#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yq2 s ASP 5 N 0.00 6.29 -0.06 0.00 2.15 -1.26 -4.94 116.67 118.86 1yq2 s ASP 5 Ca 0.00 0.34 0.14 0.00 0.43 0.00 0.00 52.55 53.45 1yq2 s ASP 5 Cb 0.00 -2.21 0.44 0.00 -0.30 0.00 0.00 42.92 40.84 1yq2 s ASP 5 CO 0.00 -0.16 1.37 1.33 -0.17 0.00 0.00 175.17 177.53 1yq2 n VAL 6 N 4.96 1.43 0.33 1.11 0.24 -1.26 -4.63 118.33 120.50 1yq2 n VAL 6 Ca -0.08 -1.24 0.21 0.00 -2.04 0.00 0.00 64.34 61.18 1yq2 n VAL 6 Cb 0.51 0.26 1.12 0.00 -1.47 0.00 0.00 33.84 34.26 1yq2 n VAL 6 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1yq2 h SER 7 N 2.39 0.00 -0.11 -1.34 4.64 -1.97 -2.40 113.55 114.76 1yq2 h SER 7 Ca 0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1yq2 h SER 7 Cb 1.02 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1yq2 h SER 7 CO 0.09 0.00 0.13 0.10 -0.87 0.00 0.00 176.83 176.28 1yq2 h TYR 8 N 0.00 0.00 -0.25 4.77 -0.00 -1.97 -1.68 116.97 117.84 1yq2 h TYR 8 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.62 1yq2 h TYR 8 Cb 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.80 1yq2 h TYR 8 CO 0.00 0.00 -0.31 1.25 -0.00 0.00 0.00 178.16 179.10 1yq2 h LEU 9 N 0.00 0.54 -1.94 0.10 5.85 -1.82 -3.23 115.31 114.81 1yq2 h LEU 9 Ca 0.05 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1yq2 h LEU 9 Cb 0.31 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1yq2 h LEU 9 CO -0.00 0.82 0.00 0.35 -0.34 0.00 0.00 178.44 179.27 1yq2 n THR 10 N -4.08 0.38 -1.89 1.05 -2.24 -0.86 -1.55 114.28 105.09 1yq2 n THR 10 Ca -0.01 -0.69 -0.41 0.00 -2.27 0.00 0.00 64.05 60.67 1yq2 n THR 10 Cb 0.45 0.93 -0.01 0.00 -2.10 0.00 0.00 70.33 69.59 1yq2 n THR 10 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1yq2 s ASP 11 N -0.84 6.47 0.00 3.42 2.15 -0.69 -4.76 116.67 122.42 1yq2 s ASP 11 Ca 0.14 2.91 0.21 0.00 0.43 0.00 0.00 52.55 56.24 1yq2 s ASP 11 Cb 0.08 -2.65 0.54 0.00 -0.30 0.00 0.00 42.92 40.59 1yq2 s ASP 11 CO 0.12 -0.79 1.45 0.00 -0.17 0.00 0.00 175.17 175.77 1yq2 n GLN 12 N 1.09 2.23 -2.20 4.34 6.02 -1.26 -4.74 117.38 122.86 1yq2 n GLN 12 Ca 0.03 -1.87 -0.27 0.00 -0.01 0.00 0.00 57.00 54.87 1yq2 n GLN 12 Cb 0.39 -1.46 0.14 0.00 1.02 0.00 0.00 30.24 30.34 1yq2 n GLN 12 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1yq2 s GLY 13 N -1.38 1.76 0.00 1.08 0.00 -1.26 -4.37 107.32 103.15 1yq2 s GLY 13 Ca 0.37 -1.37 0.20 0.00 0.00 0.00 0.00 44.72 43.92 1yq2 s GLY 13 CO 0.28 -0.71 1.63 -1.55 0.00 0.00 0.00 173.10 172.76 1yq2 n PRO 14 N -3.33 0.06 0.00 2.90 -0.04 -1.26 -4.78 135.00 128.55 1yq2 n PRO 14 Ca 0.14 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 1yq2 n PRO 14 Cb 0.60 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 1yq2 n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yq2 n GLY 15 N 0.51 2.45 3.43 0.55 0.00 -1.26 -4.27 105.19 106.60 1yq2 n GLY 15 Ca 0.06 -1.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.00 1yq2 n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yq2 s SER 16 N 0.00 0.27 0.00 1.61 1.04 -0.73 -4.96 113.70 110.92 1yq2 s SER 16 Ca 0.00 -1.23 0.00 0.00 0.48 0.00 0.00 55.95 55.20 1yq2 s SER 16 Cb 0.00 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.65 1yq2 s SER 16 CO 0.00 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 173.76 1yq2 n GLY 17 N -0.39 -0.57 2.39 7.32 0.00 -1.26 -1.77 105.19 110.91 1yq2 n GLY 17 Ca 0.00 -1.77 -0.40 0.00 0.00 0.00 0.00 46.02 43.86 1yq2 n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 n ARG 18 N 0.00 4.02 -2.51 1.61 1.74 -0.09 -4.95 116.66 116.48 1yq2 n ARG 18 Ca 0.00 -2.70 -0.41 0.00 -0.77 0.00 0.00 57.85 53.97 1yq2 n ARG 18 Cb 0.00 -2.75 -0.04 0.00 -1.02 0.00 0.00 32.46 28.64 1yq2 n ARG 18 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1yq2 s ARG 19 N 0.93 4.62 -0.06 5.56 0.52 -1.26 -0.71 118.95 128.55 1yq2 s ARG 19 Ca 0.63 1.74 -0.12 0.00 -0.52 0.00 0.00 55.73 57.46 1yq2 s ARG 19 Cb 0.18 -3.24 -0.05 0.00 0.52 0.00 0.00 34.95 32.36 1yq2 s ARG 19 CO -0.07 0.15 0.29 0.08 0.02 0.00 0.00 175.30 175.77 1yq2 s VAL 20 N -0.63 5.24 0.31 3.52 1.01 -0.67 -4.82 120.40 124.35 1yq2 s VAL 20 Ca 0.47 0.57 -0.28 0.00 0.00 0.00 0.00 61.98 62.74 1yq2 s VAL 20 Cb -0.30 -3.58 -0.13 0.00 0.00 0.00 0.00 36.38 32.36 1yq2 s VAL 20 CO 0.37 0.58 1.11 -2.65 0.00 0.00 0.00 175.10 174.51 1yq2 n PRO 21 N 2.04 1.62 -1.71 2.72 -0.02 -1.26 -4.66 135.00 133.72 1yq2 n PRO 21 Ca -0.16 0.57 -0.43 0.00 -2.02 0.00 0.00 63.50 61.46 1yq2 n PRO 21 Cb 0.53 -2.01 -0.01 0.00 -0.02 0.00 0.00 33.50 31.99 1yq2 n PRO 21 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 n ALA 22 N 0.28 1.60 -2.57 3.55 0.00 -1.26 -5.00 120.51 117.11 1yq2 n ALA 22 Ca 0.08 0.38 -0.16 0.00 0.00 0.00 0.00 53.44 53.74 1yq2 n ALA 22 Cb 0.33 -2.32 -0.07 0.00 0.00 0.00 0.00 19.45 17.40 1yq2 n ALA 22 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1yq2 s ARG 23 N -1.11 1.72 0.62 0.00 1.70 -1.26 -4.98 118.95 115.64 1yq2 s ARG 23 Ca 0.61 -1.81 -0.17 0.00 -0.47 0.00 0.00 55.73 53.89 1yq2 s ARG 23 Cb -0.57 0.37 -0.02 0.00 -0.57 0.00 0.00 34.95 34.16 1yq2 s ARG 23 CO 0.55 -0.67 1.15 -1.12 -1.08 0.00 0.00 175.30 174.14 1yq2 s SER 24 N -3.26 5.14 -0.26 -2.89 0.01 -0.99 -3.35 113.70 108.09 1yq2 s SER 24 Ca 0.35 2.20 -0.29 0.00 1.31 0.00 0.00 55.95 59.52 1yq2 s SER 24 Cb 0.02 -2.58 0.01 0.00 0.21 0.00 0.00 66.02 63.68 1yq2 s SER 24 CO 0.21 -1.62 1.09 0.86 0.41 0.00 0.00 173.24 174.19 1yq2 s TRP 25 N -1.95 3.19 0.12 2.43 -0.00 -0.68 -4.92 118.94 117.13 1yq2 s TRP 25 Ca 0.72 1.29 0.07 0.00 -0.00 0.00 0.00 56.10 58.18 1yq2 s TRP 25 Cb -0.25 -3.49 -0.04 0.00 -0.00 0.00 0.00 33.47 29.69 1yq2 s TRP 25 CO 0.36 -0.76 -0.17 -0.51 -0.00 0.00 0.00 176.95 175.87 1yq2 s LEU 26 N 3.47 2.37 -0.81 5.86 1.43 -1.26 -4.98 118.68 124.76 1yq2 s LEU 26 Ca 0.46 -0.76 -0.20 0.00 -1.03 0.00 0.00 54.13 52.60 1yq2 s LEU 26 Cb -0.15 -0.69 0.11 0.00 0.03 0.00 0.00 46.19 45.49 1yq2 s LEU 26 CO 0.11 -0.06 1.04 -1.00 0.23 0.00 0.00 176.35 176.67 1yq2 s HIS 27 N -1.74 2.95 0.10 0.29 3.76 -1.26 -5.03 115.29 114.36 1yq2 s HIS 27 Ca 0.08 -1.06 0.06 0.00 -0.15 0.00 0.00 55.06 53.99 1yq2 s HIS 27 Cb -0.07 -4.27 -0.04 0.00 1.11 0.00 0.00 32.58 29.31 1yq2 s HIS 27 CO 0.04 -1.53 -0.03 0.45 -0.85 0.00 0.00 174.74 172.82 1yq2 s SER 28 N 3.66 4.83 0.00 1.40 0.15 -1.26 -0.60 113.70 121.88 1yq2 s SER 28 Ca 0.27 -0.25 0.09 0.00 0.70 0.00 0.00 55.95 56.76 1yq2 s SER 28 Cb -0.11 -1.08 0.36 0.00 -1.71 0.00 0.00 66.02 63.48 1yq2 s SER 28 CO -0.01 0.17 1.26 -0.90 1.20 0.00 0.00 173.24 174.96 1yq2 n ASP 29 N 0.54 0.90 -4.66 5.45 5.68 -0.77 -4.96 116.55 118.73 1yq2 n ASP 29 Ca -0.11 -1.88 -0.38 0.00 -0.50 0.00 0.00 54.79 51.92 1yq2 n ASP 29 Cb 0.52 -0.10 0.06 0.00 -1.14 0.00 0.00 41.12 40.46 1yq2 n ASP 29 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1yq2 n ALA 30 N -0.06 0.62 -1.79 2.12 0.00 -1.26 -4.90 120.51 115.24 1yq2 n ALA 30 Ca 0.08 0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.13 1yq2 n ALA 30 Cb 0.16 -2.20 -0.01 0.00 0.00 0.00 0.00 19.45 17.40 1yq2 n ALA 30 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1yq2 s PRO 31 N -2.95 4.17 0.01 0.00 0.02 -1.26 -4.86 135.00 130.14 1yq2 s PRO 31 Ca 0.77 2.48 -0.13 0.00 0.02 0.00 0.00 61.00 64.15 1yq2 s PRO 31 Cb -0.41 -3.02 0.02 0.00 0.02 0.00 0.00 34.50 31.11 1yq2 s PRO 31 CO 0.45 -0.50 0.28 0.00 -0.33 0.00 0.00 177.00 176.90 1yq2 s ALA 32 N -0.60 -0.65 -0.00 -1.55 0.00 -1.26 -0.56 121.76 117.15 1yq2 s ALA 32 Ca 0.57 0.08 0.03 0.00 0.00 0.00 0.00 51.96 52.64 1yq2 s ALA 32 Cb -0.45 0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 1yq2 s ALA 32 CO 0.54 -0.32 -0.11 -0.48 0.00 0.00 0.00 175.76 175.39 1yq2 s LEU 33 N -1.70 2.05 0.06 0.00 0.05 -0.12 -5.00 118.68 114.02 1yq2 s LEU 33 Ca -0.10 -0.23 -0.25 0.00 0.05 0.00 0.00 54.13 53.61 1yq2 s LEU 33 Cb -0.03 -0.52 -0.06 0.00 -2.05 0.00 0.00 46.19 43.53 1yq2 s LEU 33 CO 0.00 0.10 0.77 -0.55 -0.55 0.00 0.00 176.35 176.13 1yq2 s SER 34 N -0.39 7.24 0.00 1.48 0.15 -1.26 -0.78 113.70 120.14 1yq2 s SER 34 Ca 0.03 1.48 0.23 0.00 0.70 0.00 0.00 55.95 58.39 1yq2 s SER 34 Cb -0.05 -2.48 0.48 0.00 -1.71 0.00 0.00 66.02 62.27 1yq2 s SER 34 CO -0.00 0.03 1.44 0.18 1.20 0.00 0.00 173.24 176.08 1yq2 n LEU 35 N 2.72 3.60 -4.74 3.45 4.32 0.11 -4.96 117.00 121.50 1yq2 n LEU 35 Ca -0.02 -1.61 -0.37 0.00 -0.02 0.00 0.00 56.01 53.99 1yq2 n LEU 35 Cb 0.50 -0.31 0.05 0.00 -1.62 0.00 0.00 43.42 42.05 1yq2 n LEU 35 CO 0.47 0.80 0.91 0.20 -1.22 0.00 0.00 177.39 178.56 1yq2 s ASN 36 N -1.38 4.92 0.00 -1.43 0.02 -1.23 -4.89 114.94 110.94 1yq2 s ASN 36 Ca 0.41 2.61 0.00 0.00 -1.02 0.00 0.00 52.86 54.86 1yq2 s ASN 36 Cb 0.24 -2.62 0.00 0.00 0.02 0.00 0.00 41.25 38.89 1yq2 s ASN 36 CO 0.32 -1.79 0.00 0.61 0.02 0.00 0.00 177.10 176.26 1yq2 n GLY 37 N 0.77 0.05 3.48 0.66 0.00 0.53 -5.00 105.19 105.69 1yq2 n GLY 37 Ca 0.14 -1.16 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 1yq2 n GLY 37 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yq2 s ASP 38 N -4.00 5.99 0.13 1.61 1.01 -1.26 0.44 116.67 120.59 1yq2 s ASP 38 Ca 0.00 -0.67 0.01 0.00 0.71 0.00 0.00 52.55 52.60 1yq2 s ASP 38 Cb 0.00 -2.12 -0.04 0.00 1.01 0.00 0.00 42.92 41.77 1yq2 s ASP 38 CO 0.00 -0.33 0.28 0.26 0.21 0.00 0.00 175.17 175.59 1yq2 s TRP 39 N 1.68 3.49 0.28 4.23 0.52 -0.48 -4.84 118.94 123.82 1yq2 s TRP 39 Ca 0.05 0.19 -0.30 0.00 0.02 0.00 0.00 56.10 56.06 1yq2 s TRP 39 Cb -0.18 -1.72 -0.11 0.00 -1.15 0.00 0.00 33.47 30.31 1yq2 s TRP 39 CO 0.09 0.52 1.48 1.03 0.02 0.00 0.00 176.95 180.10 1yq2 s ARG 40 N -3.02 4.21 -0.03 4.98 3.00 -0.73 -0.73 118.95 126.63 1yq2 s ARG 40 Ca 0.35 2.41 -0.05 0.00 0.00 0.00 0.00 55.73 58.44 1yq2 s ARG 40 Cb -0.12 -3.06 0.01 0.00 0.00 0.00 0.00 34.95 31.78 1yq2 s ARG 40 CO 0.28 -0.48 0.12 0.12 0.00 0.00 0.00 175.30 175.35 1yq2 s PHE 41 N -0.21 -0.06 -0.03 -0.53 5.36 -0.43 -0.75 117.98 121.33 1yq2 s PHE 41 Ca 0.59 0.13 -0.06 0.00 -0.96 0.00 0.00 56.93 56.63 1yq2 s PHE 41 Cb -0.44 0.00 0.01 0.00 -0.34 0.00 0.00 43.02 42.25 1yq2 s PHE 41 CO 0.48 -0.15 0.14 -0.98 -1.46 0.00 0.00 175.22 173.24 1yq2 s ARG 42 N -0.52 0.32 -0.19 10.12 1.70 -0.86 -3.59 118.95 125.94 1yq2 s ARG 42 Ca -0.06 -0.10 -0.06 0.00 -0.47 0.00 0.00 55.73 55.04 1yq2 s ARG 42 Cb -0.04 0.14 -0.04 0.00 -0.57 0.00 0.00 34.95 34.45 1yq2 s ARG 42 CO 0.01 -0.07 0.04 -1.17 -1.08 0.00 0.00 175.30 173.03 1yq2 s LEU 43 N -0.65 3.61 0.03 -1.89 2.96 -1.26 -1.04 118.68 120.44 1yq2 s LEU 43 Ca -0.07 -0.02 0.04 0.00 -0.22 0.00 0.00 54.13 53.85 1yq2 s LEU 43 Cb -0.04 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 1yq2 s LEU 43 CO 0.01 0.13 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.36 1yq2 s LEU 44 N 0.60 3.26 0.00 -0.68 1.43 0.69 -4.96 118.68 119.02 1yq2 s LEU 44 Ca 0.02 -0.15 0.30 0.00 -1.03 0.00 0.00 54.13 53.27 1yq2 s LEU 44 Cb -0.13 -1.91 1.53 0.00 0.03 0.00 0.00 46.19 45.70 1yq2 s LEU 44 CO 0.02 0.25 2.06 -0.81 0.23 0.00 0.00 176.35 178.10 1yq2 n PRO 45 N 1.27 0.44 -3.89 1.29 -0.04 -1.26 -0.92 135.00 131.89 1yq2 n PRO 45 Ca -0.14 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.22 1yq2 n PRO 45 Cb 0.52 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.42 1yq2 n PRO 45 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yq2 s ALA 46 N -2.56 -0.26 -0.38 0.55 0.00 -1.20 -1.13 121.76 116.78 1yq2 s ALA 46 Ca 0.29 -0.68 -0.25 0.00 0.00 0.00 0.00 51.96 51.32 1yq2 s ALA 46 Cb 0.20 0.80 0.01 0.00 0.00 0.00 0.00 23.12 24.14 1yq2 s ALA 46 CO 0.46 -0.66 0.87 0.00 0.00 0.00 0.00 175.76 176.43 1yq2 s ALA 47 N -3.93 3.39 0.33 0.00 0.00 -1.25 -4.56 121.76 115.74 1yq2 s ALA 47 Ca 0.13 -0.58 -0.28 0.00 0.00 0.00 0.00 51.96 51.24 1yq2 s ALA 47 Cb 0.03 -3.49 -0.13 0.00 0.00 0.00 0.00 23.12 19.53 1yq2 s ALA 47 CO -0.03 -1.63 1.18 -2.30 0.00 0.00 0.00 175.76 172.99 1yq2 n PRO 48 N 6.70 1.83 0.00 0.00 -0.02 -1.26 -2.64 135.00 139.61 1yq2 n PRO 48 Ca 0.05 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1yq2 n PRO 48 Cb 0.48 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1yq2 n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yq2 n GLY 49 N 0.93 1.88 3.86 -1.23 0.00 -1.26 -4.95 105.19 104.43 1yq2 n GLY 49 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 1yq2 n GLY 49 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yq2 s THR 50 N -2.37 4.62 0.36 2.61 -4.23 -1.08 -4.81 115.64 110.73 1yq2 s THR 50 Ca 0.00 0.96 0.06 0.00 -1.18 0.00 0.00 61.69 61.52 1yq2 s THR 50 Cb 0.00 -3.80 0.19 0.00 1.34 0.00 0.00 72.50 70.22 1yq2 s THR 50 CO 0.00 -1.01 1.93 0.00 -0.54 0.00 0.00 174.62 174.99 1yq2 h ALA 51 N -0.01 1.47 -0.57 3.99 0.00 -1.96 -2.06 119.26 120.11 1yq2 h ALA 51 Ca -0.45 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.17 1yq2 h ALA 51 Cb 1.19 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 1yq2 h ALA 51 CO 0.62 0.39 0.17 0.41 0.00 0.00 0.00 179.25 180.83 1yq2 n GLY 52 N -1.03 3.11 1.32 0.00 0.00 -1.26 -4.10 105.19 103.23 1yq2 n GLY 52 Ca 0.02 -0.78 0.01 0.00 0.00 0.00 0.00 46.02 45.27 1yq2 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 n ALA 53 N 0.08 3.23 -0.32 4.61 0.00 -0.78 -4.94 120.51 122.38 1yq2 n ALA 53 Ca 0.30 -2.95 0.21 0.00 0.00 0.00 0.00 53.44 51.00 1yq2 n ALA 53 Cb 1.15 -0.55 0.41 0.00 0.00 0.00 0.00 19.45 20.46 1yq2 n ALA 53 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1yq2 h GLY 54 N 1.30 1.72 -2.04 0.00 0.00 -1.71 -2.71 103.07 99.63 1yq2 h GLY 54 Ca -0.06 -0.04 -0.17 0.00 0.00 0.00 0.00 47.33 47.05 1yq2 h GLY 54 CO 0.14 -0.57 -0.64 -1.14 0.00 0.00 0.00 176.54 174.33 1yq2 n SER 55 N -5.29 2.58 0.12 0.19 3.41 -1.26 -4.80 113.62 108.57 1yq2 n SER 55 Ca 0.29 -3.69 -0.02 0.00 -0.26 0.00 0.00 58.87 55.18 1yq2 n SER 55 Cb 0.94 -0.46 0.16 0.00 -0.26 0.00 0.00 64.21 64.59 1yq2 n SER 55 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1yq2 h VAL 56 N 1.85 1.42 -3.08 -3.33 3.04 -1.88 -3.45 116.25 110.81 1yq2 h VAL 56 Ca 0.09 -2.03 -0.54 0.00 -1.01 0.00 0.00 66.70 63.21 1yq2 h VAL 56 Cb 1.22 2.07 -0.02 0.00 -2.01 0.00 0.00 31.29 32.55 1yq2 h VAL 56 CO 0.23 0.59 -0.24 -0.76 -1.01 0.00 0.00 177.57 176.37 1yq2 s LEU 57 N -7.75 4.16 0.44 3.16 1.43 -1.26 -4.94 118.68 113.92 1yq2 s LEU 57 Ca -0.02 0.59 -0.23 0.00 -1.03 0.00 0.00 54.13 53.44 1yq2 s LEU 57 Cb 0.13 -3.37 -0.10 0.00 0.03 0.00 0.00 46.19 42.87 1yq2 s LEU 57 CO 0.77 -0.09 0.89 -2.65 0.23 0.00 0.00 176.35 175.50 1yq2 n PRO 58 N -0.61 1.10 -1.68 1.29 -0.02 -1.26 -4.87 135.00 128.95 1yq2 n PRO 58 Ca -0.03 0.40 -0.45 0.00 -2.02 0.00 0.00 63.50 61.40 1yq2 n PRO 58 Cb 0.53 -1.93 -0.04 0.00 -0.02 0.00 0.00 33.50 32.05 1yq2 n PRO 58 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1yq2 n SER 59 N 0.54 3.33 0.00 2.55 2.88 -1.26 -1.57 113.62 120.09 1yq2 n SER 59 Ca 0.10 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 1yq2 n SER 59 Cb 0.40 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.41 1yq2 n SER 59 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1yq2 n GLY 60 N 3.63 2.49 3.73 0.46 0.00 -1.26 -5.07 105.19 109.17 1yq2 n GLY 60 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1yq2 n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yq2 s GLU 61 N -0.13 4.42 0.62 1.61 2.12 -0.61 -5.06 118.70 121.68 1yq2 s GLU 61 Ca 0.00 0.87 -0.10 0.00 0.36 0.00 0.00 54.97 56.11 1yq2 s GLU 61 Cb 0.00 -3.41 -0.02 0.00 0.26 0.00 0.00 34.13 30.97 1yq2 s GLU 61 CO 0.00 0.18 0.99 0.95 -0.54 0.00 0.00 175.26 176.84 1yq2 s THR 62 N 0.40 4.25 0.24 -1.70 -4.23 -1.26 -4.87 115.64 108.47 1yq2 s THR 62 Ca 0.36 0.54 -0.06 0.00 -1.18 0.00 0.00 61.69 61.35 1yq2 s THR 62 Cb -0.18 -3.70 0.23 0.00 1.34 0.00 0.00 72.50 70.18 1yq2 s THR 62 CO 0.19 -0.86 1.68 0.58 -0.54 0.00 0.00 174.62 175.66 1yq2 h VAL 63 N -0.31 0.50 -0.15 2.29 2.07 -1.97 -1.38 116.25 117.30 1yq2 h VAL 63 Ca -0.45 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 66.96 1yq2 h VAL 63 Cb 1.22 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1yq2 h VAL 63 CO 0.62 0.04 -0.08 -0.62 0.02 0.00 0.00 177.57 177.55 1yq2 n GLU 64 N -5.20 1.95 0.28 1.57 1.02 -1.26 -4.68 120.64 114.32 1yq2 n GLU 64 Ca 0.13 -2.88 0.16 0.00 -0.02 0.00 0.00 57.16 54.55 1yq2 n GLU 64 Cb 0.44 -1.69 0.91 0.00 -0.02 0.00 0.00 31.44 31.08 1yq2 n GLU 64 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1yq2 h GLY 65 N 0.90 0.00 1.78 0.62 0.00 -1.61 -1.94 103.07 102.82 1yq2 h GLY 65 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.38 1yq2 h GLY 65 CO 0.15 0.00 0.10 -0.24 0.00 0.00 0.00 176.54 176.55 1yq2 h VAL 66 N 0.00 0.08 0.00 4.60 3.04 -1.83 -2.39 116.25 119.75 1yq2 h VAL 66 Ca 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.71 1yq2 h VAL 66 Cb 0.13 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 30.31 1yq2 h VAL 66 CO -0.00 0.00 -0.25 0.00 -1.01 0.00 0.00 177.57 176.31 1yq2 h ALA 67 N 1.81 0.85 -2.68 3.17 0.00 -1.74 -3.47 119.26 117.19 1yq2 h ALA 67 Ca 0.01 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.42 1yq2 h ALA 67 Cb 0.22 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.03 1yq2 h ALA 67 CO -0.00 0.00 0.46 0.00 0.00 0.00 0.00 179.25 179.71 1yq2 s ALA 68 N -3.16 3.24 0.38 0.00 0.00 -0.90 -3.23 121.76 118.10 1yq2 s ALA 68 Ca 0.08 0.84 0.25 0.00 0.00 0.00 0.00 51.96 53.12 1yq2 s ALA 68 Cb 0.11 -3.32 1.28 0.00 0.00 0.00 0.00 23.12 21.20 1yq2 s ALA 68 CO 0.66 -0.25 2.01 0.93 0.00 0.00 0.00 175.76 179.11 1yq2 h GLU 69 N 3.10 0.00 -0.00 0.00 5.08 -1.90 -2.37 114.58 118.49 1yq2 h GLU 69 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1yq2 h GLU 69 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1yq2 h GLU 69 CO 0.64 0.16 -0.07 -1.13 -1.00 0.00 0.00 179.01 177.62 1yq2 n SER 70 N -3.70 0.15 -4.77 1.42 3.41 -1.26 -4.92 113.62 103.94 1yq2 n SER 70 Ca -0.02 -0.06 -0.41 0.00 -0.26 0.00 0.00 58.87 58.13 1yq2 n SER 70 Cb 0.28 -0.25 -0.01 0.00 -0.26 0.00 0.00 64.21 63.97 1yq2 n SER 70 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1yq2 s TYR 71 N -2.71 2.65 -0.42 7.33 5.04 -0.89 -4.97 117.35 123.37 1yq2 s TYR 71 Ca 0.23 1.10 -0.12 0.00 -2.44 0.00 0.00 57.07 55.83 1yq2 s TYR 71 Cb 0.20 -4.02 0.06 0.00 0.35 0.00 0.00 41.96 38.55 1yq2 s TYR 71 CO 0.51 -3.06 0.29 0.34 -1.34 0.00 0.00 175.55 172.28 1yq2 s ASP 72 N -0.02 5.86 -0.20 4.32 3.68 -1.26 -4.89 116.67 124.15 1yq2 s ASP 72 Ca 0.55 -1.28 0.15 0.00 2.13 0.00 0.00 52.55 54.09 1yq2 s ASP 72 Cb -0.46 -2.07 0.49 0.00 -1.45 0.00 0.00 42.92 39.42 1yq2 s ASP 72 CO 0.59 -0.53 1.39 -0.90 0.13 0.00 0.00 175.17 175.85 1yq2 n ASP 73 N 5.04 3.24 -0.23 -0.34 5.75 -1.26 -4.78 116.55 123.98 1yq2 n ASP 73 Ca -0.11 -3.25 0.02 0.00 -0.01 0.00 0.00 54.79 51.43 1yq2 n ASP 73 Cb 0.44 -0.55 0.25 0.00 -1.03 0.00 0.00 41.12 40.23 1yq2 n ASP 73 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1yq2 h ALA 74 N 1.29 1.50 0.00 2.12 0.00 -2.01 -1.30 119.26 120.86 1yq2 h ALA 74 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1yq2 h ALA 74 Cb 1.43 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1yq2 h ALA 74 CO 0.23 0.44 0.00 0.00 0.00 0.00 0.00 179.25 179.93 1yq2 n ALA 75 N -2.42 2.50 -1.77 0.00 0.00 -1.26 -4.93 120.51 112.62 1yq2 n ALA 75 Ca 0.09 -0.16 -0.37 0.00 0.00 0.00 0.00 53.44 53.01 1yq2 n ALA 75 Cb 0.08 -1.48 -0.02 0.00 0.00 0.00 0.00 19.45 18.03 1yq2 n ALA 75 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1yq2 s TRP 76 N -2.37 3.02 1.23 0.00 0.52 -0.49 -5.05 118.94 115.79 1yq2 s TRP 76 Ca 0.34 1.57 -0.18 0.00 0.02 0.00 0.00 56.10 57.85 1yq2 s TRP 76 Cb 0.20 -3.29 0.30 0.00 -1.15 0.00 0.00 33.47 29.52 1yq2 s TRP 76 CO 0.41 -1.20 1.03 -0.51 0.02 0.00 0.00 176.95 176.70 1yq2 s ASP 77 N -1.42 0.59 0.30 2.95 -0.00 -1.24 -4.82 116.67 113.03 1yq2 s ASP 77 Ca 0.61 1.00 0.10 0.00 -0.00 0.00 0.00 52.55 54.26 1yq2 s ASP 77 Cb -0.26 -1.49 -0.06 0.00 -0.00 0.00 0.00 42.92 41.11 1yq2 s ASP 77 CO 0.32 -4.37 -0.14 0.42 -0.00 0.00 0.00 175.17 171.41 1yq2 s THR 78 N -2.65 2.21 -0.04 -1.27 -4.23 -1.26 -1.31 115.64 107.09 1yq2 s THR 78 Ca 0.69 -2.27 -0.03 0.00 -1.18 0.00 0.00 61.69 58.89 1yq2 s THR 78 Cb -0.16 -2.43 0.02 0.00 1.34 0.00 0.00 72.50 71.26 1yq2 s THR 78 CO 0.59 -0.33 0.10 -0.22 -0.54 0.00 0.00 174.62 174.22 1yq2 s LEU 79 N -3.52 1.46 0.29 4.79 2.96 0.09 -4.81 118.68 119.93 1yq2 s LEU 79 Ca 0.30 0.20 -0.29 0.00 -0.22 0.00 0.00 54.13 54.12 1yq2 s LEU 79 Cb -0.01 0.31 -0.10 0.00 0.50 0.00 0.00 46.19 46.89 1yq2 s LEU 79 CO 0.14 -0.06 1.41 -2.16 -1.32 0.00 0.00 176.35 174.37 1yq2 s PRO 80 N 0.30 4.27 -0.15 0.98 0.04 -1.26 -1.38 135.00 137.79 1yq2 s PRO 80 Ca -0.02 2.32 0.02 0.00 0.04 0.00 0.00 61.00 63.36 1yq2 s PRO 80 Cb -0.03 -3.08 0.01 0.00 0.04 0.00 0.00 34.50 31.44 1yq2 s PRO 80 CO -0.01 -0.38 -0.21 0.08 0.04 0.00 0.00 177.00 176.52 1yq2 s VAL 81 N -0.43 2.02 0.12 -0.36 1.01 0.17 -3.07 120.40 119.86 1yq2 s VAL 81 Ca 0.56 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 61.30 1yq2 s VAL 81 Cb -0.42 -1.80 -0.06 0.00 0.00 0.00 0.00 36.38 34.10 1yq2 s VAL 81 CO 0.48 0.54 0.98 -2.16 0.00 0.00 0.00 175.10 174.94 1yq2 s PRO 82 N 1.00 4.69 0.25 2.72 0.04 -1.26 -0.35 135.00 142.09 1yq2 s PRO 82 Ca -0.03 1.50 -0.22 0.00 0.04 0.00 0.00 61.00 62.29 1yq2 s PRO 82 Cb -0.15 -3.36 0.05 0.00 0.04 0.00 0.00 34.50 31.08 1yq2 s PRO 82 CO -0.06 0.20 0.85 -1.54 0.04 0.00 0.00 177.00 176.49 1yq2 s SER 83 N -0.05 -0.16 -0.17 6.66 1.04 -0.50 -4.93 113.70 115.59 1yq2 s SER 83 Ca 0.47 -0.64 -0.08 0.00 0.48 0.00 0.00 55.95 56.18 1yq2 s SER 83 Cb -0.24 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.48 1yq2 s SER 83 CO 0.31 -1.22 0.10 -1.00 0.98 0.00 0.00 173.24 172.41 1yq2 s HIS 84 N -3.24 3.38 -0.25 5.02 3.76 -1.26 -3.09 115.29 119.61 1yq2 s HIS 84 Ca 0.13 0.28 0.27 0.00 -0.15 0.00 0.00 55.06 55.59 1yq2 s HIS 84 Cb -0.04 -2.06 1.15 0.00 1.11 0.00 0.00 32.58 32.74 1yq2 s HIS 84 CO 0.06 0.35 1.82 0.11 -0.85 0.00 0.00 174.74 176.22 1yq2 h TRP 85 N 6.23 0.00 -0.15 1.40 0.09 -1.80 -1.87 115.95 119.84 1yq2 h TRP 85 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.55 1yq2 h TRP 85 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.41 1yq2 h TRP 85 CO 0.61 0.00 0.00 1.33 0.09 0.00 0.00 178.44 180.47 1yq2 n VAL 86 N -2.54 0.19 -4.93 0.12 0.24 -1.26 -4.39 118.33 105.76 1yq2 n VAL 86 Ca 0.01 -0.35 -0.30 0.00 -2.04 0.00 0.00 64.34 61.67 1yq2 n VAL 86 Cb 0.24 0.40 -0.15 0.00 -1.47 0.00 0.00 33.84 32.86 1yq2 n VAL 86 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1yq2 s MET 87 N -1.81 1.78 -0.77 7.34 -1.94 -0.71 -4.18 119.30 119.02 1yq2 s MET 87 Ca 0.33 -1.05 0.00 0.00 -1.71 0.00 0.00 55.69 53.26 1yq2 s MET 87 Cb 0.18 -1.91 0.00 0.00 2.01 0.00 0.00 34.83 35.11 1yq2 s MET 87 CO 0.27 0.50 0.00 0.41 -0.01 0.00 0.00 175.02 176.19 1yq2 n GLY 88 N 1.90 0.90 0.07 -0.03 0.00 -1.26 -4.75 105.19 102.02 1yq2 n GLY 88 Ca -0.17 -0.39 0.03 0.00 0.00 0.00 0.00 46.02 45.50 1yq2 n GLY 88 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yq2 n GLN 89 N -2.19 1.77 -4.05 1.61 1.13 -1.26 -5.01 117.38 109.39 1yq2 n GLN 89 Ca -0.07 -1.70 -0.32 0.00 -1.94 0.00 0.00 57.00 52.97 1yq2 n GLN 89 Cb 0.31 -1.06 -0.00 0.00 0.11 0.00 0.00 30.24 29.60 1yq2 n GLN 89 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1yq2 n ASP 90 N -0.71 -3.30 0.00 1.08 8.00 -1.26 -1.63 116.55 118.73 1yq2 n ASP 90 Ca 0.05 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.64 1yq2 n ASP 90 Cb 0.45 -3.28 0.00 0.00 -0.02 0.00 0.00 41.12 38.28 1yq2 n ASP 90 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yq2 n GLY 91 N -1.60 0.56 0.38 0.44 0.00 -1.26 -4.92 105.19 98.79 1yq2 n GLY 91 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.14 1yq2 n GLY 91 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1yq2 h LYS 92 N 1.52 0.60 -0.59 1.61 3.64 -1.65 -2.29 116.57 119.41 1yq2 h LYS 92 Ca 0.00 -0.04 -0.43 0.00 -1.27 0.00 0.00 60.65 58.92 1yq2 h LYS 92 Cb 0.12 -0.14 -0.32 0.00 -0.41 0.00 0.00 32.23 31.49 1yq2 h LYS 92 CO 0.00 0.40 -0.64 0.66 -2.27 0.00 0.00 179.45 177.60 1yq2 n TYR 93 N -4.56 2.14 -1.19 1.91 4.02 -1.26 -5.09 117.16 113.14 1yq2 n TYR 93 Ca 0.18 -2.09 0.00 0.00 -0.01 0.00 0.00 57.90 55.98 1yq2 n TYR 93 Cb 0.52 -0.38 0.00 0.00 -0.02 0.00 0.00 39.34 39.46 1yq2 n TYR 93 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1yq2 n GLY 94 N -0.82 -2.50 3.12 2.72 0.00 -0.86 -4.50 105.19 102.35 1yq2 n GLY 94 Ca 0.39 -1.77 -0.08 0.00 0.00 0.00 0.00 46.02 44.56 1yq2 n GLY 94 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yq2 s ARG 95 N -0.42 0.70 0.78 1.61 1.81 -1.26 -4.37 118.95 117.79 1yq2 s ARG 95 Ca 0.00 -1.27 -0.15 0.00 -1.72 0.00 0.00 55.73 52.60 1yq2 s ARG 95 Cb 0.00 0.04 0.04 0.00 -0.45 0.00 0.00 34.95 34.58 1yq2 s ARG 95 CO 0.00 -0.07 1.00 -2.30 -0.68 0.00 0.00 175.30 173.24 1yq2 n PRO 96 N 0.05 0.30 -4.63 3.54 -0.02 -1.26 -4.97 135.00 128.01 1yq2 n PRO 96 Ca -0.13 0.17 -0.25 0.00 -2.02 0.00 0.00 63.50 61.26 1yq2 n PRO 96 Cb 0.61 -2.26 -0.17 0.00 -0.02 0.00 0.00 33.50 31.66 1yq2 n PRO 96 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1yq2 s ILE 97 N -1.99 1.21 -0.24 4.25 1.01 -1.20 -4.83 121.20 119.40 1yq2 s ILE 97 Ca 0.72 -0.52 -0.05 0.00 0.00 0.00 0.00 60.65 60.80 1yq2 s ILE 97 Cb -0.31 -1.10 -0.00 0.00 0.01 0.00 0.00 42.46 41.05 1yq2 s ILE 97 CO 0.52 0.37 -0.01 -0.47 0.00 0.00 0.00 174.94 175.36 1yq2 s TYR 98 N 0.65 3.02 0.11 3.97 5.04 -1.26 -0.44 117.35 128.44 1yq2 s TYR 98 Ca -0.15 -0.94 0.08 0.00 -2.44 0.00 0.00 57.07 53.61 1yq2 s TYR 98 Cb -0.16 -2.15 -0.04 0.00 0.35 0.00 0.00 41.96 39.97 1yq2 s TYR 98 CO 0.04 -0.55 -0.19 0.95 -1.34 0.00 0.00 175.55 174.47 1yq2 s THR 99 N 1.48 1.60 0.00 4.34 -4.23 -1.25 -2.34 115.64 115.24 1yq2 s THR 99 Ca 0.05 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 1yq2 s THR 99 Cb -0.15 -1.53 0.00 0.00 1.34 0.00 0.00 72.50 72.16 1yq2 s THR 99 CO -0.01 -0.16 0.00 -3.20 -0.54 0.00 0.00 174.62 170.70 1yq2 n ASN 100 N 0.93 0.00 -0.10 3.99 2.85 -1.26 -3.24 115.26 118.43 1yq2 n ASN 100 Ca -0.18 0.00 -0.21 0.00 -0.11 0.00 0.00 54.58 54.07 1yq2 n ASN 100 Cb 0.55 0.00 -0.12 0.00 1.24 0.00 0.00 39.78 41.44 1yq2 n ASN 100 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1yq2 n VAL 101 N -1.00 1.57 -1.89 3.44 0.31 -1.26 -4.00 118.33 115.49 1yq2 n VAL 101 Ca 0.00 -0.51 -0.41 0.00 -0.01 0.00 0.00 64.34 63.41 1yq2 n VAL 101 Cb 0.00 -1.64 -0.02 0.00 -0.91 0.00 0.00 33.84 31.27 1yq2 n VAL 101 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yq2 s GLN 102 N -2.51 4.19 0.40 5.55 -2.07 -1.26 -3.58 119.66 120.38 1yq2 s GLN 102 Ca -0.32 2.45 -0.25 0.00 -1.82 0.00 0.00 55.36 55.41 1yq2 s GLN 102 Cb 0.09 -3.06 -0.08 0.00 -1.09 0.00 0.00 33.01 28.87 1yq2 s GLN 102 CO 0.62 -0.52 1.18 0.71 -1.32 0.00 0.00 175.29 175.96 1yq2 s TYR 103 N -0.13 3.03 -1.62 9.60 2.02 -1.26 -4.81 117.35 124.18 1yq2 s TYR 103 Ca 0.60 1.54 0.05 0.00 -0.37 0.00 0.00 57.07 58.89 1yq2 s TYR 103 Cb -0.45 -3.42 0.18 0.00 -0.40 0.00 0.00 41.96 37.86 1yq2 s TYR 103 CO 0.47 -1.41 1.03 -0.35 -1.57 0.00 0.00 175.55 173.72 1yq2 n PRO 104 N 0.05 1.60 -4.09 -1.71 -0.04 -1.26 -4.81 135.00 124.74 1yq2 n PRO 104 Ca 0.04 -0.70 -0.07 0.00 -0.04 0.00 0.00 63.50 62.74 1yq2 n PRO 104 Cb 0.46 -1.32 -0.10 0.00 -0.04 0.00 0.00 33.50 32.50 1yq2 n PRO 104 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1yq2 s PHE 105 N -1.65 0.52 0.60 0.54 -0.71 -1.26 -5.00 117.98 111.01 1yq2 s PHE 105 Ca 0.13 -1.06 -0.19 0.00 -1.04 0.00 0.00 56.93 54.77 1yq2 s PHE 105 Cb 0.08 -0.39 -0.04 0.00 -1.21 0.00 0.00 43.02 41.46 1yq2 s PHE 105 CO 0.07 -0.38 1.05 -2.30 -1.34 0.00 0.00 175.22 172.32 1yq2 n PRO 106 N 0.13 1.00 -2.84 1.99 -0.02 -1.26 -4.91 135.00 129.10 1yq2 n PRO 106 Ca -0.14 0.39 -0.43 0.00 -2.02 0.00 0.00 63.50 61.29 1yq2 n PRO 106 Cb 0.61 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.81 1yq2 n PRO 106 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1yq2 s ILE 107 N -1.47 4.45 -0.37 4.25 1.01 -1.26 -4.77 121.20 123.04 1yq2 s ILE 107 Ca 0.76 -1.00 0.13 0.00 0.00 0.00 0.00 60.65 60.54 1yq2 s ILE 107 Cb -0.42 -4.80 0.41 0.00 0.01 0.00 0.00 42.46 37.67 1yq2 s ILE 107 CO 0.46 -1.57 1.06 -0.67 0.00 0.00 0.00 174.94 174.22 1yq2 n ASP 108 N 7.36 -0.03 -4.77 3.58 2.03 -1.26 -5.13 116.55 118.33 1yq2 n ASP 108 Ca 0.16 -2.78 -0.40 0.00 0.52 0.00 0.00 54.79 52.28 1yq2 n ASP 108 Cb 0.48 0.17 0.01 0.00 -0.72 0.00 0.00 41.12 41.05 1yq2 n ASP 108 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1yq2 s PRO 109 N -1.69 3.88 -0.09 -0.67 0.04 -1.26 -1.19 135.00 134.03 1yq2 s PRO 109 Ca 0.27 2.38 0.12 0.00 0.04 0.00 0.00 61.00 63.81 1yq2 s PRO 109 Cb 0.41 -2.77 0.50 0.00 0.04 0.00 0.00 34.50 32.67 1yq2 s PRO 109 CO -0.03 -0.64 1.34 -0.35 0.04 0.00 0.00 177.00 177.36 1yq2 n PRO 110 N 0.08 2.98 -2.40 0.56 -0.04 -1.26 -5.12 135.00 129.81 1yq2 n PRO 110 Ca 0.04 -1.95 -0.38 0.00 -0.04 0.00 0.00 63.50 61.17 1yq2 n PRO 110 Cb 0.42 -1.75 -0.03 0.00 -0.04 0.00 0.00 33.50 32.10 1yq2 n PRO 110 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1yq2 s HIS 111 N -1.83 3.16 0.24 0.54 3.76 -0.33 -4.16 115.29 116.67 1yq2 s HIS 111 Ca 0.35 1.60 0.07 0.00 -0.15 0.00 0.00 55.06 56.92 1yq2 s HIS 111 Cb 0.23 -3.28 -0.05 0.00 1.11 0.00 0.00 32.58 30.59 1yq2 s HIS 111 CO 0.15 -1.01 -0.10 0.14 -0.85 0.00 0.00 174.74 173.07 1yq2 s VAL 112 N -1.50 1.67 0.80 -0.90 -7.23 -1.26 -4.64 120.40 107.34 1yq2 s VAL 112 Ca 0.57 -2.17 -0.13 0.00 -1.81 0.00 0.00 61.98 58.44 1yq2 s VAL 112 Cb -0.27 -2.24 0.08 0.00 0.56 0.00 0.00 36.38 34.51 1yq2 s VAL 112 CO 0.34 -0.45 1.21 -2.84 -0.31 0.00 0.00 175.10 173.05 1yq2 s PRO 113 N -3.69 1.66 0.27 4.82 0.02 -1.26 -4.94 135.00 131.87 1yq2 s PRO 113 Ca 0.26 1.76 0.00 0.00 0.02 0.00 0.00 61.00 63.04 1yq2 s PRO 113 Cb 0.02 -1.78 0.38 0.00 0.02 0.00 0.00 34.50 33.14 1yq2 s PRO 113 CO 0.09 -2.20 1.74 -0.44 -0.33 0.00 0.00 177.00 175.86 1yq2 h ASP 114 N -0.87 0.62 -2.29 2.53 3.32 -1.96 -3.37 116.42 114.41 1yq2 h ASP 114 Ca -0.46 -0.18 -0.53 0.00 0.02 0.00 0.00 57.03 55.88 1yq2 h ASP 114 Cb 1.30 -0.17 -0.07 0.00 0.22 0.00 0.00 39.33 40.61 1yq2 h ASP 114 CO 0.46 0.78 1.13 0.00 -1.72 0.00 0.00 179.24 179.89 1yq2 s ALA 115 N -4.74 2.61 -0.36 3.45 0.00 -1.26 -4.43 121.76 117.04 1yq2 s ALA 115 Ca -0.08 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 50.72 1yq2 s ALA 115 Cb 0.14 -4.26 0.14 0.00 0.00 0.00 0.00 23.12 19.14 1yq2 s ALA 115 CO 0.80 -3.43 0.25 1.21 0.00 0.00 0.00 175.76 174.59 1yq2 s ASN 116 N 4.85 2.56 -0.16 0.00 3.84 -0.28 -4.98 114.94 120.77 1yq2 s ASN 116 Ca 0.44 -2.06 -0.38 0.00 0.21 0.00 0.00 52.86 51.07 1yq2 s ASN 116 Cb -0.09 -0.18 -0.15 0.00 -0.55 0.00 0.00 41.25 40.27 1yq2 s ASN 116 CO 0.17 -0.30 1.67 -2.65 -2.79 0.00 0.00 177.10 173.20 1yq2 n PRO 117 N 4.08 1.33 -3.96 0.43 -0.02 -1.25 -3.24 135.00 132.37 1yq2 n PRO 117 Ca 0.12 0.48 -0.29 0.00 -2.02 0.00 0.00 63.50 61.79 1yq2 n PRO 117 Cb 0.39 -2.18 -0.16 0.00 -0.02 0.00 0.00 33.50 31.52 1yq2 n PRO 117 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1yq2 s THR 118 N 2.83 1.40 -0.22 3.45 2.01 -0.09 -0.60 115.64 124.41 1yq2 s THR 118 Ca 0.94 -0.68 -0.11 0.00 0.31 0.00 0.00 61.69 62.15 1yq2 s THR 118 Cb -0.98 -1.43 -0.05 0.00 0.01 0.00 0.00 72.50 70.05 1yq2 s THR 118 CO 0.59 0.29 0.17 -0.83 -0.69 0.00 0.00 174.62 174.15 1yq2 s GLY 119 N 1.53 2.02 -0.19 4.40 0.00 0.86 -0.22 107.32 115.71 1yq2 s GLY 119 Ca 0.02 -0.79 -0.11 0.00 0.00 0.00 0.00 44.72 43.84 1yq2 s GLY 119 CO -0.09 0.35 0.19 0.99 0.00 0.00 0.00 173.10 174.54 1yq2 s ASP 120 N 0.83 6.26 -0.07 1.64 1.01 -0.20 -0.42 116.67 125.72 1yq2 s ASP 120 Ca 0.09 0.30 0.05 0.00 0.71 0.00 0.00 52.55 53.69 1yq2 s ASP 120 Cb -0.13 -2.12 -0.00 0.00 1.01 0.00 0.00 42.92 41.68 1yq2 s ASP 120 CO 0.03 0.14 -0.22 -0.36 0.21 0.00 0.00 175.17 174.96 1yq2 s PHE 121 N 0.51 2.28 -0.03 4.23 0.40 0.60 -2.02 117.98 123.94 1yq2 s PHE 121 Ca 0.11 -0.77 0.01 0.00 -0.60 0.00 0.00 56.93 55.68 1yq2 s PHE 121 Cb -0.12 -1.52 0.01 0.00 0.51 0.00 0.00 43.02 41.91 1yq2 s PHE 121 CO 0.01 -0.27 -0.05 1.03 0.70 0.00 0.00 175.22 176.63 1yq2 s ARG 122 N 0.08 0.74 -0.04 0.44 0.52 0.07 -0.51 118.95 120.25 1yq2 s ARG 122 Ca -0.09 -0.14 -0.01 0.00 -0.52 0.00 0.00 55.73 54.97 1yq2 s ARG 122 Cb -0.15 -0.74 0.03 0.00 0.52 0.00 0.00 34.95 34.62 1yq2 s ARG 122 CO 0.05 -0.01 0.07 0.50 0.02 0.00 0.00 175.30 175.92 1yq2 s ARG 123 N 0.59 -0.01 -0.03 3.54 6.06 -0.02 -1.78 118.95 127.30 1yq2 s ARG 123 Ca -0.08 0.28 -0.02 0.00 -2.50 0.00 0.00 55.73 53.41 1yq2 s ARG 123 Cb -0.11 -0.27 -0.04 0.00 0.06 0.00 0.00 34.95 34.59 1yq2 s ARG 123 CO 0.00 -0.20 0.11 1.03 -2.50 0.00 0.00 175.30 173.74 1yq2 s ARG 124 N 1.33 3.22 0.13 5.12 0.52 -1.26 -0.52 118.95 127.49 1yq2 s ARG 124 Ca -0.06 -0.37 -0.18 0.00 -0.52 0.00 0.00 55.73 54.59 1yq2 s ARG 124 Cb -0.12 -2.97 0.05 0.00 0.52 0.00 0.00 34.95 32.42 1yq2 s ARG 124 CO -0.04 0.68 0.46 -0.59 0.02 0.00 0.00 175.30 175.83 1yq2 s PHE 125 N -1.17 -0.30 -0.15 -0.53 -0.12 -0.69 -5.01 117.98 110.01 1yq2 s PHE 125 Ca 0.22 0.02 -0.03 0.00 -0.05 0.00 0.00 56.93 57.09 1yq2 s PHE 125 Cb -0.12 0.34 -0.03 0.00 -0.63 0.00 0.00 43.02 42.59 1yq2 s PHE 125 CO 0.12 -0.74 -0.05 0.34 -0.05 0.00 0.00 175.22 174.84 1yq2 s ASP 126 N -2.77 4.69 -0.20 1.98 2.15 -1.26 -1.11 116.67 120.15 1yq2 s ASP 126 Ca 0.02 -0.15 -0.04 0.00 0.43 0.00 0.00 52.55 52.82 1yq2 s ASP 126 Cb 0.01 -1.73 -0.01 0.00 -0.30 0.00 0.00 42.92 40.89 1yq2 s ASP 126 CO -0.12 0.18 -0.04 -0.69 -0.17 0.00 0.00 175.17 174.33 1yq2 s VAL 127 N 0.28 3.51 0.27 1.11 1.01 -0.25 -4.97 120.40 121.36 1yq2 s VAL 127 Ca -0.04 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 1yq2 s VAL 127 Cb -0.14 -2.58 -0.13 0.00 0.00 0.00 0.00 36.38 33.53 1yq2 s VAL 127 CO 0.03 0.44 1.29 -2.65 0.00 0.00 0.00 175.10 174.21 1yq2 n PRO 128 N 4.41 1.86 0.25 2.72 -0.02 -1.26 -1.17 135.00 141.79 1yq2 n PRO 128 Ca -0.18 0.66 0.10 0.00 -2.02 0.00 0.00 63.50 62.06 1yq2 n PRO 128 Cb 0.51 -2.23 0.68 0.00 -0.02 0.00 0.00 33.50 32.44 1yq2 n PRO 128 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 h ALA 129 N 3.33 1.50 0.00 3.55 0.00 -1.95 -1.74 119.26 123.94 1yq2 h ALA 129 Ca -0.44 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 1yq2 h ALA 129 Cb 1.29 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1yq2 h ALA 129 CO 0.69 0.15 -0.11 0.37 0.00 0.00 0.00 179.25 180.35 1yq2 h GLN 130 N 0.00 0.00 0.00 0.00 4.15 -1.99 -2.30 115.11 114.97 1yq2 h GLN 130 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1yq2 h GLN 130 Cb 0.26 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.95 1yq2 h GLN 130 CO 0.02 0.11 0.00 0.91 -1.93 0.00 0.00 178.83 177.93 1yq2 n TRP 131 N -4.35 0.00 0.64 3.99 7.02 -0.65 -1.52 117.44 122.57 1yq2 n TRP 131 Ca -0.03 0.00 0.09 0.00 -1.02 0.00 0.00 57.50 56.54 1yq2 n TRP 131 Cb 0.18 -0.50 0.09 0.00 -2.42 0.00 0.00 31.31 28.66 1yq2 n TRP 131 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1yq2 n PHE 132 N -1.50 0.07 -1.66 -5.99 3.72 -0.87 -4.72 117.46 106.52 1yq2 n PHE 132 Ca 0.01 -0.05 -0.29 0.00 -0.05 0.00 0.00 57.45 57.07 1yq2 n PHE 132 Cb 0.06 -0.00 0.11 0.00 -0.94 0.00 0.00 39.48 38.71 1yq2 n PHE 132 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1yq2 s GLU 133 N -1.42 1.67 0.23 -1.08 2.02 -0.57 -4.95 118.70 114.59 1yq2 s GLU 133 Ca 0.22 0.33 0.23 0.00 0.02 0.00 0.00 54.97 55.77 1yq2 s GLU 133 Cb 0.15 -1.90 0.94 0.00 0.10 0.00 0.00 34.13 33.43 1yq2 s GLU 133 