#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 6.31 -0.20 0.00 3.68 -1.26 -4.93 116.67 120.27 1yq2 s ASP 5 Ca 0.00 -0.08 0.15 0.00 2.13 0.00 0.00 52.55 54.76 1yq2 s ASP 5 Cb 0.00 -2.27 0.53 0.00 -1.45 0.00 0.00 42.92 39.73 1yq2 s ASP 5 CO 0.00 -0.49 1.44 1.33 0.13 0.00 0.00 175.17 177.58 1yq2 n VAL 6 N 5.44 2.36 0.30 1.11 0.24 -1.26 -4.60 118.33 121.91 1yq2 n VAL 6 Ca -0.05 -2.04 0.18 0.00 -2.04 0.00 0.00 64.34 60.39 1yq2 n VAL 6 Cb 0.49 -0.27 0.90 0.00 -1.47 0.00 0.00 33.84 33.48 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 1.63 0.00 -0.04 -1.34 4.64 -1.98 -2.49 113.55 113.97 1yq2 h SER 7 Ca 0.05 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.39 1yq2 h SER 7 Cb 1.52 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.60 1yq2 h SER 7 CO 0.27 0.00 0.03 0.10 -0.87 0.00 0.00 176.83 176.37 1yq2 h TYR 8 N 0.00 0.00 -0.14 4.77 -0.00 -1.97 -1.79 116.97 117.84 1yq2 h TYR 8 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.73 58.65 1yq2 h TYR 8 Cb 0.18 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.90 1yq2 h TYR 8 CO 0.00 0.00 -0.26 1.25 -0.00 0.00 0.00 178.16 179.15 1yq2 h LEU 9 N 0.00 0.25 -1.60 0.10 5.85 -1.83 -3.21 115.31 114.87 1yq2 h LEU 9 Ca 0.02 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1yq2 h LEU 9 Cb 0.09 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1yq2 h LEU 9 CO -0.00 0.51 0.00 0.35 -0.34 0.00 0.00 178.44 178.96 1yq2 n THR 10 N -4.15 0.17 -1.83 1.05 -2.24 -0.93 -1.89 114.28 104.46 1yq2 n THR 10 Ca -0.01 -0.58 -0.41 0.00 -2.27 0.00 0.00 64.05 60.77 1yq2 n THR 10 Cb 0.37 1.07 -0.01 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.78 6.41 0.00 3.42 2.15 -0.72 -4.76 116.67 122.39 1yq2 s ASP 11 Ca 0.12 2.95 0.23 0.00 0.43 0.00 0.00 52.55 56.27 1yq2 s ASP 11 Cb 0.08 -2.65 0.60 0.00 -0.30 0.00 0.00 42.92 40.65 1yq2 s ASP 11 CO 0.11 -0.86 1.48 0.00 -0.17 0.00 0.00 175.17 175.73 1yq2 n GLN 12 N 1.52 2.07 -1.94 4.34 6.02 -1.26 -4.73 117.38 123.39 1yq2 n GLN 12 Ca 0.05 -1.59 -0.29 0.00 -0.01 0.00 0.00 57.00 55.16 1yq2 n GLN 12 Cb 0.38 -1.46 0.16 0.00 1.02 0.00 0.00 30.24 30.35 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 -1.68 1.74 0.06 1.08 0.00 -1.26 -4.37 107.32 102.88 1yq2 s GLY 13 Ca 0.34 -1.09 0.19 0.00 0.00 0.00 0.00 44.72 44.17 1yq2 s GLY 13 CO 0.30 -0.39 1.61 -1.55 0.00 0.00 0.00 173.10 173.06 1yq2 n PRO 14 N -3.63 0.05 0.00 2.90 -0.04 -1.26 -4.77 135.00 128.25 1yq2 n PRO 14 Ca 0.13 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 1yq2 n PRO 14 Cb 0.60 -1.58 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 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 0.33 2.25 3.42 0.55 0.00 -1.26 -4.30 105.19 106.19 1yq2 n GLY 15 Ca 0.04 -1.97 -0.11 0.00 0.00 0.00 0.00 46.02 43.98 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 0.14 0.00 1.61 1.04 -0.76 -4.96 113.70 110.78 1yq2 s SER 16 Ca 0.00 -1.18 0.00 0.00 0.48 0.00 0.00 55.95 55.25 1yq2 s SER 16 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1yq2 s SER 16 CO 0.00 -1.04 0.00 0.61 0.98 0.00 0.00 173.24 173.79 1yq2 n GLY 17 N -0.36 0.06 2.43 7.32 0.00 -1.26 -0.57 105.19 112.81 1yq2 n GLY 17 Ca 0.00 -1.82 -0.40 0.00 0.00 0.00 0.00 46.02 43.80 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 3.95 -2.43 1.61 1.74 0.21 -4.95 116.66 116.79 1yq2 n ARG 18 Ca 0.00 -2.73 -0.41 0.00 -0.77 0.00 0.00 57.85 53.94 1yq2 n ARG 18 Cb 0.00 -2.78 -0.04 0.00 -1.02 0.00 0.00 32.46 28.62 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 1.00 4.54 -0.10 5.56 0.52 -1.26 -0.57 118.95 128.64 1yq2 s ARG 19 Ca 0.61 1.83 -0.10 0.00 -0.52 0.00 0.00 55.73 57.55 1yq2 s ARG 19 Cb 0.17 -3.24 -0.05 0.00 0.52 0.00 0.00 34.95 32.36 1yq2 s ARG 19 CO -0.07 0.01 0.23 0.08 0.02 0.00 0.00 175.30 175.57 1yq2 s VAL 20 N -0.34 5.35 0.27 3.52 1.01 -0.65 -4.82 120.40 124.74 1yq2 s VAL 20 Ca 0.50 0.42 -0.30 0.00 0.00 0.00 0.00 61.98 62.61 1yq2 s VAL 20 Cb -0.32 -3.52 -0.14 0.00 0.00 0.00 0.00 36.38 32.41 1yq2 s VAL 20 CO 0.37 0.56 1.21 -2.65 0.00 0.00 0.00 175.10 174.60 1yq2 n PRO 21 N 2.27 1.70 -1.69 2.72 -0.02 -1.26 -4.68 135.00 134.04 1yq2 n PRO 21 Ca -0.17 0.60 -0.41 0.00 -2.02 0.00 0.00 63.50 61.50 1yq2 n PRO 21 Cb 0.54 -2.12 0.01 0.00 -0.02 0.00 0.00 33.50 31.91 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 0.89 1.20 -3.11 3.55 0.00 -1.26 -5.01 120.51 116.76 1yq2 n ALA 22 Ca 0.10 0.28 -0.12 0.00 0.00 0.00 0.00 53.44 53.70 1yq2 n ALA 22 Cb 0.32 -2.25 -0.03 0.00 0.00 0.00 0.00 19.45 17.49 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 -2.11 1.86 0.68 0.00 1.70 -1.26 -4.98 118.95 114.84 1yq2 s ARG 23 Ca 0.60 -1.57 -0.16 0.00 -0.47 0.00 0.00 55.73 54.13 1yq2 s ARG 23 Cb -0.53 0.48 0.01 0.00 -0.57 0.00 0.00 34.95 34.34 1yq2 s ARG 23 CO 0.59 -0.79 1.18 -1.12 -1.08 0.00 0.00 175.30 174.07 1yq2 s SER 24 N -3.15 4.71 -0.29 -2.89 0.01 -1.05 -3.37 113.70 107.66 1yq2 s SER 24 Ca 0.26 2.26 -0.25 0.00 1.31 0.00 0.00 55.95 59.52 1yq2 s SER 24 Cb -0.01 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1yq2 s SER 24 CO 0.16 -1.91 0.88 0.86 0.41 0.00 0.00 173.24 173.64 1yq2 s TRP 25 N -1.99 3.22 0.05 2.43 -0.00 -0.84 -4.93 118.94 116.88 1yq2 s TRP 25 Ca 0.73 1.02 0.06 0.00 -0.00 0.00 0.00 56.10 57.91 1yq2 s TRP 25 Cb -0.27 -3.30 -0.02 0.00 -0.00 0.00 0.00 33.47 29.88 1yq2 s TRP 25 CO 0.41 -0.57 -0.16 -0.51 -0.00 0.00 0.00 176.95 176.11 1yq2 s LEU 26 N 3.11 2.20 -0.74 5.86 1.43 -1.26 -4.97 118.68 124.30 1yq2 s LEU 26 Ca 0.37 -0.51 -0.23 0.00 -1.03 0.00 0.00 54.13 52.73 1yq2 s LEU 26 Cb -0.14 -0.71 0.07 0.00 0.03 0.00 0.00 46.19 45.44 1yq2 s LEU 26 CO 0.12 0.06 1.08 -1.00 0.23 0.00 0.00 176.35 176.83 1yq2 s HIS 27 N -0.92 2.67 0.11 0.29 3.76 -1.26 -5.01 115.29 114.94 1yq2 s HIS 27 Ca 0.03 -0.63 0.07 0.00 -0.15 0.00 0.00 55.06 54.38 1yq2 s HIS 27 Cb -0.09 -4.38 -0.04 0.00 1.11 0.00 0.00 32.58 29.19 1yq2 s HIS 27 CO 0.02 -1.72 -0.07 0.45 -0.85 0.00 0.00 174.74 172.57 1yq2 s SER 28 N 3.79 4.56 0.00 1.40 0.15 -1.26 -1.42 113.70 120.92 1yq2 s SER 28 Ca 0.28 -0.34 0.17 0.00 0.70 0.00 0.00 55.95 56.76 1yq2 s SER 28 Cb -0.12 -0.93 0.86 0.00 -1.71 0.00 0.00 66.02 64.12 1yq2 s SER 28 CO 0.06 0.17 1.58 -0.90 1.20 0.00 0.00 173.24 175.35 1yq2 n ASP 29 N 0.60 0.61 -4.65 5.45 5.75 -0.71 -4.95 116.55 118.65 1yq2 n ASP 29 Ca -0.12 -1.59 -0.40 0.00 -0.01 0.00 0.00 54.79 52.67 1yq2 n ASP 29 Cb 0.52 -0.04 0.02 0.00 -1.03 0.00 0.00 41.12 40.59 1yq2 n ASP 29 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1yq2 n ALA 30 N -0.35 0.68 -1.72 2.12 0.00 -1.26 -4.90 120.51 115.08 1yq2 n ALA 30 Ca 0.13 0.18 -0.43 0.00 0.00 0.00 0.00 53.44 53.32 1yq2 n ALA 30 Cb 0.15 -2.17 -0.02 0.00 0.00 0.00 0.00 19.45 17.41 1yq2 n ALA 30 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1yq2 n PRO 31 N -0.27 2.43 -3.71 0.00 -0.02 -1.26 -4.85 135.00 127.31 1yq2 n PRO 31 Ca 0.10 0.86 -0.12 0.00 -2.02 0.00 0.00 63.50 62.31 1yq2 n PRO 31 Cb 0.42 -2.58 -0.07 0.00 -0.02 0.00 0.00 33.50 31.24 1yq2 n PRO 31 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 s ALA 32 N -0.14 -0.85 0.01 3.55 0.00 -1.26 -0.70 121.76 122.36 1yq2 s ALA 32 Ca 0.64 0.21 -0.04 0.00 0.00 0.00 0.00 51.96 52.78 1yq2 s ALA 32 Cb -0.55 0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1yq2 s ALA 32 CO 0.50 -0.40 0.05 -0.48 0.00 0.00 0.00 175.76 175.44 1yq2 s LEU 33 N -1.89 1.90 -0.08 0.00 0.05 0.07 -5.00 118.68 113.73 1yq2 s LEU 33 Ca -0.07 -0.34 -0.19 0.00 0.05 0.00 0.00 54.13 53.58 1yq2 s LEU 33 Cb -0.02 0.38 -0.04 0.00 -2.05 0.00 0.00 46.19 44.46 1yq2 s LEU 33 CO -0.01 -0.33 0.53 -0.55 -0.55 0.00 0.00 176.35 175.44 1yq2 s SER 34 N -1.38 6.80 0.00 1.48 0.15 -1.26 -0.36 113.70 119.13 1yq2 s SER 34 Ca -0.15 0.95 0.19 0.00 0.70 0.00 0.00 55.95 57.64 1yq2 s SER 34 Cb -0.09 -2.32 0.53 0.00 -1.71 0.00 0.00 66.02 62.43 1yq2 s SER 34 CO 0.00 0.02 1.43 0.18 1.20 0.00 0.00 173.24 176.07 1yq2 n LEU 35 N 3.41 2.74 -4.71 3.45 4.77 0.10 -4.95 117.00 121.81 1yq2 n LEU 35 Ca -0.06 -1.28 -0.37 0.00 -0.03 0.00 0.00 56.01 54.27 1yq2 n LEU 35 Cb 0.51 -0.27 0.07 0.00 -2.33 0.00 0.00 43.42 41.41 1yq2 n LEU 35 CO 0.44 0.64 0.84 0.59 -1.33 0.00 0.00 177.39 178.56 1yq2 n ASN 36 N 1.00 1.77 0.00 -1.43 3.02 -1.23 -4.90 115.26 113.49 1yq2 n ASN 36 Ca 0.18 0.80 0.00 0.00 -0.03 0.00 0.00 54.58 55.53 1yq2 n ASN 36 Cb 0.46 -1.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.10 1yq2 n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yq2 n GLY 37 N 0.94 0.17 3.51 7.41 0.00 0.04 -5.00 105.19 112.25 1yq2 n GLY 37 Ca 0.15 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.26 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 6.19 0.20 1.61 1.01 -1.26 -0.03 116.67 120.39 1yq2 s ASP 38 Ca 0.00 -0.51 0.02 0.00 0.71 0.00 0.00 52.55 52.77 1yq2 s ASP 38 Cb 0.00 -2.22 -0.04 0.00 1.01 0.00 0.00 42.92 41.68 1yq2 s ASP 38 CO 0.00 -0.50 0.35 0.26 0.21 0.00 0.00 175.17 175.49 1yq2 s TRP 39 N 2.10 3.48 0.30 4.23 0.52 -0.52 -4.82 118.94 124.23 1yq2 s TRP 39 Ca 0.12 0.15 -0.29 0.00 0.02 0.00 0.00 56.10 56.10 1yq2 s TRP 39 Cb -0.17 -1.70 -0.10 0.00 -1.15 0.00 0.00 33.47 30.34 1yq2 s TRP 39 CO 0.13 0.44 1.40 1.03 0.02 0.00 0.00 176.95 179.97 1yq2 s ARG 40 N -3.52 4.27 -0.08 4.98 3.00 -0.47 -0.88 118.95 126.26 1yq2 s ARG 40 Ca 0.36 2.32 -0.07 0.00 0.00 0.00 0.00 55.73 58.33 1yq2 s ARG 40 Cb -0.10 -3.07 0.02 0.00 0.00 0.00 0.00 34.95 31.79 1yq2 s ARG 40 CO 0.29 -0.36 0.21 0.12 0.00 0.00 0.00 175.30 175.56 1yq2 s PHE 41 N -0.58 -0.23 0.04 -0.53 5.36 -0.33 -0.58 117.98 121.13 1yq2 s PHE 41 Ca 0.55 0.56 0.02 0.00 -0.96 0.00 0.00 56.93 57.10 1yq2 s PHE 41 Cb -0.42 0.07 -0.02 0.00 -0.34 0.00 0.00 43.02 42.31 1yq2 s PHE 41 CO 0.50 -0.12 -0.07 -0.98 -1.46 0.00 0.00 175.22 173.09 1yq2 s ARG 42 N 0.18 0.51 -0.19 10.12 1.70 -0.86 -3.60 118.95 126.80 1yq2 s ARG 42 Ca -0.01 -0.70 -0.06 0.00 -0.47 0.00 0.00 55.73 54.49 1yq2 s ARG 42 Cb -0.02 -0.30 -0.03 0.00 -0.57 0.00 0.00 34.95 34.03 1yq2 s ARG 42 CO -0.00 0.05 0.04 -1.17 -1.08 0.00 0.00 175.30 173.14 1yq2 s LEU 43 N -1.43 3.57 0.03 -1.89 2.96 -1.26 -1.31 118.68 119.35 1yq2 s LEU 43 Ca -0.09 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 1yq2 s LEU 43 Cb -0.09 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 1yq2 s LEU 43 CO 0.00 0.12 0.12 -0.76 -1.32 0.00 0.00 176.35 174.51 1yq2 s LEU 44 N 0.69 4.01 0.00 -0.68 1.43 0.98 -4.96 118.68 120.15 1yq2 s LEU 44 Ca 0.02 0.15 0.26 0.00 -1.03 0.00 0.00 54.13 53.53 1yq2 s LEU 44 Cb -0.14 -2.49 1.14 0.00 0.03 0.00 0.00 46.19 44.73 1yq2 s LEU 44 CO 0.02 0.23 1.84 -0.81 0.23 0.00 0.00 176.35 177.85 1yq2 n PRO 45 N 0.80 0.05 -3.87 1.29 -0.04 -1.26 -0.94 135.00 131.02 1yq2 n PRO 45 Ca -0.10 0.05 -0.09 0.00 -0.04 0.00 0.00 63.50 63.32 1yq2 n PRO 45 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.94 -0.41 -0.30 0.55 0.00 -1.21 -1.15 121.76 116.29 1yq2 s ALA 46 Ca 0.14 -0.61 -0.25 0.00 0.00 0.00 0.00 51.96 51.23 1yq2 s ALA 46 Cb 0.17 0.88 0.01 0.00 0.00 0.00 0.00 23.12 24.18 1yq2 s ALA 46 CO 0.46 -0.74 0.89 0.00 0.00 0.00 0.00 175.76 176.38 1yq2 s ALA 47 N -3.93 3.53 0.32 0.00 0.00 -1.25 -4.60 121.76 115.84 1yq2 s ALA 47 Ca 0.14 -0.27 -0.28 0.00 0.00 0.00 0.00 51.96 51.55 1yq2 s ALA 47 Cb 0.01 -3.43 -0.13 0.00 0.00 0.00 0.00 23.12 19.58 1yq2 s ALA 47 CO -0.00 -1.27 1.18 -2.30 0.00 0.00 0.00 175.76 173.37 1yq2 n PRO 48 N 6.40 1.82 -0.12 0.00 -0.02 -1.26 -2.50 135.00 139.33 1yq2 n PRO 48 Ca 0.07 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1yq2 n PRO 48 Cb 0.48 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 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 0.95 1.53 3.84 -1.23 0.00 -1.26 -4.96 105.19 104.05 1yq2 n GLY 49 Ca 0.07 0.00 -0.32 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 -2.69 4.43 0.36 2.61 -4.23 -1.04 -4.83 115.64 110.24 1yq2 s THR 50 Ca 0.00 1.10 0.05 0.00 -1.18 0.00 0.00 61.69 61.66 1yq2 s THR 50 Cb 0.00 -3.68 0.28 0.00 1.34 0.00 0.00 72.50 70.45 1yq2 s THR 50 CO 0.00 -0.72 1.98 0.00 -0.54 0.00 0.00 174.62 175.34 1yq2 h ALA 51 N 0.64 1.65 -0.43 3.99 0.00 -1.97 -1.81 119.26 121.33 1yq2 h ALA 51 Ca -0.46 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.34 1yq2 h ALA 51 Cb 1.19 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 1yq2 h ALA 51 CO 0.61 0.27 0.10 0.41 0.00 0.00 0.00 179.25 180.64 1yq2 n GLY 52 N -1.45 2.73 2.35 0.00 0.00 -1.26 -4.23 105.19 103.33 1yq2 n GLY 52 Ca 0.09 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 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 0.17 3.56 0.07 4.61 0.00 -0.68 -4.95 120.51 123.29 1yq2 n ALA 53 Ca 0.23 -3.15 0.12 0.00 0.00 0.00 0.00 53.44 50.63 1yq2 n ALA 53 Cb 0.96 -0.63 0.59 0.00 0.00 0.00 0.00 19.45 20.36 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 2.28 0.23 -4.58 0.00 0.00 -1.74 -3.02 103.07 96.25 1yq2 h GLY 54 Ca 0.06 -0.07 -0.43 0.00 0.00 0.00 0.00 47.33 46.88 1yq2 h GLY 54 CO 0.39 0.05 -0.95 -1.14 0.00 0.00 0.00 176.54 174.90 1yq2 n SER 55 N -4.47 3.35 0.05 0.19 3.41 -1.26 -4.85 113.62 110.03 1yq2 n SER 55 Ca 0.04 -3.05 -0.12 0.00 -0.26 0.00 0.00 58.87 55.48 1yq2 n SER 55 Cb 0.29 -0.43 -0.01 0.00 -0.26 0.00 0.00 64.21 63.80 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 3.45 1.37 -3.37 -3.33 3.04 -1.93 -3.46 116.25 112.01 1yq2 h VAL 56 Ca 0.13 -2.22 -0.49 0.00 -1.01 0.00 0.00 66.70 63.12 1yq2 h VAL 56 Cb 1.30 2.20 0.03 0.00 -2.01 0.00 0.00 31.29 32.81 1yq2 h VAL 56 CO 0.55 0.67 0.03 -0.76 -1.01 0.00 0.00 177.57 177.06 1yq2 s LEU 57 N -7.95 3.74 0.61 3.16 1.43 -1.26 -4.94 118.68 113.46 1yq2 s LEU 57 Ca -0.06 0.81 -0.19 0.00 -1.03 0.00 0.00 54.13 53.65 1yq2 s LEU 57 Cb 0.10 -3.74 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 1yq2 s LEU 57 CO 0.86 -0.50 1.31 -2.84 0.23 0.00 0.00 176.35 175.41 1yq2 s PRO 58 N -4.60 2.76 0.12 1.29 0.02 -1.26 -4.89 135.00 128.43 1yq2 s PRO 58 Ca 0.45 2.11 -0.35 0.00 0.02 0.00 0.00 61.00 63.23 1yq2 s PRO 58 Cb -0.10 -1.98 -0.16 0.00 0.02 0.00 0.00 34.50 32.28 1yq2 s PRO 58 CO 0.42 -1.45 1.29 0.43 -0.33 0.00 0.00 177.00 177.36 1yq2 n SER 59 N -1.62 1.58 0.00 2.53 7.64 -1.26 -1.76 113.62 120.73 1yq2 n SER 59 Ca 0.14 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.15 1yq2 n SER 59 Cb 0.47 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 1yq2 n SER 59 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yq2 n GLY 60 N 2.37 2.26 3.71 0.23 0.00 -1.26 -5.04 105.19 107.47 1yq2 n GLY 60 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.46 4.53 0.74 1.61 2.12 -0.72 -5.07 118.70 121.45 1yq2 s GLU 61 Ca 0.00 1.25 -0.12 0.00 0.36 0.00 0.00 54.97 56.46 1yq2 s GLU 61 Cb 0.00 -3.45 0.04 0.00 0.26 0.00 0.00 34.13 30.98 1yq2 s GLU 61 CO 0.00 0.01 1.11 0.95 -0.54 0.00 0.00 175.26 176.78 1yq2 s THR 62 N 0.87 3.22 0.23 -1.70 -4.23 -1.26 -4.87 115.64 107.91 1yq2 s THR 62 Ca 0.47 0.40 -0.06 0.00 -1.18 0.00 0.00 61.69 61.32 1yq2 s THR 62 Cb -0.20 -3.32 0.19 0.00 1.34 0.00 0.00 72.50 70.51 1yq2 s THR 62 CO 0.25 -0.52 1.81 0.58 -0.54 0.00 0.00 174.62 176.20 1yq2 h VAL 63 N -0.82 0.91 -0.20 2.29 2.07 -1.97 -1.99 116.25 116.55 1yq2 h VAL 63 Ca -0.46 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 1yq2 h VAL 63 Cb 1.27 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1yq2 h VAL 63 CO 0.63 0.14 -0.02 -0.62 0.02 0.00 0.00 177.57 177.72 1yq2 n GLU 64 N -4.77 2.35 -0.06 1.57 1.02 -1.26 -4.71 120.64 114.77 1yq2 n GLU 64 Ca 0.12 -2.82 0.21 0.00 -0.02 0.00 0.00 57.16 54.65 1yq2 n GLU 64 Cb 0.25 -1.75 0.67 0.00 -0.02 0.00 0.00 31.44 30.60 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 1.22 0.09 1.12 0.62 0.00 -1.72 -2.59 103.07 101.81 1yq2 h GLY 65 Ca 0.02 -0.02 0.09 0.00 0.00 0.00 0.00 47.33 47.42 1yq2 h GLY 65 CO 0.18 0.01 0.35 -0.24 0.00 0.00 0.00 176.54 176.84 1yq2 h VAL 66 N 0.05 0.38 0.00 4.60 3.04 -1.84 -2.12 116.25 120.36 1yq2 h VAL 66 Ca 0.31 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.97 1yq2 h VAL 66 Cb 1.15 0.71 -0.00 0.00 -2.01 0.00 0.00 31.29 31.14 1yq2 h VAL 66 CO -0.02 0.00 -0.13 0.00 -1.01 0.00 0.00 177.57 176.41 1yq2 h ALA 67 N 1.58 0.97 -2.84 3.17 0.00 -1.86 -3.47 119.26 116.81 1yq2 h ALA 67 Ca 0.15 -0.12 -0.52 0.00 0.00 0.00 0.00 54.91 54.42 1yq2 h ALA 67 Cb 0.85 -0.02 0.05 0.00 0.00 0.00 0.00 17.79 18.68 1yq2 h ALA 67 CO -0.00 0.16 0.57 0.00 0.00 0.00 0.00 179.25 179.98 1yq2 s ALA 68 N -3.46 3.40 0.47 0.00 0.00 -0.80 -3.40 121.76 117.97 1yq2 s ALA 68 Ca 0.03 1.12 0.19 0.00 0.00 0.00 0.00 51.96 53.30 1yq2 s ALA 68 Cb 0.08 -3.42 1.23 0.00 0.00 0.00 0.00 23.12 21.01 1yq2 s ALA 68 CO 0.63 -0.51 2.07 0.93 0.00 0.00 0.00 175.76 178.87 1yq2 h GLU 69 N 3.31 0.00 0.00 0.00 5.08 -1.90 -2.25 114.58 118.82 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 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1yq2 h GLU 69 CO 0.65 0.12 0.00 -1.13 -1.00 0.00 0.00 179.01 177.65 1yq2 n SER 70 N -4.17 0.32 -4.74 1.42 3.41 -1.26 -4.88 113.62 103.72 1yq2 n SER 70 Ca -0.02 0.55 -0.42 0.00 -0.26 0.00 0.00 58.87 58.72 1yq2 n SER 70 Cb 0.20 -0.63 -0.02 0.00 -0.26 0.00 0.00 64.21 63.50 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 -3.09 3.02 -0.34 7.33 5.04 -0.85 -4.99 117.35 123.48 1yq2 s TYR 71 Ca 0.09 0.91 -0.12 0.00 -2.44 0.00 0.00 57.07 55.51 1yq2 s TYR 71 Cb 0.13 -3.86 -0.01 0.00 0.35 0.00 0.00 41.96 38.57 1yq2 s TYR 71 CO 0.45 -2.90 0.22 0.34 -1.34 0.00 0.00 175.55 172.32 1yq2 s ASP 72 N 0.59 5.94 -0.17 4.32 3.68 -1.26 -4.91 116.67 124.86 1yq2 s ASP 72 Ca 0.62 -0.48 0.16 0.00 2.13 0.00 0.00 52.55 54.99 1yq2 s ASP 72 Cb -0.42 -2.11 0.37 0.00 -1.45 0.00 0.00 42.92 39.31 1yq2 s ASP 72 CO 0.40 -0.24 1.22 -0.90 0.13 0.00 0.00 175.17 175.79 1yq2 n ASP 73 N 5.08 2.39 -0.25 -0.34 5.68 -1.26 -4.79 116.55 123.06 1yq2 n ASP 73 Ca -0.13 -3.33 0.12 0.00 -0.50 0.00 0.00 54.79 50.95 1yq2 n ASP 73 Cb 0.49 -0.48 0.40 0.00 -1.14 0.00 0.00 41.12 40.39 1yq2 n ASP 73 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1yq2 h ALA 74 N 0.54 1.87 -0.00 2.12 0.00 -2.01 -0.94 119.26 120.83 1yq2 h ALA 74 Ca 0.02 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1yq2 h ALA 74 Cb 1.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1yq2 h ALA 74 CO 0.06 -0.10 -0.09 0.00 0.00 0.00 0.00 179.25 179.11 1yq2 n ALA 75 N -2.45 2.71 -1.77 0.00 0.00 -1.26 -4.94 120.51 112.80 1yq2 n ALA 75 Ca 0.17 -0.23 -0.36 0.00 0.00 0.00 0.00 53.44 53.01 1yq2 n ALA 75 Cb 0.47 -1.37 0.01 0.00 0.00 0.00 0.00 19.45 18.56 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 -2.52 2.57 1.18 0.00 0.52 -0.36 -5.04 118.94 115.28 1yq2 s TRP 76 Ca 0.28 1.53 -0.17 0.00 0.02 0.00 0.00 56.10 57.75 1yq2 s TRP 76 Cb 0.20 -3.39 0.27 0.00 -1.15 0.00 0.00 33.47 29.41 1yq2 s TRP 76 CO 0.48 -1.85 1.07 -0.51 0.02 0.00 0.00 176.95 176.16 1yq2 s ASP 77 N -1.64 1.06 0.23 2.95 1.01 -1.24 -4.83 116.67 114.21 1yq2 s ASP 77 Ca 0.74 0.87 0.10 0.00 0.71 0.00 0.00 52.55 54.97 1yq2 s ASP 77 Cb -0.27 -1.29 -0.05 0.00 1.01 0.00 0.00 42.92 42.32 1yq2 s ASP 77 CO 0.30 -4.06 -0.19 0.42 0.21 0.00 0.00 175.17 171.85 1yq2 s THR 78 N -2.85 2.19 -0.01 -1.27 -4.23 -1.26 -1.19 115.64 107.01 1yq2 s THR 78 Ca 0.69 -2.21 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 1yq2 s THR 78 Cb -0.14 -2.13 0.01 0.00 1.34 0.00 0.00 72.50 71.58 1yq2 s THR 78 CO 0.57 -0.37 -0.01 -0.22 -0.54 0.00 0.00 174.62 174.05 1yq2 s LEU 79 N -3.16 1.78 0.42 4.79 0.20 -0.06 -4.83 118.68 117.82 1yq2 s LEU 79 Ca 0.24 -0.02 -0.26 0.00 0.69 0.00 0.00 54.13 54.78 1yq2 s LEU 79 Cb -0.05 -0.11 -0.09 0.00 -0.43 0.00 0.00 46.19 45.51 1yq2 s LEU 79 CO 0.11 -0.01 1.38 -2.84 -0.29 0.00 0.00 176.35 174.69 1yq2 s PRO 80 N 0.23 3.89 -0.10 0.98 0.02 -1.26 -1.43 135.00 137.32 1yq2 s PRO 80 Ca -0.02 2.32 0.01 0.00 0.02 0.00 0.00 61.00 63.33 1yq2 s PRO 80 Cb -0.04 -2.76 0.02 0.00 0.02 0.00 0.00 34.50 31.74 1yq2 s PRO 80 CO -0.01 -0.61 -0.12 0.08 -0.33 0.00 0.00 177.00 176.01 1yq2 s VAL 81 N -1.21 1.25 0.25 3.83 1.01 0.95 -3.38 120.40 123.09 1yq2 s VAL 81 Ca 0.58 -0.47 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 1yq2 s VAL 81 Cb -0.41 -1.18 -0.09 0.00 0.00 0.00 0.00 36.38 34.69 1yq2 s VAL 81 CO 0.54 0.40 1.03 -2.16 0.00 0.00 0.00 175.10 174.90 1yq2 s PRO 82 N 1.22 4.73 0.22 2.72 0.04 -1.26 -0.78 135.00 141.89 1yq2 s PRO 82 Ca -0.03 1.65 -0.22 0.00 0.04 0.00 0.00 61.00 62.44 1yq2 s PRO 82 Cb -0.14 -3.24 0.06 0.00 0.04 0.00 0.00 34.50 31.22 1yq2 s PRO 82 CO -0.04 0.33 0.93 -1.54 0.04 0.00 0.00 177.00 176.72 1yq2 s SER 83 N -0.90 -0.09 -0.13 6.66 1.04 -0.31 -4.92 113.70 115.05 1yq2 s SER 83 Ca 0.44 -0.66 -0.06 0.00 0.48 0.00 0.00 55.95 56.14 1yq2 s SER 83 Cb -0.29 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 1yq2 s SER 83 CO 0.36 -1.14 0.10 -1.00 0.98 0.00 0.00 173.24 172.55 1yq2 s HIS 84 N -2.80 3.46 -0.02 5.02 3.76 -1.26 -3.22 115.29 120.23 1yq2 s HIS 84 Ca 0.16 0.41 0.31 0.00 -0.15 0.00 0.00 55.06 55.79 1yq2 s HIS 84 Cb -0.03 -1.94 1.39 0.00 1.11 0.00 0.00 32.58 33.10 1yq2 s HIS 84 CO 0.06 0.59 1.93 0.11 -0.85 0.00 0.00 174.74 176.58 1yq2 h TRP 85 N 5.32 0.00 -0.30 1.40 0.09 -1.77 -2.32 115.95 118.38 1yq2 h TRP 85 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.47 1yq2 h TRP 85 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.45 1yq2 h TRP 85 CO 0.70 0.00 0.00 1.33 0.09 0.00 0.00 178.44 180.56 1yq2 n VAL 86 N -2.78 0.39 -4.63 0.12 0.24 -1.26 -4.41 118.33 106.00 1yq2 n VAL 86 Ca 0.00 -0.42 -0.24 0.00 -2.04 0.00 0.00 64.34 61.64 1yq2 n VAL 86 Cb 0.23 0.24 -0.14 0.00 -1.47 0.00 0.00 33.84 32.70 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 -1.61 1.29 -0.90 7.34 -1.94 -0.87 -4.09 119.30 118.52 1yq2 s MET 87 Ca 0.24 -0.80 0.00 0.00 -1.71 0.00 0.00 55.69 53.42 1yq2 s MET 87 Cb 0.13 -1.33 0.00 0.00 2.01 0.00 0.00 34.83 35.64 1yq2 s MET 87 CO 0.17 0.35 0.00 0.41 -0.01 0.00 0.00 175.02 175.94 1yq2 n GLY 88 N 2.11 1.02 0.12 -0.03 0.00 -1.26 -4.73 105.19 102.42 1yq2 n GLY 88 Ca -0.17 -0.51 0.03 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.51 1.22 -2.58 1.61 1.13 -1.26 -5.01 117.38 109.98 1yq2 n GLN 89 Ca -0.09 -1.46 -0.19 0.00 -1.94 0.00 0.00 57.00 53.33 1yq2 n GLN 89 Cb 0.31 -0.91 -0.00 0.00 0.11 0.00 0.00 30.24 29.74 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 -0.53 -5.16 0.00 1.08 8.00 -1.26 -1.97 116.55 116.70 1yq2 n ASP 90 Ca 0.04 -0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.53 1yq2 n ASP 90 Cb 0.51 -4.29 0.00 0.00 -0.02 0.00 0.00 41.12 37.31 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 -1.04 0.73 0.36 0.44 0.00 -1.26 -4.93 105.19 99.49 1yq2 n GLY 91 Ca -0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.90 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 2.03 0.91 -0.65 1.61 3.64 -1.75 -2.07 116.57 120.29 1yq2 h LYS 92 Ca 0.00 -0.05 -0.43 0.00 -1.27 0.00 0.00 60.65 58.90 1yq2 h LYS 92 Cb 0.00 -0.21 -0.27 0.00 -0.41 0.00 0.00 32.23 31.35 1yq2 h LYS 92 CO 0.00 0.60 -0.15 0.66 -2.27 0.00 0.00 179.45 178.30 1yq2 n TYR 93 N -4.52 2.19 -1.60 1.91 4.02 -1.26 -5.08 117.16 112.82 1yq2 n TYR 93 Ca 0.15 -2.15 0.00 0.00 -0.01 0.00 0.00 57.90 55.88 1yq2 n TYR 93 Cb 0.27 -0.65 0.00 0.00 -0.02 0.00 0.00 39.34 38.94 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 -0.93 -2.34 3.26 2.72 0.00 -0.78 -4.48 105.19 102.63 1yq2 n GLY 94 Ca 0.44 -1.71 -0.14 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.35 1.10 0.79 1.61 1.81 -1.26 -4.35 118.95 118.30 1yq2 s ARG 95 Ca 0.00 -1.50 -0.14 0.00 -1.72 0.00 0.00 55.73 52.37 1yq2 s ARG 95 Cb 0.00 -0.52 0.05 0.00 -0.45 0.00 0.00 34.95 34.03 1yq2 s ARG 95 CO 0.00 -0.00 1.03 -2.30 -0.68 0.00 0.00 175.30 173.35 1yq2 n PRO 96 N -0.23 0.25 -4.28 3.54 -0.02 -1.26 -4.97 135.00 128.03 1yq2 n PRO 96 Ca -0.09 0.15 -0.25 0.00 -2.02 0.00 0.00 63.50 61.30 1yq2 n PRO 96 Cb 0.62 -2.30 -0.17 0.00 -0.02 0.00 0.00 33.50 31.63 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 -2.04 1.02 -0.24 4.25 1.01 -1.21 -4.83 121.20 119.16 1yq2 s ILE 97 Ca 0.72 -0.36 -0.08 0.00 0.00 0.00 0.00 60.65 60.93 1yq2 s ILE 97 Cb -0.30 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.15 1yq2 s ILE 97 CO 0.52 0.34 0.08 -0.47 0.00 0.00 0.00 174.94 175.41 1yq2 s TYR 98 N 1.09 3.11 0.11 3.97 5.04 -1.26 -0.49 117.35 128.93 1yq2 s TYR 98 Ca -0.07 -0.30 0.07 0.00 -2.44 0.00 0.00 57.07 54.33 1yq2 s TYR 98 Cb -0.14 -2.22 -0.04 0.00 0.35 0.00 0.00 41.96 39.91 1yq2 s TYR 98 CO -0.01 -0.27 -0.17 0.95 -1.34 0.00 0.00 175.55 174.71 1yq2 s THR 99 N 1.43 1.47 0.00 4.34 -4.23 -1.25 -2.44 115.64 114.96 1yq2 s THR 99 Ca 0.06 -1.58 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 1yq2 s THR 99 Cb -0.15 -1.46 0.00 0.00 1.34 0.00 0.00 72.50 72.23 1yq2 s THR 99 CO 0.04 -0.23 0.00 -3.20 -0.54 0.00 0.00 174.62 170.69 1yq2 n ASN 100 N 0.88 0.00 -0.09 3.99 5.15 -1.26 -3.42 115.26 120.50 1yq2 n ASN 100 Ca -0.18 0.01 -0.21 0.00 -0.60 0.00 0.00 54.58 53.60 1yq2 n ASN 100 Cb 0.55 -0.02 -0.12 0.00 -0.53 0.00 0.00 39.78 39.66 1yq2 n ASN 100 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1yq2 n VAL 101 N -1.11 1.57 -1.91 3.44 0.31 -1.26 -3.99 118.33 115.38 1yq2 n VAL 101 Ca 0.00 -0.54 -0.41 0.00 -0.01 0.00 0.00 64.34 63.38 1yq2 n VAL 101 Cb 0.00 -1.60 -0.02 0.00 -0.91 0.00 0.00 33.84 31.31 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 -2.52 4.20 0.37 5.55 -2.07 -1.26 -3.67 119.66 120.26 1yq2 s GLN 102 Ca -0.32 2.43 -0.25 0.00 -1.82 0.00 0.00 55.36 55.39 1yq2 s GLN 102 Cb 0.09 -3.05 -0.09 0.00 -1.09 0.00 0.00 33.01 28.87 1yq2 s GLN 102 CO 0.63 -0.48 1.07 0.71 -1.32 0.00 0.00 175.29 175.90 1yq2 s TYR 103 N -0.37 3.34 -1.51 9.60 2.02 -1.26 -4.81 117.35 124.36 1yq2 s TYR 103 Ca 0.58 1.66 0.01 0.00 -0.37 0.00 0.00 57.07 58.95 1yq2 s TYR 103 Cb -0.44 -3.18 0.05 0.00 -0.40 0.00 0.00 41.96 37.99 1yq2 s TYR 103 CO 0.50 -0.64 0.83 -0.35 -1.57 0.00 0.00 175.55 174.32 1yq2 n PRO 104 N 0.25 1.19 -4.01 -1.71 -0.04 -1.26 -4.82 135.00 124.59 1yq2 n PRO 104 Ca 0.03 -0.20 -0.08 0.00 -0.04 0.00 0.00 63.50 63.21 1yq2 n PRO 104 Cb 0.48 -1.28 -0.09 0.00 -0.04 0.00 0.00 33.50 32.57 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 -1.55 0.46 0.61 0.54 -0.71 -1.26 -5.02 117.98 111.05 1yq2 s PHE 105 Ca 0.04 -0.91 -0.19 0.00 -1.04 0.00 0.00 56.93 54.82 1yq2 s PHE 105 Cb 0.02 -0.26 -0.04 0.00 -1.21 0.00 0.00 43.02 41.53 1yq2 s PHE 105 CO 0.02 -0.50 1.13 -2.30 -1.34 0.00 0.00 175.22 172.22 1yq2 n PRO 106 N -0.03 1.07 -2.79 1.99 -0.02 -1.26 -4.88 135.00 129.08 1yq2 n PRO 106 Ca -0.12 0.41 -0.43 0.00 -2.02 0.00 0.00 63.50 61.35 1yq2 n PRO 106 Cb 0.62 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.74 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 -1.44 4.49 -0.38 4.25 1.01 -1.26 -4.78 121.20 123.09 1yq2 s ILE 107 Ca 0.78 -1.59 0.11 0.00 0.00 0.00 0.00 60.65 59.94 1yq2 s ILE 107 Cb -0.41 -4.93 0.34 0.00 0.01 0.00 0.00 42.46 37.47 1yq2 s ILE 107 CO 0.45 -1.71 0.71 -0.67 0.00 0.00 0.00 174.94 173.72 1yq2 n ASP 108 N 7.24 0.86 -4.77 3.58 2.03 -1.26 -5.12 116.55 119.11 1yq2 n ASP 108 Ca 0.32 -2.99 -0.40 0.00 0.52 0.00 0.00 54.79 52.24 1yq2 n ASP 108 Cb 0.48 -0.62 -0.01 0.00 -0.72 0.00 0.00 41.12 40.25 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 -2.29 4.02 -0.19 -0.67 0.04 -1.26 -0.65 135.00 134.01 1yq2 s PRO 109 Ca 0.40 2.21 0.09 0.00 0.04 0.00 0.00 61.00 63.73 1yq2 s PRO 109 Cb 0.32 -2.81 0.59 0.00 0.04 0.00 0.00 34.50 32.63 1yq2 s PRO 109 CO -0.09 -0.46 1.43 -0.35 0.04 0.00 0.00 177.00 177.57 1yq2 n PRO 110 N 0.24 3.64 -2.96 0.56 -0.04 -1.26 -5.11 135.00 130.06 1yq2 n PRO 110 Ca 0.03 -2.28 -0.34 0.00 -0.04 0.00 0.00 63.50 60.88 1yq2 n PRO 110 Cb 0.43 -2.04 -0.07 0.00 -0.04 0.00 0.00 33.50 31.78 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 -2.29 3.41 0.26 0.54 3.76 0.18 -4.18 115.29 116.97 1yq2 s HIS 111 Ca 0.40 1.46 0.05 0.00 -0.15 0.00 0.00 55.06 56.82 1yq2 s HIS 111 Cb 0.31 -2.71 -0.06 0.00 1.11 0.00 0.00 32.58 31.23 1yq2 s HIS 111 CO 0.11 0.05 -0.04 0.14 -0.85 0.00 0.00 174.74 174.15 1yq2 s VAL 112 N -1.98 1.39 0.74 -0.90 -7.23 -1.26 -4.62 120.40 106.54 1yq2 s VAL 112 Ca 0.56 -2.09 -0.13 0.00 -1.81 0.00 0.00 61.98 58.52 1yq2 s VAL 112 Cb -0.11 -2.40 0.05 0.00 0.56 0.00 0.00 36.38 34.48 1yq2 s VAL 112 CO 0.17 -0.32 1.12 -2.84 -0.31 0.00 0.00 175.10 172.92 1yq2 s PRO 113 N -3.78 2.26 0.19 4.82 0.02 -1.26 -4.95 135.00 132.30 1yq2 s PRO 113 Ca 0.29 1.39 -0.08 0.00 0.02 0.00 0.00 61.00 62.62 1yq2 s PRO 113 Cb 0.04 -1.88 0.10 0.00 0.02 0.00 0.00 34.50 32.79 1yq2 s PRO 113 CO 0.10 -1.67 1.67 -0.44 -0.33 0.00 0.00 177.00 176.33 1yq2 h ASP 114 N -0.68 1.04 -2.21 2.53 3.32 -1.96 -3.37 116.42 115.08 1yq2 h ASP 114 Ca -0.45 -0.28 -0.53 0.00 0.02 0.00 0.00 57.03 55.79 1yq2 h ASP 114 Cb 1.25 -0.28 -0.07 0.00 0.22 0.00 0.00 39.33 40.46 1yq2 h ASP 114 CO 0.51 1.07 1.15 0.00 -1.72 0.00 0.00 179.24 180.24 1yq2 s ALA 115 N -5.07 2.59 -0.38 3.45 0.00 -1.26 -4.43 121.76 116.66 1yq2 s ALA 115 Ca -0.12 -1.20 0.03 0.00 0.00 0.00 0.00 51.96 50.67 1yq2 s ALA 115 Cb 0.14 -4.28 0.16 0.00 0.00 0.00 0.00 23.12 19.13 1yq2 s ALA 115 CO 0.85 -3.47 0.36 1.21 0.00 0.00 0.00 175.76 174.71 1yq2 s ASN 116 N 4.96 1.37 -0.09 0.00 3.84 -0.30 -5.00 114.94 119.72 1yq2 s ASN 116 Ca 0.44 -1.81 -0.37 0.00 0.21 0.00 0.00 52.86 51.34 1yq2 s ASN 116 Cb -0.09 0.39 -0.14 0.00 -0.55 0.00 0.00 41.25 40.85 1yq2 s ASN 116 CO 0.16 -0.25 1.68 -2.65 -2.79 0.00 0.00 177.10 173.25 1yq2 n PRO 117 N 4.04 1.60 -4.03 0.43 -0.02 -1.25 -3.34 135.00 132.44 1yq2 n PRO 117 Ca 0.13 0.58 -0.29 0.00 -2.02 0.00 0.00 63.50 61.91 1yq2 n PRO 117 Cb 0.44 -2.32 -0.17 0.00 -0.02 0.00 0.00 33.50 31.44 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 2.73 1.35 -0.21 3.45 2.01 -0.11 -0.90 115.64 123.96 1yq2 s THR 118 Ca 0.91 -0.50 -0.08 0.00 0.31 0.00 0.00 61.69 62.33 1yq2 s THR 118 Cb -0.88 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.30 1yq2 s THR 118 CO 0.54 0.42 0.07 -0.83 -0.69 0.00 0.00 174.62 174.13 1yq2 s GLY 119 N 1.50 1.87 -0.20 4.40 0.00 0.12 -0.01 107.32 115.00 1yq2 s GLY 119 Ca 0.03 -0.88 -0.09 0.00 0.00 0.00 0.00 44.72 43.78 1yq2 s GLY 119 CO -0.09 0.24 0.10 0.99 0.00 0.00 0.00 173.10 174.34 1yq2 s ASP 120 N 0.84 5.91 -0.07 1.64 1.01 -0.43 -0.11 116.67 125.46 1yq2 s ASP 120 Ca 0.04 0.14 0.05 0.00 0.71 0.00 0.00 52.55 53.49 1yq2 s ASP 120 Cb -0.14 -2.03 -0.01 0.00 1.01 0.00 0.00 42.92 41.76 1yq2 s ASP 120 CO 0.02 0.16 -0.23 -0.36 0.21 0.00 0.00 175.17 174.97 1yq2 s PHE 121 N 0.46 2.34 -0.05 4.23 0.40 0.41 -2.04 117.98 123.73 1yq2 s PHE 121 Ca 0.06 -0.77 0.01 0.00 -0.60 0.00 0.00 56.93 55.62 1yq2 s PHE 121 Cb -0.12 -1.55 0.02 0.00 0.51 0.00 0.00 43.02 41.88 1yq2 s PHE 121 CO -0.00 -0.26 -0.04 1.03 0.70 0.00 0.00 175.22 176.65 1yq2 s ARG 122 N 0.02 0.78 -0.03 0.44 0.52 0.25 -0.82 118.95 120.11 1yq2 s ARG 122 Ca -0.08 -0.06 0.00 0.00 -0.52 0.00 0.00 55.73 55.07 1yq2 s ARG 122 Cb -0.15 -0.86 0.03 0.00 0.52 0.00 0.00 34.95 34.50 1yq2 s ARG 122 CO 0.05 -0.12 0.01 0.50 0.02 0.00 0.00 175.30 175.75 1yq2 s ARG 123 N 1.11 0.24 -0.03 3.54 6.06 0.31 -1.37 118.95 128.81 1yq2 s ARG 123 Ca -0.08 0.12 -0.03 0.00 -2.50 0.00 0.00 55.73 53.23 1yq2 s ARG 123 Cb -0.14 -0.48 -0.04 0.00 0.06 0.00 0.00 34.95 34.35 1yq2 s ARG 123 CO -0.01 -0.17 0.16 1.03 -2.50 0.00 0.00 175.30 173.81 1yq2 s ARG 124 N 1.18 3.39 0.07 5.12 3.00 -1.26 -0.16 118.95 130.28 1yq2 s ARG 124 Ca -0.08 -0.31 -0.22 0.00 0.00 0.00 0.00 55.73 55.12 1yq2 s ARG 124 Cb -0.13 -3.08 0.05 0.00 0.00 0.00 0.00 34.95 31.79 1yq2 s ARG 124 CO -0.02 0.69 0.53 -0.59 0.00 0.00 0.00 175.30 175.91 1yq2 s PHE 125 N -1.25 -0.43 -0.13 -0.53 -0.12 -0.88 -4.98 117.98 109.65 1yq2 s PHE 125 Ca 0.24 0.40 -0.07 0.00 -0.05 0.00 0.00 56.93 57.45 1yq2 s PHE 125 Cb -0.12 0.38 -0.04 0.00 -0.63 0.00 0.00 43.02 42.60 1yq2 s PHE 125 CO 0.15 -0.69 0.13 -0.51 -0.05 0.00 0.00 175.22 174.26 1yq2 s ASP 126 N -2.19 6.32 -0.17 1.98 -0.00 -1.26 -0.91 116.67 120.44 1yq2 s ASP 126 Ca -0.03 0.42 -0.01 0.00 -0.00 0.00 0.00 52.55 52.92 1yq2 s ASP 126 Cb -0.00 -2.06 -0.00 0.00 -0.00 0.00 0.00 42.92 40.85 1yq2 s ASP 126 CO -0.05 0.37 -0.11 -0.69 -0.00 0.00 0.00 175.17 174.69 1yq2 s VAL 127 N -0.78 2.94 0.36 -1.27 1.01 -0.05 -4.97 120.40 117.65 1yq2 s VAL 127 Ca 0.14 -0.66 -0.27 0.00 0.00 0.00 0.00 61.98 61.18 1yq2 s VAL 127 Cb -0.12 -2.28 -0.12 0.00 0.00 0.00 0.00 36.38 33.87 1yq2 s VAL 127 CO 0.03 0.49 1.17 -2.65 0.00 0.00 0.00 175.10 174.14 1yq2 n PRO 128 N 4.24 1.78 -0.06 2.72 -0.02 -1.26 -1.40 135.00 140.99 1yq2 n PRO 128 Ca -0.19 0.63 0.11 0.00 -2.02 0.00 0.00 63.50 62.03 1yq2 n PRO 128 Cb 0.51 -2.18 0.50 0.00 -0.02 0.00 0.00 33.50 32.32 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 2.14 2.00 -0.17 3.55 0.00 -1.95 -2.01 119.26 122.82 1yq2 h ALA 129 Ca -0.45 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.50 1yq2 h ALA 129 Cb 1.