt2 h ASP 103 CO 0.08 0.00 -0.60 -0.07 -1.72 0.00 0.00 179.24 176.93 2yt2 h LEU 104 N 0.00 0.00 -2.10 1.55 3.38 -0.78 -2.66 115.31 114.70 2yt2 h LEU 104 Ca -0.00 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.74 2yt2 h LEU 104 Cb 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2yt2 h LEU 104 CO 0.00 0.98 0.33 0.00 0.09 0.00 0.00 178.44 179.83 2yt2 h MET 105 N -1.00 0.00 0.03 1.13 -0.00 -1.51 -1.82 114.93 111.77 2yt2 h MET 105 Ca -0.11 0.00 -0.22 0.00 -0.00 0.00 0.00 59.70 59.37 2yt2 h MET 105 Cb 0.74 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.32 2yt2 h MET 105 CO -0.07 0.00 -1.17 -0.56 -0.00 0.00 0.00 176.91 175.12 2yt2 h GLN 106 N 0.00 0.07 -6.32 -0.10 3.07 -1.59 -3.48 115.11 106.76 2yt2 h GLN 106 Ca 0.10 -0.12 -0.46 0.00 0.09 0.00 0.00 58.65 58.27 2yt2 h GLN 106 Cb 0.75 0.04 -0.21 0.00 0.08 0.00 0.00 27.48 28.14 2yt2 h GLN 106 CO -0.00 1.06 -0.69 0.00 0.09 0.00 0.00 178.83 179.29 2yt2 n ASN 108 N -1.82 1.89 -3.95 0.00 5.15 -1.26 -5.07 115.26 110.19 2yt2 n ASN 108 Ca -0.09 0.27 -0.10 0.00 -0.60 0.00 0.00 54.58 54.06 2yt2 n ASN 108 Cb 0.43 -0.74 -0.06 0.00 -0.53 0.00 0.00 39.78 38.88 2yt2 n ASN 108 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2yt2 s SER 109 N -7.27 -0.01 0.00 1.20 1.04 -1.26 -5.04 113.70 102.35 2yt2 s SER 109 Ca -0.37 -0.86 0.24 0.00 0.48 0.00 0.00 55.95 55.44 2yt2 s SER 109 Cb 0.14 0.47 0.29 0.00 0.10 0.00 0.00 66.02 67.02 2yt2 s SER 109 CO 0.48 -0.95 1.27 -0.38 0.98 0.00 0.00 173.24 174.64 2yt2 n ILE 110 N -0.26 0.00 -1.58 -1.02 5.41 -1.26 -4.91 119.36 115.74 2yt2 n ILE 110 Ca -0.06 -0.01 -0.50 0.00 1.00 0.00 0.00 62.75 63.18 2yt2 n ILE 110 Cb 0.63 0.49 -0.06 0.00 -0.71 0.00 0.00 39.64 39.99 2yt2 n ILE 110 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2yt2 n ASN 111 N -1.45 2.71 -4.08 4.38 2.85 -1.26 -4.94 115.26 113.47 2yt2 n ASN 111 Ca 0.05 0.67 -0.14 0.00 -0.11 0.00 0.00 54.58 55.05 2yt2 n ASN 111 Cb 0.34 -1.31 -0.12 0.00 1.24 0.00 0.00 39.78 39.93 2yt2 n ASN 111 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2yt2 s VAL 112 N 5.83 0.64 0.62 3.44 0.11 -1.26 -5.15 120.40 124.62 2yt2 s VAL 112 Ca 1.02 -1.07 -0.12 0.00 -2.93 0.00 0.00 61.98 58.89 2yt2 s VAL 112 Cb -0.78 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 33.35 2yt2 s VAL 112 CO 0.51 -0.32 1.03 -0.04 -3.33 0.00 0.00 175.10 172.95 2yt2 s MET 113 N -1.51 3.56 -0.75 1.54 -1.94 -1.26 -4.98 119.30 113.97 2yt2 s MET 113 Ca -0.08 0.80 -0.02 0.00 -1.71 0.00 0.00 55.69 54.68 2yt2 s MET 113 Cb -0.09 -2.08 0.39 0.00 2.01 0.00 0.00 34.83 35.06 2yt2 s MET 113 CO 0.01 -0.60 2.05 0.39 -0.01 0.00 0.00 175.02 176.86 2yt2 n GLU 114 N -2.67 2.70 -1.33 2.03 -0.58 -1.26 -5.03 120.64 114.51 2yt2 n GLU 114 Ca 0.06 -3.35 -0.42 0.00 -0.42 0.00 0.00 57.16 53.03 2yt2 n GLU 114 Cb 0.54 -2.