CO 0.22 -1.84 1.70 -1.13 0.02 0.00 0.00 175.26 174.23 1yq2 n SER 134 N -3.53 0.62 0.00 -0.19 3.41 -1.26 -2.14 113.62 110.53 1yq2 n SER 134 Ca 0.07 0.64 0.07 0.00 -0.26 0.00 0.00 58.87 59.39 1yq2 n SER 134 Cb 0.59 -0.78 0.31 0.00 -0.26 0.00 0.00 64.21 64.07 1yq2 n SER 134 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1yq2 n THR 135 N -2.18 0.88 -4.53 6.66 -2.24 -1.26 -4.54 114.28 107.08 1yq2 n THR 135 Ca 0.03 0.22 -0.33 0.00 -2.27 0.00 0.00 64.05 61.69 1yq2 n THR 135 Cb 0.24 -0.99 -0.15 0.00 -2.10 0.00 0.00 70.33 67.33 1yq2 n THR 135 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1yq2 s THR 136 N -2.82 2.93 -0.01 4.28 2.01 -0.91 -1.49 115.64 119.64 1yq2 s THR 136 Ca 0.09 -0.68 -0.06 0.00 0.31 0.00 0.00 61.69 61.35 1yq2 s THR 136 Cb 0.09 -2.25 -0.29 0.00 0.01 0.00 0.00 72.50 70.06 1yq2 s THR 136 CO 0.23 0.51 0.80 0.00 -0.69 0.00 0.00 174.62 175.46 1yq2 h ALA 137 N 7.18 0.22 -2.97 7.40 0.00 -0.70 -3.43 119.26 126.95 1yq2 h ALA 137 Ca -0.31 -1.12 -0.01 0.00 0.00 0.00 0.00 54.91 53.47 1yq2 h ALA 137 Cb 1.19 0.34 -0.11 0.00 0.00 0.00 0.00 17.79 19.21 1yq2 h ALA 137 CO 0.57 1.09 0.18 0.00 0.00 0.00 0.00 179.25 181.09 1yq2 s ALA 138 N -2.60 -1.47 -0.11 0.00 0.00 -1.16 -5.01 121.76 111.41 1yq2 s ALA 138 Ca -0.11 0.33 0.03 0.00 0.00 0.00 0.00 51.96 52.20 1yq2 s ALA 138 Cb 0.06 0.87 0.01 0.00 0.00 0.00 0.00 23.12 24.06 1yq2 s ALA 138 CO 0.86 -0.79 -0.20 -0.51 0.00 0.00 0.00 175.76 175.12 1yq2 s LEU 139 N -2.78 1.96 -0.09 0.00 1.43 -1.26 0.10 118.68 118.04 1yq2 s LEU 139 Ca 0.03 -0.52 0.03 0.00 -1.03 0.00 0.00 54.13 52.63 1yq2 s LEU 139 Cb -0.01 -1.29 -0.01 0.00 0.03 0.00 0.00 46.19 44.91 1yq2 s LEU 139 CO -0.10 0.08 -0.18 -0.89 0.23 0.00 0.00 176.35 175.49 1yq2 s THR 140 N 0.71 2.67 -0.23 5.49 2.01 -0.39 -1.50 115.64 124.40 1yq2 s THR 140 Ca -0.11 -0.82 -0.11 0.00 0.31 0.00 0.00 61.69 60.96 1yq2 s THR 140 Cb -0.16 -2.06 -0.05 0.00 0.01 0.00 0.00 72.50 70.24 1yq2 s THR 140 CO 0.02 0.55 0.16 -0.22 -0.69 0.00 0.00 174.62 174.45 1yq2 s LEU 141 N 0.02 4.15 -0.10 4.42 2.96 -0.10 -1.02 118.68 129.02 1yq2 s LEU 141 Ca -0.06 0.17 0.03 0.00 -0.22 0.00 0.00 54.13 54.05 1yq2 s LEU 141 Cb -0.15 -2.12 0.01 0.00 0.50 0.00 0.00 46.19 44.43 1yq2 s LEU 141 CO 0.05 0.09 -0.20 -0.60 -1.32 0.00 0.00 176.35 174.37 1yq2 s ARG 142 N 0.86 2.60 -0.23 1.98 3.52 0.61 -0.43 118.95 127.85 1yq2 s ARG 142 Ca 0.08 -0.72 -0.05 0.00 -0.13 0.00 0.00 55.73 54.91 1yq2 s ARG 142 Cb -0.13 -2.03 -0.02 0.00 -1.56 0.00 0.00 34.95 31.21 1yq2 s ARG 142 CO 0.03 0.09 0.01 -0.06 -0.81 0.00 0.00 175.30 174.56 1yq2 s PHE 143 N 0.55 3.02 -1.13 5.12 0.40 -0.09 -1.29 117.98 124.56 1yq2 s PHE 143 Ca -0.15 -0.69 0.28 0.00 -0.60 0.00 0.00 56.93 55.76 1yq2 s PHE 143 Cb -0.17 -2.17 1.02 0.00 0.51 0.00 0.00 43.02 42.21 1yq2 s PHE 143 CO 0.05 -0.46 1.76 -0.25 0.70 0.00 0.00 175.22 177.03 1yq2 n ASP 144 N 4.84 0.24 0.00 1.36 8.00 -0.57 -1.03 116.55 129.40 1yq2 n ASP 144 Ca -0.17 0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.38 1yq2 n ASP 144 Cb 0.51 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.43 1yq2 n ASP 144 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yq2 n GLY 145 N 1.45 1.01 2.80 0.44 0.00 -1.26 -4.18 105.19 105.46 1yq2 n GLY 145 Ca 0.08 0.56 -0.14 0.00 0.00 0.00 0.00 46.02 46.52 1yq2 n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yq2 s VAL 146 N 0.00 -0.04 -0.21 1.61 1.01 -0.95 -2.15 120.40 119.67 1yq2 s VAL 146 Ca 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.11 1yq2 s VAL 146 Cb 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 36.38 36.33 1yq2 s VAL 146 CO 0.00 0.06 -0.11 -0.70 0.00 0.00 0.00 175.10 174.35 1yq2 s GLU 147 N 0.74 3.13 -0.06 2.72 2.12 -0.26 -4.11 118.70 122.97 1yq2 s GLU 147 Ca -0.06 -0.76 0.00 0.00 0.36 0.00 0.00 54.97 54.51 1yq2 s GLU 147 Cb -0.09 -2.82 -0.04 0.00 0.26 0.00 0.00 34.13 31.45 1yq2 s GLU 147 CO -0.02 -0.23 -0.05 -1.13 -0.54 0.00 0.00 175.26 173.28 1yq2 n SER 148 N 4.70 3.54 -4.23 -1.70 3.41 -0.46 -1.58 113.62 117.31 1yq2 n SER 148 Ca -0.19 -0.03 -0.24 0.00 -0.26 0.00 0.00 58.87 58.14 1yq2 n SER 148 Cb 0.50 -0.09 -0.14 0.00 -0.26 0.00 0.00 64.21 64.22 1yq2 n SER 148 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1yq2 s ARG 149 N -2.12 1.28 0.02 4.33 3.52 -1.21 -4.09 118.95 120.68 1yq2 s ARG 149 Ca -0.08 -0.90 -0.09 0.00 -0.13 0.00 0.00 55.73 54.53 1yq2 s ARG 149 Cb 0.02 -1.38 0.00 0.00 -1.56 0.00 0.00 34.95 32.04 1yq2 s ARG 149 CO 0.14 0.35 0.18 1.52 -0.81 0.00 0.00 175.30 176.68 1yq2 s TYR 150 N -0.81 0.02 -0.00 5.12 -0.85 -0.83 -1.32 117.35 118.67 1yq2 s TYR 150 Ca 0.06 -0.15 0.08 0.00 -0.52 0.00 0.00 57.07 56.54 1yq2 s TYR 150 Cb -0.09 -0.03 -0.02 0.00 0.38 0.00 0.00 41.96 42.20 1yq2 s TYR 150 CO 0.02 -0.36 -0.24 0.21 -1.52 0.00 0.00 175.55 173.66 1yq2 s LYS 151 N -1.89 2.09 -0.09 -3.49 2.20 -0.45 -0.64 119.74 117.47 1yq2 s LYS 151 Ca -0.10 -0.95 0.03 0.00 -0.36 0.00 0.00 55.97 54.59 1yq2 s LYS 151 Cb -0.04 -2.09 0.01 0.00 -1.51 0.00 0.00 37.83 34.19 1yq2 s LYS 151 CO -0.00 0.56 -0.20 0.08 -0.36 0.00 0.00 175.35 175.42 1yq2 s VAL 152 N -0.71 1.74 -0.01 4.02 1.01 -0.21 -1.34 120.40 124.90 1yq2 s VAL 152 Ca 0.11 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.30 1yq2 s VAL 152 Cb -0.10 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 1yq2 s VAL 152 CO 0.01 0.49 -0.14 0.26 0.00 0.00 0.00 175.10 175.72 1yq2 s TRP 153 N 0.48 1.26 -0.13 5.22 0.51 -0.33 -0.06 118.94 125.89 1yq2 s TRP 153 Ca -0.17 -0.25 -0.00 0.00 -2.12 0.00 0.00 56.10 53.56 1yq2 s TRP 153 Cb -0.17 -0.82 0.02 0.00 -0.81 0.00 0.00 33.47 31.69 1yq2 s TRP 153 CO 0.07 -0.03 -0.11 0.08 -0.51 0.00 0.00 176.95 176.45 1yq2 s VAL 154 N -0.28 1.29 -1.43 4.03 1.01 -0.31 -0.75 120.40 123.95 1yq2 s VAL 154 Ca 0.04 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.47 1yq2 s VAL 154 Cb -0.06 -1.26 0.03 0.00 0.00 0.00 0.00 36.38 35.09 1yq2 s VAL 154 CO -0.00 0.40 1.01 0.59 0.00 0.00 0.00 175.10 177.10 1yq2 n ASN 155 N 4.86 -5.96 0.00 3.32 3.02 -0.38 -1.69 115.26 118.43 1yq2 n ASN 155 Ca -0.15 -0.53 0.00 0.00 -0.03 0.00 0.00 54.58 53.87 1yq2 n ASN 155 Cb 0.50 -4.73 0.00 0.00 -0.61 0.00 0.00 39.78 34.94 1yq2 n ASN 155 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yq2 n GLY 156 N -1.83 2.36 3.71 7.41 0.00 -1.20 -4.82 105.19 110.83 1yq2 n GLY 156 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1yq2 n GLY 156 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yq2 s GLN 157 N -0.09 4.22 0.07 1.61 -0.21 -0.68 -4.83 119.66 119.74 1yq2 s GLN 157 Ca 0.00 0.01 -0.31 0.00 0.02 0.00 0.00 55.36 55.09 1yq2 s GLN 157 Cb 0.00 -3.45 -0.08 0.00 1.00 0.00 0.00 33.01 30.48 1yq2 s GLN 157 CO 0.00 0.20 1.70 -2.00 -2.12 0.00 0.00 175.29 173.07 1yq2 s GLU 158 N 0.62 4.18 -0.22 2.91 2.12 -1.26 -1.16 118.70 125.88 1yq2 s GLU 158 Ca 0.14 2.38 -0.07 0.00 0.36 0.00 0.00 54.97 57.78 1yq2 s GLU 158 Cb -0.13 -3.67 -0.18 0.00 0.26 0.00 0.00 34.13 30.41 1yq2 s GLU 158 CO 0.03 -0.78 -0.06 -0.89 -0.54 0.00 0.00 175.26 173.03 1yq2 n ILE 159 N 4.85 1.58 -2.94 -3.70 2.08 0.91 -4.93 119.36 117.19 1yq2 n ILE 159 Ca 0.17 -0.47 0.00 0.00 0.56 0.00 0.00 62.75 63.01 1yq2 n ILE 159 Cb 0.40 -1.69 0.00 0.00 -0.75 0.00 0.00 39.64 37.60 1yq2 n ILE 159 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1yq2 n GLY 160 N 1.83 -1.54 2.96 7.39 0.00 -1.16 -0.91 105.19 113.76 1yq2 n GLY 160 Ca -0.43 -1.12 -0.23 0.00 0.00 0.00 0.00 46.02 44.24 1yq2 n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yq2 s VAL 161 N -2.80 0.91 0.14 1.61 1.01 -0.73 -1.04 120.40 119.51 1yq2 s VAL 161 Ca 0.00 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 61.71 1yq2 s VAL 161 Cb 0.00 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 1yq2 s VAL 161 CO 0.00 0.31 0.02 -0.83 0.00 0.00 0.00 175.10 174.61 1yq2 s GLY 162 N 0.90 1.79 0.10 4.51 0.00 0.19 -1.78 107.32 113.03 1yq2 s GLY 162 Ca -0.11 -1.25 -0.13 0.00 0.00 0.00 0.00 44.72 43.24 1yq2 s GLY 162 CO 0.01 -1.25 0.30 -0.56 0.00 0.00 0.00 173.10 171.60 1yq2 s SER 163 N -2.74 -0.08 0.00 1.64 0.01 -1.26 -1.97 113.70 109.30 1yq2 s SER 163 Ca 0.27 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 57.11 1yq2 s SER 163 Cb -0.10 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.53 1yq2 s SER 163 CO 0.19 -0.77 0.00 0.61 0.41 0.00 0.00 173.24 173.69 1yq2 n GLY 164 N -0.03 0.37 0.35 3.44 0.00 -1.26 -4.91 105.19 103.16 1yq2 n GLY 164 Ca -0.16 -0.65 0.07 0.00 0.00 0.00 0.00 46.02 45.28 1yq2 n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1yq2 h SER 165 N 0.00 0.66 -0.36 1.61 0.02 -1.77 -1.97 113.55 111.74 1yq2 h SER 165 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1yq2 h SER 165 Cb 0.00 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1yq2 h SER 165 CO 0.00 0.42 0.00 0.54 -1.14 0.00 0.00 176.83 176.65 1yq2 n ARG 166 N -4.48 3.32 -4.40 3.45 3.00 -1.26 -2.24 116.66 114.04 1yq2 n ARG 166 Ca 0.11 -2.79 -0.31 0.00 -0.01 0.00 0.00 57.85 54.84 1yq2 n ARG 166 Cb 0.24 -1.84 -0.10 0.00 0.00 0.00 0.00 32.46 30.76 1yq2 n ARG 166 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1yq2 s LEU 167 N -2.47 3.16 0.40 0.55 1.43 -0.74 -4.43 118.68 116.58 1yq2 s LEU 167 Ca 0.42 -0.20 -0.24 0.00 -1.03 0.00 0.00 54.13 53.09 1yq2 s LEU 167 Cb 0.32 -1.84 -0.09 0.00 0.03 0.00 0.00 46.19 44.61 1yq2 s LEU 167 CO 0.12 0.25 1.03 0.00 0.23 0.00 0.00 176.35 177.99 1yq2 s ALA 168 N -1.06 3.07 -0.02 4.21 0.00 -1.26 -4.31 121.76 122.40 1yq2 s ALA 168 Ca 0.18 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.79 1yq2 s ALA 168 Cb -0.11 -3.25 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1yq2 s ALA 168 CO 0.09 -0.16 0.01 -1.14 0.00 0.00 0.00 175.76 174.57 1yq2 s GLN 169 N -2.60 0.04 -0.01 0.00 2.00 -0.20 -5.00 119.66 113.90 1yq2 s GLN 169 Ca 0.58 0.11 0.03 0.00 -2.00 0.00 0.00 55.36 54.09 1yq2 s GLN 169 Cb -0.20 -0.23 -0.03 0.00 0.80 0.00 0.00 33.01 33.35 1yq2 s GLN 169 CO 0.25 -0.11 -0.09 -1.21 -0.50 0.00 0.00 175.29 173.62 1yq2 s GLU 170 N 0.76 2.51 0.07 1.67 2.02 -1.26 -0.91 118.70 123.56 1yq2 s GLU 170 Ca -0.07 -0.72 0.09 0.00 0.02 0.00 0.00 54.97 54.29 1yq2 s GLU 170 Cb -0.10 -2.46 -0.03 0.00 0.10 0.00 0.00 34.13 31.65 1yq2 s GLU 170 CO -0.02 0.61 -0.25 -0.06 0.02 0.00 0.00 175.26 175.56 1yq2 s PHE 171 N -0.92 2.15 -0.41 1.61 0.40 0.43 -1.68 117.98 119.57 1yq2 s PHE 171 Ca 0.15 -0.40 -0.22 0.00 -0.60 0.00 0.00 56.93 55.87 1yq2 s PHE 171 Cb -0.11 -1.25 0.02 0.00 0.51 0.00 0.00 43.02 42.19 1yq2 s PHE 171 CO 0.05 0.17 0.71 0.34 0.70 0.00 0.00 175.22 177.19 1yq2 s ASP 172 N -1.46 6.41 -0.02 1.36 3.68 0.11 -0.92 116.67 125.83 1yq2 s ASP 172 Ca 0.11 -0.02 0.12 0.00 2.13 0.00 0.00 52.55 54.88 1yq2 s ASP 172 Cb -0.10 -2.35 0.34 0.00 -1.45 0.00 0.00 42.92 39.36 1yq2 s ASP 172 CO 0.03 -0.76 1.28 1.33 0.13 0.00 0.00 175.17 177.18 1yq2 n VAL 173 N 5.86 1.17 -0.29 1.11 0.24 -0.56 -4.74 118.33 121.11 1yq2 n VAL 173 Ca 0.00 -1.11 0.10 0.00 -2.04 0.00 0.00 64.34 61.29 1yq2 n VAL 173 Cb 0.48 0.40 0.22 0.00 -1.47 0.00 0.00 33.84 33.48 1yq2 n VAL 173 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1yq2 h SER 174 N 2.06 -0.31 0.42 -1.34 0.02 -1.88 -0.89 113.55 111.63 1yq2 h SER 174 Ca 0.00 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1yq2 h SER 174 Cb 0.83 0.37 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1yq2 h SER 174 CO 0.03 -0.22 -0.35 0.47 -1.14 0.00 0.00 176.83 175.62 1yq2 n ASP 175 N -5.36 0.65 -0.05 3.07 8.00 -1.26 -4.15 116.55 117.45 1yq2 n ASP 175 Ca 0.18 -0.46 0.00 0.00 0.71 0.00 0.00 54.79 55.23 1yq2 n ASP 175 Cb 0.60 0.13 -0.16 0.00 -0.02 0.00 0.00 41.12 41.68 1yq2 n ASP 175 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yq2 n ALA 176 N -1.15 2.14 -1.90 2.24 0.00 -0.40 -4.97 120.51 116.47 1yq2 n ALA 176 Ca 0.09 -0.90 -0.31 0.00 0.00 0.00 0.00 53.44 52.31 1yq2 n ALA 176 Cb 0.33 -0.50 -0.01 0.00 0.00 0.00 0.00 19.45 19.27 1yq2 n ALA 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yq2 s LEU 177 N -5.06 3.45 0.13 0.00 1.43 -0.85 -4.69 118.68 113.08 1yq2 s LEU 177 Ca -0.09 1.44 0.04 0.00 -1.03 0.00 0.00 54.13 54.49 1yq2 s LEU 177 Cb 0.10 -4.43 -0.04 0.00 0.03 0.00 0.00 46.19 41.84 1yq2 s LEU 177 CO 0.86 -0.71 -0.09 0.00 0.23 0.00 0.00 176.35 176.65 1yq2 s ARG 178 N -4.61 0.96 0.24 1.70 1.70 -1.26 -5.01 118.95 112.67 1yq2 s ARG 178 Ca 0.56 -1.38 -0.30 0.00 -0.47 0.00 0.00 55.73 54.14 1yq2 s ARG 178 Cb -0.10 -0.48 -0.10 0.00 -0.57 0.00 0.00 34.95 33.70 1yq2 s ARG 178 CO 0.43 0.05 1.37 0.00 -1.08 0.00 0.00 175.30 176.06 1yq2 s ALA 179 N -3.31 3.57 0.00 7.88 0.00 -1.26 -4.62 121.76 124.02 1yq2 s ALA 179 Ca 0.14 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.33 1yq2 s ALA 179 Cb 0.03 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1yq2 s ALA 179 CO -0.01 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 175.51 1yq2 n GLY 180 N 2.09 0.95 3.70 0.00 0.00 -0.31 -4.95 105.19 106.68 1yq2 n GLY 180 Ca 0.06 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.45 1yq2 n GLY 180 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yq2 s SER 181 N -4.00 7.24 0.08 1.61 0.01 -1.26 -1.10 113.70 116.29 1yq2 s SER 181 Ca 0.00 1.51 0.01 0.00 1.31 0.00 0.00 55.95 58.78 1yq2 s SER 181 Cb 0.00 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.66 1yq2 s SER 181 CO 0.00 -0.30 -0.05 0.20 0.41 0.00 0.00 173.24 173.49 1yq2 s ASN 182 N 1.02 0.90 -0.04 2.44 0.01 -0.27 -4.79 114.94 114.21 1yq2 s ASN 182 Ca 0.48 -1.01 0.04 0.00 -0.71 0.00 0.00 52.86 51.66 1yq2 s ASN 182 Cb -0.19 0.13 0.00 0.00 0.41 0.00 0.00 41.25 41.60 1yq2 s ASN 182 CO 0.22 -0.52 -0.15 -0.22 -1.51 0.00 0.00 177.10 174.92 1yq2 s LEU 183 N -3.00 1.86 -0.11 0.60 2.96 -1.26 -1.71 118.68 118.01 1yq2 s LEU 183 Ca 0.10 -0.32 0.04 0.00 -0.22 0.00 0.00 54.13 53.73 1yq2 s LEU 183 Cb 0.06 -0.89 0.00 0.00 0.50 0.00 0.00 46.19 45.87 1yq2 s LEU 183 CO -0.07 0.12 -0.23 -0.22 -1.32 0.00 0.00 176.35 174.63 1yq2 s LEU 184 N 0.16 2.10 -0.08 -0.68 0.20 0.33 -1.25 118.68 119.45 1yq2 s LEU 184 Ca -0.05 -0.57 0.03 0.00 0.69 0.00 0.00 54.13 54.22 1yq2 s LEU 184 Cb -0.12 -1.42 0.01 0.00 -0.43 0.00 0.00 46.19 44.23 1yq2 s LEU 184 CO 0.02 0.13 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.35 1yq2 s VAL 185 N 0.50 1.54 -0.07 1.68 1.01 0.07 -0.84 120.40 124.29 1yq2 s VAL 185 Ca -0.15 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.13 1yq2 s VAL 185 Cb -0.17 -1.36 0.02 0.00 0.00 0.00 0.00 36.38 34.86 1yq2 s VAL 185 CO 0.05 0.44 -0.10 -0.69 0.00 0.00 0.00 175.10 174.81 1yq2 s VAL 186 N 0.51 1.02 -0.19 2.92 1.01 0.33 -1.18 120.40 124.81 1yq2 s VAL 186 Ca -0.16 -0.38 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 1yq2 s VAL 186 Cb -0.17 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 1yq2 s VAL 186 CO 0.06 0.34 0.02 -0.60 0.00 0.00 0.00 175.10 174.92 1yq2 s ARG 187 N 0.95 3.73 -0.09 2.72 3.52 -0.45 -0.29 118.95 129.04 1yq2 s ARG 187 Ca -0.09 -0.47 0.03 0.00 -0.13 0.00 0.00 55.73 55.06 1yq2 s ARG 187 Cb -0.15 -3.11 0.01 0.00 -1.56 0.00 0.00 34.95 30.14 1yq2 s ARG 187 CO 0.00 0.10 -0.16 0.08 -0.81 0.00 0.00 175.30 174.51 1yq2 s VAL 188 N 0.78 1.49 -0.10 7.11 1.01 0.44 -1.34 120.40 129.80 1yq2 s VAL 188 Ca 0.01 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 1yq2 s VAL 188 Cb -0.14 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 1yq2 s VAL 188 CO 0.02 0.44 -0.02 -1.00 0.00 0.00 0.00 175.10 174.54 1yq2 s HIS 189 N 0.69 3.08 0.03 5.22 0.09 -0.44 -0.10 115.29 123.87 1yq2 s HIS 189 Ca -0.13 0.05 -0.25 0.00 -0.00 0.00 0.00 55.06 54.73 1yq2 s HIS 189 Cb -0.16 -1.82 -0.18 0.00 -0.00 0.00 0.00 32.58 30.43 1yq2 s HIS 189 CO 0.03 0.32 1.46 0.37 -0.00 0.00 0.00 174.74 176.92 1yq2 h GLN 190 N 5.57 -0.09 -5.80 1.40 4.15 -1.11 -1.20 115.11 118.03 1yq2 h GLN 190 Ca -0.46 0.01 -0.67 0.00 0.77 0.00 0.00 58.65 58.30 1yq2 h GLN 190 Cb 1.19 0.02 -0.10 0.00 0.21 0.00 0.00 27.48 28.79 1yq2 h GLN 190 CO 0.56 0.18 -0.54 -1.58 -1.93 0.00 0.00 178.83 175.52 1yq2 s TRP 191 N -5.13 3.40 0.37 3.99 0.23 -1.26 -3.96 118.94 116.58 1yq2 s TRP 191 Ca -0.15 0.37 -0.15 0.00 -2.03 0.00 0.00 56.10 54.14 1yq2 s TRP 191 Cb 0.03 -1.87 0.05 0.00 0.03 0.00 0.00 33.47 31.72 1yq2 s TRP 191 CO 0.65 0.62 0.76 -1.54 0.96 0.00 0.00 176.95 178.40 1yq2 s SER 192 N -1.01 0.04 0.47 2.95 1.04 -1.26 -4.87 113.70 111.06 1yq2 s SER 192 Ca 0.15 -1.12 0.19 0.00 0.48 0.00 0.00 55.95 55.65 1yq2 s SER 192 Cb -0.12 0.83 1.19 0.00 0.10 0.00 0.00 66.02 68.02 1yq2 s SER 192 CO 0.04 -1.64 1.96 0.00 0.98 0.00 0.00 173.24 174.58 1yq2 h ALA 193 N 2.01 2.25 0.00 5.32 0.00 -1.44 -0.44 119.26 126.96 1yq2 h ALA 193 Ca -0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1yq2 h ALA 193 Cb 1.25 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1yq2 h ALA 193 CO 0.39 -0.42 -0.07 0.00 0.00 0.00 0.00 179.25 179.15 1yq2 h ALA 194 N 1.69 1.22 0.00 0.00 0.00 -1.86 -2.52 119.26 117.79 1yq2 h ALA 194 Ca 0.30 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1yq2 h ALA 194 Cb 0.86 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1yq2 h ALA 194 CO -0.06 0.09 -0.06 0.77 0.00 0.00 0.00 179.25 179.98 1yq2 h SER 195 N 0.00 0.00 0.12 0.00 0.02 -1.42 0.81 113.55 113.07 1yq2 h SER 195 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1yq2 h SER 195 Cb 0.27 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 1yq2 h SER 195 CO 0.01 0.06 -0.05 1.88 -1.14 0.00 0.00 176.83 177.59 1yq2 h TYR 196 N 0.00 0.00 -0.02 3.45 -1.99 -1.59 -2.44 116.97 114.38 1yq2 h TYR 196 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1yq2 h TYR 196 Cb 0.12 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.85 1yq2 h TYR 196 CO 0.00 0.05 -0.00 1.28 -0.00 0.00 0.00 178.16 179.48 1yq2 n LEU 197 N -3.89 1.96 -2.61 3.88 4.77 0.27 -4.38 117.00 116.99 1yq2 n LEU 197 Ca -0.03 -0.65 -0.17 0.00 -0.03 0.00 0.00 56.01 55.13 1yq2 n LEU 197 Cb 0.14 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1yq2 n LEU 197 CO 0.29 0.33 0.01 -0.62 -1.33 0.00 0.00 177.39 176.07 1yq2 n GLU 198 N 0.53 2.09 -1.10 3.23 1.02 -0.92 -0.75 120.64 124.74 1yq2 n GLU 198 Ca 0.17 -3.79 -0.25 0.00 -0.02 0.00 0.00 57.16 53.27 1yq2 n GLU 198 Cb 0.43 -1.67 0.06 0.00 -0.02 0.00 0.00 31.44 30.23 1yq2 n GLU 198 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1yq2 n ASP 199 N -0.22 7.05 -4.73 1.62 2.03 0.42 -4.94 116.55 117.78 1yq2 n ASP 199 Ca 0.22 -3.40 -0.37 0.00 0.52 0.00 0.00 54.79 51.76 1yq2 n ASP 199 Cb 0.74 -1.02 0.07 0.00 -0.72 0.00 0.00 41.12 40.19 1yq2 n ASP 199 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1yq2 s GLN 200 N -2.75 2.55 -0.93 -0.67 1.11 -1.26 -4.69 119.66 113.01 1yq2 s GLN 200 Ca 0.47 2.02 -0.24 0.00 0.01 0.00 0.00 55.36 57.62 1yq2 s GLN 200 Cb 0.37 -1.85 -0.01 0.00 -1.01 0.00 0.00 33.01 30.51 1yq2 s GLN 200 CO -0.01 -1.59 1.73 0.34 0.01 0.00 0.00 175.29 175.77 1yq2 s ASP 201 N -1.46 5.71 -0.01 5.90 2.15 -1.26 -4.83 116.67 122.87 1yq2 s ASP 201 Ca 0.82 -0.91 -0.30 0.00 0.43 0.00 0.00 52.55 52.59 1yq2 s ASP 201 Cb -0.36 -2.56 0.12 0.00 -0.30 0.00 0.00 42.92 39.81 1yq2 s ASP 201 CO 0.40 -2.22 1.29 0.00 -0.17 0.00 0.00 175.17 174.46 1yq2 s GLN 202 N 6.19 0.40 0.35 4.34 -2.07 -1.20 -5.00 119.66 122.67 1yq2 s GLN 202 Ca 0.59 -0.23 -0.28 0.00 -1.82 0.00 0.00 55.36 53.62 1yq2 s GLN 202 Cb -0.04 0.13 -0.10 0.00 -1.09 0.00 0.00 33.01 31.90 1yq2 s GLN 202 CO -0.03 -0.18 1.30 -1.58 -1.32 0.00 0.00 175.29 173.48 1yq2 s TRP 203 N -2.30 2.99 -0.16 9.60 0.52 -1.26 -3.90 118.94 124.42 1yq2 s TRP 203 Ca 0.18 1.42 -0.26 0.00 0.02 0.00 0.00 56.10 57.46 1yq2 s TRP 203 Cb 0.04 -3.67 -0.01 0.00 -1.15 0.00 0.00 33.47 28.67 1yq2 s TRP 203 CO -0.03 -1.91 0.85 -1.58 0.02 0.00 0.00 176.95 174.30 1yq2 s TRP 204 N -1.18 3.43 -0.36 -1.98 0.52 0.41 -4.94 118.94 114.85 1yq2 s TRP 204 Ca 0.51 1.29 0.01 0.00 0.02 0.00 0.00 56.10 57.93 1yq2 s TRP 204 Cb -0.39 -3.03 0.15 0.00 -1.15 0.00 0.00 33.47 29.05 1yq2 s TRP 204 CO 0.52 -0.24 0.24 -0.51 0.02 0.00 0.00 176.95 176.98 1yq2 s LEU 205 N 2.12 0.92 0.67 2.99 1.43 -1.26 -3.25 118.68 122.30 1yq2 s LEU 205 Ca 0.39 -2.24 -0.11 0.00 -1.03 0.00 0.00 54.13 51.14 1yq2 s LEU 205 Cb -0.17 -0.30 -0.01 0.00 0.03 0.00 0.00 46.19 45.74 1yq2 s LEU 205 CO 0.13 -0.29 1.05 -2.16 0.23 0.00 0.00 176.35 175.31 1yq2 s PRO 206 N 0.98 3.21 0.00 1.29 0.04 -1.26 -4.78 135.00 134.47 1yq2 s PRO 206 Ca 0.20 0.78 0.00 0.00 0.04 0.00 0.00 61.00 62.02 1yq2 s PRO 206 Cb -0.19 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.32 1yq2 s PRO 206 CO -0.02 -0.86 0.00 0.41 0.04 0.00 0.00 177.00 176.57 1yq2 n GLY 207 N -2.48 2.11 3.45 0.56 0.00 -0.61 -2.21 105.19 106.00 1yq2 n GLY 207 Ca 0.07 -1.92 -0.44 0.00 0.00 0.00 0.00 46.02 43.73 1yq2 n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yq2 s ILE 208 N -1.53 4.59 -1.76 -0.61 1.01 -1.18 -1.11 121.20 120.62 1yq2 s ILE 208 Ca 0.00 -1.17 0.15 0.00 0.00 0.00 0.00 60.65 59.63 1yq2 s ILE 208 Cb 0.00 -4.75 0.08 0.00 0.01 0.00 0.00 42.46 37.81 1yq2 s ILE 208 CO 0.00 -1.49 0.93 2.22 0.00 0.00 0.00 174.94 176.60 1yq2 n PHE 209 N 6.95 0.00 -4.56 3.97 1.16 -0.92 -1.41 117.46 122.65 1yq2 n PHE 209 Ca 0.15 0.00 -0.27 0.00 -1.87 0.00 0.00 57.45 55.45 1yq2 n PHE 209 Cb 0.48 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.27 1yq2 n PHE 209 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1yq2 s ARG 210 N -1.45 2.02 0.62 3.97 0.52 -1.01 -4.41 118.95 119.22 1yq2 s ARG 210 Ca 0.16 -2.25 -0.19 0.00 -0.52 0.00 0.00 55.73 52.93 1yq2 s ARG 210 Cb 0.13 -0.72 -0.02 0.00 0.52 0.00 0.00 34.95 34.86 1yq2 s ARG 210 CO 0.25 -0.50 1.28 -0.25 0.02 0.00 0.00 175.30 176.09 1yq2 n ASP 211 N -1.40 2.08 -4.14 0.23 9.92 -1.26 -4.55 116.55 117.42 1yq2 n ASP 211 Ca -0.08 0.86 -0.31 0.00 -0.53 0.00 0.00 54.79 54.72 1yq2 n ASP 211 Cb 0.65 -1.55 -0.17 0.00 -0.64 0.00 0.00 41.12 39.42 1yq2 n ASP 211 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1yq2 s VAL 212 N -1.38 1.88 0.05 2.53 1.01 -1.26 -1.51 120.40 121.72 1yq2 s VAL 212 Ca 0.80 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.86 1yq2 s VAL 212 Cb -0.39 -1.67 -0.02 0.00 0.00 0.00 0.00 36.38 34.30 1yq2 s VAL 212 CO 0.43 0.52 0.05 0.42 0.00 0.00 0.00 175.10 176.51 1yq2 s THR 213 N 0.81 0.16 -0.01 3.92 -4.23 -0.41 0.07 115.64 115.95 1yq2 s THR 213 Ca -0.08 -1.34 0.07 0.00 -1.18 0.00 0.00 61.69 59.16 1yq2 s THR 213 Cb -0.16 -1.11 -0.02 0.00 1.34 0.00 0.00 72.50 72.56 1yq2 s THR 213 CO -0.01 -0.74 -0.22 -0.76 -0.54 0.00 0.00 174.62 172.36 1yq2 s LEU 214 N -2.44 2.05 -0.02 4.79 1.43 0.04 -0.29 118.68 124.26 1yq2 s LEU 214 Ca -0.01 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 1yq2 s LEU 214 Cb 0.02 -1.13 0.01 0.00 0.03 0.00 0.00 46.19 45.12 1yq2 s LEU 214 CO -0.07 0.26 -0.03 -1.58 0.23 0.00 0.00 176.35 175.16 1yq2 s GLN 215 N -0.58 0.43 -0.53 1.70 0.74 -0.19 -0.95 119.66 120.27 1yq2 s GLN 215 Ca 0.09 -0.09 -0.20 0.00 0.05 0.00 0.00 55.36 55.21 1yq2 s GLN 215 Cb -0.09 -0.47 0.07 0.00 1.10 0.00 0.00 33.01 33.62 1yq2 s GLN 215 CO -0.01 0.01 0.68 0.00 -0.55 0.00 0.00 175.29 175.42 1yq2 s ALA 216 N 0.36 3.37 -0.16 1.58 0.00 0.28 -1.27 121.76 125.92 1yq2 s ALA 216 Ca -0.04 -1.82 -0.29 0.00 0.00 0.00 0.00 51.96 49.81 1yq2 s ALA 216 Cb -0.07 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1yq2 s ALA 216 CO -0.00 -2.13 1.64 1.03 0.00 0.00 0.00 175.76 176.29 1yq2 s ARG 217 N 2.78 3.93 0.36 0.00 1.81 0.12 -4.14 118.95 123.81 1yq2 s ARG 217 Ca 0.16 1.87 -0.27 0.00 -1.72 0.00 0.00 55.73 55.76 1yq2 s ARG 217 Cb -0.20 -4.02 -0.09 0.00 -0.45 0.00 0.00 34.95 30.19 1yq2 s ARG 217 CO 0.11 -1.14 1.26 -2.14 -0.68 0.00 0.00 175.30 172.72 1yq2 s PRO 218 N 4.46 4.20 0.23 3.54 0.02 -1.26 -0.07 135.00 146.11 1yq2 s PRO 218 Ca 0.73 2.10 -0.31 0.00 0.02 0.00 0.00 61.00 63.53 1yq2 s PRO 218 Cb -0.28 -2.91 -0.11 0.00 0.02 0.00 0.00 34.50 31.22 1yq2 s PRO 218 CO 0.29 -0.28 1.60 0.00 -0.33 0.00 0.00 177.00 178.28 1yq2 s ALA 219 N -1.23 3.80 -0.91 -1.55 0.00 -0.55 -1.61 121.76 119.71 1yq2 s ALA 219 Ca 0.53 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.97 1yq2 s ALA 219 Cb -0.37 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.11 1yq2 s ALA 219 CO 0.48 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.77 1yq2 n GLY 220 N 3.15 0.93 0.35 0.00 0.00 -1.26 -4.75 105.19 103.61 1yq2 n GLY 220 Ca 0.12 -0.63 -0.02 0.00 0.00 0.00 0.00 46.02 45.49 1yq2 n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 221 N -1.80 0.34 3.14 -0.02 0.00 -0.63 -4.25 105.19 101.97 1yq2 n GLY 221 Ca -0.09 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 43.69 1yq2 n GLY 221 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yq2 s ILE 222 N -0.32 2.64 0.09 -0.61 1.01 -1.26 -4.40 121.20 118.34 1yq2 s ILE 222 Ca 0.06 -1.40 -0.17 0.00 0.00 0.00 0.00 60.65 59.15 1yq2 s ILE 222 Cb -0.00 -2.48 -0.09 0.00 0.01 0.00 0.00 42.46 39.90 1yq2 s ILE 222 CO 0.04 -0.00 1.46 0.74 0.00 0.00 0.00 174.94 177.18 1yq2 h THR 223 N 6.50 1.30 -3.38 2.92 2.02 -1.20 -3.46 112.91 117.61 1yq2 h THR 223 Ca -0.23 -1.19 -0.10 0.00 0.77 0.00 0.00 66.41 65.65 1yq2 h THR 223 Cb 1.06 1.51 -0.17 0.00 -1.74 0.00 0.00 68.15 68.81 1yq2 h THR 223 CO 0.52 0.37 -0.30 -0.62 0.37 0.00 0.00 175.52 175.86 1yq2 s ASP 224 N -6.22 -0.07 -0.05 4.18 2.15 -0.98 -4.85 116.67 110.83 1yq2 s ASP 224 Ca -0.13 -0.23 -0.05 0.00 0.43 0.00 0.00 52.55 52.56 1yq2 s ASP 224 Cb 0.08 0.33 0.01 0.00 -0.30 0.00 0.00 42.92 43.04 1yq2 s ASP 224 CO 0.78 -0.58 0.15 0.00 -0.17 0.00 0.00 175.17 175.35 1yq2 s ALA 225 N -2.44 -0.36 -0.20 3.66 0.00 -1.26 -1.05 121.76 120.11 1yq2 s ALA 225 Ca -0.06 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1yq2 s ALA 225 Cb -0.01 -0.20 0.05 0.00 0.00 0.00 0.00 23.12 22.95 1yq2 s ALA 225 CO -0.03 -0.09 -0.06 -0.46 0.00 0.00 0.00 175.76 175.13 1yq2 s TRP 226 N -0.10 2.09 -0.90 0.00 -0.00 -0.20 -4.85 118.94 114.99 1yq2 s TRP 226 Ca -0.02 -1.45 -0.13 0.00 -0.00 0.00 0.00 56.10 54.51 1yq2 s TRP 226 Cb -0.02 -1.47 0.23 0.00 -0.00 0.00 0.00 33.47 32.21 1yq2 s TRP 226 CO 0.00 -0.71 0.85 -0.51 -0.00 0.00 0.00 176.95 176.59 1yq2 s LEU 227 N 1.50 6.64 -0.28 5.86 1.43 -1.26 -1.05 118.68 131.51 1yq2 s LEU 227 Ca -0.02 -2.93 -0.29 0.00 -1.03 0.00 0.00 54.13 49.85 1yq2 s LEU 227 Cb -0.17 -2.20 0.01 0.00 0.03 0.00 0.00 46.19 43.86 1yq2 s LEU 227 CO -0.07 -0.49 1.06 -0.60 0.23 0.00 0.00 176.35 176.48 1yq2 s ARG 228 N -0.22 4.15 0.20 1.70 3.52 -1.13 -4.89 118.95 122.28 1yq2 s ARG 228 Ca 0.21 1.19 0.05 0.00 -0.13 0.00 0.00 55.73 57.06 1yq2 s ARG 228 Cb -0.10 -3.70 -0.04 0.00 -1.56 0.00 0.00 34.95 29.55 1yq2 s ARG 228 CO -0.09 -0.79 0.18 0.99 -0.81 0.00 0.00 175.30 174.79 1yq2 s THR 229 N 3.47 4.61 0.24 4.11 2.01 -1.26 -0.02 115.64 128.79 1yq2 s THR 229 Ca 0.45 -1.14 -0.15 0.00 0.31 0.00 0.00 61.69 61.16 1yq2 s THR 229 Cb -0.13 -3.41 0.01 0.00 0.01 0.00 0.00 72.50 68.98 1yq2 s THR 229 CO 0.12 -0.20 0.53 -0.83 -0.69 0.00 0.00 174.62 173.55 1yq2 s GLY 230 N -3.41 0.24 -0.16 4.40 0.00 -0.53 -4.56 107.32 103.30 1yq2 s GLY 230 Ca 0.32 -0.59 -0.21 0.00 0.00 0.00 0.00 44.72 44.24 1yq2 s GLY 230 CO 0.25 -0.44 0.56 0.86 0.00 0.00 0.00 173.10 174.33 1yq2 s TRP 231 N -3.96 -0.58 -0.01 1.90 -0.00 -1.26 -1.10 118.94 113.93 1yq2 s TRP 231 Ca 0.16 1.30 -0.10 0.00 -0.00 0.00 0.00 56.10 57.47 1yq2 s TRP 231 Cb -0.02 0.23 0.01 0.00 -0.00 0.00 0.00 33.47 33.70 1yq2 s TRP 231 CO 0.05 -0.37 0.20 -1.54 -0.00 0.00 0.00 176.95 175.30 1yq2 s SER 232 N -0.16 -0.07 0.24 5.86 1.04 -0.29 -4.37 113.70 115.95 1yq2 s SER 232 Ca -0.04 -0.04 -0.30 0.00 0.48 0.00 0.00 55.95 56.06 1yq2 s SER 232 Cb -0.03 0.27 -0.09 0.00 0.10 0.00 0.00 66.02 66.27 1yq2 s SER 232 CO 0.03 -0.36 1.14 0.00 0.98 0.00 0.00 173.24 175.02 1yq2 s ALA 233 N -1.20 3.41 -0.07 5.32 0.00 -1.26 -1.23 121.76 126.73 1yq2 s ALA 233 Ca -0.13 0.92 -0.06 0.00 0.00 0.00 0.00 51.96 52.69 1yq2 s ALA 233 Cb -0.06 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.72 1yq2 s ALA 233 CO 0.02 -0.25 0.18 1.03 0.00 0.00 0.00 175.76 176.74 1yq2 s ARG 234 N -0.97 0.19 -0.29 0.00 1.81 -1.26 -4.83 118.95 113.60 1yq2 s ARG 234 Ca 0.48 0.27 -0.42 0.00 -1.72 0.00 0.00 55.73 54.34 1yq2 s ARG 234 Cb -0.32 0.06 -0.17 0.00 -0.45 0.00 0.00 34.95 34.06 1yq2 s ARG 234 CO 0.40 -0.05 1.61 -1.13 -0.68 0.00 0.00 175.30 175.45 1yq2 n SER 235 N 3.19 1.79 0.00 0.23 3.41 -1.26 -3.76 113.62 117.23 1yq2 n SER 235 Ca -0.15 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.58 1yq2 n SER 235 Cb 0.58 -1.05 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 1yq2 n SER 235 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yq2 n GLY 236 N 3.77 -0.02 0.24 5.00 0.00 -1.26 -4.71 105.19 108.21 1yq2 n GLY 236 Ca 0.27 -1.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.33 1yq2 n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 h ALA 237 N 0.00 0.58 0.00 4.61 0.00 -1.88 -3.50 119.26 119.08 1yq2 h ALA 237 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1yq2 h ALA 237 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1yq2 h ALA 237 CO 0.00 0.41 0.00 0.41 0.00 0.00 0.00 179.25 180.07 1yq2 n GLY 238 N -0.30 1.56 3.28 0.00 0.00 -1.24 -4.58 105.19 103.91 1yq2 n GLY 238 Ca -0.00 -2.23 -0.33 0.00 0.00 0.00 0.00 46.02 43.45 1yq2 n GLY 238 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yq2 s THR 239 N -1.39 2.73 0.02 2.61 2.01 -0.37 -0.66 115.64 120.60 1yq2 s THR 239 Ca 0.00 -0.75 -0.05 0.00 0.31 0.00 0.00 61.69 61.20 1yq2 s THR 239 Cb 0.00 -2.16 -0.05 0.00 0.01 0.00 0.00 72.50 70.31 1yq2 s THR 239 CO 0.00 0.51 0.26 -0.83 -0.69 0.00 0.00 174.62 173.88 1yq2 s GLY 240 N 0.79 2.24 0.07 4.40 0.00 0.55 -1.13 107.32 114.24 1yq2 s GLY 240 Ca -0.05 -0.62 0.08 0.00 0.00 0.00 0.00 44.72 44.13 1yq2 s GLY 240 CO 0.00 -0.46 -0.21 -0.51 0.00 0.00 0.00 173.10 171.92 1yq2 s THR 241 N -1.35 1.75 -0.10 0.90 -4.23 -0.26 0.81 115.64 113.15 1yq2 s THR 241 Ca 0.29 -1.39 0.02 0.00 -1.18 0.00 0.00 61.69 59.44 1yq2 s THR 241 Cb -0.13 -1.55 0.01 0.00 1.34 0.00 0.00 72.50 72.17 1yq2 s THR 241 CO 0.18 0.09 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.56 1yq2 s ILE 242 N -0.97 1.57 -0.52 2.99 1.01 -0.18 -1.45 121.20 123.65 1yq2 s ILE 242 Ca 0.08 -0.71 0.04 0.00 0.00 0.00 0.00 60.65 60.05 1yq2 s ILE 242 Cb -0.09 -1.41 0.13 0.00 0.01 0.00 0.00 42.46 41.09 1yq2 s ILE 242 CO 0.03 0.45 0.26 -0.62 0.00 0.00 0.00 174.94 175.06 1yq2 s ASP 243 N 0.76 4.39 0.30 3.58 2.15 0.97 -0.95 116.67 127.87 1yq2 s ASP 243 Ca -0.11 -2.96 -0.19 0.00 0.43 0.00 0.00 52.55 49.71 1yq2 s ASP 243 Cb -0.16 -1.65 -0.09 0.00 -0.30 0.00 0.00 42.92 40.72 1yq2 s ASP 243 CO 0.02 -0.25 0.80 -2.16 -0.17 0.00 0.00 175.17 173.41 1yq2 s PRO 244 N -0.22 4.22 -0.08 4.34 0.04 -1.26 -2.82 135.00 139.23 1yq2 s PRO 244 Ca 0.17 0.92 0.01 0.00 0.04 0.00 0.00 61.00 62.14 1yq2 s PRO 244 Cb -0.25 -2.61 0.02 0.00 0.04 0.00 0.00 34.50 31.69 1yq2 s PRO 244 CO -0.01 0.23 -0.10 -2.00 0.04 0.00 0.00 177.00 175.17 1yq2 s GLU 245 N -2.50 1.55 -0.15 4.56 2.12 -0.22 -4.71 118.70 119.34 1yq2 s GLU 245 Ca 0.51 -0.33 0.01 0.00 0.36 0.00 0.00 54.97 55.52 1yq2 s GLU 245 Cb -0.14 -1.38 0.01 0.00 0.26 0.00 0.00 34.13 32.88 1yq2 s GLU 245 CO 0.19 -0.07 -0.19 0.42 -0.54 0.00 0.00 175.26 175.08 1yq2 s ILE 246 N 0.98 2.33 -0.45 -3.70 -1.09 -1.26 -1.03 121.20 116.98 1yq2 s ILE 246 Ca -0.09 -0.88 -0.10 0.00 -2.23 0.00 0.00 60.65 57.35 1yq2 s ILE 246 Cb -0.15 -1.96 0.10 0.00 -1.58 0.00 0.00 42.46 38.86 1yq2 s ILE 246 CO 0.00 0.53 0.31 -0.89 -1.23 0.00 0.00 174.94 173.66 1yq2 s THR 247 N 0.91 4.33 -0.09 2.92 2.01 -0.21 -5.01 115.64 120.50 1yq2 s THR 247 Ca -0.04 -1.53 -0.30 0.00 0.31 0.00 0.00 61.69 60.13 1yq2 s THR 247 Cb -0.15 -3.73 0.07 0.00 0.01 0.00 0.00 72.50 68.70 1yq2 s THR 247 CO -0.03 -0.63 0.68 0.00 -0.69 0.00 0.00 174.62 173.95 1yq2 s ALA 248 N 1.42 -1.76 0.80 7.40 0.00 -1.26 -0.51 121.76 127.86 1yq2 s ALA 248 Ca 0.04 1.43 -0.14 0.00 0.00 0.00 0.00 51.96 53.29 1yq2 s ALA 248 Cb -0.25 -0.20 0.06 0.00 0.00 0.00 0.00 23.12 22.73 1yq2 s ALA 248 CO 0.01 -0.36 1.05 -3.47 0.00 0.00 0.00 175.76 172.99 1yq2 n ASP 249 N 1.22 0.53 -0.09 0.00 -0.08 -1.26 -4.90 116.55 111.97 1yq2 n ASP 249 Ca -0.18 0.58 0.10 0.00 -1.51 0.00 0.00 54.79 53.78 1yq2 n ASP 249 Cb 0.57 -1.45 0.46 0.00 2.34 0.00 0.00 41.12 43.04 1yq2 n ASP 249 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1yq2 h ALA 250 N -0.80 1.91 0.00 -1.67 0.00 -2.00 -1.56 119.26 115.14 1yq2 h ALA 250 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1yq2 h ALA 250 Cb 1.31 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1yq2 h ALA 250 CO 0.45 -0.03 0.00 0.25 0.00 0.00 0.00 179.25 179.92 1yq2 n THR 251 N -4.48 0.89 0.19 0.00 -2.24 -1.26 -2.60 114.28 104.78 1yq2 n THR 251 Ca 0.09 0.22 0.07 0.00 -2.27 0.00 0.00 64.05 62.16 1yq2 n THR 251 Cb 0.31 -0.99 0.29 0.00 -2.10 0.00 0.00 70.33 67.84 1yq2 n THR 251 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yq2 h ALA 252 N 2.54 0.91 -2.69 6.98 0.00 -1.46 -3.43 119.26 122.11 1yq2 h ALA 252 Ca 0.00 -0.30 -0.50 0.00 0.00 0.00 0.00 54.91 54.12 1yq2 h ALA 252 Cb 0.19 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 17.95 1yq2 h ALA 252 CO 0.00 0.41 0.46 -0.06 0.00 0.00 0.00 179.25 180.05 1yq2 s PHE 253 N -3.42 3.39 0.24 0.00 0.08 -1.07 -4.21 117.98 113.00 1yq2 s PHE 253 Ca 0.02 1.66 -0.30 0.00 0.12 0.00 0.00 56.93 58.43 1yq2 s PHE 253 Cb 0.09 -3.24 -0.09 0.00 -0.57 0.00 0.00 43.02 39.21 1yq2 s PHE 253 CO 0.68 -0.68 1.09 -1.25 -0.10 0.00 0.00 175.22 174.96 1yq2 s PRO 254 N -1.95 4.64 -0.16 0.24 0.04 -1.26 -5.01 135.00 131.54 1yq2 s PRO 254 Ca 0.51 1.75 -0.02 0.00 0.04 0.00 0.00 61.00 63.28 1yq2 s PRO 254 Cb -0.28 -3.23 -0.02 0.00 0.04 0.00 0.00 34.50 31.01 1yq2 s PRO 254 CO 0.36 0.19 -0.07 0.08 0.04 0.00 0.00 177.00 177.59 1yq2 s VAL 255 N -0.84 3.46 -0.13 -0.36 1.01 -0.44 -4.36 120.40 118.75 1yq2 s VAL 255 Ca 0.46 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.92 1yq2 s VAL 255 Cb -0.31 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 1yq2 s VAL 255 CO 0.38 0.49 -0.05 -0.89 0.00 0.00 0.00 175.10 175.03 1yq2 s THR 256 N 0.58 3.79 -0.23 3.92 2.01 0.38 -0.40 115.64 125.67 1yq2 s THR 256 Ca -0.05 -0.41 -0.09 0.00 0.31 0.00 0.00 61.69 61.45 1yq2 s THR 256 Cb -0.15 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.70 1yq2 s THR 256 CO 0.03 0.53 0.11 -0.22 -0.69 0.00 0.00 174.62 174.38 1yq2 s LEU 257 N -0.01 3.85 -0.12 4.42 2.96 0.40 -1.16 118.68 129.02 1yq2 s LEU 257 Ca 0.00 0.01 0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1yq2 s LEU 257 Cb -0.13 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.55 1yq2 s LEU 257 CO 0.03 0.06 -0.17 -0.55 -1.32 0.00 0.00 176.35 174.40 1yq2 s SER 258 N 1.05 2.64 -0.58 3.68 0.15 -0.23 -1.15 113.70 119.27 1yq2 s SER 258 Ca 0.06 -0.48 0.04 0.00 0.70 0.00 0.00 55.95 56.27 1yq2 s SER 258 Cb -0.14 -1.19 0.16 0.00 -1.71 0.00 0.00 66.02 63.15 1yq2 s SER 258 CO 0.04 0.02 0.41 -0.69 1.20 0.00 0.00 173.24 174.22 1yq2 s VAL 259 N 1.03 1.88 0.20 4.45 1.01 -0.50 -0.97 120.40 127.51 1yq2 s VAL 259 Ca -0.05 -3.54 -0.12 0.00 0.00 0.00 0.00 61.98 58.28 1yq2 s VAL 259 Cb -0.15 -2.26 0.16 0.00 0.00 0.00 0.00 36.38 34.14 1yq2 s VAL 259 CO -0.03 -1.07 1.69 -0.65 0.00 0.00 0.00 175.10 175.04 1yq2 h PRO 260 N 5.64 0.16 -0.01 2.72 0.11 -1.75 -1.04 132.00 137.83 1yq2 h PRO 260 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1yq2 h PRO 