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1yq2 h ALA 129 CO 0.60 -0.12 0.16 0.37 0.00 0.00 0.00 179.25 180.27 1yq2 h GLN 130 N 0.40 0.00 0.00 0.00 4.15 -1.99 -0.97 115.11 116.70 1yq2 h GLN 130 Ca 0.25 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.67 1yq2 h GLN 130 Cb 0.48 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.17 1yq2 h GLN 130 CO -0.07 0.00 0.00 0.91 -1.93 0.00 0.00 178.83 177.74 1yq2 n TRP 131 N -4.04 0.00 0.87 3.99 7.02 -0.75 -1.94 117.44 122.59 1yq2 n TRP 131 Ca 0.01 0.00 0.10 0.00 -1.02 0.00 0.00 57.50 56.60 1yq2 n TRP 131 Cb 0.28 -0.47 0.08 0.00 -2.42 0.00 0.00 31.31 28.78 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 -1.47 0.00 -1.32 -5.99 3.72 -0.37 -4.70 117.46 107.33 1yq2 n PHE 132 Ca 0.05 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.13 1yq2 n PHE 132 Cb 0.21 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 38.83 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 -1.77 2.23 0.15 -1.08 2.02 -0.82 -4.90 118.70 114.52 1yq2 s GLU 133 Ca 0.24 1.30 0.12 0.00 0.02 0.00 0.00 54.97 56.65 1yq2 s GLU 133 Cb 0.17 -1.89 0.59 0.00 0.10 0.00 0.00 34.13 33.11 1yq2 s GLU 133 CO 0.28 -1.68 1.35 -1.13 0.02 0.00 0.00 175.26 174.10 1yq2 n SER 134 N -3.29 0.27 0.15 -0.19 3.41 -1.26 -1.30 113.62 111.41 1yq2 n SER 134 Ca 0.10 0.62 0.13 0.00 -0.26 0.00 0.00 58.87 59.45 1yq2 n SER 134 Cb 0.52 -0.65 0.52 0.00 -0.26 0.00 0.00 64.21 64.34 1yq2 n SER 134 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1yq2 h THR 135 N 0.00 0.00 -3.43 6.66 1.35 -1.90 -3.42 112.91 112.16 1yq2 h THR 135 Ca 0.00 -0.27 -0.64 0.00 -0.55 0.00 0.00 66.41 64.95 1yq2 h THR 135 Cb 0.05 1.04 -0.23 0.00 -1.73 0.00 0.00 68.15 67.28 1yq2 h THR 135 CO 0.00 0.00 -0.66 -0.89 -0.25 0.00 0.00 175.52 173.72 1yq2 s THR 136 N -3.37 3.94 -0.03 6.82 2.01 -0.42 -0.07 115.64 124.52 1yq2 s THR 136 Ca 0.04 -0.32 0.07 0.00 0.31 0.00 0.00 61.69 61.79 1yq2 s THR 136 Cb 0.09 -2.78 -0.24 0.00 0.01 0.00 0.00 72.50 69.58 1yq2 s THR 136 CO 0.41 0.43 0.71 0.00 -0.69 0.00 0.00 174.62 175.48 1yq2 h ALA 137 N 7.52 0.62 -2.89 7.40 0.00 -0.00 -3.44 119.26 128.47 1yq2 h ALA 137 Ca -0.36 -1.35 -0.03 0.00 0.00 0.00 0.00 54.91 53.17 1yq2 h ALA 137 Cb 1.18 0.43 -0.13 0.00 0.00 0.00 0.00 17.79 19.27 1yq2 h ALA 137 CO 0.61 1.46 0.17 0.00 0.00 0.00 0.00 179.25 181.49 1yq2 s ALA 138 N -2.61 -1.54 -0.11 0.00 0.00 -1.18 -5.02 121.76 111.32 1yq2 s ALA 138 Ca -0.07 0.50 0.03 0.00 0.00 0.00 0.00 51.96 52.42 1yq2 s ALA 138 Cb 0.08 0.79 0.00 0.00 0.00 0.00 0.00 23.12 24.00 1yq2 s ALA 138 CO 0.82 -0.72 -0.22 -0.51 0.00 0.00 0.00 175.76 175.13 1yq2 s LEU 139 N -2.62 2.04 -0.09 0.00 1.02 -1.26 -0.55 118.68 117.22 1yq2 s LEU 139 Ca 0.00 -0.54 0.05 0.00 0.02 0.00 0.00 54.13 53.65 1yq2 s LEU 139 Cb -0.01 -1.36 -0.00 0.00 0.02 0.00 0.00 46.19 44.84 1yq2 s LEU 139 CO -0.11 0.12 -0.24 -0.89 0.02 0.00 0.00 176.35 175.26 1yq2 s THR 140 N 0.51 2.02 -0.21 5.49 2.01 -0.20 -1.17 115.64 124.09 1yq2 s THR 140 Ca -0.15 -1.01 -0.06 0.00 0.31 0.00 0.00 61.69 60.77 1yq2 s THR 140 Cb -0.17 -1.74 -0.03 0.00 0.01 0.00 0.00 72.50 70.57 1yq2 s THR 140 CO 0.06 0.55 0.03 -0.22 -0.69 0.00 0.00 174.62 174.35 1yq2 s LEU 141 N 0.21 3.45 -0.09 4.42 2.96 -0.31 -0.60 118.68 128.72 1yq2 s LEU 141 Ca -0.15 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 1yq2 s LEU 141 Cb -0.17 -1.88 -0.00 0.00 0.50 0.00 0.00 46.19 44.63 1yq2 s LEU 141 CO 0.07 0.07 -0.23 -0.60 -1.32 0.00 0.00 176.35 174.34 1yq2 s ARG 142 N 0.97 2.91 -0.20 1.98 3.52 0.38 -0.70 118.95 127.81 1yq2 s ARG 142 Ca 0.03 -0.87 -0.02 0.00 -0.13 0.00 0.00 55.73 54.74 1yq2 s ARG 142 Cb -0.14 -2.28 0.00 0.00 -1.56 0.00 0.00 34.95 30.97 1yq2 s ARG 142 CO 0.02 0.25 -0.11 -0.06 -0.81 0.00 0.00 175.30 174.59 1yq2 s PHE 143 N 0.17 2.87 -0.98 5.12 0.40 -0.02 -1.58 117.98 123.97 1yq2 s PHE 143 Ca -0.13 -1.21 0.26 0.00 -0.60 0.00 0.00 56.93 55.25 1yq2 s PHE 143 Cb -0.16 -2.01 0.65 0.00 0.51 0.00 0.00 43.02 42.01 1yq2 s PHE 143 CO 0.07 -0.64 1.52 -0.25 0.70 0.00 0.00 175.22 176.62 1yq2 n ASP 144 N 4.65 0.41 0.00 1.36 8.00 -0.56 -1.00 116.55 129.41 1yq2 n ASP 144 Ca -0.19 -0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.24 1yq2 n ASP 144 Cb 0.51 0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 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 1.49 0.48 2.83 0.44 0.00 -1.26 -4.15 105.19 105.03 1yq2 n GLY 145 Ca 0.06 0.66 -0.15 0.00 0.00 0.00 0.00 46.02 46.59 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 -0.08 -0.25 1.61 1.01 -0.91 -2.29 120.40 119.49 1yq2 s VAL 146 Ca 0.00 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.18 1yq2 s VAL 146 Cb 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 36.38 36.22 1yq2 s VAL 146 CO 0.00 0.10 -0.02 -0.70 0.00 0.00 0.00 175.10 174.47 1yq2 s GLU 147 N 1.32 3.01 -0.01 2.72 2.12 -0.47 -4.15 118.70 123.24 1yq2 s GLU 147 Ca -0.07 -0.87 0.01 0.00 0.36 0.00 0.00 54.97 54.40 1yq2 s GLU 147 Cb -0.12 -3.08 -0.01 0.00 0.26 0.00 0.00 34.13 31.17 1yq2 s GLU 147 CO -0.04 -0.37 -0.00 -1.13 -0.54 0.00 0.00 175.26 173.18 1yq2 n SER 148 N 4.74 4.41 -4.05 -1.70 3.41 -0.04 -1.33 113.62 119.07 1yq2 n SER 148 Ca -0.16 -0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.26 1yq2 n SER 148 Cb 0.48 0.32 -0.14 0.00 -0.26 0.00 0.00 64.21 64.61 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 -2.03 0.75 0.01 4.33 3.52 -1.20 -4.12 118.95 120.20 1yq2 s ARG 149 Ca -0.01 -0.47 -0.06 0.00 -0.13 0.00 0.00 55.73 55.06 1yq2 s ARG 149 Cb 0.00 -0.70 -0.00 0.00 -1.56 0.00 0.00 34.95 32.69 1yq2 s ARG 149 CO 0.04 0.18 0.11 1.52 -0.81 0.00 0.00 175.30 176.34 1yq2 s TYR 150 N -0.50 0.08 0.01 5.12 -0.85 -0.99 -1.08 117.35 119.15 1yq2 s TYR 150 Ca 0.01 -0.20 0.08 0.00 -0.52 0.00 0.00 57.07 56.45 1yq2 s TYR 150 Cb -0.05 -0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.19 1yq2 s TYR 150 CO 0.00 -0.27 -0.26 0.21 -1.52 0.00 0.00 175.55 173.71 1yq2 s LYS 151 N -1.40 1.97 -0.08 -3.49 2.20 -0.44 -0.99 119.74 117.50 1yq2 s LYS 151 Ca -0.15 -1.01 0.03 0.00 -0.36 0.00 0.00 55.97 54.48 1yq2 s LYS 151 Cb -0.08 -2.02 0.00 0.00 -1.51 0.00 0.00 37.83 34.22 1yq2 s LYS 151 CO 0.01 0.54 -0.19 0.08 -0.36 0.00 0.00 175.35 175.43 1yq2 s VAL 152 N -0.71 1.67 -0.02 4.02 1.01 -0.33 -1.15 120.40 124.89 1yq2 s VAL 152 Ca 0.11 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.35 1yq2 s VAL 152 Cb -0.10 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 1yq2 s VAL 152 CO 0.01 0.47 -0.18 0.26 0.00 0.00 0.00 175.10 175.66 1yq2 s TRP 153 N 0.44 1.69 -0.13 5.22 0.51 -0.22 -0.36 118.94 126.09 1yq2 s TRP 153 Ca -0.16 -0.36 0.01 0.00 -2.12 0.00 0.00 56.10 53.47 1yq2 s TRP 153 Cb -0.17 -1.10 0.02 0.00 -0.81 0.00 0.00 33.47 31.41 1yq2 s TRP 153 CO 0.07 -0.06 -0.16 0.08 -0.51 0.00 0.00 176.95 176.37 1yq2 s VAL 154 N -0.34 1.60 -1.52 4.03 1.01 -0.23 -1.18 120.40 123.77 1yq2 s VAL 154 Ca 0.05 -0.68 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 1yq2 s VAL 154 Cb -0.08 -1.47 0.08 0.00 0.00 0.00 0.00 36.38 34.90 1yq2 s VAL 154 CO -0.00 0.46 0.80 0.59 0.00 0.00 0.00 175.10 176.95 1yq2 n ASN 155 N 4.45 -3.11 0.00 3.32 3.02 -0.12 -0.92 115.26 121.90 1yq2 n ASN 155 Ca -0.18 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 1yq2 n ASN 155 Cb 0.51 -3.50 0.00 0.00 -0.61 0.00 0.00 39.78 36.18 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 -1.65 2.15 3.75 7.41 0.00 -1.22 -4.83 105.19 110.79 1yq2 n GLY 156 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.03 4.28 0.11 1.61 -0.21 -0.09 -4.87 119.66 120.46 1yq2 s GLN 157 Ca 0.00 0.53 -0.31 0.00 0.02 0.00 0.00 55.36 55.60 1yq2 s GLN 157 Cb 0.00 -3.39 -0.09 0.00 1.00 0.00 0.00 33.01 30.53 1yq2 s GLN 157 CO 0.00 0.27 1.64 -2.00 -2.12 0.00 0.00 175.29 173.08 1yq2 s GLU 158 N 0.22 4.20 -0.22 2.91 2.12 -1.26 -1.07 118.70 125.60 1yq2 s GLU 158 Ca 0.27 2.37 -0.05 0.00 0.36 0.00 0.00 54.97 57.91 1yq2 s GLU 158 Cb -0.16 -3.44 -0.12 0.00 0.26 0.00 0.00 34.13 30.67 1yq2 s GLU 158 CO 0.13 -0.70 -0.25 -0.89 -0.54 0.00 0.00 175.26 173.01 1yq2 n ILE 159 N 4.46 1.24 -3.38 -3.70 2.08 0.51 -4.93 119.36 115.65 1yq2 n ILE 159 Ca 0.15 -0.39 0.00 0.00 0.56 0.00 0.00 62.75 63.07 1yq2 n ILE 159 Cb 0.40 -1.56 0.00 0.00 -0.75 0.00 0.00 39.64 37.73 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 1.99 -1.37 3.04 7.39 0.00 -1.20 -0.62 105.19 114.42 1yq2 n GLY 160 Ca -0.42 -1.05 -0.23 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.95 1.07 0.23 1.61 1.01 0.27 -1.19 120.40 120.45 1yq2 s VAL 161 Ca 0.00 -0.49 0.08 0.00 0.00 0.00 0.00 61.98 61.58 1yq2 s VAL 161 Cb 0.00 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1yq2 s VAL 161 CO 0.00 0.33 0.02 -0.83 0.00 0.00 0.00 175.10 174.62 1yq2 s GLY 162 N 0.35 1.64 0.11 4.51 0.00 -0.16 -1.82 107.32 111.95 1yq2 s GLY 162 Ca -0.08 -1.52 -0.13 0.00 0.00 0.00 0.00 44.72 42.99 1yq2 s GLY 162 CO 0.02 -1.57 0.31 -0.56 0.00 0.00 0.00 173.10 171.30 1yq2 s SER 163 N -3.44 -0.08 0.00 1.64 0.01 -1.26 -2.33 113.70 108.23 1yq2 s SER 163 Ca 0.30 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 57.10 1yq2 s SER 163 Cb -0.08 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.57 1yq2 s SER 163 CO 0.20 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 173.66 1yq2 n GLY 164 N -0.15 0.55 0.35 3.44 0.00 -1.26 -4.89 105.19 103.22 1yq2 n GLY 164 Ca -0.16 -0.64 0.09 0.00 0.00 0.00 0.00 46.02 45.31 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 0.49 -0.35 1.61 0.02 -1.79 -1.76 113.55 111.77 1yq2 h SER 165 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1yq2 h SER 165 Cb 0.00 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.44 1yq2 h SER 165 CO 0.00 0.31 0.00 0.54 -1.14 0.00 0.00 176.83 176.54 1yq2 n ARG 166 N -4.48 3.05 -4.36 3.45 3.00 -1.26 -2.15 116.66 113.91 1yq2 n ARG 166 Ca 0.09 -2.54 -0.33 0.00 -0.01 0.00 0.00 57.85 55.06 1yq2 n ARG 166 Cb 0.28 -1.63 -0.09 0.00 0.00 0.00 0.00 32.46 31.02 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 -1.98 3.42 0.43 0.55 1.43 -0.66 -4.49 118.68 117.38 1yq2 s LEU 167 Ca 0.36 -0.01 -0.22 0.00 -1.03 0.00 0.00 54.13 53.23 1yq2 s LEU 167 Cb 0.25 -1.92 -0.10 0.00 0.03 0.00 0.00 46.19 44.46 1yq2 s LEU 167 CO 0.14 0.30 1.00 0.00 0.23 0.00 0.00 176.35 178.02 1yq2 s ALA 168 N -1.01 3.00 -0.02 4.21 0.00 -1.26 -4.39 121.76 122.29 1yq2 s ALA 168 Ca 0.17 0.54 -0.00 0.00 0.00 0.00 0.00 51.96 52.67 1yq2 s ALA 168 Cb -0.11 -3.21 0.03 0.00 0.00 0.00 0.00 23.12 19.82 1yq2 s ALA 168 CO 0.08 -0.09 0.04 -1.14 0.00 0.00 0.00 175.76 174.65 1yq2 s GLN 169 N -2.96 -0.01 -0.01 0.00 2.00 -0.17 -5.01 119.66 113.50 1yq2 s GLN 169 Ca 0.62 0.19 0.04 0.00 -2.00 0.00 0.00 55.36 54.21 1yq2 s GLN 169 Cb -0.15 -0.20 -0.03 0.00 0.80 0.00 0.00 33.01 33.42 1yq2 s GLN 169 CO 0.19 -0.15 -0.12 -1.21 -0.50 0.00 0.00 175.29 173.51 1yq2 s GLU 170 N 0.94 2.44 0.09 1.67 2.02 -1.26 -0.84 118.70 123.76 1yq2 s GLU 170 Ca -0.08 -0.76 0.08 0.00 0.02 0.00 0.00 54.97 54.23 1yq2 s GLU 170 Cb -0.11 -2.39 -0.03 0.00 0.10 0.00 0.00 34.13 31.69 1yq2 s GLU 170 CO -0.03 0.60 -0.21 -0.06 0.02 0.00 0.00 175.26 175.58 1yq2 s PHE 171 N -0.88 1.82 -0.45 1.61 0.40 0.13 -1.64 117.98 118.96 1yq2 s PHE 171 Ca 0.14 -0.40 -0.24 0.00 -0.60 0.00 0.00 56.93 55.83 1yq2 s PHE 171 Cb -0.11 -1.02 0.03 0.00 0.51 0.00 0.00 43.02 42.43 1yq2 s PHE 171 CO 0.04 0.18 0.85 0.34 0.70 0.00 0.00 175.22 177.33 1yq2 s ASP 172 N -1.71 6.46 -0.14 1.36 3.68 0.26 -1.16 116.67 125.42 1yq2 s ASP 172 Ca 0.07 0.01 0.15 0.00 2.13 0.00 0.00 52.55 54.92 1yq2 s ASP 172 Cb -0.10 -2.42 0.57 0.00 -1.45 0.00 0.00 42.92 39.53 1yq2 s ASP 172 CO 0.04 -0.97 1.49 1.33 0.13 0.00 0.00 175.17 177.18 1yq2 n VAL 173 N 6.25 2.02 -0.24 1.11 0.24 -0.32 -4.72 118.33 122.68 1yq2 n VAL 173 Ca 0.04 -1.49 0.02 0.00 -2.04 0.00 0.00 64.34 60.87 1yq2 n VAL 173 Cb 0.48 -0.03 0.11 0.00 -1.47 0.00 0.00 33.84 32.94 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 2.68 -0.47 1.02 -1.34 0.02 -1.88 -1.85 113.55 111.73 1yq2 h SER 174 Ca 0.00 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1yq2 h SER 174 Cb 1.39 0.37 0.00 0.00 0.14 0.00 0.00 62.40 64.30 1yq2 h SER 174 CO 0.22 -0.19 -0.22 0.47 -1.14 0.00 0.00 176.83 175.97 1yq2 n ASP 175 N -5.39 0.48 -0.09 3.07 8.00 -1.26 -4.10 116.55 117.26 1yq2 n ASP 175 Ca 0.11 0.31 -0.11 0.00 0.71 0.00 0.00 54.79 55.81 1yq2 n ASP 175 Cb 0.40 -0.31 -0.15 0.00 -0.02 0.00 0.00 41.12 41.03 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 -1.66 1.49 -1.74 2.24 0.00 -0.74 -4.98 120.51 115.13 1yq2 n ALA 176 Ca 0.05 -1.26 -0.32 0.00 0.00 0.00 0.00 53.44 51.92 1yq2 n ALA 176 Cb 0.39 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.60 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 -5.64 3.42 0.16 0.00 1.43 -0.94 -4.73 118.68 112.37 1yq2 s LEU 177 Ca -0.12 1.63 0.02 0.00 -1.03 0.00 0.00 54.13 54.63 1yq2 s LEU 177 Cb 0.06 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.73 1yq2 s LEU 177 CO 0.81 -0.99 -0.02 0.00 0.23 0.00 0.00 176.35 176.38 1yq2 s ARG 178 N -4.46 1.05 0.38 1.70 1.70 -1.26 -5.01 118.95 113.04 1yq2 s ARG 178 Ca 0.59 -1.49 -0.26 0.00 -0.47 0.00 0.00 55.73 54.10 1yq2 s ARG 178 Cb -0.13 -0.27 -0.09 0.00 -0.57 0.00 0.00 34.95 33.90 1yq2 s ARG 178 CO 0.42 -0.10 1.22 0.00 -1.08 0.00 0.00 175.30 175.76 1yq2 s ALA 179 N -3.64 3.26 0.00 7.88 0.00 -1.26 -4.57 121.76 123.43 1yq2 s ALA 179 Ca 0.21 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.24 1yq2 s ALA 179 Cb 0.06 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1yq2 s ALA 179 CO 0.02 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.60 1yq2 n GLY 180 N 0.73 0.75 3.78 0.00 0.00 -0.50 -4.92 105.19 105.03 1yq2 n GLY 180 Ca 0.03 -1.28 -0.39 0.00 0.00 0.00 0.00 46.02 44.38 1yq2 n GLY 180 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1yq2 s SER 181 N -4.00 7.10 0.18 1.61 0.15 -1.26 -0.87 113.70 116.61 1yq2 s SER 181 Ca 0.00 1.31 0.02 0.00 0.70 0.00 0.00 55.95 57.98 1yq2 s SER 181 Cb 0.00 -2.40 -0.05 0.00 -1.71 0.00 0.00 66.02 61.86 1yq2 s SER 181 CO 0.00 0.16 -0.01 0.20 1.20 0.00 0.00 173.24 174.79 1yq2 s ASN 182 N -0.60 1.38 -0.08 5.45 0.01 -0.09 -4.85 114.94 116.17 1yq2 s ASN 182 Ca 0.32 -1.16 0.04 0.00 -0.71 0.00 0.00 52.86 51.36 1yq2 s ASN 182 Cb -0.20 0.08 -0.00 0.00 0.41 0.00 0.00 41.25 41.55 1yq2 s ASN 182 CO 0.20 -0.53 -0.22 -0.22 -1.51 0.00 0.00 177.10 174.82 1yq2 s LEU 183 N -3.19 2.00 -0.10 0.60 2.96 -1.26 -2.07 118.68 117.61 1yq2 s LEU 183 Ca 0.23 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.70 1yq2 s LEU 183 Cb 0.06 -1.26 -0.00 0.00 0.50 0.00 0.00 46.19 45.49 1yq2 s LEU 183 CO 0.04 0.17 -0.24 -0.22 -1.32 0.00 0.00 176.35 174.78 1yq2 s LEU 184 N 0.20 2.11 -0.09 -0.68 2.96 0.77 -0.95 118.68 123.00 1yq2 s LEU 184 Ca -0.12 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.26 1yq2 s LEU 184 Cb -0.16 -1.42 0.01 0.00 0.50 0.00 0.00 46.19 45.13 1yq2 s LEU 184 CO 0.06 0.16 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.41 1yq2 s VAL 185 N 0.35 1.38 -0.08 1.68 1.01 -0.32 -0.53 120.40 123.89 1yq2 s VAL 185 Ca -0.18 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.23 1yq2 s VAL 185 Cb -0.18 -1.25 0.00 0.00 0.00 0.00 0.00 36.38 34.95 1yq2 s VAL 185 CO 0.09 0.41 -0.20 -0.69 0.00 0.00 0.00 175.10 174.71 1yq2 s VAL 186 N 0.77 1.70 -0.21 2.92 1.01 0.00 -1.06 120.40 125.53 1yq2 s VAL 186 Ca -0.12 -0.82 -0.04 0.00 0.00 0.00 0.00 61.98 61.00 1yq2 s VAL 186 Cb -0.16 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.73 1yq2 s VAL 186 CO 0.02 0.48 -0.03 -0.60 0.00 0.00 0.00 175.10 174.97 1yq2 s ARG 187 N 0.37 3.46 -0.14 2.72 3.52 -0.30 -0.45 118.95 128.13 1yq2 s ARG 187 Ca -0.15 -0.59 0.01 0.00 -0.13 0.00 0.00 55.73 54.87 1yq2 s ARG 187 Cb -0.16 -3.01 -0.00 0.00 -1.56 0.00 0.00 34.95 30.21 1yq2 s ARG 187 CO 0.06 -0.11 -0.18 0.08 -0.81 0.00 0.00 175.30 174.35 1yq2 s VAL 188 N 1.27 2.50 -0.16 7.11 1.01 0.85 -1.33 120.40 131.64 1yq2 s VAL 188 Ca 0.03 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 1yq2 s VAL 188 Cb -0.14 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1yq2 s VAL 188 CO -0.01 0.53 0.10 -1.00 0.00 0.00 0.00 175.10 174.72 1yq2 s HIS 189 N 0.65 3.39 0.07 5.22 3.76 -0.24 0.13 115.29 128.28 1yq2 s HIS 189 Ca -0.09 0.29 -0.27 0.00 -0.15 0.00 0.00 55.06 54.84 1yq2 s HIS 189 Cb -0.16 -2.04 -0.17 0.00 1.11 0.00 0.00 32.58 31.32 1yq2 s HIS 189 CO 0.02 0.39 1.62 0.37 -0.85 0.00 0.00 174.74 176.29 1yq2 h GLN 190 N 6.08 -0.36 -5.79 1.40 4.15 -1.26 -0.05 115.11 119.28 1yq2 h GLN 190 Ca -0.44 0.02 -0.67 0.00 0.77 0.00 0.00 58.65 58.33 1yq2 h GLN 190 Cb 1.18 0.08 -0.09 0.00 0.21 0.00 0.00 27.48 28.86 1yq2 h GLN 190 CO 0.67 -0.19 -0.53 -1.58 -1.93 0.00 0.00 178.83 175.27 1yq2 s TRP 191 N -5.88 3.44 0.39 3.99 0.23 -1.26 -3.97 118.94 115.88 1yq2 s TRP 191 Ca -0.15 0.39 -0.12 0.00 -2.03 0.00 0.00 56.10 54.18 1yq2 s TRP 191 Cb 0.04 -1.86 0.05 0.00 0.03 0.00 0.00 33.47 31.73 1yq2 s TRP 191 CO 0.63 0.64 0.73 -1.54 0.96 0.00 0.00 176.95 178.37 1yq2 s SER 192 N -1.17 0.25 0.49 2.95 1.04 -1.26 -4.88 113.70 111.12 1yq2 s SER 192 Ca 0.17 -1.27 0.16 0.00 0.48 0.00 0.00 55.95 55.48 1yq2 s SER 192 Cb -0.12 0.82 1.18 0.00 0.10 0.00 0.00 66.02 68.00 1yq2 s SER 192 CO 0.06 -1.64 2.08 0.00 0.98 0.00 0.00 173.24 174.72 1yq2 h ALA 193 N 2.02 2.04 -0.01 5.32 0.00 -1.54 -0.90 119.26 126.20 1yq2 h ALA 193 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1yq2 h ALA 193 Cb 1.25 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1yq2 h ALA 193 CO 0.41 -0.10 0.02 0.00 0.00 0.00 0.00 179.25 179.58 1yq2 h ALA 194 N 1.85 1.20 0.00 0.00 0.00 -1.85 -2.56 119.26 117.90 1yq2 h ALA 194 Ca 0.12 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1yq2 h ALA 194 Cb 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1yq2 h ALA 194 CO -0.02 -0.02 -0.30 0.77 0.00 0.00 0.00 179.25 179.67 1yq2 h SER 195 N 0.00 0.00 0.07 0.00 0.02 -1.51 -1.33 113.55 110.79 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 0.04 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 1yq2 h SER 195 CO -0.00 0.30 -0.06 1.88 -1.14 0.00 0.00 176.83 177.82 1yq2 h TYR 196 N 0.00 0.00 -0.01 3.45 -1.99 -1.62 -2.44 116.97 114.37 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 0.63 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.36 1yq2 h TYR 196 CO 0.00 0.06 -0.08 1.28 -0.00 0.00 0.00 178.16 179.42 1yq2 n LEU 197 N -4.37 1.26 -2.56 3.88 4.77 -0.51 -4.45 117.00 115.03 1yq2 n LEU 197 Ca -0.03 -0.39 -0.20 0.00 -0.03 0.00 0.00 56.01 55.36 1yq2 n LEU 197 Cb 0.14 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.20 1yq2 n LEU 197 CO 0.34 0.22 0.07 -0.62 -1.33 0.00 0.00 177.39 176.06 1yq2 n GLU 198 N -0.16 2.51 -0.98 3.23 1.02 -0.92 -0.55 120.64 124.79 1yq2 n GLU 198 Ca 0.17 -4.01 -0.21 0.00 -0.02 0.00 0.00 57.16 53.09 1yq2 n GLU 198 Cb 0.34 -1.85 0.07 0.00 -0.02 0.00 0.00 31.44 29.99 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 -0.31 6.04 -4.68 1.62 2.03 0.02 -4.94 116.55 116.33 1yq2 n ASP 199 Ca 0.27 -3.25 -0.37 0.00 0.52 0.00 0.00 54.79 51.96 1yq2 n ASP 199 Cb 0.72 -0.95 0.07 0.00 -0.72 0.00 0.00 41.12 40.24 1yq2 n ASP 199 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1yq2 n GLN 200 N -0.22 0.97 -2.37 -0.67 3.00 -1.26 -4.68 117.38 112.16 1yq2 n GLN 200 Ca 0.41 0.38 -0.36 0.00 -0.01 0.00 0.00 57.00 57.42 1yq2 n GLN 200 Cb 0.78 -2.38 -0.04 0.00 0.00 0.00 0.00 30.24 28.60 1yq2 n GLN 200 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1yq2 s ASP 201 N -1.37 6.01 0.04 1.08 2.15 -1.26 -4.83 116.67 118.50 1yq2 s ASP 201 Ca 0.80 -1.30 -0.27 0.00 0.43 0.00 0.00 52.55 52.20 1yq2 s ASP 201 Cb -0.39 -2.57 0.10 0.00 -0.30 0.00 0.00 42.92 39.76 1yq2 s ASP 201 CO 0.43 -1.96 1.20 0.00 -0.17 0.00 0.00 175.17 174.67 1yq2 s GLN 202 N 5.65 0.67 0.40 4.34 -2.07 -1.22 -5.01 119.66 122.42 1yq2 s GLN 202 Ca 0.56 -0.41 -0.26 0.00 -1.82 0.00 0.00 55.36 53.43 1yq2 s GLN 202 Cb -0.02 0.20 -0.09 0.00 -1.09 0.00 0.00 33.01 32.02 1yq2 s GLN 202 CO -0.04 -0.31 1.27 -1.58 -1.32 0.00 0.00 175.29 173.31 1yq2 s TRP 203 N -2.34 2.88 -0.21 9.60 0.52 -1.26 -3.93 118.94 124.20 1yq2 s TRP 203 Ca 0.20 1.44 -0.24 0.00 0.02 0.00 0.00 56.10 57.53 1yq2 s TRP 203 Cb 0.01 -3.61 -0.01 0.00 -1.15 0.00 0.00 33.47 28.71 1yq2 s TRP 203 CO -0.00 -1.92 0.79 -1.58 0.02 0.00 0.00 176.95 174.26 1yq2 s TRP 204 N -1.29 3.36 -0.36 -1.98 0.52 0.36 -4.95 118.94 114.61 1yq2 s TRP 204 Ca 0.57 1.13 0.00 0.00 0.02 0.00 0.00 56.10 57.82 1yq2 s TRP 204 Cb -0.37 -2.99 0.14 0.00 -1.15 0.00 0.00 33.47 29.11 1yq2 s TRP 204 CO 0.47 -0.30 0.22 -0.51 0.02 0.00 0.00 176.95 176.84 1yq2 s LEU 205 N 2.41 1.06 0.59 2.99 1.43 -1.26 -3.33 118.68 122.57 1yq2 s LEU 205 Ca 0.35 -2.23 -0.16 0.00 -1.03 0.00 0.00 54.13 51.06 1yq2 s LEU 205 Cb -0.16 -0.42 -0.04 0.00 0.03 0.00 0.00 46.19 45.60 1yq2 s LEU 205 CO 0.10 -0.30 1.06 -2.16 0.23 0.00 0.00 176.35 175.27 1yq2 s PRO 206 N 1.01 3.34 0.00 1.29 0.04 -1.26 -4.76 135.00 134.65 1yq2 s PRO 206 Ca 0.18 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.45 1yq2 s PRO 206 Cb -0.22 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.28 1yq2 s PRO 206 CO 0.00 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.66 1yq2 n GLY 207 N -0.92 0.99 3.43 0.56 0.00 -0.44 -2.02 105.19 106.78 1yq2 n GLY 207 Ca 0.09 -1.90 -0.44 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.11 4.82 -1.84 -0.61 1.01 -1.20 -1.37 121.20 120.90 1yq2 s ILE 208 Ca 0.00 -1.51 0.21 0.00 0.00 0.00 0.00 60.65 59.34 1yq2 s ILE 208 Cb 0.00 -4.70 -0.02 0.00 0.01 0.00 0.00 42.46 37.76 1yq2 s ILE 208 CO 0.00 -1.40 1.01 2.22 0.00 0.00 0.00 174.94 176.78 1yq2 n PHE 209 N 6.29 0.00 -4.64 3.97 1.16 -0.97 -1.16 117.46 122.11 1yq2 n PHE 209 Ca 0.16 0.00 -0.29 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 38.26 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 -2.33 2.04 0.54 3.97 0.52 -1.02 -4.39 118.95 118.28 1yq2 s ARG 210 Ca 0.17 -2.26 -0.22 0.00 -0.52 0.00 0.00 55.73 52.90 1yq2 s ARG 210 Cb 0.17 -1.16 -0.05 0.00 0.52 0.00 0.00 34.95 34.42 1yq2 s ARG 210 CO 0.53 -0.36 1.36 -0.25 0.02 0.00 0.00 175.30 176.60 1yq2 n ASP 211 N -1.21 2.69 -4.24 0.23 9.92 -1.26 -4.57 116.55 118.11 1yq2 n ASP 211 Ca -0.12 0.98 -0.34 0.00 -0.53 0.00 0.00 54.79 54.79 1yq2 n ASP 211 Cb 0.66 -1.58 -0.15 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 -1.29 2.71 0.09 2.53 1.01 -1.26 -1.50 120.40 122.69 1yq2 s VAL 212 Ca 0.71 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.97 1yq2 s VAL 212 Cb -0.42 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 1yq2 s VAL 212 CO 0.49 0.50 -0.06 0.42 0.00 0.00 0.00 175.10 176.45 1yq2 s THR 213 N 1.13 0.58 -0.05 3.92 -4.23 -0.61 0.01 115.64 116.38 1yq2 s THR 213 Ca 0.01 -1.91 0.05 0.00 -1.18 0.00 0.00 61.69 58.66 1yq2 s THR 213 Cb -0.14 -1.65 -0.02 0.00 1.34 0.00 0.00 72.50 72.03 1yq2 s THR 213 CO -0.05 -0.90 -0.20 -0.76 -0.54 0.00 0.00 174.62 172.17 1yq2 s LEU 214 N -3.01 2.38 0.00 4.79 1.43 0.52 -0.47 118.68 124.32 1yq2 s LEU 214 Ca 0.11 -0.36 0.06 0.00 -1.03 0.00 0.00 54.13 52.90 1yq2 s LEU 214 Cb 0.06 -1.46 -0.02 0.00 0.03 0.00 0.00 46.19 44.81 1yq2 s LEU 214 CO -0.06 0.30 -0.18 -1.58 0.23 0.00 0.00 176.35 175.06 1yq2 s GLN 215 N -0.45 1.38 -0.44 1.70 0.74 0.23 -0.75 119.66 122.07 1yq2 s GLN 215 Ca 0.05 -0.71 -0.16 0.00 0.05 0.00 0.00 55.36 54.59 1yq2 s GLN 215 Cb -0.12 -1.38 0.04 0.00 1.10 0.00 0.00 33.01 32.66 1yq2 s GLN 215 CO 0.01 0.37 0.36 0.00 -0.55 0.00 0.00 175.29 175.48 1yq2 s ALA 216 N -0.54 3.50 -0.18 1.58 0.00 0.12 -1.04 121.76 125.20 1yq2 s ALA 216 Ca 0.06 -1.83 -0.29 0.00 0.00 0.00 0.00 51.96 49.90 1yq2 s ALA 216 Cb -0.07 -2.99 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 1yq2 s ALA 216 CO 0.00 -1.58 1.45 1.03 0.00 0.00 0.00 175.76 176.65 1yq2 s ARG 217 N 1.75 4.05 0.34 0.00 1.81 0.29 -4.09 118.95 123.11 1yq2 s ARG 217 Ca 0.06 1.70 -0.29 0.00 -1.72 0.00 0.00 55.73 55.48 1yq2 s ARG 217 Cb -0.21 -3.90 -0.11 0.00 -0.45 0.00 0.00 34.95 30.29 1yq2 s ARG 217 CO 0.09 -0.96 1.41 -2.14 -0.68 0.00 0.00 175.30 173.02 1yq2 s PRO 218 N 4.04 4.23 0.17 3.54 0.02 -1.26 0.65 135.00 146.39 1yq2 s PRO 218 Ca 0.63 2.39 -0.31 0.00 0.02 0.00 0.00 61.00 63.73 1yq2 s PRO 218 Cb -0.24 -3.03 -0.09 0.00 0.02 0.00 0.00 34.50 31.16 1yq2 s PRO 218 CO 0.23 -0.38 1.43 0.00 -0.33 0.00 0.00 177.00 177.95 1yq2 s ALA 219 N -0.95 3.63 -1.42 -1.55 0.00 0.90 -1.69 121.76 120.67 1yq2 s ALA 219 Ca 0.52 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.70 1yq2 s ALA 219 Cb -0.43 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.14 1yq2 s ALA 219 CO 0.56 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 176.06 1yq2 n GLY 220 N 3.07 0.90 2.75 0.00 0.00 -1.26 -4.76 105.19 105.89 1yq2 n GLY 220 Ca 0.10 -0.33 -0.19 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.15 -0.60 3.30 -0.02 0.00 -0.68 -4.28 105.19 101.76 1yq2 n GLY 221 Ca -0.15 -1.82 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 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 -2.71 3.73 0.16 -0.61 1.01 -1.26 -4.41 121.20 117.11 1yq2 s ILE 222 Ca 0.51 -0.85 -0.07 0.00 0.00 0.00 0.00 60.65 60.24 1yq2 s ILE 222 Cb -0.02 -2.96 -0.06 0.00 0.01 0.00 0.00 42.46 39.43 1yq2 s ILE 222 CO 0.35 0.04 1.47 0.74 0.00 0.00 0.00 174.94 177.54 1yq2 h THR 223 N 5.99 1.30 -2.79 2.92 2.02 -1.26 -3.46 112.91 117.63 1yq2 h THR 223 Ca -0.30 -1.73 -0.07 0.00 0.77 0.00 0.00 66.41 65.09 1yq2 h THR 223 Cb 1.11 1.65 -0.17 0.00 -1.74 0.00 0.00 68.15 69.01 1yq2 h THR 223 CO 0.60 0.55 -0.02 -0.62 0.37 0.00 0.00 175.52 176.40 1yq2 s ASP 224 N -6.92 -0.39 0.00 4.18 2.15 -1.07 -4.84 116.67 109.78 1yq2 s ASP 224 Ca -0.09 0.17 -0.06 0.00 0.43 0.00 0.00 52.55 53.01 1yq2 s ASP 224 Cb 0.11 0.46 -0.00 0.00 -0.30 0.00 0.00 42.92 43.19 1yq2 s ASP 224 CO 0.86 -0.66 0.11 0.00 -0.17 0.00 0.00 175.17 175.30 1yq2 s ALA 225 N -2.21 -0.24 -0.19 3.66 0.00 -1.26 -0.45 121.76 121.06 1yq2 s ALA 225 Ca -0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 51.96 51.68 1yq2 s ALA 225 Cb -0.01 0.10 0.06 0.00 0.00 0.00 0.00 23.12 23.27 1yq2 s ALA 225 CO -0.00 -0.19 0.03 -0.46 0.00 0.00 0.00 175.76 175.14 1yq2 s TRP 226 N -1.31 1.04 -0.85 0.00 -0.00 -0.10 -4.85 118.94 112.88 1yq2 s TRP 226 Ca -0.14 -0.86 -0.16 0.00 -0.00 0.00 0.00 56.10 54.94 1yq2 s TRP 226 Cb -0.08 -1.03 0.18 0.00 -0.00 0.00 0.00 33.47 32.54 1yq2 s TRP 226 CO 0.01 -0.61 0.90 -0.51 -0.00 0.00 0.00 176.95 176.74 1yq2 s LEU 227 N 1.85 6.01 -0.27 5.86 1.43 -1.26 -0.91 118.68 131.40 1yq2 s LEU 227 Ca -0.01 -2.35 -0.28 0.00 -1.03 0.00 0.00 54.13 50.47 1yq2 s LEU 227 Cb -0.17 -2.29 0.01 0.00 0.03 0.00 0.00 46.19 43.77 1yq2 s LEU 227 CO -0.08 -0.80 0.98 -0.60 0.23 0.00 0.00 176.35 176.08 1yq2 s ARG 228 N 1.31 4.15 0.35 1.70 3.52 -1.13 -4.89 118.95 123.97 1yq2 s ARG 228 Ca 0.23 1.10 0.07 0.00 -0.13 0.00 0.00 55.73 57.00 1yq2 s ARG 228 Cb -0.09 -3.68 -0.02 0.00 -1.56 0.00 0.00 34.95 29.59 1yq2 s ARG 228 CO -0.08 -0.70 0.33 0.95 -0.81 0.00 0.00 175.30 174.99 1yq2 s THR 229 N 3.25 3.44 0.26 4.11 -4.23 -1.26 -0.29 115.64 120.91 1yq2 s THR 229 Ca 0.41 -1.32 -0.19 0.00 -1.18 0.00 0.00 61.69 59.41 1yq2 s THR 229 Cb -0.14 -3.17 0.02 0.00 1.34 0.00 0.00 72.50 70.55 1yq2 s THR 229 CO 0.10 -0.14 0.65 -0.83 -0.54 0.00 0.00 174.62 173.86 1yq2 s GLY 230 N -4.04 -0.02 -0.24 3.99 0.00 -0.72 -4.56 107.32 101.73 1yq2 s GLY 230 Ca 0.43 -0.34 -0.21 0.00 0.00 0.00 0.00 44.72 44.60 1yq2 s GLY 230 CO 0.27 -0.18 0.63 0.86 0.00 0.00 0.00 173.10 174.68 1yq2 s TRP 231 N -3.92 -0.74 0.03 1.90 -0.00 -1.26 -1.97 118.94 112.99 1yq2 s TRP 231 Ca 0.12 1.73 -0.03 0.00 -0.00 0.00 0.00 56.10 57.92 1yq2 s TRP 231 Cb -0.04 0.29 -0.02 0.00 -0.00 0.00 0.00 33.47 33.70 1yq2 s TRP 231 CO 0.05 -0.36 0.04 -1.54 -0.00 0.00 0.00 176.95 175.14 1yq2 s SER 232 N 0.54 0.24 0.18 5.86 1.04 -0.48 -4.40 113.70 116.68 1yq2 s SER 232 Ca -0.02 -0.58 -0.30 0.00 0.48 0.00 0.00 55.95 55.54 1yq2 s SER 232 Cb -0.05 0.18 -0.08 0.00 0.10 0.00 0.00 66.02 66.18 1yq2 s SER 232 CO -0.02 -0.46 0.99 0.00 0.98 0.00 0.00 173.24 174.73 1yq2 s ALA 233 N -2.42 3.31 0.10 5.32 0.00 -1.26 -0.71 121.76 126.10 1yq2 s ALA 233 Ca -0.07 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.56 1yq2 s ALA 233 Cb -0.03 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 19.82 1yq2 s ALA 233 CO -0.04 0.01 0.02 0.54 0.00 0.00 0.00 175.76 176.29 1yq2 n ARG 234 N 2.12 1.19 -2.86 0.00 5.12 -1.26 -4.83 116.66 116.14 1yq2 n ARG 234 Ca 0.01 -0.78 -0.33 0.00 -1.93 0.00 0.00 57.85 54.82 1yq2 n ARG 234 Cb 0.47 0.34 -0.06 0.00 -1.16 0.00 0.00 32.46 32.05 1yq2 n ARG 234 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1yq2 s SER 235 N -1.57 6.82 0.03 0.55 1.04 -1.26 -4.65 113.70 114.65 1yq2 s SER 235 Ca 0.03 1.51 0.00 0.00 0.48 0.00 0.00 55.95 57.97 1yq2 s SER 235 Cb 0.00 -2.47 0.00 0.00 0.10 0.00 0.00 66.02 63.65 1yq2 s SER 235 CO 0.02 -0.35 0.00 0.61 0.98 0.00 0.00 173.24 174.50 1yq2 n GLY 236 N -0.74 0.02 0.18 7.32 0.00 -1.26 -4.28 105.19 106.44 1yq2 n GLY 236 Ca 0.06 -1.01 -0.12 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.03 0.38 0.00 4.61 0.00 -1.87 -3.50 119.26 118.85 1yq2 h ALA 237 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1yq2 h ALA 237 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1yq2 h ALA 237 CO 0.00 0.24 0.00 0.41 0.00 0.00 0.00 179.25 179.90 1yq2 n GLY 238 N -0.06 1.72 3.41 0.00 0.00 -1.23 -4.60 105.19 104.42 1yq2 n GLY 238 Ca -0.04 -2.20 -0.35 0.00 0.00 0.00 0.00 46.02 43.43 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 -1.48 3.76 0.23 2.61 2.01 0.11 -1.41 115.64 121.47 1yq2 s THR 239 Ca 0.00 -0.38 -0.04 0.00 0.31 0.00 0.00 61.69 61.58 1yq2 s THR 239 Cb 0.00 -2.69 -0.05 0.00 0.01 0.00 0.00 72.50 69.77 1yq2 s THR 239 CO 0.00 0.44 0.46 -0.83 -0.69 0.00 0.00 174.62 