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.14 2yt2 n GLU 114 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2yt2 n GLU 115 N -0.68 0.11 -2.26 3.49 1.02 -1.26 -4.88 120.64 116.19 2yt2 n GLU 115 Ca 0.58 0.04 -0.37 0.00 -0.02 0.00 0.00 57.16 57.39 2yt2 n GLU 115 Cb 0.45 -1.11 -0.01 0.00 -0.02 0.00 0.00 31.44 30.75 2yt2 n GLU 115 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2yt2 s PRO 116 N -1.13 3.75 0.20 3.49 0.04 -1.26 -5.04 135.00 135.06 2yt2 s PRO 116 Ca 0.60 1.78 -0.09 0.00 0.04 0.00 0.00 61.00 63.33 2yt2 s PRO 116 Cb -0.62 -2.40 -0.07 0.00 0.04 0.00 0.00 34.50 31.45 2yt2 s PRO 116 CO 0.62 -0.56 0.50 0.08 0.04 0.00 0.00 177.00 177.68 2yt2 s VAL 117 N -1.55 4.99 -0.29 -0.36 1.01 -1.26 -5.08 120.40 117.86 2yt2 s VAL 117 Ca 0.64 0.37 -0.02 0.00 0.00 0.00 0.00 61.98 62.97 2yt2 s VAL 117 Cb -0.29 -3.62 0.10 0.00 0.00 0.00 0.00 36.38 32.57 2yt2 s VAL 117 CO 0.35 -0.03 0.10 -0.63 0.00 0.00 0.00 175.10 174.89 2yt2 s ILE 118 N -1.76 0.57 -0.31 2.22 -1.09 -1.26 -5.09 121.20 114.48 2yt2 s ILE 118 Ca 0.45 -1.12 0.03 0.00 -2.23 0.00 0.00 60.65 57.79 2yt2 s ILE 118 Cb -0.12 -1.40 0.08 0.00 -1.58 0.00 0.00 42.46 39.45 2yt2 s ILE 118 CO 0.22 -0.64 -0.01 -0.63 -1.23 0.00 0.00 174.94 172.65 2yt2 s ILE 119 N 1.78 2.19 0.29 2.92 1.01 -1.26 -4.98 121.20 123.16 2yt2 s ILE 119 Ca 0.08 -2.04 0.06 0.00 0.00 0.00 0.00 60.65 58.75 2yt2 s ILE 119 Cb -0.17 -2.50 -0.02 0.00 0.01 0.00 0.00 42.46 39.79 2yt2 s ILE 119 CO -0.27 -0.38 0.42 0.42 0.00 0.00 0.00 174.94 175.14 2yt2 s THR 120 N 1.00 4.61 -0.61 2.92 -4.23 -1.26 -5.06 115.64 113.01 2yt2 s THR 120 Ca 0.03 -0.98 -0.19 0.00 -1.18 0.00 0.00 61.69 59.37 2yt2 s THR 120 Cb -0.19 -3.61 0.11 0.00 1.34 0.00 0.00 72.50 70.14 2yt2 s THR 120 CO -0.07 -0.24 0.71 -0.55 -0.54 0.00 0.00 174.62 173.92 2yt2 s SER 121 N -4.09 6.21 0.00 3.99 0.15 -1.26 -4.80 113.70 113.90 2yt2 s SER 121 Ca 0.40 -1.51 0.00 0.00 0.70 0.00 0.00 55.95 55.54 2yt2 s SER 121 Cb -0.09 -2.30 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2yt2 s SER 121 CO 0.30 -1.08 0.00 0.61 1.20 0.00 0.00 173.24 174.27 2yt2 n GLY 122 N 5.25 -1.94 3.26 9.45 0.00 -1.26 -5.15 105.19 114.81 2yt2 n GLY 122 Ca -0.08 0.93 -0.34 0.00 0.00 0.00 0.00 46.02 46.53 2yt2 n GLY 122 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yt2 s SER 123 N 0.00 3.81 -0.05 1.61 0.15 -1.26 -5.10 113.70 112.85 2yt2 s SER 123 Ca 0.00 -0.46 -0.00 0.00 0.70 0.00 0.00 55.95 56.19 2yt2 s SER 123 Cb 0.00 -1.61 0.03 0.00 -1.71 0.00 0.00 66.02 62.73 2yt2 s SER 123 CO 0.00 0.04 -0.01 -0.55 1.20 0.00 0.00 173.24 173.92 2yt2 s SER 124 N 1.07 1.14 -0.36 5.45 0.15 -1.26 -5.09 113.70 114.80 2yt2 s SER 124 Ca -0.00 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.57 2yt2 s SER 124 Cb -0.15 -0.40 0.18 0.00 -1.71 0.00 0.00 66.02 63.95 2yt2 s SER 124 CO -0.03 -0.13 0.81 -0.83 1.20 0.00 0.00 173.24 174.25 2yt2 s GLY 125 N 1.44 -1.34 0.26 9.45 0.00 -1.26 -5.16 107.32 110.70 2yt2 s GLY 125 Ca -0.03 0.81 0.08 0.00 0.00 0.00 0.00 44.72 45.58 2yt2 s GLY 125 CO -0.03 3.93 0.10 -0.45 0.00 0.00 0.00 173.10 176.65 2yt2 s SER 126 N 2.06 5.01 0.24 1.64 0.15 -1.26 -5.10 113.70 116.44 2yt2 s SER 126 Ca 0.16 -0.47 -0.30 0.00 0.70 0.00 0.00 55.95 56.04 2yt2 s SER 126 Cb -0.02 -1.10 -0.09 0.00 -1.71 0.00 0.00 66.02 63.10 2yt2 s SER 126 CO -0.13 -0.03 1.22 -0.44 1.20 0.00 0.00 173.24 175.07 2yt2 s SER 127 N -3.76 7.02 0.00 5.45 0.01 -1.26 -5.01 113.70 116.16 2yt2 s SER 127 Ca 0.32 2.38 0.00 0.00 1.31 0.00 0.00 55.95 59.96 2yt2 s SER 127 Cb -0.07 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.54 2yt2 s SER 127 CO 0.22 -0.38 0.00 0.61 0.41 0.00 0.00 173.24 174.10 2yt2 n GLY 128 N 1.69 5.04 3.77 3.44 0.00 -1.26 -5.13 105.19 112.74 2yt2 n GLY 128 Ca 0.02 -1.19 -0.40 0.00 0.00 0.00 0.00 46.02 44.46 2yt2 n GLY 128 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yt2 s SER 129 N 1.13 5.98 -0.64 1.61 0.01 -1.26 -4.98 113.70 115.55 2yt2 s SER 129 Ca 0.00 2.81 -0.06 0.00 1.31 0.00 0.00 55.95 60.01 2yt2 s SER 129 Cb 0.00 -2.65 0.17 0.00 0.21 0.00 0.00 66.02 63.75 2yt2 s SER 129 CO 0.00 -1.10 0.49 -0.55 0.41 0.00 0.00 173.24 172.50 2yt2 s SER 130 N -0.63 5.63 -0.41 2.44 0.15 -1.26 -4.93 113.70 114.69 2yt2 s SER 130 Ca 0.60 -2.68 0.08 0.00 0.70 0.00 0.00 55.95 54.66 2yt2 s SER 130 Cb -0.41 -1.95 0.26 0.00 -1.71 0.00 0.00 66.02 62.21 2yt2 s SER 130 CO 0.53 -0.46 0.63 0.61 1.20 0.00 0.00 173.24 175.75 2yt2 n GLY 131 N 3.81 2.35 2.74 9.45 0.00 -1.26 -5.06 105.19 117.21 2yt2 n GLY 131 Ca 0.07 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.57 2yt2 n GLY 131 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yt2 s SER 132 N -1.42 4.00 -0.60 1.61 0.15 -1.26 -5.08 113.70 111.10 2yt2 s SER 132 Ca 0.35 -1.78 -0.19 0.00 0.70 0.00 0.00 55.95 55.02 2yt2 s SER 132 Cb 0.21 -0.91 0.09 0.00 -1.71 0.00 0.00 66.02 63.70 2yt2 s SER 132 CO -0.13 -0.40 0.74 -0.94 1.20 0.00 0.00 173.24 173.71 2yt2 