260 Cb 0.83 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 1yq2 h PRO 260 CO 0.58 0.11 0.02 1.49 -0.21 0.00 0.00 178.00 179.98 1yq2 h GLU 261 N 0.16 0.00 -0.42 1.05 4.81 -1.94 0.10 114.58 118.35 1yq2 h GLU 261 Ca 0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1yq2 h GLU 261 Cb 0.45 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1yq2 h GLU 261 CO -0.44 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 179.12 1yq2 n LEU 262 N -3.82 3.28 -2.25 1.64 4.77 -0.46 -4.97 117.00 115.19 1yq2 n LEU 262 Ca -0.03 -1.68 -0.17 0.00 -0.03 0.00 0.00 56.01 54.11 1yq2 n LEU 262 Cb 0.10 -0.27 0.02 0.00 -2.33 0.00 0.00 43.42 40.94 1yq2 n LEU 262 CO 0.27 0.76 -0.04 0.61 -1.33 0.00 0.00 177.39 177.66 1yq2 n GLY 263 N 1.20 -0.24 3.65 -0.72 0.00 0.35 -5.00 105.19 104.42 1yq2 n GLY 263 Ca 0.17 -0.11 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 1yq2 n GLY 263 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yq2 s VAL 264 N -2.98 5.23 -0.31 1.61 1.01 -0.81 -5.00 120.40 119.14 1yq2 s VAL 264 Ca 0.19 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.32 1yq2 s VAL 264 Cb -0.08 -3.43 0.15 0.00 0.00 0.00 0.00 36.38 33.02 1yq2 s VAL 264 CO 0.23 0.36 0.36 0.21 0.00 0.00 0.00 175.10 176.26 1yq2 s ASN 265 N 1.00 1.11 -0.14 3.32 3.84 -1.25 -1.41 114.94 121.40 1yq2 s ASN 265 Ca 0.07 -0.88 0.02 0.00 0.21 0.00 0.00 52.86 52.27 1yq2 s ASN 265 Cb -0.13 0.72 0.00 0.00 -0.55 0.00 0.00 41.25 41.29 1yq2 s ASN 265 CO 0.04 -0.34 -0.19 -0.69 -2.79 0.00 0.00 177.10 173.13 1yq2 s VAL 266 N 2.15 2.31 -0.23 -5.21 1.01 -0.30 -4.98 120.40 115.15 1yq2 s VAL 266 Ca 0.12 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.14 1yq2 s VAL 266 Cb -0.14 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 1yq2 s VAL 266 CO -0.24 0.54 0.03 -0.89 0.00 0.00 0.00 175.10 174.54 1yq2 s THR 267 N 0.79 4.02 -0.35 3.92 2.01 -1.26 -0.45 115.64 124.32 1yq2 s THR 267 Ca -0.07 -0.28 -0.18 0.00 0.31 0.00 0.00 61.69 61.48 1yq2 s THR 267 Cb -0.16 -2.85 -0.00 0.00 0.01 0.00 0.00 72.50 69.50 1yq2 s THR 267 CO -0.01 0.39 0.48 0.26 -0.69 0.00 0.00 174.62 175.05 1yq2 s TRP 268 N 1.37 3.19 -0.66 4.92 0.51 0.46 -4.95 118.94 123.78 1yq2 s TRP 268 Ca 0.05 0.13 0.25 0.00 -2.12 0.00 0.00 56.10 54.41 1yq2 s TRP 268 Cb -0.15 -2.88 0.47 0.00 -0.81 0.00 0.00 33.47 30.10 1yq2 s TRP 268 CO 0.02 -0.52 1.44 1.63 -0.51 0.00 0.00 176.95 179.01 1yq2 n LYS 269 N 5.67 0.29 -3.82 4.98 5.02 -1.26 -1.33 118.16 127.70 1yq2 n LYS 269 Ca -0.06 0.12 -0.07 0.00 -2.02 0.00 0.00 58.31 56.28 1yq2 n LYS 269 Cb 0.49 -1.72 -0.02 0.00 -0.02 0.00 0.00 35.03 33.76 1yq2 n LYS 269 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1yq2 s SER 270 N -4.33 -0.28 0.36 4.39 1.04 -1.26 -4.52 113.70 109.09 1yq2 s SER 270 Ca 0.07 -0.56 0.14 0.00 0.48 0.00 0.00 55.95 56.08 1yq2 s SER 270 Cb 0.13 0.72 0.99 0.00 0.10 0.00 0.00 66.02 67.96 1yq2 s SER 270 CO 0.69 -1.32 1.77 0.00 0.98 0.00 0.00 173.24 175.36 1yq2 h ALA 271 N 2.00 2.03 0.00 5.32 0.00 -1.95 0.18 119.26 126.85 1yq2 h ALA 271 Ca -0.20 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1yq2 h ALA 271 Cb 1.25 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1yq2 h ALA 271 CO 0.24 -0.44 -0.07 1.05 0.00 0.00 0.00 179.25 180.03 1yq2 h GLU 272 N 0.50 0.00 0.00 0.00 4.11 -1.99 -2.60 114.58 114.60 1yq2 h GLU 272 Ca 0.60 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.03 1yq2 h GLU 272 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1yq2 h GLU 272 CO -0.34 0.07 0.00 0.93 0.07 0.00 0.00 179.01 179.74 1yq2 h GLU 273 N 0.00 0.00 -5.69 1.06 5.08 -1.35 -3.43 114.58 110.25 1yq2 h GLU 273 Ca -0.00 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.00 1yq2 h GLU 273 Cb 0.47 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1yq2 h GLU 273 CO 0.01 0.00 1.10 0.08 -1.00 0.00 0.00 179.01 179.20 1yq2 s VAL 274 N -3.24 3.18 0.08 3.13 1.01 -0.98 -4.92 120.40 118.66 1yq2 s VAL 274 Ca 0.07 -0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.05 1yq2 s VAL 274 Cb 0.06 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 1yq2 s VAL 274 CO 0.65 -0.43 -0.05 0.00 0.00 0.00 0.00 175.10 175.27 1yq2 s ALA 275 N 11.46 0.78 0.45 5.51 0.00 -1.26 -4.90 121.76 133.80 1yq2 s ALA 275 Ca 0.83 -1.26 -0.25 0.00 0.00 0.00 0.00 51.96 51.28 1yq2 s ALA 275 Cb -0.13 0.19 -0.08 0.00 0.00 0.00 0.00 23.12 23.09 1yq2 s ALA 275 CO 0.17 -0.27 1.41 -2.30 0.00 0.00 0.00 175.76 174.76 1yq2 n PRO 276 N 0.12 2.18 -4.21 0.00 -0.02 -1.26 -4.57 135.00 127.25 1yq2 n PRO 276 Ca -0.14 0.78 -0.19 0.00 -2.02 0.00 0.00 63.50 61.94 1yq2 n PRO 276 Cb 0.60 -2.59 -0.12 0.00 -0.02 0.00 0.00 33.50 31.37 1yq2 n PRO 276 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1yq2 s LEU 277 N -2.56 2.33 -0.08 2.45 2.34 -0.12 -5.00 118.68 118.04 1yq2 s LEU 277 Ca 0.62 -0.70 0.02 0.00 0.06 0.00 0.00 54.13 54.12 1yq2 s LEU 277 Cb -0.46 -0.56 -0.02 0.00 -0.56 0.00 0.00 46.19 44.59 1yq2 s LEU 277 CO 0.57 -0.10 -0.12 0.00 -1.06 0.00 0.00 176.35 175.64 1yq2 s ALA 278 N -1.64 2.72 -0.10 1.48 0.00 -1.26 -1.01 121.76 121.95 1yq2 s ALA 278 Ca 0.03 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.07 1yq2 s ALA 278 Cb -0.08 -1.09 0.02 0.00 0.00 0.00 0.00 23.12 21.97 1yq2 s ALA 278 CO 0.03 0.48 -0.14 -0.51 0.00 0.00 0.00 175.76 175.61 1yq2 s LEU 279 N -0.45 1.68 0.45 0.00 1.02 0.24 -4.99 118.68 116.62 1yq2 s LEU 279 Ca 0.06 -0.40 -0.12 0.00 0.02 0.00 0.00 54.13 53.69 1yq2 s LEU 279 Cb -0.12 -1.04 -0.06 0.00 0.02 0.00 0.00 46.19 44.99 1yq2 s LEU 279 CO 0.02 0.01 0.84 -1.83 0.02 0.00 0.00 176.35 175.41 1yq2 s GLU 280 N 0.99 3.80 -1.24 1.70 4.04 -1.26 -0.33 118.70 126.39 1yq2 s GLU 280 Ca -0.07 0.59 -0.03 0.00 0.04 0.00 0.00 54.97 55.50 1yq2 s GLU 280 Cb -0.15 -2.31 -0.01 0.00 0.02 0.00 0.00 34.13 31.69 1yq2 s GLU 280 CO -0.01 -0.14 0.78 0.09 -1.84 0.00 0.00 175.26 174.14 1yq2 n ASN 281 N -1.52 -2.39 -4.65 0.83 4.13 -0.34 -4.87 115.26 106.44 1yq2 n ASN 281 Ca 0.04 -0.80 -0.35 0.00 1.68 0.00 0.00 54.58 55.15 1yq2 n ASN 281 Cb 0.54 -4.27 -0.10 0.00 -1.54 0.00 0.00 39.78 34.41 1yq2 n ASN 281 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1yq2 s VAL 282 N -3.57 4.57 -0.00 2.41 1.01 0.16 -4.86 120.40 120.13 1yq2 s VAL 282 Ca 0.11 -0.13 -0.25 0.00 0.00 0.00 0.00 61.98 61.71 1yq2 s VAL 282 Cb -0.03 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 1yq2 s VAL 282 CO 0.80 0.53 0.78 -1.61 0.00 0.00 0.00 175.10 175.59 1yq2 s GLU 283 N -0.16 4.49 0.49 2.72 0.41 -1.26 -3.65 118.70 121.74 1yq2 s GLU 283 Ca 0.06 1.06 -0.19 0.00 -0.41 0.00 0.00 54.97 55.49 1yq2 s GLU 283 Cb -0.12 -3.41 -0.08 0.00 -1.78 0.00 0.00 34.13 28.73 1yq2 s GLU 283 CO 0.02 0.14 1.01 -1.25 -0.49 0.00 0.00 175.26 174.69 1yq2 s PRO 284 N 0.45 3.86 0.02 0.39 0.04 -1.26 -4.58 135.00 133.91 1yq2 s PRO 284 Ca 0.40 1.21 -0.21 0.00 0.04 0.00 0.00 61.00 62.44 1yq2 s PRO 284 Cb -0.20 -2.11 -0.06 0.00 0.04 0.00 0.00 34.50 32.18 1yq2 s PRO 284 CO 0.22 -0.36 0.63 -0.46 0.04 0.00 0.00 177.00 177.07 1yq2 s TRP 285 N -2.22 3.71 0.18 0.56 -0.00 0.44 -4.27 118.94 117.34 1yq2 s TRP 285 Ca 0.64 1.27 -0.09 0.00 -0.00 0.00 0.00 56.10 57.92 1yq2 s TRP 285 Cb -0.13 -2.65 -0.01 0.00 -0.00 0.00 0.00 33.47 30.68 1yq2 s TRP 285 CO 0.23 0.36 0.31 -1.54 -0.00 0.00 0.00 176.95 176.31 1yq2 s SER 286 N -0.26 0.02 0.37 5.86 1.04 -0.52 -4.65 113.70 115.55 1yq2 s SER 286 Ca 0.33 -0.90 0.05 0.00 0.48 0.00 0.00 55.95 55.91 1yq2 s SER 286 Cb -0.19 0.46 0.73 0.00 0.10 0.00 0.00 66.02 67.12 1yq2 s SER 286 CO 0.19 -0.93 1.99 0.00 0.98 0.00 0.00 173.24 175.47 1yq2 h ALA 287 N 2.50 1.66 -0.17 5.32 0.00 -1.87 -1.42 119.26 125.27 1yq2 h ALA 287 Ca -0.31 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.36 1yq2 h ALA 287 Cb 1.23 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.82 1yq2 h ALA 287 CO 0.46 0.27 -0.73 0.93 0.00 0.00 0.00 179.25 180.18 1yq2 h GLU 288 N 0.76 0.75 -2.67 0.00 5.08 -1.93 -3.40 114.58 113.17 1yq2 h GLU 288 Ca 0.26 -0.59 -0.60 0.00 -1.00 0.00 0.00 59.36 57.43 1yq2 h GLU 288 Cb 0.09 0.11 -0.40 0.00 0.50 0.00 0.00 28.75 29.06 1yq2 h GLU 288 CO -0.07 1.20 -0.81 0.08 -1.00 0.00 0.00 179.01 178.41 1yq2 s VAL 289 N -3.80 1.37 -1.41 3.13 1.01 -1.01 -5.02 120.40 114.67 1yq2 s VAL 289 Ca -0.10 -3.27 -0.09 0.00 0.00 0.00 0.00 61.98 58.53 1yq2 s VAL 289 Cb 0.09 -1.92 -0.08 0.00 0.00 0.00 0.00 36.38 34.47 1yq2 s VAL 289 CO 0.89 -1.13 2.70 -0.81 0.00 0.00 0.00 175.10 176.75 1yq2 n PRO 290 N 2.54 3.20 -2.12 2.72 -0.04 -0.57 -1.43 135.00 139.30 1yq2 n PRO 290 Ca 0.25 -1.97 -0.43 0.00 -0.04 0.00 0.00 63.50 61.31 1yq2 n PRO 290 Cb 0.42 -2.70 -0.03 0.00 -0.04 0.00 0.00 33.50 31.16 1yq2 n PRO 290 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1yq2 s ARG 291 N 2.57 4.01 0.06 0.54 6.06 -1.26 -4.80 118.95 126.13 1yq2 s ARG 291 Ca 0.60 1.86 0.09 0.00 -2.50 0.00 0.00 55.73 55.79 1yq2 s ARG 291 Cb 0.16 -3.98 -0.03 0.00 0.06 0.00 0.00 34.95 31.16 1yq2 s ARG 291 CO -0.05 -1.04 -0.25 -0.51 -2.50 0.00 0.00 175.30 170.95 1yq2 s LEU 292 N 4.51 2.26 -0.10 -0.88 1.43 -1.26 -4.36 118.68 120.28 1yq2 s LEU 292 Ca 0.70 -0.60 0.03 0.00 -1.03 0.00 0.00 54.13 53.23 1yq2 s LEU 292 Cb -0.28 -1.31 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 1yq2 s LEU 292 CO 0.27 0.24 -0.19 -0.31 0.23 0.00 0.00 176.35 176.60 1yq2 s TYR 293 N -0.87 2.65 0.15 0.29 1.51 0.49 -4.89 117.35 116.68 1yq2 s TYR 293 Ca 0.13 -0.72 -0.30 0.00 -1.01 0.00 0.00 57.07 55.16 1yq2 s TYR 293 Cb -0.10 -1.73 -0.07 0.00 -0.11 0.00 0.00 41.96 39.94 1yq2 s TYR 293 CO 0.03 -0.23 1.18 -1.21 -1.11 0.00 0.00 175.55 174.22 1yq2 s GLU 294 N 0.12 4.49 0.07 -0.62 0.41 -1.26 -0.16 118.70 121.75 1yq2 s GLU 294 Ca -0.09 1.82 -0.02 0.00 -0.41 0.00 0.00 54.97 56.27 1yq2 s GLU 294 Cb -0.16 -3.27 -0.04 0.00 -1.78 0.00 0.00 34.13 28.89 1yq2 s GLU 294 CO 0.06 -0.10 0.01 0.00 -0.49 0.00 0.00 175.26 174.73 1yq2 s ALA 295 N 0.20 0.50 0.01 5.21 0.00 -0.02 -4.12 121.76 123.53 1yq2 s ALA 295 Ca 0.54 -1.20 -0.03 0.00 0.00 0.00 0.00 51.96 51.27 1yq2 s ALA 295 Cb -0.31 0.40 -0.01 0.00 0.00 0.00 0.00 23.12 23.20 1yq2 s ALA 295 CO 0.34 -0.41 0.05 -1.54 0.00 0.00 0.00 175.76 174.20 1yq2 s SER 296 N -2.94 0.13 -0.09 0.00 1.04 -0.14 -1.38 113.70 110.32 1yq2 s SER 296 Ca 0.10 -0.33 0.04 0.00 0.48 0.00 0.00 55.95 56.24 1yq2 s SER 296 Cb 0.08 0.15 -0.00 0.00 0.10 0.00 0.00 66.02 66.34 1yq2 s SER 296 CO -0.08 -0.31 -0.24 0.68 0.98 0.00 0.00 173.24 174.27 1yq2 s VAL 297 N -1.32 2.01 -0.00 5.02 -7.23 -0.56 -1.06 120.40 117.26 1yq2 s VAL 297 Ca -0.14 -1.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.03 1yq2 s VAL 297 Cb -0.08 -1.74 0.00 0.00 0.56 0.00 0.00 36.38 35.12 1yq2 s VAL 297 CO 0.00 0.55 -0.00 -0.44 -0.31 0.00 0.00 175.10 174.90 1yq2 s SER 298 N 0.28 0.07 0.52 4.85 0.01 -0.31 -0.58 113.70 118.53 1yq2 s SER 298 Ca -0.16 -0.00 0.08 0.00 1.31 0.00 0.00 55.95 57.17 1yq2 s SER 298 Cb -0.17 -0.02 0.04 0.00 0.21 0.00 0.00 66.02 66.08 1yq2 s SER 298 CO 0.08 -0.01 0.56 -0.94 0.41 0.00 0.00 173.24 173.34 1yq2 s SER 299 N 0.11 4.98 0.50 2.44 1.04 -0.41 -0.47 113.70 121.88 1yq2 s SER 299 Ca -0.01 -0.93 0.20 0.00 0.48 0.00 0.00 55.95 55.70 1yq2 s SER 299 Cb -0.02 0.09 1.26 0.00 0.10 0.00 0.00 66.02 67.45 1yq2 s SER 299 CO -0.00 -1.08 2.01 0.00 0.98 0.00 0.00 173.24 175.15 1yq2 h ALA 300 N 0.58 2.28 0.00 5.32 0.00 -1.80 -3.16 119.26 122.48 1yq2 h ALA 300 Ca -0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1yq2 h ALA 300 Cb 1.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1yq2 h ALA 300 CO 0.50 -0.41 -0.99 0.00 0.00 0.00 0.00 179.25 178.36 1yq2 n ALA 301 N -2.59 2.84 -3.59 0.00 0.00 -1.26 -4.97 120.51 110.94 1yq2 n ALA 301 Ca 0.08 -0.29 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 1yq2 n ALA 301 Cb 0.47 -1.07 -0.07 0.00 0.00 0.00 0.00 19.45 18.78 1yq2 n ALA 301 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1yq2 s GLU 302 N -3.29 0.82 -0.06 0.00 2.12 -1.19 -4.86 118.70 112.23 1yq2 s GLU 302 Ca 0.02 0.91 0.05 0.00 0.36 0.00 0.00 54.97 56.30 1yq2 s GLU 302 Cb 0.12 0.40 -0.00 0.00 0.26 0.00 0.00 34.13 34.90 1yq2 s GLU 302 CO 0.78 -0.11 -0.21 0.45 -0.54 0.00 0.00 175.26 175.63 1yq2 s SER 303 N 0.26 2.69 -0.17 -1.70 0.15 -1.26 -1.29 113.70 112.38 1yq2 s SER 303 Ca -0.01 -0.46 -0.02 0.00 0.70 0.00 0.00 55.95 56.16 1yq2 s SER 303 Cb -0.05 -0.88 -0.01 0.00 -1.71 0.00 0.00 66.02 63.37 1yq2 s SER 303 CO 0.02 0.18 -0.07 -0.63 1.20 0.00 0.00 173.24 173.93 1yq2 s ILE 304 N 0.07 3.36 -0.16 6.45 1.01 0.25 -1.85 121.20 130.33 1yq2 s ILE 304 Ca -0.08 -0.53 -0.11 0.00 0.00 0.00 0.00 60.65 59.94 1yq2 s ILE 304 Cb -0.14 -2.47 -0.05 0.00 0.01 0.00 0.00 42.46 39.81 1yq2 s ILE 304 CO 0.04 0.48 0.19 -0.44 0.00 0.00 0.00 174.94 175.21 1yq2 s SER 305 N 0.81 6.33 0.05 3.58 0.01 0.23 -1.49 113.70 123.22 1yq2 s SER 305 Ca -0.03 0.38 0.01 0.00 1.31 0.00 0.00 55.95 57.63 1yq2 s SER 305 Cb -0.15 -2.12 -0.03 0.00 0.21 0.00 0.00 66.02 63.94 1yq2 s SER 305 CO 0.01 0.21 -0.06 0.68 0.41 0.00 0.00 173.24 174.49 1yq2 s VAL 306 N 0.05 0.44 -0.19 3.43 -7.23 -0.48 -4.15 120.40 112.26 1yq2 s VAL 306 Ca 0.12 -1.26 -0.02 0.00 -1.81 0.00 0.00 61.98 59.02 1yq2 s VAL 306 Cb -0.12 -0.80 -0.00 0.00 0.56 0.00 0.00 36.38 36.02 1yq2 s VAL 306 CO 0.01 -0.55 -0.10 -0.13 -0.31 0.00 0.00 175.10 174.03 1yq2 s ARG 307 N -2.15 3.27 -0.17 4.82 0.52 -1.26 -0.84 118.95 123.14 1yq2 s ARG 307 Ca -0.06 -0.69 -0.17 0.00 -0.52 0.00 0.00 55.73 54.29 1yq2 s ARG 307 Cb -0.06 -2.83 -0.04 0.00 0.52 0.00 0.00 34.95 32.55 1yq2 s ARG 307 CO -0.02 -0.13 0.42 -0.51 0.02 0.00 0.00 175.30 175.08 1yq2 s LEU 308 N 1.24 4.21 -0.22 2.53 1.43 0.77 -4.84 118.68 123.80 1yq2 s LEU 308 Ca 0.03 0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 53.74 1yq2 s LEU 308 Cb -0.14 -2.57 0.01 0.00 0.03 0.00 0.00 46.19 43.52 1yq2 s LEU 308 CO -0.04 -0.03 -0.07 -0.83 0.23 0.00 0.00 176.35 175.60 1yq2 s GLY 309 N 0.81 1.58 -0.38 -3.19 0.00 -1.26 -0.38 107.32 104.50 1yq2 s GLY 309 Ca 0.21 -1.28 -0.24 0.00 0.00 0.00 0.00 44.72 43.42 1yq2 s GLY 309 CO 0.08 0.44 0.82 -1.36 0.00 0.00 0.00 173.10 173.08 1yq2 s PHE 310 N 1.40 3.08 -0.03 1.90 0.40 -1.26 -4.77 117.98 118.69 1yq2 s PHE 310 Ca 0.04 0.53 -0.29 0.00 -0.60 0.00 0.00 56.93 56.61 1yq2 s PHE 310 Cb -0.15 -3.52 0.07 0.00 0.51 0.00 0.00 43.02 39.93 1yq2 s PHE 310 CO -0.05 -0.81 0.64 -0.98 0.70 0.00 0.00 175.22 174.72 1yq2 s ARG 311 N 3.24 1.04 -0.12 0.44 1.04 -1.26 -0.42 118.95 122.90 1yq2 s ARG 311 Ca 0.33 0.16 0.01 0.00 -1.04 0.00 0.00 55.73 55.19 1yq2 s ARG 311 Cb -0.13 0.49 0.02 0.00 -2.04 0.00 0.00 34.95 33.29 1yq2 s ARG 311 CO 0.19 -0.33 -0.15 0.99 -0.04 0.00 0.00 175.30 175.95 1yq2 s THR 312 N -1.40 1.53 -0.17 4.99 2.01 -1.26 -3.93 115.64 117.41 1yq2 s THR 312 Ca -0.10 -0.65 -0.13 0.00 0.31 0.00 0.00 61.69 61.12 1yq2 s THR 312 Cb -0.01 -1.41 -0.05 0.00 0.01 0.00 0.00 72.50 71.04 1yq2 s THR 312 CO 0.08 0.45 0.26 -0.69 -0.69 0.00 0.00 174.62 174.03 1yq2 s VAL 313 N 1.16 5.32 -0.04 3.82 1.01 -1.26 -1.03 120.40 129.38 1yq2 s VAL 313 Ca -0.03 0.47 -0.02 0.00 0.00 0.00 0.00 61.98 62.40 1yq2 s VAL 313 Cb -0.14 -3.60 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1yq2 s VAL 313 CO -0.05 0.39 0.10 -0.60 0.00 0.00 0.00 175.10 174.94 1yq2 s ARG 314 N 0.53 0.07 -0.18 2.72 3.52 -0.18 -4.86 118.95 120.57 1yq2 s ARG 314 Ca 0.14 0.24 -0.15 0.00 -0.13 0.00 0.00 55.73 55.83 1yq2 s ARG 314 Cb -0.13 -0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 33.12 1yq2 s ARG 314 CO 0.03 -0.11 0.36 0.42 -0.81 0.00 0.00 175.30 175.19 1yq2 s ILE 315 N 0.72 5.24 -0.28 4.11 1.01 -1.26 -0.23 121.20 130.51 1yq2 s ILE 315 Ca -0.06 0.66 0.01 0.00 0.00 0.00 0.00 60.65 61.27 1yq2 s ILE 315 Cb -0.08 -3.70 0.08 0.00 0.01 0.00 0.00 42.46 38.78 1yq2 s ILE 315 CO -0.03 0.31 0.00 -0.69 0.00 0.00 0.00 174.94 174.53 1yq2 s VAL 316 N 0.94 1.64 0.00 2.92 1.01 -0.60 -4.99 120.40 121.32 1yq2 s VAL 316 Ca 0.18 -1.60 0.00 0.00 0.00 0.00 0.00 61.98 60.57 1yq2 s VAL 316 Cb -0.14 -2.05 0.00 0.00 0.00 0.00 0.00 36.38 34.19 1yq2 s VAL 316 CO 0.07 -0.36 0.00 0.61 0.00 0.00 0.00 175.10 175.42 1yq2 n GLY 317 N 4.58 4.21 1.91 4.51 0.00 -1.26 -1.78 105.19 117.36 1yq2 n GLY 317 Ca -0.05 0.15 -0.04 0.00 0.00 0.00 0.00 46.02 46.08 1yq2 n GLY 317 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yq2 n ASP 318 N 8.24 4.81 -4.35 1.61 5.68 -1.21 -4.21 116.55 127.13 1yq2 n ASP 318 Ca 0.00 -3.21 -0.33 0.00 -0.50 0.00 0.00 54.79 50.75 1yq2 n ASP 318 Cb 0.00 -0.73 -0.15 0.00 -1.14 0.00 0.00 41.12 39.10 1yq2 n ASP 318 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 1yq2 s GLN 319 N -2.98 3.17 -0.41 0.11 -1.52 -0.73 -3.60 119.66 113.68 1yq2 s GLN 319 Ca 0.54 -0.74 -0.15 0.00 -1.95 0.00 0.00 55.36 53.06 1yq2 s GLN 319 Cb 0.43 -2.51 0.02 0.00 -0.22 0.00 0.00 33.01 30.74 1yq2 s GLN 319 CO 0.13 0.27 0.32 0.12 -0.25 0.00 0.00 175.29 175.88 1yq2 s PHE 320 N 0.19 3.23 -0.07 0.91 5.36 -1.26 -1.56 117.98 124.78 1yq2 s PHE 320 Ca -0.10 -0.57 0.00 0.00 -0.96 0.00 0.00 56.93 55.30 1yq2 s PHE 320 Cb -0.16 -2.65 -0.03 0.00 -0.34 0.00 0.00 43.02 39.85 1yq2 s PHE 320 CO 0.06 -0.61 -0.05 -0.51 -1.46 0.00 0.00 175.22 172.65 1yq2 s LEU 321 N 1.74 3.28 -0.08 6.12 1.43 0.68 -1.63 118.68 130.22 1yq2 s LEU 321 Ca 0.06 0.01 0.04 0.00 -1.03 0.00 0.00 54.13 53.21 1yq2 s LEU 321 Cb -0.19 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.30 1yq2 s LEU 321 CO 0.10 0.36 -0.19 -0.69 0.23 0.00 0.00 176.35 176.17 1yq2 s VAL 322 N -0.85 1.63 -1.40 -1.59 1.01 -0.54 -1.01 120.40 117.65 1yq2 s VAL 322 Ca 0.13 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.26 1yq2 s VAL 322 Cb -0.11 -1.43 0.04 0.00 0.00 0.00 0.00 36.38 34.89 1yq2 s VAL 322 CO 0.02 0.46 0.56 0.59 0.00 0.00 0.00 175.10 176.74 1yq2 n ASN 323 N 3.54 -4.77 0.00 3.32 3.02 -0.19 -1.94 115.26 118.24 1yq2 n ASN 323 Ca -0.20 -0.36 0.00 0.00 -0.03 0.00 0.00 54.58 53.99 1yq2 n ASN 323 Cb 0.52 -3.89 0.00 0.00 -0.61 0.00 0.00 39.78 35.80 1yq2 n ASN 323 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yq2 n GLY 324 N -1.34 0.85 3.16 7.41 0.00 -1.26 -4.94 105.19 109.07 1yq2 n GLY 324 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 1yq2 n GLY 324 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yq2 s ARG 325 N -0.13 1.14 0.19 1.61 3.52 -0.82 -5.03 118.95 119.42 1yq2 s ARG 325 Ca 0.00 -0.72 -0.33 0.00 -0.13 0.00 0.00 55.73 54.55 1yq2 s ARG 325 Cb 0.00 -1.15 -0.14 0.00 -1.56 0.00 0.00 34.95 32.10 1yq2 s ARG 325 CO 0.00 0.30 1.52 -2.13 -0.81 0.00 0.00 175.30 174.17 1yq2 n ARG 326 N 2.17 2.09 -3.54 5.12 0.63 -1.26 -1.46 116.66 120.41 1yq2 n ARG 326 Ca -0.17 0.75 -0.37 0.00 -0.92 0.00 0.00 57.85 57.14 1yq2 n ARG 326 Cb 0.54 -2.48 -0.09 0.00 0.45 0.00 0.00 32.46 30.89 1yq2 n ARG 326 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1yq2 s VAL 327 N 0.58 5.29 -0.24 5.15 1.01 -0.65 -4.87 120.40 126.67 1yq2 s VAL 327 Ca 0.75 0.41 -0.12 0.00 0.00 0.00 0.00 61.98 63.02 1yq2 s VAL 327 Cb -0.68 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 1yq2 s VAL 327 CO 0.42 0.30 0.23 -0.69 0.00 0.00 0.00 175.10 175.36 1yq2 s VAL 328 N 1.19 5.31 -0.25 2.92 1.01 -1.26 -4.82 120.40 124.49 1yq2 s VAL 328 Ca 0.12 0.32 -0.20 0.00 0.00 0.00 0.00 61.98 62.23 1yq2 s VAL 328 Cb -0.14 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1yq2 s VAL 328 CO 0.06 0.30 0.60 -0.36 0.00 0.00 0.00 175.10 175.70 1yq2 s PHE 329 N 1.24 3.29 -0.82 5.22 0.08 0.53 -4.98 117.98 122.54 1yq2 s PHE 329 Ca 0.10 0.78 0.00 0.00 0.12 0.00 0.00 56.93 57.93 1yq2 s PHE 329 Cb -0.14 -2.80 0.20 0.00 -0.57 0.00 0.00 43.02 39.70 1yq2 s PHE 329 CO 0.06 -0.30 0.67 -1.01 -0.10 0.00 0.00 175.22 174.55 1yq2 s HIS 330 N 2.40 3.77 0.44 0.36 3.76 -1.26 -1.34 115.29 123.43 1yq2 s HIS 330 Ca 0.25 -3.10 0.06 0.00 -0.15 0.00 0.00 55.06 52.13 1yq2 s HIS 330 Cb -0.16 -3.09 -0.04 0.00 1.11 0.00 0.00 32.58 30.40 1yq2 s HIS 330 CO 0.09 -0.69 0.16 0.20 -0.85 0.00 0.00 174.74 173.65 1yq2 s GLY 331 N -0.44 2.46 0.05 -2.22 0.00 -0.11 -1.00 107.32 106.06 1yq2 s GLY 331 Ca 0.26 -1.79 0.04 0.00 0.00 0.00 0.00 44.72 43.23 1yq2 s GLY 331 CO -0.13 -1.98 -0.12 -1.34 0.00 0.00 0.00 173.10 169.53 1yq2 s VAL 332 N -2.67 0.90 -0.08 1.40 -7.23 -0.66 -0.87 120.40 111.19 1yq2 s VAL 332 Ca 0.35 -1.05 -0.29 0.00 -1.81 0.00 0.00 61.98 59.17 1yq2 s VAL 332 Cb 0.04 -0.86 -0.02 0.00 0.56 0.00 0.00 36.38 36.09 1yq2 s VAL 332 CO 0.19 -0.16 0.97 0.20 -0.31 0.00 0.00 175.10 175.99 1yq2 s ASN 333 N -1.36 7.25 -0.02 4.85 0.01 -0.40 -1.18 114.94 124.08 1yq2 s ASN 333 Ca -0.03 1.53 -0.01 0.00 -0.71 0.00 0.00 52.86 53.64 1yq2 s ASN 333 Cb -0.09 -2.55 0.02 0.00 0.41 0.00 0.00 41.25 39.05 1yq2 s ASN 333 CO 0.01 -0.37 0.04 -0.60 -1.51 0.00 0.00 177.10 174.67 1yq2 s ARG 334 N 1.65 0.01 0.15 -0.60 3.52 -0.57 -1.41 118.95 121.70 1yq2 s ARG 334 Ca 0.48 0.14 0.04 0.00 -0.13 0.00 0.00 55.73 56.26 1yq2 s ARG 334 Cb -0.19 -0.12 -0.04 0.00 -1.56 0.00 0.00 34.95 33.03 1yq2 s ARG 334 CO 0.21 -0.10 -0.09 -3.38 -0.81 0.00 0.00 175.30 171.13 1yq2 s HIS 335 N 0.61 1.26 0.23 5.12 -3.43 -1.26 -2.45 115.29 115.39 1yq2 s HIS 335 Ca -0.05 -0.78 -0.30 0.00 -0.80 0.00 0.00 55.06 53.12 1yq2 s HIS 335 Cb -0.07 -0.65 -0.10 0.00 -1.43 0.00 0.00 32.58 30.32 1yq2 s HIS 335 CO -0.02 0.06 1.51 -2.00 -2.00 0.00 0.00 174.74 172.28 1yq2 s GLU 336 N -3.76 4.22 -0.15 -0.38 2.56 -1.26 -4.97 118.70 114.95 1yq2 s GLU 336 Ca 0.17 2.37 -0.16 0.00 0.00 0.00 0.00 54.97 57.36 1yq2 s GLU 336 Cb 0.03 -3.10 0.04 0.00 2.00 0.00 0.00 34.13 33.10 1yq2 s GLU 336 CO 0.01 -0.51 0.45 -0.08 -0.56 0.00 0.00 175.26 174.56 1yq2 s THR 337 N 0.31 0.00 -0.26 -1.70 -1.32 -1.25 -4.48 115.64 106.95 1yq2 s THR 337 Ca 0.63 -0.03 -0.15 0.00 -1.21 0.00 0.00 61.69 60.93 1yq2 s THR 337 Cb -0.44 -0.64 0.08 0.00 -1.51 0.00 0.00 72.50 69.99 1yq2 s THR 337 CO 0.41 -0.02 0.64 -2.28 -2.21 0.00 0.00 174.62 171.16 1yq2 s HIS 338 N 0.09 -0.97 -0.03 9.09 5.04 -0.72 -4.96 115.29 122.85 1yq2 s HIS 338 Ca -0.01 1.96 0.29 0.00 -1.54 0.00 0.00 55.06 55.76 1yq2 s HIS 338 Cb -0.03 0.55 1.45 0.00 0.04 0.00 0.00 32.58 34.59 1yq2 s HIS 338 CO 0.01 -0.49 1.87 -1.35 -2.34 0.00 0.00 174.74 172.45 1yq2 h PRO 339 N 6.93 0.00 0.00 2.88 0.11 -1.87 -0.48 132.00 139.56 1yq2 h PRO 339 Ca -0.31 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.49 1yq2 h PRO 339 Cb 1.22 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 1yq2 h PRO 339 CO 0.18 0.00 -2.10 -0.25 -0.21 0.00 0.00 178.00 175.62 1yq2 n ASP 340 N -2.54 2.20 -0.40 -2.05 8.00 -1.26 -1.44 116.55 119.05 1yq2 n ASP 340 Ca -0.01 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.54 1yq2 n ASP 340 Cb 0.12 -0.39 0.06 0.00 -0.02 0.00 0.00 41.12 40.88 1yq2 n ASP 340 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1yq2 n ARG 341 N -3.31 0.79 0.00 -1.24 1.85 -1.16 -4.17 116.66 109.42 1yq2 n ARG 341 Ca -0.36 -1.23 0.00 0.00 -1.00 0.00 0.00 57.85 55.27 1yq2 n ARG 341 Cb 0.84 -1.19 0.00 0.00 -1.05 0.00 0.00 32.46 31.06 1yq2 n ARG 341 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1yq2 n GLY 342 N 0.49 3.55 1.24 2.89 0.00 -0.20 -3.07 105.19 110.09 1yq2 n GLY 342 Ca 0.06 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.11 1yq2 n GLY 342 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 n ARG 343 N 13.33 2.57 -2.10 1.61 1.74 -1.26 -1.75 116.66 130.80 1yq2 n ARG 343 Ca 0.00 -2.43 -0.42 0.00 -0.77 0.00 0.00 57.85 54.23 1yq2 n ARG 343 Cb 0.00 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 29.88 1yq2 n ARG 343 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1yq2 s VAL 344 N -1.16 3.10 0.37 1.55 1.01 -1.17 -4.88 120.40 119.22 1yq2 s VAL 344 Ca 0.45 0.80 -0.25 0.00 0.00 0.00 0.00 61.98 62.97 1yq2 s VAL 344 Cb 0.24 -3.51 -0.09 0.00 0.00 0.00 0.00 36.38 33.02 1yq2 s VAL 344 CO 0.31 0.06 1.05 0.12 0.00 0.00 0.00 175.10 176.65 1yq2 s PHE 345 N 1.08 3.36 -0.12 5.22 5.36 -1.26 -4.90 117.98 126.71 1yq2 s PHE 345 Ca 0.66 1.67 -0.04 0.00 -0.96 0.00 0.00 56.93 58.26 1yq2 s PHE 345 Cb -0.39 -3.14 0.06 0.00 -0.34 0.00 0.00 43.02 39.21 1yq2 s PHE 345 CO 0.31 -0.55 0.16 0.34 -1.46 0.00 0.00 175.22 174.02 1yq2 s ASP 346 N -1.44 1.07 0.20 6.13 2.15 -1.26 -5.07 116.67 118.46 1yq2 s ASP 346 Ca 0.55 0.10 -0.10 0.00 0.43 0.00 0.00 52.55 53.54 1yq2 s ASP 346 Cb -0.24 0.23 0.14 0.00 -0.30 0.00 0.00 42.92 42.76 1yq2 s ASP 346 CO 0.30 -0.27 1.81 -0.08 -0.17 0.00 0.00 175.17 176.76 1yq2 h GLU 347 N 8.36 1.05 -0.30 4.34 4.81 -1.98 -0.45 114.58 130.41 1yq2 h GLU 347 Ca -0.14 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 58.94 1yq2 h GLU 347 Cb 1.13 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 1yq2 h GLU 347 CO 0.19 0.79 0.12 0.00 -0.73 0.00 0.00 179.01 179.38 1yq2 h ALA 348 N 1.20 0.39 -0.81 2.92 0.00 -1.99 0.23 119.26 121.20 1yq2 h ALA 348 Ca 0.26 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1yq2 h ALA 348 Cb 0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1yq2 h ALA 348 CO -0.04 -0.02 0.54 0.78 0.00 0.00 0.00 179.25 180.51 1yq2 h GLY 349 N 0.33 1.14 1.38 0.00 0.00 -1.95 -1.73 103.07 102.25 1yq2 h GLY 349 Ca 0.10 -0.42 -0.14 0.00 0.00 0.00 0.00 47.33 46.87 1yq2 h GLY 349 CO -0.01 0.41 -0.37 0.00 0.00 0.00 0.00 176.54 176.57 1yq2 h ALA 350 N 1.30 0.79 -0.65 3.60 0.00 -0.82 -0.99 119.26 122.49 1yq2 h ALA 350 Ca 0.30 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1yq2 h ALA 350 Cb -0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1yq2 h ALA 350 CO -0.07 0.65 0.06 -0.09 0.00 0.00 0.00 179.25 179.81 1yq2 h ARG 351 N 0.57 1.11 -0.34 0.00 2.43 -0.77 -1.46 114.38 115.90 1yq2 h ARG 351 Ca 0.05 -0.32 -0.09 0.00 -0.81 0.00 0.00 59.98 58.82 1yq2 h ARG 351 Cb 0.90 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.32 1yq2 h ARG 351 CO 0.08 1.04 -0.15 1.49 -1.51 0.00 0.00 179.97 180.92 1yq2 h GLU 352 N 1.03 0.62 0.08 0.20 4.57 -1.09 -1.91 114.58 118.08 1yq2 h GLU 352 Ca 0.19 -0.20 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1yq2 h GLU 352 Cb 0.50 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.03 1yq2 h GLU 352 CO 0.02 0.74 -0.04 0.22 -1.18 0.00 0.00 179.01 178.77 1yq2 h ASP 353 N 0.56 -0.10 0.07 1.04 3.58 -0.86 -0.53 116.42 120.18 1yq2 h ASP 353 Ca 0.09 -0.04 -0.09 0.00 0.42 0.00 0.00 57.03 57.41 1yq2 h ASP 353 Cb 0.58 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.64 1yq2 h ASP 353 CO 0.04 -0.02 -0.28 -0.07 -2.88 0.00 0.00 179.24 176.03 1yq2 h LEU 354 N -0.16 0.34 -0.60 2.28 3.38 -1.25 -1.56 115.31 117.73 1yq2 h LEU 354 Ca -0.01 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1yq2 h LEU 354 Cb 0.13 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1yq2 h LEU 354 CO 0.02 0.61 0.18 0.00 0.09 0.00 0.00 178.44 179.34 1yq2 h ALA 355 N 1.41 0.79 -0.64 1.53 0.00 -1.15 -1.57 119.26 119.64 1yq2 h ALA 355 Ca 0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1yq2 h ALA 355 Cb 0.65 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1yq2 h ALA 355 CO 0.05 0.48 0.25 1.25 0.00 0.00 0.00 179.25 181.28 1yq2 h LEU 356 N 0.87 0.89 -0.39 0.00 5.85 -0.61 -1.86 115.31 120.06 1yq2 h LEU 356 Ca 0.19 -0.17 0.07 0.00 0.84 0.00 0.00 57.88 58.81 1yq2 h LEU 356 Cb 0.31 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.05 1yq2 h LEU 356 CO -0.00 0.82 -0.01 0.24 -0.34 0.00 0.00 178.44 179.15 1yq2 h MET 357 N 0.90 0.10 -0.67 1.25 2.86 -1.07 -2.50 114.93 115.80 1yq2 h MET 357 Ca 0.21 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.84 1yq2 h MET 357 Cb 0.21 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 1yq2 h MET 357 CO -0.02 0.06 0.39 0.87 1.06 0.00 0.00 176.91 179.28 1yq2 h LYS 358 N 0.10 0.90 0.00 1.72 1.57 -0.86 -0.47 116.57 119.53 1yq2 h LYS 358 Ca 0.19 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1yq2 h LYS 358 Cb 0.27 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1yq2 h LYS 358 CO -0.33 0.64 -0.01 0.00 -0.57 0.00 0.00 179.45 179.19 1yq2 h ARG 359 N 0.92 0.00 -0.40 3.15 3.08 -0.91 -2.27 114.38 117.95 1yq2 h ARG 359 Ca 0.24 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.17 1yq2 h ARG 359 Cb -0.02 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.96 1yq2 h ARG 359 CO -0.04 0.01 0.05 1.19 -1.07 0.00 0.00 179.97 180.11 1yq2 n PHE 360 N -3.16 1.33 -1.28 3.04 3.72 -0.24 -4.96 117.46 115.91 1yq2 n PHE 360 Ca -0.02 -1.23 -0.10 0.00 -0.05 0.00 0.00 57.45 56.06 1yq2 n PHE 360 Cb 0.18 -0.47 -0.04 0.00 -0.94 0.00 0.00 39.48 38.21 1yq2 n PHE 360 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1yq2 n ASN 361 N -0.71 -4.27 -4.70 4.37 3.02 -0.85 -4.14 115.26 107.99 1yq2 n ASN 361 Ca 0.30 0.24 -0.42 0.00 -0.03 0.00 0.00 54.58 54.67 1yq2 n ASN 361 Cb 1.06 -2.60 -0.03 0.00 -0.61 0.00 0.00 39.78 37.60 1yq2 n ASN 361 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1yq2 s VAL 362 N -2.31 3.53 -0.88 2.41 1.01 -0.84 -4.89 120.40 118.43 1yq2 s VAL 362 Ca 0.00 1.00 0.08 0.00 0.00 0.00 0.00 61.98 63.06 1yq2 s VAL 362 Cb 0.00 -3.64 0.11 0.00 0.00 0.00 0.00 36.38 32.85 1yq2 s VAL 362 CO 0.00 0.03 0.89 -0.46 0.00 0.00 0.00 175.10 175.55 1yq2 n ASN 363 N 4.91 1.98 -3.69 3.32 0.23 -0.17 -4.43 115.26 117.41 1yq2 n ASN 363 Ca 0.13 -1.55 -0.14 0.00 -0.53 0.00 0.00 54.58 52.49 1yq2 n ASN 363 Cb 0.43 -0.05 -0.08 0.00 -2.08 0.00 0.00 39.78 37.99 1yq2 n ASN 363 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1yq2 s ALA 364 N -0.77 -1.14 -0.06 -2.53 0.00 -1.21 -0.96 121.76 115.09 1yq2 s ALA 364 Ca 0.12 0.87 0.02 0.00 0.00 0.00 0.00 51.96 52.96 1yq2 s ALA 364 Cb 0.07 -0.19 0.01 0.00 0.00 0.00 0.00 23.12 23.01 1yq2 s ALA 364 CO 0.10 -0.28 -0.12 0.42 0.00 0.00 0.00 175.76 175.89 1yq2 s ILE 365 N -0.83 1.08 -0.20 0.00 1.01 0.24 -1.65 121.20 120.85 1yq2 s ILE 365 Ca -0.09 -0.45 -0.07 0.00 0.00 0.00 0.00 60.65 60.04 1yq2 s ILE 365 Cb -0.03 -0.99 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 1yq2 s ILE 365 CO 0.05 0.34 0.05 -0.60 0.00 0.00 0.00 174.94 174.77 1yq2 s ARG 366 N 0.66 3.83 -1.08 2.79 3.52 -0.33 -1.02 118.95 127.31 1yq2 s ARG 366 Ca -0.14 -0.42 -0.20 0.00 -0.13 0.00 0.00 55.73 54.84 1yq2 s ARG 366 Cb -0.15 -3.19 0.08 0.00 -1.56 0.00 0.00 34.95 30.13 1yq2 s ARG 366 CO 0.03 0.13 1.45 0.95 -0.81 0.00 0.00 175.30 177.06 1yq2 s THR 367 N 0.73 4.23 -0.29 4.11 -4.23 -0.91 -1.51 115.64 117.77 1yq2 s THR 367 Ca 0.02 -1.36 -0.23 0.00 -1.18 0.00 0.00 61.69 58.94 1yq2 s THR 367 Cb -0.14 -5.02 -0.00 0.00 1.34 0.00 0.00 72.50 68.68 1yq2 s THR 367 CO 0.02 -1.85 0.77 -0.94 -0.54 0.00 0.00 174.62 172.08 1yq2 s SER 368 N 4.34 6.68 -0.45 3.99 1.04 -1.02 -1.65 113.70 126.63 1yq2 s SER 368 Ca 0.45 0.74 0.08 0.00 0.48 0.00 0.00 55.95 57.70 1yq2 s SER 368 Cb -0.00 -2.40 0.27 0.00 0.10 0.00 0.00 66.02 63.99 1yq2 s SER 368 CO -0.05 -0.56 0.62 1.41 0.98 0.00 0.00 173.24 175.65 1yq2 n HIS 369 N 6.09 0.82 0.00 5.02 -0.00 -1.26 -4.29 115.22 121.59 1yq2 n HIS 369 Ca 0.03 -3.75 0.00 0.00 -0.00 0.00 0.00 57.72 54.00 1yq2 n HIS 369 Cb 0.48 -0.41 0.00 0.00 -0.00 0.00 0.00 29.99 30.06 1yq2 n HIS 369 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.34 178.82 1yq2 n TYR 370 N 1.03 0.00 -2.08 4.41 0.18 -0.66 -3.93 117.16 116.11 1yq2 n TYR 370 Ca 0.24 0.00 -0.40 0.00 1.88 0.00 0.00 57.90 59.62 1yq2 n TYR 370 Cb 0.52 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.47 1yq2 n TYR 370 CO 0.00 0.00 0.00 -2.14 -2.08 0.00 0.00 176.86 172.64 1yq2 s PRO 371 N -2.00 4.06 0.83 -3.48 0.02 -0.91 -4.59 135.00 128.93 1yq2 s PRO 371 Ca 0.00 2.15 -0.14 0.00 0.02 0.00 0.00 61.00 63.03 1yq2 s PRO 371 Cb 0.00 -2.82 0.19 0.00 0.02 0.00 0.00 34.50 31.89 1yq2 s PRO 371 CO 0.00 -0.41 1.12 -0.35 -0.33 0.00 0.00 177.00 177.03 1yq2 n PRO 372 N 0.28 -1.11 -1.72 5.54 -0.04 -1.26 -4.86 135.00 131.83 1yq2 n PRO 372 Ca 0.03 -1.73 -0.42 0.00 -0.04 0.00 0.00 63.50 61.34 1yq2 n PRO 372 Cb 0.43 -1.16 -0.00 0.00 -0.04 0.00 0.00 33.50 32.73 1yq2 n PRO 372 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1yq2 n HIS 373 N -3.56 2.44 0.26 0.54 -0.00 -1.26 -4.86 115.22 108.78 1yq2 n HIS 373 Ca 0.14 0.51 0.09 0.00 -0.00 0.00 0.00 57.72 58.46 1yq2 n HIS 373 Cb 0.49 -2.44 0.67 0.00 -0.00 0.00 0.00 29.99 28.71 1yq2 n HIS 373 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1yq2 h PRO 374 N 2.54 0.00 0.00 1.57 0.13 -1.95 -1.46 132.00 132.82 1yq2 h PRO 374 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1yq2 h PRO 374 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 1yq2 h PRO 374 CO 0.62 0.04 -0.06 -0.09 -0.23 0.00 0.00 178.00 178.29 1yq2 h ARG 375 N 0.00 0.00 -0.33 0.86 9.65 -2.01 -2.38 114.38 120.18 1yq2 h ARG 375 Ca -0.00 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 1yq2 h ARG 375 Cb 0.08 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.64 1yq2 h ARG 375 CO 0.01 0.06 0.17 1.25 2.80 0.00 0.00 179.97 184.25 1yq2 h LEU 376 N 0.00 0.39 -1.12 3.80 5.85 -1.62 -2.18 115.31 120.43 1yq2 h LEU 376 Ca -0.00 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 1yq2 h LEU 376 Cb 0.11 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1yq2 h LEU 376 CO 0.01 0.32 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.16 1yq2 h LEU 377 N 0.45 0.37 -0.84 2.25 3.38 -1.59 -1.43 115.31 117.90 1yq2 h LEU 377 Ca 0.12 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.01 1yq2 h LEU 377 Cb 0.02 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 1yq2 h LEU 377 CO -0.02 0.58 0.55 0.44 0.09 0.00 0.00 178.44 180.08 1yq2 h ASP 378 N 0.34 0.92 -0.64 -0.43 3.32 -1.50 -0.87 116.42 117.56 1yq2 h ASP 378 Ca 0.06 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 1yq2 h ASP 378 Cb 0.55 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 1yq2 h ASP 378 CO 0.04 0.64 0.28 -0.07 -1.72 0.00 0.00 179.24 178.41 1yq2 h LEU 379 N 1.08 0.86 -0.57 1.55 3.38 -1.21 -2.20 115.31 118.20 1yq2 h LEU 379 Ca 0.33 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 1yq2 h LEU 379 Cb -0.03 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1yq2 h LEU 379 CO -0.10 0.77 0.27 0.00 0.09 0.00 0.00 178.44 179.48 1yq2 h ALA 380 N 1.12 0.74 -0.69 1.53 0.00 -1.01 0.34 119.26 121.29 1yq2 h ALA 380 Ca 0.22 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1yq2 h ALA 380 Cb 0.16 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1yq2 h ALA 380 CO -0.02 0.30 0.39 -0.44 0.00 0.00 0.00 179.25 179.48 1yq2 h ASP 381 N 0.77 0.58 0.07 0.00 3.32 -1.07 -0.50 116.42 119.59 1yq2 h ASP 381 Ca 0.20 0.03 -0.19 0.00 0.02 0.00 0.00 57.03 57.08 1yq2 h ASP 381 Cb 0.12 -0.09 0.02 0.00 0.22 0.00 0.00 39.33 39.60 1yq2 h ASP 381 CO -0.02 0.37 -0.79 -0.08 -1.72 0.00 0.00 179.24 177.00 1yq2 h GLU 382 N 0.72 0.42 0.00 3.56 4.81 -1.17 -3.37 114.58 119.54 1yq2 h GLU 382 Ca 0.31 -0.54 -0.22 0.00 -0.13 0.00 0.00 59.36 58.78 1yq2 h GLU 382 Cb 0.19 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 1yq2 h GLU 382 CO -0.18 1.20 -1.26 0.52 -0.73 0.00 0.00 179.01 178.55 1yq2 h MET 383 N -0.11 0.00 -0.02 1.92 2.86 -0.97 -3.45 114.93 115.16 1yq2 h MET 383 Ca -0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1yq2 h MET 383 Cb 1.