174.00 1yq2 s GLY 240 N 1.04 1.95 0.05 4.40 0.00 0.94 -1.38 107.32 114.33 1yq2 s GLY 240 Ca 0.01 -0.62 0.04 0.00 0.00 0.00 0.00 44.72 44.16 1yq2 s GLY 240 CO 0.01 -0.53 -0.13 -0.51 0.00 0.00 0.00 173.10 171.94 1yq2 s THR 241 N -1.90 0.98 -0.11 0.90 -4.23 -0.83 0.58 115.64 111.03 1yq2 s THR 241 Ca 0.42 -1.04 0.03 0.00 -1.18 0.00 0.00 61.69 59.92 1yq2 s THR 241 Cb -0.11 -0.92 0.01 0.00 1.34 0.00 0.00 72.50 72.82 1yq2 s THR 241 CO 0.28 -0.11 -0.19 -0.63 -0.54 0.00 0.00 174.62 173.43 1yq2 s ILE 242 N -1.00 1.74 -0.61 2.99 1.01 -0.45 -1.75 121.20 123.13 1yq2 s ILE 242 Ca -0.01 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.84 1yq2 s ILE 242 Cb -0.08 -1.54 0.15 0.00 0.01 0.00 0.00 42.46 41.00 1yq2 s ILE 242 CO 0.01 0.49 0.40 -0.62 0.00 0.00 0.00 174.94 175.22 1yq2 s ASP 243 N 0.70 4.87 0.30 3.58 2.15 0.60 -0.64 116.67 128.22 1yq2 s ASP 243 Ca -0.12 -3.08 -0.28 0.00 0.43 0.00 0.00 52.55 49.51 1yq2 s ASP 243 Cb -0.16 -1.75 -0.09 0.00 -0.30 0.00 0.00 42.92 40.61 1yq2 s ASP 243 CO 0.02 -0.27 0.98 -2.16 -0.17 0.00 0.00 175.17 173.57 1yq2 s PRO 244 N -0.39 4.64 -0.12 4.34 0.04 -1.26 -2.81 135.00 139.43 1yq2 s PRO 244 Ca 0.18 1.47 0.02 0.00 0.04 0.00 0.00 61.00 62.71 1yq2 s PRO 244 Cb -0.20 -2.99 0.01 0.00 0.04 0.00 0.00 34.50 31.36 1yq2 s PRO 244 CO -0.04 0.30 -0.19 -2.00 0.04 0.00 0.00 177.00 175.12 1yq2 s GLU 245 N -1.73 2.62 -0.16 4.56 2.12 -0.09 -4.75 118.70 121.27 1yq2 s GLU 245 Ca 0.47 -0.71 0.01 0.00 0.36 0.00 0.00 54.97 55.10 1yq2 s GLU 245 Cb -0.23 -2.16 0.01 0.00 0.26 0.00 0.00 34.13 32.00 1yq2 s GLU 245 CO 0.29 -0.04 -0.19 0.42 -0.54 0.00 0.00 175.26 175.20 1yq2 s ILE 246 N 0.91 2.23 -0.36 -3.70 -1.09 -1.26 -0.92 121.20 117.01 1yq2 s ILE 246 Ca -0.07 -0.90 -0.09 0.00 -2.23 0.00 0.00 60.65 57.36 1yq2 s ILE 246 Cb -0.15 -1.93 0.03 0.00 -1.58 0.00 0.00 42.46 38.83 1yq2 s ILE 246 CO -0.02 0.53 0.17 -0.89 -1.23 0.00 0.00 174.94 173.50 1yq2 s THR 247 N 1.05 4.29 0.02 2.92 2.01 0.40 -5.01 115.64 121.31 1yq2 s THR 247 Ca -0.01 -0.97 -0.28 0.00 0.31 0.00 0.00 61.69 60.75 1yq2 s THR 247 Cb -0.14 -3.41 0.09 0.00 0.01 0.00 0.00 72.50 69.05 1yq2 s THR 247 CO -0.06 -0.22 0.77 0.00 -0.69 0.00 0.00 174.62 174.42 1yq2 s ALA 248 N 1.50 -1.76 0.69 7.40 0.00 -1.26 -0.60 121.76 127.72 1yq2 s ALA 248 Ca 0.01 0.99 -0.16 0.00 0.00 0.00 0.00 51.96 52.80 1yq2 s ALA 248 Cb -0.19 0.33 0.02 0.00 0.00 0.00 0.00 23.12 23.27 1yq2 s ALA 248 CO 0.05 -0.60 1.18 0.34 0.00 0.00 0.00 175.76 176.73 1yq2 s ASP 249 N -2.13 4.63 0.39 0.00 2.15 -1.26 -4.94 116.67 115.50 1yq2 s ASP 249 Ca -0.00 2.25 0.12 0.00 0.43 0.00 0.00 52.55 55.34 1yq2 s ASP 249 Cb -0.01 -2.58 0.92 0.00 -0.30 0.00 0.00 42.92 40.95 1yq2 s ASP 249 CO -0.05 -1.96 1.91 0.00 -0.17 0.00 0.00 175.17 174.89 1yq2 h ALA 250 N -0.01 1.94 0.00 3.66 0.00 -1.99 -0.96 119.26 121.90 1yq2 h ALA 250 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1yq2 h ALA 250 Cb 1.28 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1yq2 h ALA 250 CO 0.52 -0.14 0.00 0.25 0.00 0.00 0.00 179.25 179.88 1yq2 n THR 251 N -4.51 1.10 0.16 0.00 -2.24 -1.26 -2.50 114.28 105.03 1yq2 n THR 251 Ca 0.15 0.70 0.02 0.00 -2.27 0.00 0.00 64.05 62.65 1yq2 n THR 251 Cb 0.45 -1.70 0.23 0.00 -2.10 0.00 0.00 70.33 67.22 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 2.01 0.94 -2.75 6.98 0.00 -1.36 -3.44 119.26 121.65 1yq2 h ALA 252 Ca 0.00 -0.46 -0.50 0.00 0.00 0.00 0.00 54.91 53.95 1yq2 h ALA 252 Cb 0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1yq2 h ALA 252 CO 0.00 0.64 0.41 -0.06 0.00 0.00 0.00 179.25 180.23 1yq2 s PHE 253 N -3.54 3.80 0.28 0.00 0.08 -1.04 -4.25 117.98 113.31 1yq2 s PHE 253 Ca -0.00 1.81 -0.29 0.00 0.12 0.00 0.00 56.93 58.56 1yq2 s PHE 253 Cb 0.11 -3.12 -0.09 0.00 -0.57 0.00 0.00 43.02 39.35 1yq2 s PHE 253 CO 0.73 -0.00 1.03 -1.25 -0.10 0.00 0.00 175.22 175.63 1yq2 s PRO 254 N -1.11 4.67 -0.12 0.24 0.04 -1.26 -5.00 135.00 132.46 1yq2 s PRO 254 Ca 0.43 1.65 -0.00 0.00 0.04 0.00 0.00 61.00 63.12 1yq2 s PRO 254 Cb -0.28 -3.14 -0.02 0.00 0.04 0.00 0.00 34.50 31.09 1yq2 s PRO 254 CO 0.35 0.29 -0.11 0.08 0.04 0.00 0.00 177.00 177.66 1yq2 s VAL 255 N -1.24 3.31 -0.11 -0.36 1.01 0.25 -4.39 120.40 118.87 1yq2 s VAL 255 Ca 0.45 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1yq2 s VAL 255 Cb -0.28 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 1yq2 s VAL 255 CO 0.36 0.54 -0.15 -0.89 0.00 0.00 0.00 175.10 174.95 1yq2 s THR 256 N 0.06 2.85 -0.25 3.92 2.01 0.35 0.12 115.64 124.69 1yq2 s THR 256 Ca -0.04 -0.74 -0.11 0.00 0.31 0.00 0.00 61.69 61.11 1yq2 s THR 256 Cb -0.14 -2.17 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 1yq2 s THR 256 CO 0.04 0.54 0.17 -0.22 -0.69 0.00 0.00 174.62 174.46 1yq2 s LEU 257 N 0.20 4.08 -0.11 4.42 2.96 0.36 -1.00 118.68 129.59 1yq2 s LEU 257 Ca -0.09 0.07 0.02 0.00 -0.22 0.00 0.00 54.13 53.91 1yq2 s LEU 257 Cb -0.16 -2.11 0.01 0.00 0.50 0.00 0.00 46.19 44.44 1yq2 s LEU 257 CO 0.06 0.03 -0.19 -0.55 -1.32 0.00 0.00 176.35 174.38 1yq2 s SER 258 N 1.28 2.72 -0.55 3.68 0.15 -0.19 -1.04 113.70 119.75 1yq2 s SER 258 Ca 0.07 -0.50 0.05 0.00 0.70 0.00 0.00 55.95 56.27 1yq2 s SER 258 Cb -0.14 -1.24 0.18 0.00 -1.71 0.00 0.00 66.02 63.10 1yq2 s SER 258 CO 0.07 0.06 0.43 0.52 1.20 0.00 0.00 173.24 175.52 1yq2 n VAL 259 N 4.03 0.16 -0.18 4.45 0.31 -0.27 -0.99 118.33 125.85 1yq2 n VAL 259 Ca -0.20 -4.14 -0.04 0.00 -0.01 0.00 0.00 64.34 59.96 1yq2 n VAL 259 Cb 0.52 -1.91 0.03 0.00 -0.91 0.00 0.00 33.84 31.56 1yq2 n VAL 259 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1yq2 h PRO 260 N 5.40 -0.10 -0.31 5.55 0.11 -1.74 0.23 132.00 141.14 1yq2 h PRO 260 Ca 0.21 0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.41 1yq2 h PRO 260 Cb 0.83 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 1yq2 h PRO 260 CO 0.54 -0.07 0.24 1.49 -0.21 0.00 0.00 178.00 180.00 1yq2 h GLU 261 N -0.10 0.00 -0.44 1.05 4.81 -1.94 0.33 114.58 118.28 1yq2 h GLU 261 Ca 0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1yq2 h GLU 261 Cb 0.50 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1yq2 h GLU 261 CO -0.62 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 178.94 1yq2 n LEU 262 N -4.29 3.48 -1.73 1.64 4.77 0.00 -4.94 117.00 115.92 1yq2 n LEU 262 Ca 0.05 -1.54 -0.19 0.00 -0.03 0.00 0.00 56.01 54.30 1yq2 n LEU 262 Cb 0.41 -0.29 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1yq2 n LEU 262 CO 0.34 0.77 -0.20 0.61 -1.33 0.00 0.00 177.39 177.58 1yq2 n GLY 263 N 1.52 0.89 3.77 -0.72 0.00 0.12 -4.99 105.19 105.77 1yq2 n GLY 263 Ca 0.20 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1yq2 n GLY 263 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 s VAL 264 N -2.80 5.11 -0.32 1.61 0.11 -0.84 -4.97 120.40 118.29 1yq2 s VAL 264 Ca 0.00 0.91 0.02 0.00 -2.93 0.00 0.00 61.98 59.98 1yq2 s VAL 264 Cb 0.00 -3.78 0.15 0.00 -1.53 0.00 0.00 36.38 31.23 1yq2 s VAL 264 CO 0.00 0.43 0.38 0.21 -3.33 0.00 0.00 175.10 172.79 1yq2 s ASN 265 N -0.07 0.84 -0.15 3.54 3.84 -1.25 -1.11 114.94 120.57 1yq2 s ASN 265 Ca 0.25 -0.87 0.01 0.00 0.21 0.00 0.00 52.86 52.46 1yq2 s ASN 265 Cb -0.16 0.84 0.01 0.00 -0.55 0.00 0.00 41.25 41.39 1yq2 s ASN 265 CO 0.12 -0.32 -0.19 -0.69 -2.79 0.00 0.00 177.10 173.23 1yq2 s VAL 266 N 2.12 2.34 -0.24 -5.21 1.01 -0.20 -4.98 120.40 115.23 1yq2 s VAL 266 Ca 0.12 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.16 1yq2 s VAL 266 Cb -0.13 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.26 1yq2 s VAL 266 CO -0.21 0.53 0.03 -0.89 0.00 0.00 0.00 175.10 174.56 1yq2 s THR 267 N 0.89 4.00 -0.16 3.92 2.01 -1.26 -0.48 115.64 124.55 1yq2 s THR 267 Ca -0.05 -0.28 -0.14 0.00 0.31 0.00 0.00 61.69 61.53 1yq2 s THR 267 Cb -0.15 -2.85 -0.05 0.00 0.01 0.00 0.00 72.50 69.46 1yq2 s THR 267 CO -0.02 0.37 0.32 0.26 -0.69 0.00 0.00 174.62 174.85 1yq2 s TRP 268 N 1.55 3.46 -0.41 4.92 0.51 0.12 -4.95 118.94 124.14 1yq2 s TRP 268 Ca 0.06 0.62 0.22 0.00 -2.12 0.00 0.00 56.10 54.89 1yq2 s TRP 268 Cb -0.15 -2.38 -0.09 0.00 -0.81 0.00 0.00 33.47 30.05 1yq2 s TRP 268 CO 0.01 0.21 0.87 1.63 -0.51 0.00 0.00 176.95 179.17 1yq2 n LYS 269 N 3.65 0.43 -4.05 4.98 5.02 -1.26 -0.58 118.16 126.34 1yq2 n LYS 269 Ca -0.11 -0.03 -0.10 0.00 -2.02 0.00 0.00 58.31 56.04 1yq2 n LYS 269 Cb 0.52 -1.61 -0.06 0.00 -0.02 0.00 0.00 35.03 33.86 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 -4.29 0.09 0.31 4.39 1.04 -1.26 -4.51 113.70 109.47 1yq2 s SER 270 Ca 0.00 -1.10 0.04 0.00 0.48 0.00 0.00 55.95 55.37 1yq2 s SER 270 Cb 0.13 0.56 0.64 0.00 0.10 0.00 0.00 66.02 67.45 1yq2 s SER 270 CO 0.83 -1.10 1.87 0.00 0.98 0.00 0.00 173.24 175.82 1yq2 h ALA 271 N 2.31 1.62 0.00 5.32 0.00 -1.94 -1.71 119.26 124.85 1yq2 h ALA 271 Ca -0.28 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1yq2 h ALA 271 Cb 1.25 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1yq2 h ALA 271 CO 0.39 0.17 -0.08 0.93 0.00 0.00 0.00 179.25 180.66 1yq2 h GLU 272 N 0.90 0.00 0.00 0.00 3.07 -2.01 -2.66 114.58 113.88 1yq2 h GLU 272 Ca 0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.30 1yq2 h GLU 272 Cb 0.46 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 1yq2 h GLU 272 CO -0.20 0.08 -0.04 0.93 -1.40 0.00 0.00 179.01 178.39 1yq2 h GLU 273 N 0.00 0.00 -6.25 2.33 5.08 -1.71 -3.45 114.58 110.58 1yq2 h GLU 273 Ca -0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 1yq2 h GLU 273 Cb 0.42 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.68 1yq2 h GLU 273 CO 0.01 0.00 1.31 0.08 -1.00 0.00 0.00 179.01 179.41 1yq2 s VAL 274 N -3.17 3.03 0.06 3.13 1.01 -1.01 -4.94 120.40 118.51 1yq2 s VAL 274 Ca 0.08 0.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.97 1yq2 s VAL 274 Cb 0.08 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.45 1yq2 s VAL 274 CO 0.65 -0.01 0.29 0.00 0.00 0.00 0.00 175.10 176.03 1yq2 s ALA 275 N 5.58 -0.61 0.61 5.51 0.00 -1.26 -5.02 121.76 126.57 1yq2 s ALA 275 Ca 0.92 -0.15 -0.19 0.00 0.00 0.00 0.00 51.96 52.54 1yq2 s ALA 275 Cb -0.40 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 1yq2 s ALA 275 CO 0.39 -0.46 1.30 -2.14 0.00 0.00 0.00 175.76 174.85 1yq2 s PRO 276 N -3.00 2.81 0.04 0.00 0.02 -1.26 -4.56 135.00 129.05 1yq2 s PRO 276 Ca -0.02 2.08 0.05 0.00 0.02 0.00 0.00 61.00 63.14 1yq2 s PRO 276 Cb 0.01 -1.99 -0.02 0.00 0.02 0.00 0.00 34.50 32.51 1yq2 s PRO 276 CO -0.06 -1.40 -0.16 -0.51 -0.33 0.00 0.00 177.00 174.54 1yq2 s LEU 277 N -4.05 2.16 -0.09 -5.54 1.02 0.19 -5.00 118.68 107.38 1yq2 s LEU 277 Ca 0.78 -0.46 0.02 0.00 0.02 0.00 0.00 54.13 54.49 1yq2 s LEU 277 Cb -0.37 -0.69 -0.02 0.00 0.02 0.00 0.00 46.19 45.13 1yq2 s LEU 277 CO 0.41 0.07 -0.16 0.00 0.02 0.00 0.00 176.35 176.69 1yq2 s ALA 278 N -0.82 2.53 -0.09 4.21 0.00 -1.26 -1.34 121.76 125.00 1yq2 s ALA 278 Ca 0.03 -0.95 0.03 0.00 0.00 0.00 0.00 51.96 51.07 1yq2 s ALA 278 Cb -0.08 -1.02 0.01 0.00 0.00 0.00 0.00 23.12 22.03 1yq2 s ALA 278 CO 0.01 0.38 -0.16 -0.51 0.00 0.00 0.00 175.76 175.48 1yq2 s LEU 279 N -0.10 1.79 0.41 0.00 1.02 0.20 -4.99 118.68 117.01 1yq2 s LEU 279 Ca -0.03 -0.40 -0.03 0.00 0.02 0.00 0.00 54.13 53.69 1yq2 s LEU 279 Cb -0.14 -1.06 -0.04 0.00 0.02 0.00 0.00 46.19 44.98 1yq2 s LEU 279 CO 0.04 0.06 0.66 -1.83 0.02 0.00 0.00 176.35 175.31 1yq2 s GLU 280 N 0.65 3.53 -1.22 1.70 -1.05 -1.26 -0.04 118.70 121.01 1yq2 s GLU 280 Ca -0.14 -0.05 -0.04 0.00 -0.15 0.00 0.00 54.97 54.59 1yq2 s GLU 280 Cb -0.16 -2.52 -0.01 0.00 -0.44 0.00 0.00 34.13 30.99 1yq2 s GLU 280 CO 0.04 -0.02 0.79 0.09 0.95 0.00 0.00 175.26 177.11 1yq2 n ASN 281 N -1.95 -2.87 -4.49 0.83 4.13 -0.84 -4.87 115.26 105.21 1yq2 n ASN 281 Ca -0.02 -0.81 -0.34 0.00 1.68 0.00 0.00 54.58 55.09 1yq2 n ASN 281 Cb 0.55 -4.29 -0.12 0.00 -1.54 0.00 0.00 39.78 34.38 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 -3.55 3.90 0.01 2.41 1.01 -0.50 -4.89 120.40 118.79 1yq2 s VAL 282 Ca 0.15 -0.35 -0.25 0.00 0.00 0.00 0.00 61.98 61.53 1yq2 s VAL 282 Cb -0.04 -2.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.58 1yq2 s VAL 282 CO 0.80 0.48 0.77 -1.61 0.00 0.00 0.00 175.10 175.54 1yq2 s GLU 283 N 0.49 4.49 0.58 2.72 0.41 -1.26 -3.56 118.70 122.56 1yq2 s GLU 283 Ca -0.03 1.06 -0.15 0.00 -0.41 0.00 0.00 54.97 55.44 1yq2 s GLU 283 Cb -0.14 -3.40 -0.05 0.00 -1.78 0.00 0.00 34.13 28.76 1yq2 s GLU 283 CO 0.03 0.18 1.02 -1.25 -0.49 0.00 0.00 175.26 174.75 1yq2 s PRO 284 N 0.31 3.58 -0.00 0.39 0.04 -1.26 -4.64 135.00 133.41 1yq2 s PRO 284 Ca 0.40 1.00 -0.23 0.00 0.04 0.00 0.00 61.00 62.21 1yq2 s PRO 284 Cb -0.20 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 1yq2 s PRO 284 CO 0.22 -0.58 0.67 -0.46 0.04 0.00 0.00 177.00 176.89 1yq2 s TRP 285 N -2.71 3.68 0.22 0.56 -0.00 0.61 -4.25 118.94 117.05 1yq2 s TRP 285 Ca 0.60 1.29 -0.08 0.00 -0.00 0.00 0.00 56.10 57.91 1yq2 s TRP 285 Cb -0.12 -2.72 -0.02 0.00 -0.00 0.00 0.00 33.47 30.61 1yq2 s TRP 285 CO 0.39 0.27 0.32 -1.54 -0.00 0.00 0.00 176.95 176.39 1yq2 s SER 286 N 0.07 0.02 0.31 5.86 1.04 -0.51 -4.68 113.70 115.80 1yq2 s SER 286 Ca 0.35 -1.10 -0.00 0.00 0.48 0.00 0.00 55.95 55.67 1yq2 s SER 286 Cb -0.19 0.49 0.48 0.00 0.10 0.00 0.00 66.02 66.90 1yq2 s SER 286 CO 0.19 -1.00 1.92 0.00 0.98 0.00 0.00 173.24 175.33 1yq2 h ALA 287 N 2.43 1.36 -0.38 5.32 0.00 -1.89 -2.05 119.26 124.05 1yq2 h ALA 287 Ca -0.30 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.34 1yq2 h ALA 287 Cb 1.25 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1yq2 h ALA 287 CO 0.44 0.51 -0.33 0.93 0.00 0.00 0.00 179.25 180.79 1yq2 h GLU 288 N 0.90 0.87 -2.69 0.00 5.08 -1.93 -3.39 114.58 113.41 1yq2 h GLU 288 Ca 0.22 -0.42 -0.60 0.00 -1.00 0.00 0.00 59.36 57.56 1yq2 h GLU 288 Cb 0.07 -0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.92 1yq2 h GLU 288 CO -0.03 1.07 -0.82 0.08 -1.00 0.00 0.00 179.01 178.31 1yq2 s VAL 289 N -4.45 1.19 -1.60 3.13 1.01 -0.99 -5.01 120.40 113.68 1yq2 s VAL 289 Ca -0.10 -2.99 -0.10 0.00 0.00 0.00 0.00 61.98 58.79 1yq2 s VAL 289 Cb 0.12 -1.81 -0.08 0.00 0.00 0.00 0.00 36.38 34.60 1yq2 s VAL 289 CO 0.86 -1.09 2.95 -0.81 0.00 0.00 0.00 175.10 177.01 1yq2 n PRO 290 N 2.84 3.73 -1.83 2.72 -0.04 -0.81 -1.42 135.00 140.19 1yq2 n PRO 290 Ca 0.22 -2.25 -0.43 0.00 -0.04 0.00 0.00 63.50 61.01 1yq2 n PRO 290 Cb 0.41 -2.78 -0.03 0.00 -0.04 0.00 0.00 33.50 31.06 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 2.00 3.75 -0.00 0.54 6.06 -1.26 -4.80 118.95 125.23 1yq2 s ARG 291 Ca 0.69 2.10 0.04 0.00 -2.50 0.00 0.00 55.73 56.06 1yq2 s ARG 291 Cb 0.18 -4.16 -0.03 0.00 0.06 0.00 0.00 34.95 31.00 1yq2 s ARG 291 CO -0.06 -1.38 -0.11 -0.51 -2.50 0.00 0.00 175.30 170.74 1yq2 s LEU 292 N 5.72 2.93 -0.17 -0.88 1.43 -1.26 -4.34 118.68 122.11 1yq2 s LEU 292 Ca 0.85 -0.22 -0.02 0.00 -1.03 0.00 0.00 54.13 53.71 1yq2 s LEU 292 Cb -0.33 -1.67 -0.01 0.00 0.03 0.00 0.00 46.19 44.20 1yq2 s LEU 292 CO 0.35 0.30 -0.08 -0.31 0.23 0.00 0.00 176.35 176.84 1yq2 s TYR 293 N -0.90 2.92 0.24 0.29 1.51 0.60 -4.91 117.35 117.09 1yq2 s TYR 293 Ca 0.15 -0.71 -0.30 0.00 -1.01 0.00 0.00 57.07 55.20 1yq2 s TYR 293 Cb -0.11 -1.98 -0.09 0.00 -0.11 0.00 0.00 41.96 39.67 1yq2 s TYR 293 CO 0.05 -0.33 1.35 -1.21 -1.11 0.00 0.00 175.55 174.30 1yq2 s GLU 294 N 0.84 4.35 0.12 -0.62 0.41 -1.26 -0.41 118.70 122.13 1yq2 s GLU 294 Ca -0.02 2.15 -0.04 0.00 -0.41 0.00 0.00 54.97 56.65 1yq2 s GLU 294 Cb -0.15 -3.15 -0.03 0.00 -1.78 0.00 0.00 34.13 29.03 1yq2 s GLU 294 CO 0.01 -0.29 0.12 0.00 -0.49 0.00 0.00 175.26 174.61 1yq2 s ALA 295 N -0.14 0.42 0.01 5.21 0.00 -0.39 -4.24 121.76 122.62 1yq2 s ALA 295 Ca 0.56 -1.15 -0.06 0.00 0.00 0.00 0.00 51.96 51.31 1yq2 s ALA 295 Cb -0.39 0.70 -0.00 0.00 0.00 0.00 0.00 23.12 23.43 1yq2 s ALA 295 CO 0.42 -0.51 0.11 -1.54 0.00 0.00 0.00 175.76 174.24 1yq2 s SER 296 N -2.98 0.07 -0.11 0.00 1.04 -0.16 -1.76 113.70 109.81 1yq2 s SER 296 Ca 0.16 -0.29 0.02 0.00 0.48 0.00 0.00 55.95 56.33 1yq2 s SER 296 Cb 0.06 0.20 0.01 0.00 0.10 0.00 0.00 66.02 66.39 1yq2 s SER 296 CO -0.03 -0.39 -0.18 0.68 0.98 0.00 0.00 173.24 174.31 1yq2 s VAL 297 N -1.59 1.69 -0.00 5.02 -7.23 0.11 -1.02 120.40 117.38 1yq2 s VAL 297 Ca -0.13 -0.77 -0.02 0.00 -1.81 0.00 0.00 61.98 59.24 1yq2 s VAL 297 Cb -0.07 -1.52 -0.00 0.00 0.56 0.00 0.00 36.38 35.35 1yq2 s VAL 297 CO 0.00 0.48 0.04 -0.94 -0.31 0.00 0.00 175.10 174.37 1yq2 s SER 298 N 0.82 0.05 0.49 4.85 1.04 -0.17 -0.54 113.70 120.23 1yq2 s SER 298 Ca -0.09 -0.14 0.07 0.00 0.48 0.00 0.00 55.95 56.27 1yq2 s SER 298 Cb -0.16 0.12 0.01 0.00 0.10 0.00 0.00 66.02 66.10 1yq2 s SER 298 CO 0.00 -0.17 0.40 -0.94 0.98 0.00 0.00 173.24 173.52 1yq2 s SER 299 N -0.68 4.78 0.50 7.02 1.04 -0.27 -0.49 113.70 125.60 1yq2 s SER 299 Ca -0.08 -1.04 0.23 0.00 0.48 0.00 0.00 55.95 55.54 1yq2 s SER 299 Cb -0.05 -0.01 1.30 0.00 0.10 0.00 0.00 66.02 67.37 1yq2 s SER 299 CO -0.00 -0.91 1.98 0.00 0.98 0.00 0.00 173.24 175.29 1yq2 h ALA 300 N 0.87 2.39 0.00 5.32 0.00 -1.79 -2.94 119.26 123.11 1yq2 h ALA 300 Ca -0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1yq2 h ALA 300 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1yq2 h ALA 300 CO 0.57 -0.55 -1.17 0.00 0.00 0.00 0.00 179.25 178.11 1yq2 n ALA 301 N -2.61 2.75 -3.44 0.00 0.00 -1.26 -4.97 120.51 110.98 1yq2 n ALA 301 Ca 0.10 -0.32 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 1yq2 n ALA 301 Cb 0.57 -1.02 -0.08 0.00 0.00 0.00 0.00 19.45 18.91 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 -3.35 0.68 -0.08 0.00 2.12 -1.11 -4.85 118.70 112.11 1yq2 s GLU 302 Ca -0.01 0.65 0.04 0.00 0.36 0.00 0.00 54.97 56.01 1yq2 s GLU 302 Cb 0.11 0.33 0.00 0.00 0.26 0.00 0.00 34.13 34.84 1yq2 s GLU 302 CO 0.81 -0.11 -0.19 0.45 -0.54 0.00 0.00 175.26 175.68 1yq2 s SER 303 N 0.04 2.53 -0.17 -1.70 0.15 -1.26 -1.11 113.70 112.18 1yq2 s SER 303 Ca -0.02 -0.44 -0.03 0.00 0.70 0.00 0.00 55.95 56.16 1yq2 s SER 303 Cb -0.04 -1.05 -0.02 0.00 -1.71 0.00 0.00 66.02 63.20 1yq2 s SER 303 CO 0.02 0.13 -0.05 -0.63 1.20 0.00 0.00 173.24 173.90 1yq2 s ILE 304 N 0.35 3.63 -0.21 6.45 1.01 0.29 -1.74 121.20 130.99 1yq2 s ILE 304 Ca -0.14 -0.44 -0.11 0.00 0.00 0.00 0.00 60.65 59.96 1yq2 s ILE 304 Cb -0.16 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.66 1yq2 s ILE 304 CO 0.06 0.47 0.17 -0.44 0.00 0.00 0.00 174.94 175.20 1yq2 s SER 305 N 0.69 6.22 0.08 3.58 0.01 -0.51 -0.71 113.70 123.07 1yq2 s SER 305 Ca -0.03 0.24 0.07 0.00 1.31 0.00 0.00 55.95 57.54 1yq2 s SER 305 Cb -0.15 -2.11 -0.03 0.00 0.21 0.00 0.00 66.02 63.94 1yq2 s SER 305 CO 0.02 0.13 -0.17 -0.69 0.41 0.00 0.00 173.24 172.93 1yq2 s VAL 306 N 0.62 1.40 -0.25 3.43 1.01 -0.72 -4.11 120.40 121.78 1yq2 s VAL 306 Ca 0.09 -1.38 -0.07 0.00 0.00 0.00 0.00 61.98 60.63 1yq2 s VAL 306 Cb -0.12 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1yq2 s VAL 306 CO 0.01 -0.11 0.05 -0.13 0.00 0.00 0.00 175.10 174.92 1yq2 s ARG 307 N -1.74 3.55 -0.14 2.72 0.52 -1.26 -1.27 118.95 121.34 1yq2 s ARG 307 Ca 0.02 -0.54 -0.18 0.00 -0.52 0.00 0.00 55.73 54.52 1yq2 s ARG 307 Cb -0.10 -3.27 -0.04 0.00 0.52 0.00 0.00 34.95 32.06 1yq2 s ARG 307 CO 0.03 -0.21 0.46 -0.51 0.02 0.00 0.00 175.30 175.09 1yq2 s LEU 308 N 1.58 4.25 -0.20 2.53 1.43 0.45 -4.85 118.68 123.88 1yq2 s LEU 308 Ca 0.06 0.76 -0.01 0.00 -1.03 0.00 0.00 54.13 53.91 1yq2 s LEU 308 Cb -0.15 -2.66 0.01 0.00 0.03 0.00 0.00 46.19 43.42 1yq2 s LEU 308 CO 0.02 -0.02 -0.13 -0.83 0.23 0.00 0.00 176.35 175.62 1yq2 s GLY 309 N 0.70 1.48 -0.29 -3.19 0.00 -1.26 -0.29 107.32 104.47 1yq2 s GLY 309 Ca 0.25 -1.21 -0.21 0.00 0.00 0.00 0.00 44.72 43.55 1yq2 s GLY 309 CO 0.10 0.35 0.65 -1.36 0.00 0.00 0.00 173.10 172.83 1yq2 s PHE 310 N 1.36 3.23 -0.13 1.90 0.40 -1.26 -4.76 117.98 118.73 1yq2 s PHE 310 Ca 0.05 0.66 -0.30 0.00 -0.60 0.00 0.00 56.93 56.75 1yq2 s PHE 310 Cb -0.14 -2.98 0.10 0.00 0.51 0.00 0.00 43.02 40.51 1yq2 s PHE 310 CO -0.09 -0.45 0.83 -0.98 0.70 0.00 0.00 175.22 175.23 1yq2 s ARG 311 N 2.62 0.82 -0.11 0.44 1.04 -1.26 -0.29 118.95 122.23 1yq2 s ARG 311 Ca 0.26 0.31 0.02 0.00 -1.04 0.00 0.00 55.73 55.28 1yq2 s ARG 311 Cb -0.15 0.39 0.01 0.00 -2.04 0.00 0.00 34.95 33.16 1yq2 s ARG 311 CO 0.11 -0.23 -0.16 0.99 -0.04 0.00 0.00 175.30 175.97 1yq2 s THR 312 N -0.90 1.53 -0.26 4.99 2.01 -1.26 -3.96 115.64 117.80 1yq2 s THR 312 Ca -0.05 -0.67 -0.11 0.00 0.31 0.00 0.00 61.69 61.17 1yq2 s THR 312 Cb -0.01 -1.39 -0.05 0.00 0.01 0.00 0.00 72.50 71.06 1yq2 s THR 312 CO 0.05 0.45 0.17 -0.69 -0.69 0.00 0.00 174.62 173.91 1yq2 s VAL 313 N 0.91 5.33 -0.01 3.82 1.01 -1.26 -0.63 120.40 129.57 1yq2 s VAL 313 Ca -0.08 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.08 1yq2 s VAL 313 Cb -0.15 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.73 1yq2 s VAL 313 CO -0.00 0.30 -0.03 -0.13 0.00 0.00 0.00 175.10 175.24 1yq2 s ARG 314 N 1.36 0.34 -0.19 2.72 1.81 -0.23 -4.85 118.95 119.92 1yq2 s ARG 314 Ca 0.07 -0.06 -0.14 0.00 -1.72 0.00 0.00 55.73 53.88 1yq2 s ARG 314 Cb -0.15 -0.39 -0.04 0.00 -0.45 0.00 0.00 34.95 33.92 1yq2 s ARG 314 CO 0.07 0.00 0.30 0.42 -0.68 0.00 0.00 175.30 175.42 1yq2 s ILE 315 N 0.33 5.28 -0.26 1.52 1.01 -1.26 -0.55 121.20 127.28 1yq2 s ILE 315 Ca -0.03 0.54 0.01 0.00 0.00 0.00 0.00 60.65 61.16 1yq2 s ILE 315 Cb -0.06 -3.64 0.07 0.00 0.01 0.00 0.00 42.46 38.84 1yq2 s ILE 315 CO -0.01 0.34 -0.02 -0.69 0.00 0.00 0.00 174.94 174.56 1yq2 s VAL 316 N 0.83 1.52 0.00 2.92 1.01 -0.63 -4.98 120.40 121.07 1yq2 s VAL 316 Ca 0.16 -1.38 0.00 0.00 0.00 0.00 0.00 61.98 60.75 1yq2 s VAL 316 Cb -0.14 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.36 1yq2 s VAL 316 CO 0.05 -0.25 0.00 0.61 0.00 0.00 0.00 175.10 175.51 1yq2 n GLY 317 N 4.65 3.79 1.61 4.51 0.00 -1.26 -1.82 105.19 116.66 1yq2 n GLY 317 Ca -0.08 0.16 0.06 0.00 0.00 0.00 0.00 46.02 46.15 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 6.85 4.79 -4.47 1.61 5.68 -1.19 -4.20 116.55 125.61 1yq2 n ASP 318 Ca 0.00 -2.73 -0.33 0.00 -0.50 0.00 0.00 54.79 51.23 1yq2 n ASP 318 Cb 0.00 -0.64 -0.13 0.00 -1.14 0.00 0.00 41.12 39.21 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 -2.39 3.44 -0.46 0.11 -1.52 -0.76 -3.44 119.66 114.65 1yq2 s GLN 319 Ca 0.44 -0.58 -0.16 0.00 -1.95 0.00 0.00 55.36 53.11 1yq2 s GLN 319 Cb 0.33 -2.77 0.05 0.00 -0.22 0.00 0.00 33.01 30.41 1yq2 s GLN 319 CO 0.13 0.30 0.40 0.12 -0.25 0.00 0.00 175.29 175.99 1yq2 s PHE 320 N 0.17 3.22 -0.10 0.91 5.36 -1.26 -1.61 117.98 124.67 1yq2 s PHE 320 Ca -0.04 -0.77 -0.04 0.00 -0.96 0.00 0.00 56.93 55.12 1yq2 s PHE 320 Cb -0.14 -3.04 -0.04 0.00 -0.34 0.00 0.00 43.02 39.46 1yq2 s PHE 320 CO 0.04 -0.76 0.06 -0.51 -1.46 0.00 0.00 175.22 172.58 1yq2 s LEU 321 N 1.78 3.90 -0.09 6.12 1.43 0.29 -1.60 118.68 130.50 1yq2 s LEU 321 Ca 0.06 0.27 0.03 0.00 -1.03 0.00 0.00 54.13 53.45 1yq2 s LEU 321 Cb -0.22 -1.92 0.01 0.00 0.03 0.00 0.00 46.19 44.09 1yq2 s LEU 321 CO 0.08 0.39 -0.17 -0.69 0.23 0.00 0.00 176.35 176.20 1yq2 s VAL 322 N -0.93 1.53 -1.47 -1.59 1.01 -0.58 -1.06 120.40 117.30 1yq2 s VAL 322 Ca 0.14 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.37 1yq2 s VAL 322 Cb -0.12 -1.37 0.02 0.00 0.00 0.00 0.00 36.38 34.92 1yq2 s VAL 322 CO 0.03 0.44 0.50 0.59 0.00 0.00 0.00 175.10 176.66 1yq2 n ASN 323 N 3.85 -5.32 0.00 3.32 3.02 0.20 -2.33 115.26 118.00 1yq2 n ASN 323 Ca -0.21 -0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.08 1yq2 n ASN 323 Cb 0.52 -4.34 0.00 0.00 -0.61 0.00 0.00 39.78 35.35 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 -1.35 0.90 3.14 7.41 0.00 -1.26 -4.94 105.19 109.09 1yq2 n GLY 324 Ca -0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.09 1.55 0.15 1.61 3.52 -0.99 -5.03 118.95 119.68 1yq2 s ARG 325 Ca 0.00 -0.60 -0.34 0.00 -0.13 0.00 0.00 55.73 54.66 1yq2 s ARG 325 Cb 0.00 -1.43 -0.15 0.00 -1.56 0.00 0.00 34.95 31.81 1yq2 s ARG 325 CO 0.00 0.31 1.33 -2.13 -0.81 0.00 0.00 175.30 173.99 1yq2 n ARG 326 N 2.89 1.46 -3.70 5.12 0.63 -1.26 -1.53 116.66 120.28 1yq2 n ARG 326 Ca -0.16 0.52 -0.37 0.00 -0.92 0.00 0.00 57.85 56.92 1yq2 n ARG 326 Cb 0.54 -2.14 -0.10 0.00 0.45 0.00 0.00 32.46 31.20 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 0.22 5.13 -0.26 5.15 1.01 -0.63 -4.87 120.40 126.15 1yq2 s VAL 327 Ca 0.77 0.10 -0.13 0.00 0.00 0.00 0.00 61.98 62.71 1yq2 s VAL 327 Cb -0.82 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1yq2 s VAL 327 CO 0.48 0.33 0.30 -0.69 0.00 0.00 0.00 175.10 175.52 1yq2 s VAL 328 N 1.25 5.24 -0.22 2.92 1.01 -1.26 -4.82 120.40 124.53 1yq2 s VAL 328 Ca 0.07 0.44 -0.22 0.00 0.00 0.00 0.00 61.98 62.27 1yq2 s VAL 328 Cb -0.14 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 1yq2 s VAL 328 CO 0.06 0.22 0.67 -0.36 0.00 0.00 0.00 175.10 175.69 1yq2 s PHE 329 N 1.75 3.35 -0.89 5.22 0.08 0.47 -4.98 117.98 122.98 1yq2 s PHE 329 Ca 0.13 0.95 -0.01 0.00 0.12 0.00 0.00 56.93 58.12 1yq2 s PHE 329 Cb -0.15 -2.86 0.22 0.00 -0.57 0.00 0.00 43.02 39.65 1yq2 s PHE 329 CO 0.09 -0.25 0.77 0.72 -0.10 0.00 0.00 175.22 176.45 1yq2 n HIS 330 N 5.37 4.14 -4.16 0.36 8.25 -1.26 -1.27 115.22 126.65 1yq2 n HIS 330 Ca 0.00 -4.14 -0.27 0.00 -0.26 0.00 0.00 57.72 53.05 1yq2 n HIS 330 Cb 0.49 -1.09 -0.05 0.00 1.12 0.00 0.00 29.99 30.46 1yq2 n HIS 330 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1yq2 s GLY 331 N -0.30 2.49 0.06 -1.41 0.00 0.04 -1.17 107.32 107.03 1yq2 s GLY 331 Ca 0.28 -1.41 0.04 0.00 0.00 0.00 0.00 44.72 43.63 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 -2.72 0.96 -0.09 1.40 -7.23 -0.68 -0.44 120.40 111.60 1yq2 s VAL 332 Ca 0.31 -1.21 -0.27 0.00 -1.81 0.00 0.00 61.98 59.00 1yq2 s VAL 332 Cb 0.01 -0.94 -0.02 0.00 0.56 0.00 0.00 36.38 35.99 1yq2 s VAL 332 CO 0.18 -0.24 0.86 0.20 -0.31 0.00 0.00 175.10 175.79 1yq2 s ASN 333 N -1.63 7.12 -0.01 4.85 0.01 -0.26 -1.59 114.94 123.44 1yq2 s ASN 333 Ca -0.04 1.36 -0.00 0.00 -0.71 0.00 0.00 52.86 53.47 1yq2 s ASN 333 Cb -0.10 -2.49 0.01 0.00 0.41 0.00 0.00 41.25 39.08 1yq2 s ASN 333 CO 0.02 -0.29 0.01 -0.60 -1.51 0.00 0.00 177.10 174.73 1yq2 s ARG 334 N 1.46 0.00 0.19 -0.60 3.52 -0.66 -1.17 118.95 121.68 1yq2 s ARG 334 Ca 0.43 0.04 0.02 0.00 -0.13 0.00 0.00 55.73 56.09 1yq2 s ARG 334 Cb -0.18 -0.04 -0.05 0.00 -1.56 0.00 0.00 34.95 33.12 1yq2 s ARG 334 CO 0.19 -0.03 0.01 -3.38 -0.81 0.00 0.00 175.30 171.28 1yq2 s HIS 335 N 0.19 1.27 0.19 5.12 -3.43 -1.26 -2.41 115.29 114.96 1yq2 s HIS 335 Ca -0.02 -1.03 -0.31 0.00 -0.80 0.00 0.00 55.06 52.91 1yq2 s HIS 335 Cb -0.02 -0.73 -0.09 0.00 -1.43 0.00 0.00 32.58 30.31 1yq2 s HIS 335 CO -0.01 -0.21 1.42 -2.00 -2.00 0.00 0.00 174.74 171.94 1yq2 s GLU 336 N -3.92 4.30 -0.19 -0.38 2.56 -1.26 -4.98 118.70 114.83 1yq2 s GLU 336 Ca 0.26 2.20 -0.14 0.00 0.00 0.00 0.00 54.97 57.30 1yq2 s GLU 336 Cb 0.06 -3.17 0.05 0.00 2.00 0.00 0.00 34.13 33.08 1yq2 s GLU 336 CO 0.05 -0.41 0.47 -0.08 -0.56 0.00 0.00 175.26 174.73 1yq2 s THR 337 N 0.45 -0.01 -0.16 -1.70 -1.32 -1.25 -4.40 115.64 107.24 1yq2 s THR 337 Ca 0.62 0.04 -0.10 0.00 -1.21 0.00 0.00 61.69 61.03 1yq2 s THR 337 Cb -0.40 -0.68 0.05 0.00 -1.51 0.00 0.00 72.50 69.97 1yq2 s THR 337 CO 0.37 0.01 0.41 -2.28 -2.21 0.00 0.00 174.62 170.92 1yq2 s HIS 338 N 0.84 -0.55 -0.06 9.09 5.04 -0.45 -4.96 115.29 124.24 1yq2 s HIS 338 Ca -0.05 1.22 0.28 0.00 -1.54 0.00 0.00 55.06 54.98 1yq2 s HIS 338 Cb -0.05 0.23 1.40 0.00 0.04 0.00 0.00 32.58 34.20 1yq2 s HIS 338 CO -0.07 -0.31 1.85 -1.35 -2.34 0.00 0.00 174.74 172.53 1yq2 h PRO 339 N 6.69 0.00 0.00 2.88 0.11 -1.86 -0.94 132.00 138.89 1yq2 h PRO 339 Ca -0.34 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.58 1yq2 h PRO 339 Cb 1.18 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 1yq2 h PRO 339 CO 0.29 0.00 -1.82 -0.25 -0.21 0.00 0.00 178.00 176.01 1yq2 n ASP 340 N -2.51 1.88 -0.02 -2.05 8.00 -1.26 -1.74 116.55 118.86 1yq2 n ASP 340 Ca -0.01 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.50 1yq2 n ASP 340 Cb 0.12 0.97 -0.01 0.00 -0.02 0.00 0.00 41.12 42.18 1yq2 n ASP 340 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1yq2 n ARG 341 N -2.37 5.15 0.00 -1.24 1.74 -1.11 -4.18 116.66 114.65 1yq2 n ARG 341 Ca -0.17 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 1yq2 n ARG 341 Cb 0.80 -0.68 0.00 0.00 -1.02 0.00 0.00 32.46 31.57 1yq2 n ARG 341 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yq2 n GLY 342 N 0.91 1.19 1.64 -0.13 0.00 -0.37 -3.19 105.19 105.24 1yq2 n GLY 342 Ca 0.01 -0.57 0.09 0.00 0.00 0.00 0.00 46.02 45.55 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 12.56 3.86 -2.13 1.61 1.74 -1.26 -1.33 116.66 131.70 1yq2 n ARG 343 Ca 0.00 -2.92 -0.42 0.00 -0.77 0.00 0.00 57.85 53.74 1yq2 n ARG 343 Cb 0.00 -1.94 -0.03 0.00 -1.02 0.00 0.00 32.46 29.47 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 -1.92 3.13 0.24 1.55 1.01 -1.19 -4.87 120.40 118.35 1yq2 s VAL 344 Ca 0.52 0.85 -0.27 0.00 0.00 0.00 0.00 61.98 63.08 1yq2 s VAL 344 Cb 0.34 -3.54 -0.09 0.00 0.00 0.00 0.00 36.38 33.09 1yq2 s VAL 344 CO 0.25 0.09 0.89 0.12 0.00 0.00 0.00 175.10 176.44 1yq2 s PHE 345 N 0.79 3.87 -0.10 5.22 5.36 -1.26 -4.90 117.98 126.96 1yq2 s PHE 345 Ca 0.63 1.78 -0.02 0.00 -0.96 0.00 0.00 56.93 58.36 1yq2 s PHE 345 Cb -0.38 -2.89 0.03 0.00 -0.34 0.00 0.00 43.02 39.44 1yq2 s PHE 345 CO 0.33 0.40 -0.00 0.34 -1.46 0.00 0.00 175.22 174.83 1yq2 s ASP 346 N -1.32 1.89 0.16 6.13 2.15 -1.26 -5.06 116.67 119.36 1yq2 s ASP 346 Ca 0.42 -0.24 -0.14 0.00 0.43 0.00 0.00 52.55 53.02 1yq2 s ASP 346 Cb -0.23 -0.51 0.04 0.00 -0.30 0.00 0.00 42.92 41.93 1yq2 s ASP 346 CO 0.28 -0.21 1.76 -0.08 -0.17 0.00 0.00 175.17 176.75 1yq2 h GLU 347 N 8.30 0.71 -0.65 4.34 4.81 -1.99 -0.25 114.58 129.84 1yq2 h GLU 347 Ca -0.20 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1yq2 h GLU 347 Cb 1.12 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 1yq2 h GLU 347 CO 0.29 0.56 0.42 0.00 -0.73 0.00 0.00 179.01 179.55 1yq2 h ALA 348 N 1.11 0.83 -0.55 2.92 0.00 -2.00 -0.41 119.26 121.16 1yq2 h ALA 348 Ca 0.18 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1yq2 h ALA 348 Cb 0.07 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1yq2 h ALA 348 CO -0.03 0.27 0.30 0.78 0.00 0.00 0.00 179.25 180.58 1yq2 h GLY 349 N 0.89 0.82 1.00 0.00 0.00 -1.93 -2.47 103.07 101.37 1yq2 h GLY 349 Ca 0.24 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 1yq2 h GLY 349 CO -0.05 0.35 0.36 0.00 0.00 0.00 0.00 176.54 177.20 1yq2 h ALA 350 N 1.14 0.77 -0.16 3.60 0.00 -0.69 -0.82 119.26 123.10 1yq2 h ALA 350 Ca 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1yq2 h ALA 350 Cb 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1yq2 h ALA 350 CO -0.03 0.26 0.09 0.00 0.00 0.00 0.00 179.25 179.57 1yq2 h ARG 351 N 0.82 0.19 -0.95 0.00 3.08 -1.01 -1.02 114.38 115.49 1yq2 h ARG 351 Ca 0.22 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 1yq2 h ARG 351 Cb -0.01 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 29.96 1yq2 h ARG 351 CO -0.04 0.12 0.56 0.93 -1.07 0.00 0.00 179.97 180.48 1yq2 h GLU 352 N 0.19 1.29 0.07 0.04 4.39 -1.34 -0.06 114.58 119.16 1yq2 h GLU 352 Ca 0.06 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1yq2 h GLU 352 Cb -0.01 -0.27 -0.01 0.00 -0.10 0.00 0.00 28.75 28.36 1yq2 h GLU 352 CO -0.02 