s SER 133 N 1.43 6.19 0.01 5.45 1.04 -1.26 -4.82 113.70 121.73 2yt2 s SER 133 Ca 0.11 -1.32 0.00 0.00 0.48 0.00 0.00 55.95 55.22 2yt2 s SER 133 Cb -0.18 -2.32 0.00 0.00 0.10 0.00 0.00 66.02 63.62 2yt2 s SER 133 CO -0.21 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.47 2yt2 n GLY 134 N 5.28 -3.54 3.70 7.32 0.00 -1.26 -4.86 105.19 111.83 2yt2 n GLY 134 Ca -0.08 -0.86 -0.58 0.00 0.00 0.00 0.00 46.02 44.50 2yt2 n GLY 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yt2 n LEU 135 N -0.20 2.11 -4.70 0.99 4.77 -1.26 -4.76 117.00 113.95 2yt2 n LEU 135 Ca 0.00 1.10 -0.55 0.00 -0.03 0.00 0.00 56.01 56.52 2yt2 n LEU 135 Cb 0.00 -1.11 -0.07 0.00 -2.33 0.00 0.00 43.42 39.91 2yt2 n LEU 135 CO 0.00 -0.59 1.35 0.33 -1.33 0.00 0.00 177.39 177.16 2yt2 n PHE 136 N 4.77 2.11 -3.52 -1.77 -0.00 -1.26 -4.92 117.46 112.86 2yt2 n PHE 136 Ca 0.26 0.41 -0.38 0.00 -0.00 0.00 0.00 57.45 57.74 2yt2 n PHE 136 Cb 0.11 -2.50 -0.09 0.00 -0.00 0.00 0.00 39.48 37.00 2yt2 n PHE 136 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2yt2 s ARG 137 N 3.58 4.08 0.27 -4.13 0.52 -1.26 -4.55 118.95 117.45 2yt2 s ARG 137 Ca 0.97 -0.07 -0.08 0.00 -0.52 0.00 0.00 55.73 56.02 2yt2 s ARG 137 Cb -0.98 -3.57 -0.06 0.00 0.52 0.00 0.00 34.95 30.86 2yt2 s ARG 137 CO 0.62 -0.05 0.57 -0.51 0.02 0.00 0.00 175.30 175.95 2yt2 s LEU 138 N 1.37 4.10 -0.10 2.53 1.43 0.18 -4.85 118.68 123.34 2yt2 s LEU 138 Ca 0.12 0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 53.98 2yt2 s LEU 138 Cb -0.14 -3.67 -0.28 0.00 0.03 0.00 0.00 46.19 42.13 2yt2 s LEU 138 CO 0.07 -0.15 0.51 0.03 0.23 0.00 0.00 176.35 177.05 2yt2 h ARG 139 N 2.12 0.29 -6.06 1.70 3.08 -1.98 -3.28 114.38 110.25 2yt2 h ARG 139 Ca -0.47 -0.49 -0.57 0.00 0.07 0.00 0.00 59.98 58.52 2yt2 h ARG 139 Cb 1.18 0.18 -0.03 0.00 0.08 0.00 0.00 29.97 31.38 2yt2 h ARG 139 CO 0.68 1.24 -0.25 -1.01 -1.07 0.00 0.00 179.97 179.55 2yt2 s HIS 140 N -2.53 1.48 -0.24 3.04 3.76 -1.26 -5.01 115.29 114.54 2yt2 s HIS 140 Ca -0.20 -0.85 -0.07 0.00 -0.15 0.00 0.00 55.06 53.79 2yt2 s HIS 140 Cb 0.05 -1.95 -0.03 0.00 1.11 0.00 0.00 32.58 31.77 2yt2 s HIS 140 CO 0.79 -0.65 0.05 0.12 -0.85 0.00 0.00 174.74 174.20 2yt2 s PHE 141 N -2.78 3.07 -0.02 1.40 5.36 -1.26 -4.99 117.98 118.77 2yt2 s PHE 141 Ca 0.38 -0.45 -0.25 0.00 -0.96 0.00 0.00 56.93 55.65 2yt2 s PHE 141 Cb -0.03 -2.21 -0.19 0.00 -0.34 0.00 0.00 43.02 40.25 2yt2 s PHE 141 CO 0.24 -0.35 1.23 -1.00 -1.46 0.00 0.00 175.22 173.88 2yt2 h PRO 142 N 8.10 -0.06 -7.06 10.12 0.13 -1.99 -3.45 132.00 137.79 2yt2 h PRO 142 Ca -0.38 