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.19 1yq2 h MET 383 CO 0.15 0.65 0.00 0.41 1.06 0.00 0.00 176.91 179.18 1yq2 n GLY 384 N 1.42 0.38 2.98 8.32 0.00 -0.22 -4.87 105.19 113.20 1yq2 n GLY 384 Ca -0.07 -0.68 -0.16 0.00 0.00 0.00 0.00 46.02 45.11 1yq2 n GLY 384 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yq2 s PHE 385 N -0.00 0.51 0.10 1.61 0.40 -1.07 -4.71 117.98 114.82 1yq2 s PHE 385 Ca 0.00 -0.15 -0.31 0.00 -0.60 0.00 0.00 56.93 55.88 1yq2 s PHE 385 Cb 0.00 -0.33 -0.07 0.00 0.51 0.00 0.00 43.02 43.14 1yq2 s PHE 385 CO 0.00 -0.02 1.23 -1.58 0.70 0.00 0.00 175.22 175.56 1yq2 s TRP 386 N -0.30 3.40 -0.07 0.36 0.52 -0.13 -4.70 118.94 118.02 1yq2 s TRP 386 Ca 0.00 1.26 0.05 0.00 0.02 0.00 0.00 56.10 57.43 1yq2 s TRP 386 Cb -0.03 -3.47 -0.01 0.00 -1.15 0.00 0.00 33.47 28.81 1yq2 s TRP 386 CO -0.00 -1.47 -0.22 0.08 0.02 0.00 0.00 176.95 175.35 1yq2 s VAL 387 N 0.83 2.27 -0.37 4.03 1.01 0.96 -0.60 120.40 128.53 1yq2 s VAL 387 Ca 0.59 -0.98 -0.13 0.00 0.00 0.00 0.00 61.98 61.45 1yq2 s VAL 387 Cb -0.32 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.22 1yq2 s VAL 387 CO 0.31 0.57 0.25 -0.63 0.00 0.00 0.00 175.10 175.60 1yq2 s ILE 388 N -0.08 5.09 -0.30 2.22 1.01 -0.19 -1.57 121.20 127.38 1yq2 s ILE 388 Ca -0.05 -0.54 -0.14 0.00 0.00 0.00 0.00 60.65 59.92 1yq2 s ILE 388 Cb -0.14 -3.74 -0.03 0.00 0.01 0.00 0.00 42.46 38.55 1yq2 s ILE 388 CO 0.04 -0.17 0.30 -0.22 0.00 0.00 0.00 174.94 174.89 1yq2 s LEU 389 N 1.66 4.19 -0.13 2.97 1.98 -0.79 -2.14 118.68 126.43 1yq2 s LEU 389 Ca 0.05 -0.02 -0.03 0.00 -2.89 0.00 0.00 54.13 51.24 1yq2 s LEU 389 Cb -0.18 -2.28 -0.03 0.00 0.66 0.00 0.00 46.19 44.36 1yq2 s LEU 389 CO 0.09 -0.19 -0.02 -0.70 -1.89 0.00 0.00 176.35 173.64 1yq2 s GLU 390 N 1.92 3.45 0.60 1.98 2.12 -1.26 -1.10 118.70 126.41 1yq2 s GLU 390 Ca 0.11 -0.47 -0.19 0.00 0.36 0.00 0.00 54.97 54.78 1yq2 s GLU 390 Cb -0.16 -2.89 -0.03 0.00 0.26 0.00 0.00 34.13 31.31 1yq2 s GLU 390 CO 0.11 0.41 1.24 0.00 -0.54 0.00 0.00 175.26 176.47 1yq2 s ASP 392 N -1.51 6.07 -0.29 0.00 -1.08 -1.26 -4.00 116.67 114.60 1yq2 s ASP 392 Ca 0.79 -1.29 -0.12 0.00 -0.52 0.00 0.00 52.55 51.41 1yq2 s ASP 392 Cb -0.33 -2.57 0.11 0.00 -1.46 0.00 0.00 42.92 38.68 1yq2 s ASP 392 CO 0.35 -1.91 0.66 -0.22 0.52 0.00 0.00 175.17 174.58 1yq2 s LEU 393 N 6.65 -1.08 -0.28 -1.34 2.96 -1.25 -4.91 118.68 119.43 1yq2 s LEU 393 Ca 0.54 1.56 -0.06 0.00 -0.22 0.00 0.00 54.13 55.95 1yq2 s LEU 393 Cb -0.02 2.33 0.14 0.00 0.50 0.00 0.00 46.19 49.15 1yq2 s LEU 393 CO -0.05 -0.23 0.57 -0.70 -1.32 0.00 0.00 176.35 174.62 1yq2 s GLU 394 N 2.47 0.52 -0.23 1.98 2.12 0.07 -1.16 118.70 124.47 1yq2 s GLU 394 Ca -0.07 1.17 0.11 0.00 0.36 0.00 0.00 54.97 56.54 1yq2 s GLU 394 Cb -0.10 0.57 0.44 0.00 0.26 0.00 0.00 34.13 35.31 1yq2 s GLU 394 CO -0.19 -0.38 1.29 0.25 -0.54 0.00 0.00 175.26 175.69 1yq2 n THR 395 N 5.43 2.29 -0.32 -1.70 -2.24 -1.24 -0.43 114.28 116.06 1yq2 n THR 395 Ca -0.07 -3.03 0.19 0.00 -2.27 0.00 0.00 64.05 58.86 1yq2 n THR 395 Cb 0.50 -0.26 0.44 0.00 -2.10 0.00 0.00 70.33 68.90 1yq2 n THR 395 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1yq2 h HIS 396 N 0.95 0.81 0.00 4.78 6.17 -1.64 -1.36 115.15 124.86 1yq2 h HIS 396 Ca 0.06 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.17 1yq2 h HIS 396 Cb 1.20 -0.24 0.00 0.00 2.52 0.00 0.00 27.41 30.89 1yq2 h HIS 396 CO 0.79 0.12 0.03 0.78 0.71 0.00 0.00 177.93 180.36 1yq2 h GLY 397 N 0.53 0.00 2.00 5.26 0.00 -1.87 -1.85 103.07 107.14 1yq2 h GLY 397 Ca 0.58 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.91 1yq2 h GLY 397 CO -0.33 0.00 0.00 0.69 0.00 0.00 0.00 176.54 176.90 1yq2 n PHE 398 N -2.28 0.36 -0.04 5.60 3.01 -0.51 -4.14 117.46 119.46 1yq2 n PHE 398 Ca -0.01 0.12 -0.11 0.00 1.01 0.00 0.00 57.45 58.46 1yq2 n PHE 398 Cb 0.06 -0.69 -0.04 0.00 -0.01 0.00 0.00 39.48 38.79 1yq2 n PHE 398 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1yq2 h GLU 399 N 0.00 0.25 -0.85 -1.08 4.81 -1.53 -0.59 114.58 115.59 1yq2 h GLU 399 Ca 0.00 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.27 1yq2 h GLU 399 Cb 0.48 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.76 1yq2 h GLU 399 CO 0.00 0.26 0.55 0.00 -0.73 0.00 0.00 179.01 179.10 1yq2 h ALA 400 N 0.98 1.59 -0.16 2.92 0.00 -1.81 0.18 119.26 122.95 1yq2 h ALA 400 Ca 0.06 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1yq2 h ALA 400 Cb 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1yq2 h ALA 400 CO -0.01 0.27 0.03 0.41 0.00 0.00 0.00 179.25 179.96 1yq2 n GLY 401 N -1.41 2.02 2.16 0.00 0.00 -1.21 -4.86 105.19 101.89 1yq2 n GLY 401 Ca 0.13 -0.23 -0.07 0.00 0.00 0.00 0.00 46.02 45.84 1yq2 n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 402 N 0.14 0.23 2.54 -0.02 0.00 0.61 -3.27 105.19 105.43 1yq2 n GLY 402 Ca 0.08 -0.60 -0.12 0.00 0.00 0.00 0.00 46.02 45.38 1yq2 n GLY 402 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1yq2 n TRP 403 N -3.78 0.00 -2.12 1.61 7.02 -0.23 -4.96 117.44 114.99 1yq2 n TRP 403 Ca -0.09 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 55.98 1yq2 n TRP 403 Cb 0.51 -2.46 -0.03 0.00 -2.42 0.00 0.00 31.31 26.91 1yq2 n TRP 403 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1yq2 s VAL 404 N -2.25 3.07 -0.75 -0.99 1.01 -1.20 -1.75 120.40 117.53 1yq2 s VAL 404 Ca 0.00 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.79 1yq2 s VAL 404 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.86 1yq2 s VAL 404 CO 0.00 0.09 0.00 -0.62 0.00 0.00 0.00 175.10 174.57 1yq2 n GLU 405 N 3.37 -1.14 -1.68 2.72 -0.58 -1.26 -4.97 120.64 117.09 1yq2 n GLU 405 Ca 0.10 0.67 -0.49 0.00 -0.42 0.00 0.00 57.16 57.01 1yq2 n GLU 405 Cb 0.41 -4.71 -0.05 0.00 -0.57 0.00 0.00 31.44 26.53 1yq2 n GLU 405 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1yq2 n ASN 406 N -0.45 3.34 0.11 1.62 5.15 -0.72 -4.84 115.26 119.47 1yq2 n ASN 406 Ca -0.07 0.98 0.19 0.00 -0.60 0.00 0.00 54.58 55.09 1yq2 n ASN 406 Cb 0.39 -1.35 0.76 0.00 -0.53 0.00 0.00 39.78 39.06 1yq2 n ASN 406 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1yq2 h PRO 407 N 8.98 0.00 0.00 1.20 0.11 -1.91 -1.32 132.00 139.05 1yq2 h PRO 407 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1yq2 h PRO 407 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1yq2 h PRO 407 CO 0.95 0.00 0.01 0.77 -0.21 0.00 0.00 178.00 179.52 1yq2 h SER 408 N 0.00 0.00 0.00 -2.05 0.02 -1.88 -2.88 113.55 106.75 1yq2 h SER 408 Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1yq2 h SER 408 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1yq2 h SER 408 CO -0.00 0.00 -0.25 -0.67 -1.14 0.00 0.00 176.83 174.77 1yq2 n ASP 409 N -3.06 1.12 -4.39 3.07 2.03 -0.51 -1.75 116.55 113.06 1yq2 n ASP 409 Ca -0.03 -2.49 -0.37 0.00 0.52 0.00 0.00 54.79 52.42 1yq2 n ASP 409 Cb 0.08 -0.30 -0.13 0.00 -0.72 0.00 0.00 41.12 40.05 1yq2 n ASP 409 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1yq2 s VAL 410 N -1.36 4.08 0.54 5.18 1.01 -1.09 -4.82 120.40 123.95 1yq2 s VAL 410 Ca 0.15 -0.39 0.26 0.00 0.00 0.00 0.00 61.98 62.00 1yq2 s VAL 410 Cb 0.13 -2.97 0.39 0.00 0.00 0.00 0.00 36.38 33.93 1yq2 s VAL 410 CO 0.01 0.26 1.99 -0.65 0.00 0.00 0.00 175.10 176.72 1yq2 h PRO 411 N 8.23 0.00 0.00 2.72 0.11 -1.94 -1.91 132.00 139.20 1yq2 h PRO 411 Ca -0.36 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 1yq2 h PRO 411 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1yq2 h PRO 411 CO 0.59 0.00 -0.05 0.00 -0.21 0.00 0.00 178.00 178.33 1yq2 h ALA 412 N 1.71 1.23 -0.02 -0.75 0.00 -1.95 -2.46 119.26 117.02 1yq2 h ALA 412 Ca 0.24 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1yq2 h ALA 412 Cb 1.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1yq2 h ALA 412 CO -0.00 0.06 -0.11 0.91 0.00 0.00 0.00 179.25 180.11 1yq2 n TRP 413 N -3.48 0.00 0.04 0.00 7.02 -0.72 -4.55 117.44 115.75 1yq2 n TRP 413 Ca -0.02 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.33 1yq2 n TRP 413 Cb 0.17 -0.01 -0.08 0.00 -2.42 0.00 0.00 31.31 28.97 1yq2 n TRP 413 CO 0.00 0.00 0.00 -0.09 -2.02 0.00 0.00 177.69 175.58 1yq2 h ARG 414 N 3.53 -0.04 -0.39 -0.99 2.43 -1.51 -1.56 114.38 115.84 1yq2 h ARG 414 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1yq2 h ARG 414 Cb 0.81 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 1yq2 h ARG 414 CO 0.00 0.11 0.15 -0.44 -1.51 0.00 0.00 179.97 178.28 1yq2 h ASP 415 N -0.18 0.50 -0.45 -3.80 3.32 -1.82 -1.90 116.42 112.08 1yq2 h ASP 415 Ca -0.00 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1yq2 h ASP 415 Cb 0.17 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1yq2 h ASP 415 CO 0.01 0.46 0.22 0.00 -1.72 0.00 0.00 179.24 178.21 1yq2 h ALA 416 N 1.62 0.58 -0.32 3.45 0.00 -1.69 -0.52 119.26 122.38 1yq2 h ALA 416 Ca 0.14 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1yq2 h ALA 416 Cb 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1yq2 h ALA 416 CO -0.01 0.14 -0.17 -0.07 0.00 0.00 0.00 179.25 179.15 1yq2 h LEU 417 N 0.59 0.70 -0.68 0.00 4.07 -0.93 -1.00 115.31 118.07 1yq2 h LEU 417 Ca 0.16 -0.41 -0.12 0.00 0.08 0.00 0.00 57.88 57.58 1yq2 h LEU 417 Cb 0.12 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.65 1yq2 h LEU 417 CO -0.02 0.96 -0.25 0.58 -1.08 0.00 0.00 178.44 178.63 1yq2 h VAL 418 N 0.44 1.27 -0.67 1.22 2.07 -1.37 -2.02 116.25 117.20 1yq2 h VAL 418 Ca 0.07 -1.37 0.04 0.00 0.82 0.00 0.00 66.70 66.26 1yq2 h VAL 418 Cb 0.70 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1yq2 h VAL 418 CO 0.05 0.45 0.41 -0.78 0.02 0.00 0.00 177.57 177.72 1yq2 h ASP 419 N 0.66 0.65 -0.39 0.57 3.58 -0.97 0.09 116.42 120.62 1yq2 h ASP 419 Ca 0.09 0.01 0.06 0.00 0.42 0.00 0.00 57.03 57.60 1yq2 h ASP 419 Cb 0.76 -0.13 -0.05 0.00 1.72 0.00 0.00 39.33 41.63 1yq2 h ASP 419 CO 0.06 0.45 0.08 0.03 -2.88 0.00 0.00 179.24 176.98 1yq2 h ARG 420 N 0.79 0.21 -0.76 0.28 3.08 -0.86 -1.73 114.38 115.38 1yq2 h ARG 420 Ca 0.27 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.28 1yq2 h ARG 420 Cb 0.05 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1yq2 h ARG 420 CO -0.12 0.14 0.34 1.98 -1.07 0.00 0.00 179.97 181.24 1yq2 h MET 421 N 0.21 1.11 -0.29 0.04 4.05 -0.72 -1.63 114.93 117.70 1yq2 h MET 421 Ca 0.18 -0.18 -0.01 0.00 -0.28 0.00 0.00 59.70 59.42 1yq2 h MET 421 Cb 0.21 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 1yq2 h MET 421 CO -0.24 0.88 0.15 1.49 0.23 0.00 0.00 176.91 179.42 1yq2 h GLU 422 N 1.08 0.41 -0.31 0.39 4.81 -0.76 -0.96 114.58 119.24 1yq2 h GLU 422 Ca 0.26 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.35 1yq2 h GLU 422 Cb 0.15 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1yq2 h GLU 422 CO -0.03 0.38 -0.15 0.00 -0.73 0.00 0.00 179.01 178.48 1yq2 h ARG 423 N 0.34 0.55 0.12 1.92 3.08 -1.18 0.70 114.38 119.91 1yq2 h ARG 423 Ca 0.10 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1yq2 h ARG 423 Cb 0.10 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.10 1yq2 h ARG 423 CO -0.01 0.69 -0.06 1.15 -1.07 0.00 0.00 179.97 180.67 1yq2 h THR 424 N 0.50 0.98 -0.18 2.04 2.02 -1.13 -2.78 112.91 114.36 1yq2 h THR 424 Ca 0.09 -0.41 -0.06 0.00 0.77 0.00 0.00 66.41 66.79 1yq2 h THR 424 Cb 0.55 1.24 -0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1yq2 h THR 424 CO 0.04 0.10 -0.12 0.58 0.37 0.00 0.00 175.52 176.49 1yq2 h VAL 425 N -0.36 1.32 -0.39 3.16 2.07 -0.95 -3.26 116.25 117.84 1yq2 h VAL 425 Ca -0.02 -1.22 -0.07 0.00 0.82 0.00 0.00 66.70 66.22 1yq2 h VAL 425 Cb 0.29 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 1yq2 h VAL 425 CO 0.03 0.36 -0.05 -0.33 0.02 0.00 0.00 177.57 177.61 1yq2 h GLU 426 N 0.08 0.64 -0.68 1.57 4.39 -0.96 -1.90 114.58 117.73 1yq2 h GLU 426 Ca 0.04 -0.17 -0.00 0.00 0.34 0.00 0.00 59.36 59.57 1yq2 h GLU 426 Cb 0.62 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.16 1yq2 h GLU 426 CO 0.03 0.69 0.42 -0.09 -1.16 0.00 0.00 179.01 178.91 1yq2 h ARG 427 N 0.60 0.92 -0.18 2.33 2.43 -1.49 -2.63 114.38 116.35 1yq2 h ARG 427 Ca 0.12 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1yq2 h ARG 427 Cb 0.45 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1yq2 h ARG 427 CO 0.02 0.64 0.00 -0.25 -1.51 0.00 0.00 179.97 178.87 1yq2 n ASP 428 N -4.57 2.39 0.31 -3.80 8.00 -1.13 -1.68 116.55 116.06 1yq2 n ASP 428 Ca 0.06 -1.76 0.21 0.00 0.71 0.00 0.00 54.79 54.00 1yq2 n ASP 428 Cb 0.05 -0.12 1.05 0.00 -0.02 0.00 0.00 41.12 42.08 1yq2 n ASP 428 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 1yq2 h LYS 429 N 1.74 0.00 -0.00 -1.24 2.10 -1.46 -2.20 116.57 115.51 1yq2 h LYS 429 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1yq2 h LYS 429 Cb 0.58 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.91 1yq2 h LYS 429 CO 0.00 0.00 -0.04 0.09 -2.00 0.00 0.00 179.45 177.50 1yq2 n ASN 430 N -2.98 0.04 -4.65 7.07 3.02 -1.26 -4.89 115.26 111.61 1yq2 n ASN 430 Ca -0.02 0.41 -0.42 0.00 -0.03 0.00 0.00 54.58 54.51 1yq2 n ASN 430 Cb 0.11 -0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 38.82 1yq2 n ASN 430 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1yq2 s HIS 431 N -2.97 3.31 0.38 3.10 3.76 -0.83 -4.92 115.29 117.11 1yq2 s HIS 431 Ca 0.15 1.25 0.28 0.00 -0.15 0.00 0.00 55.06 56.59 1yq2 s HIS 431 Cb 0.19 -3.16 1.43 0.00 1.11 0.00 0.00 32.58 32.14 1yq2 s HIS 431 CO 0.54 -0.45 2.05 -1.00 -0.85 0.00 0.00 174.74 175.03 1yq2 h PRO 432 N 7.63 0.00 0.00 8.40 0.13 -1.90 -2.86 132.00 143.40 1yq2 h PRO 432 Ca -0.21 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.87 1yq2 h PRO 432 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1yq2 h PRO 432 CO 0.92 0.12 -0.21 0.66 -0.23 0.00 0.00 178.00 179.27 1yq2 h SER 433 N 0.00 0.00 -3.28 1.44 4.64 -1.90 -3.41 113.55 111.04 1yq2 h SER 433 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1yq2 h SER 433 Cb 0.37 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.40 1yq2 h SER 433 CO 0.02 0.21 0.92 -0.63 -0.87 0.00 0.00 176.83 176.47 1yq2 s ILE 434 N -4.28 4.29 -0.26 0.95 1.01 -1.08 -0.03 121.20 121.81 1yq2 s ILE 434 Ca -0.03 1.45 0.03 0.00 0.00 0.00 0.00 60.65 62.11 1yq2 s ILE 434 Cb 0.14 -4.32 -0.02 0.00 0.01 0.00 0.00 42.46 38.28 1yq2 s ILE 434 CO 0.65 -0.55 0.29 1.33 0.00 0.00 0.00 174.94 176.67 1yq2 n VAL 435 N 6.17 0.00 -3.84 2.92 0.24 -0.61 -4.92 118.33 118.29 1yq2 n VAL 435 Ca 0.13 -0.45 -0.12 0.00 -2.04 0.00 0.00 64.34 61.87 1yq2 n VAL 435 Cb 0.47 1.03 -0.11 0.00 -1.47 0.00 0.00 33.84 33.75 1yq2 n VAL 435 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1yq2 s MET 436 N -0.99 0.34 -0.09 7.34 -1.94 -1.20 -4.10 119.30 118.66 1yq2 s MET 436 Ca 0.02 -0.08 -0.09 0.00 -1.71 0.00 0.00 55.69 53.83 1yq2 s MET 436 Cb 0.03 0.15 -0.04 0.00 2.01 0.00 0.00 34.83 36.97 1yq2 s MET 436 CO 0.11 -0.07 0.21 -1.58 -0.01 0.00 0.00 175.02 173.68 1yq2 s TRP 437 N -0.65 3.63 -0.04 -0.03 0.52 -0.85 -1.88 118.94 119.65 1yq2 s TRP 437 Ca -0.07 0.66 0.06 0.00 0.02 0.00 0.00 56.10 56.77 1yq2 s TRP 437 Cb -0.04 -2.04 -0.02 0.00 -1.15 0.00 0.00 33.47 30.22 1yq2 s TRP 437 CO 0.01 0.71 -0.23 0.45 0.02 0.00 0.00 176.95 177.91 1yq2 s SER 438 N -1.04 3.31 0.50 2.95 0.15 -0.26 -0.42 113.70 118.90 1yq2 s SER 438 Ca 0.17 -0.41 0.29 0.00 0.70 0.00 0.00 55.95 56.71 1yq2 s SER 438 Cb -0.13 -0.60 1.15 0.00 -1.71 0.00 0.00 66.02 64.72 1yq2 s SER 438 CO 0.07 0.31 1.91 -0.07 1.20 0.00 0.00 173.24 176.65 1yq2 h LEU 439 N 5.61 0.00 0.00 3.45 3.38 -1.70 0.13 115.31 126.19 1yq2 h LEU 439 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1yq2 h LEU 439 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1yq2 h LEU 439 CO 0.48 0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.71 1yq2 n GLY 440 N 0.12 0.45 2.93 0.83 0.00 -1.26 -4.44 105.19 103.83 1yq2 n GLY 440 Ca 0.01 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 44.32 1yq2 n GLY 440 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yq2 s ASN 441 N -4.00 -0.10 -1.24 1.61 2.47 -0.31 -4.70 114.94 108.66 1yq2 s ASN 441 Ca 0.00 0.27 -0.22 0.00 0.42 0.00 0.00 52.86 53.32 1yq2 s ASN 441 Cb 0.00 0.19 0.02 0.00 -1.45 0.00 0.00 41.25 40.00 1yq2 s ASN 441 CO 0.00 -0.12 0.63 -0.62 -3.72 0.00 0.00 177.10 173.27 1yq2 n GLU 442 N 3.89 -1.05 -0.66 0.43 1.02 -1.26 -4.24 120.64 118.76 1yq2 n GLU 442 Ca -0.23 0.26 0.06 0.00 -0.02 0.00 0.00 57.16 57.23 1yq2 n GLU 442 Cb 0.54 -3.46 0.15 0.00 -0.02 0.00 0.00 31.44 28.65 1yq2 n GLU 442 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1yq2 n SER 443 N -2.52 1.59 0.00 1.62 7.64 -1.26 -1.88 113.62 118.82 1yq2 n SER 443 Ca -0.15 -3.29 0.00 0.00 1.01 0.00 0.00 58.87 56.44 1yq2 n SER 443 Cb 0.60 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 1yq2 n SER 443 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yq2 n GLY 444 N -0.81 0.82 3.32 0.23 0.00 -1.26 -4.65 105.19 102.84 1yq2 n GLY 444 Ca 0.15 -0.70 -0.17 0.00 0.00 0.00 0.00 46.02 45.30 1yq2 n GLY 444 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1yq2 s THR 445 N 0.00 0.64 0.00 2.61 -1.32 -1.26 -4.63 115.64 111.68 1yq2 s THR 445 Ca 0.00 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.48 1yq2 s THR 445 Cb 0.00 -2.60 0.00 0.00 -1.51 0.00 0.00 72.50 68.39 1yq2 s THR 445 CO 0.00 -0.05 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 1yq2 n GLY 446 N -0.47 1.47 0.29 6.08 0.00 -1.26 -4.43 105.19 106.88 1yq2 n GLY 446 Ca -0.01 -0.99 -0.02 0.00 0.00 0.00 0.00 46.02 45.00 1yq2 n GLY 446 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1yq2 h SER 447 N 0.00 0.67 -0.65 1.61 0.87 -1.87 -2.58 113.55 111.60 1yq2 h SER 447 Ca 0.00 -0.13 -0.06 0.00 -1.23 0.00 0.00 61.79 60.38 1yq2 h SER 447 Cb 0.00 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 1yq2 h SER 447 CO 0.00 0.69 0.19 0.78 -0.53 0.00 0.00 176.83 177.96 1yq2 h ASN 448 N 0.69 0.99 -0.45 6.23 2.35 -1.68 0.24 115.58 123.94 1yq2 h ASN 448 Ca 0.15 -0.19 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 1yq2 h ASN 448 Cb 0.32 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 1yq2 h ASN 448 CO 0.00 0.93 0.10 -0.07 -1.65 0.00 0.00 177.43 176.75 1yq2 h LEU 449 N 1.01 0.69 -1.57 1.61 3.38 -1.55 -1.40 115.31 117.47 1yq2 h LEU 449 Ca 0.22 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1yq2 h LEU 449 Cb 0.32 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1yq2 h LEU 449 CO -0.00 0.75 0.23 0.00 0.09 0.00 0.00 178.44 179.51 1yq2 h ALA 450 N 0.97 1.68 -0.18 1.53 0.00 -1.20 -1.60 119.26 120.46 1yq2 h ALA 450 Ca 0.14 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 1yq2 h ALA 450 Cb 0.34 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1yq2 h ALA 450 CO 0.00 0.28 -0.50 0.00 0.00 0.00 0.00 179.25 179.03 1yq2 h ALA 451 N 1.73 0.81 -0.40 0.00 0.00 -0.59 -0.83 119.26 119.97 1yq2 h ALA 451 Ca 0.14 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1yq2 h ALA 451 Cb -0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1yq2 h ALA 451 CO -0.03 0.67 0.25 0.52 0.00 0.00 0.00 179.25 180.66 1yq2 h MET 452 N 0.38 0.54 -0.63 0.00 2.07 -0.63 -1.35 114.93 115.31 1yq2 h MET 452 Ca 0.02 -0.05 -0.07 0.00 -2.07 0.00 0.00 59.70 57.54 1yq2 h MET 452 Cb 1.01 -0.12 -0.03 0.00 -1.87 0.00 0.00 31.60 30.60 1yq2 h MET 452 CO 0.09 0.39 0.13 0.00 1.07 0.00 0.00 176.91 178.60 1yq2 h ALA 453 N 1.12 1.05 -0.66 6.32 0.00 -1.17 -1.81 119.26 124.10 1yq2 h ALA 453 Ca 0.14 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1yq2 h ALA 453 Cb -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1yq2 h ALA 453 CO -0.03 0.62 0.17 0.00 0.00 0.00 0.00 179.25 180.01 1yq2 h ALA 454 N 1.19 1.05 -0.26 0.00 0.00 -0.96 -0.86 119.26 119.42 1yq2 h ALA 454 Ca 0.20 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1yq2 h ALA 454 Cb 0.37 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1yq2 h ALA 454 CO 0.00 0.63 0.01 2.35 0.00 0.00 0.00 179.25 182.25 1yq2 h TRP 455 N 0.99 0.48 -0.58 0.00 7.01 -0.91 -1.46 115.95 121.48 1yq2 h TRP 455 Ca 0.21 -0.08 -0.04 0.00 2.11 0.00 0.00 58.89 61.09 1yq2 h TRP 455 Cb 0.34 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.25 1yq2 h TRP 455 CO 0.02 0.59 0.19 0.00 -2.79 0.00 0.00 178.44 176.46 1yq2 h ALA 456 N 0.83 0.76 -0.97 2.65 0.00 -1.14 0.39 119.26 121.79 1yq2 h ALA 456 Ca 0.07 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1yq2 h ALA 456 Cb 0.39 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1yq2 h ALA 456 CO 0.01 0.42 0.64 0.45 0.00 0.00 0.00 179.25 180.77 1yq2 h HIS 457 N 0.82 1.19 -0.03 0.00 3.86 -1.11 0.25 115.15 120.13 1yq2 h HIS 457 Ca 0.19 0.03 -0.21 0.00 -1.16 0.00 0.00 60.37 59.22 1yq2 h HIS 457 Cb 0.27 -0.40 -0.00 0.00 1.06 0.00 0.00 27.41 28.34 1yq2 h HIS 457 CO 0.02 0.69 -0.85 0.00 0.86 0.00 0.00 177.93 178.65 1yq2 h ALA 458 N 1.43 0.47 0.03 2.45 0.00 -0.54 -3.35 119.26 119.74 1yq2 h ALA 458 Ca 0.38 -0.67 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 1yq2 h ALA 458 Cb -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1yq2 h ALA 458 CO -0.11 0.80 -0.16 -0.09 0.00 0.00 0.00 179.25 179.69 1yq2 h ARG 459 N 0.25 0.06 -3.25 0.00 9.65 -0.70 -3.45 114.38 116.94 1yq2 h ARG 459 Ca -0.06 -0.10 -0.58 0.00 -1.10 0.00 0.00 59.98 58.14 1yq2 h ARG 459 Cb 1.46 0.04 -0.40 0.00 -1.39 0.00 0.00 29.97 29.68 1yq2 h ARG 459 CO 0.15 1.04 -0.77 0.34 2.80 0.00 0.00 179.97 183.53 1yq2 s ASP 460 N -6.36 3.79 0.00 -3.80 2.15 0.86 -4.96 116.67 108.35 1yq2 s ASP 460 Ca -0.18 -1.82 0.31 0.00 0.43 0.00 0.00 52.55 51.29 1yq2 s ASP 460 Cb -0.02 -0.78 1.66 0.00 -0.30 0.00 0.00 42.92 43.48 1yq2 s ASP 460 CO 0.72 -0.38 2.12 -1.54 -0.17 0.00 0.00 175.17 175.91 1yq2 n SER 461 N 4.59 0.00 0.06 -0.34 3.41 -1.26 -3.87 113.62 116.21 1yq2 n SER 461 Ca 0.01 -0.44 0.13 0.00 -0.26 0.00 0.00 58.87 58.31 1yq2 n SER 461 Cb 0.40 -0.19 0.48 0.00 -0.26 0.00 0.00 64.21 64.65 1yq2 n SER 461 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1yq2 n SER 462 N -1.18 0.47 -3.81 4.04 3.41 -1.26 -4.78 113.62 110.50 1yq2 n SER 462 Ca 0.18 0.51 -0.19 0.00 -0.26 0.00 0.00 58.87 59.11 1yq2 n SER 462 Cb 0.20 -0.61 -0.17 0.00 -0.26 0.00 0.00 64.21 63.37 1yq2 n SER 462 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1yq2 s ARG 463 N -3.06 0.41 0.73 4.33 0.52 -1.25 -4.46 118.95 116.17 1yq2 s ARG 463 Ca 0.12 0.07 -0.14 0.00 -0.52 0.00 0.00 55.73 55.25 1yq2 s ARG 463 Cb 0.15 -0.62 0.04 0.00 0.52 0.00 0.00 34.95 35.04 1yq2 s ARG 463 CO 0.58 -0.16 1.17 -2.14 0.02 0.00 0.00 175.30 174.76 1yq2 s PRO 464 N 1.22 2.21 -0.16 3.54 0.02 -1.26 -4.70 135.00 135.87 1yq2 s PRO 464 Ca -0.07 1.62 -0.07 0.00 0.02 0.00 0.00 61.00 62.50 1yq2 s PRO 464 Cb -0.13 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.49 1yq2 s PRO 464 CO -0.02 -1.75 0.06 0.08 -0.33 0.00 0.00 177.00 175.05 1yq2 s VAL 465 N -2.18 4.82 -0.02 3.83 1.01 -1.26 -2.00 120.40 124.59 1yq2 s VAL 465 Ca 0.71 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.69 1yq2 s VAL 465 Cb -0.26 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 1yq2 s VAL 465 CO 0.46 0.49 -0.09 -2.28 0.00 0.00 0.00 175.10 173.68 1yq2 s HIS 466 N 0.07 2.85 -0.30 5.22 5.04 0.43 -1.40 115.29 127.20 1yq2 s HIS 466 Ca 0.05 -0.06 -0.11 0.00 -1.54 0.00 0.00 55.06 53.41 1yq2 s HIS 466 Cb -0.12 -1.63 0.18 0.00 0.04 0.00 0.00 32.58 31.04 1yq2 s HIS 466 CO 0.01 0.32 0.94 -0.47 -2.34 0.00 0.00 174.74 173.19 1yq2 s TYR 467 N -0.90 -0.80 0.21 3.88 5.04 -1.26 -1.90 117.35 121.62 1yq2 s TYR 467 Ca 0.15 0.99 0.25 0.00 -2.44 0.00 0.00 57.07 56.02 1yq2 s TYR 467 Cb -0.11 0.33 1.08 0.00 0.35 0.00 0.00 41.96 43.61 1yq2 s TYR 467 CO 0.04 -0.43 1.90 1.49 -1.34 0.00 0.00 175.55 177.21 1yq2 h GLU 468 N 7.86 0.00 0.00 4.97 4.22 -1.84 -2.55 114.58 127.25 1yq2 h GLU 468 Ca -0.16 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.28 1yq2 h GLU 468 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1yq2 h GLU 468 CO 0.03 0.19 0.00 0.41 -2.18 0.00 0.00 179.01 177.46 1yq2 n GLY 469 N -0.08 -0.80 2.83 1.92 0.00 -1.26 -4.16 105.19 103.64 1yq2 n GLY 469 Ca -0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1yq2 n GLY 469 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1yq2 n ASP 470 N -1.38 5.15 -0.03 1.61 2.03 -0.96 -4.46 116.55 118.51 1yq2 n ASP 470 Ca 0.05 -3.09 0.01 0.00 0.52 0.00 0.00 54.79 52.27 1yq2 n ASP 470 Cb 0.12 -1.48 0.32 0.00 -0.72 0.00 0.00 41.12 39.35 1yq2 n ASP 470 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 1yq2 h TYR 471 N 5.70 0.60 -0.07 -0.67 0.99 -1.87 -1.97 116.97 119.68 1yq2 h TYR 471 Ca 0.42 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 61.12 1yq2 h TYR 471 Cb 0.61 -0.19 0.00 0.00 1.00 0.00 0.00 36.73 38.16 1yq2 h TYR 471 CO 1.28 0.50 0.00 0.25 -0.00 0.00 0.00 178.16 180.19 1yq2 n THR 472 N -4.35 0.07 -2.64 -2.88 -2.24 -1.26 -4.79 114.28 96.19 1yq2 n THR 472 Ca 0.03 -0.29 -0.10 0.00 -2.27 0.00 0.00 64.05 61.42 1yq2 n THR 472 Cb 0.17 0.48 0.02 0.00 -2.10 0.00 0.00 70.33 68.90 1yq2 n THR 472 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yq2 n GLY 473 N 1.17 0.18 0.21 3.38 0.00 -0.74 -4.80 105.19 104.59 1yq2 n GLY 473 Ca 0.18 -0.37 0.09 0.00 0.00 0.00 0.00 46.02 45.92 1yq2 n GLY 473 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 h ALA 474 N 0.43 0.92 0.00 4.61 0.00 -1.93 -3.40 119.26 119.89 1yq2 h ALA 474 Ca -0.23 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1yq2 h ALA 474 Cb 1.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1yq2 h ALA 474 CO 0.25 0.28 -0.04 2.48 0.00 0.00 0.00 179.25 182.22 1yq2 n TYR 475 N -3.25 0.00 -4.27 0.00 0.18 -1.26 -5.10 117.16 103.46 1yq2 n TYR 475 Ca 0.01 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.54 1yq2 n TYR 475 Cb 0.52 0.10 -0.08 0.00 -0.38 0.00 0.00 39.34 39.50 1yq2 n TYR 475 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1yq2 s THR 476 N 0.00 3.39 -0.12 -3.48 -4.23 -1.26 -4.89 115.64 105.04 1yq2 s THR 476 Ca 0.00 -1.65 0.21 0.00 -1.18 0.00 0.00 61.69 59.06 1yq2 s THR 476 Cb 0.00 -2.71 -0.20 0.00 1.34 0.00 0.00 72.50 70.93 1yq2 s THR 476 CO 0.00 -0.17 0.65 0.47 -0.54 0.00 0.00 174.62 175.03 1yq2 n ASP 477 N -0.20 0.40 -4.38 3.99 8.00 -0.50 -4.88 116.55 118.97 1yq2 n ASP 477 Ca -0.09 0.16 -0.29 0.00 0.71 0.00 0.00 54.79 55.28 1yq2 n ASP 477 Cb 0.56 1.10 -0.13 0.00 -0.02 0.00 0.00 41.12 42.63 1yq2 n ASP 477 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1yq2 s VAL 478 N -3.23 2.23 -0.28 2.53 -7.23 -1.23 -4.49 120.40 108.69 1yq2 s VAL 478 Ca -0.05 -1.70 -0.22 0.00 -1.81 0.00 0.00 61.98 58.20 1yq2 s VAL 478 Cb 0.11 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 35.08 1yq2 s VAL 478 CO 0.85 0.13 0.70 -0.47 -0.31 0.00 0.00 175.10 176.00 1yq2 s TYR 479 N -1.02 3.24 -0.03 2.82 5.04 0.12 -4.69 117.35 122.83 1yq2 s TYR 479 Ca 0.13 0.79 0.06 0.00 -2.44 0.00 0.00 57.07 55.61 1yq2 s TYR 479 Cb -0.10 -3.02 -0.01 0.00 0.35 0.00 0.00 41.96 39.18 1yq2 s TYR 479 CO 0.05 -0.45 -0.23 0.45 -1.34 0.00 0.00 175.55 174.04 1yq2 s SER 480 N 1.55 2.74 0.20 4.32 0.15 -1.26 -1.43 113.70 119.96 1yq2 s SER 480 Ca 0.29 -0.44 0.03 0.00 0.70 0.00 0.00 55.95 56.53 1yq2 s SER 480 Cb -0.15 -0.52 -0.05 0.00 -1.71 0.00 0.00 66.02 63.59 1yq2 s SER 480 CO 0.10 0.25 -0.00 -0.13 1.20 0.00 0.00 173.24 174.66 1yq2 s ARG 481 N -0.33 1.21 -0.08 5.44 1.81 -0.85 -4.61 118.95 121.54 1yq2 s ARG 481 Ca 0.03 -1.60 0.02 0.00 -1.72 0.00 0.00 55.73 52.47 1yq2 s ARG 481 Cb -0.11 -0.43 0.01 0.00 -0.45 0.00 0.00 34.95 33.97 1yq2 s ARG 481 CO 0.01 -0.11 -0.15 0.00 -0.68 0.00 0.00 175.30 174.37 1yq2 s MET 482 N -3.89 2.05 -1.56 3.54 0.23 -1.26 -1.28 119.30 117.13 1yq2 s MET 482 Ca 0.26 -0.52 -0.00 0.00 -1.03 0.00 0.00 55.69 54.39 1yq2 s MET 482 Cb 0.06 -1.68 0.00 0.00 -1.53 0.00 0.00 34.83 31.68 1yq2 s MET 482 CO 0.06 0.02 0.02 0.66 -2.03 0.00 0.00 175.02 173.75 1yq2 n TYR 483 N 3.88 -1.16 -2.02 3.16 4.02 -0.16 -4.95 117.16 119.93 1yq2 n TYR 483 Ca -0.21 0.02 -0.40 0.00 -0.01 0.00 0.00 57.90 57.30 1yq2 n TYR 483 Cb 0.52 -3.62 -0.01 0.00 -0.02 0.00 0.00 39.34 36.21 1yq2 n TYR 483 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1yq2 s SER 484 N -2.06 6.36 1.04 7.72 1.04 -1.26 -4.69 113.70 121.85 1yq2 s SER 484 Ca 0.01 2.71 -0.15 0.00 0.48 0.00 0.00 55.95 59.01 1yq2 s SER 484 Cb -0.00 -2.64 0.21 0.00 0.10 0.00 0.00 66.02 63.68 1yq2 s SER 484 CO 0.01 -0.82 1.12 -0.94 0.98 0.00 0.00 173.24 173.59 1yq2 s SER 485 N -0.62 2.33 0.10 7.02 1.04 -1.26 -4.71 113.70 117.59 1yq2 s SER 485 Ca 0.55 0.91 -0.20 0.00 0.48 0.00 0.00 55.95 57.69 1yq2 s SER 485 Cb -0.39 -1.40 -0.09 0.00 0.10 0.00 0.00 66.02 64.23 1yq2 s SER 485 CO 0.51 -3.28 1.69 0.40 0.98 0.00 0.00 173.24 173.54 1yq2 h ILE 486 N -2.00 1.11 -0.83 -1.02 1.08 -1.90 -0.70 117.51 113.24 1yq2 h ILE 486 Ca -0.51 -0.29 0.05 0.00 -0.39 0.00 0.00 64.86 63.73 1yq2 h ILE 486 Cb 1.32 0.99 -0.06 0.00 -3.07 0.00 0.00 36.82 36.00 1yq2 h ILE 486 CO 0.51 0.10 0.51 -0.65 -0.69 0.00 0.00 178.15 177.93 1yq2 h PRO 487 N 0.17 0.93 -0.36 2.37 0.11 -1.89 -0.17 132.00 133.15 1yq2 h PRO 487 Ca 0.06 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 65.96 1yq2 h PRO 487 Cb 0.08 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 1yq2 h PRO 487 CO -0.01 0.61 -0.38 1.49 -0.21 0.00 0.00 178.00 179.50 1yq2 h GLU 488 N 0.95 0.87 -0.38 1.05 4.81 -1.63 -1.52 114.58 118.74 1yq2 h GLU 488 Ca 0.36 -0.45 -0.12 0.00 -0.13 0.00 0.00 59.36 59.01 1yq2 h GLU 488 Cb 0.13 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1yq2 h GLU 488 CO -0.16 1.10 -0.24 1.15 -0.73 0.00 0.00 179.01 180.13 1yq2 h THR 489 N 0.72 1.27 -0.60 0.32 2.02 -0.97 0.25 112.91 115.92 1yq2 h THR 489 Ca 0.06 -1.36 0.04 0.00 0.77 0.00 0.00 66.41 65.92 1yq2 h THR 489 Cb 0.96 1.24 -0.04 0.00 -1.74 0.00 0.00 68.15 68.57 1yq2 h THR 489 CO 0.09 0.45 0.34 -0.78 0.37 0.00 0.00 175.52 176.00 1yq2 h ASP 490 N 0.66 0.53 0.13 4.18 1.82 -0.98 -1.67 116.42 121.09 1yq2 h ASP 490 Ca 0.09 0.02 -0.07 0.00 -0.39 0.00 0.00 57.03 56.68 1yq2 h ASP 490 Cb 0.75 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 40.66 1yq2 h ASP 490 CO 0.06 0.36 -0.24 0.77 -1.61 0.00 0.00 179.24 178.59 1yq2 h SER 491 N 0.66 0.19 -0.18 2.28 4.64 -0.31 -1.45 113.55 119.38 1yq2 h SER 491 Ca 0.25 -0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.49 1yq2 h SER 491 Cb 0.09 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1yq2 h SER 491 CO -0.14 0.44 -0.02 0.40 -0.87 0.00 0.00 176.83 176.64 1yq2 h ILE 492 N 0.18 1.27 -0.20 0.95 2.04 -0.59 -3.32 117.51 117.85 1yq2 h ILE 492 Ca 0.03 -0.94 -0.13 0.00 1.00 0.00 0.00 64.86 64.82 1yq2 h ILE 492 Cb 0.52 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 1yq2 h ILE 492 CO 0.04 0.28 -0.44 1.23 0.00 0.00 0.00 178.15 179.26 1yq2 h GLY 493 N 0.06 0.54 -1.68 5.37 0.00 -0.93 -3.46 103.07 102.97 1yq2 h GLY 493 Ca 0.05 -0.55 -0.48 0.00 0.00 0.00 0.00 47.33 46.34 1yq2 h GLY 493 CO 0.01 0.50 0.38 1.09 0.00 0.00 0.00 176.54 178.52 1yq2 s ARG 494 N -4.16 3.75 0.00 4.80 1.70 -0.58 -4.71 118.95 119.75 1yq2 s ARG 494 Ca -0.07 0.98 0.21 0.00 -0.47 0.00 0.00 55.73 56.38 1yq2 s ARG 494 Cb 0.12 -2.10 0.51 0.00 -0.57 0.00 0.00 34.95 32.91 1yq2 s ARG 494 CO 0.82 -0.44 1.44 0.09 -1.08 0.00 0.00 175.30 176.13 1yq2 n ASN 495 N -1.86 3.61 -0.96 -2.89 3.02 -1.26 -4.32 115.26 110.60 1yq2 n ASN 495 Ca 0.07 -1.98 0.01 0.00 -0.03 0.00 0.00 54.58 52.65 1yq2 n ASN 495 Cb 0.54 -0.37 0.16 0.00 -0.61 0.00 0.00 39.78 39.50 1yq2 n ASN 495 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1yq2 n ASP 496 N 1.42 2.18 -4.09 6.41 5.75 -1.26 -5.02 116.55 121.94 1yq2 n ASP 496 Ca 0.21 -3.67 -0.26 0.00 -0.01 0.00 0.00 54.79 51.05 1yq2 n ASP 496 Cb 0.58 -0.48 -0.16 0.00 -1.03 0.00 0.00 41.12 40.03 1yq2 n ASP 496 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1yq2 s SER 497 N -3.20 2.10 -0.04 -1.12 0.15 -1.26 -4.98 113.70 105.34 1yq2 s SER 497 Ca 0.40 -0.36 0.13 0.00 0.70 0.00 0.00 55.95 56.82 1yq2 s SER 497 Cb 0.38 -0.84 0.40 0.00 -1.71 0.00 0.00 66.02 64.24 1yq2 s SER 497 CO -0.06 0.09 1.33 1.41 1.20 0.00 0.00 173.24 177.21 1yq2 n HIS 498 N 3.55 0.65 -1.55 3.44 8.25 -1.26 -5.02 115.22 123.28 1yq2 n HIS 498 Ca -0.21 -0.58 -0.46 0.00 -0.26 0.00 0.00 57.72 56.21 1yq2 n HIS 498 Cb 0.52 -0.10 -0.02 0.00 1.12 0.00 0.00 29.99 31.52 1yq2 n HIS 498 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yq2 n ALA 499 N 0.40 -0.76 -1.77 -1.41 0.00 -1.26 -4.93 120.51 110.79 1yq2 n ALA 499 Ca 0.15 0.41 -0.40 0.00 0.00 0.00 0.00 53.44 53.59 1yq2 n ALA 499 Cb 0.56 -1.