0.91 -0.07 0.22 -1.16 0.00 0.00 179.01 178.88 1yq2 h ASP 353 N 1.31 -0.19 -0.01 1.42 3.58 -0.81 -0.51 116.42 121.21 1yq2 h ASP 353 Ca 0.34 0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.74 1yq2 h ASP 353 Cb -0.05 0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.06 1yq2 h ASP 353 CO -0.06 -0.12 -0.19 -0.07 -2.88 0.00 0.00 179.24 175.92 1yq2 h LEU 354 N -0.16 0.35 -0.42 2.28 4.07 -1.02 -1.70 115.31 118.69 1yq2 h LEU 354 Ca 0.00 -0.10 -0.05 0.00 0.08 0.00 0.00 57.88 57.82 1yq2 h LEU 354 Cb 0.16 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.79 1yq2 h LEU 354 CO -0.02 0.56 0.07 0.00 -1.08 0.00 0.00 178.44 177.97 1yq2 h ALA 355 N 1.48 0.56 -0.66 1.53 0.00 -0.74 -1.67 119.26 119.76 1yq2 h ALA 355 Ca 0.06 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.78 1yq2 h ALA 355 Cb 0.53 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1yq2 h ALA 355 CO 0.03 0.27 0.41 1.25 0.00 0.00 0.00 179.25 181.22 1yq2 h LEU 356 N 0.55 0.67 -0.28 0.00 5.85 -0.70 -1.75 115.31 119.66 1yq2 h LEU 356 Ca 0.13 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.90 1yq2 h LEU 356 Cb 0.37 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 1yq2 h LEU 356 CO 0.01 0.47 -0.08 0.24 -0.34 0.00 0.00 178.44 178.74 1yq2 h MET 357 N 0.81 -0.01 -0.76 1.25 2.86 -1.04 -2.48 114.93 115.56 1yq2 h MET 357 Ca 0.26 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.92 1yq2 h MET 357 Cb 0.01 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 1yq2 h MET 357 CO -0.10 -0.01 0.50 0.87 1.06 0.00 0.00 176.91 179.23 1yq2 h LYS 358 N -0.01 0.98 0.00 1.72 1.57 -0.79 -1.15 116.57 118.88 1yq2 h LYS 358 Ca 0.14 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1yq2 h LYS 358 Cb 0.22 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1yq2 h LYS 358 CO -0.29 0.65 -0.03 0.00 -0.57 0.00 0.00 179.45 179.20 1yq2 h ARG 359 N 1.01 0.00 -0.47 3.15 3.08 -0.88 -2.20 114.38 118.06 1yq2 h ARG 359 Ca 0.28 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.18 1yq2 h ARG 359 Cb -0.08 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 29.87 1yq2 h ARG 359 CO -0.07 0.03 0.09 1.19 -1.07 0.00 0.00 179.97 180.14 1yq2 n PHE 360 N -3.27 1.53 -1.43 3.04 3.72 -0.50 -4.97 117.46 115.58 1yq2 n PHE 360 Ca -0.02 -1.29 -0.14 0.00 -0.05 0.00 0.00 57.45 55.95 1yq2 n PHE 360 Cb 0.17 -0.52 -0.06 0.00 -0.94 0.00 0.00 39.48 38.13 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 -0.70 -4.72 -4.71 4.37 3.02 -0.83 -4.14 115.26 107.56 1yq2 n ASN 361 Ca 0.33 0.35 -0.42 0.00 -0.03 0.00 0.00 54.58 54.81 1yq2 n ASN 361 Cb 1.13 -3.49 -0.03 0.00 -0.61 0.00 0.00 39.78 36.78 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 -2.54 3.82 -0.23 2.41 1.01 -0.82 -4.89 120.40 119.17 1yq2 s VAL 362 Ca 0.00 1.28 0.02 0.00 0.00 0.00 0.00 61.98 63.28 1yq2 s VAL 362 Cb 0.00 -3.82 0.04 0.00 0.00 0.00 0.00 36.38 32.60 1yq2 s VAL 362 CO 0.00 0.07 0.84 -0.46 0.00 0.00 0.00 175.10 175.55 1yq2 n ASN 363 N 4.34 1.74 -3.70 3.32 0.23 -0.32 -4.36 115.26 116.51 1yq2 n ASN 363 Ca 0.11 -1.60 -0.14 0.00 -0.53 0.00 0.00 54.58 52.42 1yq2 n ASN 363 Cb 0.45 -0.03 -0.08 0.00 -2.08 0.00 0.00 39.78 38.04 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 -0.64 -0.99 -0.04 -2.53 0.00 -1.19 -1.18 121.76 115.19 1yq2 s ALA 364 Ca 0.04 0.50 0.01 0.00 0.00 0.00 0.00 51.96 52.51 1yq2 s ALA 364 Cb 0.02 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.26 1yq2 s ALA 364 CO 0.03 -0.31 -0.04 0.42 0.00 0.00 0.00 175.76 175.86 1yq2 s ILE 365 N -1.46 0.49 -0.21 0.00 1.01 -0.14 -1.69 121.20 119.21 1yq2 s ILE 365 Ca -0.12 -0.12 -0.07 0.00 0.00 0.00 0.00 60.65 60.34 1yq2 s ILE 365 Cb -0.04 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.89 1yq2 s ILE 365 CO 0.04 0.20 0.06 -0.60 0.00 0.00 0.00 174.94 174.65 1yq2 s ARG 366 N 0.75 3.83 -1.08 2.79 3.52 -0.62 -1.36 118.95 126.78 1yq2 s ARG 366 Ca -0.10 -0.41 -0.18 0.00 -0.13 0.00 0.00 55.73 54.91 1yq2 s ARG 366 Cb -0.13 -3.24 0.11 0.00 -1.56 0.00 0.00 34.95 30.14 1yq2 s ARG 366 CO 0.00 0.10 1.38 0.95 -0.81 0.00 0.00 175.30 176.92 1yq2 s THR 367 N 0.84 4.53 -0.24 4.11 -4.23 -0.92 -1.65 115.64 118.07 1yq2 s THR 367 Ca 0.03 -1.73 -0.25 0.00 -1.18 0.00 0.00 61.69 58.56 1yq2 s THR 367 Cb -0.14 -4.95 -0.00 0.00 1.34 0.00 0.00 72.50 68.75 1yq2 s THR 367 CO 0.02 -1.72 0.83 -0.94 -0.54 0.00 0.00 174.62 172.28 1yq2 s SER 368 N 3.82 6.83 -0.49 3.99 1.04 -1.01 -1.88 113.70 126.00 1yq2 s SER 368 Ca 0.42 1.03 0.08 0.00 0.48 0.00 0.00 55.95 57.96 1yq2 s SER 368 Cb -0.02 -2.44 0.29 0.00 0.10 0.00 0.00 66.02 63.96 1yq2 s SER 368 CO -0.04 -0.52 0.72 1.41 0.98 0.00 0.00 173.24 175.78 1yq2 n HIS 369 N 6.02 1.74 -3.62 5.02 -0.00 -1.26 -4.31 115.22 118.81 1yq2 n HIS 369 Ca 0.06 -3.87 -0.01 0.00 -0.00 0.00 0.00 57.72 53.90 1yq2 n HIS 369 Cb 0.47 -0.45 -0.01 0.00 -0.00 0.00 0.00 29.99 30.00 1yq2 n HIS 369 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 1yq2 s TYR 370 N -2.28 -0.03 0.43 4.41 -0.85 -0.79 -3.86 117.35 114.38 1yq2 s TYR 370 Ca 0.40 0.01 -0.25 0.00 -0.52 0.00 0.00 57.07 56.71 1yq2 s TYR 370 Cb 0.23 0.51 -0.08 0.00 0.38 0.00 0.00 41.96 43.00 1yq2 s TYR 370 CO -0.08 -0.07 1.28 -2.14 -1.52 0.00 0.00 175.55 173.02 1yq2 s PRO 371 N -2.13 3.84 0.41 -3.49 0.02 -0.75 -4.54 135.00 128.38 1yq2 s PRO 371 Ca 0.12 2.08 -0.06 0.00 0.02 0.00 0.00 61.00 63.16 1yq2 s PRO 371 Cb 0.01 -2.64 0.09 0.00 0.02 0.00 0.00 34.50 31.99 1yq2 s PRO 371 CO -0.04 -0.57 0.56 -0.35 -0.33 0.00 0.00 177.00 176.28 1yq2 n PRO 372 N -0.11 -0.44 -1.78 5.54 -0.04 -1.26 -4.89 135.00 132.03 1yq2 n PRO 372 Ca 0.05 -0.95 -0.41 0.00 -0.04 0.00 0.00 63.50 62.15 1yq2 n PRO 372 Cb 0.45 -0.55 -0.00 0.00 -0.04 0.00 0.00 33.50 33.35 1yq2 n PRO 372 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1yq2 s HIS 373 N -2.12 2.55 0.59 0.54 5.65 -1.26 -4.85 115.29 116.40 1yq2 s HIS 373 Ca 0.33 1.15 0.29 0.00 0.25 0.00 0.00 55.06 57.08 1yq2 s HIS 373 Cb -0.01 -4.05 1.77 0.00 -1.18 0.00 0.00 32.58 29.12 1yq2 s HIS 373 CO 0.23 -3.08 2.22 -1.00 -0.65 0.00 0.00 174.74 172.46 1yq2 h PRO 374 N 2.98 0.00 0.00 2.88 0.13 -1.95 -1.46 132.00 134.58 1yq2 h PRO 374 Ca -0.51 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 1yq2 h PRO 374 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1yq2 h PRO 374 CO 0.64 0.00 -0.22 -0.09 -0.23 0.00 0.00 178.00 178.10 1yq2 h ARG 375 N 0.00 0.00 -0.78 0.86 9.65 -2.01 -2.44 114.38 119.66 1yq2 h ARG 375 Ca 0.02 0.00 0.11 0.00 -1.10 0.00 0.00 59.98 59.01 1yq2 h ARG 375 Cb 0.10 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.63 1yq2 h ARG 375 CO -0.00 0.22 0.51 1.25 2.80 0.00 0.00 179.97 184.75 1yq2 h LEU 376 N 0.00 0.60 -1.00 3.80 5.85 -1.62 -1.96 115.31 120.97 1yq2 h LEU 376 Ca -0.00 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.63 1yq2 h LEU 376 Cb 0.45 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 1yq2 h LEU 376 CO 0.03 0.34 -0.47 -0.07 -0.34 0.00 0.00 178.44 177.93 1yq2 h LEU 377 N 0.66 0.06 -0.92 2.25 3.38 -1.60 -1.51 115.31 117.62 1yq2 h LEU 377 Ca 0.37 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.27 1yq2 h LEU 377 Cb 0.54 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1yq2 h LEU 377 CO -0.14 0.52 0.32 0.44 0.09 0.00 0.00 178.44 179.67 1yq2 h ASP 378 N 0.04 1.01 -0.20 -0.43 3.32 -1.47 -1.43 116.42 117.27 1yq2 h ASP 378 Ca -0.00 -0.14 -0.13 0.00 0.02 0.00 0.00 57.03 56.78 1yq2 h ASP 378 Cb 0.86 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1yq2 h ASP 378 CO 0.06 0.89 -0.33 -0.07 -1.72 0.00 0.00 179.24 178.07 1yq2 h LEU 379 N 1.09 0.74 -0.59 1.55 3.38 -1.19 -2.22 115.31 118.07 1yq2 h LEU 379 Ca 0.26 -0.31 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 1yq2 h LEU 379 Cb 0.17 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1yq2 h LEU 379 CO -0.03 1.01 -0.28 0.00 0.09 0.00 0.00 178.44 179.23 1yq2 h ALA 380 N 1.03 0.77 -0.81 1.53 0.00 -1.09 0.17 119.26 120.86 1yq2 h ALA 380 Ca 0.06 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1yq2 h ALA 380 Cb 0.85 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1yq2 h ALA 380 CO 0.07 0.65 0.44 -0.44 0.00 0.00 0.00 179.25 179.98 1yq2 h ASP 381 N 0.70 1.02 0.22 0.00 3.32 -1.20 -0.93 116.42 119.55 1yq2 h ASP 381 Ca 0.08 -0.10 -0.31 0.00 0.02 0.00 0.00 57.03 56.72 1yq2 h ASP 381 Cb 0.83 -0.26 0.03 0.00 0.22 0.00 0.00 39.33 40.15 1yq2 h ASP 381 CO 0.07 0.83 -1.37 -0.08 -1.72 0.00 0.00 179.24 176.98 1yq2 h GLU 382 N 1.13 0.47 0.00 3.56 4.81 -1.20 -3.37 114.58 119.98 1yq2 h GLU 382 Ca 0.29 -0.80 -0.17 0.00 -0.13 0.00 0.00 59.36 58.55 1yq2 h GLU 382 Cb 0.04 0.30 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 1yq2 h GLU 382 CO -0.04 1.38 -1.10 0.52 -0.73 0.00 0.00 179.01 179.04 1yq2 h MET 383 N 0.02 0.00 -0.58 1.92 2.86 -0.72 -3.45 114.93 114.97 1yq2 h MET 383 Ca -0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1yq2 h MET 383 Cb 2.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.70 1yq2 h MET 383 CO 0.23 0.48 0.00 0.41 1.06 0.00 0.00 176.91 179.09 1yq2 n GLY 384 N 1.35 0.26 2.93 8.32 0.00 -0.37 -4.88 105.19 112.80 1yq2 n GLY 384 Ca -0.05 -0.56 -0.18 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.16 0.59 0.19 1.61 0.40 -1.07 -4.68 117.98 114.85 1yq2 s PHE 385 Ca 0.00 -0.12 -0.30 0.00 -0.60 0.00 0.00 56.93 55.90 1yq2 s PHE 385 Cb 0.00 -0.45 -0.09 0.00 0.51 0.00 0.00 43.02 42.99 1yq2 s PHE 385 CO 0.00 -0.08 1.32 -1.58 0.70 0.00 0.00 175.22 175.58 1yq2 s TRP 386 N 0.29 3.25 -0.05 0.36 0.52 -0.32 -4.69 118.94 118.30 1yq2 s TRP 386 Ca -0.03 1.20 0.05 0.00 0.02 0.00 0.00 56.10 57.34 1yq2 s TRP 386 Cb -0.07 -3.61 -0.01 0.00 -1.15 0.00 0.00 33.47 28.63 1yq2 s TRP 386 CO -0.00 -1.92 -0.21 0.08 0.02 0.00 0.00 176.95 174.91 1yq2 s VAL 387 N 0.20 1.78 -0.39 4.03 1.01 0.11 -0.96 120.40 126.18 1yq2 s VAL 387 Ca 0.57 -0.91 -0.13 0.00 0.00 0.00 0.00 61.98 61.52 1yq2 s VAL 387 Cb -0.36 -1.51 0.03 0.00 0.00 0.00 0.00 36.38 34.53 1yq2 s VAL 387 CO 0.37 0.50 0.25 -0.63 0.00 0.00 0.00 175.10 175.59 1yq2 s ILE 388 N -0.05 4.85 -0.29 2.22 1.01 -0.46 -1.39 121.20 127.09 1yq2 s ILE 388 Ca -0.04 -0.80 -0.14 0.00 0.00 0.00 0.00 60.65 59.66 1yq2 s ILE 388 Cb -0.13 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.59 1yq2 s ILE 388 CO 0.03 -0.28 0.35 -0.22 0.00 0.00 0.00 174.94 174.82 1yq2 s LEU 389 N 1.60 4.13 -0.12 2.97 1.98 -0.81 -2.17 118.68 126.25 1yq2 s LEU 389 Ca 0.03 0.13 -0.02 0.00 -2.89 0.00 0.00 54.13 51.38 1yq2 s LEU 389 Cb -0.19 -2.37 -0.03 0.00 0.66 0.00 0.00 46.19 44.26 1yq2 s LEU 389 CO 0.08 -0.21 -0.06 -0.70 -1.89 0.00 0.00 176.35 173.57 1yq2 s GLU 390 N 2.03 3.35 0.59 1.98 2.12 -1.26 -0.98 118.70 126.54 1yq2 s GLU 390 Ca 0.13 -0.55 -0.19 0.00 0.36 0.00 0.00 54.97 54.72 1yq2 s GLU 390 Cb -0.16 -2.77 -0.03 0.00 0.26 0.00 0.00 34.13 31.43 1yq2 s GLU 390 CO 0.11 0.37 1.23 0.00 -0.54 0.00 0.00 175.26 176.42 1yq2 s ASP 392 N -1.51 6.28 -0.28 0.00 -1.08 -1.26 -3.95 116.67 114.87 1yq2 s ASP 392 Ca 0.78 -1.64 -0.10 0.00 -0.52 0.00 0.00 52.55 51.07 1yq2 s ASP 392 Cb -0.32 -2.57 0.12 0.00 -1.46 0.00 0.00 42.92 38.68 1yq2 s ASP 392 CO 0.35 -1.72 0.62 -0.22 0.52 0.00 0.00 175.17 174.71 1yq2 s LEU 393 N 6.01 -1.04 -0.25 -1.34 2.96 -1.25 -4.90 118.68 118.86 1yq2 s LEU 393 Ca 0.54 1.48 -0.07 0.00 -0.22 0.00 0.00 54.13 55.85 1yq2 s LEU 393 Cb 0.00 2.16 0.12 0.00 0.50 0.00 0.00 46.19 48.97 1yq2 s LEU 393 CO -0.02 -0.22 0.51 -0.70 -1.32 0.00 0.00 176.35 174.60 1yq2 s GLU 394 N 2.72 0.44 -0.27 1.98 2.12 0.29 -1.25 118.70 124.73 1yq2 s GLU 394 Ca -0.06 1.13 0.09 0.00 0.36 0.00 0.00 54.97 56.49 1yq2 s GLU 394 Cb -0.11 0.46 0.45 0.00 0.26 0.00 0.00 34.13 35.19 1yq2 s GLU 394 CO -0.18 -0.31 1.29 0.25 -0.54 0.00 0.00 175.26 175.77 1yq2 n THR 395 N 5.41 2.44 -0.24 -1.70 -2.24 -1.24 -0.80 114.28 115.92 1yq2 n THR 395 Ca -0.08 -3.44 0.16 0.00 -2.27 0.00 0.00 64.05 58.42 1yq2 n THR 395 Cb 0.50 -0.57 0.47 0.00 -2.10 0.00 0.00 70.33 68.62 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 1.40 0.62 0.00 4.78 6.17 -1.65 -1.68 115.15 124.80 1yq2 h HIS 396 Ca 0.18 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.28 1yq2 h HIS 396 Cb 1.30 -0.19 0.00 0.00 2.52 0.00 0.00 27.41 31.03 1yq2 h HIS 396 CO 0.88 0.20 0.01 0.78 0.71 0.00 0.00 177.93 180.51 1yq2 h GLY 397 N 0.50 0.00 1.93 5.26 0.00 -1.87 -1.66 103.07 107.23 1yq2 h GLY 397 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 1yq2 h GLY 397 CO -0.18 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.05 1yq2 n PHE 398 N -2.47 0.00 -0.05 5.60 3.01 -0.63 -4.12 117.46 118.79 1yq2 n PHE 398 Ca -0.02 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.33 1yq2 n PHE 398 Cb 0.05 -0.47 -0.05 0.00 -0.01 0.00 0.00 39.48 39.01 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 0.26 -0.94 -1.08 4.81 -1.50 -0.39 114.58 115.74 1yq2 h GLU 399 Ca 0.00 -0.05 0.13 0.00 -0.13 0.00 0.00 59.36 59.32 1yq2 h GLU 399 Cb 0.45 -0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.71 1yq2 h GLU 399 CO 0.00 0.33 0.60 0.00 -0.73 0.00 0.00 179.01 179.21 1yq2 h ALA 400 N 0.92 1.68 -0.35 2.92 0.00 -1.80 0.16 119.26 122.80 1yq2 h ALA 400 Ca 0.06 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 1yq2 h ALA 400 Cb 0.16 -0.16 -0.10 0.00 0.00 0.00 0.00 17.79 17.69 1yq2 h ALA 400 CO -0.01 0.07 0.20 0.41 0.00 0.00 0.00 179.25 179.93 1yq2 n GLY 401 N -1.39 2.79 2.31 0.00 0.00 -1.20 -4.86 105.19 102.84 1yq2 n GLY 401 Ca 0.18 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.06 -0.10 2.50 -0.02 0.00 0.57 -3.05 105.19 105.03 1yq2 n GLY 402 Ca 0.21 -0.24 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.87 0.00 -2.02 1.61 7.02 -0.16 -4.96 117.44 115.06 1yq2 n TRP 403 Ca -0.18 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 55.88 1yq2 n TRP 403 Cb 0.63 -2.36 -0.03 0.00 -2.42 0.00 0.00 31.31 27.13 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 -2.26 2.85 -0.30 -0.99 1.01 -1.17 -1.59 120.40 117.95 1yq2 s VAL 404 Ca 0.00 0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.59 1yq2 s VAL 404 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1yq2 s VAL 404 CO 0.00 0.05 0.00 -0.62 0.00 0.00 0.00 175.10 174.53 1yq2 n GLU 405 N 3.92 -1.11 -1.66 2.72 1.02 -1.26 -4.96 120.64 119.32 1yq2 n GLU 405 Ca 0.13 0.44 -0.53 0.00 -0.02 0.00 0.00 57.16 57.18 1yq2 n GLU 405 Cb 0.40 -4.36 -0.06 0.00 -0.02 0.00 0.00 31.44 27.40 1yq2 n GLU 405 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1yq2 n ASN 406 N -0.45 2.81 -0.13 1.62 5.15 -0.62 -4.82 115.26 118.81 1yq2 n ASN 406 Ca -0.03 0.93 0.27 0.00 -0.60 0.00 0.00 54.58 55.16 1yq2 n ASN 406 Cb 0.32 -1.26 0.72 0.00 -0.53 0.00 0.00 39.78 39.03 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 8.86 0.00 0.00 1.20 0.11 -1.92 -0.93 132.00 139.32 1yq2 h PRO 407 Ca -0.45 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 1yq2 h PRO 407 Cb 1.30 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 1yq2 h PRO 407 CO 0.97 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 -2.86 113.55 106.78 1yq2 h SER 408 Ca 0.39 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.34 1yq2 h SER 408 Cb 1.68 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.21 1yq2 h SER 408 CO -0.00 0.01 -0.16 -0.67 -1.14 0.00 0.00 176.83 174.86 1yq2 n ASP 409 N -3.43 1.71 -4.36 3.07 2.03 -0.37 -1.86 116.55 113.35 1yq2 n ASP 409 Ca -0.03 -2.83 -0.35 0.00 0.52 0.00 0.00 54.79 52.10 1yq2 n ASP 409 Cb 0.09 -0.37 -0.13 0.00 -0.72 0.00 0.00 41.12 39.98 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 -2.12 3.62 0.46 5.18 1.01 -1.08 -4.81 120.40 122.65 1yq2 s VAL 410 Ca 0.24 -0.42 0.15 0.00 0.00 0.00 0.00 61.98 61.95 1yq2 s VAL 410 Cb 0.21 -2.65 0.32 0.00 0.00 0.00 0.00 36.38 34.27 1yq2 s VAL 410 CO 0.02 0.42 2.02 -0.65 0.00 0.00 0.00 175.10 176.90 1yq2 h PRO 411 N 7.94 0.31 -0.21 2.72 0.11 -1.94 -1.85 132.00 139.08 1yq2 h PRO 411 Ca -0.39 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.76 1yq2 h PRO 411 Cb 1.17 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1yq2 h PRO 411 CO 0.60 0.20 0.24 0.00 -0.21 0.00 0.00 178.00 178.83 1yq2 h ALA 412 N 1.75 1.82 -0.02 -0.75 0.00 -1.95 -1.72 119.26 118.39 1yq2 h ALA 412 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1yq2 h ALA 412 Cb 0.44 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1yq2 h ALA 412 CO -0.05 -0.35 -0.19 0.91 0.00 0.00 0.00 179.25 179.57 1yq2 n TRP 413 N -3.74 0.00 -0.00 0.00 7.02 -0.70 -4.55 117.44 115.48 1yq2 n TRP 413 Ca 0.02 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.39 1yq2 n TRP 413 Cb 0.37 -0.01 -0.06 0.00 -2.42 0.00 0.00 31.31 29.18 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 3.37 0.10 -0.76 -0.99 2.43 -1.36 -1.57 114.38 115.60 1yq2 h ARG 414 Ca 0.00 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.23 1yq2 h ARG 414 Cb 0.82 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.29 1yq2 h ARG 414 CO 0.00 0.18 0.43 -0.44 -1.51 0.00 0.00 179.97 178.63 1yq2 h ASP 415 N -0.00 0.64 -0.48 -3.80 3.32 -1.82 -1.34 116.42 112.93 1yq2 h ASP 415 Ca 0.02 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 1yq2 h ASP 415 Cb 0.11 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 1yq2 h ASP 415 CO -0.00 0.39 0.23 0.00 -1.72 0.00 0.00 179.24 178.14 1yq2 h ALA 416 N 1.40 0.62 -0.31 3.45 0.00 -1.68 -1.73 119.26 121.01 1yq2 h ALA 416 Ca 0.35 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1yq2 h ALA 416 Cb 0.26 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1yq2 h ALA 416 CO -0.21 0.18 -0.22 -0.07 0.00 0.00 0.00 179.25 178.93 1yq2 h LEU 417 N 0.63 0.73 -0.68 0.00 4.07 -0.65 -1.35 115.31 118.05 1yq2 h LEU 417 Ca 0.16 -0.44 -0.09 0.00 0.08 0.00 0.00 57.88 57.60 1yq2 h LEU 417 Cb 0.12 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.63 1yq2 h LEU 417 CO -0.02 1.02 0.04 0.58 -1.08 0.00 0.00 178.44 178.98 1yq2 h VAL 418 N 0.45 1.26 -0.95 1.22 2.07 -1.26 -2.25 116.25 116.80 1yq2 h VAL 418 Ca 0.06 -1.10 0.01 0.00 0.82 0.00 0.00 66.70 66.49 1yq2 h VAL 418 Cb 0.78 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 1yq2 h VAL 418 CO 0.06 0.40 0.62 -0.78 0.02 0.00 0.00 177.57 177.90 1yq2 h ASP 419 N 0.98 1.11 -0.65 0.57 3.58 -1.21 0.08 116.42 120.88 1yq2 h ASP 419 Ca 0.18 -0.04 0.02 0.00 0.42 0.00 0.00 57.03 57.62 1yq2 h ASP 419 Cb 0.50 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 41.24 1yq2 h ASP 419 CO 0.02 0.81 0.41 0.03 -2.88 0.00 0.00 179.24 177.63 1yq2 h ARG 420 N 1.30 0.79 -0.42 0.28 3.08 -0.88 -0.97 114.38 117.57 1yq2 h ARG 420 Ca 0.35 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 60.25 1yq2 h ARG 420 Cb -0.13 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.73 1yq2 h ARG 420 CO -0.07 0.52 -0.13 1.98 -1.07 0.00 0.00 179.97 181.21 1yq2 h MET 421 N 0.82 0.82 -0.52 0.04 4.05 -0.80 -1.44 114.93 117.91 1yq2 h MET 421 Ca 0.26 -0.33 0.01 0.00 -0.28 0.00 0.00 59.70 59.36 1yq2 h MET 421 Cb -0.01 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 30.72 1yq2 h MET 421 CO -0.09 0.95 0.34 1.49 0.23 0.00 0.00 176.91 179.83 1yq2 h GLU 422 N 0.64 0.68 -0.25 0.39 4.81 -0.83 -0.46 114.58 119.56 1yq2 h GLU 422 Ca 0.10 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.19 1yq2 h GLU 422 Cb 0.66 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 1yq2 h GLU 422 CO 0.05 0.45 -0.27 0.00 -0.73 0.00 0.00 179.01 178.50 1yq2 h ARG 423 N 0.70 0.49 0.13 1.92 3.08 -1.01 -0.59 114.38 119.09 1yq2 h ARG 423 Ca 0.19 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1yq2 h ARG 423 Cb -0.08 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1yq2 h ARG 423 CO -0.04 0.72 -0.06 1.15 -1.07 0.00 0.00 179.97 180.66 1yq2 h THR 424 N 0.43 0.92 -0.22 2.04 2.02 -0.87 -2.89 112.91 114.34 1yq2 h THR 424 Ca 0.06 -0.22 -0.08 0.00 0.77 0.00 0.00 66.41 66.94 1yq2 h THR 424 Cb 0.70 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 68.17 1yq2 h THR 424 CO 0.05 0.05 -0.17 0.58 0.37 0.00 0.00 175.52 176.40 1yq2 h VAL 425 N -0.28 1.32 -0.58 3.16 2.07 -1.02 -3.22 116.25 117.70 1yq2 h VAL 425 Ca -0.02 -1.31 -0.10 0.00 0.82 0.00 0.00 66.70 66.10 1yq2 h VAL 425 Cb 0.22 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1yq2 h VAL 425 CO 0.03 0.40 -0.02 -0.33 0.02 0.00 0.00 177.57 177.67 1yq2 h GLU 426 N 0.21 1.03 -0.64 1.57 4.39 -1.19 -1.51 114.58 118.44 1yq2 h GLU 426 Ca 0.04 -0.34 0.04 0.00 0.34 0.00 0.00 59.36 59.45 1yq2 h GLU 426 Cb 0.71 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.22 1yq2 h GLU 426 CO 0.05 1.03 0.37 -0.09 -1.16 0.00 0.00 179.01 179.20 1yq2 h ARG 427 N 0.92 0.69 -0.07 2.33 2.43 -1.52 -2.78 114.38 116.38 1yq2 h ARG 427 Ca 0.16 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1yq2 h ARG 427 Cb 0.57 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1yq2 h ARG 427 CO 0.03 0.46 0.00 -0.25 -1.51 0.00 0.00 179.97 178.70 1yq2 n ASP 428 N -4.76 1.99 0.18 -3.80 8.00 -1.11 -1.99 116.55 115.06 1yq2 n ASP 428 Ca 0.07 -1.52 0.19 0.00 0.71 0.00 0.00 54.79 54.24 1yq2 n ASP 428 Cb 0.13 -0.04 0.79 0.00 -0.02 0.00 0.00 41.12 41.97 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 1.87 0.00 0.00 -1.24 2.10 -1.39 -2.37 116.57 115.53 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 0.46 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 1yq2 h LYS 429 CO 0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 1yq2 n ASN 430 N -3.52 0.08 -4.68 7.07 3.02 -1.26 -4.86 115.26 111.10 1yq2 n ASN 430 Ca 0.04 0.51 -0.41 0.00 -0.03 0.00 0.00 54.58 54.69 1yq2 n ASN 430 Cb 0.50 -0.53 -0.05 0.00 -0.61 0.00 0.00 39.78 39.09 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 -3.01 3.44 0.40 3.10 3.76 -0.90 -4.94 115.29 117.15 1yq2 s HIS 431 Ca 0.12 1.18 0.16 0.00 -0.15 0.00 0.00 55.06 56.37 1yq2 s HIS 431 Cb 0.16 -2.92 0.95 0.00 1.11 0.00 0.00 32.58 31.89 1yq2 s HIS 431 CO 0.48 -0.16 1.93 -1.00 -0.85 0.00 0.00 174.74 175.14 1yq2 h PRO 432 N 7.25 0.00 0.00 8.40 0.13 -1.89 -2.97 132.00 142.93 1yq2 h PRO 432 Ca -0.32 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.80 1yq2 h PRO 432 Cb 1.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 1yq2 h PRO 432 CO 0.80 0.25 -0.04 0.66 -0.23 0.00 0.00 178.00 179.44 1yq2 h SER 433 N 0.00 0.00 -3.01 1.44 4.64 -1.89 -3.41 113.55 111.32 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 0.48 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.52 1yq2 h SER 433 CO 0.03 0.04 0.89 -0.63 -0.87 0.00 0.00 176.83 176.30 1yq2 s ILE 434 N -4.95 4.35 0.00 0.95 1.01 -1.12 0.08 121.20 121.52 1yq2 s ILE 434 Ca -0.05 1.61 0.00 0.00 0.00 0.00 0.00 60.65 62.22 1yq2 s ILE 434 Cb 0.17 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.52 1yq2 s ILE 434 CO 0.67 -0.23 0.12 1.33 0.00 0.00 0.00 174.94 176.83 1yq2 n VAL 435 N 5.55 0.00 -3.79 2.92 0.24 -0.49 -4.91 118.33 117.85 1yq2 n VAL 435 Ca 0.14 -0.49 -0.13 0.00 -2.04 0.00 0.00 64.34 61.82 1yq2 n VAL 435 Cb 0.46 1.00 -0.11 0.00 -1.47 0.00 0.00 33.84 33.72 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 -0.74 0.35 -0.00 7.34 -1.94 -1.21 -3.93 119.30 119.17 1yq2 s MET 436 Ca 0.00 0.20 -0.07 0.00 -1.71 0.00 0.00 55.69 54.10 1yq2 s MET 436 Cb 0.00 0.16 -0.05 0.00 2.01 0.00 0.00 34.83 36.96 1yq2 s MET 436 CO 0.00 -0.06 0.27 -1.58 -0.01 0.00 0.00 175.02 173.64 1yq2 s TRP 437 N -0.20 3.59 -0.02 -0.03 0.23 -0.59 -1.93 118.94 119.98 1yq2 s TRP 437 Ca -0.03 0.62 0.07 0.00 -2.03 0.00 0.00 56.10 54.72 1yq2 s TRP 437 Cb -0.03 -2.02 -0.02 0.00 0.03 0.00 0.00 33.47 31.44 1yq2 s TRP 437 CO 0.01 0.62 -0.23 0.45 0.96 0.00 0.00 176.95 178.77 1yq2 s SER 438 N -1.58 2.69 0.44 2.95 0.15 -0.15 -0.67 113.70 117.53 1yq2 s SER 438 Ca 0.26 -0.42 0.29 0.00 0.70 0.00 0.00 55.95 56.78 1yq2 s SER 438 Cb -0.13 -0.36 0.99 0.00 -1.71 0.00 0.00 66.02 64.81 1yq2 s SER 438 CO 0.15 0.27 1.82 -0.07 1.20 0.00 0.00 173.24 176.61 1yq2 h LEU 439 N 5.64 0.00 0.00 3.45 3.38 -1.66 -0.67 115.31 125.45 1yq2 h LEU 439 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 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 0.47 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.61 1yq2 n GLY 440 N 0.42 0.67 3.00 0.83 0.00 -1.26 -4.48 105.19 104.37 1yq2 n GLY 440 Ca 0.02 -1.63 -0.13 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.18 -1.25 1.61 2.47 -0.38 -4.70 114.94 108.51 1yq2 s ASN 441 Ca 0.00 0.38 -0.22 0.00 0.42 0.00 0.00 52.86 53.44 1yq2 s ASN 441 Cb 0.00 0.30 0.02 0.00 -1.45 0.00 0.00 41.25 40.12 1yq2 s ASN 441 CO 0.00 -0.12 0.61 -0.62 -3.72 0.00 0.00 177.10 173.25 1yq2 n GLU 442 N 3.79 -1.04 -0.48 0.43 1.02 -1.26 -4.14 120.64 118.97 1yq2 n GLU 442 Ca -0.21 0.24 0.07 0.00 -0.02 0.00 0.00 57.16 57.24 1yq2 n GLU 442 Cb 0.54 -3.43 0.17 0.00 -0.02 0.00 0.00 31.44 28.71 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 -2.51 1.83 0.00 1.62 7.64 -1.26 -1.90 113.62 119.04 1yq2 n SER 443 Ca -0.15 -3.48 0.00 0.00 1.01 0.00 0.00 58.87 56.24 1yq2 n SER 443 Cb 0.60 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 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 -1.10 1.42 3.20 0.23 0.00 -1.26 -4.65 105.19 103.03 1yq2 n GLY 444 Ca 0.17 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 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 0.45 0.00 2.61 -1.32 -1.26 -4.57 115.64 111.55 1yq2 s THR 445 Ca 0.00 -1.94 0.00 0.00 -1.21 0.00 0.00 61.69 58.54 1yq2 s THR 445 Cb 0.00 -2.05 0.00 0.00 -1.51 0.00 0.00 72.50 68.94 1yq2 s THR 445 CO 0.00 -0.51 0.00 0.61 -2.21 0.00 0.00 174.62 172.51 1yq2 n GLY 446 N -0.17 1.31 0.28 6.08 0.00 -1.26 -4.43 105.19 107.00 1yq2 n GLY 446 Ca -0.07 -0.90 0.06 0.00 0.00 0.00 0.00 46.02 45.12 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 0.20 0.19 1.61 0.87 -1.87 -2.46 113.55 112.09 1yq2 h SER 447 Ca 0.00 -0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.38 1yq2 h SER 447 Cb 0.00 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 1yq2 h SER 447 CO 0.00 0.15 -0.67 0.78 -0.53 0.00 0.00 176.83 176.56 1yq2 h ASN 448 N 0.24 0.52 -0.33 6.23 2.35 -1.71 0.73 115.58 123.61 1yq2 h ASN 448 Ca 0.07 -0.32 -0.06 0.00 -0.55 0.00 0.00 56.30 55.44 1yq2 h ASN 448 Cb -0.03 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 1yq2 h ASN 448 CO -0.01 1.04 -0.05 -0.07 -1.65 0.00 0.00 177.43 176.68 1yq2 h LEU 449 N 0.32 0.61 -1.38 1.61 3.38 -1.55 -1.12 115.31 117.18 1yq2 h LEU 449 Ca -0.02 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 1yq2 h LEU 449 Cb 1.23 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 1yq2 h LEU 449 CO 0.12 0.81 0.32 0.00 0.09 0.00 0.00 178.44 179.78 1yq2 h ALA 450 N 0.82 1.53 -0.49 1.53 0.00 -1.23 -1.85 119.26 119.56 1yq2 h ALA 450 Ca 0.09 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1yq2 h ALA 450 Cb 0.53 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1yq2 h ALA 450 CO 0.03 0.40 -0.15 0.00 0.00 0.00 0.00 179.25 179.53 1yq2 h ALA 451 N 1.60 0.81 -0.63 0.00 0.00 -0.53 0.23 119.26 120.73 1yq2 h ALA 451 Ca 0.20 -0.36 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1yq2 h ALA 451 Cb -0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1yq2 h ALA 451 CO -0.04 0.66 0.38 0.52 0.00 0.00 0.00 179.25 180.77 1yq2 h MET 452 N 0.84 0.70 -0.50 0.00 2.07 -0.73 -1.00 114.93 116.32 1yq2 h MET 452 Ca 0.13 -0.04 -0.05 0.00 -2.07 0.00 0.00 59.70 57.66 1yq2 h MET 452 Cb 0.70 -0.16 -0.02 0.00 -1.87 0.00 0.00 31.60 30.25 1yq2 h MET 452 CO 0.05 0.47 0.11 0.00 1.07 0.00 0.00 176.91 178.61 1yq2 h ALA 453 N 1.29 0.66 -0.89 6.32 0.00 -1.06 -1.73 119.26 123.86 1yq2 h ALA 453 Ca 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1yq2 h ALA 453 Cb 0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1yq2 h ALA 453 CO -0.13 0.37 0.49 0.00 0.00 0.00 0.00 179.25 179.97 1yq2 h ALA 454 N 0.98 1.17 -0.10 0.00 0.00 -0.74 -0.59 119.26 119.98 1yq2 h ALA 454 Ca 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1yq2 h ALA 454 Cb 0.35 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1yq2 h ALA 454 CO 0.00 0.66 0.02 2.35 0.00 0.00 0.00 179.25 182.29 1yq2 h TRP 455 N 1.25 0.17 -0.89 0.00 7.01 -0.94 -1.43 115.95 121.12 1yq2 h TRP 455 Ca 0.31 -0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.34 1yq2 h TRP 455 Cb 0.03 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 26.99 1yq2 h TRP 455 CO 0.01 0.35 0.57 0.00 -2.79 0.00 0.00 178.44 176.58 1yq2 h ALA 456 N 0.80 1.19 -0.72 2.65 0.00 -1.05 0.14 119.26 122.27 1yq2 h ALA 456 Ca 0.03 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1yq2 h ALA 456 Cb 0.27 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1yq2 h ALA 456 CO 0.00 0.39 0.19 0.45 0.00 0.00 0.00 179.25 180.28 1yq2 h HIS 457 N 1.09 1.21 -0.26 0.00 3.86 -1.02 0.23 115.15 120.24 1yq2 h HIS 457 Ca 0.36 -0.14 -0.16 0.00 -1.16 0.00 0.00 60.37 59.28 1yq2 h HIS 457 Cb 0.06 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.18 1yq2 h HIS 457 CO -0.02 0.97 -0.48 0.00 0.86 0.00 0.00 177.93 179.26 1yq2 h ALA 458 N 1.10 0.66 0.06 2.45 0.00 -0.57 -3.33 119.26 119.63 1yq2 h ALA 458 Ca 0.23 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 1yq2 h ALA 458 Cb 0.36 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1yq2 h ALA 458 CO 0.00 0.67 -0.41 -0.09 0.00 0.00 0.00 179.25 179.42 1yq2 h ARG 459 N 0.56 0.17 -3.06 0.00 9.65 -0.51 -3.45 114.38 117.75 1yq2 h ARG 459 Ca 0.03 -0.27 -0.57 0.00 -1.10 0.00 0.00 59.98 58.07 1yq2 h ARG 459 Cb 1.03 0.10 -0.40 0.00 -1.39 0.00 0.00 29.97 29.31 1yq2 h ARG 459 CO 0.10 1.11 -0.78 0.34 2.80 0.00 0.00 179.97 183.54 1yq2 s ASP 460 N -6.59 3.63 0.00 -3.80 2.15 0.78 -4.97 116.67 107.88 1yq2 s ASP 460 Ca -0.16 -1.76 0.31 0.00 0.43 0.00 0.00 52.55 51.37 1yq2 s ASP 460 Cb -0.01 -0.64 1.81 0.00 -0.30 0.00 0.00 42.92 43.78 1yq2 s ASP 460 CO 0.76 -0.38 2.18 -1.54 -0.17 0.00 0.00 175.17 176.02 1yq2 n SER 461 N 4.65 0.00 0.08 -0.34 3.41 -1.26 -3.90 113.62 116.26 1yq2 n SER 461 Ca 0.01 -0.78 0.13 0.00 -0.26 0.00 0.00 58.87 57.96 1yq2 n SER 461 Cb 0.40 -0.07 0.36 0.00 -0.26 0.00 0.00 64.21 64.64 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 -1.07 0.69 -3.84 4.04 3.41 -1.26 -4.81 113.62 110.79 1yq2 n SER 462 Ca 0.21 0.42 -0.20 0.00 -0.26 0.00 0.00 58.87 59.05 1yq2 n SER 462 Cb 0.14 -0.49 -0.17 0.00 -0.26 0.00 0.00 64.21 63.44 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 -3.10 0.64 0.85 4.33 0.52 -1.25 -4.44 118.95 116.49 1yq2 s ARG 463 Ca 0.10 0.00 -0.10 0.00 -0.52 0.00 0.00 55.73 55.21 1yq2 s ARG 463 Cb 0.13 -0.80 0.10 0.00 0.52 0.00 0.00 34.95 34.91 1yq2 s ARG 463 CO 0.62 -0.16 1.12 -2.14 0.02 0.00 0.00 175.30 174.76 1yq2 s PRO 464 N 1.28 1.60 -0.19 3.54 0.02 -1.25 -4.67 135.00 135.32 1yq2 s PRO 464 Ca -0.06 1.33 -0.07 0.00 0.02 0.00 0.00 61.00 62.23 1yq2 s PRO 464 Cb -0.13 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 1yq2 s PRO 464 CO -0.02 -2.15 0.05 0.08 -0.33 0.00 0.00 177.00 174.62 1yq2 s VAL 465 N -2.78 4.49 -0.10 3.83 1.01 -1.26 -1.55 120.40 124.05 1yq2 s VAL 465 Ca 0.64 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.49 1yq2 s VAL 465 Cb -0.20 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 1yq2 s VAL 465 CO 0.57 0.43 -0.10 -2.28 0.00 0.00 0.00 175.10 173.73 1yq2 s HIS 466 N 0.69 2.86 -0.30 5.22 5.04 0.15 -0.71 115.29 128.25 1yq2 s HIS 466 Ca 0.02 -0.29 -0.07 0.00 -1.54 0.00 0.00 55.06 53.18 1yq2 s HIS 466 Cb -0.13 -1.78 0.17 0.00 0.04 0.00 0.00 32.58 30.88 1yq2 s HIS 466 CO 0.02 0.06 0.78 -0.47 -2.34 0.00 0.00 174.74 172.79 1yq2 s TYR 467 N -0.21 -1.16 -0.02 3.88 5.04 -1.26 -1.74 117.35 121.88 1yq2 s TYR 467 Ca 0.02 1.43 0.27 0.00 -2.44 0.00 0.00 57.07 56.35 1yq2 s TYR 467 Cb -0.13 0.48 0.92 0.00 0.35 0.00 0.00 41.96 43.59 1yq2 s TYR 467 CO 0.03 -0.62 1.82 1.49 -1.34 0.00 0.00 175.55 176.93 1yq2 h GLU 468 N 7.93 0.00 0.00 4.97 4.22 -1.84 -2.56 114.58 127.30 1yq2 h GLU 468 Ca -0.19 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.25 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 0.12 0.10 0.00 0.41 -2.18 0.00 0.00 179.01 177.46 1yq2 n GLY 469 N 0.38 -1.21 2.67 1.92 0.00 -1.26 -4.10 105.19 103.59 1yq2 n GLY 469 Ca 0.01 -0.08 -0.41 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 -1.46 4.97 -0.05 1.61 2.03 -0.97 -4.54 116.55 118.15 1yq2 n ASP 470 Ca 0.06 -2.83 0.03 0.00 0.52 0.00 0.00 54.79 52.56 1yq2 n ASP 470 Cb 0.24 -1.61 0.37 0.00 -0.72 0.00 0.00 41.12 39.39 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 5.76 0.61 -0.01 -0.67 0.99 -1.86 -1.62 116.97 120.17 1yq2 h TYR 471 Ca 0.61 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.34 1yq2 h TYR 471 Cb 0.57 -0.20 0.00 0.00 1.00 0.00 0.00 36.73 38.09 1yq2 h TYR 471 CO 1.51 0.41 -0.05 0.25 -0.00 0.00 0.00 178.16 180.28 1yq2 n THR 472 N -4.43 0.00 -3.27 -2.88 -2.24 -1.26 -4.82 114.28 95.37 1yq2 n THR 472 Ca 0.04 -0.18 -0.17 0.00 -2.27 0.00 0.00 64.05 61.47 1yq2 n THR 472 Cb 0.08 0.29 0.06 0.00 -2.10 0.00 0.00 70.33 68.66 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 1.19 -0.12 0.23 3.38 0.00 -0.61 -4.79 105.19 104.48 1yq2 n GLY 473 Ca 0.18 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.31 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 0.72 1.00 0.00 4.61 0.00 -1.93 -3.40 119.26 120.27 1yq2 h ALA 474 Ca -0.41 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1yq2 h ALA 474 Cb 1.