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.35 2yt2 h PRO 142 Cb 1.17 0.01 0.22 0.00 0.13 0.00 0.00 31.00 32.53 2yt2 h PRO 142 CO 0.59 0.40 -0.09 0.00 -0.23 0.00 0.00 178.00 178.67 2yt2 n GLY 144 N 1.27 0.00 3.53 0.00 0.00 -1.26 -4.95 105.19 103.78 2yt2 n GLY 144 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2yt2 n GLY 144 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2yt2 s ASN 145 N -3.44 6.30 -0.21 1.61 0.01 -1.26 -4.99 114.94 112.95 2yt2 s ASN 145 Ca 0.00 -0.94 -0.10 0.00 -0.71 0.00 0.00 52.86 51.11 2yt2 s ASN 145 Cb 0.00 -2.53 -0.05 0.00 0.41 0.00 0.00 41.25 39.08 2yt2 s ASN 145 CO 0.00 -1.63 0.14 -0.69 -1.51 0.00 0.00 177.10 173.40 2yt2 s VAL 146 N 5.08 5.39 -0.05 1.60 1.01 -1.26 -3.89 120.40 128.27 2yt2 s VAL 146 Ca 0.36 0.18 0.04 0.00 0.00 0.00 0.00 61.98 62.57 2yt2 s VAL 146 Cb -0.07 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 2yt2 s VAL 146 CO 0.05 0.41 -0.15 0.21 0.00 0.00 0.00 175.10 175.62 2yt2 s ASN 147 N 0.56 3.93 -0.16 3.32 2.47 0.67 -4.92 114.94 120.80 2yt2 s ASN 147 Ca 0.08 -0.23 -0.16 0.00 0.42 0.00 0.00 52.86 52.96 2yt2 s ASN 147 Cb -0.12 -0.85 -0.04 0.00 -1.45 0.00 0.00 41.25 38.79 2yt2 s ASN 147 CO -0.00 0.33 0.41 -0.31 -3.72 0.00 0.00 177.10 173.81 2yt2 s TYR 148 N -0.65 3.44 0.00 0.43 2.02 -1.26 -2.80 117.35 118.54 2yt2 s TYR 148 Ca 0.10 0.71 0.00 0.00 -0.37 0.00 0.00 57.07 57.51 2yt2 s TYR 148 Cb -0.11 -2.50 0.00 0.00 -0.40 0.00 0.00 41.96 38.95 2yt2 s TYR 148 CO 0.01 0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.50 2yt2 n GLY 149 N 3.57 0.32 3.79 0.71 0.00 -1.24 -4.99 105.19 107.34 2yt2 n GLY 149 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 2yt2 n GLY 149 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yt2 s TYR 150 N 0.00 3.84 0.00 1.61 1.51 -1.26 -5.04 117.35 118.01 2yt2 s TYR 150 Ca 0.00 1.56 -0.12 0.00 -1.01 0.00 0.00 57.07 57.49 2yt2 s TYR 150 Cb 0.00 -2.72 0.02 0.00 -0.11 0.00 0.00 41.96 39.15 2yt2 s TYR 150 CO 0.00 0.48 0.26 1.14 -1.11 0.00 0.00 175.55 176.32 2yt2 s GLN 151 N -1.33 0.65 -0.64 -0.62 0.00 -1.26 -4.92 119.66 111.54 2yt2 s GLN 151 Ca 0.37 -0.33 0.00 0.00 -0.00 0.00 0.00 55.36 55.40 2yt2 s GLN 151 Cb -0.21 0.28 0.16 0.00 0.00 0.00 0.00 33.01 33.24 2yt2 s GLN 151 CO 0.24 -0.18 0.44 -0.65 0.00 0.00 0.00 175.29 175.15 2yt2 s GLN 152 N -1.64 2.50 0.00 9.60 -1.52 -1.26 -5.28 119.66 122.06 2yt2 s GLN 152 Ca -0.12 -2.76 0.31 0.00 -1.95 0.00 0.00 55.36 50.84 2yt2 s GLN 152 Cb -0.05 -3.62 1.74 0.00 -0.22 0.00 0.00 33.01 30.86 2yt2 s GLN 152 CO 0.02 -1.18 2.13 0.00 -0.25 0.00 0.00 175.29 176.01