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.04 1yq2 n ALA 499 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yq2 s LEU 500 N 0.92 4.42 0.26 0.00 1.43 -1.26 -4.92 118.68 119.53 1yq2 s LEU 500 Ca 0.61 2.55 0.07 0.00 -1.03 0.00 0.00 54.13 56.33 1yq2 s LEU 500 Cb -0.76 -3.70 -0.03 0.00 0.03 0.00 0.00 46.19 41.73 1yq2 s LEU 500 CO 0.59 -0.47 0.21 -0.76 0.23 0.00 0.00 176.35 176.14 1yq2 s LEU 501 N -1.82 3.79 -0.13 1.79 1.43 -1.26 -5.03 118.68 117.46 1yq2 s LEU 501 Ca 0.49 -0.28 -0.39 0.00 -1.03 0.00 0.00 54.13 52.92 1yq2 s LEU 501 Cb -0.37 -2.34 -0.17 0.00 0.03 0.00 0.00 46.19 43.35 1yq2 s LEU 501 CO 0.48 -0.08 1.50 -0.11 0.23 0.00 0.00 176.35 178.38 1yq2 n LEU 502 N -1.20 1.75 0.00 1.79 7.94 -1.26 -1.57 117.00 124.45 1yq2 n LEU 502 Ca -0.07 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.94 1yq2 n LEU 502 Cb 0.58 -1.12 0.00 0.00 0.53 0.00 0.00 43.42 43.42 1yq2 n LEU 502 CO 0.43 -0.86 0.00 0.61 -1.11 0.00 0.00 177.39 176.46 1yq2 n GLY 503 N 3.24 0.42 3.45 -3.96 0.00 -1.26 -4.76 105.19 102.32 1yq2 n GLY 503 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 1yq2 n GLY 503 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 n ASP 505 N 1.07 0.52 -0.06 0.00 3.85 -1.26 -4.42 116.55 116.25 1yq2 n ASP 505 Ca -0.16 -1.52 -0.02 0.00 -0.71 0.00 0.00 54.79 52.38 1yq2 n ASP 505 Cb 0.53 -0.45 0.24 0.00 -1.35 0.00 0.00 41.12 40.08 1yq2 n ASP 505 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 1yq2 h SER 506 N -0.58 0.62 0.02 -1.12 4.64 -1.96 -1.27 113.55 113.89 1yq2 h SER 506 Ca -0.21 -0.12 -0.25 0.00 -0.47 0.00 0.00 61.79 60.74 1yq2 h SER 506 Cb 0.69 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 62.64 1yq2 h SER 506 CO 0.19 0.67 -0.94 0.00 -0.87 0.00 0.00 176.83 175.88 1yq2 h ALA 507 N 1.40 0.23 -0.40 5.18 0.00 -1.96 -1.35 119.26 122.36 1yq2 h ALA 507 Ca 0.13 -0.67 -0.11 0.00 0.00 0.00 0.00 54.91 54.26 1yq2 h ALA 507 Cb 0.35 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1yq2 h ALA 507 CO 0.01 0.71 -0.19 0.93 0.00 0.00 0.00 179.25 180.71 1yq2 h GLU 508 N 0.41 0.77 -0.40 0.00 5.08 -1.85 -1.97 114.58 116.62 1yq2 h GLU 508 Ca -0.10 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 57.95 1yq2 h GLU 508 Cb 1.58 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.77 1yq2 h GLU 508 CO 0.18 0.91 0.19 0.77 -1.00 0.00 0.00 179.01 180.06 1yq2 h SER 509 N 0.68 0.52 -0.74 1.42 0.02 -1.18 -2.19 113.55 112.08 1yq2 h SER 509 Ca 0.10 -0.13 0.05 0.00 -0.84 0.00 0.00 61.79 60.97 1yq2 h SER 509 Cb 0.69 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.05 1yq2 h SER 509 CO 0.05 0.50 0.45 0.00 -1.14 0.00 0.00 176.83 176.69 1yq2 h ALA 510 N 1.04 1.00 -0.35 3.77 0.00 -1.10 -2.45 119.26 121.17 1yq2 h ALA 510 Ca 0.14 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1yq2 h ALA 510 Cb 0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1yq2 h ALA 510 CO -0.02 0.19 0.14 -0.09 0.00 0.00 0.00 179.25 179.48 1yq2 h ARG 511 N 0.85 0.30 -0.10 0.00 2.43 -1.16 -2.40 114.38 114.29 1yq2 h ARG 511 Ca 0.32 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.38 1yq2 h ARG 511 Cb 0.11 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1yq2 h ARG 511 CO -0.15 0.20 -0.32 1.96 -1.51 0.00 0.00 179.97 180.15 1yq2 h GLN 512 N 0.31 0.19 0.00 0.20 1.08 -1.15 -2.19 115.11 113.54 1yq2 h GLN 512 Ca 0.15 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1yq2 h GLN 512 Cb 0.10 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 1yq2 h GLN 512 CO -0.14 0.50 0.00 0.54 -0.95 0.00 0.00 178.83 178.78 1yq2 n ARG 513 N -4.11 0.56 0.00 1.46 1.74 -0.91 -2.70 116.66 112.70 1yq2 n ARG 513 Ca -0.01 0.02 0.13 0.00 -0.77 0.00 0.00 57.85 57.21 1yq2 n ARG 513 Cb 0.40 -1.50 0.33 0.00 -1.02 0.00 0.00 32.46 30.67 1yq2 n ARG 513 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1yq2 n THR 514 N -1.05 0.00 -4.24 0.55 -2.24 -0.82 -4.97 114.28 101.51 1yq2 n THR 514 Ca 0.14 -0.15 -0.24 0.00 -2.27 0.00 0.00 64.05 61.54 1yq2 n THR 514 Cb 0.08 0.50 -0.07 0.00 -2.10 0.00 0.00 70.33 68.74 1yq2 n THR 514 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1yq2 s LYS 515 N -2.49 2.42 0.58 -0.78 1.02 -1.10 -3.28 119.74 116.12 1yq2 s LYS 515 Ca 0.24 -1.27 -0.20 0.00 0.02 0.00 0.00 55.97 54.76 1yq2 s LYS 515 Cb 0.19 -2.28 -0.03 0.00 -0.52 0.00 0.00 37.83 35.18 1yq2 s LYS 515 CO 0.52 0.40 1.31 -2.14 -0.92 0.00 0.00 175.35 174.52 1yq2 s PRO 516 N -3.48 2.94 -0.08 -1.68 0.02 -1.24 -4.68 135.00 126.79 1yq2 s PRO 516 Ca 0.30 2.12 0.02 0.00 0.02 0.00 0.00 61.00 63.46 1yq2 s PRO 516 Cb -0.07 -2.08 -0.02 0.00 0.02 0.00 0.00 34.50 32.34 1yq2 s PRO 516 CO 0.20 -1.31 -0.13 0.12 -0.33 0.00 0.00 177.00 175.54 1yq2 s PHE 517 N -1.37 2.76 0.03 6.54 5.36 -0.47 -0.70 117.98 130.12 1yq2 s PHE 517 Ca 0.76 -0.35 0.02 0.00 -0.96 0.00 0.00 56.93 56.40 1yq2 s PHE 517 Cb -0.38 -1.72 -0.02 0.00 -0.34 0.00 0.00 43.02 40.56 1yq2 s PHE 517 CO 0.43 0.03 -0.08 -1.50 -1.46 0.00 0.00 175.22 172.64 1yq2 s ILE 518 N -0.28 0.59 -0.43 3.12 1.10 -0.52 -0.61 121.20 124.17 1yq2 s ILE 518 Ca 0.02 -0.88 -0.22 0.00 -0.51 0.00 0.00 60.65 59.06 1yq2 s ILE 518 Cb -0.13 -0.61 0.02 0.00 0.15 0.00 0.00 42.46 41.90 1yq2 s ILE 518 CO 0.03 -0.22 0.72 -0.76 -2.11 0.00 0.00 174.94 172.59 1yq2 s LEU 519 N -1.20 4.34 0.44 8.50 1.43 -0.65 -2.02 118.68 129.53 1yq2 s LEU 519 Ca -0.06 -0.15 0.25 0.00 -1.03 0.00 0.00 54.13 53.14 1yq2 s LEU 519 Cb -0.08 -2.86 0.69 0.00 0.03 0.00 0.00 46.19 43.97 1yq2 s LEU 519 CO 0.00 -0.83 1.73 0.00 0.23 0.00 0.00 176.35 177.48 1yq2 s GLU 521 N -3.39 0.08 0.31 0.00 2.02 -1.24 -4.39 118.70 112.09 1yq2 s GLU 521 Ca 0.04 0.37 -0.12 0.00 0.02 0.00 0.00 54.97 55.27 1yq2 s GLU 521 Cb 0.08 -0.19 0.02 0.00 0.10 0.00 0.00 34.13 34.13 1yq2 s GLU 521 CO 0.64 -0.18 0.59 1.52 0.02 0.00 0.00 175.26 177.86 1yq2 s TYR 522 N 1.24 0.40 -1.24 1.61 -0.00 -0.79 -0.99 117.35 117.58 1yq2 s TYR 522 Ca -0.08 -0.83 -0.32 0.00 -0.00 0.00 0.00 57.07 55.84 1yq2 s TYR 522 Cb -0.12 0.36 0.04 0.00 -0.00 0.00 0.00 41.96 42.24 1yq2 s TYR 522 CO -0.06 -1.22 0.63 1.33 -0.00 0.00 0.00 175.55 176.24 1yq2 n VAL 523 N -0.48 -2.68 -1.72 -3.49 0.24 -1.26 -1.58 118.33 107.36 1yq2 n VAL 523 Ca -0.03 -0.61 -0.64 0.00 -2.04 0.00 0.00 64.34 61.02 1yq2 n VAL 523 Cb 0.61 -2.25 -0.09 0.00 -1.47 0.00 0.00 33.84 30.64 1yq2 n VAL 523 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1yq2 n HIS 524 N -5.01 1.85 1.11 6.34 -0.00 -1.26 -4.45 115.22 113.80 1yq2 n HIS 524 Ca -0.13 0.92 0.12 0.00 0.46 0.00 0.00 57.72 59.09 1yq2 n HIS 524 Cb 0.57 -2.32 0.35 0.00 -0.12 0.00 0.00 29.99 28.48 1yq2 n HIS 524 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1yq2 n ALA 525 N 4.63 2.51 -1.71 1.57 0.00 0.61 -4.34 120.51 123.79 1yq2 n ALA 525 Ca 0.30 -0.60 -0.43 0.00 0.00 0.00 0.00 53.44 52.70 1yq2 n ALA 525 Cb 0.01 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 1yq2 n ALA 525 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1yq2 n MET 526 N 0.61 2.49 0.00 0.00 0.00 -1.25 -4.54 117.12 114.42 1yq2 n MET 526 Ca 0.17 0.89 0.00 0.00 0.00 0.00 0.00 57.70 58.76 1yq2 n MET 526 Cb 0.41 -2.67 0.00 0.00 0.00 0.00 0.00 33.22 30.96 1yq2 n MET 526 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1yq2 n GLY 527 N 3.08 1.42 3.64 -5.12 0.00 -1.26 -4.52 105.19 102.43 1yq2 n GLY 527 Ca 0.14 -0.62 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 1yq2 n GLY 527 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yq2 s ASN 528 N -4.00 6.89 0.00 1.61 3.84 -1.26 -4.81 114.94 117.21 1yq2 s ASN 528 Ca 0.00 1.07 0.00 0.00 0.21 0.00 0.00 52.86 54.14 1yq2 s ASN 528 Cb 0.00 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.16 1yq2 s ASN 528 CO 0.00 -0.92 0.00 0.61 -2.79 0.00 0.00 177.10 174.00 1yq2 n GLY 529 N 3.95 0.57 3.96 1.21 0.00 -1.26 -4.75 105.19 108.87 1yq2 n GLY 529 Ca 0.12 -1.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 1yq2 n GLY 529 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1yq2 s PRO 530 N -1.30 3.21 0.66 1.61 0.04 -1.26 -4.39 135.00 133.57 1yq2 s PRO 530 Ca 0.00 -0.61 -0.02 0.00 0.04 0.00 0.00 61.00 60.41 1yq2 s PRO 530 Cb 0.00 -2.68 0.07 0.00 0.04 0.00 0.00 34.50 31.93 1yq2 s PRO 530 CO 0.00 -0.02 0.92 0.20 0.04 0.00 0.00 177.00 178.14 1yq2 s GLY 531 N -4.14 1.77 0.00 0.56 0.00 0.25 -4.67 107.32 101.09 1yq2 s GLY 531 Ca 0.44 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 43.88 1yq2 s GLY 531 CO 0.35 -0.88 0.00 0.00 0.00 0.00 0.00 173.10 172.57 1yq2 n ALA 532 N -2.70 0.00 -0.19 3.20 0.00 -1.25 -4.70 120.51 114.86 1yq2 n ALA 532 Ca 0.10 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.66 1yq2 n ALA 532 Cb 0.60 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.48 1yq2 n ALA 532 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1yq2 h MET 533 N 3.02 0.57 -0.10 0.00 2.86 -1.88 -0.89 114.93 118.51 1yq2 h MET 533 Ca 0.00 -0.03 -0.15 0.00 -2.06 0.00 0.00 59.70 57.46 1yq2 h MET 533 Cb 0.00 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 1yq2 h MET 533 CO 0.00 0.38 -0.57 0.38 1.06 0.00 0.00 176.91 178.15 1yq2 h ASP 534 N 0.58 0.35 -0.67 1.22 2.03 -1.93 -1.57 116.42 116.44 1yq2 h ASP 534 Ca 0.37 -0.19 -0.08 0.00 -0.73 0.00 0.00 57.03 56.39 1yq2 h ASP 534 Cb 0.63 -0.10 -0.03 0.00 -0.83 0.00 0.00 39.33 39.01 1yq2 h ASP 534 CO -0.14 0.85 0.10 1.56 -1.03 0.00 0.00 179.24 180.58 1yq2 h GLN 535 N 0.24 1.12 -0.52 4.15 4.20 -1.59 0.36 115.11 123.07 1yq2 h GLN 535 Ca -0.00 -0.31 -0.09 0.00 0.06 0.00 0.00 58.65 58.31 1yq2 h GLN 535 Cb 1.08 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.71 1yq2 h GLN 535 CO 0.09 1.03 -0.03 1.88 -0.67 0.00 0.00 178.83 181.13 1yq2 h TYR 536 N 1.04 1.03 -0.59 2.96 -1.99 -1.28 -2.69 116.97 115.46 1yq2 h TYR 536 Ca 0.20 -0.19 -0.08 0.00 2.00 0.00 0.00 58.73 60.66 1yq2 h TYR 536 Cb 0.46 -0.26 -0.02 0.00 2.00 0.00 0.00 36.73 38.90 1yq2 h TYR 536 CO 0.03 0.96 0.04 1.49 -0.00 0.00 0.00 178.16 180.68 1yq2 h GLU 537 N 0.80 0.99 -0.37 4.88 4.57 -1.06 -2.28 114.58 122.11 1yq2 h GLU 537 Ca 0.14 -0.28 0.02 0.00 -1.18 0.00 0.00 59.36 58.07 1yq2 h GLU 537 Cb 0.56 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.03 1yq2 h GLU 537 CO 0.03 0.95 0.25 0.00 -1.18 0.00 0.00 179.01 179.05 1yq2 h ALA 538 N 1.12 1.83 -0.42 2.92 0.00 -0.77 -1.72 119.26 122.22 1yq2 h ALA 538 Ca 0.17 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 1yq2 h ALA 538 Cb 0.48 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1yq2 h ALA 538 CO 0.02 0.13 -0.27 -0.07 0.00 0.00 0.00 179.25 179.06 1yq2 h LEU 539 N 0.42 0.97 -1.07 0.00 3.38 -1.09 -2.25 115.31 115.66 1yq2 h LEU 539 Ca 0.15 -0.43 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1yq2 h LEU 539 Cb 0.07 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 1yq2 h LEU 539 CO -0.03 1.19 0.38 0.58 0.09 0.00 0.00 178.44 180.65 1yq2 h VAL 540 N 0.76 1.22 -0.74 1.22 2.07 -1.10 -0.65 116.25 119.03 1yq2 h VAL 540 Ca 0.09 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1yq2 h VAL 540 Cb 0.86 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1yq2 h VAL 540 CO 0.08 0.26 0.43 0.44 0.02 0.00 0.00 177.57 178.80 1yq2 h ASP 541 N 1.03 0.89 0.48 0.57 3.32 -1.10 -3.29 116.42 118.31 1yq2 h ASP 541 Ca 0.26 -0.05 -0.30 0.00 0.02 0.00 0.00 57.03 56.96 1yq2 h ASP 541 Cb 0.06 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 1yq2 h ASP 541 CO -0.04 0.69 -1.65 0.50 -1.72 0.00 0.00 179.24 177.01 1yq2 h LYS 542 N 1.02 0.08 -4.37 3.56 3.64 -0.78 -3.46 116.57 116.26 1yq2 h LYS 542 Ca 0.26 -0.13 -0.61 0.00 -1.27 0.00 0.00 60.65 58.90 1yq2 h LYS 542 Cb -0.03 0.05 -0.38 0.00 -0.41 0.00 0.00 32.23 31.46 1yq2 h LYS 542 CO -0.05 0.75 -0.79 0.71 -2.27 0.00 0.00 179.45 177.81 1yq2 s TYR 543 N -2.61 2.44 0.53 1.91 4.12 -0.32 -5.01 117.35 118.42 1yq2 s TYR 543 Ca -0.08 -1.79 0.30 0.00 0.02 0.00 0.00 57.07 55.52 1yq2 s TYR 543 Cb 0.08 -1.60 1.45 0.00 -1.52 0.00 0.00 41.96 40.37 1yq2 s TYR 543 CO 0.82 -0.78 1.91 -1.35 0.02 0.00 0.00 175.55 176.17 1yq2 h PRO 544 N 7.95 0.02 0.00 -1.71 0.11 -1.88 -1.35 132.00 135.14 1yq2 h PRO 544 Ca -0.18 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.92 1yq2 h PRO 544 Cb 1.07 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1yq2 h PRO 544 CO 0.41 0.01 -0.03 -0.09 -0.21 0.00 0.00 178.00 178.09 1yq2 h ARG 545 N 0.02 0.00 -5.60 1.05 2.43 -1.84 -3.42 114.38 107.01 1yq2 h ARG 545 Ca 0.40 0.00 -0.60 0.00 -0.81 0.00 0.00 59.98 58.97 1yq2 h ARG 545 Cb 1.56 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 31.01 1yq2 h ARG 545 CO -0.01 0.03 0.06 -0.51 -1.51 0.00 0.00 179.97 178.03 1yq2 s LEU 546 N -6.33 4.14 -0.21 3.80 1.43 -0.51 -1.37 118.68 119.62 1yq2 s LEU 546 Ca -0.00 0.76 0.15 0.00 -1.03 0.00 0.00 54.13 54.00 1yq2 s LEU 546 Cb 0.10 -2.81 0.53 0.00 0.03 0.00 0.00 46.19 44.04 1yq2 s LEU 546 CO 0.53 -0.24 1.45 1.41 0.23 0.00 0.00 176.35 179.73 1yq2 n HIS 547 N 4.99 1.04 -1.32 0.29 8.25 0.22 -4.78 115.22 123.90 1yq2 n HIS 547 Ca -0.03 -1.05 0.00 0.00 -0.26 0.00 0.00 57.72 56.38 1yq2 n HIS 547 Cb 0.50 -0.37 0.00 0.00 1.12 0.00 0.00 29.99 31.24 1yq2 n HIS 547 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1yq2 n GLY 548 N -0.65 0.26 3.68 -1.41 0.00 -1.26 -0.34 105.19 105.46 1yq2 n GLY 548 Ca 0.25 -1.51 0.04 0.00 0.00 0.00 0.00 46.02 44.79 1yq2 n GLY 548 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1yq2 s GLY 549 N 0.00 -0.42 -0.25 -0.02 0.00 -0.45 -1.63 107.32 104.55 1yq2 s GLY 549 Ca 0.00 0.72 -0.00 0.00 0.00 0.00 0.00 44.72 45.44 1yq2 s GLY 549 CO 0.00 1.71 -0.08 -1.36 0.00 0.00 0.00 173.10 173.37 1yq2 s PHE 550 N -2.08 3.11 0.33 1.90 0.40 -0.16 -0.94 117.98 120.54 1yq2 s PHE 550 Ca 0.19 -1.79 -0.29 0.00 -0.60 0.00 0.00 56.93 54.44 1yq2 s PHE 550 Cb 0.06 -2.02 -0.12 0.00 0.51 0.00 0.00 43.02 41.45 1yq2 s PHE 550 CO -0.05 -0.78 1.52 0.28 0.70 0.00 0.00 175.22 176.88 1yq2 n VAL 551 N 4.60 1.46 -3.40 -0.44 0.31 -0.05 -1.88 118.33 118.93 1yq2 n VAL 551 Ca -0.16 -0.36 -0.42 0.00 -0.01 0.00 0.00 64.34 63.38 1yq2 n VAL 551 Cb 0.46 -1.91 -0.09 0.00 -0.91 0.00 0.00 33.84 31.38 1yq2 n VAL 551 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 1yq2 s TRP 552 N -0.51 3.21 0.13 3.52 -0.11 -0.61 -1.28 118.94 123.29 1yq2 s TRP 552 Ca 0.60 -0.35 0.02 0.00 1.22 0.00 0.00 56.10 57.58 1yq2 s TRP 552 Cb -0.50 -2.71 -0.01 0.00 -1.50 0.00 0.00 33.47 28.75 1yq2 s TRP 552 CO 0.55 -0.58 0.13 -0.85 -4.62 0.00 0.00 176.95 171.58 1yq2 n GLU 553 N 5.37 0.19 0.03 5.86 0.28 -0.89 -0.28 120.64 131.20 1yq2 n GLU 553 Ca -0.09 -1.25 -0.12 0.00 -0.16 0.00 0.00 57.16 55.53 1yq2 n GLU 553 Cb 0.48 1.07 -0.09 0.00 1.43 0.00 0.00 31.44 34.33 1yq2 n GLU 553 CO 0.00 0.00 0.00 2.35 -0.16 0.00 0.00 177.13 179.32 1yq2 h TRP 554 N 1.41 -0.13 -4.07 -1.84 -0.00 -1.47 -0.35 115.95 109.50 1yq2 h TRP 554 Ca -0.09 -0.00 -0.41 0.00 -0.00 0.00 0.00 58.89 58.38 1yq2 h TRP 554 Cb 0.47 0.04 -0.28 0.00 -0.00 0.00 0.00 29.16 29.39 1yq2 h TRP 554 CO 0.00 0.34 -0.79 0.50 -0.00 0.00 0.00 178.44 178.49 1yq2 s ARG 555 N -3.91 0.82 0.51 2.65 3.52 -1.26 -0.88 118.95 120.40 1yq2 s ARG 555 Ca -0.15 -0.39 -0.23 0.00 -0.13 0.00 0.00 55.73 54.84 1yq2 s ARG 555 Cb 0.01 -0.79 -0.06 0.00 -1.56 0.00 0.00 34.95 32.55 1yq2 s ARG 555 CO 0.58 0.22 1.33 -0.51 -0.81 0.00 0.00 175.30 176.11 1yq2 s ASP 556 N -0.31 5.56 -0.71 -2.12 1.11 -0.34 -4.17 116.67 115.68 1yq2 s ASP 556 Ca 0.04 2.70 0.02 0.00 0.18 0.00 0.00 52.55 55.49 1yq2 s ASP 556 Cb -0.04 -2.63 0.36 0.00 1.07 0.00 0.00 42.92 41.67 1yq2 s ASP 556 CO -0.00 -1.37 1.45 1.41 1.18 0.00 0.00 175.17 177.84 1yq2 n HIS 557 N -0.76 3.34 -2.17 4.23 8.25 -0.81 -4.43 115.22 122.88 1yq2 n HIS 557 Ca 0.09 -3.04 -0.35 0.00 -0.26 0.00 0.00 57.72 54.16 1yq2 n HIS 557 Cb 0.45 -0.71 0.01 0.00 1.12 0.00 0.00 29.99 30.86 1yq2 n HIS 557 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1yq2 s GLY 558 N -2.44 2.58 -0.20 -1.41 0.00 -1.26 -4.90 107.32 99.68 1yq2 s GLY 558 Ca 0.47 0.80 -0.03 0.00 0.00 0.00 0.00 44.72 45.96 1yq2 s GLY 558 CO -0.22 1.16 -0.06 -0.42 0.00 0.00 0.00 173.10 173.57 1yq2 s ILE 559 N -1.83 3.31 0.07 0.90 -1.09 -0.63 -3.97 121.20 117.94 1yq2 s ILE 559 Ca 0.72 -0.52 -0.31 0.00 -2.23 0.00 0.00 60.65 58.31 1yq2 s ILE 559 Cb -0.24 -2.48 -0.07 0.00 -1.58 0.00 0.00 42.46 38.09 1yq2 s ILE 559 CO 0.29 0.44 1.42 -0.60 -1.23 0.00 0.00 174.94 175.27 1yq2 s ARG 560 N 1.28 4.30 0.06 2.79 3.52 -0.52 -0.06 118.95 130.31 1yq2 s ARG 560 Ca 0.03 2.06 -0.01 0.00 -0.13 0.00 0.00 55.73 57.68 1yq2 s ARG 560 Cb -0.14 -3.40 0.00 0.00 -1.56 0.00 0.00 34.95 29.85 1yq2 s ARG 560 CO -0.02 -0.52 0.09 -2.37 -0.81 0.00 0.00 175.30 171.67 1yq2 n THR 561 N 4.28 0.00 -4.12 4.11 5.66 -0.32 -4.92 114.28 118.97 1yq2 n THR 561 Ca 0.12 -0.23 -0.15 0.00 -3.05 0.00 0.00 64.05 60.74 1yq2 n THR 561 Cb 0.43 0.17 -0.13 0.00 -1.55 0.00 0.00 70.33 69.24 1yq2 n THR 561 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1yq2 s ARG 562 N -2.08 0.52 1.16 1.09 0.52 -1.26 -0.91 118.95 117.98 1yq2 s ARG 562 Ca 0.04 -0.55 -0.16 0.00 -0.52 0.00 0.00 55.73 54.53 1yq2 s ARG 562 Cb -0.00 -0.39 0.26 0.00 0.52 0.00 0.00 34.95 35.34 1yq2 s ARG 562 CO 0.03 0.09 1.07 0.95 0.02 0.00 0.00 175.30 177.46 1yq2 s THR 563 N -0.87 1.75 0.48 0.02 -4.23 0.60 -4.84 115.64 108.54 1yq2 s THR 563 Ca -0.05 0.00 0.34 0.00 -1.18 0.00 0.00 61.69 60.80 1yq2 s THR 563 Cb -0.07 -2.40 0.37 0.00 1.34 0.00 0.00 72.50 71.74 1yq2 s THR 563 CO 0.00 0.00 2.19 0.00 -0.54 0.00 0.00 174.62 176.27 1yq2 h ALA 564 N -2.46 1.20 -0.11 3.99 0.00 -2.02 -1.07 119.26 118.80 1yq2 h ALA 564 Ca -0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1yq2 h ALA 564 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1yq2 h ALA 564 CO 0.44 0.06 0.00 0.39 0.00 0.00 0.00 179.25 180.14 1yq2 n GLU 565 N -3.43 2.04 -0.41 0.00 4.71 -1.26 -4.96 120.64 117.32 1yq2 n GLU 565 Ca -0.02 -1.53 0.00 0.00 -0.01 0.00 0.00 57.16 55.60 1yq2 n GLU 565 Cb 0.17 -1.46 0.00 0.00 -1.01 0.00 0.00 31.44 29.13 1yq2 n GLU 565 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1yq2 n GLY 566 N 1.28 0.78 3.66 0.62 0.00 -0.41 -5.05 105.19 106.08 1yq2 n GLY 566 Ca 0.17 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1yq2 n GLY 566 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1yq2 s MET 567 N -0.65 4.26 0.20 1.61 0.00 -1.26 -4.71 119.30 118.75 1yq2 s MET 567 Ca 0.00 1.47 -0.30 0.00 0.00 0.00 0.00 55.69 56.86 1yq2 s MET 567 Cb 0.00 -3.67 -0.08 0.00 0.00 0.00 0.00 34.83 31.08 1yq2 s MET 567 CO 0.00 -0.63 1.06 -2.00 0.00 0.00 0.00 175.02 173.45 1yq2 s GLU 568 N 3.19 4.66 0.22 4.11 2.12 -1.26 -0.29 118.70 131.44 1yq2 s GLU 568 Ca 0.48 1.67 -0.13 0.00 0.36 0.00 0.00 54.97 57.35 1yq2 s GLU 568 Cb -0.18 -3.27 0.00 0.00 0.26 0.00 0.00 34.13 30.95 1yq2 s GLU 568 CO 0.10 0.19 0.45 -0.59 -0.54 0.00 0.00 175.26 174.87 1yq2 s PHE 569 N -0.54 0.25 -0.40 5.30 -0.12 -0.09 -4.97 117.98 117.41 1yq2 s PHE 569 Ca 0.47 -0.61 -0.20 0.00 -0.05 0.00 0.00 56.93 56.54 1yq2 s PHE 569 Cb -0.29 0.19 0.01 0.00 -0.63 0.00 0.00 43.02 42.31 1yq2 s PHE 569 CO 0.35 -0.92 0.61 -0.06 -0.05 0.00 0.00 175.22 175.14 1yq2 s PHE 570 N -3.97 3.11 0.39 3.49 0.40 -1.26 -1.17 117.98 118.97 1yq2 s PHE 570 Ca 0.18 0.08 -0.24 0.00 -0.60 0.00 0.00 56.93 56.35 1yq2 s PHE 570 Cb -0.00 -3.19 -0.09 0.00 0.51 0.00 0.00 43.02 40.25 1yq2 s PHE 570 CO 0.04 -0.73 1.05 0.00 0.70 0.00 0.00 175.22 176.28 1yq2 s ALA 571 N 2.67 3.10 0.07 5.36 0.00 0.91 -4.71 121.76 129.17 1yq2 s ALA 571 Ca 0.22 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.88 1yq2 s ALA 571 Cb -0.15 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 19.70 1yq2 s ALA 571 CO 0.17 -0.19 0.01 2.48 0.00 0.00 0.00 175.76 178.22 1yq2 n TYR 572 N -0.01 0.12 -1.62 0.00 0.18 -1.26 -1.61 117.16 112.96 1yq2 n TYR 572 Ca 0.05 -0.40 -0.46 0.00 1.88 0.00 0.00 57.90 58.97 1yq2 n TYR 572 Cb 0.49 -0.03 -0.03 0.00 -0.38 0.00 0.00 39.34 39.39 1yq2 n TYR 572 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1yq2 n GLY 573 N 3.15 0.31 1.85 -7.48 0.00 -0.44 -2.05 105.19 100.53 1yq2 n GLY 573 Ca -0.02 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1yq2 n GLY 573 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 574 N 1.92 3.10 0.05 -0.02 0.00 -1.26 -3.81 105.19 105.17 1yq2 n GLY 574 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 1yq2 n GLY 574 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yq2 n ASP 575 N 0.00 0.30 -1.42 1.61 8.00 -0.87 -2.67 116.55 121.51 1yq2 n ASP 575 Ca 0.00 0.56 -0.07 0.00 0.71 0.00 0.00 54.79 55.99 1yq2 n ASP 575 Cb 0.00 -0.63 0.21 0.00 -0.02 0.00 0.00 41.12 40.68 1yq2 n ASP 575 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1yq2 n PHE 576 N -1.82 1.59 -1.36 1.24 3.01 -1.26 -4.96 117.46 113.90 1yq2 n PHE 576 Ca 0.04 -1.52 -0.12 0.00 1.01 0.00 0.00 57.45 56.85 1yq2 n PHE 576 Cb 0.25 -0.58 -0.05 0.00 -0.01 0.00 0.00 39.48 39.09 1yq2 n PHE 576 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1yq2 n GLY 577 N -0.97 1.33 3.71 1.37 0.00 -1.09 -4.96 105.19 104.59 1yq2 n GLY 577 Ca 0.38 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1yq2 n GLY 577 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yq2 n GLU 578 N -2.53 1.90 0.01 1.61 4.71 -1.26 -4.95 120.64 120.13 1yq2 n GLU 578 Ca -0.12 0.68 -0.12 0.00 -0.01 0.00 0.00 57.16 57.58 1yq2 n GLU 578 Cb 0.42 -2.44 -0.09 0.00 -1.01 0.00 0.00 31.44 28.32 1yq2 n GLU 578 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1yq2 h VAL 579 N 1.94 1.20 -4.19 2.62 2.07 -1.98 -3.44 116.25 114.48 1yq2 h VAL 579 Ca -0.49 -1.27 -0.69 0.00 0.82 0.00 0.00 66.70 65.07 1yq2 h VAL 579 Cb 1.30 1.99 -0.25 0.00 -1.52 0.00 0.00 31.29 32.81 1yq2 h VAL 579 CO 0.59 0.30 -0.83 0.68 0.02 0.00 0.00 177.57 178.33 1yq2 s VAL 580 N -3.69 2.57 0.16 2.57 -7.23 -1.26 -5.13 120.40 108.39 1yq2 s VAL 580 Ca -0.15 -1.10 -0.24 0.00 -1.81 0.00 0.00 61.98 58.68 1yq2 s VAL 580 Cb 0.01 -2.01 0.06 0.00 0.56 0.00 0.00 36.38 34.99 1yq2 s VAL 580 CO 0.59 0.45 0.84 -1.38 -0.31 0.00 0.00 175.10 175.30 1yq2 s HIS 581 N -0.79 -0.23 -0.24 2.82 -0.00 -1.26 -4.76 115.29 110.84 1yq2 s HIS 581 Ca 0.12 -0.08 0.10 0.00 -0.00 0.00 0.00 55.06 55.20 1yq2 s HIS 581 Cb -0.10 0.63 0.44 0.00 -0.00 0.00 0.00 32.58 33.55 1yq2 s HIS 581 CO 0.02 -0.90 1.23 -0.25 -0.00 0.00 0.00 174.74 174.84 1yq2 n ASP 582 N -0.42 2.70 0.00 7.38 8.00 -0.99 -4.94 116.55 128.28 1yq2 n ASP 582 Ca -0.07 -3.86 0.00 0.00 0.71 0.00 0.00 54.79 51.57 1yq2 n ASP 582 Cb 0.61 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 1yq2 n ASP 582 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1yq2 n SER 583 N -1.00 0.00 -0.40 -2.24 2.88 -1.25 -2.14 113.62 109.46 1yq2 n SER 583 Ca 0.27 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.84 1yq2 n SER 583 Cb 0.79 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.33 1yq2 n SER 583 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1yq2 n ASN 584 N 2.07 1.13 0.13 -3.46 2.04 -1.26 -1.33 115.26 114.57 1yq2 n ASN 584 Ca 0.00 -2.03 0.10 0.00 -0.44 0.00 0.00 54.58 52.21 1yq2 n ASN 584 Cb 0.00 -0.18 0.48 0.00 -2.53 0.00 0.00 39.78 37.55 1yq2 n ASN 584 CO 0.00 0.00 0.00 0.49 -0.44 0.00 0.00 177.26 177.31 1yq2 n PHE 585 N 0.04 0.65 1.10 -2.53 3.01 -0.91 -0.87 117.46 117.95 1yq2 n PHE 585 Ca 0.06 0.30 0.14 0.00 1.01 0.00 0.00 57.45 58.96 1yq2 n PHE 585 Cb 0.20 -0.98 0.64 0.00 -0.01 0.00 0.00 39.48 39.32 1yq2 n PHE 585 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1yq2 n VAL 586 N -2.14 0.09 -3.17 -4.37 3.14 -1.25 -4.14 118.33 106.50 1yq2 n VAL 586 Ca 0.00 0.02 -0.38 0.00 -2.96 0.00 0.00 64.34 61.02 1yq2 n VAL 586 Cb 0.11 -0.55 -0.02 0.00 -1.06 0.00 0.00 33.84 32.32 1yq2 n VAL 586 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 1yq2 n MET 587 N -1.42 3.83 -1.06 1.45 2.81 -0.05 -1.92 117.12 120.76 1yq2 n MET 587 Ca 0.09 -4.58 0.03 0.00 -1.81 0.00 0.00 57.70 51.43 1yq2 n MET 587 Cb 0.29 -2.44 0.13 0.00 -0.71 0.00 0.00 33.22 30.49 1yq2 n MET 587 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1yq2 n ASP 588 N 1.31 1.75 -4.96 7.83 5.68 -1.26 -4.20 116.55 122.70 1yq2 n ASP 588 Ca 0.27 -3.28 -0.22 0.00 -0.50 0.00 0.00 54.79 51.06 1yq2 n ASP 588 Cb 0.36 -0.45 -0.00 0.00 -1.14 0.00 0.00 41.12 39.88 1yq2 n ASP 588 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1yq2 s GLY 589 N -2.93 1.44 0.51 6.12 0.00 -1.26 -2.08 107.32 109.11 1yq2 s GLY 589 Ca 0.37 -1.14 0.29 0.00 0.00 0.00 0.00 44.72 44.24 1yq2 s GLY 589 CO -0.09 -1.06 1.84 -0.33 0.00 0.00 0.00 173.10 173.46 1yq2 h MET 590 N 0.76 0.00 -5.52 2.90 2.86 0.65 -3.43 114.93 113.15 1yq2 h MET 590 Ca -0.48 0.00 -0.59 0.00 -2.06 0.00 0.00 59.70 56.57 1yq2 h MET 590 Cb 1.24 0.00 -0.31 0.00 0.06 0.00 0.00 31.60 32.59 1yq2 h MET 590 CO 0.58 0.00 -0.85 0.08 1.06 0.00 0.00 176.91 177.79 1yq2 s VAL 591 N -3.49 1.55 0.84 -2.22 1.01 -0.06 -1.78 120.40 116.25 1yq2 s VAL 591 Ca 0.03 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 1yq2 s VAL 591 Cb 0.07 -1.32 0.09 0.00 0.00 0.00 0.00 36.38 35.22 1yq2 s VAL 591 CO 0.59 0.44 1.12 -0.76 0.00 0.00 0.00 175.10 176.50 1yq2 s LEU 592 N -0.08 2.38 0.62 3.92 1.43 -0.31 -1.20 118.68 125.44 1yq2 s LEU 592 Ca -0.02 1.12 0.38 0.00 -1.03 0.00 0.00 54.13 54.58 1yq2 s LEU 592 Cb -0.11 -3.63 2.09 0.00 0.03 0.00 0.00 46.19 44.57 1yq2 s LEU 592 CO 0.02 -2.15 2.29 0.28 0.23 0.00 0.00 176.35 177.02 1yq2 h SER 593 N -1.22 0.00 -0.46 2.29 0.02 -1.90 0.16 113.55 112.44 1yq2 h SER 593 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1yq2 h SER 593 Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 1yq2 h SER 593 CO 0.61 0.01 0.00 -0.90 -1.14 0.00 0.00 176.83 175.41 1yq2 n ASP 594 N -3.39 3.35 -0.12 3.07 3.85 -1.26 -4.79 116.55 117.26 1yq2 n ASP 594 Ca -0.03 -2.26 -0.02 0.00 -0.71 0.00 0.00 54.79 51.78 1yq2 n ASP 594 Cb 0.10 -0.46 -0.01 0.00 -1.35 0.00 0.00 41.12 39.41 1yq2 n ASP 594 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1yq2 n SER 595 N 0.76 -3.51 -4.69 -1.12 7.64 0.04 -5.03 113.62 107.71 1yq2 n SER 595 Ca 0.18 0.04 -0.42 0.00 1.01 0.00 0.00 58.87 59.67 1yq2 n SER 595 Cb 0.62 -1.15 -0.03 0.00 -1.01 0.00 0.00 64.21 62.65 1yq2 n SER 595 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1yq2 s THR 596 N -1.95 4.39 0.22 0.44 2.01 -1.25 -4.78 115.64 114.72 1yq2 s THR 596 Ca 0.00 1.70 -0.30 0.00 0.31 0.00 0.00 61.69 63.40 1yq2 s THR 596 Cb 0.00 -4.09 -0.10 0.00 0.01 0.00 0.00 72.50 68.32 1yq2 s THR 596 CO 0.00 -0.01 1.41 -2.84 -0.69 0.00 0.00 174.62 172.49 1yq2 s PRO 597 N 2.24 4.30 0.62 4.92 0.02 -1.26 -1.16 135.00 144.68 1yq2 s PRO 597 Ca 0.54 2.22 -0.07 0.00 0.02 0.00 0.00 61.00 63.70 1yq2 s PRO 597 Cb -0.23 -3.14 0.01 0.00 0.02 0.00 0.00 34.50 31.16 1yq2 s PRO 597 CO 0.20 -0.38 0.95 0.95 -0.33 0.00 0.00 177.00 178.40 1yq2 s THR 598 N 0.14 3.65 0.56 0.99 -4.23 -0.74 -4.93 115.64 111.09 1yq2 s THR 598 Ca 0.59 0.15 0.25 0.00 -1.18 0.00 0.00 61.69 61.50 1yq2 s THR 598 Cb -0.40 -3.48 0.33 0.00 1.34 0.00 0.00 72.50 70.30 1yq2 s THR 598 CO 0.40 -0.53 2.16 -0.65 -0.54 0.00 0.00 174.62 175.46 1yq2 h PRO 599 N -0.30 0.00 -0.01 3.99 0.11 -1.94 -1.20 132.00 132.65 1yq2 h PRO 599 Ca -0.45 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 1yq2 h PRO 599 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1yq2 h PRO 599 CO 0.62 0.00 -0.30 0.78 -0.21 0.00 0.00 178.00 178.88 1yq2 h GLY 600 N 0.00 0.01 1.30 -0.55 0.00 -1.90 -1.74 103.07 100.18 1yq2 h GLY 600 Ca 0.05 -0.01 -0.19 0.00 0.00 0.00 0.00 47.33 47.18 1yq2 h GLY 600 CO -0.00 0.01 -0.63 -2.00 0.00 0.00 0.00 176.54 173.91 1yq2 h LEU 601 N 0.01 0.82 -1.11 3.11 5.85 -1.45 -0.67 115.31 121.86 1yq2 h LEU 601 Ca -0.00 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.20 1yq2 h LEU 601 Cb 0.54 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1yq2 h LEU 601 CO 0.04 1.25 0.16 1.88 -0.34 0.00 0.00 178.44 181.42 1yq2 h TYR 602 N 0.53 0.80 -0.16 1.25 -1.99 -1.36 -0.12 116.97 115.91 1yq2 h TYR 602 Ca -0.01 -0.06 -0.02 0.00 2.00 0.00 0.00 58.73 60.64 1yq2 h TYR 602 Cb 1.23 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 39.71 1yq2 h TYR 602 CO 0.07 0.66 0.02 1.49 -0.00 0.00 0.00 178.16 180.39 1yq2 h GLU 603 N 0.77 0.27 -0.13 4.88 4.57 -1.15 -2.20 114.58 121.59 1yq2 h GLU 603 Ca 0.18 -0.08 0.05 0.00 -1.18 0.00 0.00 59.36 58.32 1yq2 h GLU 603 Cb 0.24 -0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.74 1yq2 h GLU 603 CO -0.01 0.46 -0.26 0.35 -1.18 0.00 0.00 179.01 178.38 1yq2 h PHE 604 N 0.04 -0.70 -0.63 0.92 3.57 -1.01 -1.55 116.94 117.58 1yq2 h PHE 604 Ca 0.05 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.69 1yq2 h PHE 604 Cb 0.33 0.33 -0.08 0.00 2.79 0.00 0.00 35.95 39.32 1yq2 h PHE 604 CO 0.02 -0.34 0.21 -0.22 -2.23 0.00 0.00 178.31 175.75 1yq2 h LYS 605 N -0.33 0.35 -0.31 1.11 3.64 -0.92 -0.98 116.57 119.14 1yq2 h LYS 605 Ca 0.10 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1yq2 h LYS 605 Cb 0.48 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1yq2 h LYS 605 CO -0.32 0.23 0.05 0.37 -2.27 0.00 0.00 179.45 177.52 1yq2 h GLN 606 N 0.37 0.52 -0.35 1.90 5.75 -1.18 -2.72 115.11 119.39 1yq2 h GLN 606 Ca 0.33 -0.14 -0.07 0.00 -0.15 0.00 0.00 58.65 58.62 1yq2 h GLN 606 Cb 0.45 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.93 1yq2 h GLN 606 CO -0.36 0.62 -0.08 0.82 -2.65 0.00 0.00 178.83 177.18 1yq2 h ILE 607 N 0.35 1.23 -0.66 2.39 2.04 -0.41 -2.99 117.51 119.46 1yq2 h ILE 607 Ca 0.09 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.96 1yq2 h ILE 607 Cb 0.35 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1yq2 h ILE 607 CO 0.01 0.33 0.00 1.33 0.00 0.00 0.00 178.15 179.82 1yq2 n VAL 608 N -4.21 1.16 -1.66 1.67 0.24 -0.45 -4.99 118.33 110.09 1yq2 n VAL 608 Ca 0.01 -0.97 -0.45 0.00 -2.04 0.00 0.00 64.34 60.89 1yq2 n VAL 608 Cb 0.31 0.34 -0.03 0.00 -1.47 0.00 0.00 33.84 32.99 1yq2 n VAL 608 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1yq2 n SER 609 N 1.35 2.60 0.26 -1.34 2.88 -1.03 -4.86 113.62 113.49 1yq2 n SER 609 Ca 0.23 1.14 0.17 0.00 -1.33 0.00 0.00 58.87 59.08 1yq2 n SER 609 Cb 0.66 -1.40 0.73 0.00 -0.75 0.00 0.00 64.21 63.45 1yq2 n SER 609 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1yq2 h PRO 610 N 4.26 0.00 -4.64 -1.46 0.13 -1.90 -3.38 132.00 125.00 1yq2 h PRO 610 Ca -0.45 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 63.99 1yq2 h PRO 610 Cb 1.28 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.09 1yq2 h PRO 610 CO 0.76 0.00 -0.62 0.42 -0.23 0.00 0.00 178.00 178.33 1yq2 s ILE 611 N -3.68 3.29 -0.13 -3.56 -1.09 -1.26 -0.23 121.20 114.54 1yq2 s ILE 611 Ca 0.01 -1.56 -0.22 0.00 -2.23 0.00 0.00 60.65 56.64 1yq2 s ILE 611 Cb 0.09 -3.02 -0.03 0.00 -1.58 0.00 0.00 42.46 37.93 1yq2 s ILE 611 CO 0.50 -0.33 0.67 -0.60 -1.23 0.00 0.00 174.94 173.95 1yq2 s ARG 612 N 1.25 4.33 -0.05 2.79 6.06 -0.01 -4.87 118.95 128.45 1yq2 s ARG 612 Ca 0.00 0.77 0.04 0.00 -2.50 0.00 0.00 55.73 54.05 1yq2 s ARG 612 Cb -0.21 -3.51 -0.02 0.00 0.06 0.00 0.00 34.95 31.27 1yq2 s ARG 612 CO -0.01 -0.08 -0.17 -0.51 -2.50 0.00 0.00 175.30 172.03 1yq2 s LEU 613 N 1.34 2.56 0.03 -0.88 1.43 -1.26 -0.74 118.68 121.16 1yq2 s LEU 613 Ca 0.34 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.18 1yq2 s LEU 613 Cb -0.17 -1.51 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 1yq2 s LEU 613 CO 0.14 0.32 -0.08 -0.83 0.23 0.00 0.00 176.35 176.13 1yq2 s GLY 614 N -0.58 0.47 -0.00 -3.19 0.00 -0.17 -4.84 107.32 99.01 1yq2 s GLY 614 Ca 0.08 -0.66 0.05 0.00 0.00 0.00 0.00 44.72 44.19 1yq2 s GLY 614 CO 0.01 -0.70 -0.15 1.08 0.00 0.00 0.00 173.10 173.34 1yq2 s LEU 615 N -1.28 2.06 0.13 0.66 1.43 -1.26 -0.39 118.68 120.02 1yq2 s LEU 615 Ca -0.07 -0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 52.60 1yq2 s LEU 615 Cb -0.08 -0.76 0.01 0.00 0.03 0.00 0.00 46.19 45.38 1yq2 s LEU 615 CO 0.00 0.16 0.31 -0.94 0.23 0.00 0.00 176.35 176.11 1yq2 s SER 616 N -0.52 -0.04 -0.33 2.29 1.04 -0.84 -4.96 113.70 110.34 1yq2 s SER 616 Ca 0.05 -0.58 0.03 0.00 0.48 0.00 0.00 55.95 55.93 1yq2 s SER 616 Cb -0.06 0.42 0.09 0.00 0.10 0.00 0.00 66.02 66.57 1yq2 s SER 616 CO -0.00 -0.83 0.03 -0.22 0.98 0.00 0.00 173.24 173.20 1yq2 s LEU 617 N -2.87 4.54 0.32 2.42 2.96 -1.26 -1.02 118.68 123.77 1yq2 s LEU 617 Ca 0.07 -1.97 -0.29 0.00 -0.22 0.00 0.00 54.13 51.72 1yq2 s LEU 617 Cb 0.03 -1.64 -0.11 0.00 0.50 0.00 0.00 46.19 44.98 1yq2 s LEU 617 CO -0.08 -0.36 1.42 -2.16 -1.32 0.00 0.00 176.35 173.85 1yq2 s PRO 618 N 0.97 4.24 -0.27 0.98 0.04 -1.26 -4.89 135.00 134.82 1yq2 s PRO 618 Ca 0.06 2.38 -0.36 0.00 0.04 0.00 0.00 61.00 63.12 1yq2 s PRO 618 Cb -0.20 -3.05 -0.12 0.00 0.04 0.00 0.00 34.50 31.18 1yq2 s PRO 618 CO -0.07 -0.39 2.01 0.00 0.04 0.00 0.00 177.00 178.59 1yq2 n ALA 619 N 1.22 0.74 -0.20 8.56 0.00 -1.26 0.43 120.51 130.00 1yq2 n ALA 619 Ca 0.03 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1yq2 n ALA 619 Cb 0.40 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.39 1yq2 n ALA 619 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 620 N 5.46 1.95 0.00 0.00 0.00 -1.26 -5.02 105.19 106.32 1yq2 n GLY 620 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1yq2 n GLY 620 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 621 N -2.00 0.81 3.87 -0.02 0.00 0.17 -5.13 105.19 102.89 1yq2 n GLY 621 Ca 0.00 -1.96 -0.21 0.00 0.00 0.00 0.00 46.02 43.85 1yq2 n GLY 621 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yq2 s LYS 622 N -2.34 2.70 0.22 1.61 -2.85 -1.26 -4.79 119.74 113.03 1yq2 s LYS 622 Ca 0.00 -1.34 -0.32 0.00 -1.00 0.00 0.00 55.97 53.31 1yq2 s LYS 622 Cb 0.00 -2.48 -0.12 0.00 -2.06 0.00 0.00 37.83 33.17 1yq2 s LYS 622 CO 0.00 0.00 1.71 -2.14 0.10 0.00 0.00 175.35 175.02 1yq2 s PRO 623 N -4.06 4.12 -0.18 1.78 0.02 -1.26 -4.24 135.00 131.18 1yq2 s PRO 623 Ca 0.44 2.62 -0.04 0.00 0.02 0.00 0.00 61.00 64.04 1yq2 s PRO 623 Cb -0.05 -3.06 -0.02 0.00 0.02 0.00 0.00 34.50 31.38 1yq2 s PRO 623 CO 0.27 -0.74 -0.04 0.99 -0.33 0.00 0.00 177.00 177.15 1yq2 s THR 624 N 1.02 3.71 -0.27 0.99 2.01 -0.19 -0.17 115.64 122.74 1yq2 s THR 624 Ca 0.73 -0.41 -0.10 0.00 0.31 0.00 0.00 61.69 62.23 1yq2 s THR 624 Cb -0.50 -2.65 -0.04 0.00 0.01 0.00 0.00 72.50 69.33 1yq2 s THR 624 CO 0.34 0.46 0.15 -0.22 -0.69 0.00 0.00 174.62 174.67 1yq2 s LEU 625 N 0.75 3.85 -0.17 4.42 2.96 0.64 -2.00 118.68 129.13 1yq2 s LEU 625 Ca -0.02 -0.12 -0.16 0.00 -0.22 0.00 0.00 54.13 53.61 1yq2 s LEU 625 Cb -0.15 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 1yq2 s LEU 625 CO 0.02 -0.06 0.39 0.00 -1.32 0.00 0.00 176.35 175.37 1yq2 s ALA 626 N 1.70 3.55 -0.08 5.97 0.00 0.48 -0.28 121.76 133.09 1yq2 s ALA 626 Ca 0.07 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.64 1yq2 s ALA 626 Cb -0.16 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1yq2 s ALA 626 CO 0.08 -0.11 -0.19 0.08 0.00 0.00 0.00 175.76 175.62 1yq2 s VAL 627 N 0.90 1.62 -0.11 0.00 1.01 0.39 -1.00 120.40 123.21 1yq2 s VAL 627 Ca 0.20 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.42 1yq2 s VAL 627 Cb -0.14 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 34.83 1yq2 s VAL 627 CO 0.07 0.46 -0.14 0.00 0.00 0.00 0.00 175.10 175.49 1yq2 s ALA 628 N 0.40 1.66 -0.54 5.51 0.00 0.08 -0.32 121.76 128.55 1yq2 s ALA 628 Ca -0.15 -0.72 -0.24 0.00 0.00 0.00 0.00 51.96 50.86 1yq2 s ALA 628 Cb -0.16 -0.84 0.04 0.00 0.00 0.00 0.00 23.12 22.16 1yq2 s ALA 628 CO 0.06 -0.11 0.92 1.21 0.00 0.00 0.00 175.76 177.84 1yq2 s ASN 629 N 1.05 6.35 -0.03 0.00 3.84 -0.18 -0.83 114.94 125.14 1yq2 s ASN 629 Ca -0.05 -0.34 0.15 0.00 0.21 0.00 0.00 52.86 52.82 1yq2 s ASN 629 Cb -0.15 -2.43 0.47 0.00 -0.55 0.00 0.00 41.25 38.60 1yq2 s ASN 629 CO -0.02 -1.19 1.37 0.18 -2.79 0.00 0.00 177.10 174.65 1yq2 n LEU 630 N 7.36 3.01 -4.70 3.21 4.77 0.68 -0.41 117.00 130.92 1yq2 n LEU 630 Ca 0.02 -1.51 -0.30 0.00 -0.03 0.00 0.00 56.01 54.19 1yq2 n LEU 630 Cb 0.47 -0.39 0.15 0.00 -2.33 0.00 0.00 43.42 41.32 1yq2 n LEU 630 CO 0.63 0.65 0.66 -0.13 -1.33 0.00 0.00 177.39 177.87 1yq2 s ARG 631 N -1.48 1.09 -0.03 3.23 0.52 -1.24 -4.85 118.95 116.19 1yq2 s ARG 631 Ca 0.35 0.89 -0.18 0.00 -0.52 0.00 0.00 55.73 56.27 1yq2 s ARG 631 Cb 0.20 -1.78 -0.32 0.00 0.52 0.00 0.00 34.95 33.56 1yq2 s ARG 631 CO 0.21 -2.38 0.84 1.25 0.02 0.00 0.00 175.30 175.25 1yq2 h HIS 632 N -1.65 0.69 0.00 -0.53 -0.00 -1.93 -3.35 115.15 108.37 1yq2 h HIS 632 Ca -0.50 -0.50 0.00 0.00 -0.00 0.00 0.00 60.37 59.37 1yq2 h HIS 632 Cb 1.28 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.67 1yq2 h HIS 632 CO 0.42 1.48 -0.37 -2.37 -0.00 0.00 0.00 177.93 177.09 1yq2 n THR 633 N -3.90 0.00 -2.34 6.26 5.66 -1.26 -4.93 114.28 113.76 1yq2 n THR 633 Ca -0.18 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.41 1yq2 n THR 633 Cb 0.96 -0.20 -0.03 0.00 -1.55 0.00 0.00 70.33 69.50 1yq2 n THR 633 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yq2 s ALA 634 N -1.39 3.45 0.99 1.79 0.00 -1.26 -4.39 121.76 120.96 1yq2 s ALA 634 Ca 0.00 1.00 -0.16 0.00 0.00 0.00 0.00 51.96 52.80 1yq2 s ALA 634 Cb 0.00 -3.41 0.20 0.00 0.00 0.00 0.00 23.12 19.91 1yq2 s ALA 634 CO 0.00 -0.37 1.25 0.16 0.00 0.00 0.00 175.76 176.80 1yq2 s ASP 635 N -0.23 2.85 -0.21 0.00 1.47 -1.26 -3.71 116.67 115.58 1yq2 s ASP 635 Ca 0.50 0.44 0.08 0.00 1.18 0.00 0.00 52.55 54.76 1yq2 s ASP 635 Cb -0.34 -0.61 0.57 0.00 -0.34 0.00 0.00 42.92 42.20 1yq2 s ASP 635 CO 0.41 -2.92 1.47 0.00 0.68 0.00 0.00 175.17 174.81 1yq2 n ALA 636 N -3.92 3.81 0.28 2.11 0.00 0.84 -4.45 120.51 119.18 1yq2 n ALA 636 Ca 0.13 -1.56 0.18 0.00 0.00 0.00 0.00 53.44 52.19 1yq2 n ALA 636 Cb 0.60 -1.15 0.75 0.00 0.00 0.00 0.00 19.45 19.65 1yq2 n ALA 636 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1yq2 h SER 637 N 2.35 0.00 0.08 0.00 4.64 -1.83 -1.95 113.55 116.83 1yq2 h SER 637 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1yq2 h SER 637 Cb 1.