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1yq2 h ALA 474 CO 0.40 0.20 -0.05 2.48 0.00 0.00 0.00 179.25 182.28 1yq2 n TYR 475 N -3.28 0.00 -4.31 0.00 0.18 -1.26 -5.11 117.16 103.37 1yq2 n TYR 475 Ca 0.01 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.53 1yq2 n TYR 475 Cb 0.41 0.12 -0.09 0.00 -0.38 0.00 0.00 39.34 39.41 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 3.11 -0.13 -3.48 -4.23 -1.26 -4.89 115.64 104.76 1yq2 s THR 476 Ca 0.00 -1.78 0.22 0.00 -1.18 0.00 0.00 61.69 58.95 1yq2 s THR 476 Cb 0.00 -2.57 -0.19 0.00 1.34 0.00 0.00 72.50 71.09 1yq2 s THR 476 CO 0.00 -0.17 0.73 0.47 -0.54 0.00 0.00 174.62 175.11 1yq2 n ASP 477 N -0.14 0.38 -4.38 3.99 8.00 0.12 -4.91 116.55 119.61 1yq2 n ASP 477 Ca -0.10 0.14 -0.25 0.00 0.71 0.00 0.00 54.79 55.29 1yq2 n ASP 477 Cb 0.56 1.30 -0.12 0.00 -0.02 0.00 0.00 41.12 42.85 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 -3.45 2.12 -0.23 2.53 -7.23 -1.23 -4.51 120.40 108.40 1yq2 s VAL 478 Ca -0.05 -1.90 -0.17 0.00 -1.81 0.00 0.00 61.98 58.05 1yq2 s VAL 478 Cb 0.12 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 1yq2 s VAL 478 CO 0.86 -0.13 0.48 -0.47 -0.31 0.00 0.00 175.10 175.53 1yq2 s TYR 479 N -1.62 3.31 -0.04 2.82 5.04 0.29 -4.71 117.35 122.45 1yq2 s TYR 479 Ca 0.17 0.65 0.06 0.00 -2.44 0.00 0.00 57.07 55.51 1yq2 s TYR 479 Cb -0.08 -2.66 -0.01 0.00 0.35 0.00 0.00 41.96 39.56 1yq2 s TYR 479 CO 0.08 -0.18 -0.22 0.45 -1.34 0.00 0.00 175.55 174.34 1yq2 s SER 480 N 1.35 2.61 0.16 4.32 0.15 -1.26 -1.40 113.70 119.63 1yq2 s SER 480 Ca 0.21 -0.42 0.03 0.00 0.70 0.00 0.00 55.95 56.47 1yq2 s SER 480 Cb -0.15 -0.54 -0.05 0.00 -1.71 0.00 0.00 66.02 63.57 1yq2 s SER 480 CO 0.09 0.23 -0.04 -0.13 1.20 0.00 0.00 173.24 174.59 1yq2 s ARG 481 N -0.26 1.07 -0.09 5.44 1.81 -0.79 -4.64 118.95 121.50 1yq2 s ARG 481 Ca 0.02 -1.49 0.04 0.00 -1.72 0.00 0.00 55.73 52.58 1yq2 s ARG 481 Cb -0.11 -0.40 0.00 0.00 -0.45 0.00 0.00 34.95 33.99 1yq2 s ARG 481 CO 0.01 -0.04 -0.21 0.00 -0.68 0.00 0.00 175.30 174.38 1yq2 s MET 482 N -3.84 2.66 -1.71 3.54 0.23 -1.26 -1.11 119.30 117.81 1yq2 s MET 482 Ca 0.20 -0.76 -0.00 0.00 -1.03 0.00 0.00 55.69 54.09 1yq2 s MET 482 Cb 0.05 -2.06 0.00 0.00 -1.53 0.00 0.00 34.83 31.29 1yq2 s MET 482 CO 0.02 0.16 0.00 0.66 -2.03 0.00 0.00 175.02 173.83 1yq2 n TYR 483 N 3.54 -1.06 -2.05 3.16 4.02 -0.31 -4.94 117.16 119.52 1yq2 n TYR 483 Ca -0.20 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.29 1yq2 n TYR 483 Cb 0.53 -3.85 -0.02 0.00 -0.02 0.00 0.00 39.34 35.97 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 -2.05 6.69 1.18 7.72 1.04 -1.26 -4.72 113.70 122.29 1yq2 s SER 484 Ca 0.00 2.68 -0.15 0.00 0.48 0.00 0.00 55.95 58.96 1yq2 s SER 484 Cb -0.00 -2.63 0.28 0.00 0.10 0.00 0.00 66.02 63.77 1yq2 s SER 484 CO 0.00 -0.65 1.04 -0.94 0.98 0.00 0.00 173.24 173.67 1yq2 s SER 485 N 0.07 0.97 0.11 7.02 1.04 -1.26 -4.71 113.70 116.94 1yq2 s SER 485 Ca 0.56 1.16 -0.20 0.00 0.48 0.00 0.00 55.95 57.94 1yq2 s SER 485 Cb -0.41 -1.78 -0.09 0.00 0.10 0.00 0.00 66.02 63.85 1yq2 s SER 485 CO 0.47 -4.16 1.75 0.40 0.98 0.00 0.00 173.24 172.68 1yq2 h ILE 486 N -2.60 1.06 -0.72 -1.02 1.08 -1.90 -0.81 117.51 112.61 1yq2 h ILE 486 Ca -0.55 -0.14 0.03 0.00 -0.39 0.00 0.00 64.86 63.81 1yq2 h ILE 486 Cb 1.33 0.86 -0.05 0.00 -3.07 0.00 0.00 36.82 35.90 1yq2 h ILE 486 CO 0.47 0.06 0.45 -0.65 -0.69 0.00 0.00 178.15 177.78 1yq2 h PRO 487 N 0.20 0.84 -0.38 2.37 0.11 -1.88 0.45 132.00 133.70 1yq2 h PRO 487 Ca 0.06 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.98 1yq2 h PRO 487 Cb 0.01 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 30.92 1yq2 h PRO 487 CO -0.01 0.56 -0.33 1.49 -0.21 0.00 0.00 178.00 179.50 1yq2 h GLU 488 N 0.87 0.86 -0.56 1.05 4.81 -1.60 -1.71 114.58 118.30 1yq2 h GLU 488 Ca 0.29 -0.42 -0.07 0.00 -0.13 0.00 0.00 59.36 59.04 1yq2 h GLU 488 Cb 0.04 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 1yq2 h GLU 488 CO -0.12 1.06 0.09 1.15 -0.73 0.00 0.00 179.01 180.47 1yq2 h THR 489 N 0.72 1.25 -0.68 0.32 2.02 -0.97 -0.13 112.91 115.45 1yq2 h THR 489 Ca 0.07 -0.96 0.02 0.00 0.77 0.00 0.00 66.41 66.32 1yq2 h THR 489 Cb 0.89 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 68.05 1yq2 h THR 489 CO 0.08 0.35 0.43 -0.78 0.37 0.00 0.00 175.52 175.97 1yq2 h ASP 490 N 0.82 0.71 -0.37 4.18 1.82 -0.85 -1.94 116.42 120.79 1yq2 h ASP 490 Ca 0.17 -0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.77 1yq2 h ASP 490 Cb 0.41 -0.16 -0.02 0.00 0.68 0.00 0.00 39.33 40.24 1yq2 h ASP 490 CO 0.01 0.50 0.13 -1.28 -1.61 0.00 0.00 179.24 176.99 1yq2 h SER 491 N 0.85 0.57 -0.46 2.28 0.87 -0.64 -1.91 113.55 115.12 1yq2 h SER 491 Ca 0.27 -0.08 -0.12 0.00 -1.23 0.00 0.00 61.79 60.63 1yq2 h SER 491 Cb -0.01 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.79 1yq2 h SER 491 CO -0.09 0.55 -0.20 0.40 -0.53 0.00 0.00 176.83 176.96 1yq2 h ILE 492 N 0.62 1.27 0.00 2.23 2.04 -0.66 -3.33 117.51 119.68 1yq2 h ILE 492 Ca 0.15 -1.35 -0.19 0.00 1.00 0.00 0.00 64.86 64.46 1yq2 h ILE 492 Cb 0.19 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1yq2 h ILE 492 CO -0.01 0.46 -0.95 1.23 0.00 0.00 0.00 178.15 178.88 1yq2 h GLY 493 N 0.78 0.00 -2.26 5.37 0.00 -0.91 -3.47 103.07 102.59 1yq2 h GLY 493 Ca 0.10 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.95 1yq2 h GLY 493 CO 0.06 0.00 0.22 1.09 0.00 0.00 0.00 176.54 177.91 1yq2 s ARG 494 N -2.76 3.92 0.00 4.80 1.70 -0.76 -4.65 118.95 121.20 1yq2 s ARG 494 Ca 0.01 0.73 0.23 0.00 -0.47 0.00 0.00 55.73 56.23 1yq2 s ARG 494 Cb 0.09 -2.29 0.41 0.00 -0.57 0.00 0.00 34.95 32.59 1yq2 s ARG 494 CO 0.80 -0.08 1.40 0.09 -1.08 0.00 0.00 175.30 176.43 1yq2 n ASN 495 N -1.17 3.47 -0.84 -2.89 3.02 -1.26 -4.21 115.26 111.39 1yq2 n ASN 495 Ca 0.04 -2.00 0.01 0.00 -0.03 0.00 0.00 54.58 52.61 1yq2 n ASN 495 Cb 0.54 -0.24 0.19 0.00 -0.61 0.00 0.00 39.78 39.66 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 1.50 2.19 -4.02 6.41 5.75 -1.26 -5.01 116.55 122.11 1yq2 n ASP 496 Ca 0.19 -3.88 -0.25 0.00 -0.01 0.00 0.00 54.79 50.84 1yq2 n ASP 496 Cb 0.61 -0.52 -0.17 0.00 -1.03 0.00 0.00 41.12 40.01 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 1.85 -0.18 -1.12 0.15 -1.26 -4.99 113.70 104.95 1yq2 s SER 497 Ca 0.40 -0.31 0.16 0.00 0.70 0.00 0.00 55.95 56.91 1yq2 s SER 497 Cb 0.38 -0.85 0.48 0.00 -1.71 0.00 0.00 66.02 64.32 1yq2 s SER 497 CO -0.05 0.03 1.37 1.41 1.20 0.00 0.00 173.24 177.20 1yq2 n HIS 498 N 3.88 0.77 -1.79 3.44 8.25 -1.26 -5.04 115.22 123.47 1yq2 n HIS 498 Ca -0.22 -0.97 -0.38 0.00 -0.26 0.00 0.00 57.72 55.88 1yq2 n HIS 498 Cb 0.52 -0.30 0.04 0.00 1.12 0.00 0.00 29.99 31.37 1yq2 n HIS 498 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yq2 s ALA 499 N -2.88 2.80 0.33 -1.41 0.00 -1.26 -4.96 121.76 114.39 1yq2 s ALA 499 Ca 0.40 1.32 -0.28 0.00 0.00 0.00 0.00 51.96 53.41 1yq2 s ALA 499 Cb 0.34 -3.56 -0.10 0.00 0.00 0.00 0.00 23.12 19.80 1yq2 s ALA 499 CO 0.07 -1.37 1.21 -0.51 0.00 0.00 0.00 175.76 175.15 1yq2 s LEU 500 N -3.55 4.41 0.34 0.00 1.43 -1.26 -4.93 118.68 115.11 1yq2 s LEU 500 Ca 0.72 2.47 0.07 0.00 -1.03 0.00 0.00 54.13 56.36 1yq2 s LEU 500 Cb -0.40 -3.74 -0.02 0.00 0.03 0.00 0.00 46.19 42.06 1yq2 s LEU 500 CO 0.47 -0.45 0.40 -0.76 0.23 0.00 0.00 176.35 176.24 1yq2 s LEU 501 N -1.87 3.77 0.06 1.79 1.43 -1.26 -5.03 118.68 117.57 1yq2 s LEU 501 Ca 0.50 -0.35 -0.34 0.00 -1.03 0.00 0.00 54.13 52.90 1yq2 s LEU 501 Cb -0.35 -2.49 -0.14 0.00 0.03 0.00 0.00 46.19 43.24 1yq2 s LEU 501 CO 0.45 -0.43 1.65 -0.11 0.23 0.00 0.00 176.35 178.15 1yq2 n LEU 502 N -1.54 3.03 -0.03 1.79 7.94 -1.26 -1.86 117.00 125.06 1yq2 n LEU 502 Ca -0.00 1.05 -0.00 0.00 -1.11 0.00 0.00 56.01 55.95 1yq2 n LEU 502 Cb 0.59 -1.37 -0.00 0.00 0.53 0.00 0.00 43.42 43.16 1yq2 n LEU 502 CO 0.42 -0.30 -0.00 0.61 -1.11 0.00 0.00 177.39 177.01 1yq2 n GLY 503 N 3.66 0.37 3.29 -3.96 0.00 -1.26 -4.79 105.19 102.50 1yq2 n GLY 503 Ca 0.19 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 2.03 0.19 -0.01 0.00 3.85 -1.26 -4.36 116.55 116.98 1yq2 n ASP 505 Ca -0.17 -1.32 -0.03 0.00 -0.71 0.00 0.00 54.79 52.56 1yq2 n ASP 505 Cb 0.52 -0.48 0.20 0.00 -1.35 0.00 0.00 41.12 40.01 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 -0.78 0.55 -0.38 -1.12 4.64 -1.96 -1.24 113.55 113.26 1yq2 h SER 506 Ca -0.21 -0.16 -0.15 0.00 -0.47 0.00 0.00 61.79 60.79 1yq2 h SER 506 Cb 0.61 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 1yq2 h SER 506 CO 0.16 0.74 -0.37 0.00 -0.87 0.00 0.00 176.83 176.49 1yq2 h ALA 507 N 1.31 0.55 -0.23 5.18 0.00 -1.97 -1.63 119.26 122.46 1yq2 h ALA 507 Ca 0.08 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.44 1yq2 h ALA 507 Cb 0.59 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1yq2 h ALA 507 CO 0.04 0.64 -0.31 0.93 0.00 0.00 0.00 179.25 180.55 1yq2 h GLU 508 N 0.72 0.47 -0.39 0.00 5.08 -1.86 -1.93 114.58 116.68 1yq2 h GLU 508 Ca 0.06 -0.20 -0.08 0.00 -1.00 0.00 0.00 59.36 58.14 1yq2 h GLU 508 Cb 0.96 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1yq2 h GLU 508 CO 0.09 0.73 -0.06 0.77 -1.00 0.00 0.00 179.01 179.54 1yq2 h SER 509 N 0.41 0.72 -0.73 1.42 0.02 -1.15 -2.24 113.55 112.00 1yq2 h SER 509 Ca 0.05 -0.34 0.03 0.00 -0.84 0.00 0.00 61.79 60.69 1yq2 h SER 509 Cb 0.74 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.04 1yq2 h SER 509 CO 0.06 0.90 0.46 0.00 -1.14 0.00 0.00 176.83 177.11 1yq2 h ALA 510 N 0.85 0.96 -0.06 3.77 0.00 -1.14 -2.50 119.26 121.14 1yq2 h ALA 510 Ca 0.10 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1yq2 h ALA 510 Cb 0.56 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1yq2 h ALA 510 CO 0.03 0.26 -0.54 0.07 0.00 0.00 0.00 179.25 179.07 1yq2 h ARG 511 N 0.91 0.18 -0.38 0.00 0.11 -1.22 -2.58 114.38 111.40 1yq2 h ARG 511 Ca 0.29 -0.11 -0.07 0.00 0.10 0.00 0.00 59.98 60.19 1yq2 h ARG 511 Cb 0.00 0.01 -0.02 0.00 1.11 0.00 0.00 29.97 31.08 1yq2 h ARG 511 CO -0.10 0.68 -0.05 1.96 0.10 0.00 0.00 179.97 182.55 1yq2 h GLN 512 N 0.14 0.62 0.00 0.08 1.08 -1.16 -2.09 115.11 113.78 1yq2 h GLN 512 Ca 0.00 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1yq2 h GLN 512 Cb 1.01 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.36 1yq2 h GLN 512 CO 0.08 0.68 0.00 0.54 -0.95 0.00 0.00 178.83 179.18 1yq2 n ARG 513 N -4.22 0.45 0.00 1.46 1.74 -0.96 -2.57 116.66 112.56 1yq2 n ARG 513 Ca 0.01 0.04 0.13 0.00 -0.77 0.00 0.00 57.85 57.26 1yq2 n ARG 513 Cb 0.30 -1.50 0.31 0.00 -1.02 0.00 0.00 32.46 30.55 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 -1.09 0.00 -4.25 0.55 -2.24 -0.79 -4.96 114.28 101.51 1yq2 n THR 514 Ca 0.11 -0.14 -0.23 0.00 -2.27 0.00 0.00 64.05 61.52 1yq2 n THR 514 Cb 0.08 0.53 -0.07 0.00 -2.10 0.00 0.00 70.33 68.77 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 -2.52 2.40 0.43 -0.78 1.02 -1.06 -3.20 119.74 116.03 1yq2 s LYS 515 Ca 0.23 -1.38 -0.26 0.00 0.02 0.00 0.00 55.97 54.58 1yq2 s LYS 515 Cb 0.19 -2.22 -0.09 0.00 -0.52 0.00 0.00 37.83 35.19 1yq2 s LYS 515 CO 0.54 0.35 1.41 -2.14 -0.92 0.00 0.00 175.35 174.59 1yq2 s PRO 516 N -3.72 3.83 -0.09 -1.68 0.02 -1.22 -4.69 135.00 127.45 1yq2 s PRO 516 Ca 0.32 2.40 -0.01 0.00 0.02 0.00 0.00 61.00 63.73 1yq2 s PRO 516 Cb -0.06 -2.74 -0.03 0.00 0.02 0.00 0.00 34.50 31.68 1yq2 s PRO 516 CO 0.21 -0.69 -0.04 0.12 -0.33 0.00 0.00 177.00 176.27 1yq2 s PHE 517 N -1.19 3.04 0.03 6.54 5.36 -0.15 -0.55 117.98 131.06 1yq2 s PHE 517 Ca 0.58 0.04 0.01 0.00 -0.96 0.00 0.00 56.93 56.61 1yq2 s PHE 517 Cb -0.43 -1.78 -0.02 0.00 -0.34 0.00 0.00 43.02 40.45 1yq2 s PHE 517 CO 0.56 0.33 -0.05 0.96 -1.46 0.00 0.00 175.22 175.56 1yq2 s ILE 518 N -0.65 0.34 -0.46 3.12 -4.36 -0.49 -0.36 121.20 118.34 1yq2 s ILE 518 Ca 0.10 -0.90 -0.22 0.00 -0.26 0.00 0.00 60.65 59.37 1yq2 s ILE 518 Cb -0.12 -0.43 0.03 0.00 1.25 0.00 0.00 42.46 43.19 1yq2 s ILE 518 CO 0.02 -0.37 0.73 -0.76 0.24 0.00 0.00 174.94 174.80 1yq2 s LEU 519 N -1.36 4.41 0.48 0.37 1.43 -0.68 -1.88 118.68 121.45 1yq2 s LEU 519 Ca -0.11 -0.31 0.28 0.00 -1.03 0.00 0.00 54.13 52.95 1yq2 s LEU 519 Cb -0.09 -2.80 0.85 0.00 0.03 0.00 0.00 46.19 44.18 1yq2 s LEU 519 CO -0.00 -0.89 1.79 0.00 0.23 0.00 0.00 176.35 177.48 1yq2 s GLU 521 N -3.45 0.14 0.31 0.00 2.02 -1.24 -4.43 118.70 112.05 1yq2 s GLU 521 Ca 0.04 0.39 -0.16 0.00 0.02 0.00 0.00 54.97 55.25 1yq2 s GLU 521 Cb 0.07 -0.11 0.02 0.00 0.10 0.00 0.00 34.13 34.21 1yq2 s GLU 521 CO 0.61 -0.14 0.66 1.52 0.02 0.00 0.00 175.26 177.94 1yq2 s TYR 522 N 0.99 0.12 -1.20 1.61 -0.00 -0.71 -1.17 117.35 117.00 1yq2 s TYR 522 Ca -0.07 -0.60 -0.31 0.00 -0.00 0.00 0.00 57.07 56.09 1yq2 s TYR 522 Cb -0.09 0.56 0.04 0.00 -0.00 0.00 0.00 41.96 42.47 1yq2 s TYR 522 CO -0.06 -1.27 0.58 1.33 -0.00 0.00 0.00 175.55 176.14 1yq2 n VAL 523 N -0.47 -2.32 -1.72 -3.49 0.24 -1.26 -1.79 118.33 107.51 1yq2 n VAL 523 Ca -0.04 -0.55 -0.65 0.00 -2.04 0.00 0.00 64.34 61.05 1yq2 n VAL 523 Cb 0.60 -1.99 -0.09 0.00 -1.47 0.00 0.00 33.84 30.89 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 -4.88 1.81 0.76 6.34 -0.00 -1.26 -4.43 115.22 113.56 1yq2 n HIS 524 Ca -0.13 0.97 0.11 0.00 0.46 0.00 0.00 57.72 59.14 1yq2 n HIS 524 Cb 0.55 -2.29 0.27 0.00 -0.12 0.00 0.00 29.99 28.40 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 4.56 2.47 -1.65 1.57 0.00 0.44 -4.36 120.51 123.53 1yq2 n ALA 525 Ca 0.31 -0.77 -0.48 0.00 0.00 0.00 0.00 53.44 52.50 1yq2 n ALA 525 Cb -0.01 -0.96 -0.05 0.00 0.00 0.00 0.00 19.45 18.43 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 1.00 1.84 0.00 0.00 0.00 -1.25 -4.56 117.12 114.15 1yq2 n MET 526 Ca 0.18 0.67 0.00 0.00 0.00 0.00 0.00 57.70 58.54 1yq2 n MET 526 Cb 0.49 -2.41 0.00 0.00 0.00 0.00 0.00 33.22 31.31 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 3.30 2.17 3.60 -5.12 0.00 -1.26 -4.47 105.19 103.40 1yq2 n GLY 527 Ca 0.18 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 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 6.68 0.00 1.61 3.84 -1.26 -4.83 114.94 116.98 1yq2 s ASN 528 Ca 0.00 0.56 0.00 0.00 0.21 0.00 0.00 52.86 53.63 1yq2 s ASN 528 Cb 0.00 -2.49 0.00 0.00 -0.55 0.00 0.00 41.25 38.21 1yq2 s ASN 528 CO 0.00 -0.96 0.00 0.61 -2.79 0.00 0.00 177.10 173.96 1yq2 n GLY 529 N 4.47 0.09 3.93 1.21 0.00 -1.26 -4.76 105.19 108.87 1yq2 n GLY 529 Ca 0.08 -1.73 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.68 3.52 0.81 1.61 0.04 -1.26 -4.43 135.00 133.61 1yq2 s PRO 530 Ca 0.00 -0.33 -0.10 0.00 0.04 0.00 0.00 61.00 60.61 1yq2 s PRO 530 Cb 0.00 -2.79 0.12 0.00 0.04 0.00 0.00 34.50 31.87 1yq2 s PRO 530 CO 0.00 0.34 1.15 0.20 0.04 0.00 0.00 177.00 178.72 1yq2 s GLY 531 N -3.37 1.70 0.00 0.56 0.00 -0.32 -4.62 107.32 101.27 1yq2 s GLY 531 Ca 0.39 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 44.06 1yq2 s GLY 531 CO 0.30 -0.49 0.00 0.00 0.00 0.00 0.00 173.10 172.91 1yq2 n ALA 532 N -3.27 0.00 -0.23 3.20 0.00 -1.26 -4.70 120.51 114.24 1yq2 n ALA 532 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.64 1yq2 n ALA 532 Cb 0.60 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.41 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 2.93 0.71 -0.44 0.00 2.86 -1.88 -0.38 114.93 118.74 1yq2 h MET 533 Ca 0.00 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 1yq2 h MET 533 Cb 0.00 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.48 1yq2 h MET 533 CO 0.00 0.47 -0.06 0.38 1.06 0.00 0.00 176.91 178.76 1yq2 h ASP 534 N 0.74 0.73 -0.49 1.22 2.03 -1.92 -1.89 116.42 116.83 1yq2 h ASP 534 Ca 0.39 -0.19 -0.05 0.00 -0.73 0.00 0.00 57.03 56.44 1yq2 h ASP 534 Cb 0.50 -0.19 -0.02 0.00 -0.83 0.00 0.00 39.33 38.78 1yq2 h ASP 534 CO -0.16 0.83 0.11 1.56 -1.03 0.00 0.00 179.24 180.56 1yq2 h GLN 535 N 0.69 0.80 -0.63 4.15 4.20 -1.51 -1.16 115.11 121.65 1yq2 h GLN 535 Ca 0.13 -0.20 -0.06 0.00 0.06 0.00 0.00 58.65 58.58 1yq2 h GLN 535 Cb 0.51 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 1yq2 h GLN 535 CO 0.03 0.78 0.17 1.88 -0.67 0.00 0.00 178.83 181.02 1yq2 h TYR 536 N 0.68 1.05 -0.32 2.96 -1.99 -1.23 -2.54 116.97 115.58 1yq2 h TYR 536 Ca 0.15 -0.12 -0.07 0.00 2.00 0.00 0.00 58.73 60.69 1yq2 h TYR 536 Cb 0.35 -0.30 -0.02 0.00 2.00 0.00 0.00 36.73 38.77 1yq2 h TYR 536 CO 0.02 0.87 -0.10 1.49 -0.00 0.00 0.00 178.16 180.44 1yq2 h GLU 537 N 0.93 0.53 -0.16 4.88 4.57 -1.22 -2.39 114.58 121.73 1yq2 h GLU 537 Ca 0.20 -0.15 -0.07 0.00 -1.18 0.00 0.00 59.36 58.16 1yq2 h GLU 537 Cb 0.33 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 1yq2 h GLU 537 CO -0.00 0.64 -0.21 0.00 -1.18 0.00 0.00 179.01 178.26 1yq2 h ALA 538 N 1.40 1.36 -0.53 2.92 0.00 -0.97 -1.39 119.26 122.05 1yq2 h ALA 538 Ca 0.09 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1yq2 h ALA 538 Cb 0.48 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1yq2 h ALA 538 CO 0.03 0.44 0.03 -0.07 0.00 0.00 0.00 179.25 179.67 1yq2 h LEU 539 N 0.25 0.89 -0.86 0.00 3.38 -1.03 -2.35 115.31 115.60 1yq2 h LEU 539 Ca 0.04 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 1yq2 h LEU 539 Cb 0.51 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1yq2 h LEU 539 CO 0.03 0.96 0.25 0.58 0.09 0.00 0.00 178.44 180.36 1yq2 h VAL 540 N 0.79 1.25 -0.57 1.22 2.07 -1.04 -0.74 116.25 119.23 1yq2 h VAL 540 Ca 0.15 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.84 1yq2 h VAL 540 Cb 0.49 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1yq2 h VAL 540 CO 0.02 0.33 0.38 0.44 0.02 0.00 0.00 177.57 178.76 1yq2 h ASP 541 N 1.06 0.64 0.40 0.57 3.32 -1.15 -3.28 116.42 117.97 1yq2 h ASP 541 Ca 0.24 -0.01 -0.31 0.00 0.02 0.00 0.00 57.03 56.96 1yq2 h ASP 541 Cb 0.26 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1yq2 h ASP 541 CO -0.01 0.46 -1.75 0.50 -1.72 0.00 0.00 179.24 176.72 1yq2 h LYS 542 N 0.75 0.11 -4.17 3.56 3.64 -0.77 -3.46 116.57 116.23 1yq2 h LYS 542 Ca 0.21 -0.18 -0.59 0.00 -1.27 0.00 0.00 60.65 58.82 1yq2 h LYS 542 Cb -0.06 0.07 -0.39 0.00 -0.41 0.00 0.00 32.23 31.45 1yq2 h LYS 542 CO -0.05 0.79 -0.78 0.71 -2.27 0.00 0.00 179.45 177.85 1yq2 s TYR 543 N -2.59 2.10 0.48 1.91 4.12 -0.37 -5.01 117.35 117.98 1yq2 s TYR 543 Ca -0.10 -1.57 0.23 0.00 0.02 0.00 0.00 57.07 55.65 1yq2 s TYR 543 Cb 0.07 -1.47 1.26 0.00 -1.52 0.00 0.00 41.96 40.31 1yq2 s TYR 543 CO 0.81 -0.74 1.90 -1.35 0.02 0.00 0.00 175.55 176.19 1yq2 h PRO 544 N 8.02 0.20 0.00 -1.71 0.11 -1.87 -2.12 132.00 134.62 1yq2 h PRO 544 Ca -0.17 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.90 1yq2 h PRO 544 Cb 1.08 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1yq2 h PRO 544 CO 0.40 0.13 -0.12 -0.09 -0.21 0.00 0.00 178.00 178.11 1yq2 h ARG 545 N 0.21 0.00 -5.59 1.05 2.43 -1.83 -3.42 114.38 107.23 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 1.25 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 30.70 1yq2 h ARG 545 CO -0.08 0.12 0.23 -0.51 -1.51 0.00 0.00 179.97 178.22 1yq2 s LEU 546 N -7.53 4.07 -0.12 3.80 1.43 -0.80 -0.98 118.68 118.55 1yq2 s LEU 546 Ca -0.03 0.80 0.15 0.00 -1.03 0.00 0.00 54.13 54.02 1yq2 s LEU 546 Cb 0.14 -2.94 0.52 0.00 0.03 0.00 0.00 46.19 43.93 1yq2 s LEU 546 CO 0.60 -0.40 1.43 1.41 0.23 0.00 0.00 176.35 179.62 1yq2 n HIS 547 N 5.71 0.97 -0.23 0.29 8.25 0.51 -4.78 115.22 125.94 1yq2 n HIS 547 Ca 0.01 -0.72 0.00 0.00 -0.26 0.00 0.00 57.72 56.75 1yq2 n HIS 547 Cb 0.49 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 31.36 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 0.12 0.31 0.00 -1.41 0.00 -1.26 -0.39 105.19 102.55 1yq2 n GLY 548 Ca 0.20 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1yq2 n GLY 548 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 549 N 0.00 -1.19 3.01 -0.02 0.00 -0.40 -1.69 105.19 104.90 1yq2 n GLY 549 Ca 0.00 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 1yq2 n GLY 549 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yq2 s PHE 550 N -2.36 2.41 0.33 1.61 0.40 -0.38 -0.78 117.98 119.21 1yq2 s PHE 550 Ca 0.00 -1.52 -0.29 0.00 -0.60 0.00 0.00 56.93 54.52 1yq2 s PHE 550 Cb 0.00 -1.66 -0.11 0.00 0.51 0.00 0.00 43.02 41.77 1yq2 s PHE 550 CO 0.00 -0.73 1.48 0.08 0.70 0.00 0.00 175.22 176.74 1yq2 s VAL 551 N 1.40 2.25 -0.39 -0.44 1.01 0.42 -1.73 120.40 122.92 1yq2 s VAL 551 Ca 0.01 0.24 -0.14 0.00 0.00 0.00 0.00 61.98 62.08 1yq2 s VAL 551 Cb -0.15 -3.15 0.01 0.00 0.00 0.00 0.00 36.38 33.08 1yq2 s VAL 551 CO -0.09 0.05 0.29 0.86 0.00 0.00 0.00 175.10 176.21 1yq2 s TRP 552 N -0.68 3.23 0.31 5.22 -0.11 -0.74 -1.10 118.94 125.07 1yq2 s TRP 552 Ca 0.56 -0.45 0.05 0.00 1.22 0.00 0.00 56.10 57.48 1yq2 s TRP 552 Cb -0.45 -2.57 -0.02 0.00 -1.50 0.00 0.00 33.47 28.93 1yq2 s TRP 552 CO 0.55 -0.52 0.31 -0.85 -4.62 0.00 0.00 176.95 171.82 1yq2 n GLU 553 N 5.17 0.45 0.08 5.86 0.28 -0.81 -0.42 120.64 131.24 1yq2 n GLU 553 Ca -0.11 -2.93 -0.13 0.00 -0.16 0.00 0.00 57.16 53.83 1yq2 n GLU 553 Cb 0.48 2.51 -0.08 0.00 1.43 0.00 0.00 31.44 35.77 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 1.97 -0.16 -4.07 -1.84 2.91 -1.36 -1.11 115.95 112.29 1yq2 h TRP 554 Ca -0.22 -0.00 -0.46 0.00 1.13 0.00 0.00 58.89 59.33 1yq2 h TRP 554 Cb 1.10 0.05 -0.25 0.00 -0.51 0.00 0.00 29.16 29.55 1yq2 h TRP 554 CO 0.00 0.11 -0.80 1.03 -1.03 0.00 0.00 178.44 177.75 1yq2 s ARG 555 N -5.09 1.01 0.33 2.65 0.52 -1.26 -0.88 118.95 116.23 1yq2 s ARG 555 Ca -0.15 -0.75 -0.29 0.00 -0.52 0.00 0.00 55.73 54.02 1yq2 s ARG 555 Cb 0.03 -1.02 -0.10 0.00 0.52 0.00 0.00 34.95 34.37 1yq2 s ARG 555 CO 0.63 0.26 1.38 -0.51 0.02 0.00 0.00 175.30 177.08 1yq2 s ASP 556 N -1.06 6.63 -0.91 0.23 1.11 -0.48 -4.08 116.67 118.11 1yq2 s ASP 556 Ca 0.03 2.79 -0.00 0.00 0.18 0.00 0.00 52.55 55.54 1yq2 s ASP 556 Cb -0.08 -2.65 0.33 0.00 1.07 0.00 0.00 42.92 41.60 1yq2 s ASP 556 CO 0.01 -0.66 1.72 1.41 1.18 0.00 0.00 175.17 178.83 1yq2 n HIS 557 N 0.99 3.01 -2.46 4.23 8.25 -0.67 -4.37 115.22 124.20 1yq2 n HIS 557 Ca 0.01 -2.73 -0.36 0.00 -0.26 0.00 0.00 57.72 54.38 1yq2 n HIS 557 Cb 0.41 -1.05 -0.03 0.00 1.12 0.00 0.00 29.99 30.43 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 -1.67 2.71 -0.24 -1.41 0.00 -1.26 -4.90 107.32 100.55 1yq2 s GLY 558 Ca 0.43 0.75 -0.06 0.00 0.00 0.00 0.00 44.72 45.85 1yq2 s GLY 558 CO -0.19 1.17 0.02 -0.42 0.00 0.00 0.00 173.10 173.67 1yq2 s ILE 559 N -1.68 3.80 0.07 0.90 1.01 -0.73 -4.02 121.20 120.55 1yq2 s ILE 559 Ca 0.61 -0.39 -0.31 0.00 0.00 0.00 0.00 60.65 60.56 1yq2 s ILE 559 Cb -0.23 -2.78 -0.07 0.00 0.01 0.00 0.00 42.46 39.39 1yq2 s ILE 559 CO 0.28 0.35 1.37 -0.60 0.00 0.00 0.00 174.94 176.34 1yq2 s ARG 560 N 1.53 4.32 0.24 2.79 3.52 -0.71 -0.16 118.95 130.49 1yq2 s ARG 560 Ca 0.06 2.00 -0.05 0.00 -0.13 0.00 0.00 55.73 57.61 1yq2 s ARG 560 Cb -0.15 -3.36 0.02 0.00 -1.56 0.00 0.00 34.95 29.90 1yq2 s ARG 560 CO 0.00 -0.45 0.41 -2.37 -0.81 0.00 0.00 175.30 172.08 1yq2 n THR 561 N 4.16 0.00 -4.27 4.11 5.66 -0.34 -4.93 114.28 118.67 1yq2 n THR 561 Ca 0.12 -0.93 -0.19 0.00 -3.05 0.00 0.00 64.05 59.99 1yq2 n THR 561 Cb 0.43 0.69 -0.13 0.00 -1.55 0.00 0.00 70.33 69.77 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 -2.31 0.89 0.85 1.09 0.52 -1.26 -0.94 118.95 117.79 1yq2 s ARG 562 Ca 0.15 -0.86 -0.11 0.00 -0.52 0.00 0.00 55.73 54.39 1yq2 s ARG 562 Cb -0.02 -0.91 0.10 0.00 0.52 0.00 0.00 34.95 34.64 1yq2 s ARG 562 CO 0.11 0.21 1.10 0.95 0.02 0.00 0.00 175.30 177.69 1yq2 s THR 563 N -1.05 2.89 0.54 0.02 -4.23 0.99 -4.85 115.64 109.94 1yq2 s THR 563 Ca 0.00 0.29 0.33 0.00 -1.18 0.00 0.00 61.69 61.13 1yq2 s THR 563 Cb -0.09 -2.71 0.51 0.00 1.34 0.00 0.00 72.50 71.55 1yq2 s THR 563 CO 0.02 -0.38 1.86 0.00 -0.54 0.00 0.00 174.62 175.58 1yq2 h ALA 564 N -1.43 2.93 -0.12 3.99 0.00 -2.01 0.45 119.26 123.08 1yq2 h ALA 564 Ca -0.46 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1yq2 h ALA 564 Cb 1.26 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1yq2 h ALA 564 CO 0.51 -1.23 0.00 0.39 0.00 0.00 0.00 179.25 178.93 1yq2 n GLU 565 N -4.22 1.56 -0.73 0.00 4.71 -1.26 -4.94 120.64 115.77 1yq2 n GLU 565 Ca 0.21 -0.84 0.00 0.00 -0.01 0.00 0.00 57.16 56.52 1yq2 n GLU 565 Cb 1.06 -1.38 0.00 0.00 -1.01 0.00 0.00 31.44 30.11 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 1.06 0.58 3.69 0.62 0.00 0.16 -5.05 105.19 106.25 1yq2 n GLY 566 Ca 0.16 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.07 4.40 0.25 1.61 0.00 -1.25 -4.74 119.30 118.49 1yq2 s MET 567 Ca 0.00 1.23 -0.26 0.00 0.00 0.00 0.00 55.69 56.66 1yq2 s MET 567 Cb 0.00 -3.54 -0.09 0.00 0.00 0.00 0.00 34.83 31.20 1yq2 s MET 567 CO 0.00 -0.26 0.88 -2.00 0.00 0.00 0.00 175.02 173.64 1yq2 s GLU 568 N 1.86 4.62 0.19 4.11 2.12 -1.26 -0.01 118.70 130.33 1yq2 s GLU 568 Ca 0.45 1.28 -0.21 0.00 0.36 0.00 0.00 54.97 56.85 1yq2 s GLU 568 Cb -0.18 -3.05 0.05 0.00 0.26 0.00 0.00 34.13 31.21 1yq2 s GLU 568 CO 0.17 0.43 0.58 -0.59 -0.54 0.00 0.00 175.26 175.31 1yq2 s PHE 569 N -1.37 -0.35 -0.49 5.30 -0.12 -0.12 -4.95 117.98 115.88 1yq2 s PHE 569 Ca 0.43 0.05 -0.22 0.00 -0.05 0.00 0.00 56.93 57.14 1yq2 s PHE 569 Cb -0.22 0.52 0.04 0.00 -0.63 0.00 0.00 43.02 42.73 1yq2 s PHE 569 CO 0.26 -0.92 0.77 -0.06 -0.05 0.00 0.00 175.22 175.22 1yq2 s PHE 570 N -3.81 2.96 0.44 3.49 2.99 -1.26 -1.20 117.98 121.58 1yq2 s PHE 570 Ca 0.05 -0.08 -0.22 0.00 0.00 0.00 0.00 56.93 56.67 1yq2 s PHE 570 Cb -0.02 -3.70 -0.09 0.00 0.00 0.00 0.00 43.02 39.22 1yq2 s PHE 570 CO -0.07 -1.08 1.05 0.00 -0.00 0.00 0.00 175.22 175.12 1yq2 s ALA 571 N 3.26 2.98 0.15 5.36 0.00 0.77 -4.70 121.76 129.58 1yq2 s ALA 571 Ca 0.25 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.90 1yq2 s ALA 571 Cb -0.14 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 19.70 1yq2 s ALA 571 CO 0.19 -0.29 0.03 2.48 0.00 0.00 0.00 175.76 178.17 1yq2 n TYR 572 N -0.51 0.16 -1.61 0.00 0.18 -1.26 -1.77 117.16 112.35 1yq2 n TYR 572 Ca 0.07 -0.88 -0.57 0.00 1.88 0.00 0.00 57.90 58.40 1yq2 n TYR 572 Cb 0.51 -0.04 -0.07 0.00 -0.38 0.00 0.00 39.34 39.36 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 1.81 0.31 0.51 -7.48 0.00 -0.32 -1.69 105.19 98.33 1yq2 n GLY 573 Ca -0.04 0.81 0.00 0.00 0.00 0.00 0.00 46.02 46.79 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 2.80 2.33 0.00 -0.02 0.00 -1.26 -3.63 105.19 105.40 1yq2 n GLY 574 Ca 0.22 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.35 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 0.00 -1.03 1.61 8.00 -0.68 -2.99 116.55 121.46 1yq2 n ASP 575 Ca 0.00 0.36 -0.01 0.00 0.71 0.00 0.00 54.79 55.86 1yq2 n ASP 575 Cb 0.00 -0.45 0.21 0.00 -0.02 0.00 0.00 41.12 40.86 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 -1.45 0.94 -1.74 1.24 0.99 -1.26 -4.96 117.46 111.23 1yq2 n PHE 576 Ca 0.07 -1.44 -0.12 0.00 -0.00 0.00 0.00 57.45 55.96 1yq2 n PHE 576 Cb 0.24 -0.43 -0.03 0.00 -1.00 0.00 0.00 39.48 38.26 1yq2 n PHE 576 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yq2 n GLY 577 N -1.03 0.69 3.77 1.37 0.00 -1.16 -4.94 105.19 103.89 1yq2 n GLY 577 Ca 0.29 -0.42 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 1yq2 n GLY 577 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yq2 s GLU 578 N -3.72 3.73 0.03 1.61 8.01 -1.26 -4.94 118.70 122.16 1yq2 s GLU 578 Ca 0.00 2.47 -0.28 0.00 0.01 0.00 0.00 54.97 57.17 1yq2 s GLU 578 Cb 0.00 -2.70 -0.17 0.00 -4.31 0.00 0.00 34.13 26.95 1yq2 s GLU 578 CO 0.00 -0.80 1.33 0.28 0.01 0.00 0.00 175.26 176.08 1yq2 h VAL 579 N 2.40 0.36 -4.47 2.63 2.07 -1.98 -3.44 116.25 113.82 1yq2 h VAL 579 Ca -0.51 -0.30 -0.70 0.00 0.82 0.00 0.00 66.70 66.02 1yq2 h VAL 579 Cb 1.26 0.46 -0.28 0.00 -1.52 0.00 0.00 31.29 31.21 1yq2 h VAL 579 CO 0.61 0.04 -0.88 0.68 0.02 0.00 0.00 177.57 178.04 1yq2 s VAL 580 N -5.15 2.12 0.17 2.57 -7.23 -1.26 -5.13 120.40 106.49 1yq2 s VAL 580 Ca -0.15 -1.21 -0.24 0.00 -1.81 0.00 0.00 61.98 58.57 1yq2 s VAL 580 Cb 0.02 -1.77 0.06 0.00 0.56 0.00 0.00 36.38 35.25 1yq2 s VAL 580 CO 0.53 0.49 0.80 -1.38 -0.31 0.00 0.00 175.10 175.24 1yq2 s HIS 581 N -0.69 -0.27 -0.22 2.82 -0.00 -1.26 -4.78 115.29 110.89 1yq2 s HIS 581 Ca 0.11 -0.03 0.11 0.00 -0.00 0.00 0.00 55.06 55.24 1yq2 s HIS 581 Cb -0.10 0.63 0.43 0.00 -0.00 0.00 0.00 32.58 33.53 1yq2 s HIS 581 CO 0.00 -0.91 1.22 -0.25 -0.00 0.00 0.00 174.74 174.80 1yq2 n ASP 582 N -0.41 2.14 0.00 7.38 8.00 -1.02 -4.94 116.55 127.70 1yq2 n ASP 582 Ca -0.08 -3.88 0.00 0.00 0.71 0.00 0.00 54.79 51.54 1yq2 n ASP 582 Cb 0.61 -0.50 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.06 0.00 -0.95 -2.24 2.88 -1.24 -2.17 113.62 108.84 1yq2 n SER 583 Ca 0.22 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.80 1yq2 n SER 583 Cb 0.73 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 64.36 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 3.46 2.68 0.17 -3.46 6.94 -1.26 -1.17 115.26 122.62 1yq2 n ASN 584 Ca 0.00 -2.27 0.13 0.00 -0.02 0.00 0.00 54.58 52.41 1yq2 n ASN 584 Cb 0.00 -0.45 0.58 0.00 -2.36 0.00 0.00 39.78 37.55 1yq2 n ASN 584 CO 0.00 0.00 0.00 -0.26 -1.03 0.00 0.00 177.26 175.97 1yq2 h PHE 585 N 1.89 0.00 0.00 -2.53 -1.00 -1.84 -0.59 116.94 112.87 1yq2 h PHE 585 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1yq2 h PHE 585 Cb 0.91 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.47 1yq2 h PHE 585 CO 0.40 0.00 0.00 1.55 -1.61 0.00 0.00 178.31 178.65 1yq2 n VAL 586 N -2.35 0.16 -2.97 -0.55 3.14 -1.26 -4.19 118.33 110.31 1yq2 n VAL 586 Ca 0.00 0.04 -0.40 0.00 -2.96 0.00 0.00 64.34 61.02 1yq2 n VAL 586 Cb 0.15 -0.59 0.00 0.00 -1.06 0.00 0.00 33.84 32.34 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 -1.44 4.44 -1.83 1.45 2.81 -0.23 -1.67 117.12 120.66 1yq2 n MET 587 Ca 0.08 -4.60 -0.05 0.00 -1.81 0.00 0.00 57.70 51.31 1yq2 n MET 587 Cb 0.28 -2.47 0.07 0.00 -0.71 0.00 0.00 33.22 30.40 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 0.93 2.54 -4.95 7.83 5.68 -1.26 -4.12 116.55 123.20 1yq2 n ASP 588 Ca 0.31 -2.98 -0.24 0.00 -0.50 0.00 0.00 54.79 51.38 1yq2 n ASP 588 Cb 0.33 -0.41 -0.02 0.00 -1.14 0.00 0.00 41.12 39.87 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 -3.27 1.48 0.48 6.12 0.00 -1.26 -1.93 107.32 108.94 1yq2 s GLY 589 Ca 0.38 -1.05 0.28 0.00 0.00 0.00 0.00 44.72 44.33 1yq2 s GLY 589 CO -0.05 -1.03 1.84 -0.33 0.00 0.00 0.00 173.10 173.53 1yq2 h MET 590 N 1.53 0.00 -6.02 2.90 2.86 -0.45 -3.43 114.93 112.31 1yq2 h MET 590 Ca -0.50 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.45 1yq2 h MET 590 Cb 1.21 0.00 -0.29 0.00 0.06 0.00 0.00 31.60 32.58 1yq2 h MET 590 CO 0.64 0.09 -0.85 0.08 1.06 0.00 0.00 176.91 177.94 1yq2 s VAL 591 N -3.54 2.38 0.94 -2.22 1.01 -0.05 -1.48 120.40 117.44 1yq2 s VAL 591 Ca 0.02 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 60.92 1yq2 s VAL 591 Cb 0.08 -1.90 0.16 0.00 0.00 0.00 0.00 36.38 34.73 1yq2 s VAL 591 CO 0.61 0.57 1.15 -0.76 0.00 0.00 0.00 175.10 176.67 1yq2 s LEU 592 N -0.23 1.96 0.50 3.92 1.43 0.35 -1.39 118.68 125.23 1yq2 s LEU 592 Ca -0.01 0.86 0.19 0.00 -1.03 0.00 0.00 54.13 54.14 1yq2 s LEU 592 Cb -0.13 -3.10 1.28 0.00 0.03 0.00 0.00 46.19 44.27 1yq2 s LEU 592 CO 0.03 -2.71 2.09 0.28 0.23 0.00 0.00 176.35 176.27 1yq2 h SER 593 N -1.61 0.00 -0.40 2.29 0.02 -1.89 -0.74 113.55 111.22 1yq2 h SER 593 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1yq2 h SER 593 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 1yq2 h SER 593 CO 0.57 0.09 0.00 -0.90 -1.14 0.00 0.00 176.83 175.45 1yq2 n ASP 594 N -4.21 3.15 -0.00 3.07 3.85 -1.26 -4.76 116.55 116.40 1yq2 n ASP 594 Ca -0.03 -2.29 -0.00 0.00 -0.71 0.00 0.00 54.79 51.77 1yq2 n ASP 594 Cb 0.17 -0.46 -0.00 0.00 -1.35 0.00 0.00 41.12 39.48 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 0.59 -3.01 -4.68 -1.12 7.64 -0.28 -5.03 113.62 107.73 1yq2 n SER 595 Ca 0.16 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.61 1yq2 n SER 595 Cb 0.61 -0.51 -0.03 0.00 -1.01 0.00 0.00 64.21 63.27 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 -2.00 4.47 0.24 0.44 2.01 -1.26 -4.76 115.64 114.79 1yq2 s THR 596 Ca 0.00 1.77 -0.30 0.00 0.31 0.00 0.00 61.69 63.47 1yq2 s THR 596 Cb 0.00 -4.14 -0.10 0.00 0.01 0.00 0.00 72.50 68.27 1yq2 s THR 596 CO 0.00 -0.02 1.41 -2.84 -0.69 0.00 0.00 174.62 172.48 1yq2 s PRO 597 N 2.32 4.29 0.58 4.92 0.02 -1.26 -0.50 135.00 145.38 1yq2 s PRO 597 Ca 0.52 2.26 -0.07 0.00 0.02 0.00 0.00 61.00 63.73 1yq2 s PRO 597 Cb -0.21 -3.12 -0.00 0.00 0.02 0.00 0.00 34.50 31.18 1yq2 s PRO 597 CO 0.19 -0.38 0.90 0.95 -0.33 0.00 0.00 177.00 178.33 1yq2 s THR 598 N -0.03 3.94 0.54 0.99 -4.23 -0.55 -4.92 115.64 111.37 1yq2 s THR 598 Ca 0.58 0.13 0.26 0.00 -1.18 0.00 0.00 61.69 61.49 1yq2 s THR 598 Cb -0.41 -3.56 0.39 0.00 1.34 0.00 0.00 72.50 70.27 1yq2 s THR 598 CO 0.43 -0.59 2.00 -0.65 -0.54 0.00 0.00 174.62 175.26 1yq2 h PRO 599 N -0.15 0.00 -0.12 3.99 0.11 -1.95 -0.93 132.00 132.96 1yq2 h PRO 599 Ca -0.46 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.60 1yq2 h PRO 599 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1yq2 h PRO 599 CO 0.61 0.00 -0.16 0.78 -0.21 0.00 0.00 178.00 179.02 1yq2 h GLY 600 N 0.00 0.20 1.34 -0.55 0.00 -1.89 -1.73 103.07 100.43 1yq2 h GLY 600 Ca 0.24 -0.12 -0.20 0.00 0.00 0.00 0.00 47.33 47.25 1yq2 h GLY 600 CO -0.00 0.12 -0.70 -2.00 0.00 0.00 0.00 176.54 173.96 1yq2 h LEU 601 N 0.17 0.77 -1.00 3.11 5.85 -1.38 -0.66 115.31 122.18 1yq2 h LEU 601 Ca 0.03 -0.48 -0.05 0.00 0.84 0.00 0.00 57.88 58.23 1yq2 h LEU 601 Cb 0.40 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 1yq2 h LEU 601 CO 0.03 1.25 0.17 1.88 -0.34 0.00 0.00 178.44 181.42 1yq2 h TYR 602 N 0.47 0.91 -0.20 1.25 -1.99 -1.38 -0.69 116.97 115.33 1yq2 h TYR 602 Ca -0.03 -0.08 -0.01 0.00 2.00 0.00 0.00 58.73 60.62 1yq2 h TYR 602 Cb 1.29 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 39.75 1yq2 h TYR 602 CO 0.07 0.74 0.10 1.49 -0.00 0.00 0.00 178.16 180.56 1yq2 h GLU 603 N 0.86 0.29 -0.14 4.88 4.57 -1.16 -2.36 114.58 121.52 1yq2 h GLU 603 Ca 0.19 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.37 1yq2 h GLU 603 Cb 0.27 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.76 1yq2 h GLU 603 CO -0.01 0.31 -0.16 0.35 -1.18 0.00 0.00 179.01 178.32 1yq2 h PHE 604 N 0.20 -0.42 -0.30 0.92 3.57 -0.84 -1.80 116.94 118.28 1yq2 h PHE 604 Ca 0.07 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.66 1yq2 h PHE 604 Cb 0.11 0.21 -0.07 0.00 2.79 0.00 0.00 35.95 38.99 1yq2 h PHE 604 CO -0.03 -0.24 -0.15 -0.22 -2.23 0.00 0.00 178.31 175.45 1yq2 h LYS 605 N -0.20 -0.10 -0.34 1.11 3.64 -0.95 0.04 116.57 119.77 1yq2 h LYS 605 Ca 0.10 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1yq2 h LYS 605 Cb 0.34 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1yq2 h LYS 605 CO -0.26 -0.07 0.19 0.37 -2.27 0.00 0.00 179.45 177.41 1yq2 h GLN 606 N -0.11 0.48 -0.47 1.90 5.75 -1.28 -2.19 115.11 119.18 1yq2 h GLN 606 Ca 0.16 -0.06 -0.07 0.00 -0.15 0.00 0.00 58.65 58.53 1yq2 h GLN 606 Cb 0.35 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 1yq2 h GLN 606 CO -0.37 0.40 -0.01 0.82 -2.65 0.00 0.00 178.83 177.02 1yq2 h ILE 607 N 0.43 1.24 -0.58 2.39 2.04 -0.69 -3.01 117.51 119.33 1yq2 h ILE 607 Ca 0.12 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.96 1yq2 h ILE 607 Cb 0.06 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1yq2 h ILE 607 CO -0.02 0.36 0.00 1.33 0.00 0.00 0.00 178.15 179.82 1yq2 n VAL 608 N -4.21 1.37 -1.66 1.67 0.24 -0.06 -4.99 118.33 110.70 1yq2 n VAL 608 Ca 0.02 -0.97 -0.46 0.00 -2.04 0.00 0.00 64.34 60.90 1yq2 n VAL 608 Cb 0.31 0.17 -0.03 0.00 -1.47 0.00 0.00 33.84 32.81 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 1.07 2.74 0.27 -1.34 2.88 -0.84 -4.86 113.62 113.54 1yq2 n SER 609 Ca 0.22 1.12 0.18 0.00 -1.33 0.00 0.00 58.87 59.05 1yq2 n SER 609 Cb 0.72 -1.40 0.73 0.00 -0.75 0.00 0.00 64.21 63.51 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 4.82 0.00 -4.60 -1.46 0.13 -1.90 -3.38 132.00 125.61 1yq2 h PRO 610 Ca -0.45 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.00 1yq2 h PRO 610 Cb 1.27 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 32.05 1yq2 h PRO 610 CO 0.80 0.00 -0.63 0.42 -0.23 0.00 0.00 178.00 178.36 1yq2 s ILE 611 N -3.70 2.90 -0.18 -3.56 -1.09 -1.26 -0.72 121.20 113.59 1yq2 s ILE 611 Ca 0.01 -2.02 -0.20 0.00 -2.23 0.00 0.00 60.65 56.21 1yq2 s ILE 611 Cb 0.09 -2.97 -0.03 0.00 -1.58 0.00 0.00 42.46 37.97 1yq2 s ILE 611 CO 0.51 -0.55 0.57 -0.60 -1.23 0.00 0.00 174.94 173.64 1yq2 s ARG 612 N 1.09 4.23 -0.04 2.79 6.06 -0.28 -4.85 118.95 127.94 1yq2 s ARG 612 Ca 0.06 0.52 0.04 0.00 -2.50 0.00 0.00 55.73 53.86 1yq2 s ARG 612 Cb -0.21 -3.55 -0.02 0.00 0.06 0.00 0.00 34.95 31.22 1yq2 s ARG 612 CO -0.05 -0.14 -0.16 -0.51 -2.50 0.00 0.00 175.30 171.94 1yq2 s LEU 613 N 1.60 2.61 0.02 -0.88 1.43 -1.26 -0.91 118.68 121.29 1yq2 s LEU 613 Ca 0.27 -0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.15 1yq2 s LEU 613 Cb -0.16 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 1yq2 s LEU 613 CO 0.10 0.34 -0.09 -0.83 0.23 0.00 0.00 176.35 176.10 1yq2 s GLY 614 N -0.73 0.51 -0.02 -3.19 0.00 -0.38 -4.84 107.32 98.67 1yq2 s GLY 614 Ca 0.11 -0.57 0.06 0.00 0.00 0.00 0.00 44.72 44.32 1yq2 s GLY 614 CO 0.00 -0.56 -0.21 1.08 0.00 0.00 0.00 173.10 173.42 1yq2 s LEU 615 N -0.84 2.03 0.18 0.66 1.43 -1.26 -0.68 118.68 120.20 1yq2 s LEU 615 Ca -0.01 -0.38 -0.09 0.00 -1.03 0.00 0.00 54.13 52.62 1yq2 s LEU 615 Cb -0.06 -1.07 -0.01 0.00 0.03 0.00 0.00 46.19 45.08 1yq2 s LEU 615 CO 0.00 0.25 0.29 -0.94 0.23 0.00 0.00 176.35 176.18 1yq2 s SER 616 N -0.44 0.04 -0.36 2.29 1.04 -0.39 -4.97 113.70 110.92 1yq2 s SER 616 Ca 0.07 -0.92 0.01 0.00 0.48 0.00 0.00 55.95 55.59 1yq2 s SER 616 Cb -0.08 0.45 0.11 0.00 0.10 0.00 0.00 66.02 66.59 1yq2 s SER 616 CO -0.00 -0.91 0.13 -0.22 0.98 0.00 0.00 173.24 173.21 1yq2 s LEU 617 N -2.99 2.94 0.31 2.42 2.96 -1.26 0.27 118.68 123.33 1yq2 s LEU 617 Ca 0.19 -2.05 -0.29 0.00 -0.22 0.00 0.00 54.13 51.76 1yq2 s LEU 617 Cb 0.03 -1.09 -0.10 0.00 0.50 0.00 0.00 46.19 45.53 1yq2 s LEU 617 CO 0.02 -0.36 1.30 -2.16 -1.32 0.00 0.00 176.35 173.83 1yq2 s PRO 618 N 1.08 4.37 -0.30 0.98 0.04 -1.26 -4.88 135.00 135.03 1yq2 s PRO 618 Ca 0.12 2.18 -0.44 0.00 0.04 0.00 0.00 61.00 62.91 1yq2 s PRO 618 Cb -0.20 -3.09 -0.20 0.00 0.04 0.00 0.00 34.50 31.05 1yq2 s PRO 618 CO -0.14 -0.19 1.41 0.00 0.04 0.00 0.00 177.00 178.12 1yq2 n ALA 619 N 1.11 -2.13 0.00 8.56 0.00 -1.26 0.38 120.51 127.17 1yq2 n ALA 619 Ca 0.01 0.53 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1yq2 n ALA 619 Cb 0.42 -1.88 0.00 0.00 0.00 0.00 0.00 19.45 17.99 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 3.08 1.08 0.12 0.00 0.00 -1.26 -4.96 105.19 103.25 1yq2 n GLY 620 Ca 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.28 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 -1.87 -1.21 3.93 -0.02 0.00 0.16 -5.11 105.19 101.07 1yq2 n GLY 621 Ca 0.00 -1.66 -0.21 0.00 0.00 0.00 0.00 46.02 44.15 1yq2 n GLY 621 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 s LYS 622 N -3.09 3.18 0.13 1.61 1.02 -1.26 -4.78 119.74 116.54 1yq2 s LYS 622 Ca 0.02 -0.94 -0.34 0.00 0.02 0.00 0.00 55.97 54.73 1yq2 s LYS 622 Cb -0.00 -2.76 -0.14 0.00 -0.52 0.00 0.00 37.83 34.41 1yq2 s LYS 622 CO 0.02 0.31 1.58 -2.30 -0.92 0.00 0.00 175.35 174.03 1yq2 n PRO 623 N -1.40 2.03 -4.31 -1.68 -0.02 -1.26 -4.35 135.00 124.00 1yq2 n PRO 623 Ca -0.06 0.73 -0.34 0.00 -2.02 0.00 0.00 63.50 61.81 1yq2 n PRO 623 Cb 0.58 -2.50 -0.14 0.00 -0.02 0.00 0.00 33.50 31.42 1yq2 n PRO 623 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1yq2 s THR 624 N 1.16 3.27 -0.27 3.45 2.01 0.14 -0.68 115.64 124.72 1yq2 s THR 624 Ca 0.81 -0.56 -0.11 0.00 0.31 0.00 0.00 61.69 62.14 1yq2 s THR 624 Cb -0.71 -2.43 -0.05 0.00 0.01 0.00 0.00 72.50 69.31 1yq2 s THR 624 CO 0.40 0.48 0.18 -0.22 -0.69 0.00 0.00 174.62 174.77 1yq2 s LEU 625 N 0.89 4.04 -0.09 4.42 2.96 -0.01 -1.26 118.68 129.63 1yq2 s LEU 625 Ca -0.02 0.01 -0.14 0.00 -0.22 0.00 0.00 54.13 53.76 1yq2 s LEU 625 Cb -0.15 -2.12 -0.05 0.00 0.50 0.00 0.00 46.19 44.38 1yq2 s LEU 625 CO 0.01 -0.03 0.35 0.00 -1.32 0.00 0.00 176.35 175.36 1yq2 s ALA 626 N 1.62 3.65 -0.05 5.97 0.00 0.14 -0.53 121.76 132.56 1yq2 s ALA 626 Ca 0.07 -0.34 0.01 0.00 0.00 0.00 0.00 51.96 51.70 1yq2 s ALA 626 Cb -0.16 -2.38 0.02 0.00 0.00 0.00 0.00 23.12 20.60 1yq2 s ALA 626 CO 0.10 0.29 -0.05 0.08 0.00 0.00 0.00 175.76 176.18 1yq2 s VAL 627 N -0.29 0.58 -0.09 0.00 1.01 0.02 -1.25 120.40 120.38 1yq2 s VAL 627 Ca 0.21 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.07 1yq2 s VAL 627 Cb -0.15 -0.61 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1yq2 s VAL 627 CO 0.09 0.24 -0.15 0.00 0.00 0.00 0.00 175.10 175.27 1yq2 s ALA 628 N 1.00 1.61 -0.62 5.51 0.00 -0.09 -1.13 121.76 128.04 1yq2 s ALA 628 Ca -0.10 -0.66 -0.24 0.00 0.00 0.00 0.00 51.96 50.97 1yq2 s ALA 628 Cb -0.14 -0.74 0.05 0.00 0.00 0.00 0.00 23.12 22.29 1yq2 s ALA 628 CO -0.00 0.03 0.99 1.21 0.00 0.00 0.00 175.76 177.99 1yq2 s ASN 629 N 0.81 6.24 -0.04 0.00 3.84 -0.50 -1.12 114.94 124.16 1yq2 s ASN 629 Ca -0.11 -0.64 0.14 0.00 0.21 0.00 0.00 52.86 52.46 1yq2 s ASN 629 Cb -0.16 -2.44 0.49 0.00 -0.55 0.00 0.00 41.25 38.59 1yq2 s ASN 629 CO 0.02 -1.40 1.38 0.18 -2.79 0.00 0.00 177.10 174.49 1yq2 n LEU 630 N 7.81 3.18 -4.67 3.21 4.77 0.10 0.06 117.00 131.44 1yq2 n LEU 630 Ca -0.01 -1.60 -0.30 0.00 -0.03 0.00 0.00 56.01 54.08 1yq2 n LEU 630 Cb 0.47 -0.42 0.16 0.00 -2.33 0.00 0.00 43.42 41.29 1yq2 n LEU 630 CO 0.65 0.65 0.65 -0.13 -1.33 0.00 0.00 177.39 177.88 1yq2 s ARG 631 N -1.55 0.98 -0.08 3.23 0.52 -1.24 -4.85 118.95 115.96 1yq2 s ARG 631 Ca 0.36 1.08 -0.23 0.00 -0.52 0.00 0.00 55.73 56.42 1yq2 s ARG 631 Cb 0.21 -1.76 -0.29 0.00 0.52 0.00 0.00 34.95 33.63 1yq2 s ARG 631 CO 0.20 -2.51 0.80 1.25 0.02 0.00 0.00 175.30 175.07 1yq2 h HIS 632 N -1.75 0.38 0.00 -0.53 -0.00 -1.93 -3.36 115.15 107.96 1yq2 h HIS 632 Ca -0.49 -0.27 0.00 0.00 -0.00 0.00 0.00 60.37 59.61 1yq2 h HIS 632 Cb 1.28 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.67 1yq2 h HIS 632 CO 0.44 1.26 -0.46 0.25 -0.00 0.00 0.00 177.93 179.42 1yq2 n THR 633 N -4.24 0.00 -2.55 6.26 -2.24 -1.26 -4.94 114.28 105.32 1yq2 n THR 633 Ca -0.15 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 1yq2 n THR 633 Cb 0.74 -0.26 -0.04 0.00 -2.10 0.00 0.00 70.33 68.67 1yq2 n THR 633 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yq2 s ALA 634 N -1.46 3.37 1.03 6.98 0.00 -1.26 -4.41 121.76 126.00 1yq2 s ALA 634 Ca 0.00 0.79 -0.16 0.00 0.00 0.00 0.00 51.96 52.59 1yq2 s ALA 634 Cb 0.00 -3.32 0.21 0.00 0.00 0.00 0.00 23.12 20.01 1yq2 s ALA 634 CO 0.00 -0.14 1.19 0.16 0.00 0.00 0.00 175.76 176.97 1yq2 s ASP 635 N -0.39 2.49 -0.28 0.00 1.47 -1.26 -3.94 116.67 114.75 1yq2 s ASP 635 Ca 0.47 0.62 0.06 0.00 1.18 0.00 0.00 52.55 54.88 1yq2 s ASP 635 Cb -0.29 -0.91 0.55 0.00 -0.34 0.00 0.00 42.92 41.92 1yq2 s ASP 635 CO 0.35 -3.15 1.60 0.00 0.68 0.00 0.00 175.17 174.65 1yq2 n ALA 636 N -4.11 4.35 0.25 2.11 0.00 0.49 -4.45 120.51 119.15 1yq2 n ALA 636 Ca 0.12 -1.90 0.13 0.00 0.00 0.00 0.00 53.44 51.78 1yq2 n ALA 636 Cb 0.59 -1.25 0.58 0.00 0.00 0.00 0.00 19.45 19.38 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 1.59 0.00 0.49 0.00 4.64 -1.85 -2.42 113.55 116.01 1yq2 h SER 637 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1yq2 h SER 637 Cb 2.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.20 1yq2 h SER 637 CO 0.66 0.15 0.00 -0.90 -0.87 0.00 0.00 176.83 175.87 1yq2 n ASP 638 N -3.35 0.00 -4.50 4.97 5.75 -1.26 -4.86 116.55 113.29 1yq2 n ASP 638 Ca -0.00 -0.20 -0.33 0.00 -0.01 0.00 0.00 54.79 54.25 1yq2 n ASP 638 Cb 0.35 -0.26 -0.13 0.00 -1.03 0.00 0.00 41.12 40.06 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 -2.52 3.28 0.06 2.12 1.01 -0.91 -1.00 120.40 122.43 1yq2 s VAL 639 Ca 0.29 -0.64 0.08 0.00 0.00 0.00 0.00 61.98 61.72 1yq2 s VAL 639 Cb 0.19 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1yq2 s VAL 639 CO 0.43 0.59 -0.23 0.54 0.00 0.00 0.00 175.10 176.43 1yq2 s VAL 640 N -0.67 1.88 -0.39 2.92 0.11 0.56 -4.26 120.40 120.55 1yq2 s VAL 640 Ca 0.10 -1.34 -0.11 0.00 -2.93 0.00 0.00 61.98 57.70 1yq2 s VAL 640 Cb -0.11 -1.63 0.04 0.00 -1.53 0.00 0.00 36.38 33.14 1yq2 s VAL 640 CO 0.01 0.23 0.24 -0.76 -3.33 0.00 0.00 175.10 171.49 1yq2 s LEU 641 N -1.33 4.89 -0.20 2.54 1.43 -0.22 -0.76 118.68 125.03 1yq2 s LEU 641 Ca 0.09 -1.08 -0.08 0.00 -1.03 0.00 0.00 54.13 52.04 1yq2 s LEU 641 Cb -0.09 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 1yq2 s LEU 641 CO 0.02 -0.43 0.08 -0.13 0.23 0.00 0.00 176.35 176.12 1yq2 s ARG 642 N 1.56 3.94 0.16 1.70 0.52 -0.13 -0.39 118.95 126.31 1yq2 s ARG 642 Ca 0.02 -0.35 0.09 0.00 -0.52 0.00 0.00 55.73 54.98 1yq2 s ARG 642 Cb -0.20 -3.29 -0.04 0.00 0.52 0.00 0.00 34.95 31.94 1yq2 s ARG 642 CO 0.06 0.16 -0.15 1.67 0.02 0.00 0.00 175.30 177.06 1yq2 s TRP 643 N 0.69 2.53 -0.09 -0.53 1.48 0.03 -0.47 118.94 122.58 1yq2 s TRP 643 Ca 0.04 -0.26 -0.14 0.00 -1.06 0.00 0.00 56.10 54.67 1yq2 s TRP 643 Cb -0.13 -1.27 0.03 0.00 -1.16 0.00 0.00 33.47 30.94 1yq2 s TRP 643 CO 0.02 0.47 0.36 -0.98 -4.06 0.00 0.00 176.95 172.76 1yq2 s ARG 644 N -2.60 0.55 -0.11 3.25 1.70 -0.08 -1.56 118.95 120.10 1yq2 s ARG 644 Ca 0.22 0.25 -0.01 0.00 -0.47 0.00 0.00 55.73 55.72 1yq2 s ARG 644 Cb -0.09 0.26 -0.03 0.00 -0.57 0.00 0.00 34.95 34.52 1yq2 s ARG 644 CO 0.12 -0.11 -0.07 0.08 -1.08 0.00 0.00 175.30 174.25 1yq2 s VAL 645 N -0.41 3.68 -0.05 4.99 1.01 0.00 -0.79 120.40 128.84 1yq2 s VAL 645 Ca -0.05 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.53 1yq2 s VAL 645 Cb -0.03 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 1yq2 s VAL 645 CO 0.02 0.55 -0.24 -1.61 0.00 0.00 0.00 175.10 173.82 1yq2 s GLU 646 N -0.16 2.30 -0.27 2.72 2.02 -0.26 -0.19 118.70 124.86 1yq2 s GLU 646 Ca 0.02 -0.85 -0.08 0.00 0.02 0.00 0.00 54.97 54.07 1yq2 s GLU 646 Cb -0.13 -2.01 -0.02 0.00 0.10 0.00 0.00 34.13 32.07 1yq2 s GLU 646 CO 0.03 0.39 0.11 -1.58 0.02 0.00 0.00 175.26 174.23 1yq2 s HIS 647 N -0.23 3.13 -1.48 1.61 5.65 -0.07 -1.44 115.29 122.46 1yq2 s HIS 647 Ca -0.01 -0.43 -0.01 0.00 0.25 0.00 0.00 55.06 54.86 1yq2 s HIS 647 Cb -0.12 -2.29 0.01 0.00 -1.18 0.00 0.00 32.58 29.00 1yq2 s HIS 647 CO 0.02 -0.37 0.04 -0.25 -0.65 0.00 0.00 174.74 173.53 1yq2 n ASP 648 N 4.96 0.73 0.00 9.88 10.43 0.27 -1.45 116.55 141.36 1yq2 n ASP 648 Ca -0.15 -1.21 0.00 0.00 2.57 0.00 0.00 54.79 56.00 1yq2 n ASP 648 Cb 0.51 -1.50 0.00 0.00 1.84 0.00 0.00 41.12 41.96 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 -2.40 3.00 3.69 0.44 0.00 -1.26 -4.80 105.19 103.85 1yq2 n GLY 649 Ca -0.28 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.13 3.57 0.09 4.61 0.00 -0.53 -4.67 121.76 122.70 1yq2 s ALA 650 Ca 0.00 -0.51 -0.31 0.00 0.00 0.00 0.00 51.96 51.14 1yq2 s ALA 650 Cb 0.00 -2.51 -0.10 0.00 0.00 0.00 0.00 23.12 20.52 1yq2 s ALA 650 CO 0.00 -0.12 1.82 0.08 0.00 0.00 0.00 175.76 177.55 1yq2 s VAL 651 N 0.91 2.74 -0.21 0.00 1.01 -1.26 -0.89 120.40 122.71 1yq2 s VAL 651 Ca 0.17 0.14 0.11 0.00 0.00 0.00 0.00 61.98 62.40 1yq2 s VAL 651 Cb -0.14 -3.09 -0.21 0.00 0.00 0.00 0.00 36.38 32.95 1yq2 s VAL 651 CO 0.06 -0.00 -0.04 0.00 0.00 0.00 0.00 175.10 175.11 1yq2 n ALA 652 N 6.08 1.51 -3.49 5.51 0.00 0.73 -4.90 120.51 125.95 1yq2 n ALA 652 Ca 0.18 -1.17 -0.15 0.00 0.00 0.00 0.00 53.44 52.29 1yq2 n ALA 652 Cb 0.39 -0.12 -0.05 0.00 0.00 0.00 0.00 19.45 19.68 1yq2 n ALA 652 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yq2 s ALA 653 N -2.47 -1.73 0.15 0.00 0.00 -1.17 -5.01 121.76 111.52 1yq2 s ALA 653 Ca -0.18 1.08 -0.16 0.00 0.00 0.00 0.00 51.96 52.69 1yq2 s ALA 653 Cb 0.07 0.24 0.03 0.00 0.00 0.00 0.00 23.12 23.46 1yq2 s ALA 653 CO 0.70 -0.50 0.44 -1.54 0.00 0.00 0.00 175.76 174.85 1yq2 s SER 654 N -1.69 -0.25 0.12 0.00 1.04 -1.26 -0.82 113.70 110.85 1yq2 s SER 654 Ca -0.06 -0.37 -0.25 0.00 0.48 0.00 0.00 55.95 55.75 1yq2 s SER 654 Cb -0.00 0.50 0.08 0.00 0.10 0.00 0.00 66.02 66.70 1yq2 s SER 654 CO 0.02 -0.91 1.09 -0.83 0.98 0.00 0.00 173.24 173.59 1yq2 s GLY 655 N -2.83 -0.07 0.06 7.32 0.00 -0.60 -4.99 107.32 106.21 1yq2 s GLY 655 Ca 0.05 -0.04 0.04 0.00 0.00 0.00 0.00 44.72 44.77 1yq2 s GLY 655 CO -0.09 1.96 -0.12 -0.54 0.00 0.00 0.00 173.10 174.31 1yq2 s GLU 656 N -2.44 0.71 -0.01 2.90 2.02 -1.26 -0.79 118.70 119.83 1yq2 s GLU 656 Ca 0.20 -0.88 -0.01 0.00 0.02 0.00 0.00 54.97 54.29 1yq2 s GLU 656 Cb -0.01 -0.63 0.01 0.00 0.10 0.00 0.00 34.13 33.59 1yq2 s GLU 656 CO 0.03 0.13 0.03 0.08 0.02 0.00 0.00 175.26 175.55 1yq2 s VAL 657 N -1.31 -0.01 0.43 2.63 1.01 0.48 -4.99 120.40 118.64 1yq2 s VAL 657 Ca -0.05 0.03 -0.22 0.00 0.00 0.00 0.00 61.98 61.74 1yq2 s VAL 657 Cb -0.10 -0.06 -0.09 0.00 0.00 0.00 0.00 36.38 36.13 1yq2 s VAL 657 CO 0.02 0.01 1.01 0.00 0.00 0.00 0.00 175.10 176.13 1yq2 s ALA 658 N 0.15 3.01 -0.86 5.51 0.00 -1.26 -1.05 121.76 127.25 1yq2 s ALA 658 Ca -0.01 0.56 -0.22 0.00 0.00 0.00 0.00 51.96 52.29 1yq2 s ALA 658 Cb -0.02 -3.22 0.08 0.00 0.00 0.00 0.00 23.12 19.97 1yq2 s ALA 658 CO -0.00 -0.11 1.18 0.00 0.00 0.00 0.00 175.76 176.83 1yq2 s ALA 659 N -1.92 3.07 0.04 0.00 0.00 -1.26 -4.89 121.76 116.80 1yq2 s ALA 659 Ca 0.62 -2.25 0.07 0.00 0.00 0.00 0.00 51.96 50.39 1yq2 s ALA 659 Cb -0.16 -4.15 -0.03 0.00 0.00 0.00 0.00 23.12 18.78 1yq2 s ALA 659 CO 0.20 -3.12 -0.19 -1.21 0.00 0.00 0.00 175.76 171.44 1yq2 s GLU 660 N 3.95 2.05 0.00 0.00 0.41 -1.26 -1.60 118.70 122.25 1yq2 s GLU 660 Ca 0.34 -0.99 0.00 0.00 -0.41 0.00 0.00 54.97 53.91 1yq2 s GLU 660 Cb -0.07 -2.17 0.00 0.00 -1.78 0.00 0.00 34.13 30.11 1yq2 s GLU 660 CO -0.02 0.54 0.00 0.41 -0.49 0.00 0.00 175.26 175.70 1yq2 n GLY 661 N 1.60 3.67 0.25 -1.39 0.00 0.99 -4.57 105.19 105.74 1yq2 n GLY 661 Ca -0.16 -1.87 0.14 0.00 0.00 0.00 0.00 46.02 44.13 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 -2.07 1.61 4.64 -1.90 -3.38 113.55 112.45 1yq2 h SER 662 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1yq2 h SER 662 Cb 0.00 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 61.75 1yq2 h SER 662 CO 0.00 0.09 -0.91 -0.67 -0.87 0.00 0.00 176.83 174.48 1yq2 n ASP 663 N -3.21 -0.95 0.00 4.97 -0.08 -1.26 -5.11 116.55 110.91 1yq2 n ASP 663 Ca 0.01 -2.50 0.00 0.00 -1.51 0.00 0.00 54.79 50.78 1yq2 n ASP 663 Cb 0.38 -0.15 0.00 0.00 2.34 0.00 0.00 41.12 43.69 1yq2 n ASP 663 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yq2 n GLY 664 N 2.71 -0.46 3.57 0.27 0.00 -1.26 -4.91 105.19 105.10 1yq2 n GLY 664 Ca 0.27 -1.10 -0.45 0.00 0.00 0.00 0.00 46.02 44.74 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 1.20 -1.64 1.61 -0.02 -1.26 -0.01 135.00 134.88 1yq2 n PRO 665 Ca 0.00 0.42 -0.44 0.00 -2.02 0.00 0.00 63.50 61.46 1yq2 n PRO 665 Cb 0.00 -1.75 -0.04 0.00 -0.02 0.00 0.00 33.50 31.69 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 1.32 3.70 -4.84 2.45 0.00 -0.63 -4.25 117.00 114.75 1yq2 n LEU 666 Ca 0.11 0.74 -0.31 0.00 0.00 0.00 0.00 56.01 56.54 1yq2 n LEU 666 Cb 0.31 -1.48 0.01 0.00 0.00 0.00 0.00 43.42 42.25 1yq2 n LEU 666 CO 0.60 -0.10 0.71 -0.13 0.00 0.00 0.00 177.39 178.46 1yq2 s ARG 667 N 4.90 3.50 0.04 1.96 0.52 -1.26 -0.38 118.95 128.24 1yq2 s ARG 667 Ca 0.94 0.90 -0.33 0.00 -0.52 0.00 0.00 55.73 56.72 1yq2 s ARG 667 Cb -0.49 -2.07 -0.12 0.00 0.52 0.00 0.00 34.95 32.79 1yq2 s ARG 667 CO 0.43 -0.65 1.81 0.00 0.02 0.00 0.00 175.30 176.92 1yq2 n ALA 668 N -2.46 1.45 -0.43 2.13 0.00 -1.25 -0.88 120.51 119.07 1yq2 n ALA 668 Ca 0.07 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1yq2 n ALA 668 Cb 0.54 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 17.47 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 4.14 0.83 3.90 0.00 0.00 0.11 -4.98 105.19 109.19 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 -0.52 3.40 0.14 1.61 2.12 -0.06 -4.93 118.70 120.47 1yq2 s GLU 670 Ca 0.00 -0.36 0.11 0.00 0.36 0.00 0.00 54.97 55.08 1yq2 s GLU 670 Cb 0.00 -3.06 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 1yq2 s GLU 670 CO 0.00 0.66 -0.26 -1.12 -0.54 0.00 0.00 175.26 174.00 1yq2 s SER 671 N -2.04 3.26 0.08 -1.70 0.01 -1.26 -1.42 113.70 110.64 1yq2 s SER 671 Ca 0.28 -0.77 -0.11 0.00 1.31 0.00 0.00 55.95 56.66 1yq2 s SER 671 Cb -0.13 -0.22 0.01 0.00 0.21 0.00 0.00 66.02 65.89 1yq2 s SER 671 CO 0.20 0.15 0.24 0.00 0.41 0.00 0.00 173.24 174.24 1yq2 s ALA 672 N -1.22 -0.42 0.10 1.44 0.00 -0.28 -4.90 121.76 116.48 1yq2 s ALA 672 Ca 0.15 -0.40 0.09 0.00 0.00 0.00 0.00 51.96 51.79 1yq2 s ALA 672 Cb -0.09 0.48 -0.03 0.00 0.00 0.00 0.00 23.12 23.47 1yq2 s ALA 672 CO 0.07 -0.50 -0.22 0.95 0.00 0.00 0.00 175.76 176.05 1yq2 s THR 673 N -3.54 1.80 -0.04 0.00 -4.23 -1.26 -0.80 115.64 107.57 1yq2 s THR 673 Ca 0.02 -1.54 -0.01 0.00 -1.18 0.00 0.00 61.69 58.98 1yq2 s THR 673 Cb 0.03 -1.62 0.03 0.00 1.34 0.00 0.00 72.50 72.28 1yq2 s THR 673 CO -0.09 -0.00 0.08 -0.51 -0.54 0.00 0.00 174.62 173.55 1yq2 s ILE 674 N -1.10 -0.05 -0.07 2.99 -1.16 0.31 -4.98 121.20 117.14 1yq2 s ILE 674 Ca 0.08 0.20 -0.30 0.00 -0.51 0.00 0.00 60.65 60.12 1yq2 s ILE 674 Cb -0.10 -0.15 -0.02 0.00 0.61 0.00 0.00 42.46 42.80 1yq2 s ILE 674 CO 0.04 0.08 1.07 0.00 -2.81 0.00 0.00 174.94 173.32 1yq2 s ALA 675 N 1.09 3.39 0.62 1.50 0.00 -1.26 -0.83 121.76 126.27 1yq2 s ALA 675 Ca -0.09 0.50 -0.03 0.00 0.00 0.00 0.00 51.96 52.34 1yq2 s ALA 675 Cb -0.12 -3.44 0.04 0.00 0.00 0.00 0.00 23.12 19.60 1yq2 s ALA 675 CO -0.04 -0.58 0.89 -0.51 0.00 0.00 0.00 175.76 175.52 1yq2 s LEU 676 N 1.85 3.07 0.96 0.00 1.43 0.14 -4.98 118.68 121.16 1yq2 s LEU 676 Ca 0.52 0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 53.75 1yq2 s LEU 676 Cb -0.21 -3.03 0.08 0.00 0.03 0.00 0.00 46.19 43.07 1yq2 s LEU 676 CO 0.21 -1.34 0.62 -2.65 0.23 0.00 0.00 176.35 173.42 1yq2 n PRO 677 N -2.62 -0.52 -2.10 1.29 -0.02 -1.26 -4.39 135.00 125.38 1yq2 n PRO 677 Ca 0.08 -0.11 -0.41 0.00 -2.02 0.00 0.00 63.50 61.04 1yq2 n PRO 677 Cb 0.60 -2.01 -0.02 0.00 -0.02 0.00 0.00 33.50 32.05 1yq2 n PRO 677 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 s ALA 678 N -2.46 3.52 -0.46 3.55 0.00 -1.26 -4.33 121.76 120.32 1yq2 s ALA 678 Ca 0.60 1.27 0.03 0.00 0.00 0.00 0.00 51.96 53.86 1yq2 s ALA 678 Cb -0.21 -3.49 0.15 0.00 0.00 0.00 0.00 23.12 19.57 1yq2 s ALA 678 CO 0.65 -0.66 0.31 -1.64 0.00 0.00 0.00 175.76 174.42 1yq2 s MET 679 N -1.52 1.26 0.47 0.00 -1.94 -1.26 -5.06 119.30 111.24 1yq2 s MET 679 Ca 0.51 -2.17 -0.22 0.00 -1.71 0.00 0.00 55.69 52.09 1yq2 s MET 679 Cb -0.40 -2.07 -0.07 0.00 2.01 0.00 0.00 34.83 34.29 1yq2 s MET 679 CO 0.51 -1.26 1.16 -1.25 -0.01 0.00 0.00 175.02 174.17 1yq2 s PRO 680 N 0.05 3.72 0.39 2.03 0.04 -1.26 -4.95 135.00 135.02 1yq2 s PRO 680 Ca 0.24 1.75 -0.27 0.00 0.04 0.00 0.00 61.00 62.76 1yq2 s PRO 680 Cb -0.12 -2.36 -0.09 0.00 0.04 0.00 0.00 34.50 31.97 1yq2 s PRO 680 CO -0.09 -0.58 1.32 0.00 0.04 0.00 0.00 177.00 177.69 1yq2 s ALA 681 N -1.58 3.34 0.39 8.56 0.00 -1.26 -4.99 121.76 126.23 1yq2 s ALA 681 Ca 0.65 1.27 -0.27 0.00 0.00 0.00 0.00 51.96 53.61 1yq2 s ALA 681 Cb -0.28 -3.50 -0.10 0.00 0.00 0.00 0.00 23.12 19.24 1yq2 s ALA 681 CO 0.34 -0.81 1.44 0.00 0.00 0.00 0.00 175.76 176.73 1yq2 s ALA 682 N -1.22 3.46 0.36 0.00 0.00 -1.26 -4.90 121.76 118.20 1yq2 s ALA 682 Ca 0.55 1.50 0.09 0.00 0.00 0.00 0.00 51.96 54.09 1yq2 s ALA 682 Cb -0.39 -3.59 0.67 0.00 0.00 0.00 0.00 23.12 19.82 1yq2 s ALA 682 CO 0.51 -1.04 1.84 -1.35 0.00 0.00 0.00 175.76 175.72 1yq2 h PRO 683 N 2.84 0.22 -6.61 0.00 0.11 -2.00 -3.37 132.00 123.18 1yq2 h PRO 683 Ca -0.51 -0.07 -0.69 0.00 0.11 0.00 0.00 66.00 64.85 1yq2 h PRO 683 Cb 1.25 -0.02 -0.22 0.00 0.11 0.00 0.00 31.00 32.11 1yq2 h PRO 683 CO 0.63 0.45 -0.81 -0.51 -0.21 0.00 0.00 178.00 177.55 1yq2 s LEU 684 N -8.57 2.58 0.00 2.35 1.43 -1.26 -4.86 118.68 110.35 1yq2 s LEU 684 Ca -0.05 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.59 1yq2 s LEU 684 Cb 0.15 -1.50 0.00 0.00 0.03 0.00 0.00 46.19 44.87 1yq2 s LEU 684 CO 0.74 0.24 0.00 0.61 0.23 0.00 0.00 176.35 178.18 1yq2 n GLY 685 N 1.46 -1.70 3.65 -3.19 0.00 -1.26 -4.91 105.19 99.23 1yq2 n GLY 685 Ca -0.16 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.07 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 2.56 -0.14 1.61 2.02 -1.26 -4.34 118.70 119.14 1yq2 s GLU 686 Ca 0.00 -0.77 0.00 0.00 0.02 0.00 0.00 54.97 54.22 1yq2 s GLU 686 Cb 0.00 -2.53 0.02 0.00 0.10 0.00 0.00 34.13 31.72 1yq2 s GLU 686 CO 0.00 0.58 -0.13 0.99 0.02 0.00 0.00 175.26 176.71 1yq2 s THR 687 N -1.15 1.49 -0.12 3.63 2.01 -1.26 -0.57 115.64 119.68 1yq2 s THR 687 Ca 0.21 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 61.65 1yq2 s THR 687 Cb -0.11 -1.42 0.01 0.00 0.01 0.00 0.00 72.50 70.99 1yq2 s THR 687 CO 0.13 0.44 -0.20 0.26 -0.69 0.00 0.00 174.62 174.55 1yq2 s TRP 688 N 1.52 2.41 -0.16 4.92 0.52 -0.52 -0.31 118.94 127.32 1yq2 s TRP 688 Ca 0.05 -1.12 -0.17 0.00 0.02 0.00 0.00 56.10 54.88 1yq2 s TRP 688 Cb -0.13 -1.65 -0.04 0.00 -1.15 0.00 0.00 33.47 30.50 1yq2 s TRP 688 CO -0.10 -0.51 0.43 -1.17 0.02 0.00 0.00 176.95 175.62 1yq2 s LEU 689 N 0.71 4.22 -0.07 2.99 2.96 -0.18 -1.10 118.68 128.20 1yq2 s LEU 689 Ca -0.11 0.66 0.05 0.00 -0.22 0.00 0.00 54.13 54.51 1yq2 s LEU 689 Cb -0.16 -2.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.93 1yq2 s LEU 689 CO 0.02 -0.03 -0.24 -0.89 -1.32 0.00 0.00 176.35 173.89 1yq2 s THR 690 N 0.95 2.14 -0.10 3.68 2.01 0.03 -0.75 115.64 123.60 1yq2 s THR 690 Ca 0.22 -1.02 0.04 0.00 0.31 0.00 0.00 61.69 61.23 1yq2 s THR 690 Cb -0.15 -1.79 0.00 0.00 0.01 0.00 0.00 72.50 70.58 1yq2 s THR 690 CO 0.08 0.57 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.67 1yq2 s VAL 691 N -0.03 1.97 -0.05 3.82 1.01 -0.52 -0.90 120.40 125.69 1yq2 s VAL 691 Ca -0.07 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.01 1yq2 s VAL 691 Cb -0.15 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 1yq2 s VAL 691 CO 0.05 0.54 -0.23 -1.61 0.00 0.00 0.00 175.10 173.85 1yq2 s GLU 692 N 0.47 2.50 -0.22 2.72 2.02 0.38 -1.48 118.70 125.10 1yq2 s GLU 692 Ca -0.16 -0.86 -0.24 0.00 0.02 0.00 0.00 54.97 53.73 1yq2 s GLU 692 Cb -0.17 -2.20 -0.01 0.00 0.10 0.00 0.00 34.13 31.84 1yq2 s GLU 692 CO 0.06 0.45 0.78 0.00 0.02 0.00 0.00 175.26 176.57 1yq2 s ALA 693 N -0.32 3.59 0.12 5.21 0.00 -0.29 -0.96 121.76 129.12 1yq2 s ALA 693 Ca 0.01 -0.14 0.06 0.00 0.00 0.00 0.00 51.96 51.89 1yq2 s ALA 693 Cb -0.13 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 1yq2 s ALA 693 CO 0.02 -0.78 -0.15 0.14 0.00 0.00 0.00 175.76 175.00 1yq2 s VAL 694 N 2.47 1.37 0.06 0.00 -7.23 0.06 -0.19 120.40 116.94 1yq2 s VAL 694 Ca 0.34 -1.72 -0.31 0.00 -1.81 0.00 0.00 61.98 58.48 1yq2 s VAL 694 Cb -0.16 -1.54 -0.07 0.00 0.56 0.00 0.00 36.38 35.17 1yq2 s VAL 694 CO 0.09 -0.40 1.39 -0.76 -0.31 0.00 0.00 175.10 175.11 1yq2 s LEU 695 N -2.44 4.35 0.08 1.32 1.43 0.13 -0.32 118.68 123.23 1yq2 s LEU 695 Ca 0.09 2.21 -0.23 0.00 -1.03 0.00 0.00 54.13 55.17 1yq2 s LEU 695 Cb -0.05 -3.57 -0.15 0.00 0.03 0.00 0.00 46.19 42.44 1yq2 s LEU 695 CO 0.03 -0.67 1.70 0.03 0.23 0.00 0.00 176.35 177.67 1yq2 h ARG 696 N 7.29 0.01 -6.13 1.70 3.08 -1.39 0.25 114.38 119.18 1yq2 h ARG 696 Ca -0.40 -0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.05 1yq2 h ARG 696 Cb 1.20 -0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.12 1yq2 h ARG 696 CO 0.88 0.05 -0.69 -0.51 -1.07 0.00 0.00 179.97 178.63 1yq2 s ASP 697 N -5.24 3.97 0.69 7.04 1.01 -1.26 -4.05 116.67 118.82 1yq2 s ASP 697 Ca -0.13 -0.95 -0.16 0.00 0.71 0.00 0.00 52.55 52.02 1yq2 s ASP 697 Cb 0.06 -0.49 0.02 0.00 1.01 0.00 0.00 42.92 43.51 1yq2 s ASP 697 CO 0.66 -0.06 1.19 0.00 0.21 0.00 0.00 175.17 177.17 1yq2 s ALA 698 N -2.48 2.28 0.34 5.23 0.00 -1.26 -4.38 121.76 121.48 1yq2 s ALA 698 Ca 0.32 0.83 0.01 0.00 0.00 0.00 0.00 51.96 53.12 1yq2 s ALA 698 Cb -0.03 -3.43 -0.00 0.00 0.00 0.00 0.00 23.12 19.65 1yq2 s ALA 698 CO 0.17 -1.61 0.02 0.25 0.00 0.00 0.00 175.76 174.60 1yq2 n THR 699 N -2.43 0.00 0.29 0.00 -2.24 0.20 -4.91 114.28 105.19 1yq2 n THR 699 Ca 0.13 -1.66 0.15 0.00 -2.27 0.00 0.00 64.05 60.39 1yq2 n THR 699 Cb 0.50 0.39 0.88 0.00 -2.10 0.00 0.00 70.33 70.01 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 0.91 0.00 -0.36 3.38 0.00 -2.02 -3.26 103.07 101.72 1yq2 h GLY 700 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1yq2 h GLY 700 CO 0.46 0.00 -0.03 -2.67 0.00 0.00 0.00 176.54 174.29 1yq2 n TRP 701 N -3.83 0.00 -3.62 5.60 4.27 -1.26 -5.04 117.44 113.57 1yq2 n TRP 701 Ca -0.03 0.00 -0.16 0.00 -3.89 0.00 0.00 57.50 53.42 1yq2 n TRP 701 Cb 0.11 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 29.99 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 -0.60 -1.44 0.82 -1.67 0.00 -1.23 -4.75 121.76 112.89 1yq2 s ALA 702 Ca 0.06 1.15 -0.11 0.00 0.00 0.00 0.00 51.96 53.06 1yq2 s ALA 702 Cb 0.04 -0.22 0.08 0.00 0.00 0.00 0.00 23.12 23.03 1yq2 s ALA 702 CO 0.09 -0.32 1.09 -1.25 0.00 0.00 0.00 175.76 175.37 1yq2 s PRO 703 N -0.85 1.87 0.43 0.00 0.04 -1.26 -0.63 135.00 134.59 1yq2 s PRO 703 Ca -0.09 0.83 -0.25 0.00 0.04 0.00 0.00 61.00 61.52 1yq2 s PRO 703 Cb -0.02 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.54 1yq2 s PRO 703 CO 0.06 -1.82 1.29 0.00 0.04 0.00 0.00 177.00 176.57 1yq2 n ALA 704 N -3.60 1.37 -0.92 8.56 0.00 -1.26 -2.34 120.51 122.33 1yq2 n ALA 704 Ca 0.07 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1yq2 n ALA 704 Cb 0.55 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.72 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 0.79 0.71 3.68 0.00 0.00 0.87 -4.93 105.19 106.31 1yq2 n GLY 705 Ca 0.07 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.54 2.34 -2.54 1.61 -0.00 -0.99 -4.60 115.22 108.51 1yq2 n HIS 706 Ca 0.00 0.02 -0.39 0.00 -0.00 0.00 0.00 57.72 57.35 1yq2 n HIS 706 Cb 0.00 -2.65 -0.05 0.00 -0.00 0.00 0.00 29.99 27.29 1yq2 n HIS 706 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 1yq2 s PRO 707 N 3.41 4.58 -0.22 1.57 0.04 -1.26 -0.69 135.00 142.43 1yq2 s PRO 707 Ca 0.89 1.68 0.12 0.00 0.04 0.00 0.00 61.00 63.74 1yq2 s PRO 707 Cb -0.67 -3.07 -0.22 0.00 0.04 0.00 0.00 34.50 30.58 1yq2 s PRO 707 CO 0.48 0.19 -0.02 1.28 0.04 0.00 0.00 177.00 178.97 1yq2 n LEU 708 N 0.97 1.06 0.00 -3.56 4.77 0.73 -4.94 117.00 116.03 1yq2 n LEU 708 Ca -0.00 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1yq2 n LEU 708 Cb 0.46 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1yq2 n LEU 708 CO 0.51 0.65 0.00 0.61 -1.33 0.00 0.00 177.39 177.83 1yq2 n GLY 709 N 1.92 0.77 3.42 -0.72 0.00 -1.23 -4.59 105.19 104.76 1yq2 n GLY 709 Ca -0.37 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 44.74 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 0.38 0.02 4.61 0.00 -1.26 -1.13 121.76 122.38 1yq2 s ALA 710 Ca 0.00 -1.24 -0.14 0.00 0.00 0.00 0.00 51.96 50.58 1yq2 s ALA 710 Cb 0.00 1.21 0.02 0.00 0.00 0.00 0.00 23.12 24.35 1yq2 s ALA 710 CO 0.00 -0.74 0.30 0.54 0.00 0.00 0.00 175.76 175.86 1yq2 s VAL 711 N -4.06 0.07 0.20 0.00 0.11 -0.55 -4.90 120.40 111.28 1yq2 s VAL 711 Ca 0.30 -0.61 0.07 0.00 -2.93 0.00 0.00 61.98 58.81 1yq2 s VAL 711 Cb 0.03 -0.83 -0.05 0.00 -1.53 0.00 0.00 36.38 34.00 1yq2 s VAL 711 CO 0.11 -0.34 -0.13 -1.10 -3.33 0.00 0.00 175.10 170.30 1yq2 s GLN 712 N -2.14 1.30 -0.03 1.54 -0.21 -1.26 -1.44 119.66 117.42 1yq2 s GLN 712 Ca -0.08 -1.58 -0.01 0.00 0.02 0.00 0.00 55.36 53.71 1yq2 s GLN 712 Cb -0.02 -1.05 0.03 0.00 1.00 0.00 0.00 33.01 32.97 1yq2 s GLN 712 CO -0.01 0.16 0.06 -1.17 -2.12 0.00 0.00 175.29 172.21 1yq2 s LEU 713 N -3.30 1.01 -0.22 2.90 2.96 0.07 -4.79 118.68 117.31 1yq2 s LEU 713 Ca 0.22 0.11 -0.25 0.00 -0.22 0.00 0.00 54.13 53.99 1yq2 s LEU 713 Cb -0.00 0.05 -0.00 0.00 0.50 0.00 0.00 46.19 46.73 1yq2 s LEU 713 CO 0.06 -0.13 0.86 -0.62 -1.32 0.00 0.00 176.35 175.21 1yq2 s ASP 714 N 1.06 6.91 -0.08 3.68 3.68 -1.26 -1.01 116.67 129.64 1yq2 s ASP 714 Ca -0.09 1.13 0.12 0.00 2.13 0.00 0.00 52.55 55.84 1yq2 s ASP 714 Cb -0.12 -2.46 0.31 0.00 -1.45 0.00 0.00 42.92 39.20 1yq2 s ASP 714 CO -0.04 -0.51 1.23 0.18 0.13 0.00 0.00 175.17 176.16 1yq2 n LEU 715 N 5.87 2.92 -4.72 -1.34 4.77 0.58 -4.99 117.00 120.08 1yq2 n LEU 715 Ca 0.06 -2.53 -0.36 0.00 -0.03 0.00 0.00 56.01 53.15 1yq2 n LEU 715 Cb 0.48 -0.32 0.08 0.00 -2.33 0.00 0.00 43.42 41.32 1yq2 n LEU 715 CO 0.48 0.66 0.89 -0.44 -1.33 0.00 0.00 177.39 177.65 1yq2 s SER 716 N -1.66 4.41 0.73 -1.43 0.01 -1.00 -4.52 113.70 110.24 1yq2 s SER 716 Ca 0.26 2.59 -0.15 0.00 1.31 0.00 0.00 55.95 59.97 1yq2 s SER 716 Cb 0.20 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.85 1yq2 s SER 716 CO 0.08 -2.13 1.19 0.00 0.41 0.00 0.00 173.24 172.78 1yq2 s ALA 717 N -1.51 2.12 0.31 1.44 0.00 -1.26 -4.91 121.76 117.95 1yq2 s ALA 717 Ca 0.81 0.81 -0.28 0.00 0.00 0.00 0.00 51.96 53.31 1yq2 s ALA 717 Cb -0.36 -3.45 -0.13 0.00 0.00 0.00 0.00 23.12 19.18 1yq2 s ALA 717 CO 0.42 -1.86 1.10 -2.30 0.00 0.00 0.00 175.76 173.12 1yq2 n PRO 718 N -2.79 1.61 -2.05 0.00 -0.02 -1.26 -4.85 135.00 125.64 1yq2 n PRO 718 Ca 0.13 0.56 -0.41 0.00 -2.02 0.00 0.00 63.50 61.76 1yq2 n PRO 718 Cb 0.51 -2.01 -0.02 0.00 -0.02 0.00 0.00 33.50 31.96 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 -1.08 3.52 -0.47 3.55 0.00 -1.26 -5.00 121.76 121.02 1yq2 s ALA 719 Ca 0.58 1.32 -0.16 0.00 0.00 0.00 0.00 51.96 53.70 1yq2 s ALA 719 Cb -0.65 -3.51 0.07 0.00 0.00 0.00 0.00 23.12 19.03 1yq2 s ALA 719 CO 0.61 -0.72 0.40 0.08 0.00 0.00 0.00 175.76 176.12 1yq2 s VAL 720 N -1.03 5.23 0.14 0.00 1.01 -1.26 -5.06 120.40 119.43 1yq2 s VAL 720 Ca 0.51 -1.08 -0.31 0.00 0.00 0.00 0.00 61.98 61.10 1yq2 s VAL 720 Cb -0.41 -4.13 -0.09 0.00 0.00 0.00 0.00 36.38 31.75 1yq2 s VAL 720 CO 0.54 -0.59 1.41 -2.16 0.00 0.00 0.00 175.10 174.30 1yq2 s PRO 721 N 1.64 4.31 0.63 2.72 0.04 -1.26 -4.99 135.00 138.09 1yq2 s PRO 721 Ca 0.04 2.14 -0.15 0.00 0.04 0.00 0.00 61.00 63.06 1yq2 s PRO 721 Cb -0.24 -3.22 -0.01 0.00 0.04 0.00 0.00 34.50 31.06 1yq2 s PRO 721 CO 0.07 -0.45 1.09 0.95 0.04 0.00 0.00 177.00 178.70 1yq2 s THR 722 N 0.94 3.43 -0.57 1.26 -4.23 -1.26 -4.98 115.64 110.23 1yq2 s THR 722 Ca 0.64 0.68 -0.21 0.00 -1.18 0.00 0.00 61.69 61.62 1yq2 s THR 722 Cb -0.38 -3.20 0.07 0.00 1.34 0.00 0.00 72.50 70.32 1yq2 s THR 722 CO 0.32 -0.40 0.79 0.00 -0.54 0.00 0.00 174.62 174.79 1yq2 s ARG 723 N -4.06 3.15 0.42 3.99 1.70 -1.26 -5.04 118.95 117.86 1yq2 s ARG 723 Ca 0.66 -0.81 -0.21 0.00 -0.47 0.00 0.00 55.73 54.89 1yq2 s ARG 723 Cb -0.19 -4.15 -0.11 0.00 -0.57 0.00 0.00 34.95 29.93 1yq2 s ARG 723 CO 0.39 -1.48 0.95 -1.12 -1.08 0.00 0.00 175.30 172.97 1yq2 s SER 724 N 3.12 6.96 0.44 -2.89 0.01 -1.26 -5.01 113.70 115.06 1yq2 s SER 724 Ca 0.19 1.71 -0.25 0.00 1.31 0.00 0.00 55.95 58.91 1yq2 s SER 724 Cb -0.18 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.42 1yq2 s SER 724 CO 0.12 -0.35 1.37 -2.84 0.41 0.00 0.00 173.24 171.95 1yq2 s PRO 725 N -3.08 3.77 0.32 12.44 0.02 -1.26 -4.95 135.00 142.27 1yq2 s PRO 725 Ca 0.61 2.29 -0.29 0.00 0.02 0.00 0.00 61.00 63.63 1yq2 s PRO 725 Cb -0.10 -2.67 -0.11 0.00 0.02 0.00 0.00 34.50 31.63 1yq2 s PRO 725 CO 0.14 -0.70 1.56 0.50 -0.33 0.00 0.00 177.00 178.17 1yq2 s ARG 726 N -2.39 4.12 0.18 5.54 3.52 -1.26 -4.92 118.95 123.74 1yq2 s ARG 726 Ca 0.60 2.58 -0.33 0.00 -0.13 0.00 0.00 55.73 58.44 1yq2 s ARG 726 Cb -0.41 -3.01 -0.15 0.00 -1.56 0.00 0.00 34.95 29.83 1yq2 s ARG 726 CO 0.52 -0.60 1.35 -2.30 -0.81 0.00 0.00 175.30 173.46 1yq2 n PRO 727 N 1.65 1.65 -4.34 5.12 -0.02 -1.26 -4.97 135.00 132.83 1yq2 n PRO 727 Ca 0.06 0.59 -0.32 0.00 -2.02 0.00 0.00 63.50 61.81 1yq2 n PRO 727 Cb 0.38 -2.21 -0.09 0.00 -0.02 0.00 0.00 33.50 31.55 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 0.14 3.15 0.06 3.55 0.00 -1.26 -5.10 121.76 122.29 1yq2 s ALA 728 Ca 0.74 -1.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.38 1yq2 s ALA 728 Cb -0.76 -1.20 -0.05 0.00 0.00 0.00 0.00 23.12 21.11 1yq2 s ALA 728 CO 0.48 0.64 1.03 0.99 0.00 0.00 0.00 175.76 178.90 1yq2 s THR 729 N -1.09 4.52 0.50 0.00 2.01 -1.26 -5.02 115.64 115.31 1yq2 s THR 729 Ca 0.19 1.90 -0.22 0.00 0.31 0.00 0.00 61.69 63.87 1yq2 s THR 729 Cb -0.11 -4.22 -0.06 0.00 0.01 0.00 0.00 72.50 68.12 1yq2 s THR 729 CO 0.10 0.20 1.26 -2.16 -0.69 0.00 0.00 174.62 173.34 1yq2 s PRO 730 N 0.62 3.46 0.13 4.92 0.04 -1.26 -4.66 135.00 138.25 1yq2 s PRO 730 Ca 0.52 2.01 0.05 0.00 0.04 0.00 0.00 61.00 63.62 1yq2 s PRO 730 Cb -0.24 -2.34 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 1yq2 s PRO 730 CO 0.29 -0.87 0.09 -0.51 0.04 0.00 0.00 177.00 176.05 1yq2 s LEU 731 N -3.26 3.72 0.86 -3.56 1.43 0.72 -5.00 118.68 113.59 1yq2 s LEU 731 Ca 0.67 -0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.53 1yq2 s LEU 731 Cb -0.35 -2.37 0.11 0.00 0.03 0.00 0.00 46.19 43.61 1yq2 s LEU 731 CO 0.42 0.11 1.09 -1.81 0.23 0.00 0.00 176.35 176.39 1yq2 s ASP 732 N -2.78 3.85 0.00 2.29 -0.00 -1.26 -3.84 116.67 114.93 1yq2 s ASP 732 Ca 0.29 1.42 0.00 0.00 -0.00 0.00 0.00 52.55 54.26 1yq2 s ASP 732 Cb -0.11 -2.12 0.00 0.00 -0.00 0.00 0.00 42.92 40.70 1yq2 s ASP 732 CO 0.22 -2.39 0.00 0.61 -0.00 0.00 0.00 175.17 173.61 1yq2 n GLY 733 N -1.49 -2.54 3.76 0.21 0.00 -1.26 -4.92 105.19 98.95 1yq2 n GLY 733 Ca 0.07 -1.87 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 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 -1.40 3.66 0.53 4.61 0.00 -1.26 -4.58 121.76 123.33 1yq2 s ALA 734 Ca 0.00 1.52 -0.19 0.00 0.00 0.00 0.00 51.96 53.29 1yq2 s ALA 734 Cb 0.00 -3.61 -0.06 0.00 0.00 0.00 0.00 23.12 19.44 1yq2 s ALA 734 CO 0.00 -0.95 1.07 -0.51 0.00 0.00 0.00 175.76 175.37 1yq2 s LEU 735 N -1.03 3.73 0.62 0.00 1.43 -1.26 -4.75 118.68 117.43 1yq2 s LEU 735 Ca 0.59 1.97 -0.16 0.00 -1.03 0.00 0.00 54.13 55.50 1yq2 s LEU 735 Cb -0.46 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.18 1yq2 s LEU 735 CO 0.52 -1.00 1.10 -2.16 0.23 0.00 0.00 176.35 175.03 1yq2 s PRO 736 N -3.45 3.05 -0.26 1.29 0.04 -1.26 -4.96 135.00 129.45 1yq2 s PRO 736 Ca 0.68 1.37 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1yq2 s PRO 736 Cb -0.18 -1.98 -0.16 0.00 0.04 0.00 0.00 34.50 32.21 1yq2 s PRO 736 CO 0.26 -1.05 -0.24 0.28 0.04 0.00 0.00 177.00 176.28 1yq2 n VAL 737 N -2.11 1.49 -4.09 -0.36 0.31 -1.26 -4.68 118.33 107.62 1yq2 n VAL 737 Ca 0.10 -0.55 -0.33 0.00 -0.01 0.00 0.00 64.34 63.55 1yq2 n VAL 737 Cb 0.52 -1.46 -0.16 0.00 -0.91 0.00 0.00 33.84 31.83 1yq2 n VAL 737 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1yq2 s SER 738 N -6.60 3.47 -0.51 4.52 0.01 -1.26 0.09 113.70 113.41 1yq2 s SER 738 Ca -0.35 -0.78 0.03 0.00 1.31 0.00 0.00 55.95 56.16 1yq2 s SER 738 Cb 0.10 -1.51 0.14 0.00 0.21 0.00 0.00 66.02 64.96 1yq2 s SER 738 CO 0.59 -0.04 0.30 -0.76 0.41 0.00 0.00 173.24 173.73 1yq2 s LEU 739 N 1.27 3.42 0.00 2.44 1.43 0.12 -5.03 118.68 122.32 1yq2 s LEU 739 Ca 0.02 -2.99 0.00 0.00 -1.03 0.00 0.00 54.13 50.13 1yq2 s LEU 739 Cb -0.14 -1.26 0.00 0.00 0.03 0.00 0.00 46.19 44.82 1yq2 s LEU 739 CO -0.11 -0.22 0.00 0.61 0.23 0.00 0.00 176.35 176.87 1yq2 n GLY 740 N 3.08 3.27 0.00 -3.19 0.00 -1.26 -1.85 105.19 105.24 1yq2 n GLY 740 Ca 0.11 -0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.06 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 13.67 0.00 -3.76 1.61 -0.04 -1.26 -4.75 135.00 140.47 1yq2 n PRO 741 Ca 0.00 0.24 -0.37 0.00 -0.04 0.00 0.00 63.50 63.33 1yq2 n PRO 741 Cb 0.00 -1.51 -0.06 0.00 -0.04 0.00 0.00 33.50 31.89 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 -3.01 3.81 -0.02 0.55 0.00 -0.77 -0.93 121.76 121.39 1yq2 s ALA 742 Ca 0.07 -0.53 0.07 0.00 0.00 0.00 0.00 51.96 51.57 1yq2 s ALA 742 Cb 0.10 -2.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.09 1yq2 s ALA 742 CO 0.28 0.52 -0.24 0.99 0.00 0.00 0.00 175.76 177.32 1yq2 s THR 743 N -0.86 1.91 0.03 0.00 2.01 -0.80 -0.70 115.64 117.22 1yq2 s THR 743 Ca 0.17 -1.03 0.09 0.00 0.31 0.00 0.00 61.69 61.22 1yq2 s THR 743 Cb -0.13 -1.59 -0.03 0.00 0.01 0.00 0.00 72.50 70.76 1yq2 s THR 743 CO 0.06 0.54 -0.26 -0.36 -0.69 0.00 0.00 174.62 173.91 1yq2 s PHE 744 N -0.53 2.34 -0.28 4.92 0.40 0.11 -1.14 117.98 123.81 1yq2 s PHE 744 Ca 0.08 -0.41 -0.03 0.00 -0.60 0.00 0.00 56.93 55.98 1yq2 s PHE 744 Cb -0.10 -1.43 0.03 0.00 0.51 0.00 0.00 43.02 42.04 1yq2 s PHE 744 CO -0.01 0.09 -0.01 0.34 0.70 0.00 0.00 175.22 176.33 1yq2 s ASP 745 N -1.09 4.68 -1.56 1.36 -1.08 0.49 -4.64 116.67 114.84 1yq2 s ASP 745 Ca 0.11 -1.00 -0.07 0.00 -0.52 0.00 0.00 52.55 51.08 1yq2 s ASP 745 Cb -0.10 -1.72 0.06 0.00 -1.46 0.00 0.00 42.92 39.70 1yq2 s ASP 745 CO 0.01 -0.19 0.42 0.00 0.52 0.00 0.00 175.17 175.93 1yq2 n ALA 746 N 4.69 -1.76 -0.20 3.66 0.00 -1.26 -0.91 120.51 124.73 1yq2 n ALA 746 Ca -0.15 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1yq2 n ALA 746 Cb 0.46 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 -1.92 2.32 3.67 0.00 0.00 -1.26 -5.03 105.19 102.97 1yq2 n GLY 747 Ca -0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.10 5.18 0.21 2.61 2.01 -0.09 -5.02 115.64 117.44 1yq2 s THR 748 Ca 0.00 0.76 -0.31 0.00 0.31 0.00 0.00 61.69 62.45 1yq2 s THR 748 Cb 0.00 -3.75 -0.11 0.00 0.01 0.00 0.00 72.50 68.65 1yq2 s THR 748 CO 0.00 0.24 1.61 -0.22 -0.69 0.00 0.00 174.62 175.57 1yq2 s LEU 749 N 1.32 4.37 0.00 4.42 2.96 -1.26 -0.38 118.68 130.10 1yq2 s LEU 749 Ca 0.20 2.77 0.00 0.00 -0.22 0.00 0.00 54.13 56.88 1yq2 s LEU 749 Cb -0.15 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.94 1yq2 s LEU 749 CO 0.08 -0.88 0.00 1.33 -1.32 0.00 0.00 176.35 175.56 1yq2 n VAL 750 N 3.51 0.00 -3.63 1.68 0.24 -0.29 -4.53 118.33 115.32 1yq2 n VAL 750 Ca 0.13 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.29 1yq2 n VAL 750 Cb 0.37 0.18 -0.06 0.00 -1.47 0.00 0.00 33.84 32.86 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 -1.85 -0.36 -0.03 -1.34 1.04 -1.18 -1.45 113.70 108.54 1yq2 s SER 751 Ca 0.00 0.11 0.01 0.00 0.48 0.00 0.00 55.95 56.55 1yq2 s SER 751 Cb 0.00 0.45 0.02 0.00 0.10 0.00 0.00 66.02 66.59 1yq2 s SER 751 CO 0.00 -0.67 -0.03 -0.76 0.98 0.00 0.00 173.24 172.76 1yq2 s LEU 752 N -1.91 1.46 -1.38 2.42 1.43 -0.39 -1.91 118.68 118.40 1yq2 s LEU 752 Ca -0.06 -0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 52.80 1yq2 s LEU 752 Cb -0.01 -0.34 0.02 0.00 0.03 0.00 0.00 46.19 45.89 1yq2 s LEU 752 CO -0.01 -0.04 0.36 0.00 0.23 0.00 0.00 176.35 176.89 1yq2 n ALA 753 N 3.79 -2.27 -0.99 4.21 0.00 -0.11 -1.89 120.51 123.25 1yq2 n ALA 753 Ca -0.23 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1yq2 n ALA 753 Cb 0.52 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.19 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 -2.27 0.67 3.12 0.00 0.00 -1.26 -5.01 105.19 100.43 1yq2 n GLY 754 Ca -0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.01 1.03 0.21 1.61 -1.52 -0.79 -5.12 119.66 115.07 1yq2 s GLN 755 Ca 0.00 -0.60 -0.31 0.00 -1.95 0.00 0.00 55.36 52.50 1yq2 s GLN 755 Cb 0.00 -1.02 -0.10 0.00 -0.22 0.00 0.00 33.01 31.67 1yq2 s GLN 755 CO 0.00 0.27 1.48 -1.25 -0.25 0.00 0.00 175.29 175.54 1yq2 s PRO 756 N -0.67 4.25 -0.09 2.91 0.04 -1.26 -1.27 135.00 138.92 1yq2 s PRO 756 Ca 0.04 2.32 -0.09 0.00 0.04 0.00 0.00 61.00 63.30 1yq2 s PRO 756 Cb -0.06 -3.13 0.02 0.00 0.04 0.00 0.00 34.50 31.37 1yq2 s PRO 756 CO 0.00 -0.49 0.26 0.08 0.04 0.00 0.00 177.00 176.89 1yq2 s VAL 757 N 0.45 0.01 0.13 -0.36 1.01 -0.53 -4.08 120.40 117.04 1yq2 s VAL 757 Ca 0.63 -0.08 0.09 0.00 0.00 0.00 0.00 61.98 62.63 1yq2 s VAL 757 Cb -0.42 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 1yq2 s VAL 757 CO 0.38 -0.04 -0.18 -0.44 0.00 0.00 0.00 175.10 174.82 1yq2 s SER 758 N -0.06 3.83 0.00 3.32 0.01 -0.82 -3.62 113.70 116.36 1yq2 s SER 758 Ca -0.02 -0.61 0.00 0.00 1.31 0.00 0.00 55.95 56.63 1yq2 s SER 758 Cb -0.02 -0.50 0.00 0.00 0.21 0.00 0.00 66.02 65.70 1yq2 s SER 758 CO 0.01 0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.43 1yq2 n GLY 759 N 0.65 0.93 3.84 3.44 0.00 -1.26 -0.84 105.19 111.94 1yq2 n GLY 759 Ca -0.15 -2.12 -0.32 0.00 0.00 0.00 0.00 46.02 43.43 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 -1.01 4.05 -0.14 1.61 0.04 -1.26 -4.50 135.00 133.79 1yq2 s PRO 760 Ca 0.00 0.82 0.03 0.00 0.04 0.00 0.00 61.00 61.89 1yq2 s PRO 760 Cb 0.00 -2.32 0.01 0.00 0.04 0.00 0.00 34.50 32.23 1yq2 s PRO 760 CO 0.00 0.04 -0.22 0.50 0.04 0.00 0.00 177.00 177.36 1yq2 s ARG 761 N -3.24 2.98 0.40 4.56 3.52 -0.41 -4.89 118.95 121.87 1yq2 s ARG 761 Ca 0.57 -0.84 -0.27 0.00 -0.13 0.00 0.00 55.73 55.06 1yq2 s ARG 761 Cb -0.10 -2.40 -0.10 0.00 -1.56 0.00 0.00 34.95 30.79 1yq2 s ARG 761 CO 0.19 -0.01 1.46 -1.17 -0.81 0.00 0.00 175.30 174.95 1yq2 s LEU 762 N 0.81 4.25 -0.02 -0.88 2.96 -1.26 -0.10 118.68 124.44 1yq2 s LEU 762 Ca -0.07 2.99 0.00 0.00 -0.22 0.00 0.00 54.13 56.83 1yq2 s LEU 762 Cb -0.16 -3.76 0.03 0.00 0.50 0.00 0.00 46.19 42.80 1yq2 s LEU 762 CO -0.02 -0.97 0.02 -0.70 -1.32 0.00 0.00 176.35 173.37 1yq2 s GLU 763 N -2.21 -0.00 -0.01 1.98 2.56 -0.19 -4.83 118.70 115.99 1yq2 s GLU 763 Ca 0.56 0.16 0.08 0.00 0.00 0.00 0.00 54.97 55.77 1yq2 s GLU 763 Cb -0.45 -0.25 -0.11 0.00 2.00 0.00 0.00 34.13 35.32 1yq2 s GLU 763 CO 0.60 -0.15 0.23 1.28 -0.56 0.00 0.00 175.26 176.67 1yq2 n LEU 764 N 4.09 0.14 -4.76 2.70 4.77 -1.26 -2.28 117.00 120.39 1yq2 n LEU 764 Ca -0.27 -0.19 -0.39 0.00 -0.03 0.00 0.00 56.01 55.14 1yq2 n LEU 764 Cb 0.51 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.54 1yq2 n LEU 764 CO 0.22 0.03 0.66 0.86 -1.33 0.00 0.00 177.39 177.84 1yq2 s TRP 765 N -2.24 3.84 0.13 -1.77 -0.11 -1.25 -2.74 118.94 114.81 1yq2 s TRP 765 Ca -0.01 1.85 0.07 0.00 1.22 0.00 0.00 56.10 59.24 1yq2 s TRP 765 Cb 0.05 -2.99 -0.04 0.00 -1.50 0.00 0.00 33.47 29.00 1yq2 s TRP 765 CO 0.33 0.27 -0.17 -0.98 -4.62 0.00 0.00 176.95 171.78 1yq2 s ARG 766 N -1.53 1.13 -0.26 5.86 1.70 -1.26 -4.79 118.95 119.80 1yq2 s ARG 766 Ca 0.45 -1.28 -0.28 0.00 -0.47 0.00 0.00 55.73 54.14 1yq2 s ARG 766 Cb -0.24 -1.15 -0.03 0.00 -0.57 0.00 0.00 34.95 32.96 1yq2 s ARG 766 CO 0.30 0.24 1.89 0.00 -1.08 0.00 0.00 175.30 176.64 1yq2 s ALA 767 N -1.90 2.95 0.18 7.88 0.00 -1.26 -4.88 121.76 124.73 1yq2 s ALA 767 Ca 0.11 0.50 -0.33 0.00 0.00 0.00 0.00 51.96 52.24 1yq2 s ALA 767 Cb -0.06 -3.99 -0.14 0.00 0.00 0.00 0.00 23.12 18.93 1yq2 s ALA 767 CO 0.05 -2.48 1.51 -2.30 0.00 0.00 0.00 175.76 172.53 1yq2 n PRO 768 N 8.33 2.06 -1.10 0.00 -0.02 -1.26 -0.46 135.00 142.55 1yq2 n PRO 768 Ca 0.24 0.74 -0.29 0.00 -2.02 0.00 0.00 63.50 62.16 1yq2 n PRO 768 Cb 0.46 -2.47 0.16 0.00 -0.02 0.00 0.00 33.50 31.63 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 0.58 2.44 0.28 3.45 -4.23 -1.26 -4.50 115.64 112.40 1yq2 s THR 769 Ca 0.76 0.14 -0.01 0.00 -1.18 0.00 0.00 61.69 61.40 1yq2 s THR 769 Cb -0.68 -2.55 0.28 0.00 1.34 0.00 0.00 72.50 70.88 1yq2 s THR 769 CO 0.42 -0.19 1.88 0.44 -0.54 0.00 0.00 174.62 176.63 1yq2 h ASP 770 N -1.76 1.00 -0.93 3.99 3.32 -1.88 -1.43 116.42 118.74 1yq2 h ASP 770 Ca -0.51 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 56.55 1yq2 h ASP 770 Cb 1.30 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.60 1yq2 h ASP 770 CO 0.54 0.63 0.57 0.78 -1.72 0.00 0.00 179.24 180.04 1yq2 h ASN 771 N 1.13 1.10 -0.00 6.45 2.35 -1.86 -1.70 115.58 123.06 1yq2 h ASN 771 Ca 0.44 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 56.13 1yq2 h ASN 771 Cb 0.22 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 1yq2 h ASN 771 CO -0.18 0.83 0.01 0.44 -1.65 0.00 0.00 177.43 176.89 1yq2 h ASP 772 N 1.27 0.00 -0.01 5.81 3.32 -1.57 -2.04 116.42 123.20 1yq2 h ASP 772 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1yq2 h ASP 772 Cb -0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1yq2 h ASP 772 CO -0.07 0.00 -0.18 0.54 -1.72 0.00 0.00 179.24 177.81 1yq2 n ARG 773 N -3.31 1.80 -3.03 3.56 1.74 -0.67 -0.64 116.66 116.10 1yq2 n ARG 773 Ca -0.03 -1.45 -0.35 0.00 -0.77 0.00 0.00 57.85 55.25 1yq2 n ARG 773 Cb 0.09 -1.47 -0.06 0.00 -1.02 0.00 0.00 32.46 30.00 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 -2.20 2.54 -0.01 -0.13 0.00 -0.77 -4.79 107.32 101.97 1yq2 s GLY 774 Ca 0.25 0.21 0.01 0.00 0.00 0.00 0.00 44.72 45.19 1yq2 s GLY 774 CO 0.41 0.52 0.85 0.00 0.00 0.00 0.00 173.10 174.89 1yq2 n ALA 775 N 0.24 1.70 -0.25 3.20 0.00 -1.26 -4.19 120.51 119.96 1yq2 n ALA 775 Ca 0.01 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.50 1yq2 n ALA 775 Cb 0.52 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.65 1yq2 n ALA 775 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 776 N -0.11 -2.33 3.69 0.00 0.00 -1.26 -4.67 105.19 100.51 1yq2 n GLY 776 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1yq2 n GLY 776 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yq2 s PHE 777 N -2.34 1.86 1.00 1.61 2.99 -1.26 -5.02 117.98 116.81 1yq2 s PHE 777 Ca 0.00 1.71 -0.16 0.00 0.00 0.00 0.00 56.93 58.48 1yq2 s PHE 777 Cb 0.00 -3.26 0.20 0.00 0.00 0.00 0.00 43.02 39.96 1yq2 s PHE 777 CO 0.00 -2.59 1.23 0.20 -0.00 0.00 0.00 175.22 174.06 1yq2 s GLY 778 N -2.86 1.68 0.34 4.36 0.00 0.00 -4.82 107.32 106.03 1yq2 s GLY 778 Ca 0.65 -0.98 -0.13 0.00 0.00 0.00 0.00 44.72 44.26 1yq2 s GLY 778 CO 0.58 -0.25 0.73 0.00 0.00 0.00 0.00 173.10 174.16 1yq2 s ALA 779 N -3.56 3.35 -0.60 3.20 0.00 -0.58 -4.28 121.76 119.30 1yq2 s ALA 779 Ca 0.71 -0.06 0.24 0.00 0.00 0.00 0.00 51.96 52.85 1yq2 s ALA 779 Cb -0.08 -2.72 0.41 0.00 0.00 0.00 0.00 23.12 20.74 1yq2 s ALA 779 CO 0.53 0.26 1.42 1.88 0.00 0.00 0.00 175.76 179.85 1yq2 h TYR 780 N 2.01 0.00 0.23 0.00 0.99 -1.88 -0.28 116.97 118.03 1yq2 h TYR 780 Ca -0.48 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.26 1yq2 h TYR 780 Cb 1.18 0.00 -0.04 0.00 1.00 0.00 0.00 36.73 38.87 1yq2 h TYR 780 CO 0.61 0.00 -0.51 0.78 -0.00 0.00 0.00 178.16 179.04 1yq2 h GLY 781 N 4.41 -1.15 0.82 3.88 0.00 -1.95 -3.27 103.07 105.81 1yq2 h GLY 781 Ca 0.00 0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.94 1yq2 h GLY 781 CO 0.00 -0.30 0.00 -1.05 0.00 0.00 0.00 176.54 175.19 1yq2 n PRO 782 N -5.51 0.48 -3.83 4.80 -0.02 -1.26 -4.82 135.00 124.84 1yq2 n PRO 782 Ca -0.09 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.31 1yq2 n PRO 782 Cb 0.42 -1.41 -0.02 0.00 -0.02 0.00 0.00 33.50 32.47 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 -1.91 -0.11 0.04 -1.23 0.00 -1.24 -5.07 107.32 97.80 1yq2 s GLY 783 Ca 0.19 -0.27 -0.31 0.00 0.00 0.00 0.00 44.72 44.34 1yq2 s GLY 783 CO 0.15 -0.09 1.94 1.34 0.00 0.00 0.00 173.10 176.44 1yq2 n ASP 784 N -0.45 4.10 0.21 1.64 -0.08 -1.26 -4.84 116.55 115.86 1yq2 n ASP 784 Ca -0.05 0.92 0.15 0.00 -1.51 0.00 0.00 54.79 54.30 1yq2 n ASP 784 Cb 0.60 -1.52 0.70 0.00 2.34 0.00 0.00 41.12 43.24 1yq2 n ASP 784 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1yq2 h PRO 785 N 10.11 0.00 0.00 -0.67 0.13 -1.96 -1.94 132.00 137.67 1yq2 h PRO 785 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 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 -0.09 0.91 -0.23 0.00 0.00 178.00 179.53 1yq2 n TRP 786 N -2.54 0.54 -1.66 1.56 7.02 -1.26 -3.69 117.44 117.41 1yq2 n TRP 786 Ca -0.00 0.16 -0.30 0.00 -1.02 0.00 0.00 57.50 56.33 1yq2 n TRP 786 Cb 0.13 -0.73 0.08 0.00 -2.42 0.00 0.00 31.31 28.38 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 -3.92 2.61 -1.43 -0.99 1.02 -0.73 -4.20 118.68 111.05 1yq2 s LEU 787 Ca 0.11 1.20 -0.08 0.00 0.02 0.00 0.00 54.13 55.38 1yq2 s LEU 787 Cb 0.15 -3.83 0.05 0.00 0.02 0.00 0.00 46.19 42.58 1yq2 s LEU 787 CO 0.59 -1.86 0.63 -3.20 0.02 0.00 0.00 176.35 172.53 1yq2 n ASN 788 N -3.35 -4.91 -2.06 2.29 4.05 -1.26 -1.25 115.26 108.78 1yq2 n ASN 788 Ca 0.07 -0.41 -0.20 0.00 0.45 0.00 0.00 54.58 54.49 1yq2 n ASN 788 Cb 0.57 -3.98 -0.04 0.00 1.23 0.00 0.00 39.78 37.56 1yq2 n ASN 788 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 1yq2 n SER 789 N -2.48 -5.69 -0.82 1.20 7.64 -1.26 -1.41 113.62 110.80 1yq2 n SER 789 Ca -0.04 0.17 -0.11 0.00 1.01 0.00 0.00 58.87 59.90 1yq2 n SER 789 Cb 0.57 -4.80 -0.04 0.00 -1.01 0.00 0.00 64.21 58.92 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 -0.82 1.18 0.32 0.23 0.00 -0.38 -3.77 105.19 101.95 1yq2 n GLY 790 Ca -0.23 -0.54 0.15 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.68 1.41 0.00 1.61 1.74 -0.50 -4.77 116.66 113.48 1yq2 n ARG 791 Ca -0.11 -0.64 0.00 0.00 -0.77 0.00 0.00 57.85 56.33 1yq2 n ARG 791 Cb 0.35 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 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 1.13 -1.29 3.28 -0.13 0.00 -1.26 -0.82 105.19 106.10 1yq2 n GLY 792 Ca 0.20 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 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 2.97 0.14 1.61 1.01 -0.12 -4.69 120.40 121.33 1yq2 s VAL 793 Ca 0.00 -0.65 -0.34 0.00 0.00 0.00 0.00 61.98 61.00 1yq2 s VAL 793 Cb 0.00 -2.30 -0.17 0.00 0.00 0.00 0.00 36.38 33.91 1yq2 s VAL 793 CO 0.00 0.48 1.12 -2.65 0.00 0.00 0.00 175.10 174.05 1yq2 n PRO 794 N 4.41 0.91 -3.52 2.72 -0.02 -1.26 -1.52 135.00 136.71 1yq2 n PRO 794 Ca -0.19 0.32 -0.10 0.00 -2.02 0.00 0.00 63.50 61.52 1yq2 n PRO 794 Cb 0.51 -1.80 -0.03 0.00 -0.02 0.00 0.00 33.50 32.16 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 -0.15 -1.85 1.11 3.55 0.00 -1.26 -4.83 121.76 118.34 1yq2 s ALA 795 Ca 0.76 1.19 -0.12 0.00 0.00 0.00 0.00 51.96 53.79 1yq2 s ALA 795 Cb -0.93 0.07 0.25 0.00 0.00 0.00 0.00 23.12 22.51 1yq2 s ALA 795 CO 0.52 -0.56 1.05 -2.14 0.00 0.00 0.00 175.76 174.64 1yq2 s PRO 796 N -2.42 -0.51 0.80 0.00 0.02 -1.26 -4.81 135.00 126.82 1yq2 s PRO 796 Ca 0.02 0.87 -0.12 0.00 0.02 0.00 0.00 61.00 61.79 1yq2 s PRO 796 Cb -0.01 -1.60 0.08 0.00 0.02 0.00 0.00 34.50 32.99 1yq2 s PRO 796 CO -0.05 -3.46 1.14 -1.54 -0.33 0.00 0.00 177.00 172.77 1yq2 s SER 797 N -2.69 3.89 0.23 2.53 1.04 -1.26 -4.89 113.70 112.56 1yq2 s SER 797 Ca 0.68 2.12 -0.06 0.00 0.48 0.00 0.00 55.95 59.16 1yq2 s SER 797 Cb -0.24 -2.56 0.31 0.00 0.10 0.00 0.00 66.02 63.63 1yq2 s SER 797 CO 0.63 -2.45 1.84 0.28 0.98 0.00 0.00 173.24 174.51 1yq2 h SER 798 N -1.06 0.75 -0.82 7.02 0.02 -1.60 -2.47 113.55 115.39 1yq2 h SER 798 Ca -0.45 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 60.55 1yq2 h SER 798 Cb 1.26 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.62 1yq2 h SER 798 CO 0.47 0.48 0.53 -0.08 -1.14 0.00 0.00 176.83 177.10 1yq2 h GLU 799 N 0.89 1.02 -0.38 3.45 4.81 -1.24 -0.25 114.58 122.87 1yq2 h GLU 799 Ca 0.35 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.55 1yq2 h GLU 799 Cb 0.18 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 1yq2 h GLU 799 CO -0.18 0.68 0.20 0.00 -0.73 0.00 0.00 179.01 178.97 1yq2 h ALA 800 N 1.33 0.47 -0.25 2.92 0.00 -1.72 -1.07 119.26 120.94 1yq2 h ALA 800 Ca 0.32 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 1yq2 h ALA 800 Cb -0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1yq2 h ALA 800 CO -0.10 -0.17 -0.41 -0.39 0.00 0.00 0.00 179.25 178.19 1yq2 h VAL 801 N 0.40 1.30 -0.48 0.00 -1.51 -1.19 -1.49 116.25 113.28 1yq2 h VAL 801 Ca 0.16 -1.58 -0.02 0.00 -1.23 0.00 0.00 66.70 64.04 1yq2 h VAL 801 Cb 0.06 1.54 -0.02 0.00 -2.13 0.00 0.00 31.29 30.74 1yq2 h VAL 801 CO -0.11 0.50 0.22 -0.50 -1.23 0.00 0.00 177.57 176.46 1yq2 h TRP 802 N 0.50 0.70 -0.36 5.19 6.55 -0.84 -1.48 115.95 126.21 1yq2 h TRP 802 Ca 0.04 -0.04 -0.14 0.00 0.95 0.00 0.00 58.89 59.71 1yq2 h TRP 802 Cb 0.92 -0.21 -0.01 0.00 -0.86 0.00 0.00 29.16 29.00 1yq2 h TRP 802 CO 0.04 0.56 -0.31 0.87 -1.05 0.00 0.00 178.44 178.55 1yq2 h LYS 803 N 0.63 0.85 -0.96 0.49 1.79 -1.09 -1.49 116.57 116.79 1yq2 h LYS 803 Ca 0.16 -0.43 0.05 0.00 -2.18 0.00 0.00 60.65 58.25 1yq2 h LYS 803 Cb 0.13 0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 30.73 1yq2 h LYS 803 CO -0.02 1.07 0.62 0.37 -1.08 0.00 0.00 179.45 180.42 1yq2 h GLN 804 N 0.64 1.13 0.00 3.15 4.15 -1.22 -1.60 115.11 121.37 1yq2 h GLN 804 Ca 0.06 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1yq2 h GLN 804 Cb 0.89 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 28.33 1yq2 h GLN 804 CO 0.08 0.75 0.00 0.00 -1.93 0.00 0.00 178.83 177.73 1yq2 n ALA 805 N -2.38 2.18 -1.30 3.38 0.00 -0.56 -4.93 120.51 116.90 1yq2 n ALA 805 Ca 0.13 -0.10 -0.06 0.00 0.00 0.00 0.00 53.44 53.41 1yq2 n ALA 805 Cb 0.13 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.16 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 0.93 0.78 0.29 0.00 0.00 -0.60 -4.78 105.19 101.80 1yq2 n GLY 806 Ca 0.09 -0.75 0.15 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.54 -1.04 115.31 117.10 1yq2 h LEU 807 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1yq2 h LEU 807 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1yq2 h LEU 807 CO 0.19 0.05 0.00 -0.90 0.09 0.00 0.00 178.44 177.87 1yq2 n ASP 808 N -3.64 0.00 -2.58 -0.43 5.75 -1.26 -3.84 116.55 110.55 1yq2 n ASP 808 Ca -0.02 0.44 -0.13 0.00 -0.01 0.00 0.00 54.79 55.07 1yq2 n ASP 808 Cb 0.16 -0.48 0.03 0.00 -1.03 0.00 0.00 41.12 39.79 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 -1.48 2.14 -2.08 0.11 1.85 -0.40 -4.95 116.66 111.85 1yq2 n ARG 809 Ca 0.07 -3.72 -0.41 0.00 -1.00 0.00 0.00 57.85 52.80 1yq2 n ARG 809 Cb 0.32 -1.70 -0.02 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 -3.46 4.39 0.03 2.89 1.43 -1.22 -4.37 118.68 118.36 1yq2 s LEU 810 Ca 0.35 2.72 0.02 0.00 -1.03 0.00 0.00 54.13 56.18 1yq2 s LEU 810 Cb 0.40 -3.69 -0.04 0.00 0.03 0.00 0.00 46.19 42.90 1yq2 s LEU 810 CO -0.03 -0.61 0.04 0.42 0.23 0.00 0.00 176.35 176.41 1yq2 s THR 811 N -1.16 4.38 -0.23 5.49 -4.23 0.46 -4.91 115.64 115.45 1yq2 s THR 811 Ca 0.50 -0.64 -0.08 0.00 -1.18 0.00 0.00 61.69 60.30 1yq2 s THR 811 Cb -0.40 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.38 1yq2 s THR 811 CO 0.53 0.28 0.09 -0.60 -0.54 0.00 0.00 174.62 174.38 1yq2 s ARG 812 N -1.89 3.84 -0.15 3.99 3.52 -1.26 -2.25 118.95 124.75 1yq2 s ARG 812 Ca 0.23 -0.39 0.02 0.00 -0.13 0.00 0.00 55.73 55.46 1yq2 s ARG 812 Cb -0.12 -3.34 0.01 0.00 -1.56 0.00 0.00 34.95 29.94 1yq2 s ARG 812 CO 0.15 0.00 -0.21 0.50 -0.81 0.00 0.00 175.30 174.93 1yq2 s ARG 813 N 1.13 3.04 -0.19 5.12 3.52 0.30 -4.97 118.95 126.90 1yq2 s ARG 813 Ca 0.05 -0.84 -0.28 0.00 -0.13 0.00 0.00 55.73 54.53 1yq2 s ARG 813 Cb -0.14 -2.47 -0.00 0.00 -1.56 0.00 0.00 34.95 30.78 1yq2 s ARG 813 CO 0.04 -0.03 0.98 0.08 -0.81 0.00 0.00 175.30 175.56 1yq2 s VAL 814 N 0.86 4.75 -0.16 7.11 1.01 -1.26 -0.32 120.40 132.39 1yq2 s VAL 814 Ca -0.06 1.94 -0.24 0.00 0.00 0.00 0.00 61.98 63.63 1yq2 s VAL 814 Cb -0.15 -4.27 -0.23 0.00 0.00 0.00 0.00 36.38 31.73 1yq2 s VAL 814 CO -0.03 -0.09 0.49 -0.33 0.00 0.00 0.00 175.10 175.14 1yq2 h GLU 815 N 7.36 0.04 -2.75 2.72 5.08 -1.01 -3.49 114.58 122.53 1yq2 h GLU 815 Ca -0.24 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.11 1yq2 h GLU 815 Cb 1.10 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 30.26 1yq2 h GLU 815 CO 0.92 1.03 0.31 0.16 -1.00 0.00 0.00 179.01 180.43 1yq2 s ASP 816 N -6.63 -0.42 -0.06 1.42 -4.77 -0.93 -5.01 116.67 100.28 1yq2 s ASP 816 Ca -0.23 -0.16 -0.03 0.00 -3.30 0.00 0.00 52.55 48.82 1yq2 s ASP 816 Cb 0.02 0.56 0.03 0.00 -1.09 0.00 0.00 42.92 42.45 1yq2 s ASP 816 CO 0.66 -0.95 0.13 -0.69 0.70 0.00 0.00 175.17 175.01 1yq2 s VAL 817 N -3.58 -0.04 -0.06 2.11 1.01 -1.26 -0.76 120.40 117.82 1yq2 s VAL 817 Ca 0.05 0.16 -0.09 0.00 0.00 0.00 0.00 61.98 62.10 1yq2 s VAL 817 Cb -0.02 -0.21 0.02 0.00 0.00 0.00 0.00 36.38 36.17 1yq2 s VAL 817 CO -0.06 0.07 0.24 0.00 0.00 0.00 0.00 175.10 175.34 1yq2 s ALA 818 N 1.01 -0.59 0.54 5.51 0.00 -0.39 -5.00 121.76 122.84 1yq2 s ALA 818 Ca -0.08 0.47 -0.20 0.00 0.00 0.00 0.00 51.96 52.15 1yq2 s ALA 818 Cb -0.10 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.75 