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.86 1yq2 h SER 637 CO 0.47 0.02 -0.02 -0.90 -0.87 0.00 0.00 176.83 175.53 1yq2 n ASP 638 N -3.13 0.47 -4.48 4.97 5.75 -1.26 -4.87 116.55 114.01 1yq2 n ASP 638 Ca -0.00 -1.03 -0.33 0.00 -0.01 0.00 0.00 54.79 53.42 1yq2 n ASP 638 Cb 0.28 -0.02 -0.13 0.00 -1.03 0.00 0.00 41.12 40.21 1yq2 n ASP 638 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1yq2 s VAL 639 N -2.10 3.09 0.06 2.12 1.01 -0.73 -1.20 120.40 122.65 1yq2 s VAL 639 Ca 0.42 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 61.77 1yq2 s VAL 639 Cb 0.21 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 1yq2 s VAL 639 CO 0.38 0.59 -0.24 0.54 0.00 0.00 0.00 175.10 176.37 1yq2 s VAL 640 N -0.71 1.95 -0.37 2.92 0.11 -0.03 -4.22 120.40 120.04 1yq2 s VAL 640 Ca 0.11 -1.37 -0.12 0.00 -2.93 0.00 0.00 61.98 57.67 1yq2 s VAL 640 Cb -0.11 -1.69 0.02 0.00 -1.53 0.00 0.00 36.38 33.07 1yq2 s VAL 640 CO 0.01 0.25 0.23 -0.76 -3.33 0.00 0.00 175.10 171.49 1yq2 s LEU 641 N -1.36 4.74 -0.21 2.54 1.43 -0.01 -1.11 118.68 124.71 1yq2 s LEU 641 Ca 0.10 -0.88 -0.10 0.00 -1.03 0.00 0.00 54.13 52.23 1yq2 s LEU 641 Cb -0.10 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.01 1yq2 s LEU 641 CO 0.03 -0.37 0.13 -0.13 0.23 0.00 0.00 176.35 176.24 1yq2 s ARG 642 N 1.61 4.17 0.11 1.70 0.52 -0.19 -0.20 118.95 126.66 1yq2 s ARG 642 Ca 0.03 -0.23 0.09 0.00 -0.52 0.00 0.00 55.73 55.10 1yq2 s ARG 642 Cb -0.19 -3.43 -0.04 0.00 0.52 0.00 0.00 34.95 31.81 1yq2 s ARG 642 CO 0.08 0.27 -0.20 1.67 0.02 0.00 0.00 175.30 177.13 1yq2 s TRP 643 N 0.46 2.49 -0.01 -0.53 1.48 -0.07 -0.45 118.94 122.31 1yq2 s TRP 643 Ca 0.08 -0.29 -0.06 0.00 -1.06 0.00 0.00 56.10 54.77 1yq2 s TRP 643 Cb -0.11 -1.34 0.00 0.00 -1.16 0.00 0.00 33.47 30.86 1yq2 s TRP 643 CO -0.01 0.36 0.13 -0.98 -4.06 0.00 0.00 176.95 172.39 1yq2 s ARG 644 N -2.06 0.42 -0.11 3.25 1.70 -0.36 -1.28 118.95 120.51 1yq2 s ARG 644 Ca 0.17 -0.31 0.03 0.00 -0.47 0.00 0.00 55.73 55.15 1yq2 s ARG 644 Cb -0.10 0.17 -0.01 0.00 -0.57 0.00 0.00 34.95 34.44 1yq2 s ARG 644 CO 0.09 -0.09 -0.20 0.08 -1.08 0.00 0.00 175.30 174.10 1yq2 s VAL 645 N -1.13 2.47 -0.04 4.99 1.01 -0.05 -1.17 120.40 126.48 1yq2 s VAL 645 Ca -0.12 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.05 1yq2 s VAL 645 Cb -0.07 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 1yq2 s VAL 645 CO 0.01 0.55 -0.25 -1.61 0.00 0.00 0.00 175.10 173.80 1yq2 s GLU 646 N 0.28 2.33 -0.34 2.72 2.02 -0.08 0.00 118.70 125.63 1yq2 s GLU 646 Ca -0.14 -0.91 -0.10 0.00 0.02 0.00 0.00 54.97 53.84 1yq2 s GLU 646 Cb -0.17 -2.09 0.01 0.00 0.10 0.00 0.00 34.13 31.99 1yq2 s GLU 646 CO 0.07 0.46 0.17 -1.58 0.02 0.00 0.00 175.26 174.41 1yq2 s HIS 647 N -0.37 3.21 -1.69 1.61 5.65 0.17 -1.19 115.29 122.68 1yq2 s HIS 647 Ca 0.03 -0.84 -0.18 0.00 0.25 0.00 0.00 55.06 54.32 1yq2 s HIS 647 Cb -0.12 -2.39 0.15 0.00 -1.18 0.00 0.00 32.58 29.04 1yq2 s HIS 647 CO 0.01 -0.58 0.81 -0.25 -0.65 0.00 0.00 174.74 174.09 1yq2 n ASP 648 N 4.97 -3.50 0.00 9.88 10.43 0.22 -1.46 116.55 137.09 1yq2 n ASP 648 Ca -0.13 -0.99 0.00 0.00 2.57 0.00 0.00 54.79 56.25 1yq2 n ASP 648 Cb 0.47 -2.88 0.00 0.00 1.84 0.00 0.00 41.12 40.55 1yq2 n ASP 648 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1yq2 n GLY 649 N -1.42 1.89 3.71 0.44 0.00 -1.26 -4.77 105.19 103.77 1yq2 n GLY 649 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1yq2 n GLY 649 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 650 N -2.33 3.50 -0.13 4.61 0.00 -0.54 -4.61 121.76 122.26 1yq2 s ALA 650 Ca 0.00 -0.26 -0.29 0.00 0.00 0.00 0.00 51.96 51.41 1yq2 s ALA 650 Cb 0.00 -2.64 -0.05 0.00 0.00 0.00 0.00 23.12 20.44 1yq2 s ALA 650 CO 0.00 -0.05 1.73 0.08 0.00 0.00 0.00 175.76 177.52 1yq2 s VAL 651 N 0.75 3.51 -0.02 0.00 1.01 -1.26 -0.66 120.40 123.73 1yq2 s VAL 651 Ca 0.24 0.59 0.07 0.00 0.00 0.00 0.00 61.98 62.88 1yq2 s VAL 651 Cb -0.15 -3.46 -0.24 0.00 0.00 0.00 0.00 36.38 32.53 1yq2 s VAL 651 CO 0.09 -0.14 0.76 0.00 0.00 0.00 0.00 175.10 175.81 1yq2 h ALA 652 N 10.68 0.58 -1.82 5.51 0.00 -0.77 -3.47 119.26 129.97 1yq2 h ALA 652 Ca -0.38 -1.31 0.00 0.00 0.00 0.00 0.00 54.91 53.21 1yq2 h ALA 652 Cb 1.18 0.38 -0.21 0.00 0.00 0.00 0.00 17.79 19.14 1yq2 h ALA 652 CO 0.97 1.43 0.33 0.00 0.00 0.00 0.00 179.25 181.98 1yq2 s ALA 653 N -2.61 -1.84 0.23 0.00 0.00 -1.17 -5.01 121.76 111.35 1yq2 s ALA 653 Ca -0.07 1.52 -0.13 0.00 0.00 0.00 0.00 51.96 53.28 1yq2 s ALA 653 Cb 0.08 -0.46 0.00 0.00 0.00 0.00 0.00 23.12 22.74 1yq2 s ALA 653 CO 0.82 -0.34 0.47 -1.54 0.00 0.00 0.00 175.76 175.17 1yq2 s SER 654 N -0.92 -0.11 0.00 0.00 1.04 -1.26 -0.87 113.70 111.58 1yq2 s SER 654 Ca -0.06 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.54 1yq2 s SER 654 Cb -0.01 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1yq2 s SER 654 CO 0.05 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.78 1yq2 n GLY 655 N -0.35 -1.21 3.11 7.32 0.00 -0.40 -4.99 105.19 108.67 1yq2 n GLY 655 Ca -0.04 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 45.06 1yq2 n GLY 655 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yq2 s GLU 656 N -0.04 0.31 0.06 1.61 2.02 -1.26 -0.89 118.70 120.51 1yq2 s GLU 656 Ca 0.00 0.19 0.04 0.00 0.02 0.00 0.00 54.97 55.22 1yq2 s GLU 656 Cb 0.00 0.15 -0.03 0.00 0.10 0.00 0.00 34.13 34.35 1yq2 s GLU 656 CO 0.00 -0.05 -0.12 0.08 0.02 0.00 0.00 175.26 175.19 1yq2 s VAL 657 N -0.17 0.94 0.41 2.63 1.01 0.72 -4.99 120.40 120.96 1yq2 s VAL 657 Ca -0.03 -1.20 -0.20 0.00 0.00 0.00 0.00 61.98 60.56 1yq2 s VAL 657 Cb -0.03 -0.92 -0.11 0.00 0.00 0.00 0.00 36.38 35.32 1yq2 s VAL 657 CO 0.01 -0.24 0.91 0.00 0.00 0.00 0.00 175.10 175.77 1yq2 s ALA 658 N -1.25 3.10 -0.87 5.51 0.00 -1.26 -0.83 121.76 126.16 1yq2 s ALA 658 Ca -0.04 0.32 -0.19 0.00 0.00 0.00 0.00 51.96 52.06 1yq2 s ALA 658 Cb -0.10 -3.07 0.13 0.00 0.00 0.00 0.00 23.12 20.09 1yq2 s ALA 658 CO 0.02 0.17 1.05 0.00 0.00 0.00 0.00 175.76 176.99 1yq2 s ALA 659 N -2.14 3.42 0.08 0.00 0.00 -1.26 -4.87 121.76 117.00 1yq2 s ALA 659 Ca 0.60 -2.71 0.06 0.00 0.00 0.00 0.00 51.96 49.91 1yq2 s ALA 659 Cb -0.09 -3.94 -0.03 0.00 0.00 0.00 0.00 23.12 19.05 1yq2 s ALA 659 CO 0.14 -2.85 -0.15 -1.83 0.00 0.00 0.00 175.76 171.07 1yq2 s GLU 660 N 2.54 0.89 0.00 0.00 -1.05 -1.26 -1.54 118.70 118.28 1yq2 s GLU 660 Ca 0.29 -1.03 0.00 0.00 -0.15 0.00 0.00 54.97 54.07 1yq2 s GLU 660 Cb -0.08 -0.90 0.00 0.00 -0.44 0.00 0.00 34.13 32.71 1yq2 s GLU 660 CO -0.07 0.20 0.00 0.41 0.95 0.00 0.00 175.26 176.75 1yq2 n GLY 661 N 1.11 2.65 0.09 -3.83 0.00 0.20 -4.62 105.19 100.79 1yq2 n GLY 661 Ca -0.20 -1.57 -0.04 0.00 0.00 0.00 0.00 46.02 44.21 1yq2 n GLY 661 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yq2 h SER 662 N 0.00 0.00 -2.12 1.61 4.64 -1.92 -3.38 113.55 112.38 1yq2 h SER 662 Ca 0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1yq2 h SER 662 Cb 0.00 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 61.68 1yq2 h SER 662 CO 0.00 0.83 -0.85 -0.67 -0.87 0.00 0.00 176.83 175.27 1yq2 n ASP 663 N -3.24 2.29 0.00 4.97 2.03 -1.26 -5.09 116.55 116.26 1yq2 n ASP 663 Ca -0.02 -3.17 0.00 0.00 0.52 0.00 0.00 54.79 52.11 1yq2 n ASP 663 Cb 0.89 -0.64 0.00 0.00 -0.72 0.00 0.00 41.12 40.65 1yq2 n ASP 663 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1yq2 n GLY 664 N 0.81 -0.59 3.54 0.27 0.00 -1.26 -4.94 105.19 103.02 1yq2 n GLY 664 Ca 0.26 -1.24 -0.46 0.00 0.00 0.00 0.00 46.02 44.58 1yq2 n GLY 664 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yq2 n PRO 665 N 0.00 0.97 -1.68 1.61 -0.02 -1.26 -0.63 135.00 134.00 1yq2 n PRO 665 Ca 0.00 0.34 -0.47 0.00 -2.02 0.00 0.00 63.50 61.35 1yq2 n PRO 665 Cb 0.00 -1.63 -0.04 0.00 -0.02 0.00 0.00 33.50 31.81 1yq2 n PRO 665 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1yq2 n LEU 666 N 1.48 3.61 -4.86 2.45 0.00 -0.59 -4.26 117.00 114.84 1yq2 n LEU 666 Ca 0.12 0.96 -0.31 0.00 0.00 0.00 0.00 56.01 56.78 1yq2 n LEU 666 Cb 0.29 -1.41 -0.01 0.00 0.00 0.00 0.00 43.42 42.29 1yq2 n LEU 666 CO 0.59 0.00 0.70 -0.13 0.00 0.00 0.00 177.39 178.55 1yq2 s ARG 667 N 4.01 3.75 0.04 1.96 0.52 -1.26 -0.11 118.95 127.86 1yq2 s ARG 667 Ca 0.91 0.84 -0.33 0.00 -0.52 0.00 0.00 55.73 56.63 1yq2 s ARG 667 Cb -0.63 -2.10 -0.11 0.00 0.52 0.00 0.00 34.95 32.62 1yq2 s ARG 667 CO 0.49 -0.44 1.83 0.00 0.02 0.00 0.00 175.30 177.20 1yq2 n ALA 668 N -2.24 1.48 -0.32 2.13 0.00 -1.24 -1.09 120.51 119.23 1yq2 n ALA 668 Ca 0.06 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1yq2 n ALA 668 Cb 0.54 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.46 1yq2 n ALA 668 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 669 N 4.20 0.86 3.90 0.00 0.00 0.45 -4.97 105.19 109.63 1yq2 n GLY 669 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 1yq2 n GLY 669 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yq2 s GLU 670 N -0.57 3.51 0.16 1.61 2.12 -0.25 -4.91 118.70 120.38 1yq2 s GLU 670 Ca 0.00 -0.23 0.11 0.00 0.36 0.00 0.00 54.97 55.21 1yq2 s GLU 670 Cb 0.00 -3.05 -0.04 0.00 0.26 0.00 0.00 34.13 31.30 1yq2 s GLU 670 CO 0.00 0.62 -0.25 -1.12 -0.54 0.00 0.00 175.26 173.97 1yq2 s SER 671 N -2.05 3.34 0.16 -1.70 0.01 -1.26 -1.01 113.70 111.20 1yq2 s SER 671 Ca 0.31 -0.81 -0.06 0.00 1.31 0.00 0.00 55.95 56.69 1yq2 s SER 671 Cb -0.13 -0.23 -0.02 0.00 0.21 0.00 0.00 66.02 65.85 1yq2 s SER 671 CO 0.21 0.14 0.21 0.00 0.41 0.00 0.00 173.24 174.21 1yq2 s ALA 672 N -1.42 0.38 0.03 1.44 0.00 0.56 -4.95 121.76 117.81 1yq2 s ALA 672 Ca 0.17 -1.16 0.05 0.00 0.00 0.00 0.00 51.96 51.03 1yq2 s ALA 672 Cb -0.09 0.94 -0.02 0.00 0.00 0.00 0.00 23.12 23.95 1yq2 s ALA 672 CO 0.08 -0.61 -0.16 0.95 0.00 0.00 0.00 175.76 176.02 1yq2 s THR 673 N -4.02 1.27 -0.02 0.00 -4.23 -1.26 -0.46 115.64 106.91 1yq2 s THR 673 Ca 0.22 -0.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.79 1yq2 s THR 673 Cb 0.05 -1.11 0.01 0.00 1.34 0.00 0.00 72.50 72.78 1yq2 s THR 673 CO 0.03 0.14 -0.04 0.27 -0.54 0.00 0.00 174.62 174.47 1yq2 s ILE 674 N -0.71 0.43 -0.07 2.99 -4.36 0.61 -4.97 121.20 115.11 1yq2 s ILE 674 Ca 0.04 -0.15 -0.30 0.00 -0.26 0.00 0.00 60.65 59.98 1yq2 s ILE 674 Cb -0.08 -0.42 -0.02 0.00 1.25 0.00 0.00 42.46 43.19 1yq2 s ILE 674 CO 0.01 0.16 1.13 0.00 0.24 0.00 0.00 174.94 176.48 1yq2 s ALA 675 N 0.37 3.47 0.49 2.27 0.00 -1.26 -0.26 121.76 126.83 1yq2 s ALA 675 Ca -0.04 0.53 -0.02 0.00 0.00 0.00 0.00 51.96 52.44 1yq2 s ALA 675 Cb -0.08 -3.49 -0.00 0.00 0.00 0.00 0.00 23.12 19.55 1yq2 s ALA 675 CO -0.00 -0.71 0.74 -0.51 0.00 0.00 0.00 175.76 175.27 1yq2 s LEU 676 N 2.16 3.53 1.04 0.00 1.43 0.76 -4.98 118.68 122.62 1yq2 s LEU 676 Ca 0.53 0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 53.94 1yq2 s LEU 676 Cb -0.22 -3.29 0.21 0.00 0.03 0.00 0.00 46.19 42.92 1yq2 s LEU 676 CO 0.20 -0.80 1.05 -2.65 0.23 0.00 0.00 176.35 174.39 1yq2 n PRO 677 N -2.23 -1.38 -1.77 1.29 -0.02 -1.26 -4.28 135.00 125.35 1yq2 n PRO 677 Ca 0.02 -0.35 -0.41 0.00 -2.02 0.00 0.00 63.50 60.74 1yq2 n PRO 677 Cb 0.58 -2.26 -0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1yq2 n PRO 677 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 n ALA 678 N -4.58 2.38 -3.51 3.55 0.00 -1.26 -4.41 120.51 112.68 1yq2 n ALA 678 Ca 0.08 0.35 -0.27 0.00 0.00 0.00 0.00 53.44 53.59 1yq2 n ALA 678 Cb 0.53 -2.42 -0.11 0.00 0.00 0.00 0.00 19.45 17.45 1yq2 n ALA 678 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1yq2 s MET 679 N -1.89 1.26 0.28 0.00 -1.94 -1.26 -5.06 119.30 110.70 1yq2 s MET 679 Ca 0.55 -2.38 -0.30 0.00 -1.71 0.00 0.00 55.69 51.85 1yq2 s MET 679 Cb -0.48 -1.89 -0.10 0.00 2.01 0.00 0.00 34.83 34.37 1yq2 s MET 679 CO 0.62 -1.36 1.45 -1.25 -0.01 0.00 0.00 175.02 174.47 1yq2 s PRO 680 N -0.27 4.24 0.29 2.03 0.04 -1.26 -4.92 135.00 135.15 1yq2 s PRO 680 Ca 0.31 2.36 -0.30 0.00 0.04 0.00 0.00 61.00 63.41 1yq2 s PRO 680 Cb 0.01 -3.07 -0.11 0.00 0.04 0.00 0.00 34.50 31.36 1yq2 s PRO 680 CO -0.19 -0.43 1.59 0.00 0.04 0.00 0.00 177.00 178.02 1yq2 s ALA 681 N -0.33 3.75 0.28 8.56 0.00 -1.26 -4.96 121.76 127.81 1yq2 s ALA 681 Ca 0.57 1.56 -0.30 0.00 0.00 0.00 0.00 51.96 53.79 1yq2 s ALA 681 Cb -0.43 -3.65 -0.12 0.00 0.00 0.00 0.00 23.12 18.92 1yq2 s ALA 681 CO 0.48 -0.97 1.49 0.00 0.00 0.00 0.00 175.76 176.76 1yq2 n ALA 682 N 2.29 1.90 0.27 0.00 0.00 -1.26 -4.89 120.51 118.81 1yq2 n ALA 682 Ca 0.09 0.38 0.13 0.00 0.00 0.00 0.00 53.44 54.04 1yq2 n ALA 682 Cb 0.37 -2.37 0.75 0.00 0.00 0.00 0.00 19.45 18.20 1yq2 n ALA 682 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1yq2 h PRO 683 N 4.30 0.00 -6.33 0.00 0.11 -2.00 -3.38 132.00 124.70 1yq2 h PRO 683 Ca -0.46 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.05 1yq2 h PRO 683 Cb 1.25 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.17 1yq2 h PRO 683 CO 0.76 0.11 -0.82 -0.51 -0.21 0.00 0.00 178.00 177.33 1yq2 s LEU 684 N -7.24 2.39 0.00 2.35 1.43 -1.26 -4.92 118.68 111.43 1yq2 s LEU 684 Ca -0.03 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.26 1yq2 s LEU 684 Cb 0.13 -1.00 0.00 0.00 0.03 0.00 0.00 46.19 45.35 1yq2 s LEU 684 CO 0.58 0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.83 1yq2 n GLY 685 N 0.52 -0.48 3.77 -3.19 0.00 -1.26 -4.89 105.19 99.66 1yq2 n GLY 685 Ca -0.15 -1.10 -0.32 0.00 0.00 0.00 0.00 46.02 44.45 1yq2 n GLY 685 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yq2 s GLU 686 N 0.00 3.01 -0.16 1.61 2.02 -1.26 -4.51 118.70 119.41 1yq2 s GLU 686 Ca 0.00 -0.53 0.01 0.00 0.02 0.00 0.00 54.97 54.47 1yq2 s GLU 686 Cb 0.00 -2.82 0.02 0.00 0.10 0.00 0.00 34.13 31.43 1yq2 s GLU 686 CO 0.00 0.63 -0.18 0.99 0.02 0.00 0.00 175.26 176.72 1yq2 s THR 687 N -1.22 1.85 -0.06 3.63 2.01 -1.26 -0.61 115.64 119.98 1yq2 s THR 687 Ca 0.24 -0.82 0.03 0.00 0.31 0.00 0.00 61.69 61.46 1yq2 s THR 687 Cb -0.12 -1.69 0.00 0.00 0.01 0.00 0.00 72.50 70.71 1yq2 s THR 687 CO 0.15 0.51 -0.16 0.26 -0.69 0.00 0.00 174.62 174.69 1yq2 s TRP 688 N 1.29 1.68 -0.19 4.92 0.52 -0.34 -0.34 118.94 126.49 1yq2 s TRP 688 Ca 0.03 -0.56 -0.09 0.00 0.02 0.00 0.00 56.10 55.50 1yq2 s TRP 688 Cb -0.13 -1.16 -0.05 0.00 -1.15 0.00 0.00 33.47 30.97 1yq2 s TRP 688 CO -0.10 -0.23 0.12 -1.17 0.02 0.00 0.00 176.95 175.59 1yq2 s LEU 689 N 0.29 4.15 -0.09 2.99 2.96 -0.29 -0.90 118.68 127.80 1yq2 s LEU 689 Ca -0.09 0.23 0.03 0.00 -0.22 0.00 0.00 54.13 54.08 1yq2 s LEU 689 Cb -0.14 -2.06 0.01 0.00 0.50 0.00 0.00 46.19 44.50 1yq2 s LEU 689 CO 0.03 0.20 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.18 1yq2 s THR 690 N 0.22 1.70 -0.07 3.68 2.01 -0.32 -0.32 115.64 122.54 1yq2 s THR 690 Ca 0.08 -0.81 0.05 0.00 0.31 0.00 0.00 61.69 61.32 1yq2 s THR 690 Cb -0.11 -1.50 -0.01 0.00 0.01 0.00 0.00 72.50 70.89 1yq2 s THR 690 CO -0.01 0.48 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.49 1yq2 s VAL 691 N 0.50 2.28 -0.05 3.82 1.01 -0.34 -1.23 120.40 126.38 1yq2 s VAL 691 Ca -0.16 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 60.89 1yq2 s VAL 691 Cb -0.17 -1.86 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 1yq2 s VAL 691 CO 0.06 0.56 -0.21 -1.61 0.00 0.00 0.00 175.10 173.91 1yq2 s GLU 692 N -0.06 2.21 -0.19 2.72 2.02 0.40 -0.87 118.70 124.93 1yq2 s GLU 692 Ca -0.06 -0.75 -0.22 0.00 0.02 0.00 0.00 54.97 53.96 1yq2 s GLU 692 Cb -0.15 -1.87 -0.02 0.00 0.10 0.00 0.00 34.13 32.20 1yq2 s GLU 692 CO 0.05 0.29 0.69 0.00 0.02 0.00 0.00 175.26 176.31 1yq2 s ALA 693 N -0.00 3.54 0.16 5.21 0.00 -0.54 -1.03 121.76 129.11 1yq2 s ALA 693 Ca -0.05 -0.19 0.06 0.00 0.00 0.00 0.00 51.96 51.78 1yq2 s ALA 693 Cb -0.13 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1yq2 s ALA 693 CO 0.03 -0.61 -0.12 0.14 0.00 0.00 0.00 175.76 175.21 1yq2 s VAL 694 N 2.03 1.39 -0.02 0.00 -7.23 -0.26 -0.16 120.40 116.15 1yq2 s VAL 694 Ca 0.31 -2.08 -0.30 0.00 -1.81 0.00 0.00 61.98 58.10 1yq2 s VAL 694 Cb -0.16 -1.89 -0.03 0.00 0.56 0.00 0.00 36.38 34.86 1yq2 s VAL 694 CO 0.11 -0.66 1.05 -0.76 -0.31 0.00 0.00 175.10 174.52 1yq2 s LEU 695 N -3.15 4.33 0.15 1.32 1.43 -0.44 -0.85 118.68 121.46 1yq2 s LEU 695 Ca 0.18 1.71 -0.16 0.00 -1.03 0.00 0.00 54.13 54.83 1yq2 s LEU 695 Cb 0.01 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.67 1yq2 s LEU 695 CO 0.03 -0.37 1.76 0.03 0.23 0.00 0.00 176.35 178.03 1yq2 h ARG 696 N 6.94 0.58 -5.92 1.70 3.08 -1.49 0.33 114.38 119.60 1yq2 h ARG 696 Ca -0.38 -0.06 -0.53 0.00 0.07 0.00 0.00 59.98 59.07 1yq2 h ARG 696 Cb 1.20 -0.12 -0.15 0.00 0.08 0.00 0.00 29.97 30.98 1yq2 h ARG 696 CO 0.80 0.45 -0.76 -0.51 -1.07 0.00 0.00 179.97 178.89 1yq2 s ASP 697 N -5.70 3.02 0.68 7.04 1.01 -1.26 -4.10 116.67 117.36 1yq2 s ASP 697 Ca -0.13 -0.99 -0.17 0.00 0.71 0.00 0.00 52.55 51.97 1yq2 s ASP 697 Cb 0.11 -0.21 0.01 0.00 1.01 0.00 0.00 42.92 43.84 1yq2 s ASP 697 CO 0.74 -0.05 1.27 0.00 0.21 0.00 0.00 175.17 177.33 1yq2 s ALA 698 N -2.58 2.25 0.48 5.23 0.00 -1.26 -4.36 121.76 121.52 1yq2 s ALA 698 Ca 0.24 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.32 1yq2 s ALA 698 Cb -0.04 -3.53 -0.00 0.00 0.00 0.00 0.00 23.12 19.55 1yq2 s ALA 698 CO 0.10 -1.75 0.00 0.25 0.00 0.00 0.00 175.76 174.37 1yq2 n THR 699 N -2.23 0.00 0.30 0.00 -2.24 -0.37 -4.90 114.28 104.84 1yq2 n THR 699 Ca 0.15 -2.29 0.16 0.00 -2.27 0.00 0.00 64.05 59.81 1yq2 n THR 699 Cb 0.49 0.47 0.75 0.00 -2.10 0.00 0.00 70.33 69.93 1yq2 n THR 699 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1yq2 h GLY 700 N 1.17 0.00 -0.19 3.38 0.00 -2.02 -3.25 103.07 102.17 1yq2 h GLY 700 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1yq2 h GLY 700 CO 0.66 0.00 -0.15 -2.67 0.00 0.00 0.00 176.54 174.38 1yq2 n TRP 701 N -2.72 0.00 -3.68 5.60 4.27 -1.26 -5.04 117.44 114.61 1yq2 n TRP 701 Ca -0.00 0.00 -0.14 0.00 -3.89 0.00 0.00 57.50 53.47 1yq2 n TRP 701 Cb 0.18 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.06 1yq2 n TRP 701 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1yq2 s ALA 702 N -1.09 -1.03 0.74 -1.67 0.00 -1.23 -4.75 121.76 112.72 1yq2 s ALA 702 Ca 0.04 0.47 -0.11 0.00 0.00 0.00 0.00 51.96 52.36 1yq2 s ALA 702 Cb 0.04 0.19 0.03 0.00 0.00 0.00 0.00 23.12 23.38 1yq2 s ALA 702 CO 0.16 -0.37 1.08 -1.25 0.00 0.00 0.00 175.76 175.38 1yq2 s PRO 703 N -1.84 2.60 0.45 0.00 0.04 -1.26 -1.24 135.00 133.75 1yq2 s PRO 703 Ca -0.09 0.78 -0.24 0.00 0.04 0.00 0.00 61.00 61.49 1yq2 s PRO 703 Cb -0.02 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.46 1yq2 s PRO 703 CO 0.02 -1.29 1.12 0.00 0.04 0.00 0.00 177.00 176.88 1yq2 n ALA 704 N -3.24 0.65 -0.99 8.56 0.00 -1.26 -2.10 120.51 122.13 1yq2 n ALA 704 Ca 0.07 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1yq2 n ALA 704 Cb 0.55 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.83 1yq2 n ALA 704 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 705 N 1.04 0.42 3.67 0.00 0.00 0.12 -4.90 105.19 105.54 1yq2 n GLY 705 Ca 0.09 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.62 1yq2 n GLY 705 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1yq2 n HIS 706 N -2.73 2.28 -2.44 1.61 -0.00 -0.89 -4.62 115.22 108.42 1yq2 n HIS 706 Ca 0.00 0.03 -0.38 0.00 0.46 0.00 0.00 57.72 57.83 1yq2 n HIS 706 Cb 0.10 -2.65 -0.03 0.00 -0.12 0.00 0.00 29.99 27.29 1yq2 n HIS 706 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 1yq2 s PRO 707 N 4.22 4.27 -0.20 1.57 0.04 -1.26 -1.33 135.00 142.31 1yq2 s PRO 707 Ca 0.94 1.71 0.09 0.00 0.04 0.00 0.00 61.00 63.78 1yq2 s PRO 707 Cb -0.72 -2.78 -0.18 0.00 0.04 0.00 0.00 34.50 30.86 1yq2 s PRO 707 CO 0.52 -0.10 -0.06 1.28 0.04 0.00 0.00 177.00 178.69 1yq2 n LEU 708 N 0.35 1.34 0.00 -3.56 4.77 0.77 -4.94 117.00 115.72 1yq2 n LEU 708 Ca 0.03 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1yq2 n LEU 708 Cb 0.47 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 1yq2 n LEU 708 CO 0.49 0.63 0.00 0.61 -1.33 0.00 0.00 177.39 177.80 1yq2 n GLY 709 N 2.15 0.61 3.38 -0.72 0.00 -1.23 -4.63 105.19 104.75 1yq2 n GLY 709 Ca -0.33 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.77 1yq2 n GLY 709 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 710 N -2.00 0.29 0.05 4.61 0.00 -1.26 -1.47 121.76 121.97 1yq2 s ALA 710 Ca 0.00 -1.14 -0.08 0.00 0.00 0.00 0.00 51.96 50.74 1yq2 s ALA 710 Cb 0.00 1.09 -0.00 0.00 0.00 0.00 0.00 23.12 24.21 1yq2 s ALA 710 CO 0.00 -0.70 0.15 0.54 0.00 0.00 0.00 175.76 175.75 1yq2 s VAL 711 N -4.05 0.13 0.15 0.00 0.11 -0.05 -4.92 120.40 111.78 1yq2 s VAL 711 Ca 0.26 -1.04 0.07 0.00 -2.93 0.00 0.00 61.98 58.34 1yq2 s VAL 711 Cb 0.03 -0.97 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 1yq2 s VAL 711 CO 0.07 -0.57 -0.15 -1.10 -3.33 0.00 0.00 175.10 170.02 1yq2 s GLN 712 N -2.78 1.15 -0.02 1.54 -0.21 -1.26 -1.20 119.66 116.87 1yq2 s GLN 712 Ca -0.03 -1.38 -0.00 0.00 0.02 0.00 0.00 55.36 53.97 1yq2 s GLN 712 Cb -0.00 -1.01 0.03 0.00 1.00 0.00 0.00 33.01 33.03 1yq2 s GLN 712 CO -0.05 0.18 0.03 -1.17 -2.12 0.00 0.00 175.29 172.16 1yq2 s LEU 713 N -2.78 1.01 -0.28 2.90 2.96 0.56 -4.80 118.68 118.26 1yq2 s LEU 713 Ca 0.14 0.03 -0.27 0.00 -0.22 0.00 0.00 54.13 53.81 1yq2 s LEU 713 Cb -0.03 -0.11 0.01 0.00 0.50 0.00 0.00 46.19 46.55 1yq2 s LEU 713 CO 0.04 -0.13 0.97 -0.62 -1.32 0.00 0.00 176.35 175.29 1yq2 s ASP 714 N 1.16 6.91 -0.09 3.68 3.68 -1.26 -1.14 116.67 129.61 1yq2 s ASP 714 Ca -0.08 1.06 0.14 0.00 2.13 0.00 0.00 52.55 55.80 1yq2 s ASP 714 Cb -0.13 -2.50 0.44 0.00 -1.45 0.00 0.00 42.92 39.28 1yq2 s ASP 714 CO -0.03 -0.72 1.37 0.18 0.13 0.00 0.00 175.17 176.10 1yq2 n LEU 715 N 6.46 3.53 -4.77 -1.34 4.77 0.54 -4.99 117.00 121.21 1yq2 n LEU 715 Ca 0.09 -2.49 -0.39 0.00 -0.03 0.00 0.00 56.01 53.18 1yq2 n LEU 715 Cb 0.47 -0.40 0.01 0.00 -2.33 0.00 0.00 43.42 41.16 1yq2 n LEU 715 CO 0.54 0.71 1.01 -0.44 -1.33 0.00 0.00 177.39 177.88 1yq2 s SER 716 N -1.40 6.05 0.74 -1.43 0.01 -1.12 -4.47 113.70 112.09 1yq2 s SER 716 Ca 0.34 2.77 -0.15 0.00 1.31 0.00 0.00 55.95 60.23 1yq2 s SER 716 Cb 0.24 -2.64 0.04 0.00 0.21 0.00 0.00 66.02 63.87 1yq2 s SER 716 CO 0.13 -1.04 1.21 0.00 0.41 0.00 0.00 173.24 173.95 1yq2 s ALA 717 N -1.24 2.08 0.31 1.44 0.00 -1.26 -4.91 121.76 118.18 1yq2 s ALA 717 Ca 0.60 0.89 -0.27 0.00 0.00 0.00 0.00 51.96 53.17 1yq2 s ALA 717 Cb -0.40 -3.48 -0.14 0.00 0.00 0.00 0.00 23.12 19.10 1yq2 s ALA 717 CO 0.52 -1.94 0.94 -2.30 0.00 0.00 0.00 175.76 172.98 1yq2 n PRO 718 N -2.79 1.19 -1.79 0.00 -0.02 -1.26 -4.85 135.00 125.49 1yq2 n PRO 718 Ca 0.14 0.42 -0.42 0.00 -2.02 0.00 0.00 63.50 61.62 1yq2 n PRO 718 Cb 0.50 -1.78 -0.02 0.00 -0.02 0.00 0.00 33.50 32.18 1yq2 n PRO 718 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 s ALA 719 N -1.11 3.82 -0.54 3.55 0.00 -1.26 -4.96 121.76 121.25 1yq2 s ALA 719 Ca 0.60 1.54 -0.26 0.00 0.00 0.00 0.00 51.96 53.85 1yq2 s ALA 719 Cb -0.69 -3.66 0.04 0.00 0.00 0.00 0.00 23.12 18.80 1yq2 s ALA 719 CO 0.59 -0.93 1.02 0.08 0.00 0.00 0.00 175.76 176.52 1yq2 s VAL 720 N 0.55 4.29 -0.18 0.00 1.01 -1.26 -5.02 120.40 119.80 1yq2 s VAL 720 Ca 0.68 0.56 -0.29 0.00 0.00 0.00 0.00 61.98 62.92 1yq2 s VAL 720 Cb -0.48 -4.58 -0.03 0.00 0.00 0.00 0.00 36.38 31.29 1yq2 s VAL 720 CO 0.40 -1.13 1.59 -2.16 0.00 0.00 0.00 175.10 173.80 1yq2 s PRO 721 N 4.22 3.92 0.25 2.72 0.04 -1.26 -4.95 135.00 139.94 1yq2 s PRO 721 Ca 0.35 1.78 -0.31 0.00 0.04 0.00 0.00 61.00 62.86 1yq2 s PRO 721 Cb -0.11 -4.00 -0.13 0.00 0.04 0.00 0.00 34.50 30.31 1yq2 s PRO 721 CO 0.22 -1.14 1.48 2.41 0.04 0.00 0.00 177.00 180.02 1yq2 n THR 722 N 6.10 0.92 -2.66 1.26 -1.04 -1.26 -4.96 114.28 112.64 1yq2 n THR 722 Ca 0.18 -0.23 -0.41 0.00 -2.04 0.00 0.00 64.05 61.55 1yq2 n THR 722 Cb 0.45 -1.65 -0.05 0.00 -1.82 0.00 0.00 70.33 67.26 1yq2 n THR 722 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1yq2 s ARG 723 N -0.35 4.70 0.12 -2.82 0.52 -1.26 -5.06 118.95 114.80 1yq2 s ARG 723 Ca 0.67 1.55 0.08 0.00 -0.52 0.00 0.00 55.73 57.52 1yq2 s ARG 723 Cb -0.60 -3.32 -0.04 0.00 0.52 0.00 0.00 34.95 31.51 1yq2 s ARG 723 CO 0.48 0.24 -0.14 -1.12 0.02 0.00 0.00 175.30 174.78 1yq2 s SER 724 N -0.33 4.11 0.39 0.23 0.01 -1.26 -5.09 113.70 111.75 1yq2 s SER 724 Ca 0.46 -0.51 -0.28 0.00 1.31 0.00 0.00 55.95 56.94 1yq2 s SER 724 Cb -0.26 -0.67 -0.10 0.00 0.21 0.00 0.00 66.02 65.20 1yq2 s SER 724 CO 0.32 0.17 1.47 -2.16 0.41 0.00 0.00 173.24 173.45 1yq2 s PRO 725 N -2.28 4.04 0.33 12.44 0.04 -1.26 -4.95 135.00 143.35 1yq2 s PRO 725 Ca 0.20 2.54 -0.29 0.00 0.04 0.00 0.00 61.00 63.49 1yq2 s PRO 725 Cb -0.10 -2.91 -0.12 0.00 0.04 0.00 0.00 34.50 31.40 1yq2 s PRO 725 CO 0.12 -0.58 1.42 -2.13 0.04 0.00 0.00 177.00 175.87 1yq2 n ARG 726 N 0.35 2.38 -1.69 4.56 0.63 -1.26 -4.93 116.66 116.70 1yq2 n ARG 726 Ca 0.02 0.84 -0.45 0.00 -0.92 0.00 0.00 57.85 57.34 1yq2 n ARG 726 Cb 0.40 -2.51 -0.03 0.00 0.45 0.00 0.00 32.46 30.76 1yq2 n ARG 726 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1yq2 n PRO 727 N 1.05 2.26 -4.30 -0.14 -0.02 -1.26 -4.98 135.00 127.61 1yq2 n PRO 727 Ca 0.05 0.81 -0.33 0.00 -2.02 0.00 0.00 63.50 62.02 1yq2 n PRO 727 Cb 0.36 -2.55 -0.09 0.00 -0.02 0.00 0.00 33.50 31.20 1yq2 n PRO 727 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 s ALA 728 N 0.51 3.25 0.07 3.55 0.00 -1.26 -5.09 121.76 122.79 1yq2 s ALA 728 Ca 0.73 -0.96 -0.30 0.00 0.00 0.00 0.00 51.96 51.43 1yq2 s ALA 728 Cb -0.63 -1.32 -0.05 0.00 0.00 0.00 0.00 23.12 21.13 1yq2 s ALA 728 CO 0.42 0.64 1.03 0.99 0.00 0.00 0.00 175.76 178.84 1yq2 s THR 729 N -1.07 4.49 0.47 0.00 2.01 -1.26 -5.01 115.64 115.26 1yq2 s THR 729 Ca 0.19 1.91 -0.24 0.00 0.31 0.00 0.00 61.69 63.86 1yq2 s THR 729 Cb -0.11 -4.22 -0.07 0.00 0.01 0.00 0.00 72.50 68.10 1yq2 s THR 729 CO 0.10 0.21 1.33 -2.16 -0.69 0.00 0.00 174.62 173.42 1yq2 s PRO 730 N 0.54 3.61 0.01 4.92 0.04 -1.26 -4.67 135.00 138.20 1yq2 s PRO 730 Ca 0.51 2.20 -0.04 0.00 0.04 0.00 0.00 61.00 63.71 1yq2 s PRO 730 Cb -0.24 -2.53 -0.04 0.00 0.04 0.00 0.00 34.50 31.72 1yq2 s PRO 730 CO 0.30 -0.80 0.23 -0.51 0.04 0.00 0.00 177.00 176.25 1yq2 s LEU 731 N -2.92 4.36 0.33 -3.56 1.43 0.60 -5.01 118.68 113.91 1yq2 s LEU 731 Ca 0.63 0.43 -0.28 0.00 -1.03 0.00 0.00 54.13 53.88 1yq2 s LEU 731 Cb -0.39 -2.69 -0.10 0.00 0.03 0.00 0.00 46.19 43.04 1yq2 s LEU 731 CO 0.49 0.24 1.26 -1.81 0.23 0.00 0.00 176.35 176.76 1yq2 s ASP 732 N -1.91 6.81 0.00 2.29 1.01 -1.26 -3.80 116.67 119.81 1yq2 s ASP 732 Ca 0.29 2.60 0.00 0.00 0.71 0.00 0.00 52.55 56.14 1yq2 s ASP 732 Cb -0.13 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.16 1yq2 s ASP 732 CO 0.19 -0.50 0.00 0.61 0.21 0.00 0.00 175.17 175.68 1yq2 n GLY 733 N 0.85 1.13 3.77 0.21 0.00 -1.26 -4.99 105.19 104.90 1yq2 n GLY 733 Ca 0.00 -2.04 -0.40 0.00 0.00 0.00 0.00 46.02 43.59 1yq2 n GLY 733 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 734 N -1.07 3.37 0.28 4.61 0.00 -1.26 -4.62 121.76 123.07 1yq2 s ALA 734 Ca 0.00 1.28 -0.29 0.00 0.00 0.00 0.00 51.96 52.95 1yq2 s ALA 734 Cb 0.00 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.53 1yq2 s ALA 734 CO 0.00 -0.79 1.07 -0.51 0.00 0.00 0.00 175.76 175.53 1yq2 s LEU 735 N -2.19 4.54 0.48 0.00 1.43 -1.26 -4.71 118.68 116.97 1yq2 s LEU 735 Ca 0.54 2.21 -0.24 0.00 -1.03 0.00 0.00 54.13 55.61 1yq2 s LEU 735 Cb -0.39 -3.66 -0.07 0.00 0.03 0.00 0.00 46.19 42.09 1yq2 s LEU 735 CO 0.52 -0.12 1.32 -0.81 0.23 0.00 0.00 176.35 177.49 1yq2 n PRO 736 N 1.15 1.88 0.03 1.29 -0.04 -1.26 -4.94 135.00 133.10 1yq2 n PRO 736 Ca -0.01 0.68 -0.12 0.00 -0.04 0.00 0.00 63.50 64.01 1yq2 n PRO 736 Cb 0.45 -2.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.28 1yq2 n PRO 736 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1yq2 h VAL 737 N 1.83 1.13 -3.57 0.52 2.07 -1.95 -3.43 116.25 112.85 1yq2 h VAL 737 Ca -0.50 -2.87 -0.14 0.00 0.82 0.00 0.00 66.70 64.01 1yq2 h VAL 737 Cb 1.29 2.63 -0.20 0.00 -1.52 0.00 0.00 31.29 33.49 1yq2 h VAL 737 CO 0.59 0.73 -0.51 -0.94 0.02 0.00 0.00 177.57 177.46 1yq2 s SER 738 N -6.58 0.05 -0.24 0.57 1.04 -1.26 0.24 113.70 107.52 1yq2 s SER 738 Ca -0.06 -0.26 -0.03 0.00 0.48 0.00 0.00 55.95 56.08 1yq2 s SER 738 Cb 0.08 0.20 0.10 0.00 0.10 0.00 0.00 66.02 66.50 1yq2 s SER 738 CO 0.83 -0.38 0.20 -0.76 0.98 0.00 0.00 173.24 174.11 1yq2 s LEU 739 N -1.46 0.08 0.00 2.42 1.43 -0.18 -5.01 118.68 115.96 1yq2 s LEU 739 Ca -0.14 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.29 1yq2 s LEU 739 Cb -0.07 0.14 0.00 0.00 0.03 0.00 0.00 46.19 46.29 1yq2 s LEU 739 CO 0.01 -0.37 0.00 0.61 0.23 0.00 0.00 176.35 176.83 1yq2 n GLY 740 N 5.29 3.40 0.00 -3.19 0.00 -1.26 -1.35 105.19 108.09 1yq2 n GLY 740 Ca -0.05 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1yq2 n GLY 740 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1yq2 n PRO 741 N 14.00 0.21 -3.58 1.61 -0.04 -1.26 -4.80 135.00 141.14 1yq2 n PRO 741 Ca 0.00 0.07 -0.38 0.00 -0.04 0.00 0.00 63.50 63.15 1yq2 n PRO 741 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 1yq2 n PRO 741 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yq2 s ALA 742 N -2.74 3.71 -0.06 0.55 0.00 -0.46 -0.80 121.76 121.96 1yq2 s ALA 742 Ca 0.19 -0.35 0.05 0.00 0.00 0.00 0.00 51.96 51.85 1yq2 s ALA 742 Cb 0.16 -2.31 -0.01 0.00 0.00 0.00 0.00 23.12 20.96 1yq2 s ALA 742 CO 0.40 0.42 -0.22 0.99 0.00 0.00 0.00 175.76 177.35 1yq2 s THR 743 N -0.73 2.30 0.11 0.00 2.01 -0.53 -1.01 115.64 117.79 1yq2 s THR 743 Ca 0.21 -0.98 0.10 0.00 0.31 0.00 0.00 61.69 61.33 1yq2 s THR 743 Cb -0.15 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.47 1yq2 s THR 743 CO 0.10 0.57 -0.27 -0.36 -0.69 0.00 0.00 174.62 173.97 1yq2 s PHE 744 N -0.24 2.29 -0.32 4.92 0.40 0.14 -0.75 117.98 124.43 1yq2 s PHE 744 Ca -0.01 -0.39 0.03 0.00 -0.60 0.00 0.00 56.93 55.96 1yq2 s PHE 744 Cb -0.13 -1.28 0.09 0.00 0.51 0.00 0.00 43.02 42.21 1yq2 s PHE 744 CO 0.03 0.27 0.02 0.34 0.70 0.00 0.00 175.22 176.58 1yq2 s ASP 745 N -1.82 4.58 -1.50 1.36 -1.08 0.62 -4.65 116.67 114.18 1yq2 s ASP 745 Ca 0.13 -1.91 -0.06 0.00 -0.52 0.00 0.00 52.55 50.19 1yq2 s ASP 745 Cb -0.10 -1.51 0.02 0.00 -1.46 0.00 0.00 42.92 39.87 1yq2 s ASP 745 CO 0.05 -0.34 0.73 0.00 0.52 0.00 0.00 175.17 176.13 1yq2 n ALA 746 N 4.37 -1.07 -0.12 3.66 0.00 -1.26 -1.99 120.51 124.10 1yq2 n ALA 746 Ca -0.01 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1yq2 n ALA 746 Cb 0.42 -4.15 0.00 0.00 0.00 0.00 0.00 19.45 15.72 1yq2 n ALA 746 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 747 N -1.60 0.77 3.69 0.00 0.00 -1.26 -5.05 105.19 101.75 1yq2 n GLY 747 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 1yq2 n GLY 747 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yq2 s THR 748 N -2.41 5.34 0.14 2.61 2.01 -0.84 -5.02 115.64 117.46 1yq2 s THR 748 Ca 0.00 0.34 -0.31 0.00 0.31 0.00 0.00 61.69 62.03 1yq2 s THR 748 Cb 0.00 -3.56 -0.10 0.00 0.01 0.00 0.00 72.50 68.86 1yq2 s THR 748 CO 0.00 0.37 1.62 -0.22 -0.69 0.00 0.00 174.62 175.69 1yq2 s LEU 749 N 0.79 4.37 0.00 4.42 2.96 -1.26 -0.28 118.68 129.68 1yq2 s LEU 749 Ca 0.11 2.61 0.00 0.00 -0.22 0.00 0.00 54.13 56.63 1yq2 s LEU 749 Cb -0.13 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.98 1yq2 s LEU 749 CO 0.03 -0.86 0.00 1.33 -1.32 0.00 0.00 176.35 175.53 1yq2 n VAL 750 N 4.22 0.00 -3.71 1.68 0.24 0.07 -4.54 118.33 116.29 1yq2 n VAL 750 Ca 0.15 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.31 1yq2 n VAL 750 Cb 0.39 0.17 -0.09 0.00 -1.47 0.00 0.00 33.84 32.84 1yq2 n VAL 750 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1yq2 s SER 751 N -2.18 -0.34 -0.05 -1.34 1.04 -1.11 -1.45 113.70 108.26 1yq2 s SER 751 Ca 0.00 0.42 0.02 0.00 0.48 0.00 0.00 55.95 56.87 1yq2 s SER 751 Cb 0.00 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.65 1yq2 s SER 751 CO 0.00 -0.38 -0.10 -0.76 0.98 0.00 0.00 173.24 172.98 1yq2 s LEU 752 N -0.82 1.60 -1.42 2.42 1.43 -0.27 -1.45 118.68 120.16 1yq2 s LEU 752 Ca -0.09 -0.25 -0.08 0.00 -1.03 0.00 0.00 54.13 52.68 1yq2 s LEU 752 Cb -0.04 -0.71 0.01 0.00 0.03 0.00 0.00 46.19 45.48 1yq2 s LEU 752 CO 0.04 0.02 0.28 0.00 0.23 0.00 0.00 176.35 176.92 1yq2 n ALA 753 N 3.77 -2.17 -0.94 4.21 0.00 0.02 -1.77 120.51 123.63 1yq2 n ALA 753 Ca -0.23 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 52.80 1yq2 n ALA 753 Cb 0.52 -1.52 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1yq2 n ALA 753 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 754 N -2.30 0.90 3.25 0.00 0.00 -1.26 -5.00 105.19 100.78 1yq2 n GLY 754 Ca -0.27 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 1yq2 n GLY 754 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yq2 s GLN 755 N -0.06 1.48 0.19 1.61 -1.52 -0.73 -5.11 119.66 115.52 1yq2 s GLN 755 Ca 0.00 -0.90 -0.31 0.00 -1.95 0.00 0.00 55.36 52.21 1yq2 s GLN 755 Cb 0.00 -1.56 -0.09 0.00 -0.22 0.00 0.00 33.01 31.14 1yq2 s GLN 755 CO 0.00 0.41 1.43 -1.25 -0.25 0.00 0.00 175.29 175.62 1yq2 s PRO 756 N -1.01 4.29 -0.07 2.91 0.04 -1.26 -1.12 135.00 138.79 1yq2 s PRO 756 Ca 0.08 2.21 -0.06 0.00 0.04 0.00 0.00 61.00 63.26 1yq2 s PRO 756 Cb -0.09 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.31 1yq2 s PRO 756 CO 0.01 -0.43 0.19 0.08 0.04 0.00 0.00 177.00 176.89 1yq2 s VAL 757 N 0.50 -0.00 0.12 -0.36 1.01 -0.53 -4.06 120.40 117.08 1yq2 s VAL 757 Ca 0.62 0.01 0.09 0.00 0.00 0.00 0.00 61.98 62.70 1yq2 s VAL 757 Cb -0.40 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 1yq2 s VAL 757 CO 0.37 0.00 -0.19 -0.44 0.00 0.00 0.00 175.10 174.84 1yq2 s SER 758 N 0.15 3.85 0.00 3.32 0.01 -0.80 -3.61 113.70 116.61 1yq2 s SER 758 Ca -0.00 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 56.68 1yq2 s SER 758 Cb -0.02 -0.52 0.00 0.00 0.21 0.00 0.00 66.02 65.69 1yq2 s SER 758 CO -0.00 0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.44 1yq2 n GLY 759 N 0.81 0.75 3.79 3.44 0.00 -1.26 -0.39 105.19 112.33 1yq2 n GLY 759 Ca -0.16 -2.11 -0.36 0.00 0.00 0.00 0.00 46.02 43.40 1yq2 n GLY 759 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1yq2 s PRO 760 N -1.05 4.30 -0.12 1.61 0.04 -1.26 -4.49 135.00 134.02 1yq2 s PRO 760 Ca 0.00 1.35 0.03 0.00 0.04 0.00 0.00 61.00 62.42 1yq2 s PRO 760 Cb 0.00 -2.51 0.00 0.00 0.04 0.00 0.00 34.50 32.03 1yq2 s PRO 760 CO 0.00 0.01 -0.22 0.50 0.04 0.00 0.00 177.00 177.33 1yq2 s ARG 761 N -2.56 3.08 0.32 4.56 3.52 -0.22 -4.89 118.95 122.77 1yq2 s ARG 761 Ca 0.57 -0.85 -0.29 0.00 -0.13 0.00 0.00 55.73 55.03 1yq2 s ARG 761 Cb -0.17 -2.40 -0.12 0.00 -1.56 0.00 0.00 34.95 30.70 1yq2 s ARG 761 CO 0.22 0.10 1.52 -0.11 -0.81 0.00 0.00 175.30 176.23 1yq2 n LEU 762 N 3.76 4.37 -3.95 -0.88 7.94 -1.26 0.10 117.00 127.08 1yq2 n LEU 762 Ca -0.19 1.18 -0.21 0.00 -1.11 0.00 0.00 56.01 55.68 1yq2 n LEU 762 Cb 0.52 -1.58 -0.16 0.00 0.53 0.00 0.00 43.42 42.73 1yq2 n LEU 762 CO 0.28 0.07 -0.43 -0.70 -1.11 0.00 0.00 177.39 175.50 1yq2 s GLU 763 N -1.16 0.99 -0.01 1.96 2.56 0.10 -4.82 118.70 118.32 1yq2 s GLU 763 Ca 0.60 -0.22 0.08 0.00 0.00 0.00 0.00 54.97 55.43 1yq2 s GLU 763 Cb -0.50 -0.92 -0.12 0.00 2.00 0.00 0.00 34.13 34.59 1yq2 s GLU 763 CO 0.55 0.01 0.24 1.28 -0.56 0.00 0.00 175.26 176.78 1yq2 n LEU 764 N 3.69 0.13 -4.77 2.70 4.77 -1.26 -1.91 117.00 120.36 1yq2 n LEU 764 Ca -0.22 -0.17 -0.39 0.00 -0.03 0.00 0.00 56.01 55.20 1yq2 n LEU 764 Cb 0.52 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.55 1yq2 n LEU 764 CO 0.24 0.03 0.58 0.86 -1.33 0.00 0.00 177.39 177.77 1yq2 s TRP 765 N -2.32 3.85 0.15 -1.77 -0.11 -1.25 -3.11 118.94 114.39 1yq2 s TRP 765 Ca -0.01 1.74 0.08 0.00 1.22 0.00 0.00 56.10 59.13 1yq2 s TRP 765 Cb 0.06 -2.86 -0.04 0.00 -1.50 0.00 0.00 33.47 29.12 1yq2 s TRP 765 CO 0.35 0.40 -0.17 -0.98 -4.62 0.00 0.00 176.95 171.92 1yq2 s ARG 766 N -1.48 1.20 -0.25 5.86 1.70 -1.26 -4.83 118.95 119.88 1yq2 s ARG 766 Ca 0.42 -1.35 -0.29 0.00 -0.47 0.00 0.00 55.73 54.04 1yq2 s ARG 766 Cb -0.22 -1.23 -0.03 0.00 -0.57 0.00 0.00 34.95 32.90 1yq2 s ARG 766 CO 0.27 0.25 1.80 0.00 -1.08 0.00 0.00 175.30 176.54 1yq2 s ALA 767 N -2.01 3.04 0.26 7.88 0.00 -1.26 -4.89 121.76 124.78 1yq2 s ALA 767 Ca 0.13 0.47 -0.31 0.00 0.00 0.00 0.00 51.96 52.25 1yq2 s ALA 767 Cb -0.06 -3.95 -0.13 0.00 0.00 0.00 0.00 23.12 18.98 1yq2 s ALA 767 CO 0.05 -2.35 1.52 -2.30 0.00 0.00 0.00 175.76 172.69 1yq2 n PRO 768 N 8.15 2.38 -1.09 0.00 -0.02 -1.26 -0.56 135.00 142.60 1yq2 n PRO 768 Ca 0.22 0.85 -0.29 0.00 -2.02 0.00 0.00 63.50 62.26 1yq2 n PRO 768 Cb 0.46 -2.58 0.17 0.00 -0.02 0.00 0.00 33.50 31.53 1yq2 n PRO 768 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1yq2 s THR 769 N 0.06 2.27 0.34 3.45 -4.23 -1.26 -4.52 115.64 111.75 1yq2 s THR 769 Ca 0.67 0.09 0.03 0.00 -1.18 0.00 0.00 61.69 61.29 1yq2 s THR 769 Cb -0.57 -2.51 0.27 0.00 1.34 0.00 0.00 72.50 71.03 1yq2 s THR 769 CO 0.48 -0.11 1.98 0.44 -0.54 0.00 0.00 174.62 176.86 1yq2 h ASP 770 N -1.87 0.75 -0.57 3.99 3.32 -1.87 -2.32 116.42 117.85 1yq2 h ASP 770 Ca -0.53 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.43 1yq2 h ASP 770 Cb 1.31 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.67 1yq2 h ASP 770 CO 0.55 0.52 0.04 0.78 -1.72 0.00 0.00 179.24 179.41 1yq2 h ASN 771 N 0.87 0.95 -0.13 6.45 2.35 -1.85 -2.37 115.58 121.85 1yq2 h ASN 771 Ca 0.28 -0.29 0.04 0.00 -0.55 0.00 0.00 56.30 55.78 1yq2 h ASN 771 Cb 0.04 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 1yq2 h ASN 771 CO -0.08 1.00 0.15 0.44 -1.65 0.00 0.00 177.43 177.29 1yq2 h ASP 772 N 0.87 0.00 -0.16 5.81 3.32 -1.72 -0.88 116.42 123.65 1yq2 h ASP 772 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1yq2 h ASP 772 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1yq2 h ASP 772 CO 0.02 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.08 1yq2 n ARG 773 N -3.84 2.08 -3.00 3.56 1.74 -0.92 -0.76 116.66 115.53 1yq2 n ARG 773 Ca 0.00 -1.60 -0.31 0.00 -0.77 0.00 0.00 57.85 55.17 1yq2 n ARG 773 Cb 0.26 -1.46 -0.05 0.00 -1.02 0.00 0.00 32.46 30.19 1yq2 n ARG 773 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1yq2 s GLY 774 N -1.75 2.16 0.00 -0.13 0.00 -0.34 -4.81 107.32 102.45 1yq2 s GLY 774 Ca 0.34 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 45.00 1yq2 s GLY 774 CO 0.30 0.14 0.60 0.00 0.00 0.00 0.00 173.10 174.14 1yq2 n ALA 775 N -0.79 1.44 0.12 3.20 0.00 -1.26 -4.13 120.51 119.10 1yq2 n ALA 775 Ca 0.03 -0.55 -0.06 0.00 0.00 0.00 0.00 53.44 52.87 1yq2 n ALA 775 Cb 0.53 -0.17 -0.03 0.00 0.00 0.00 0.00 19.45 19.79 1yq2 n ALA 775 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1yq2 h GLY 776 N 0.00 -0.38 -1.79 0.00 0.00 -1.89 -3.43 103.07 95.58 1yq2 h GLY 776 Ca 0.00 0.14 -0.53 0.00 0.00 0.00 0.00 47.33 46.94 1yq2 h GLY 776 CO 0.00 -0.14 0.40 -1.36 0.00 0.00 0.00 176.54 175.44 1yq2 s PHE 777 N -2.82 2.15 1.06 5.60 0.08 -1.26 -5.01 117.98 117.78 1yq2 s PHE 777 Ca -0.05 1.58 -0.16 0.00 0.12 0.00 0.00 56.93 58.42 1yq2 s PHE 777 Cb 0.01 -3.44 0.22 0.00 -0.57 0.00 0.00 43.02 39.24 1yq2 s PHE 777 CO 0.16 -2.47 1.16 0.20 -0.10 0.00 0.00 175.22 174.17 1yq2 s GLY 778 N -2.05 1.62 0.31 4.36 0.00 -0.61 -4.81 107.32 106.14 1yq2 s GLY 778 Ca 0.74 -0.82 -0.15 0.00 0.00 0.00 0.00 44.72 44.49 1yq2 s GLY 778 CO 0.44 -0.07 0.72 0.00 0.00 0.00 0.00 173.10 174.18 1yq2 s ALA 779 N -3.24 3.35 -0.89 3.20 0.00 -0.39 -4.28 121.76 119.50 1yq2 s ALA 779 Ca 0.69 0.02 0.26 0.00 0.00 0.00 0.00 51.96 52.93 1yq2 s ALA 779 Cb -0.11 -2.74 0.69 0.00 0.00 0.00 0.00 23.12 20.96 1yq2 s ALA 779 CO 0.55 0.35 1.56 0.66 0.00 0.00 0.00 175.76 178.88 1yq2 n TYR 780 N -0.31 0.21 0.42 0.00 0.53 -1.26 -1.46 117.16 115.29 1yq2 n TYR 780 Ca 0.03 0.06 -0.20 0.00 -1.02 0.00 0.00 57.90 56.78 1yq2 n TYR 780 Cb 0.53 -0.47 -0.10 0.00 -1.03 0.00 0.00 39.34 38.27 1yq2 n TYR 780 CO 0.00 0.00 0.00 0.78 -1.02 0.00 0.00 176.86 176.62 1yq2 h GLY 781 N 4.84 -1.32 1.14 2.72 0.00 -1.94 -3.28 103.07 105.23 1yq2 h GLY 781 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1yq2 h GLY 781 CO 0.00 -0.45 0.00 -1.05 0.00 0.00 0.00 176.54 175.04 1yq2 n PRO 782 N -5.62 0.21 -3.83 4.80 -0.02 -1.26 -4.82 135.00 124.46 1yq2 n PRO 782 Ca -0.15 0.05 -0.07 0.00 -2.02 0.00 0.00 63.50 61.31 1yq2 n PRO 782 Cb 0.50 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.48 1yq2 n PRO 782 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1yq2 s GLY 783 N -2.14 0.10 -0.00 -1.23 0.00 -1.24 -5.09 107.32 97.73 1yq2 s GLY 783 Ca 0.10 -0.47 -0.30 0.00 0.00 0.00 0.00 44.72 44.06 1yq2 s GLY 783 CO 0.09 -0.06 2.01 -0.35 0.00 0.00 0.00 173.10 174.80 1yq2 s ASP 784 N -3.01 6.28 0.41 1.64 -1.08 -1.26 -4.85 116.67 114.80 1yq2 s ASP 784 Ca 0.13 2.55 0.29 0.00 -0.52 0.00 0.00 52.55 55.01 1yq2 s ASP 784 Cb -0.05 -2.53 1.31 0.00 -1.46 0.00 0.00 42.92 40.19 1yq2 s ASP 784 CO 0.08 -1.20 1.87 1.55 0.52 0.00 0.00 175.17 177.99 1yq2 h PRO 785 N 11.35 0.00 0.00 4.34 0.13 -1.96 -1.14 132.00 144.72 1yq2 h PRO 785 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1yq2 h PRO 785 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1yq2 h PRO 785 CO 0.94 0.00 0.00 0.91 -0.23 0.00 0.00 178.00 179.62 1yq2 n TRP 786 N -2.60 0.35 -2.06 1.56 7.02 -1.26 -3.72 117.44 116.73 1yq2 n TRP 786 Ca 0.00 0.11 -0.28 0.00 -1.02 0.00 0.00 57.50 56.31 1yq2 n TRP 786 Cb 0.20 -0.67 0.06 0.00 -2.42 0.00 0.00 31.31 28.48 1yq2 n TRP 786 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1yq2 s LEU 787 N -3.58 2.83 -1.47 -0.99 1.02 -0.43 -4.21 118.68 111.85 1yq2 s LEU 787 Ca 0.11 0.80 -0.11 0.00 0.02 0.00 0.00 54.13 54.96 1yq2 s LEU 787 Cb 0.15 -3.48 0.06 0.00 0.02 0.00 0.00 46.19 42.94 1yq2 s LEU 787 CO 0.50 -1.51 0.81 -3.20 0.02 0.00 0.00 176.35 172.98 1yq2 n ASN 788 N -3.00 -4.96 -2.13 2.29 5.15 -1.26 -0.96 115.26 110.40 1yq2 n ASN 788 Ca 0.07 -0.57 -0.18 0.00 -0.60 0.00 0.00 54.58 53.30 1yq2 n ASN 788 Cb 0.59 -3.99 -0.03 0.00 -0.53 0.00 0.00 39.78 35.82 1yq2 n ASN 788 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1yq2 n SER 789 N -2.66 -5.09 -1.45 1.20 7.64 -1.26 -1.58 113.62 110.42 1yq2 n SER 789 Ca -0.00 0.18 -0.16 0.00 1.01 0.00 0.00 58.87 59.90 1yq2 n SER 789 Cb 0.55 -4.35 -0.05 0.00 -1.01 0.00 0.00 64.21 59.35 1yq2 n SER 789 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yq2 n GLY 790 N -0.75 0.94 0.45 0.23 0.00 -0.13 -3.87 105.19 102.05 1yq2 n GLY 790 Ca -0.20 -0.24 0.13 0.00 0.00 0.00 0.00 46.02 45.71 1yq2 n GLY 790 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 n ARG 791 N -2.54 1.61 0.00 1.61 1.74 -0.61 -4.77 116.66 113.70 1yq2 n ARG 791 Ca -0.17 -0.89 0.00 0.00 -0.77 0.00 0.00 57.85 56.01 1yq2 n ARG 791 Cb 0.57 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 1yq2 n ARG 791 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yq2 n GLY 792 N 1.14 -0.47 3.20 -0.13 0.00 -1.26 -1.57 105.19 106.09 1yq2 n GLY 792 Ca 0.19 -1.08 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 1yq2 n GLY 792 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yq2 s VAL 793 N 0.00 2.36 0.13 1.61 1.01 -0.54 -4.73 120.40 120.25 1yq2 s VAL 793 Ca 0.00 -0.86 -0.34 0.00 0.00 0.00 0.00 61.98 60.78 1yq2 s VAL 793 Cb 0.00 -1.99 -0.16 0.00 0.00 0.00 0.00 36.38 34.23 1yq2 s VAL 793 CO 0.00 0.53 1.18 -2.65 0.00 0.00 0.00 175.10 174.16 1yq2 n PRO 794 N 4.28 1.02 -3.53 2.72 -0.02 -1.26 -1.27 135.00 136.94 1yq2 n PRO 794 Ca -0.20 0.37 -0.13 0.00 -2.02 0.00 0.00 63.50 61.52 1yq2 n PRO 794 Cb 0.51 -1.89 -0.04 0.00 -0.02 0.00 0.00 33.50 32.06 1yq2 n PRO 794 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 s ALA 795 N -0.01 -1.82 1.11 3.55 0.00 -1.26 -4.83 121.76 118.49 1yq2 s ALA 795 Ca 0.78 1.27 -0.13 0.00 0.00 0.00 0.00 51.96 53.88 1yq2 s ALA 795 Cb -0.92 -0.09 0.25 0.00 0.00 0.00 0.00 23.12 22.36 1yq2 s ALA 795 CO 0.51 -0.45 1.05 -1.25 0.00 0.00 0.00 175.76 175.62 1yq2 s PRO 796 N -1.81 -0.46 0.80 0.00 0.04 -1.26 -4.82 135.00 127.50 1yq2 s PRO 796 Ca -0.03 0.62 -0.12 0.00 0.04 0.00 0.00 61.00 61.51 1yq2 s PRO 796 Cb -0.00 -1.63 0.08 0.00 0.04 0.00 0.00 34.50 32.99 1yq2 s PRO 796 CO 0.01 -3.36 1.15 -1.54 0.04 0.00 0.00 177.00 173.30 1yq2 s SER 797 N -2.99 3.86 0.19 6.66 1.04 -1.26 -4.90 113.70 116.30 1yq2 s SER 797 Ca 0.67 2.14 -0.12 0.00 0.48 0.00 0.00 55.95 59.12 1yq2 s SER 797 Cb -0.22 -2.56 0.17 0.00 0.10 0.00 0.00 66.02 63.51 1yq2 s SER 797 CO 0.61 -2.47 1.77 0.28 0.98 0.00 0.00 173.24 174.41 1yq2 h SER 798 N -1.05 0.31 -0.74 7.02 0.02 -1.67 -2.48 113.55 114.96 1yq2 h SER 798 Ca -0.45 0.04 0.10 0.00 -0.84 0.00 0.00 61.79 60.65 1yq2 h SER 798 Cb 1.27 -0.01 -0.08 0.00 0.14 0.00 0.00 62.40 63.72 1yq2 h SER 798 CO 0.47 0.21 0.37 -0.08 -1.14 0.00 0.00 176.83 176.67 1yq2 h GLU 799 N 0.46 0.60 -0.43 3.45 4.81 -1.31 0.22 114.58 122.39 1yq2 h GLU 799 Ca 0.24 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1yq2 h GLU 799 Cb 0.20 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 1yq2 h GLU 799 CO -0.20 0.40 0.27 0.00 -0.73 0.00 0.00 179.01 178.74 1yq2 h ALA 800 N 1.46 0.54 -0.32 2.92 0.00 -1.73 -0.41 119.26 121.72 1yq2 h ALA 800 Ca 0.37 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 55.13 1yq2 h ALA 800 Cb 0.42 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1yq2 h ALA 800 CO -0.29 -0.04 -0.35 -0.39 0.00 0.00 0.00 179.25 178.18 1yq2 h VAL 801 N 0.54 1.28 -0.38 0.00 -1.51 -1.02 -1.79 116.25 113.37 1yq2 h VAL 801 Ca 0.16 -1.51 -0.05 0.00 -1.23 0.00 0.00 66.70 64.08 1yq2 h VAL 801 Cb -0.03 1.42 -0.01 0.00 -2.13 0.00 0.00 31.29 30.54 1yq2 h VAL 801 CO -0.06 0.49 0.06 -0.50 -1.23 0.00 0.00 177.57 176.33 1yq2 h TRP 802 N 0.60 0.67 -0.57 5.19 6.55 -0.68 -1.74 115.95 125.98 1yq2 h TRP 802 Ca 0.06 -0.10 -0.02 0.00 0.95 0.00 0.00 58.89 59.78 1yq2 h TRP 802 Cb 0.88 -0.18 -0.03 0.00 -0.86 0.00 0.00 29.16 28.97 1yq2 h TRP 802 CO 0.04 0.68 0.26 0.87 -1.05 0.00 0.00 178.44 179.25 1yq2 h LYS 803 N 0.47 0.82 -0.87 0.49 1.79 -1.05 -1.83 116.57 116.39 1yq2 h LYS 803 Ca 0.11 -0.13 0.03 0.00 -2.18 0.00 0.00 60.65 58.49 1yq2 h LYS 803 Cb 0.37 -0.15 -0.05 0.00 -1.58 0.00 0.00 32.23 30.83 1yq2 h LYS 803 CO 0.01 0.68 0.57 0.37 -1.08 0.00 0.00 179.45 179.99 1yq2 h GLN 804 N 0.77 1.05 0.00 3.15 4.15 -1.20 -1.49 115.11 121.54 1yq2 h GLN 804 Ca 0.19 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.55 1yq2 h GLN 804 Cb 0.13 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.58 1yq2 h GLN 804 CO -0.02 0.70 0.00 0.00 -1.93 0.00 0.00 178.83 177.57 1yq2 n ALA 805 N -2.40 2.21 -1.31 3.38 0.00 -0.66 -4.92 120.51 116.80 1yq2 n ALA 805 Ca 0.11 -0.10 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 1yq2 n ALA 805 Cb 0.10 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.12 1yq2 n ALA 805 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 806 N 1.14 0.50 0.27 0.00 0.00 -0.56 -4.77 105.19 101.77 1yq2 n GLY 806 Ca 0.07 -0.92 0.14 0.00 0.00 0.00 0.00 46.02 45.32 1yq2 n GLY 806 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1yq2 h LEU 807 N 0.00 0.00 0.00 0.99 3.38 -1.58 -0.60 115.31 117.50 1yq2 h LEU 807 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1yq2 h LEU 807 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1yq2 h LEU 807 CO 0.08 0.10 0.00 -0.90 0.09 0.00 0.00 178.44 177.80 1yq2 n ASP 808 N -3.47 0.00 -2.66 -0.43 5.75 -1.26 -3.83 116.55 110.65 1yq2 n ASP 808 Ca -0.01 0.36 -0.07 0.00 -0.01 0.00 0.00 54.79 55.06 1yq2 n ASP 808 Cb 0.24 -0.45 0.04 0.00 -1.03 0.00 0.00 41.12 39.92 1yq2 n ASP 808 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1yq2 n ARG 809 N -1.45 2.00 -1.96 0.11 1.85 -0.24 -4.94 116.66 112.03 1yq2 n ARG 809 Ca 0.08 -3.61 -0.41 0.00 -1.00 0.00 0.00 57.85 52.91 1yq2 n ARG 809 Cb 0.29 -1.68 -0.01 0.00 -1.05 0.00 0.00 32.46 30.01 1yq2 n ARG 809 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1yq2 s LEU 810 N -3.63 4.38 0.02 2.89 1.43 -1.20 -4.39 118.68 118.17 1yq2 s LEU 810 Ca 0.32 2.86 0.01 0.00 -1.03 0.00 0.00 54.13 56.29 1yq2 s LEU 810 Cb 0.36 -3.66 -0.04 0.00 0.03 0.00 0.00 46.19 42.89 1yq2 s LEU 810 CO -0.02 -0.70 0.04 0.42 0.23 0.00 0.00 176.35 176.32 1yq2 s THR 811 N -1.07 4.41 -0.22 5.49 -4.23 0.44 -4.91 115.64 115.56 1yq2 s THR 811 Ca 0.51 -0.61 -0.09 0.00 -1.18 0.00 0.00 61.69 60.32 1yq2 s THR 811 Cb -0.43 -3.03 -0.04 0.00 1.34 0.00 0.00 72.50 70.33 1yq2 s THR 811 CO 0.57 0.29 0.12 -0.60 -0.54 0.00 0.00 174.62 174.46 1yq2 s ARG 812 N -1.87 4.00 -0.12 3.99 3.52 -1.26 -2.02 118.95 125.19 1yq2 s ARG 812 Ca 0.23 -0.31 0.03 0.00 -0.13 0.00 0.00 55.73 55.55 1yq2 s ARG 812 Cb -0.12 -3.41 0.01 0.00 -1.56 0.00 0.00 34.95 29.87 1yq2 s ARG 812 CO 0.15 0.11 -0.22 0.50 -0.81 0.00 0.00 175.30 175.03 1yq2 s ARG 813 N 0.88 2.90 -0.18 5.12 3.52 -0.25 -4.98 118.95 125.96 1yq2 s ARG 813 Ca 0.06 -0.82 -0.27 0.00 -0.13 0.00 0.00 55.73 54.57 1yq2 s ARG 813 Cb -0.13 -2.29 -0.01 0.00 -1.56 0.00 0.00 34.95 30.96 1yq2 s ARG 813 CO 0.03 0.05 0.90 0.08 -0.81 0.00 0.00 175.30 175.55 1yq2 s VAL 814 N 0.65 4.82 -0.09 7.11 1.01 -1.26 -0.62 120.40 132.02 1yq2 s VAL 814 Ca -0.12 1.77 -0.18 0.00 0.00 0.00 0.00 61.98 63.46 1yq2 s VAL 814 Cb -0.16 -4.20 -0.28 0.00 0.00 0.00 0.00 36.38 31.74 1yq2 s VAL 814 CO 0.02 -0.03 0.64 -0.33 0.00 0.00 0.00 175.10 175.40 1yq2 h GLU 815 N 7.35 0.24 -2.31 2.72 5.08 -0.04 -3.48 114.58 124.14 1yq2 h GLU 815 Ca -0.27 -0.42 0.09 0.00 -1.00 0.00 0.00 59.36 57.77 1yq2 h GLU 815 Cb 1.12 0.16 -0.15 0.00 0.50 0.00 0.00 28.75 30.37 1yq2 h GLU 815 CO 0.87 1.20 0.46 0.16 -1.00 0.00 0.00 179.01 180.70 1yq2 s ASP 816 N -6.99 -0.39 -0.02 1.42 3.84 -0.87 -5.00 116.67 108.65 1yq2 s ASP 816 Ca -0.19 0.03 0.01 0.00 -0.00 0.00 0.00 52.55 52.40 1yq2 s ASP 816 Cb 0.03 0.40 0.02 0.00 -1.38 0.00 0.00 42.92 42.00 1yq2 s ASP 816 CO 0.77 -0.64 -0.01 -0.69 -0.00 0.00 0.00 175.17 174.61 1yq2 s VAL 817 N -3.05 0.19 -0.03 2.11 1.01 -1.26 -0.65 120.40 118.73 1yq2 s VAL 817 Ca 0.04 0.03 -0.11 0.00 0.00 0.00 0.00 61.98 61.94 1yq2 s VAL 817 Cb -0.01 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.14 1yq2 s VAL 817 CO -0.09 0.12 0.24 0.00 0.00 0.00 0.00 175.10 175.38 1yq2 s ALA 818 N 0.71 -0.61 0.51 5.51 0.00 -0.35 -5.01 121.76 122.52 1yq2 s ALA 818 Ca -0.07 0.30 -0.22 0.00 0.00 0.00 0.00 51.96 51.97 1yq2 s ALA 818 Cb -0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 23.12 22.90 1yq2 s ALA 818 CO -0.01 -0.21 1.25 0.00 0.00 0.00 0.00 175.76 176.79 1yq2 s ALA 819 N -0.94 2.87 0.29 0.00 0.00 -1.25 -0.23 121.76 122.50 1yq2 s ALA 819 Ca -0.10 1.10 0.11 0.00 0.00 0.00 0.00 51.96 53.07 1yq2 s ALA 819 Cb -0.05 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.56 1yq2 s ALA 819 CO 0.02 -0.99 -0.15 -0.51 0.00 0.00 0.00 175.76 174.13 1yq2 s LEU 820 N -3.32 2.71 -0.21 0.00 1.43 -0.46 -0.30 118.68 118.54 1yq2 s LEU 820 Ca 0.68 -0.99 -0.34 0.00 -1.03 0.00 0.00 54.13 52.45 1yq2 s LEU 820 Cb -0.34 -1.19 -0.10 0.00 0.03 0.00 0.00 46.19 44.59 1yq2 s LEU 820 CO 0.40 -0.01 2.05 -2.65 0.23 0.00 0.00 176.35 176.37 1yq2 n PRO 821 N -0.70 1.72 -4.01 1.29 -0.02 -1.26 -1.47 135.00 130.56 1yq2 n PRO 821 Ca -0.05 0.56 -0.26 0.00 -2.02 0.00 0.00 63.50 61.72 1yq2 n PRO 821 Cb 0.60 -2.68 -0.03 0.00 -0.02 0.00 0.00 33.50 31.37 1yq2 n PRO 821 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1yq2 n ASP 822 N 8.72 -0.23 -1.39 2.55 8.00 -1.26 -4.79 116.55 128.14 1yq2 n ASP 822 Ca 0.31 -1.04 -0.00 0.00 0.71 0.00 0.00 54.79 54.76 1yq2 n ASP 822 Cb 0.30 -2.86 0.00 0.00 -0.02 0.00 0.00 41.12 38.54 1yq2 n ASP 822 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yq2 n GLY 823 N -2.04 1.00 3.16 0.44 0.00 -0.54 -1.36 105.19 105.85 1yq2 n GLY 823 Ca -0.30 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 1yq2 n GLY 823 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1yq2 s ILE 824 N -2.38 -0.00 -0.12 -0.61 2.07 -0.12 -1.36 121.20 118.69 1yq2 s ILE 824 Ca 0.04 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.29 1yq2 s ILE 824 Cb -0.00 -0.40 -0.02 0.00 0.13 0.00 0.00 42.46 42.17 1yq2 s ILE 824 CO 0.01 0.00 -0.13 -0.60 -1.91 0.00 0.00 174.94 172.30 1yq2 s ARG 825 N 0.19 3.24 -0.12 3.50 3.52 0.68 -1.04 118.95 128.91 1yq2 s ARG 825 Ca -0.00 -0.69 0.02 0.00 -0.13 0.00 0.00 55.73 54.93 1yq2 s ARG 825 Cb -0.02 -2.59 0.01 0.00 -1.56 0.00 0.00 34.95 30.79 1yq2 s ARG 825 CO 0.00 0.28 -0.18 0.08 -0.81 0.00 0.00 175.30 174.68 1yq2 s VAL 826 N 0.17 1.70 -0.15 7.11 1.01 -0.43 -1.21 120.40 128.60 1yq2 s VAL 826 Ca -0.07 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.14 1yq2 s VAL 826 Cb -0.15 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 1yq2 s VAL 826 CO 0.05 0.48 -0.13 -0.13 0.00 0.00 0.00 175.10 175.37 1yq2 s ARG 827 N 0.92 3.31 0.23 2.72 0.52 0.18 -1.10 118.95 125.74 1yq2 s ARG 827 Ca -0.07 -0.71 0.04 0.00 -0.52 0.00 0.00 55.73 54.47 1yq2 s ARG 827 Cb -0.15 -2.68 -0.05 0.00 0.52 0.00 0.00 34.95 32.59 1yq2 s ARG 827 CO -0.02 0.07 -0.01 0.95 0.02 0.00 0.00 175.30 176.31 1yq2 s THR 828 N 0.71 1.08 -0.04 0.02 -4.23 -0.03 0.71 115.64 113.87 1yq2 s THR 828 Ca -0.06 -2.04 0.01 0.00 -1.18 0.00 0.00 61.69 58.42 1yq2 s THR 828 Cb -0.15 -2.33 0.02 0.00 1.34 0.00 0.00 72.50 71.37 1yq2 s THR 828 CO 0.02 -0.34 -0.05 -0.60 -0.54 0.00 0.00 174.62 173.11 1yq2 s ARG 829 N -3.85 0.88 -0.08 3.99 6.06 0.21 -0.78 118.95 125.39 1yq2 s ARG 829 Ca 0.28 -0.14 0.01 0.00 -2.50 0.00 0.00 55.73 53.38 1yq2 s ARG 829 Cb 0.05 -0.86 -0.03 0.00 0.06 0.00 0.00 34.95 34.18 1yq2 s ARG 829 CO 0.09 -0.05 -0.07 0.71 -2.50 0.00 0.00 175.30 173.47 1yq2 s TYR 830 N 0.81 2.93 -0.06 5.12 2.02 0.20 -1.09 117.35 127.27 1yq2 s TYR 830 Ca -0.11 -0.04 -0.30 0.00 -0.37 0.00 0.00 57.07 56.25 1yq2 s TYR 830 Cb -0.14 -1.73 0.09 0.00 -0.40 0.00 0.00 41.96 39.78 1yq2 s TYR 830 CO 0.01 0.27 0.78 0.00 -1.57 0.00 0.00 175.55 175.04 1yq2 s ALA 831 N -0.66 -1.81 0.32 3.71 0.00 -0.85 -0.65 121.76 121.81 1yq2 s ALA 831 Ca 0.10 1.32 -0.14 0.00 0.00 0.00 0.00 51.96 53.24 1yq2 s ALA 831 Cb -0.11 -0.12 -0.08 0.00 0.00 0.00 0.00 23.12 22.80 1yq2 s ALA 831 CO 0.02 -0.40 0.72 0.00 0.00 0.00 0.00 175.76 176.09 1yq2 s ALA 832 N -1.49 3.35 0.36 0.00 0.00 -1.26 -0.42 121.76 122.30 1yq2 s ALA 832 Ca -0.06 -0.03 -0.27 0.00 0.00 0.00 0.00 51.96 51.60 1yq2 s ALA 832 Cb -0.00 -2.72 -0.12 0.00 0.00 0.00 0.00 23.12 20.28 1yq2 s ALA 832 CO 0.04 0.31 1.11 0.00 0.00 0.00 0.00 175.76 177.23 1yq2 n ALA 833 N -0.46 0.48 -1.28 0.00 0.00 -1.26 -2.28 120.51 115.71 1yq2 n ALA 833 Ca 0.03 0.32 -0.10 0.00 0.00 0.00 0.00 53.44 53.69 1yq2 n ALA 833 Cb 0.53 -2.13 -0.04 0.00 0.00 0.00 0.00 19.45 17.81 1yq2 n ALA 833 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1yq2 n ASP 834 N 0.78 -4.90 -4.65 0.00 4.64 -1.26 -4.99 116.55 106.17 1yq2 n ASP 834 Ca 0.08 0.24 -0.31 0.00 -1.38 0.00 0.00 54.79 53.41 1yq2 n ASP 834 Cb 0.36 -3.25 -0.09 0.00 -1.04 0.00 0.00 41.12 37.10 1yq2 n ASP 834 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 1yq2 s SER 835 N -2.55 4.88 0.00 1.67 0.15 -0.97 -5.01 113.70 111.87 1yq2 s SER 835 Ca 0.00 -0.14 0.24 0.00 0.70 0.00 0.00 55.95 56.75 1yq2 s SER 835 Cb 0.00 -1.17 0.32 0.00 -1.71 0.00 0.00 66.02 63.46 1yq2 s SER 835 CO 0.00 0.24 1.28 0.35 1.20 0.00 0.00 173.24 176.31 1yq2 n THR 836 N 1.10 0.00 -3.42 6.45 -2.24 -1.26 -4.83 114.28 110.09 1yq2 n THR 836 Ca -0.13 -0.12 -0.24 0.00 -2.27 0.00 0.00 64.05 61.29 1yq2 n THR 836 Cb 0.52 0.71 -0.01 0.00 -2.10 0.00 0.00 70.33 69.45 1yq2 n THR 836 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1yq2 s HIS 837 N -2.69 3.50 0.25 4.78 3.76 -1.26 -5.02 115.29 118.61 1yq2 s HIS 837 Ca 0.17 0.36 -0.17 0.00 -0.15 0.00 0.00 55.06 55.27 1yq2 s HIS 837 Cb 0.18 -1.89 0.01 0.00 1.11 0.00 0.00 32.58 31.99 1yq2 s HIS 837 CO 0.63 0.15 0.59 -1.54 -0.85 0.00 0.00 174.74 173.72 1yq2 s SER 838 N -3.92 -0.19 -0.11 1.40 1.04 -1.26 -4.54 113.70 106.13 1yq2 s SER 838 Ca 0.40 -0.73 -0.01 0.00 0.48 0.00 0.00 55.95 56.08 1yq2 s SER 838 Cb -0.10 0.65 0.03 0.00 0.10 0.00 0.00 66.02 66.70 1yq2 s SER 838 CO 0.35 -1.22 -0.03 -0.69 0.98 0.00 0.00 173.24 172.64 1yq2 s VAL 839 N -3.96 0.70 0.29 5.02 1.01 0.17 -0.71 120.40 122.93 1yq2 s VAL 839 Ca 0.16 -0.19 -0.25 0.00 0.00 0.00 0.00 61.98 61.70 1yq2 s VAL 839 Cb -0.03 -0.86 -0.09 0.00 0.00 0.00 0.00 36.38 35.40 1yq2 s VAL 839 CO 0.07 0.22 0.89 0.00 0.00 0.00 0.00 175.10 176.28 1yq2 s ALA 840 N 1.83 3.27 -0.03 5.51 0.00 -0.70 -0.63 121.76 131.01 1yq2 s ALA 840 Ca 0.04 0.45 0.02 0.00 0.00 0.00 0.00 51.96 52.46 1yq2 s ALA 840 Cb -0.13 -3.10 0.01 0.00 0.00 0.00 0.00 23.12 19.90 1yq2 s ALA 840 CO -0.07 0.21 -0.06 0.08 0.00 0.00 0.00 175.76 175.92 1yq2 s VAL 841 N -1.56 0.60 -0.07 0.00 1.01 0.04 -0.84 120.40 119.59 1yq2 s VAL 841 Ca 0.48 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.24 1yq2 s VAL 841 Cb -0.19 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1yq2 s VAL 841 CO 0.24 0.20 -0.14 -0.70 0.00 0.00 0.00 175.10 174.70 1yq2 s GLU 842 N 0.36 1.84 -0.17 2.72 2.12 -0.42 -0.85 118.70 124.30 1yq2 s GLU 842 Ca -0.05 -0.48 -0.02 0.00 0.36 0.00 0.00 54.97 54.78 1yq2 s GLU 842 Cb -0.09 -1.50 -0.01 0.00 0.26 0.00 0.00 34.13 32.79 1yq2 s GLU 842 CO 0.00 0.06 -0.09 -1.21 -0.54 0.00 0.00 175.26 173.49 1yq2 s GLU 843 N 0.56 3.39 -0.33 4.30 2.02 -0.25 -0.91 118.70 127.47 1yq2 s GLU 843 Ca -0.14 -0.65 -0.01 0.00 0.02 0.00 0.00 54.97 54.19 1yq2 s GLU 843 Cb -0.16 -2.81 0.07 0.00 0.10 0.00 0.00 34.13 31.33 1yq2 s GLU 843 CO 0.04 0.02 0.05 -0.80 0.02 0.00 0.00 175.26 174.59 1yq2 s ASN 844 N 0.88 4.94 -0.24 -0.19 0.01 0.07 -1.31 114.94 119.11 1yq2 s ASN 844 Ca -0.02 -1.55 -0.15 0.00 -0.71 0.00 0.00 52.86 50.43 1yq2 s ASN 844 Cb -0.15 -1.72 -0.04 0.00 0.41 0.00 0.00 41.25 39.75 1yq2 s ASN 844 CO 0.00 -0.34 0.39 0.26 -1.51 0.00 0.00 177.10 175.91 1yq2 s TRP 845 N 1.18 3.30 -0.02 2.20 0.52 -0.21 -1.42 118.94 124.50 1yq2 s TRP 845 Ca -0.01 0.51 -0.01 0.00 0.02 0.00 0.00 56.10 56.61 1yq2 s TRP 845 Cb -0.20 -2.56 0.02 0.00 -1.15 0.00 0.00 33.47 29.57 1yq2 s TRP 845 CO -0.03 -0.14 0.05 -0.65 0.02 0.00 0.00 176.95 176.21 1yq2 s GLN 846 N 1.76 0.03 -0.16 4.98 -0.21 0.33 -0.95 119.66 125.43 1yq2 s GLN 846 Ca 0.17 0.15 -0.26 0.00 0.02 0.00 0.00 55.36 55.44 1yq2 s GLN 846 Cb -0.15 -0.09 -0.02 0.00 1.00 0.00 0.00 33.01 33.75 1yq2 s GLN 846 CO 0.09 -0.08 0.84 -0.51 -2.12 0.00 0.00 175.29 173.51 1yq2 s LEU 847 N 0.53 4.19 -0.11 2.90 1.43 -0.46 -0.28 118.68 126.87 1yq2 s LEU 847 Ca -0.04 1.21 -0.06 0.00 -1.03 0.00 0.00 54.13 54.20 1yq2 s LEU 847 Cb -0.06 -3.26 0.05 0.00 0.03 0.00 0.00 46.19 42.95 1yq2 s LEU 847 CO -0.02 -0.39 0.27 -0.62 0.23 0.00 0.00 176.35 175.82 1yq2 s ASP 848 N 1.14 -0.30 -1.66 2.29 -1.08 0.02 -4.88 116.67 112.19 1yq2 s ASP 848 Ca 0.39 0.58 -0.02 0.00 -0.52 0.00 0.00 52.55 52.98 1yq2 s ASP 848 Cb -0.17 0.47 0.00 0.00 -1.46 0.00 0.00 42.92 41.76 1yq2 s ASP 848 CO 0.13 -0.17 0.24 0.61 0.52 0.00 0.00 175.17 176.51 1yq2 n GLY 849 N 4.18 -0.48 2.65 2.66 0.00 -1.26 -0.93 105.19 112.01 1yq2 n GLY 849 Ca -0.25 0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1yq2 n GLY 849 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 850 N -1.22 0.59 3.43 -0.02 0.00 -1.26 -5.02 105.19 101.70 1yq2 n GLY 850 Ca -0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 1yq2 n GLY 850 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yq2 s GLU 851 N -0.29 1.57 -0.41 1.61 2.02 -0.10 -5.08 118.70 118.02 1yq2 s GLU 851 Ca 0.00 -1.30 -0.25 0.00 0.02 0.00 0.00 54.97 53.44 1yq2 s GLU 851 Cb 0.00 -1.98 0.02 0.00 0.10 0.00 0.00 34.13 32.27 1yq2 s GLU 851 CO 0.00 0.46 0.90 -1.17 0.02 0.00 0.00 175.26 175.46 1yq2 s LEU 852 N -2.17 4.03 -0.13 1.80 2.96 -1.26 -0.80 118.68 123.11 1yq2 s LEU 852 Ca 0.16 0.33 -0.06 0.00 -0.22 0.00 0.00 54.13 54.35 1yq2 s LEU 852 Cb -0.10 -3.19 -0.04 0.00 0.50 0.00 0.00 46.19 43.36 1yq2 s LEU 852 CO 0.08 -0.92 0.09 0.00 -1.32 0.00 0.00 176.35 174.28 1yq2 s LEU 854 N -0.63 1.47 -0.21 0.00 2.96 0.16 -0.51 118.68 121.92 1yq2 s LEU 854 Ca 0.12 -0.71 -0.08 0.00 -0.22 0.00 0.00 54.13 53.23 1yq2 s LEU 854 Cb -0.12 -0.79 -0.04 0.00 0.50 0.00 0.00 46.19 45.74 1yq2 s LEU 854 CO 0.02 -0.23 0.09 -0.60 -1.32 0.00 0.00 176.35 174.32 1yq2 s ARG 855 N 1.71 3.94 -0.23 1.98 3.52 -0.50 -0.69 118.95 128.68 1yq2 s ARG 855 Ca -0.00 -0.35 0.01 0.00 -0.13 0.00 0.00 55.73 55.26 1yq2 s ARG 855 Cb -0.16 -3.33 0.03 0.00 -1.56 0.00 0.00 34.95 29.93 1yq2 s ARG 855 CO -0.07 0.12 -0.12 0.42 -0.81 0.00 0.00 175.30 174.84 1yq2 s ILE 856 N 0.82 2.41 -0.22 4.11 1.01 -0.13 -0.75 121.20 128.45 1yq2 s ILE 856 Ca 0.05 -1.18 -0.07 0.00 0.00 0.00 0.00 60.65 59.44 1yq2 s ILE 856 Cb -0.13 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 1yq2 s ILE 856 CO 0.02 0.24 0.06 -1.81 0.00 0.00 0.00 174.94 173.45 1yq2 s ASP 857 N 1.25 5.28 -0.21 3.58 1.01 -0.09 -0.71 116.67 126.78 1yq2 s ASP 857 Ca -0.01 -0.10 -0.02 0.00 0.71 0.00 0.00 52.55 53.13 1yq2 s ASP 857 Cb -0.17 -1.93 0.01 0.00 1.01 0.00 0.00 42.92 41.84 1yq2 s ASP 857 CO -0.07 0.05 -0.10 -0.63 0.21 0.00 0.00 175.17 174.62 1yq2 s ILE 858 N 1.12 2.82 -0.38 0.77 1.01 0.30 -1.30 121.20 125.54 1yq2 s ILE 858 Ca 0.04 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.97 1yq2 s ILE 858 Cb -0.14 -2.28 0.13 0.00 0.01 0.00 0.00 42.46 40.18 1yq2 s ILE 858 CO 0.03 0.43 0.20 0.42 0.00 0.00 0.00 174.94 176.03 1yq2 s THR 859 N 1.39 0.83 0.56 2.92 -4.23 -0.02 -1.66 115.64 115.43 1yq2 s THR 859 Ca 0.05 -2.01 -0.20 0.00 -1.18 0.00 0.00 61.69 58.35 1yq2 s THR 859 Cb -0.14 -1.60 -0.05 0.00 1.34 0.00 0.00 72.50 72.05 1yq2 s THR 859 CO -0.07 -0.89 1.20 -2.84 -0.54 0.00 0.00 174.62 171.48 1yq2 s PRO 860 N 0.87 3.17 1.13 3.99 0.02 -1.26 -1.73 135.00 141.20 1yq2 s PRO 860 Ca 0.16 1.81 -0.13 0.00 0.02 0.00 0.00 61.00 62.86 1yq2 s PRO 860 Cb -0.23 -2.03 0.27 0.00 0.02 0.00 0.00 34.50 32.53 1yq2 s PRO 860 CO -0.05 -1.04 1.04 -1.54 -0.33 0.00 0.00 177.00 175.08 1yq2 s SER 861 N -1.55 1.31 0.35 2.53 1.04 0.11 -4.88 113.70 112.61 1yq2 s SER 861 Ca 0.74 1.40 0.16 0.00 0.48 0.00 0.00 55.95 58.73 1yq2 s SER 861 Cb -0.30 -2.16 0.61 0.00 0.10 0.00 0.00 66.02 64.27 1yq2 s SER 861 CO 0.33 -3.98 1.71 0.00 0.98 0.00 0.00 173.24 172.28 1yq2 h ALA 862 N -2.47 1.01 0.00 5.32 0.00 -1.96 -3.37 119.26 117.79 1yq2 h ALA 862 Ca -0.60 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1yq2 h ALA 862 Cb 1.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1yq2 h ALA 862 CO 0.53 0.54 0.00 0.41 0.00 0.00 0.00 179.25 180.73 1yq2 n GLY 863 N 0.19 -0.95 3.67 0.00 0.00 -1.26 -4.90 105.19 101.95 1yq2 n GLY 863 Ca -0.01 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 1yq2 n GLY 863 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1yq2 s TRP 864 N -2.00 3.01 -0.40 1.61 0.52 -1.26 -4.92 118.94 115.50 1yq2 s TRP 864 Ca 0.40 1.10 0.11 0.00 0.02 0.00 0.00 56.10 57.72 1yq2 s TRP 864 Cb 0.18 -3.47 0.33 0.00 -1.15 0.00 0.00 33.47 29.36 1yq2 s TRP 864 CO 0.30 -1.55 0.73 -1.71 0.02 0.00 0.00 176.95 174.74 1yq2 n ASN 865 N 5.90 1.16 -3.44 2.95 5.15 -1.26 -4.84 115.26 120.88 1yq2 n ASN 865 Ca 0.12 -3.04 -0.13 0.00 -0.60 0.00 0.00 54.58 50.93 1yq2 n ASN 865 Cb 0.45 -0.62 -0.03 0.00 -0.53 0.00 0.00 39.78 39.06 1yq2 n ASN 865 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 1yq2 s LEU 866 N -2.38 -0.58 0.40 1.20 2.34 -1.26 -5.14 118.68 113.26 1yq2 s LEU 866 Ca 0.40 0.10 -0.27 0.00 0.06 0.00 0.00 54.13 54.42 1yq2 s LEU 866 Cb 0.32 2.58 -0.10 0.00 -0.56 0.00 0.00 46.19 48.43 1yq2 s LEU 866 CO -0.09 -0.91 1.44 -0.69 -1.06 0.00 0.00 176.35 175.04 1yq2 s VAL 867 N -3.38 2.16 -0.06 1.48 1.01 -1.26 -4.21 120.40 116.13 1yq2 s VAL 867 Ca -0.01 0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 1yq2 s VAL 867 Cb -0.01 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1yq2 s VAL 867 CO -0.10 0.03 0.06 0.26 0.00 0.00 0.00 175.10 175.35 1yq2 s TRP 868 N -1.16 3.28 0.23 5.22 0.51 -0.54 -4.90 118.94 121.58 1yq2 s TRP 868 Ca 0.56 0.26 -0.03 0.00 -2.12 0.00 0.00 56.10 54.76 1yq2 s TRP 868 Cb -0.44 -1.79 0.24 0.00 -0.81 0.00 0.00 33.47 30.67 1yq2 s TRP 868 CO 0.59 0.55 1.66 -1.35 -0.51 0.00 0.00 176.95 177.89 1yq2 h PRO 869 N 4.70 0.72 -2.47 4.98 0.11 -1.88 -3.39 132.00 134.78 1yq2 h PRO 869 Ca -0.51 -0.28 0.10 0.00 0.11 0.00 0.00 66.00 65.42 1yq2 h PRO 869 Cb 1.19 -0.04 -0.12 0.00 0.11 0.00 0.00 31.00 32.14 1yq2 h PRO 869 CO 0.58 0.87 0.42 -0.98 -0.21 0.00 0.00 178.00 178.68 1yq2 s ARG 870 N -4.62 1.04 -0.22 1.05 1.70 -1.18 -1.00 118.95 115.72 1yq2 s ARG 870 Ca -0.09 -0.45 -0.00 0.00 -0.47 0.00 0.00 55.73 54.72 1yq2 s ARG 870 Cb 0.13 0.44 0.06 0.00 -0.57 0.00 0.00 34.95 35.01 1yq2 s ARG 870 CO 0.82 -0.46 -0.03 0.42 -1.08 0.00 0.00 175.30 174.98 1yq2 s ILE 871 N -3.32 1.19 0.16 4.99 1.01 -0.40 -4.36 121.20 120.47 1yq2 s ILE 871 Ca 0.06 -0.98 -0.06 0.00 0.00 0.00 0.00 60.65 59.67 1yq2 s ILE 871 Cb -0.01 -1.53 0.02 0.00 0.01 0.00 0.00 42.46 40.95 1yq2 s ILE 871 CO -0.06 -0.12 0.33 0.61 0.00 0.00 0.00 174.94 175.69 1yq2 n GLY 872 N 4.80 1.59 3.15 6.18 0.00 -0.80 -0.10 105.19 120.00 1yq2 n GLY 872 Ca -0.11 -1.12 -0.22 0.00 0.00 0.00 0.00 46.02 44.58 1yq2 n GLY 872 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yq2 s VAL 873 N -2.62 1.19 -0.04 1.61 -7.23 -0.36 0.02 120.40 112.96 1yq2 s VAL 873 Ca 0.07 -0.89 0.01 0.00 -1.81 0.00 0.00 61.98 59.36 1yq2 s VAL 873 Cb -0.02 -1.04 -0.03 0.00 0.56 0.00 0.00 36.38 35.85 1yq2 s VAL 873 CO 0.05 0.14 -0.04 -0.60 -0.31 0.00 0.00 175.10 174.34 1yq2 s ARG 874 N -0.86 2.77 -0.04 4.82 3.52 0.11 -0.75 118.95 128.52 1yq2 s ARG 874 Ca 0.04 -0.57 0.05 0.00 -0.13 0.00 0.00 55.73 55.12 1yq2 s ARG 874 Cb -0.07 -2.63 -0.01 0.00 -1.56 0.00 0.00 34.95 30.68 1yq2 s ARG 874 CO 0.01 0.65 -0.21 -1.58 -0.81 0.00 0.00 175.30 173.36 1yq2 s TRP 875 N -0.93 2.01 -0.25 5.12 0.52 0.76 -1.06 118.94 125.12 1yq2 s TRP 875 Ca 0.15 -0.55 -0.11 0.00 0.02 0.00 0.00 56.10 55.61 1yq2 s TRP 875 Cb -0.11 -1.33 -0.05 0.00 -1.15 0.00 0.00 33.47 30.83 1yq2 s TRP 875 CO 0.05 -0.16 0.18 -0.51 0.02 0.00 0.00 176.95 176.53 1yq2 s ASP 876 N -0.14 6.10 0.34 2.95 1.11 0.48 -1.21 116.67 126.29 1yq2 s ASP 876 Ca -0.01 0.09 0.07 0.00 0.18 0.00 0.00 52.55 52.87 1yq2 s ASP 876 Cb -0.12 -2.11 -0.07 0.00 1.07 0.00 0.00 42.92 41.69 1yq2 s ASP 876 CO 0.02 0.02 -0.03 -0.76 1.18 0.00 0.00 175.17 175.60 1yq2 s LEU 877 N 1.29 2.62 0.65 1.23 1.43 0.10 -1.91 118.68 124.08 1yq2 s LEU 877 Ca 0.08 -1.28 -0.18 0.00 -1.03 0.00 0.00 54.13 51.72 1yq2 s LEU 877 Cb -0.14 -0.77 -0.01 0.00 0.03 0.00 0.00 46.19 45.30 1yq2 s LEU 877 CO 0.07 -0.38 1.28 -2.84 0.23 0.00 0.00 176.35 174.70 1yq2 s PRO 878 N -3.72 2.57 0.61 1.29 0.02 -1.26 -1.56 135.00 132.95 1yq2 s PRO 878 Ca 0.33 2.01 0.38 0.00 0.02 0.00 0.00 61.00 63.74 1yq2 s PRO 878 Cb 0.06 -1.85 1.96 0.00 0.02 0.00 0.00 34.50 34.68 1yq2 s PRO 878 CO 0.16 -1.57 2.22 1.79 -0.33 0.00 0.00 177.00 179.27 1yq2 h THR 879 N 0.52 0.15 0.00 0.99 1.35 -1.83 -2.23 112.91 111.86 1yq2 h THR 879 Ca -0.51 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.14 1yq2 h THR 879 Cb 1.33 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.93 1yq2 h THR 879 CO 0.53 0.02 0.00 -0.90 -0.25 0.00 0.00 175.52 174.92 1yq2 n ASP 880 N -3.26 0.00 -4.58 5.36 5.68 -1.26 -4.48 116.55 114.01 1yq2 n ASP 880 Ca -0.02 -0.48 -0.42 0.00 -0.50 0.00 0.00 54.79 53.37 1yq2 n ASP 880 Cb 0.16 -0.16 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 1yq2 n ASP 880 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1yq2 s VAL 881 N -2.31 3.94 -0.02 2.12 1.01 -0.84 -3.68 120.40 120.61 1yq2 s VAL 881 Ca 0.35 0.85 0.03 0.00 0.00 0.00 0.00 61.98 63.21 1yq2 s VAL 881 Cb 0.19 -4.55 0.04 0.00 0.00 0.00 0.00 36.38 32.07 1yq2 s VAL 881 CO 0.39 -1.18 1.02 -0.90 0.00 0.00 0.00 175.10 174.43 1yq2 n ASP 882 N 8.84 0.33 -3.71 3.32 3.85 -0.77 -4.82 116.55 123.59 1yq2 n ASP 882 Ca 0.11 -2.15 -0.05 0.00 -0.71 0.00 0.00 54.79 51.99 1yq2 n ASP 882 Cb 0.49 -0.23 -0.02 0.00 -1.35 0.00 0.00 41.12 40.01 1yq2 n ASP 882 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1yq2 s GLY 883 N -1.26 -0.27 0.00 6.12 0.00 -1.21 -1.89 107.32 108.81 1yq2 s GLY 883 Ca 0.04 0.21 -0.09 0.00 0.00 0.00 0.00 44.72 44.89 1yq2 s GLY 883 CO 0.00 0.05 0.17 0.00 0.00 0.00 0.00 173.10 173.32 1yq2 s ALA 884 N -3.40 -0.39 0.06 3.20 0.00 -0.15 -1.09 121.76 119.98 1yq2 s ALA 884 Ca 0.10 -0.09 0.08 0.00 0.00 0.00 0.00 51.96 52.05 1yq2 s ALA 884 Cb -0.02 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 1yq2 s ALA 884 CO 0.00 -0.23 -0.21 0.00 0.00 0.00 0.00 175.76 175.32 1yq2 s ALA 885 N -1.52 1.78 0.12 0.00 0.00 -0.37 -0.83 121.76 120.94 1yq2 s ALA 885 Ca -0.14 -1.11 -0.15 0.00 0.00 0.00 0.00 51.96 50.56 1yq2 s ALA 885 Cb -0.07 -0.32 0.03 0.00 0.00 0.00 0.00 23.12 22.77 1yq2 s ALA 885 CO 0.01 0.39 0.38 1.67 0.00 0.00 0.00 175.76 178.21 1yq2 s TRP 886 N -0.90 -0.17 -0.24 0.00 -2.14 -0.41 -0.35 118.94 114.73 1yq2 s TRP 886 Ca 0.07 -0.15 -0.03 0.00 2.66 0.00 0.00 56.10 58.64 1yq2 s TRP 886 Cb -0.09 0.23 0.01 0.00 -3.10 0.00 0.00 33.47 30.52 1yq2 s TRP 886 CO 0.02 -0.69 -0.04 0.12 -2.66 0.00 0.00 176.95 173.71 1yq2 s PHE 887 N -3.80 3.02 -4.12 1.66 5.36 -0.83 -0.63 117.98 118.63 1yq2 s PHE 887 Ca 0.03 -1.18 0.00 0.00 -0.96 0.00 0.00 56.93 54.82 1yq2 s PHE 887 Cb 0.02 -2.11 0.00 0.00 -0.34 0.00 0.00 43.02 40.60 1yq2 s PHE 887 CO -0.12 -0.62 0.00 0.41 -1.46 0.00 0.00 175.22 173.43 1yq2 n GLY 888 N 4.76 -0.51 3.73 13.12 0.00 -0.82 -0.23 105.19 125.24 1yq2 n GLY 888 Ca -0.17 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 1yq2 n GLY 888 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 889 N -1.00 3.52 0.00 4.61 0.00 -0.50 -2.10 121.76 126.29 1yq2 s ALA 889 Ca 0.00 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.04 1yq2 s ALA 889 Cb 0.00 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1yq2 s ALA 889 CO 0.00 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 175.64 1yq2 n GLY 890 N 2.62 0.84 0.14 0.00 0.00 -0.38 -4.25 105.19 104.16 1yq2 n GLY 890 Ca 0.07 -0.77 0.13 0.00 0.00 0.00 0.00 46.02 45.45 1yq2 n GLY 890 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yq2 h PRO 891 N 0.00 0.00 -6.63 1.61 0.13 -1.83 -0.15 132.00 125.12 1yq2 h PRO 891 Ca 0.00 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.69 1yq2 h PRO 891 Cb 0.00 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.16 1yq2 h PRO 891 CO 0.00 0.00 -0.15 1.03 -0.23 0.00 0.00 178.00 178.65 1yq2 s ARG 892 N -3.14 2.59 0.63 0.86 0.52 -1.26 -4.99 118.95 114.16 1yq2 s ARG 892 Ca 0.09 -1.15 -0.18 0.00 -0.52 0.00 0.00 55.73 53.98 1yq2 s ARG 892 Cb 0.10 -2.63 -0.03 0.00 0.52 0.00 0.00 34.95 32.91 1yq2 s ARG 892 CO 0.62 -0.56 1.11 -0.85 0.02 0.00 0.00 175.30 175.64 1yq2 n GLU 893 N -2.12 0.97 -3.79 3.54 0.28 -1.26 -4.86 120.64 113.41 1yq2 n GLU 893 Ca 0.09 0.38 -0.13 0.00 -0.16 0.00 0.00 57.16 57.35 1yq2 n GLU 893 Cb 0.60 -2.33 -0.09 0.00 1.43 0.00 0.00 31.44 31.04 1yq2 n GLU 893 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1yq2 s SER 894 N -1.33 -0.15 0.13 -1.84 1.04 -0.02 -4.98 113.70 106.55 1yq2 s SER 894 Ca 0.80 0.07 0.01 0.00 0.48 0.00 0.00 55.95 57.31 1yq2 s SER 894 Cb -0.40 0.32 -0.04 0.00 0.10 0.00 0.00 66.02 66.00 1yq2 s SER 894 CO 0.43 -0.39 -0.02 -0.31 0.98 0.00 0.00 173.24 173.94 1yq2 s TYR 895 N -1.16 1.00 0.41 5.02 1.51 -1.09 -4.41 117.35 118.62 1yq2 s TYR 895 Ca -0.12 -1.00 0.15 0.00 -1.01 0.00 0.00 57.07 55.09 1yq2 s TYR 895 Cb -0.05 -0.58 1.02 0.00 -0.11 0.00 0.00 41.96 42.24 1yq2 s TYR 895 CO 0.03 -0.23 1.88 -1.35 -1.11 0.00 0.00 175.55 174.77 1yq2 h PRO 896 N 2.85 0.45 -0.63 -1.71 0.11 -1.84 0.25 132.00 131.48 1yq2 h PRO 896 Ca -0.36 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1yq2 h PRO 896 Cb 1.18 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1yq2 h PRO 896 CO 0.63 0.30 0.00 -0.40 -0.21 0.00 0.00 178.00 178.32 1yq2 n ASP 897 N -4.51 3.92 -3.07 -2.05 5.75 -1.26 -4.55 116.55 110.78 1yq2 n ASP 897 Ca 0.17 -2.35 -0.19 0.00 -0.01 0.00 0.00 54.79 52.40 1yq2 n ASP 897 Cb 0.59 -0.52 -0.04 0.00 -1.03 0.00 0.00 41.12 40.13 1yq2 n ASP 897 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1yq2 n SER 898 N 0.88 -0.79 -0.12 -1.12 2.88 0.87 -3.94 113.62 112.28 1yq2 n SER 898 Ca 0.21 -2.84 0.03 0.00 -1.33 0.00 0.00 58.87 54.93 1yq2 n SER 898 Cb 0.74 0.09 -0.00 0.00 -0.75 0.00 0.00 64.21 64.29 1yq2 n SER 898 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1yq2 n MET 899 N 1.61 2.55 0.01 -1.46 2.81 -1.23 -2.66 117.12 118.75 1yq2 n MET 899 Ca 0.18 -0.42 -0.03 0.00 -1.81 0.00 0.00 57.70 55.62 1yq2 n MET 899 Cb 0.55 -0.93 0.22 0.00 -0.71 0.00 0.00 33.22 32.36 1yq2 n MET 899 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1yq2 h HIS 900 N 0.56 0.55 -0.65 2.03 3.86 -1.93 -2.95 115.15 116.62 1yq2 h HIS 900 Ca 0.00 -0.10 -0.33 0.00 -1.16 0.00 0.00 60.37 58.78 1yq2 h HIS 900 Cb 0.18 -0.14 -0.20 0.00 1.06 0.00 0.00 27.41 28.31 1yq2 h HIS 900 CO 0.00 0.66 0.42 0.00 0.86 0.00 0.00 177.93 179.87 1yq2 n ALA 901 N -2.48 4.52 -2.66 2.45 0.00 -1.26 -4.88 120.51 116.19 1yq2 n ALA 901 Ca 0.00 -1.90 -0.26 0.00 0.00 0.00 0.00 53.44 51.29 1yq2 n ALA 901 Cb 0.36 -1.29 -0.08 0.00 0.00 0.00 0.00 19.45 18.45 1yq2 n ALA 901 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1yq2 s THR 902 N -2.19 3.64 0.02 0.00 -4.23 -1.12 -4.68 115.64 107.08 1yq2 s THR 902 Ca 0.38 -1.55 0.04 0.00 -1.18 0.00 0.00 61.69 59.38 1yq2 s THR 902 Cb 0.32 -2.86 -0.02 0.00 1.34 0.00 0.00 72.50 71.29 1yq2 s THR 902 CO 0.07 -0.17 -0.12 -0.04 -0.54 0.00 0.00 174.62 173.83 1yq2 s MET 903 N -3.11 0.82 -0.43 3.99 -1.94 -0.07 -4.87 119.30 113.69 1yq2 s MET 903 Ca 0.28 -0.61 -0.27 0.00 -1.71 0.00 0.00 55.69 53.38 1yq2 s MET 903 Cb -0.09 -0.79 0.02 0.00 2.01 0.00 0.00 34.83 35.99 1yq2 s MET 903 CO 0.19 0.20 1.03 0.08 -0.01 0.00 0.00 175.02 176.51 1yq2 s VAL 904 N -0.69 4.40 0.22 -6.03 1.01 -1.26 -1.25 120.40 116.79 1yq2 s VAL 904 Ca 0.01 1.19 -0.13 0.00 0.00 0.00 0.00 61.98 63.05 1yq2 s VAL 904 Cb -0.07 -4.48 0.05 0.00 0.00 0.00 0.00 36.38 31.88 1yq2 s VAL 904 CO 0.01 -0.79 0.65 0.00 0.00 0.00 0.00 175.10 174.97 1yq2 n ALA 905 N 7.31 -1.58 -2.70 5.51 0.00 -0.89 -4.92 120.51 123.23 1yq2 n ALA 905 Ca 0.10 -0.85 -0.39 0.00 0.00 0.00 0.00 53.44 52.30 1yq2 n ALA 905 Cb 0.48 0.60 -0.05 0.00 0.00 0.00 0.00 19.45 20.48 1yq2 n ALA 905 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1yq2 s ARG 906 N -2.05 4.33 0.23 0.00 3.52 -1.26 -1.94 118.95 121.78 1yq2 s ARG 906 Ca 0.14 0.70 0.07 0.00 -0.13 0.00 0.00 55.73 56.50 1yq2 s ARG 906 Cb -0.03 -3.49 -0.05 0.00 -1.56 0.00 0.00 34.95 29.82 1yq2 s ARG 906 CO 0.07 -0.03 -0.10 -1.01 -0.81 0.00 0.00 175.30 173.42 1yq2 s HIS 907 N 1.18 1.74 -0.17 5.12 3.76 0.20 -4.98 115.29 122.14 1yq2 s HIS 907 Ca 0.32 -0.66 -0.15 0.00 -0.15 0.00 0.00 55.06 54.42 1yq2 s HIS 907 Cb -0.16 -0.90 0.05 0.00 1.11 0.00 0.00 32.58 32.67 1yq2 s HIS 907 CO 0.13 0.27 0.45 0.00 -0.85 0.00 0.00 174.74 174.75 1yq2 s ALA 908 N -3.06 -1.12 -0.15 -1.40 0.00 -1.26 -1.28 121.76 113.48 1yq2 s ALA 908 Ca 0.25 1.33 -0.16 0.00 0.00 0.00 0.00 51.96 53.38 1yq2 s ALA 908 Cb 0.02 -0.78 0.04 0.00 0.00 0.00 0.00 23.12 22.40 1yq2 s ALA 908 CO 0.08 -0.22 0.45 0.00 0.00 0.00 0.00 175.76 176.07 1yq2 s ALA 909 N 0.43 -1.12 0.97 0.00 0.00 -0.01 -5.00 121.76 117.03 1yq2 s ALA 909 Ca -0.02 1.20 -0.14 0.00 0.00 0.00 0.00 51.96 53.01 1yq2 s ALA 909 Cb -0.04 -0.65 0.17 0.00 0.00 0.00 0.00 23.12 22.60 1yq2 s ALA 909 CO -0.02 -0.22 1.16 -1.54 0.00 0.00 0.00 175.76 175.14 1yq2 s SER 910 N 0.06 3.03 0.26 0.00 1.04 -1.26 -0.98 113.70 115.85 1yq2 s SER 910 Ca -0.01 0.83 -0.03 0.00 0.48 0.00 0.00 55.95 57.22 1yq2 s SER 910 Cb -0.03 -1.29 0.44 0.00 0.10 0.00 0.00 66.02 65.24 1yq2 s SER 910 CO 0.01 -2.84 1.82 -0.07 0.98 0.00 0.00 173.24 173.15 1yq2 h LEU 911 N -1.70 0.78 -1.16 2.42 3.38 -1.76 -0.59 115.31 116.68 1yq2 h LEU 911 Ca -0.49 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 1yq2 h LEU 911 Cb 1.31 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1yq2 h LEU 911 CO 0.55 0.44 -0.12 -0.33 0.09 0.00 0.00 178.44 179.06 1yq2 h GLU 912 N 0.88 0.44 0.00 1.13 5.08 -1.88 -2.59 114.58 117.63 1yq2 h GLU 912 Ca 0.43 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 1yq2 h GLU 912 Cb 0.38 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1yq2 h GLU 912 CO -0.25 0.56 -0.21 0.93 -1.00 0.00 0.00 179.01 179.04 1yq2 h GLU 913 N 0.41 0.00 0.02 2.33 5.08 -1.78 -3.32 114.58 117.30 1yq2 h GLU 913 Ca 0.08 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.18 1yq2 h GLU 913 Cb 0.46 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.73 1yq2 h GLU 913 CO 0.03 0.10 -1.03 -0.07 -1.00 0.00 0.00 179.01 177.04 1yq2 h LEU 914 N 0.00 0.74 -8.68 1.33 3.38 -0.74 -3.46 115.31 107.88 1yq2 h LEU 914 Ca -0.00 -0.61 -0.68 0.00 0.09 0.00 0.00 57.88 56.67 1yq2 h LEU 914 Cb 1.09 -0.23 -0.27 0.00 0.09 0.00 0.00 40.66 41.34 1yq2 h LEU 914 CO 0.01 1.41 -0.81 0.20 0.09 0.00 0.00 178.44 179.35 1yq2 s ASN 915 N -7.22 3.69 -0.09 -0.43 0.01 -1.09 -4.05 114.94 105.77 1yq2 s ASN 915 Ca -0.08 -0.34 -0.23 0.00 -0.71 0.00 0.00 52.86 51.50 1yq2 s ASN 915 Cb 0.08 -1.05 -0.03 0.00 0.41 0.00 0.00 41.25 40.65 1yq2 s ASN 915 CO 0.90 0.26 0.69 -0.69 -1.51 0.00 0.00 177.10 176.75 1yq2 s VAL 916 N -0.24 5.05 -1.39 1.60 1.01 -1.26 -4.84 120.40 120.33 1yq2 s VAL 916 Ca 0.00 1.40 -0.15 0.00 0.00 0.00 0.00 61.98 63.23 1yq2 s VAL 916 Cb -0.13 -4.02 0.03 0.00 0.00 0.00 0.00 36.38 32.26 1yq2 s VAL 916 CO 0.03 0.23 2.12 -0.81 0.00 0.00 0.00 175.10 176.68 1yq2 n PRO 917 N 3.95 2.81 -1.88 2.72 -0.04 -1.26 -4.94 135.00 136.36 1yq2 n PRO 917 Ca -0.01 -2.67 -0.39 0.00 -0.04 0.00 0.00 63.50 60.39 1yq2 n PRO 917 Cb 0.51 -3.31 0.02 0.00 -0.04 0.00 0.00 33.50 30.68 1yq2 n PRO 917 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1yq2 s TYR 918 N 3.59 2.47 0.28 0.54 1.51 -1.26 -4.90 117.35 119.59 1yq2 s TYR 918 Ca 0.49 1.36 0.03 0.00 -1.01 0.00 0.00 57.07 57.94 1yq2 s TYR 918 Cb 0.12 -3.78 0.67 0.00 -0.11 0.00 0.00 41.96 38.87 1yq2 s TYR 918 CO -0.04 -2.65 1.72 0.00 -1.11 0.00 0.00 175.55 173.46 1yq2 h ALA 919 N 1.96 1.41 -3.01 3.71 0.00 -1.93 -3.32 119.26 118.08 1yq2 h ALA 919 Ca -0.51 0.13 -0.67 0.00 0.00 0.00 0.00 54.91 53.87 1yq2 h ALA 919 Cb 1.28 0.08 -0.26 0.00 0.00 0.00 0.00 17.79 18.89 1yq2 h ALA 919 CO 0.59 -0.24 -0.64 0.50 0.00 0.00 0.00 179.25 179.46 1yq2 s ARG 920 N -5.91 3.24 0.25 0.00 3.52 -1.26 -4.41 118.95 114.37 1yq2 s ARG 920 Ca -0.12 -0.75 -0.31 0.00 -0.13 0.00 0.00 55.73 54.42 1yq2 s ARG 920 Cb 0.24 -3.31 -0.14 0.00 -1.56 0.00 0.00 34.95 30.19 1yq2 s ARG 920 CO 0.78 -0.36 1.34 -2.30 -0.81 0.00 0.00 175.30 173.96 1yq2 n PRO 921 N 4.87 1.91 -3.84 5.12 -0.02 -1.25 -4.95 135.00 136.84 1yq2 n PRO 921 Ca -0.15 0.68 -0.09 0.00 -2.02 0.00 0.00 63.50 61.92 1yq2 n PRO 921 Cb 0.49 -2.29 0.01 0.00 -0.02 0.00 0.00 33.50 31.69 1yq2 n PRO 921 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1yq2 s GLN 922 N -0.64 2.12 -0.21 -0.52 -2.07 -1.26 -4.66 119.66 112.42 1yq2 s GLN 922 Ca 0.67 -1.36 -0.42 0.00 -1.82 0.00 0.00 55.36 52.42 1yq2 s GLN 922 Cb -0.66 0.61 -0.19 0.00 -1.09 0.00 0.00 33.01 31.68 1yq2 s GLN 922 CO 0.52 -0.98 1.40 -1.91 -1.32 0.00 0.00 175.29 173.00 1yq2 n GLU 923 N -0.52 0.35 -3.48 9.60 4.07 0.27 -4.92 120.64 126.01 1yq2 n GLU 923 Ca -0.07 0.13 -0.12 0.00 -0.06 0.00 0.00 57.16 57.04 1yq2 n GLU 923 Cb 0.60 -1.68 -0.03 0.00 -0.06 0.00 0.00 31.44 30.27 1yq2 n GLU 923 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 1yq2 s THR 924 N 1.68 0.02 0.00 6.31 -1.32 -1.26 -4.75 115.64 116.32 1yq2 s THR 924 Ca 0.96 -0.15 0.00 0.00 -1.21 0.00 0.00 61.69 61.30 1yq2 s THR 924 Cb -1.27 -1.04 0.00 0.00 -1.51 0.00 0.00 72.50 68.68 1yq2 s THR 924 CO 0.66 -0.08 0.00 0.61 -2.21 0.00 0.00 174.62 173.60 1yq2 n GLY 925 N -0.25 0.71 3.68 6.08 0.00 -1.26 -4.89 105.19 109.27 1yq2 n GLY 925 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1yq2 n GLY 925 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1yq2 s HIS 926 N -2.68 2.24 -0.27 1.61 5.04 -1.26 -4.54 115.29 115.42 1yq2 s HIS 926 Ca 0.00 0.23 -0.09 0.00 -1.54 0.00 0.00 55.06 53.66 1yq2 s HIS 926 Cb 0.00 -3.98 -0.03 0.00 0.04 0.00 0.00 32.58 28.61 1yq2 s HIS 926 CO 0.00 -4.00 0.12 1.03 -2.34 0.00 0.00 174.74 169.56 1yq2 s ARG 927 N 3.07 3.68 0.44 2.88 1.81 0.12 -0.84 118.95 130.12 1yq2 s ARG 927 Ca 0.75 -0.48 -0.06 0.00 -1.72 0.00 0.00 55.73 54.22 1yq2 s ARG 927 Cb -0.39 -3.48 -0.04 0.00 -0.45 0.00 0.00 34.95 30.59 1yq2 s ARG 927 CO 0.32 -0.23 0.76 -1.12 -0.68 0.00 0.00 175.30 174.35 1yq2 s SER 928 N 1.66 6.34 -1.02 0.23 0.01 -1.26 -1.49 113.70 118.18 1yq2 s SER 928 Ca 0.06 0.95 -0.01 0.00 1.31 0.00 0.00 55.95 58.26 1yq2 s SER 928 Cb -0.16 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.82 1yq2 s SER 928 CO 0.06 -0.50 0.86 -0.67 0.41 0.00 0.00 173.24 173.40 1yq2 n ASP 929 N -1.91 -2.74 -4.68 2.44 2.03 -1.12 -1.41 116.55 109.16 1yq2 n ASP 929 Ca 0.01 -0.50 -0.39 0.00 0.52 0.00 0.00 54.79 54.42 1yq2 n ASP 929 Cb 0.55 -4.32 -0.06 0.00 -0.72 0.00 0.00 41.12 36.57 1yq2 n ASP 929 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1yq2 s VAL 930 N -3.29 5.07 -0.06 5.18 1.01 -0.02 -3.79 120.40 124.50 1yq2 s VAL 930 Ca 0.10 1.13 -0.18 0.00 0.00 0.00 0.00 61.98 63.03 1yq2 s VAL 930 Cb -0.04 -3.91 -0.31 0.00 0.00 0.00 0.00 36.38 32.12 1yq2 s VAL 930 CO 0.60 0.17 0.76 0.03 0.00 0.00 0.00 175.10 176.67 1yq2 h ARG 931 N 7.28 0.33 -2.30 2.72 -0.00 -0.90 -3.40 114.38 118.12 1yq2 h ARG 931 Ca -0.34 -0.56 -0.06 0.00 -0.50 0.00 0.00 59.98 58.52 1yq2 h ARG 931 Cb 1.16 0.21 -0.18 0.00 0.00 0.00 0.00 29.97 31.16 1yq2 h ARG 931 CO 0.76 1.27 0.13 1.67 0.00 0.00 0.00 179.97 183.80 1yq2 s TRP 932 N -2.49 -0.58 0.04 3.04 1.48 -1.24 -0.95 118.94 118.25 1yq2 s TRP 932 Ca -0.15 0.88 0.06 0.00 -1.06 0.00 0.00 56.10 55.83 1yq2 s TRP 932 Cb 0.03 0.39 -0.02 0.00 -1.16 0.00 0.00 33.47 32.71 1yq2 s TRP 932 CO 0.83 -0.62 -0.16 -1.17 -4.06 0.00 0.00 176.95 171.77 1yq2 s LEU 933 N -1.48 2.17 -0.10 -4.66 2.96 0.15 -1.97 118.68 115.76 1yq2 s LEU 933 Ca -0.09 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.37 1yq2 s LEU 933 Cb -0.01 -0.71 0.01 0.00 0.50 0.00 0.00 46.19 45.99 1yq2 s LEU 933 CO 0.05 0.07 -0.17 -1.61 -1.32 0.00 0.00 176.35 173.37 1yq2 s GLU 934 N -1.16 2.35 -0.11 1.98 2.02 0.52 -0.68 118.70 123.62 1yq2 s GLU 934 Ca 0.03 -0.62 -0.13 0.00 0.02 0.00 0.00 54.97 54.27 1yq2 s GLU 934 Cb -0.08 -1.90 -0.05 0.00 0.10 0.00 0.00 34.13 32.20 1yq2 s GLU 934 CO 0.01 0.03 0.30 -0.51 0.02 0.00 0.00 175.26 175.11 1yq2 s LEU 935 N 0.72 4.34 0.08 1.80 1.43 0.59 -1.23 118.68 126.41 1yq2 s LEU 935 Ca -0.12 0.63 0.05 0.00 -1.03 0.00 0.00 54.13 53.66 1yq2 s LEU 935 Cb -0.16 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 1yq2 s LEU 935 CO 0.03 0.22 -0.01 -1.81 0.23 0.00 0.00 176.35 175.01 1yq2 s ASP 936 N -0.26 4.97 -0.39 2.29 1.01 -0.25 -0.78 116.67 123.26 1yq2 s ASP 936 Ca 0.18 -0.17 -0.02 0.00 0.71 0.00 0.00 52.55 53.25 1yq2 s ASP 936 Cb -0.14 -1.18 0.11 0.00 1.01 0.00 0.00 42.92 42.72 1yq2 s ASP 936 CO 0.07 0.19 0.17 -0.13 0.21 0.00 0.00 175.17 175.67 1yq2 s ARG 937 N -2.19 1.92 -1.25 8.23 0.52 0.92 -1.84 118.95 125.26 1yq2 s ARG 937 Ca 0.24 -1.81 -0.03 0.00 -0.52 0.00 0.00 55.73 53.61 1yq2 s ARG 937 Cb -0.12 -3.50 -0.01 0.00 0.52 0.00 0.00 34.95 31.85 1yq2 s ARG 937 CO 0.17 -1.03 0.75 0.00 0.02 0.00 0.00 175.30 175.21 1yq2 n ALA 938 N 4.53 -2.12 0.00 2.13 0.00 -1.24 -1.92 120.51 121.89 1yq2 n ALA 938 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1yq2 n ALA 938 Cb 0.42 -2.60 0.00 0.00 0.00 0.00 0.00 19.45 17.27 1yq2 n ALA 938 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 939 N -1.52 2.87 3.61 0.00 0.00 -1.26 -4.99 105.19 103.91 1yq2 n GLY 939 Ca -0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 1yq2 n GLY 939 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 940 N -1.34 3.50 0.22 4.61 0.00 -0.81 -4.99 121.76 122.95 1yq2 s ALA 940 Ca 0.00 -0.39 -0.32 0.00 0.00 0.00 0.00 51.96 51.25 1yq2 s ALA 940 Cb 0.00 -3.39 -0.13 0.00 0.00 0.00 0.00 23.12 19.59 1yq2 s ALA 940 CO 0.00 -1.32 1.48 -2.30 0.00 0.00 0.00 175.76 173.63 1yq2 n PRO 941 N 6.39 2.13 0.04 0.00 -0.02 -1.26 -0.05 135.00 142.22 1yq2 n PRO 941 Ca 0.05 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1yq2 n PRO 941 Cb 0.48 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 1yq2 n PRO 941 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 1yq2 n TRP 942 N 2.45 -0.08 -4.83 6.00 -0.00 0.04 -4.70 117.44 116.33 1yq2 n TRP 942 Ca 0.13 0.01 -0.25 0.00 -0.00 0.00 0.00 57.50 57.39 1yq2 n TRP 942 Cb 0.31 0.03 -0.16 0.00 -0.00 0.00 0.00 31.31 31.49 1yq2 n TRP 942 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 177.69 176.52 1yq2 s LEU 943 N -6.66 1.97 -0.15 5.87 2.96 -1.02 -1.58 118.68 120.08 1yq2 s LEU 943 Ca 0.00 -0.33 -0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1yq2 s LEU 943 Cb 0.00 -0.93 -0.01 0.00 0.50 0.00 0.00 46.19 45.75 1yq2 s LEU 943 CO 0.00 0.18 -0.14 -0.60 -1.32 0.00 0.00 176.35 174.48 1yq2 s ARG 944 N -0.19 3.29 -0.18 1.98 6.06 0.24 -0.30 118.95 129.85 1yq2 s ARG 944 Ca 0.02 -0.72 0.00 0.00 -2.50 0.00 0.00 55.73 52.53 1yq2 s ARG 944 Cb -0.09 -2.65 0.01 0.00 0.06 0.00 0.00 34.95 32.28 1yq2 s ARG 944 CO 0.01 0.08 -0.17 0.42 -2.50 0.00 0.00 175.30 173.14 1yq2 s ILE 945 N 0.67 2.35 -0.10 4.11 1.01 0.15 -1.17 121.20 128.22 1yq2 s ILE 945 Ca -0.07 -0.85 -0.11 0.00 0.00 0.00 0.00 60.65 59.63 1yq2 s ILE 945 Cb -0.16 -2.00 -0.05 0.00 0.01 0.00 0.00 42.46 40.27 1yq2 s ILE 945 CO 0.02 0.52 0.24 -1.81 0.00 0.00 0.00 174.94 173.90 1yq2 s ASP 946 N 1.28 6.49 -0.12 3.58 1.01 -0.27 -0.67 116.67 127.97 1yq2 s ASP 946 Ca 0.04 0.58 0.02 0.00 0.71 0.00 0.00 52.55 53.90 1yq2 s ASP 946 Cb -0.13 -2.14 -0.00 0.00 1.01 0.00 0.00 42.92 41.65 1yq2 s ASP 946 CO -0.10 0.31 -0.20 0.00 0.21 0.00 0.00 175.17 175.39 1yq2 s ALA 947 N -0.63 2.33 -0.07 5.23 0.00 -0.12 -0.65 121.76 127.85 1yq2 s ALA 947 Ca 0.17 -0.98 -0.09 0.00 0.00 0.00 0.00 51.96 51.06 1yq2 s ALA 947 Cb -0.13 -0.99 -0.04 0.00 0.00 0.00 0.00 23.12 21.95 1yq2 s ALA 947 CO 0.06 0.18 0.22 -1.21 0.00 0.00 0.00 175.76 175.01 1yq2 s GLU 948 N 0.48 3.57 0.59 0.00 0.41 -0.27 -4.73 118.70 118.76 1yq2 s GLU 948 Ca -0.13 0.00 -0.20 0.00 -0.41 0.00 0.00 54.97 54.23 1yq2 s GLU 948 Cb -0.17 -3.18 -0.04 0.00 -1.78 0.00 0.00 34.13 28.97 1yq2 s GLU 948 CO 0.05 0.74 1.25 -2.30 -0.49 0.00 0.00 175.26 174.51 1yq2 n PRO 949 N 1.80 1.31 -0.41 0.39 -0.02 -1.26 -4.39 135.00 132.43 1yq2 n PRO 949 Ca -0.17 0.50 -0.06 0.00 -2.02 0.00 0.00 63.50 61.74 1yq2 n PRO 949 Cb 0.54 -2.47 0.05 0.00 -0.02 0.00 0.00 33.50 31.60 1yq2 n PRO 949 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1yq2 n ASP 950 N -1.26 -0.04 0.25 2.55 5.68 -0.64 -4.82 116.55 118.27 1yq2 n ASP 950 Ca 0.13 -1.08 0.08 0.00 -0.50 0.00 0.00 54.79 53.42 1yq2 n ASP 950 Cb 0.46 -0.22 0.64 0.00 -1.14 0.00 0.00 41.12 40.86 1yq2 n ASP 950 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1yq2 h ALA 951 N -1.96 1.85 -0.08 2.12 0.00 -1.95 -0.76 119.26 118.47 1yq2 h ALA 951 Ca -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1yq2 h ALA 951 Cb 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1yq2 h ALA 951 CO 0.07 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.38 1yq2 n ALA 952 N -2.50 2.55 -0.47 0.00 0.00 -1.26 -4.93 120.51 113.90 1yq2 n ALA 952 Ca -0.03 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1yq2 n ALA 952 Cb 0.13 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1yq2 n ALA 952 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 953 N 1.17 0.77 3.76 0.00 0.00 -0.29 -5.04 105.19 105.55 1yq2 n GLY 953 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1yq2 n GLY 953 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yq2 s ARG 954 N -0.53 4.63 0.02 1.61 0.52 -1.26 -4.71 118.95 119.22 1yq2 s ARG 954 Ca 0.00 1.25 0.01 0.00 -0.52 0.00 0.00 55.73 56.47 1yq2 s ARG 954 Cb 0.00 -3.31 -0.04 0.00 0.52 0.00 0.00 34.95 32.12 1yq2 s ARG 954 CO 0.00 0.43 0.05 1.03 0.02 0.00 0.00 175.30 176.83 1yq2 s ARG 955 N -0.68 2.92 0.93 3.54 0.52 -1.26 -1.63 118.95 123.29 1yq2 s ARG 955 Ca 0.39 -0.58 -0.14 0.00 -0.52 0.00 0.00 55.73 54.88 1yq2 s ARG 955 Cb -0.23 -2.76 0.16 0.00 0.52 0.00 0.00 34.95 32.64 1yq2 s ARG 955 CO 0.27 0.62 1.22 -1.25 0.02 0.00 0.00 175.30 176.18 1yq2 s PRO 956 N -1.85 0.91 0.48 3.54 0.04 -1.26 -4.41 135.00 132.45 1yq2 s PRO 956 Ca 0.23 -0.08 0.02 0.00 0.04 0.00 0.00 61.00 61.21 1yq2 s PRO 956 Cb -0.12 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.57 1yq2 s PRO 956 CO 0.15 -2.28 0.06 0.41 0.04 0.00 0.00 177.00 175.37 1yq2 n GLY 957 N -3.00 3.43 3.16 0.56 0.00 0.02 -0.84 105.19 108.53 1yq2 n GLY 957 Ca 0.11 -2.28 -0.09 0.00 0.00 0.00 0.00 46.02 43.76 1yq2 n GLY 957 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1yq2 s PHE 958 N -2.95 0.21 0.03 1.61 -0.12 -0.55 -0.95 117.98 115.26 1yq2 s PHE 958 Ca 0.08 -0.59 0.03 0.00 -0.05 0.00 0.00 56.93 56.40 1yq2 s PHE 958 Cb 0.00 -0.13 -0.02 0.00 -0.63 0.00 0.00 43.02 42.25 1yq2 s PHE 958 CO 0.06 -0.45 -0.09 -1.12 -0.05 0.00 0.00 175.22 173.56 1yq2 s SER 959 N -2.56 1.01 -0.14 1.98 0.01 -0.05 -0.70 113.70 113.26 1yq2 s SER 959 Ca 0.01 -0.41 0.02 0.00 1.31 0.00 0.00 55.95 56.88 1yq2 s SER 959 Cb 0.03 -0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.24 1yq2 s SER 959 CO -0.08 -0.07 -0.19 -0.22 0.41 0.00 0.00 173.24 173.08 1yq2 s LEU 960 N -1.10 1.97 0.10 2.44 2.96 -1.26 -0.92 118.68 122.87 1yq2 s LEU 960 Ca -0.04 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 53.33 1yq2 s LEU 960 Cb -0.07 -1.33 -0.04 0.00 0.50 0.00 0.00 46.19 45.24 1yq2 s LEU 960 CO 0.01 0.04 -0.06 0.00 -1.32 0.00 0.00 176.35 175.01 1yq2 s ALA 961 N 1.00 0.95 -1.46 5.97 0.00 0.04 -4.87 121.76 123.39 1yq2 s ALA 961 Ca -0.04 -1.35 0.26 0.00 0.00 0.00 0.00 51.96 50.84 1yq2 s ALA 961 Cb -0.15 0.19 0.72 0.00 0.00 0.00 0.00 23.12 23.89 1yq2 s ALA 961 CO -0.04 -0.25 1.55 0.54 0.00 0.00 0.00 175.76 177.55 1yq2 n ARG 962 N -0.04 0.50 -3.88 0.00 1.74 -1.26 0.18 116.66 113.90 1yq2 n ARG 962 Ca -0.12 -0.28 -0.09 0.00 -0.77 0.00 0.00 57.85 56.59 1yq2 n ARG 962 Cb 0.61 -1.49 -0.07 0.00 -1.02 0.00 0.00 32.46 30.48 1yq2 n ARG 962 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1yq2 s HIS 963 N -2.69 0.22 0.68 -1.55 3.76 -1.26 -4.58 115.29 109.87 1yq2 s HIS 963 Ca 0.20 -0.63 -0.11 0.00 -0.15 0.00 0.00 55.06 54.37 1yq2 s HIS 963 Cb 0.19 -0.06 -0.00 0.00 1.11 0.00 0.00 32.58 33.81 1yq2 s HIS 963 CO 0.58 -0.59 1.05 0.95 -0.85 0.00 0.00 174.74 175.89 1yq2 s THR 964 N -3.89 4.16 0.44 1.30 -4.23 -1.26 -4.83 115.64 107.34 1yq2 s THR 964 Ca 0.08 0.71 0.16 0.00 -1.18 0.00 0.00 61.69 61.46 1yq2 s THR 964 Cb 0.04 -3.50 0.34 0.00 1.34 0.00 0.00 72.50 70.73 1yq2 s THR 964 CO -0.08 -0.91 1.97 0.00 -0.54 0.00 0.00 174.62 175.06 1yq2 h ALA 965 N -0.61 2.09 -0.46 3.99 0.00 -1.97 -1.36 119.26 120.95 1yq2 h ALA 965 Ca -0.44 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 1yq2 h ALA 965 Cb 1.21 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1yq2 h ALA 965 CO 0.58 -0.24 0.15 1.96 0.00 0.00 0.00 179.25 181.69 1yq2 h GLN 966 N 0.36 0.71 -0.20 0.00 7.50 -1.92 -1.15 115.11 120.41 1yq2 h GLN 966 Ca 0.29 -0.15 -0.08 0.00 0.50 0.00 0.00 58.65 59.21 1yq2 h GLN 966 Cb 0.66 -0.10 -0.00 0.00 0.05 0.00 0.00 27.48 28.08 1yq2 h GLN 966 CO -0.08 0.68 -0.17 0.93 -1.50 0.00 0.00 178.83 178.69 1yq2 h GLU 967 N 0.60 0.48 -0.43 1.46 5.08 -1.75 -2.69 114.58 117.34 1yq2 h GLU 967 Ca 0.15 -0.24 0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1yq2 h GLU 967 Cb 0.26 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.46 1yq2 h GLU 967 CO -0.01 0.81 0.15 0.82 -1.00 0.00 0.00 179.01 179.78 1yq2 h ILE 968 N 0.16 0.86 -0.63 3.13 2.04 -1.30 -2.22 117.51 119.55 1yq2 h ILE 968 Ca 0.04 -0.11 0.06 0.00 1.00 0.00 0.00 64.86 65.85 1yq2 h ILE 968 Cb 0.71 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 1yq2 h ILE 968 CO 0.04 0.06 0.42 0.00 0.00 0.00 0.00 178.15 178.67 1yq2 h ALA 969 N 1.28 1.80 0.00 1.87 0.00 -1.10 -2.47 119.26 120.64 1yq2 h ALA 969 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1yq2 h ALA 969 Cb 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1yq2 h ALA 969 CO -0.21 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.14 1yq2 h ALA 970 N 1.66 1.00 -2.80 0.00 0.00 -1.06 -3.45 119.26 114.60 1yq2 h ALA 970 Ca 0.27 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.61 1yq2 h ALA 970 Cb 0.29 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 1yq2 h ALA 970 CO -0.08 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 179.10 1yq2 s ALA 971 N -3.38 3.47 -0.14 0.00 0.00 -0.93 -4.96 121.76 115.82 1yq2 s ALA 971 Ca 0.05 -0.06 0.16 0.00 0.00 0.00 0.00 51.96 52.10 1yq2 s ALA 971 Cb 0.08 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.46 1yq2 s ALA 971 CO 0.57 0.08 1.18 0.78 0.00 0.00 0.00 175.76 178.37 1yq2 h GLY 972 N 6.16 0.00 -4.79 0.00 0.00 -1.87 -3.37 103.07 99.21 1yq2 h GLY 972 Ca -0.43 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.73 1yq2 h GLY 972 CO 0.72 0.00 -0.70 0.30 0.00 0.00 0.00 176.54 176.86 1yq2 s HIS 973 N -2.95 0.30 0.30 5.60 3.76 -1.26 -4.37 115.29 116.67 1yq2 s HIS 973 Ca 0.01 -0.59 0.05 0.00 -0.15 0.00 0.00 55.06 54.38 1yq2 s HIS 973 Cb 0.08 -0.22 0.77 0.00 1.11 0.00 0.00 32.58 34.32 1yq2 s HIS 973 CO 0.78 -0.21 1.70 -1.35 -0.85 0.00 0.00 174.74 174.81 1yq2 h PRO 974 N 4.49 0.40 0.00 8.40 0.11 -1.86 -1.84 132.00 141.69 1yq2 h PRO 974 Ca -0.32 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1yq2 h PRO 974 Cb 1.20 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1yq2 h PRO 974 CO 0.44 0.27 0.00 -2.39 -0.21 0.00 0.00 178.00 176.10 1yq2 n HIS 975 N -5.03 0.04 1.38 0.65 1.44 -1.26 -1.97 115.22 110.47 1yq2 n HIS 975 Ca 0.23 0.02 0.14 0.00 -2.01 0.00 0.00 57.72 56.09 1yq2 n HIS 975 Cb 0.68 -0.52 0.43 0.00 0.12 0.00 0.00 29.99 30.70 1yq2 n HIS 975 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1yq2 n GLU 976 N -1.54 1.82 -2.72 -1.40 1.02 -0.69 -4.91 120.64 112.22 1yq2 n GLU 976 Ca 0.03 -1.18 -0.38 0.00 -0.02 0.00 0.00 57.16 55.61 1yq2 n GLU 976 Cb 0.16 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.05 1yq2 n GLU 976 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1yq2 s LEU 977 N -1.99 4.45 0.84 -4.62 1.43 -0.83 -4.92 118.68 113.04 1yq2 s LEU 977 Ca 0.36 1.94 -0.12 0.00 -1.03 0.00 0.00 54.13 55.28 1yq2 s LEU 977 Cb 0.21 -3.86 0.10 0.00 0.03 0.00 0.00 46.19 42.67 1yq2 s LEU 977 CO 0.33 -0.04 1.10 -2.16 0.23 0.00 0.00 176.35 175.81 1yq2 s PRO 978 N -1.74 1.71 0.20 1.29 0.04 -1.26 -4.96 135.00 130.28 1yq2 s PRO 978 Ca 0.47 0.68 -0.32 0.00 0.04 0.00 0.00 61.00 61.87 1yq2 s PRO 978 Cb -0.23 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 32.32 1yq2 s PRO 978 CO 0.29 -1.89 1.73 0.99 0.04 0.00 0.00 177.00 178.16 1yq2 s THR 979 N -3.08 2.09 0.37 1.26 2.01 -1.26 -4.92 115.64 112.12 1yq2 s THR 979 Ca 0.62 0.03 -0.28 0.00 0.31 0.00 0.00 61.69 62.37 1yq2 s THR 979 Cb -0.16 -3.02 -0.11 0.00 0.01 0.00 0.00 72.50 69.22 1yq2 s THR 979 CO 0.55 0.00 1.41 -2.65 -0.69 0.00 0.00 174.62 173.24 1yq2 n PRO 980 N 4.17 2.42 -0.00 4.92 -0.02 -1.26 -4.93 135.00 140.30 1yq2 n PRO 980 Ca 0.16 0.85 0.05 0.00 -2.02 0.00 0.00 63.50 62.54 1yq2 n PRO 980 Cb 0.36 -2.54 -0.07 0.00 -0.02 0.00 0.00 33.50 31.22 1yq2 n PRO 980 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1yq2 n SER 981 N 0.49 2.75 -4.13 2.55 3.41 -1.26 -5.03 113.62 112.40 1yq2 n SER 981 Ca 0.03 -0.03 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 1yq2 n SER 981 Cb 0.38 1.41 -0.08 0.00 -0.26 0.00 0.00 64.21 65.66 1yq2 n SER 981 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1yq2 s HIS 982 N -2.62 0.87 0.05 7.33 3.76 -1.26 -4.52 115.29 118.90 1yq2 s HIS 982 Ca -0.03 -1.15 0.02 0.00 -0.15 0.00 0.00 55.06 53.75 1yq2 s HIS 982 Cb 0.06 -0.31 -0.04 0.00 1.11 0.00 0.00 32.58 33.40 1yq2 s HIS 982 CO 0.39 -0.74 0.08 -1.12 -0.85 0.00 0.00 174.74 172.50 1yq2 s SER 983 N -3.10 5.56 -0.07 1.40 0.01 -0.60 -4.56 113.70 112.34 1yq2 s SER 983 Ca 0.32 0.04 0.04 0.00 1.31 0.00 0.00 55.95 57.66 1yq2 s SER 983 Cb 0.05 -1.52 0.00 0.00 0.21 0.00 0.00 66.02 64.75 1yq2 s SER 983 CO 0.10 0.21 -0.19 -0.31 0.41 0.00 0.00 173.24 173.46 1yq2 s TYR 984 N -1.32 1.99 -0.24 2.43 1.51 0.13 0.01 117.35 121.86 1yq2 s TYR 984 Ca 0.27 -0.73 -0.07 0.00 -1.01 0.00 0.00 57.07 55.53 1yq2 s TYR 984 Cb -0.12 -1.36 -0.03 0.00 -0.11 0.00 0.00 41.96 40.34 1yq2 s TYR 984 CO 0.19 -0.30 0.07 -1.17 -1.11 0.00 0.00 175.55 173.24 1yq2 s LEU 985 N 0.35 3.54 -0.23 -1.29 2.96 -0.35 -0.78 118.68 122.88 1yq2 s LEU 985 Ca -0.13 -0.14 -0.09 0.00 -0.22 0.00 0.00 54.13 53.54 1yq2 s LEU 985 Cb -0.16 -1.94 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 1yq2 s LEU 985 CO 0.05 0.01 0.13 -0.31 -1.32 0.00 0.00 176.35 174.91 1yq2 s TYR 986 N 1.37 3.27 -0.34 5.38 1.51 -0.10 -0.17 117.35 128.27 1yq2 s TYR 986 Ca 0.05 0.11 -0.07 0.00 -1.01 0.00 0.00 57.07 56.15 1yq2 s TYR 986 Cb -0.15 -2.23 0.03 0.00 -0.11 0.00 0.00 41.96 39.50 1yq2 s TYR 986 CO 0.04 0.02 0.11 0.08 -1.11 0.00 0.00 175.55 174.70 1yq2 s VAL 987 N 1.01 3.94 -0.22 0.71 1.01 0.07 -0.87 120.40 126.05 1yq2 s VAL 987 Ca 0.06 -1.00 -0.06 0.00 0.00 0.00 0.00 61.98 60.98 1yq2 s VAL 987 Cb -0.14 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 1yq2 s VAL 987 CO 0.04 -0.14 0.04 -1.81 0.00 0.00 0.00 175.10 173.23 1yq2 s ASP 988 N 1.44 5.08 0.31 3.32 1.01 -0.12 -1.23 116.67 126.48 1yq2 s ASP 988 Ca -0.00 -0.16 0.04 0.00 0.71 0.00 0.00 52.55 53.13 1yq2 s ASP 988 Cb -0.19 -1.89 0.50 0.00 1.01 0.00 0.00 42.92 42.36 1yq2 s ASP 988 CO 0.03 0.03 1.78 0.00 0.21 0.00 0.00 175.17 177.23 1yq2 h ALA 989 N 7.72 1.21 -2.56 5.23 0.00 -0.80 0.09 119.26 130.15 1yq2 h ALA 989 Ca -0.37 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.13 1yq2 h ALA 989 Cb 1.18 -0.12 -0.22 0.00 0.00 0.00 0.00 17.79 18.62 1yq2 h ALA 989 CO 0.61 0.51 -0.20 0.00 0.00 0.00 0.00 179.25 180.17 1yq2 s ALA 990 N -4.61 -1.03 0.03 0.00 0.00 -0.95 -4.72 121.76 110.49 1yq2 s ALA 990 Ca -0.07 0.89 0.07 0.00 0.00 0.00 0.00 51.96 52.85 1yq2 s ALA 990 Cb 0.14 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 1yq2 s ALA 990 CO 0.78 -0.24 -0.21 -0.65 0.00 0.00 0.00 175.76 175.44 1yq2 s GLN 991 N -0.49 1.47 0.49 0.00 -1.52 -1.26 -1.28 119.66 117.06 1yq2 s GLN 991 Ca -0.06 -0.91 -0.22 0.00 -1.95 0.00 0.00 55.36 52.22 1yq2 s GLN 991 Cb -0.03 -1.55 -0.06 0.00 -0.22 0.00 0.00 33.01 31.14 1yq2 s GLN 991 CO 0.03 0.40 1.21 -1.58 -0.25 0.00 0.00 175.29 175.10 1yq2 s HIS 992 N -0.74 2.69 1.43 0.91 5.65 -0.17 -4.66 115.29 120.41 1yq2 s HIS 992 Ca 0.08 1.50 -0.23 0.00 0.25 0.00 0.00 55.06 56.65 1yq2 s HIS 992 Cb -0.09 -3.48 0.37 0.00 -1.18 0.00 0.00 32.58 28.20 1yq2 s HIS 992 CO 0.01 -1.88 0.93 0.20 -0.65 0.00 0.00 174.74 173.35 1yq2 s GLY 993 N -1.30 1.41 -0.22 1.59 0.00 -0.71 -4.70 107.32 103.38 1yq2 s GLY 993 Ca 0.67 -0.85 -0.04 0.00 0.00 0.00 0.00 44.72 44.49 1yq2 s GLY 993 CO 0.37 0.17 -0.24 1.04 0.00 0.00 0.00 173.10 174.44 1yq2 n LEU 994 N -5.67 2.38 0.00 0.66 4.77 -1.26 -4.97 117.00 112.92 1yq2 n LEU 994 Ca 0.13 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1yq2 n LEU 994 Cb 0.60 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1yq2 n LEU 994 CO 0.42 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.78 1yq2 n GLY 995 N 2.06 1.32 2.25 -0.72 0.00 -1.26 -4.59 105.19 104.24 1yq2 n GLY 995 Ca -0.42 -0.54 -0.03 0.00 0.00 0.00 0.00 46.02 45.04 1yq2 n GLY 995 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1yq2 n SER 996 N -2.52 -0.82 0.07 1.61 3.41 -0.32 -0.58 113.62 114.46 1yq2 n SER 996 Ca 0.00 -2.13 0.09 0.00 -0.26 0.00 0.00 58.87 56.56 1yq2 n SER 996 Cb 0.00 0.39 0.37 0.00 -0.26 0.00 0.00 64.21 64.72 1yq2 n SER 996 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1yq2 n ARG 997 N -0.96 0.09 -0.13 4.33 0.63 -0.99 -1.09 116.66 118.53 1yq2 n ARG 997 Ca -0.16 0.38 0.11 0.00 -0.92 0.00 0.00 57.85 57.27 1yq2 n ARG 997 Cb 0.84 -1.69 0.46 0.00 0.45 0.00 0.00 32.46 32.52 1yq2 n ARG 997 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yq2 h ALA 998 N 2.31 1.95 -0.91 5.13 0.00 -1.76 -3.35 119.26 122.63 1yq2 h ALA 998 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1yq2 h ALA 998 Cb 0.24 -0.11 -0.18 0.00 0.00 0.00 0.00 17.79 17.75 1yq2 h ALA 998 CO 0.00 -0.09 -0.43 0.00 0.00 0.00 0.00 179.25 178.73 1yq2 n GLY 1000N 3.71 0.86 3.60 0.00 0.00 -0.82 -4.35 105.19 108.19 1yq2 n GLY 1000Ca 0.13 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 1yq2 n GLY 1000CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yq2 n PRO 1001N -0.36 1.33 -0.65 1.61 -0.02 -1.26 -3.81 135.00 131.84 1yq2 n PRO 1001Ca 0.00 0.47 -0.29 0.00 -2.02 0.00 0.00 63.50 61.66 1yq2 n PRO 1001Cb 0.00 -1.99 0.22 0.00 -0.02 0.00 0.00 33.50 31.70 1yq2 n PRO 1001CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1yq2 s ASP 1002N -0.72 1.80 0.12 2.55 3.68 -1.26 -1.17 116.67 121.67 1yq2 s ASP 1002Ca 0.62 1.73 -0.36 0.00 2.13 0.00 0.00 52.55 56.68 1yq2 s ASP 1002Cb -0.58 -2.38 -0.16 0.00 -1.45 0.00 0.00 42.92 38.36 1yq2 s ASP 1002CO 0.57 -3.73 1.42 0.52 0.13 0.00 0.00 175.17 174.08 1yq2 n VAL 1003N -4.62 0.05 -1.93 1.11 0.31 -1.26 -4.60 118.33 107.39 1yq2 n VAL 1003Ca 0.06 -0.01 -0.41 0.00 -0.01 0.00 0.00 64.34 63.97 1yq2 n VAL 1003Cb 0.54 -1.08 -0.01 0.00 -0.91 0.00 0.00 33.84 32.37 1yq2 n VAL 1003CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 1yq2 s TRP 1004N 0.60 2.82 0.39 3.52 -0.11 -1.26 -4.75 118.94 120.14 1yq2 s TRP 1004Ca 0.82 1.16 0.15 0.00 1.22 0.00 0.00 56.10 59.45 1yq2 s TRP 1004Cb -0.85 -3.90 1.01 0.00 -1.50 0.00 0.00 33.47 28.24 1yq2 s TRP 1004CO 0.44 -2.69 1.83 -1.35 -4.62 0.00 0.00 176.95 170.55 1yq2 h PRO 1005N 3.71 0.47 0.00 5.86 0.11 -1.92 -0.06 132.00 140.17 1yq2 h PRO 1005Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1yq2 h PRO 1005Cb 1.23 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1yq2 h PRO 1005CO 0.69 0.31 0.28 -0.44 -0.21 0.00 0.00 178.00 178.63 1yq2 h ASP 1006N 0.48 0.00 0.00 -2.05 5.19 -2.03 -2.59 116.42 115.42 1yq2 h ASP 1006Ca 0.51 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.92 1yq2 h ASP 1006Cb 1.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.67 1yq2 h ASP 1006CO -0.23 0.00 -0.00 0.49 -3.12 0.00 0.00 179.24 176.38 1yq2 n PHE 1007N -2.84 0.00 -3.35 4.55 3.01 -0.04 -5.01 117.46 113.78 1yq2 n PHE 1007Ca -0.02 -0.51 -0.38 0.00 1.01 0.00 0.00 57.45 57.55 1yq2 n PHE 1007Cb 0.33 -0.05 -0.06 0.00 -0.01 0.00 0.00 39.48 39.68 1yq2 n PHE 1007CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1yq2 s ALA 1008N -1.09 3.55 -0.33 4.37 0.00 -0.98 -1.74 121.76 125.54 1yq2 s ALA 1008Ca 0.02 -0.16 -0.24 0.00 0.00 0.00 0.00 51.96 51.59 1yq2 s ALA 1008Cb 0.02 -2.58 0.01 0.00 0.00 0.00 0.00 23.12 20.57 1yq2 s ALA 1008CO 0.00 0.18 0.81 -1.17 0.00 0.00 0.00 175.76 175.58 1yq2 s LEU 1009N -0.07 4.09 0.20 0.00 2.96 -1.26 -4.94 118.68 119.65 1yq2 s LEU 1009Ca 0.26 0.57 0.08 0.00 -0.22 0.00 0.00 54.13 54.82 1yq2 s LEU 1009Cb -0.16 -3.09 -0.04 0.00 0.50 0.00 0.00 46.19 43.40 1yq2 s LEU 1009CO 0.12 -0.68 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.31 1yq2 s ARG 1010N 3.07 2.25 0.20 1.98 1.81 -1.26 -1.47 118.95 125.53 1yq2 s ARG 1010Ca 0.33 -1.25 -0.32 0.00 -1.72 0.00 0.00 55.73 52.77 1yq2 s ARG 1010Cb -0.14 -2.23 -0.15 0.00 -0.45 0.00 0.00 34.95 31.98 1yq2 s ARG 1010CO 0.15 0.42 1.19 -2.30 -0.68 0.00 0.00 175.30 174.08 1yq2 n PRO 1011N -0.26 1.35 -3.58 3.54 -0.02 -1.26 -4.86 135.00 129.90 1yq2 n PRO 1011Ca -0.09 0.48 -0.11 0.00 -2.02 0.00 0.00 63.50 61.76 1yq2 n PRO 1011Cb 0.56 -1.99 -0.04 0.00 -0.02 0.00 0.00 33.50 32.02 1yq2 n PRO 1011CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1yq2 s GLU 1012N -0.54 1.12 0.22 -0.52 -1.05 -1.26 -5.13 118.70 111.54 1yq2 s GLU 1012Ca 0.70 -0.65 -0.26 0.00 -0.15 0.00 0.00 54.97 54.61 1yq2 s GLU 1012Cb -0.79 0.50 -0.09 0.00 -0.44 0.00 0.00 34.13 33.31 1yq2 s GLU 1012CO 0.53 -0.45 0.84 0.00 0.95 0.00 0.00 175.26 177.13 1yq2 s ALA 1013N -3.79 3.38 0.08 -0.84 0.00 -1.26 -4.70 121.76 114.63 1yq2 s ALA 1013Ca 0.02 0.43 0.02 0.00 0.00 0.00 0.00 51.96 52.44 1yq2 s ALA 1013Cb 0.01 -3.05 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 1yq2 s ALA 1013CO -0.12 0.26 -0.07 1.03 0.00 0.00 0.00 175.76 176.85 1yq2 s ARG 1014N -1.41 0.73 -0.04 0.00 1.81 -0.67 -5.01 118.95 114.36 1yq2 s ARG 1014Ca 0.40 -1.14 0.04 0.00 -1.72 0.00 0.00 55.73 53.32 1yq2 s ARG 1014Cb -0.22 -0.23 -0.00 0.00 -0.45 0.00 0.00 34.95 34.04 1yq2 s ARG 1014CO 0.27 0.00 -0.16 0.99 -0.68 0.00 0.00 175.30 175.72 1yq2 s THR 1015N -2.87 1.37 -0.15 0.02 2.01 -1.26 -0.54 115.64 114.23 1yq2 s THR 1015Ca 0.04 -0.68 -0.03 0.00 0.31 0.00 0.00 61.69 61.33 1yq2 s THR 1015Cb 0.00 -1.18 -0.03 0.00 0.01 0.00 0.00 72.50 71.30 1yq2 s THR 1015CO -0.03 0.40 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.50 1yq2 s LEU 1016N 0.09 3.26 -0.32 4.42 1.43 0.11 -4.81 118.68 122.87 1yq2 s LEU 1016Ca -0.05 -0.11 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 1yq2 s LEU 1016Cb -0.12 -1.78 0.09 0.00 0.03 0.00 0.00 46.19 44.42 1yq2 s LEU 1016CO 0.02 0.19 0.02 -0.54 0.23 0.00 0.00 176.35 176.28 1yq2 s LYS 1017N 0.24 1.51 0.14 1.70 1.02 -1.26 -0.96 119.74 122.13 1yq2 s LYS 1017Ca -0.03 -1.64 0.10 0.00 0.02 0.00 0.00 55.97 54.43 1yq2 s LYS 1017Cb -0.14 -2.97 -0.04 0.00 -0.52 0.00 0.00 37.83 34.16 1yq2 s LYS 1017CO 0.03 -0.87 -0.23 -0.51 -0.92 0.00 0.00 175.35 172.86 1yq2 s LEU 1018N 1.05 2.49 -0.08 3.17 1.43 0.13 -1.12 118.68 125.76 1yq2 s LEU 1018Ca 0.07 -0.71 0.01 0.00 -1.03 0.00 0.00 54.13 52.46 1yq2 s LEU 1018Cb -0.19 -1.33 0.02 0.00 0.03 0.00 0.00 46.19 44.72 1yq2 s LEU 1018CO -0.10 0.16 -0.10 -0.13 0.23 0.00 0.00 176.35 176.42 1yq2 s ARG 1019N -2.27 1.56 -0.14 1.70 0.52 0.18 -0.66 118.95 119.83 1yq2 s ARG 1019Ca 0.17 -0.33 0.01 0.00 -0.52 0.00 0.00 55.73 55.07 1yq2 s ARG 1019Cb -0.10 -1.42 0.00 0.00 0.52 0.00 0.00 34.95 33.95 1yq2 s ARG 1019CO 0.09 -0.09 -0.18 0.42 0.02 0.00 0.00 175.30 175.55 1yq2 s ILE 1020N 1.07 2.45 0.08 1.52 1.01 -0.22 -1.11 121.20 126.01 1yq2 s ILE 1020Ca -0.07 -0.85 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 1yq2 s ILE 1020Cb -0.14 -2.01 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 1yq2 s ILE 1020CO -0.01 0.53 0.11 -0.94 0.00 0.00 0.00 174.94 174.63 1yq2 s SER 1021N 0.71 0.26 0.29 3.58 1.04 -0.31 -4.12 113.70 115.15 1yq2 s SER 1021Ca -0.08 -0.83 -0.29 0.00 0.48 0.00 0.00 55.95 55.23 1yq2 s SER 1021Cb -0.16 0.29 -0.10 0.00 0.10 0.00 0.00 66.02 66.16 1yq2 s SER 1021CO 0.01 -0.70 1.28 -2.84 0.98 0.00 0.00 173.24 171.98 1yq2 s PRO 1022N -3.90 4.40 0.00 4.02 0.02 -1.26 -0.59 135.00 137.69 1yq2 s PRO 1022Ca 0.08 2.12 0.21 0.00 0.02 0.00 0.00 61.00 63.44 1yq2 s PRO 1022Cb 0.06 -3.12 1.28 0.00 0.02 0.00 0.00 34.50 32.75 1yq2 s PRO 1022CO -0.09 -0.15 1.66 0.00 -0.33 0.00 0.00 177.00 178.09