1yq2 s ALA 818 CO -0.05 -0.16 1.20 0.00 0.00 0.00 0.00 175.76 176.75 1yq2 s ALA 819 N -0.43 2.72 0.35 0.00 0.00 -1.25 -0.36 121.76 122.78 1yq2 s ALA 819 Ca -0.05 0.99 0.09 0.00 0.00 0.00 0.00 51.96 52.99 1yq2 s ALA 819 Cb -0.04 -3.43 -0.06 0.00 0.00 0.00 0.00 23.12 19.59 1yq2 s ALA 819 CO 0.01 -0.97 -0.07 -0.51 0.00 0.00 0.00 175.76 174.22 1yq2 s LEU 820 N -3.68 2.79 -0.10 0.00 1.43 -0.14 -0.20 118.68 118.78 1yq2 s LEU 820 Ca 0.72 -1.17 -0.32 0.00 -1.03 0.00 0.00 54.13 52.33 1yq2 s LEU 820 Cb -0.30 -1.06 -0.10 0.00 0.03 0.00 0.00 46.19 44.76 1yq2 s LEU 820 CO 0.34 -0.22 1.98 -2.65 0.23 0.00 0.00 176.35 176.02 1yq2 n PRO 821 N -0.84 2.24 -4.15 1.29 -0.02 -1.26 -2.23 135.00 130.03 1yq2 n PRO 821 Ca -0.05 0.79 -0.31 0.00 -2.02 0.00 0.00 63.50 61.91 1yq2 n PRO 821 Cb 0.63 -2.80 -0.04 0.00 -0.02 0.00 0.00 33.50 31.27 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 7.78 -1.08 -0.40 2.55 8.00 -1.26 -4.80 116.55 127.33 1yq2 n ASP 822 Ca 0.24 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.66 1yq2 n ASP 822 Cb 0.34 -2.56 0.00 0.00 -0.02 0.00 0.00 41.12 38.88 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 -1.86 0.89 3.26 0.44 0.00 -0.95 -0.89 105.19 106.09 1yq2 n GLY 823 Ca -0.17 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.15 0.01 -0.11 -0.61 2.07 -0.47 -0.97 121.20 118.97 1yq2 s ILE 824 Ca 0.00 -0.10 0.02 0.00 -1.41 0.00 0.00 60.65 59.15 1yq2 s ILE 824 Cb 0.00 -0.55 -0.01 0.00 0.13 0.00 0.00 42.46 42.02 1yq2 s ILE 824 CO 0.00 -0.06 -0.17 -0.60 -1.91 0.00 0.00 174.94 172.21 1yq2 s ARG 825 N -0.16 3.14 -0.12 3.50 3.52 0.51 -1.38 118.95 127.97 1yq2 s ARG 825 Ca -0.03 -0.75 0.02 0.00 -0.13 0.00 0.00 55.73 54.84 1yq2 s ARG 825 Cb -0.03 -2.49 0.01 0.00 -1.56 0.00 0.00 34.95 30.88 1yq2 s ARG 825 CO 0.02 0.27 -0.18 0.08 -0.81 0.00 0.00 175.30 174.67 1yq2 s VAL 826 N 0.18 1.71 -0.14 7.11 1.01 -0.36 -1.27 120.40 128.65 1yq2 s VAL 826 Ca -0.10 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1yq2 s VAL 826 Cb -0.16 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 1yq2 s VAL 826 CO 0.06 0.48 -0.15 -0.13 0.00 0.00 0.00 175.10 175.36 1yq2 s ARG 827 N 0.89 3.29 0.27 2.72 0.52 0.07 -0.51 118.95 126.19 1yq2 s ARG 827 Ca -0.07 -0.73 0.02 0.00 -0.52 0.00 0.00 55.73 54.43 1yq2 s ARG 827 Cb -0.15 -2.59 -0.05 0.00 0.52 0.00 0.00 34.95 32.67 1yq2 s ARG 827 CO -0.01 0.14 0.07 0.95 0.02 0.00 0.00 175.30 176.47 1yq2 s THR 828 N 0.52 0.77 -0.04 0.02 -4.23 -0.07 -0.33 115.64 112.27 1yq2 s THR 828 Ca -0.10 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.39 1yq2 s THR 828 Cb -0.16 -2.61 0.03 0.00 1.34 0.00 0.00 72.50 71.09 1yq2 s THR 828 CO 0.04 -0.06 0.08 -0.60 -0.54 0.00 0.00 174.62 173.54 1yq2 s ARG 829 N -3.97 0.04 -0.05 3.99 6.06 0.56 -1.05 118.95 124.53 1yq2 s ARG 829 Ca 0.36 0.23 0.05 0.00 -2.50 0.00 0.00 55.73 53.86 1yq2 s ARG 829 Cb 0.08 -0.15 -0.02 0.00 0.06 0.00 0.00 34.95 34.91 1yq2 s ARG 829 CO 0.13 -0.13 -0.18 0.71 -2.50 0.00 0.00 175.30 173.33 1yq2 s TYR 830 N 0.84 2.59 -0.16 5.12 2.02 -0.01 -0.54 117.35 127.21 1yq2 s TYR 830 Ca -0.07 -0.29 -0.30 0.00 -0.37 0.00 0.00 57.07 56.05 1yq2 s TYR 830 Cb -0.09 -1.60 0.12 0.00 -0.40 0.00 0.00 41.96 39.99 1yq2 s TYR 830 CO -0.03 0.08 0.97 0.00 -1.57 0.00 0.00 175.55 175.00 1yq2 s ALA 831 N -0.61 -1.92 0.38 3.71 0.00 -0.95 -0.45 121.76 121.91 1yq2 s ALA 831 Ca 0.09 1.59 -0.18 0.00 0.00 0.00 0.00 51.96 53.46 1yq2 s ALA 831 Cb -0.11 -0.70 -0.10 0.00 0.00 0.00 0.00 23.12 22.21 1yq2 s ALA 831 CO 0.01 -0.31 0.85 0.00 0.00 0.00 0.00 175.76 176.31 1yq2 s ALA 832 N -1.01 3.17 0.23 0.00 0.00 -1.26 -0.40 121.76 122.49 1yq2 s ALA 832 Ca -0.02 0.23 -0.31 0.00 0.00 0.00 0.00 51.96 51.85 1yq2 s ALA 832 Cb -0.01 -2.97 -0.14 0.00 0.00 0.00 0.00 23.12 20.00 1yq2 s ALA 832 CO 0.02 0.21 1.27 0.00 0.00 0.00 0.00 175.76 177.26 1yq2 n ALA 833 N -0.55 0.34 -1.17 0.00 0.00 -1.26 -2.32 120.51 115.55 1yq2 n ALA 833 Ca 0.05 0.42 -0.06 0.00 0.00 0.00 0.00 53.44 53.86 1yq2 n ALA 833 Cb 0.54 -2.16 -0.03 0.00 0.00 0.00 0.00 19.45 17.80 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 1.87 -4.36 -4.60 0.00 4.64 -1.26 -4.98 116.55 107.86 1yq2 n ASP 834 Ca 0.12 0.15 -0.31 0.00 -1.38 0.00 0.00 54.79 53.36 1yq2 n ASP 834 Cb 0.30 -2.38 -0.10 0.00 -1.04 0.00 0.00 41.12 37.89 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 -2.51 4.60 0.00 1.67 0.15 -0.98 -5.01 113.70 111.62 1yq2 s SER 835 Ca 0.00 -0.21 0.26 0.00 0.70 0.00 0.00 55.95 56.69 1yq2 s SER 835 Cb 0.00 -1.03 0.53 0.00 -1.71 0.00 0.00 66.02 63.81 1yq2 s SER 835 CO 0.00 0.24 1.45 0.35 1.20 0.00 0.00 173.24 176.48 1yq2 n THR 836 N 1.24 0.00 -3.99 6.45 -2.24 -1.26 -4.82 114.28 109.66 1yq2 n THR 836 Ca -0.14 -0.38 -0.26 0.00 -2.27 0.00 0.00 64.05 60.99 1yq2 n THR 836 Cb 0.52 1.07 -0.04 0.00 -2.10 0.00 0.00 70.33 69.79 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 -2.03 3.37 0.27 4.78 3.76 -1.26 -5.08 115.29 119.10 1yq2 s HIS 837 Ca 0.31 0.08 -0.11 0.00 -0.15 0.00 0.00 55.06 55.19 1yq2 s HIS 837 Cb 0.20 -1.62 -0.00 0.00 1.11 0.00 0.00 32.58 32.27 1yq2 s HIS 837 CO 0.33 0.52 0.48 -1.54 -0.85 0.00 0.00 174.74 173.68 1yq2 s SER 838 N -3.17 0.06 -0.08 1.40 1.04 -1.26 -4.53 113.70 107.16 1yq2 s SER 838 Ca 0.33 -1.04 -0.01 0.00 0.48 0.00 0.00 55.95 55.72 1yq2 s SER 838 Cb -0.11 0.60 0.03 0.00 0.10 0.00 0.00 66.02 66.64 1yq2 s SER 838 CO 0.27 -1.18 -0.03 -0.69 0.98 0.00 0.00 173.24 172.59 1yq2 s VAL 839 N -3.80 0.61 0.20 5.02 1.01 0.40 -0.92 120.40 122.91 1yq2 s VAL 839 Ca 0.24 -0.06 -0.26 0.00 0.00 0.00 0.00 61.98 61.90 1yq2 s VAL 839 Cb -0.01 -0.70 -0.08 0.00 0.00 0.00 0.00 36.38 35.59 1yq2 s VAL 839 CO 0.11 0.29 0.82 0.00 0.00 0.00 0.00 175.10 176.32 1yq2 s ALA 840 N 1.67 3.41 -0.04 5.51 0.00 -0.73 -0.83 121.76 130.75 1yq2 s ALA 840 Ca 0.01 0.42 0.02 0.00 0.00 0.00 0.00 51.96 52.41 1yq2 s ALA 840 Cb -0.13 -3.02 0.01 0.00 0.00 0.00 0.00 23.12 19.98 1yq2 s ALA 840 CO -0.05 0.27 -0.06 0.08 0.00 0.00 0.00 175.76 176.00 1yq2 s VAL 841 N -1.20 0.61 -0.09 0.00 1.01 -0.22 0.02 120.40 120.53 1yq2 s VAL 841 Ca 0.38 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.19 1yq2 s VAL 841 Cb -0.23 -0.59 0.01 0.00 0.00 0.00 0.00 36.38 35.56 1yq2 s VAL 841 CO 0.27 0.22 -0.19 -0.70 0.00 0.00 0.00 175.10 174.71 1yq2 s GLU 842 N 0.62 2.45 -0.16 2.72 2.12 -0.07 -0.89 118.70 125.49 1yq2 s GLU 842 Ca -0.09 -0.67 -0.02 0.00 0.36 0.00 0.00 54.97 54.55 1yq2 s GLU 842 Cb -0.12 -1.92 -0.01 0.00 0.26 0.00 0.00 34.13 32.34 1yq2 s GLU 842 CO 0.01 0.09 -0.09 -1.21 -0.54 0.00 0.00 175.26 173.52 1yq2 s GLU 843 N 0.53 3.41 -0.33 4.30 2.02 0.33 -0.85 118.70 128.12 1yq2 s GLU 843 Ca -0.16 -0.65 0.01 0.00 0.02 0.00 0.00 54.97 54.19 1yq2 s GLU 843 Cb -0.17 -2.78 0.08 0.00 0.10 0.00 0.00 34.13 31.36 1yq2 s GLU 843 CO 0.06 0.08 0.04 -0.80 0.02 0.00 0.00 175.26 174.66 1yq2 s ASN 844 N 0.72 4.85 -0.20 -0.19 0.01 -0.14 -1.23 114.94 118.76 1yq2 s ASN 844 Ca -0.04 -1.76 -0.17 0.00 -0.71 0.00 0.00 52.86 50.17 1yq2 s ASN 844 Cb -0.15 -1.68 -0.04 0.00 0.41 0.00 0.00 41.25 39.79 1yq2 s ASN 844 CO 0.02 -0.35 0.46 0.26 -1.51 0.00 0.00 177.10 175.98 1yq2 s TRP 845 N 1.08 3.37 -0.05 2.20 0.52 -0.48 -1.17 118.94 124.42 1yq2 s TRP 845 Ca 0.02 0.70 -0.03 0.00 0.02 0.00 0.00 56.10 56.81 1yq2 s TRP 845 Cb -0.20 -2.60 0.03 0.00 -1.15 0.00 0.00 33.47 29.55 1yq2 s TRP 845 CO -0.05 -0.05 0.13 -0.65 0.02 0.00 0.00 176.95 176.35 1yq2 s GLN 846 N 1.46 0.10 -0.12 4.98 -0.21 0.50 -1.37 119.66 125.01 1yq2 s GLN 846 Ca 0.22 0.28 -0.28 0.00 0.02 0.00 0.00 55.36 55.60 1yq2 s GLN 846 Cb -0.15 -0.08 -0.01 0.00 1.00 0.00 0.00 33.01 33.76 1yq2 s GLN 846 CO 0.09 -0.10 0.93 -0.51 -2.12 0.00 0.00 175.29 173.57 1yq2 s LEU 847 N 0.71 4.23 -0.23 2.90 1.43 -0.07 -0.64 118.68 127.01 1yq2 s LEU 847 Ca -0.05 1.39 -0.02 0.00 -1.03 0.00 0.00 54.13 54.42 1yq2 s LEU 847 Cb -0.07 -3.42 0.07 0.00 0.03 0.00 0.00 46.19 42.80 1yq2 s LEU 847 CO -0.03 -0.41 0.04 -0.62 0.23 0.00 0.00 176.35 175.56 1yq2 s ASP 848 N 1.09 3.37 -1.36 2.29 3.68 0.11 -4.80 116.67 121.06 1yq2 s ASP 848 Ca 0.44 -1.11 -0.04 0.00 2.13 0.00 0.00 52.55 53.98 1yq2 s ASP 848 Cb -0.18 -0.75 0.02 0.00 -1.45 0.00 0.00 42.92 40.57 1yq2 s ASP 848 CO 0.16 -0.33 0.80 0.61 0.13 0.00 0.00 175.17 176.55 1yq2 n GLY 849 N 4.94 -0.35 3.45 2.66 0.00 -1.26 -1.43 105.19 113.21 1yq2 n GLY 849 Ca -0.07 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.60 0.41 3.81 -0.02 0.00 -1.26 -5.00 105.19 101.52 1yq2 n GLY 850 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.63 3.83 -0.37 1.61 2.02 -0.51 -5.02 118.70 119.62 1yq2 s GLU 851 Ca 0.00 -0.06 -0.26 0.00 0.02 0.00 0.00 54.97 54.67 1yq2 s GLU 851 Cb 0.00 -3.29 0.02 0.00 0.10 0.00 0.00 34.13 30.95 1yq2 s GLU 851 CO 0.00 0.55 0.91 -1.17 0.02 0.00 0.00 175.26 175.58 1yq2 s LEU 852 N -0.41 4.01 -0.14 1.80 2.96 -1.26 -0.71 118.68 124.93 1yq2 s LEU 852 Ca 0.14 0.53 -0.05 0.00 -0.22 0.00 0.00 54.13 54.53 1yq2 s LEU 852 Cb -0.12 -3.24 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 1yq2 s LEU 852 CO 0.03 -0.86 0.04 0.00 -1.32 0.00 0.00 176.35 174.24 1yq2 s LEU 854 N -0.20 1.78 -0.20 0.00 2.96 0.64 -0.37 118.68 123.30 1yq2 s LEU 854 Ca 0.07 -0.67 -0.06 0.00 -0.22 0.00 0.00 54.13 53.25 1yq2 s LEU 854 Cb -0.12 -1.04 -0.03 0.00 0.50 0.00 0.00 46.19 45.49 1yq2 s LEU 854 CO 0.02 -0.15 0.04 -0.60 -1.32 0.00 0.00 176.35 174.34 1yq2 s ARG 855 N 1.55 3.76 -0.22 1.98 3.52 -0.31 -0.87 118.95 128.36 1yq2 s ARG 855 Ca 0.01 -0.45 -0.00 0.00 -0.13 0.00 0.00 55.73 55.17 1yq2 s ARG 855 Cb -0.15 -3.17 0.02 0.00 -1.56 0.00 0.00 34.95 30.09 1yq2 s ARG 855 CO -0.08 0.08 -0.13 0.42 -0.81 0.00 0.00 175.30 174.78 1yq2 s ILE 856 N 0.86 2.49 -0.20 4.11 1.01 0.12 -0.97 121.20 128.61 1yq2 s ILE 856 Ca 0.02 -1.00 -0.06 0.00 0.00 0.00 0.00 60.65 59.61 1yq2 s ILE 856 Cb -0.14 -2.18 -0.03 0.00 0.01 0.00 0.00 42.46 40.12 1yq2 s ILE 856 CO 0.02 0.35 0.02 -1.81 0.00 0.00 0.00 174.94 173.52 1yq2 s ASP 857 N 1.30 5.04 -0.24 3.58 1.01 -0.03 -0.71 116.67 126.62 1yq2 s ASP 857 Ca 0.02 -0.14 -0.02 0.00 0.71 0.00 0.00 52.55 53.12 1yq2 s ASP 857 Cb -0.15 -1.87 0.02 0.00 1.01 0.00 0.00 42.92 41.93 1yq2 s ASP 857 CO -0.08 0.08 -0.07 -0.63 0.21 0.00 0.00 175.17 174.67 1yq2 s ILE 858 N 0.94 2.86 -0.41 0.77 1.01 0.13 -0.89 121.20 125.60 1yq2 s ILE 858 Ca 0.02 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.76 1yq2 s ILE 858 Cb -0.14 -2.40 0.13 0.00 0.01 0.00 0.00 42.46 40.05 1yq2 s ILE 858 CO 0.02 0.27 0.20 0.42 0.00 0.00 0.00 174.94 175.85 1yq2 s THR 859 N 1.35 1.46 0.53 2.92 -4.23 0.10 -1.81 115.64 115.95 1yq2 s THR 859 Ca 0.02 -2.38 -0.22 0.00 -1.18 0.00 0.00 61.69 57.93 1yq2 s THR 859 Cb -0.16 -2.04 -0.05 0.00 1.34 0.00 0.00 72.50 71.59 1yq2 s THR 859 CO -0.05 -0.83 1.28 -2.84 -0.54 0.00 0.00 174.62 171.64 1yq2 s PRO 860 N 0.58 3.27 1.04 3.99 0.02 -1.26 -1.77 135.00 140.88 1yq2 s PRO 860 Ca 0.16 2.04 -0.12 0.00 0.02 0.00 0.00 61.00 63.10 1yq2 s PRO 860 Cb -0.23 -2.24 0.22 0.00 0.02 0.00 0.00 34.50 32.27 1yq2 s PRO 860 CO -0.05 -1.02 1.08 -1.54 -0.33 0.00 0.00 177.00 175.13 1yq2 s SER 861 N -1.18 1.97 0.62 2.53 1.04 -0.10 -4.89 113.70 113.69 1yq2 s SER 861 Ca 0.70 1.75 -0.14 0.00 0.48 0.00 0.00 55.95 58.74 1yq2 s SER 861 Cb -0.35 -2.38 -0.03 0.00 0.10 0.00 0.00 66.02 63.36 1yq2 s SER 861 CO 0.42 -3.62 1.05 0.00 0.98 0.00 0.00 173.24 172.06 1yq2 s ALA 862 N -2.59 2.78 0.00 5.32 0.00 -1.26 -4.33 121.76 121.67 1yq2 s ALA 862 Ca 0.67 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.86 1yq2 s ALA 862 Cb -0.23 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1yq2 s ALA 862 CO 0.61 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1yq2 n GLY 863 N -1.50 1.22 3.67 0.00 0.00 -1.26 -4.91 105.19 102.40 1yq2 n GLY 863 Ca 0.08 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.65 1yq2 n GLY 863 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1yq2 n TRP 864 N -2.00 2.43 -3.05 1.61 7.02 -1.26 -4.90 117.44 117.28 1yq2 n TRP 864 Ca 0.00 -0.15 -0.20 0.00 -1.02 0.00 0.00 57.50 56.13 1yq2 n TRP 864 Cb 0.00 -2.72 -0.03 0.00 -2.42 0.00 0.00 31.31 26.14 1yq2 n TRP 864 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1yq2 n ASN 865 N 6.76 1.91 -3.68 -0.99 5.15 -1.26 -4.86 115.26 118.29 1yq2 n ASN 865 Ca 0.21 -3.17 -0.10 0.00 -0.60 0.00 0.00 54.58 50.92 1yq2 n ASN 865 Cb 0.35 -0.59 -0.04 0.00 -0.53 0.00 0.00 39.78 38.96 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 -2.79 0.16 0.40 1.20 2.34 -1.26 -5.14 118.68 113.59 1yq2 s LEU 866 Ca 0.41 -0.40 -0.27 0.00 0.06 0.00 0.00 54.13 53.93 1yq2 s LEU 866 Cb 0.35 2.04 -0.09 0.00 -0.56 0.00 0.00 46.19 47.92 1yq2 s LEU 866 CO -0.09 -0.97 1.38 -0.69 -1.06 0.00 0.00 176.35 174.92 1yq2 s VAL 867 N -3.84 2.37 -0.09 1.48 1.01 -1.26 -4.20 120.40 115.87 1yq2 s VAL 867 Ca 0.07 0.35 -0.04 0.00 0.00 0.00 0.00 61.98 62.36 1yq2 s VAL 867 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1yq2 s VAL 867 CO -0.07 0.06 0.07 0.26 0.00 0.00 0.00 175.10 175.43 1yq2 s TRP 868 N -1.19 3.35 0.20 5.22 0.51 -0.47 -4.91 118.94 121.64 1yq2 s TRP 868 Ca 0.55 0.33 -0.06 0.00 -2.12 0.00 0.00 56.10 54.80 1yq2 s TRP 868 Cb -0.42 -1.84 0.13 0.00 -0.81 0.00 0.00 33.47 30.53 1yq2 s TRP 868 CO 0.55 0.59 1.60 -1.35 -0.51 0.00 0.00 176.95 177.83 1yq2 h PRO 869 N 4.93 0.85 -2.97 4.98 0.11 -1.87 -3.39 132.00 134.63 1yq2 h PRO 869 Ca -0.52 -0.35 0.02 0.00 0.11 0.00 0.00 66.00 65.26 1yq2 h PRO 869 Cb 1.20 -0.03 -0.09 0.00 0.11 0.00 0.00 31.00 32.19 1yq2 h PRO 869 CO 0.57 0.99 0.23 -0.98 -0.21 0.00 0.00 178.00 178.60 1yq2 s ARG 870 N -4.62 1.47 -0.14 1.05 1.70 -1.11 -1.10 118.95 116.20 1yq2 s ARG 870 Ca -0.10 -0.68 -0.01 0.00 -0.47 0.00 0.00 55.73 54.47 1yq2 s ARG 870 Cb 0.13 0.59 0.04 0.00 -0.57 0.00 0.00 34.95 35.13 1yq2 s ARG 870 CO 0.85 -0.66 -0.04 0.42 -1.08 0.00 0.00 175.30 174.79 1yq2 s ILE 871 N -3.79 0.90 0.31 4.99 1.01 -0.42 -4.34 121.20 119.85 1yq2 s ILE 871 Ca 0.05 -0.40 -0.19 0.00 0.00 0.00 0.00 60.65 60.12 1yq2 s ILE 871 Cb -0.03 -1.07 0.06 0.00 0.01 0.00 0.00 42.46 41.43 1yq2 s ILE 871 CO -0.05 0.18 0.86 -0.83 0.00 0.00 0.00 174.94 175.11 1yq2 s GLY 872 N 1.73 0.22 0.07 6.18 0.00 -0.97 0.07 107.32 114.64 1yq2 s GLY 872 Ca 0.02 -0.54 0.06 0.00 0.00 0.00 0.00 44.72 44.26 1yq2 s GLY 872 CO -0.07 0.49 -0.17 -1.34 0.00 0.00 0.00 173.10 172.00 1yq2 s VAL 873 N -2.47 1.37 -0.06 1.40 -7.23 -0.14 -1.03 120.40 112.26 1yq2 s VAL 873 Ca 0.17 -1.33 0.02 0.00 -1.81 0.00 0.00 61.98 59.03 1yq2 s VAL 873 Cb -0.04 -1.27 -0.03 0.00 0.56 0.00 0.00 36.38 35.60 1yq2 s VAL 873 CO 0.09 -0.09 -0.11 -0.60 -0.31 0.00 0.00 175.10 174.08 1yq2 s ARG 874 N -1.64 2.61 -0.07 4.82 3.52 0.86 -0.82 118.95 128.22 1yq2 s ARG 874 Ca 0.02 -0.63 0.05 0.00 -0.13 0.00 0.00 55.73 55.04 1yq2 s ARG 874 Cb -0.10 -2.47 -0.01 0.00 -1.56 0.00 0.00 34.95 30.82 1yq2 s ARG 874 CO 0.03 0.64 -0.24 -1.58 -0.81 0.00 0.00 175.30 173.34 1yq2 s TRP 875 N -0.76 2.49 -0.26 5.12 0.52 0.31 -1.28 118.94 125.08 1yq2 s TRP 875 Ca 0.12 -0.71 -0.13 0.00 0.02 0.00 0.00 56.10 55.40 1yq2 s TRP 875 Cb -0.11 -1.62 -0.04 0.00 -1.15 0.00 0.00 33.47 30.54 1yq2 s TRP 875 CO 0.01 -0.21 0.27 -0.51 0.02 0.00 0.00 176.95 176.53 1yq2 s ASP 876 N -0.12 6.17 0.36 2.95 1.11 -0.02 -1.31 116.67 125.80 1yq2 s ASP 876 Ca -0.04 0.19 0.07 0.00 0.18 0.00 0.00 52.55 52.95 1yq2 s ASP 876 Cb -0.14 -2.16 -0.07 0.00 1.07 0.00 0.00 42.92 41.62 1yq2 s ASP 876 CO 0.04 -0.06 -0.03 -0.76 1.18 0.00 0.00 175.17 175.53 1yq2 s LEU 877 N 1.61 2.68 0.55 1.23 1.43 0.11 -1.95 118.68 124.35 1yq2 s LEU 877 Ca 0.11 -1.28 -0.21 0.00 -1.03 0.00 0.00 54.13 51.72 1yq2 s LEU 877 Cb -0.15 -0.83 -0.05 0.00 0.03 0.00 0.00 46.19 45.19 1yq2 s LEU 877 CO 0.09 -0.36 1.32 -2.65 0.23 0.00 0.00 176.35 174.98 1yq2 n PRO 878 N -0.81 1.60 0.29 1.29 -0.02 -1.26 -1.38 135.00 134.71 1yq2 n PRO 878 Ca -0.05 0.59 0.16 0.00 -2.02 0.00 0.00 63.50 62.18 1yq2 n PRO 878 Cb 0.65 -2.53 0.89 0.00 -0.02 0.00 0.00 33.50 32.49 1yq2 n PRO 878 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1yq2 h THR 879 N 1.32 0.44 0.00 3.45 1.35 -1.83 -2.08 112.91 115.56 1yq2 h THR 879 Ca -0.50 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1yq2 h THR 879 Cb 1.31 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 1yq2 h THR 879 CO 0.56 0.04 0.00 -0.90 -0.25 0.00 0.00 175.52 174.97 1yq2 n ASP 880 N -3.63 0.00 -4.59 5.36 5.68 -1.26 -4.50 116.55 113.61 1yq2 n ASP 880 Ca -0.02 -0.35 -0.42 0.00 -0.50 0.00 0.00 54.79 53.50 1yq2 n ASP 880 Cb 0.14 -0.15 -0.02 0.00 -1.14 0.00 0.00 41.12 39.94 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 3.86 0.00 2.12 1.01 -0.78 -3.43 120.40 120.87 1yq2 s VAL 881 Ca 0.27 0.81 0.06 0.00 0.00 0.00 0.00 61.98 63.12 1yq2 s VAL 881 Cb 0.15 -4.32 0.10 0.00 0.00 0.00 0.00 36.38 32.31 1yq2 s VAL 881 CO 0.30 -0.95 1.02 -0.90 0.00 0.00 0.00 175.10 174.57 1yq2 n ASP 882 N 9.18 0.21 -3.54 3.32 3.85 -0.70 -4.81 116.55 124.05 1yq2 n ASP 882 Ca 0.15 -1.97 -0.07 0.00 -0.71 0.00 0.00 54.79 52.19 1yq2 n ASP 882 Cb 0.49 -0.21 -0.02 0.00 -1.35 0.00 0.00 41.12 40.03 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 -1.19 -0.42 0.01 6.12 0.00 -1.22 -1.77 107.32 108.85 1yq2 s GLY 883 Ca 0.08 0.98 -0.07 0.00 0.00 0.00 0.00 44.72 45.71 1yq2 s GLY 883 CO -0.04 0.32 0.12 0.00 0.00 0.00 0.00 173.10 173.50 1yq2 s ALA 884 N -3.03 -0.28 0.11 3.20 0.00 0.04 -1.31 121.76 120.50 1yq2 s ALA 884 Ca 0.07 -0.20 0.10 0.00 0.00 0.00 0.00 51.96 51.93 1yq2 s ALA 884 Cb -0.01 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 1yq2 s ALA 884 CO -0.07 -0.21 -0.26 0.00 0.00 0.00 0.00 175.76 175.22 1yq2 s ALA 885 N -1.46 2.39 0.14 0.00 0.00 -0.14 -0.53 121.76 122.16 1yq2 s ALA 885 Ca -0.14 -1.42 -0.17 0.00 0.00 0.00 0.00 51.96 50.23 1yq2 s ALA 885 Cb -0.08 -0.43 0.04 0.00 0.00 0.00 0.00 23.12 22.65 1yq2 s ALA 885 CO 0.01 0.54 0.44 1.67 0.00 0.00 0.00 175.76 178.43 1yq2 s TRP 886 N -1.02 -0.23 -0.23 0.00 -2.14 -0.11 -0.47 118.94 114.75 1yq2 s TRP 886 Ca 0.14 -0.08 -0.03 0.00 2.66 0.00 0.00 56.10 58.79 1yq2 s TRP 886 Cb -0.10 0.32 0.00 0.00 -3.10 0.00 0.00 33.47 30.59 1yq2 s TRP 886 CO 0.06 -0.75 -0.06 0.12 -2.66 0.00 0.00 176.95 173.66 1yq2 s PHE 887 N -3.81 2.97 -4.41 1.66 5.36 -0.84 -0.33 117.98 118.58 1yq2 s PHE 887 Ca 0.04 -1.15 0.00 0.00 -0.96 0.00 0.00 56.93 54.85 1yq2 s PHE 887 Cb 0.01 -2.08 0.00 0.00 -0.34 0.00 0.00 43.02 40.61 1yq2 s PHE 887 CO -0.11 -0.62 0.00 0.41 -1.46 0.00 0.00 175.22 173.44 1yq2 n GLY 888 N 4.75 -0.57 3.74 13.12 0.00 -0.85 -0.61 105.19 124.77 1yq2 n GLY 888 Ca -0.18 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 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 3.48 0.01 4.61 0.00 -0.49 -2.36 121.76 126.01 1yq2 s ALA 889 Ca 0.00 1.03 -0.06 0.00 0.00 0.00 0.00 51.96 52.94 1yq2 s ALA 889 Cb 0.00 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.70 1yq2 s ALA 889 CO 0.00 -0.45 0.26 0.41 0.00 0.00 0.00 175.76 175.98 1yq2 n GLY 890 N 2.12 0.80 0.01 0.00 0.00 -0.58 -4.21 105.19 103.33 1yq2 n GLY 890 Ca 0.05 -0.92 0.12 0.00 0.00 0.00 0.00 46.02 45.27 1yq2 n GLY 890 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1yq2 n PRO 891 N -0.19 0.03 -2.90 1.61 -0.04 -1.26 -0.10 135.00 132.15 1yq2 n PRO 891 Ca 0.00 0.01 -0.19 0.00 -0.04 0.00 0.00 63.50 63.28 1yq2 n PRO 891 Cb 0.13 -1.52 0.04 0.00 -0.04 0.00 0.00 33.50 32.11 1yq2 n PRO 891 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1yq2 s ARG 892 N -3.02 2.51 0.65 0.54 0.52 -1.26 -4.99 118.95 113.91 1yq2 s ARG 892 Ca 0.10 -1.24 -0.17 0.00 -0.52 0.00 0.00 55.73 53.90 1yq2 s ARG 892 Cb 0.17 -2.63 -0.03 0.00 0.52 0.00 0.00 34.95 32.98 1yq2 s ARG 892 CO 0.70 -0.64 0.94 -0.85 0.02 0.00 0.00 175.30 175.47 1yq2 n GLU 893 N -2.16 0.72 -3.76 3.54 0.28 -1.26 -4.85 120.64 113.15 1yq2 n GLU 893 Ca 0.11 0.29 -0.13 0.00 -0.16 0.00 0.00 57.16 57.27 1yq2 n GLU 893 Cb 0.60 -2.17 -0.09 0.00 1.43 0.00 0.00 31.44 31.22 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 -1.40 -0.20 0.14 -1.84 1.04 0.00 -4.99 113.70 106.45 1yq2 s SER 894 Ca 0.75 0.10 0.02 0.00 0.48 0.00 0.00 55.95 57.30 1yq2 s SER 894 Cb -0.39 0.32 -0.04 0.00 0.10 0.00 0.00 66.02 66.01 1yq2 s SER 894 CO 0.48 -0.44 -0.02 -0.31 0.98 0.00 0.00 173.24 173.92 1yq2 s TYR 895 N -1.30 1.06 0.39 5.02 1.51 -1.09 -4.50 117.35 118.44 1yq2 s TYR 895 Ca -0.13 -0.98 0.14 0.00 -1.01 0.00 0.00 57.07 55.08 1yq2 s TYR 895 Cb -0.05 -0.60 0.97 0.00 -0.11 0.00 0.00 41.96 42.17 1yq2 s TYR 895 CO 0.04 -0.20 1.87 -1.35 -1.11 0.00 0.00 175.55 174.80 1yq2 h PRO 896 N 2.82 0.50 -0.62 -1.71 0.11 -1.82 0.10 132.00 131.38 1yq2 h PRO 896 Ca -0.36 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1yq2 h PRO 896 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1yq2 h PRO 896 CO 0.63 0.33 0.00 -0.40 -0.21 0.00 0.00 178.00 178.36 1yq2 n ASP 897 N -4.53 3.70 -3.16 -2.05 5.75 -1.26 -4.55 116.55 110.45 1yq2 n ASP 897 Ca 0.18 -2.22 -0.22 0.00 -0.01 0.00 0.00 54.79 52.52 1yq2 n ASP 897 Cb 0.58 -0.48 -0.06 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 1.05 -0.39 -0.03 -1.12 2.88 0.35 -4.05 113.62 112.32 1yq2 n SER 898 Ca 0.21 -2.72 0.01 0.00 -1.33 0.00 0.00 58.87 55.04 1yq2 n SER 898 Cb 0.66 -0.28 -0.00 0.00 -0.75 0.00 0.00 64.21 63.84 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 1.70 3.33 -0.10 -1.46 2.81 -1.24 -2.68 117.12 119.49 1yq2 n MET 899 Ca 0.21 -0.26 -0.03 0.00 -1.81 0.00 0.00 57.70 55.81 1yq2 n MET 899 Cb 0.53 -0.77 0.20 0.00 -0.71 0.00 0.00 33.22 32.47 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 0.14 0.79 -0.61 2.03 3.86 -1.93 -2.89 115.15 116.54 1yq2 h HIS 900 Ca 0.00 -0.09 -0.31 0.00 -1.16 0.00 0.00 60.37 58.81 1yq2 h HIS 900 Cb 0.05 -0.22 -0.19 0.00 1.06 0.00 0.00 27.41 28.11 1yq2 h HIS 900 CO 0.00 0.71 0.40 0.00 0.86 0.00 0.00 177.93 179.90 1yq2 n ALA 901 N -2.47 4.38 -2.75 2.45 0.00 -1.26 -4.89 120.51 115.97 1yq2 n ALA 901 Ca 0.03 -1.76 -0.28 0.00 0.00 0.00 0.00 53.44 51.42 1yq2 n ALA 901 Cb 0.26 -1.27 -0.07 0.00 0.00 0.00 0.00 19.45 18.38 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 -2.02 4.27 0.05 0.00 -4.23 -1.09 -4.67 115.64 107.95 1yq2 s THR 902 Ca 0.35 -1.05 0.06 0.00 -1.18 0.00 0.00 61.69 59.87 1yq2 s THR 902 Cb 0.29 -3.12 -0.02 0.00 1.34 0.00 0.00 72.50 70.99 1yq2 s THR 902 CO 0.07 -0.01 -0.18 -0.04 -0.54 0.00 0.00 174.62 173.92 1yq2 s MET 903 N -2.76 1.15 -0.28 3.99 -1.94 0.85 -4.86 119.30 115.45 1yq2 s MET 903 Ca 0.29 -0.88 -0.25 0.00 -1.71 0.00 0.00 55.69 53.13 1yq2 s MET 903 Cb -0.11 -1.23 0.00 0.00 2.01 0.00 0.00 34.83 35.50 1yq2 s MET 903 CO 0.21 0.31 0.88 0.08 -0.01 0.00 0.00 175.02 176.49 1yq2 s VAL 904 N -0.87 4.74 0.04 -6.03 1.01 -1.26 -1.53 120.40 116.50 1yq2 s VAL 904 Ca 0.05 1.48 -0.07 0.00 0.00 0.00 0.00 61.98 63.44 1yq2 s VAL 904 Cb -0.09 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 32.11 1yq2 s VAL 904 CO 0.02 -0.24 0.33 0.00 0.00 0.00 0.00 175.10 175.21 1yq2 n ALA 905 N 6.30 -0.90 -2.68 5.51 0.00 -1.00 -4.94 120.51 122.80 1yq2 n ALA 905 Ca 0.07 -0.29 -0.38 0.00 0.00 0.00 0.00 53.44 52.84 1yq2 n ALA 905 Cb 0.48 0.13 -0.07 0.00 0.00 0.00 0.00 19.45 19.99 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 -2.01 4.21 0.17 0.00 3.52 -1.26 -2.00 118.95 121.58 1yq2 s ARG 906 Ca 0.08 0.27 0.08 0.00 -0.13 0.00 0.00 55.73 56.02 1yq2 s ARG 906 Cb -0.01 -3.51 -0.04 0.00 -1.56 0.00 0.00 34.95 29.83 1yq2 s ARG 906 CO 0.01 0.00 -0.17 -1.01 -0.81 0.00 0.00 175.30 173.33 1yq2 s HIS 907 N 1.17 1.73 -0.04 5.12 3.76 0.55 -4.99 115.29 122.59 1yq2 s HIS 907 Ca 0.21 -0.50 -0.07 0.00 -0.15 0.00 0.00 55.06 54.54 1yq2 s HIS 907 Cb -0.15 -0.86 0.01 0.00 1.11 0.00 0.00 32.58 32.70 1yq2 s HIS 907 CO 0.08 0.31 0.17 0.00 -0.85 0.00 0.00 174.74 174.45 1yq2 s ALA 908 N -2.26 -0.42 -0.25 -1.40 0.00 -1.26 -0.94 121.76 115.24 1yq2 s ALA 908 Ca 0.16 0.27 -0.23 0.00 0.00 0.00 0.00 51.96 52.16 1yq2 s ALA 908 Cb -0.05 -0.13 0.07 0.00 0.00 0.00 0.00 23.12 23.01 1yq2 s ALA 908 CO 0.06 -0.14 0.67 0.00 0.00 0.00 0.00 175.76 176.36 1yq2 s ALA 909 N -0.51 -1.67 0.93 0.00 0.00 0.31 -4.99 121.76 115.83 1yq2 s ALA 909 Ca -0.06 1.92 -0.13 0.00 0.00 0.00 0.00 51.96 53.69 1yq2 s ALA 909 Cb -0.04 -1.11 0.15 0.00 0.00 0.00 0.00 23.12 22.12 1yq2 s ALA 909 CO 0.01 -0.32 1.14 -1.54 0.00 0.00 0.00 175.76 175.05 1yq2 s SER 910 N 0.41 3.36 0.24 0.00 1.04 -1.26 -0.78 113.70 116.70 1yq2 s SER 910 Ca -0.00 0.94 -0.05 0.00 0.48 0.00 0.00 55.95 57.31 1yq2 s SER 910 Cb -0.05 -1.49 0.43 0.00 0.10 0.00 0.00 66.02 65.01 1yq2 s SER 910 CO 0.00 -2.64 1.72 -0.07 0.98 0.00 0.00 173.24 173.22 1yq2 h LEU 911 N -1.56 0.19 -1.42 2.42 3.38 -1.72 0.23 115.31 116.83 1yq2 h LEU 911 Ca -0.50 0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.52 1yq2 h LEU 911 Cb 1.33 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.19 1yq2 h LEU 911 CO 0.60 0.06 -0.26 -0.33 0.09 0.00 0.00 178.44 178.61 1yq2 h GLU 912 N 0.38 0.05 0.00 1.13 3.07 -1.88 -2.40 114.58 114.94 1yq2 h GLU 912 Ca 0.40 -0.01 -0.18 0.00 -0.50 0.00 0.00 59.36 59.06 1yq2 h GLU 912 Cb 0.61 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.49 1yq2 h GLU 912 CO -0.42 0.31 -0.85 0.93 -1.40 0.00 0.00 179.01 177.58 1yq2 h GLU 913 N 0.05 0.00 -0.25 2.33 5.08 -1.69 -3.35 114.58 116.75 1yq2 h GLU 913 Ca 0.01 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 1yq2 h GLU 913 Cb 0.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1yq2 h GLU 913 CO 0.03 0.84 -0.16 -0.07 -1.00 0.00 0.00 179.01 178.66 1yq2 h LEU 914 N 0.00 0.57 -9.10 1.33 3.38 -0.51 -3.46 115.31 107.52 1yq2 h LEU 914 Ca -0.01 -0.43 -0.68 0.00 0.09 0.00 0.00 57.88 56.85 1yq2 h LEU 914 Cb 1.65 -0.16 -0.19 0.00 0.09 0.00 0.00 40.66 42.06 1yq2 h LEU 914 CO 0.11 0.88 -0.69 0.20 0.09 0.00 0.00 178.44 179.03 1yq2 s ASN 915 N -6.27 4.70 -0.15 -0.43 0.01 -0.97 -4.12 114.94 107.72 1yq2 s ASN 915 Ca -0.13 -0.02 -0.17 0.00 -0.71 0.00 0.00 52.86 51.83 1yq2 s ASN 915 Cb 0.07 -1.24 -0.04 0.00 0.41 0.00 0.00 41.25 40.45 1yq2 s ASN 915 CO 0.79 0.35 0.44 -0.69 -1.51 0.00 0.00 177.10 176.47 1yq2 s VAL 916 N -0.72 5.20 -1.32 1.60 1.01 -1.26 -4.82 120.40 120.09 1yq2 s VAL 916 Ca 0.11 0.84 -0.14 0.00 0.00 0.00 0.00 61.98 62.79 1yq2 s VAL 916 Cb -0.11 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1yq2 s VAL 916 CO 0.02 0.31 2.30 -0.81 0.00 0.00 0.00 175.10 176.92 1yq2 n PRO 917 N 3.90 2.70 -1.75 2.72 -0.04 -1.26 -4.94 135.00 136.32 1yq2 n PRO 917 Ca -0.08 -2.29 -0.38 0.00 -0.04 0.00 0.00 63.50 60.71 1yq2 n PRO 917 Cb 0.51 -3.06 0.05 0.00 -0.04 0.00 0.00 33.50 30.96 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 3.36 2.21 0.28 0.54 1.51 -1.26 -4.89 117.35 119.11 1yq2 s TYR 918 Ca 0.53 1.38 0.00 0.00 -1.01 0.00 0.00 57.07 57.97 1yq2 s TYR 918 Cb 0.15 -3.81 0.50 0.00 -0.11 0.00 0.00 41.96 38.69 1yq2 s TYR 918 CO -0.04 -2.98 1.88 0.00 -1.11 0.00 0.00 175.55 173.29 1yq2 h ALA 919 N 1.27 1.49 -2.97 3.71 0.00 -1.93 -3.33 119.26 117.49 1yq2 h ALA 919 Ca -0.51 -0.01 -0.66 0.00 0.00 0.00 0.00 54.91 53.73 1yq2 h ALA 919 Cb 1.31 -0.26 -0.24 0.00 0.00 0.00 0.00 17.79 18.59 1yq2 h ALA 919 CO 0.56 0.34 -0.62 0.50 0.00 0.00 0.00 179.25 180.03 1yq2 s ARG 920 N -5.96 3.36 0.19 0.00 3.52 -1.26 -4.35 118.95 114.44 1yq2 s ARG 920 Ca -0.12 -0.68 -0.33 0.00 -0.13 0.00 0.00 55.73 54.47 1yq2 s ARG 920 Cb 0.21 -3.35 -0.14 0.00 -1.56 0.00 0.00 34.95 30.10 1yq2 s ARG 920 CO 0.81 -0.33 1.37 -2.30 -0.81 0.00 0.00 175.30 174.04 1yq2 n PRO 921 N 4.90 1.73 -3.83 5.12 -0.02 -1.25 -4.95 135.00 136.70 1yq2 n PRO 921 Ca -0.15 0.62 -0.06 0.00 -2.02 0.00 0.00 63.50 61.88 1yq2 n PRO 921 Cb 0.50 -2.26 0.01 0.00 -0.02 0.00 0.00 33.50 31.73 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 -0.03 1.77 -0.04 -0.52 -2.07 -1.26 -4.63 119.66 112.88 1yq2 s GLN 922 Ca 0.73 -1.10 -0.38 0.00 -1.82 0.00 0.00 55.36 52.79 1yq2 s GLN 922 Cb -0.74 0.52 -0.17 0.00 -1.09 0.00 0.00 33.01 31.53 1yq2 s GLN 922 CO 0.48 -0.83 1.42 -1.91 -1.32 0.00 0.00 175.29 173.13 1yq2 n GLU 923 N -0.56 0.98 -3.46 9.60 4.07 0.39 -4.93 120.64 126.74 1yq2 n GLU 923 Ca -0.06 0.36 -0.14 0.00 -0.06 0.00 0.00 57.16 57.26 1yq2 n GLU 923 Cb 0.60 -1.99 -0.04 0.00 -0.06 0.00 0.00 31.44 29.95 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 1.30 0.00 0.00 6.31 -1.32 -1.26 -4.77 115.64 115.90 1yq2 s THR 924 Ca 0.89 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.37 1yq2 s THR 924 Cb -1.04 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 68.95 1yq2 s THR 924 CO 0.54 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.56 1yq2 n GLY 925 N 0.15 0.60 3.67 6.08 0.00 -1.26 -4.87 105.19 109.55 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 -2.37 1.79 -0.22 1.61 5.04 -1.26 -4.54 115.29 115.33 1yq2 s HIS 926 Ca 0.00 -0.05 -0.09 0.00 -1.54 0.00 0.00 55.06 53.39 1yq2 s HIS 926 Cb 0.00 -4.06 -0.04 0.00 0.04 0.00 0.00 32.58 28.52 1yq2 s HIS 926 CO 0.00 -4.56 0.10 1.03 -2.34 0.00 0.00 174.74 168.97 1yq2 s ARG 927 N 3.90 3.92 0.41 2.88 1.81 0.10 -0.82 118.95 131.16 1yq2 s ARG 927 Ca 0.80 -0.35 0.01 0.00 -1.72 0.00 0.00 55.73 54.46 1yq2 s ARG 927 Cb -0.39 -3.38 -0.01 0.00 -0.45 0.00 0.00 34.95 30.72 1yq2 s ARG 927 CO 0.35 0.05 0.62 -1.12 -0.68 0.00 0.00 175.30 174.52 1yq2 s SER 928 N 1.01 5.98 -1.34 0.23 0.01 -1.26 -1.21 113.70 117.12 1yq2 s SER 928 Ca 0.05 0.29 -0.05 0.00 1.31 0.00 0.00 55.95 57.55 1yq2 s SER 928 Cb -0.14 -1.65 0.02 0.00 0.21 0.00 0.00 66.02 64.46 1yq2 s SER 928 CO 0.03 -0.56 0.95 0.47 0.41 0.00 0.00 173.24 174.55 1yq2 n ASP 929 N -1.95 -3.39 -4.69 2.44 10.43 -1.16 -1.40 116.55 116.83 1yq2 n ASP 929 Ca -0.01 -0.70 -0.41 0.00 2.57 0.00 0.00 54.79 56.24 1yq2 n ASP 929 Cb 0.57 -4.52 -0.04 0.00 1.84 0.00 0.00 41.12 38.98 1yq2 n ASP 929 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1yq2 s VAL 930 N -3.43 4.89 -0.10 2.53 1.01 0.18 -3.92 120.40 121.56 1yq2 s VAL 930 Ca 0.28 1.75 -0.26 0.00 0.00 0.00 0.00 61.98 63.74 1yq2 s VAL 930 Cb -0.13 -4.18 -0.27 0.00 0.00 0.00 0.00 36.38 31.79 1yq2 s VAL 930 CO 0.78 0.08 0.83 0.03 0.00 0.00 0.00 175.10 176.82 1yq2 h ARG 931 N 7.11 0.11 -3.12 2.72 -0.00 -1.16 -3.39 114.38 116.65 1yq2 h ARG 931 Ca -0.33 -0.18 -0.08 0.00 -0.50 0.00 0.00 59.98 58.90 1yq2 h ARG 931 Cb 1.16 0.06 -0.16 0.00 0.00 0.00 0.00 29.97 31.03 1yq2 h ARG 931 CO 0.82 1.07 -0.12 1.67 0.00 0.00 0.00 179.97 183.40 1yq2 s TRP 932 N -2.37 -0.23 0.04 3.04 1.48 -1.23 -0.68 118.94 118.99 1yq2 s TRP 932 Ca -0.17 0.14 0.03 0.00 -1.06 0.00 0.00 56.10 55.04 1yq2 s TRP 932 Cb -0.01 0.20 -0.02 0.00 -1.16 0.00 0.00 33.47 32.48 1yq2 s TRP 932 CO 0.74 -0.58 -0.09 -0.48 -4.06 0.00 0.00 176.95 172.48 1yq2 s LEU 933 N -2.12 2.21 -0.08 -4.66 0.05 -0.43 -1.98 118.68 111.67 1yq2 s LEU 933 Ca -0.04 -0.48 0.00 0.00 0.05 0.00 0.00 54.13 53.66 1yq2 s LEU 933 Cb -0.00 -0.28 0.02 0.00 -2.05 0.00 0.00 46.19 43.88 1yq2 s LEU 933 CO -0.04 -0.12 -0.07 -0.70 -0.55 0.00 0.00 176.35 174.87 1yq2 s GLU 934 N -1.33 1.32 -0.00 1.48 2.12 0.38 -0.68 118.70 121.98 1yq2 s GLU 934 Ca -0.06 -0.22 -0.15 0.00 0.36 0.00 0.00 54.97 54.91 1yq2 s GLU 934 Cb -0.09 -1.31 -0.06 0.00 0.26 0.00 0.00 34.13 32.93 1yq2 s GLU 934 CO 0.01 -0.16 0.42 -0.51 -0.54 0.00 0.00 175.26 174.47 1yq2 s LEU 935 N 1.32 4.47 0.09 2.70 1.43 -0.10 -0.97 118.68 127.63 1yq2 s LEU 935 Ca -0.03 0.97 0.07 0.00 -1.03 0.00 0.00 54.13 54.11 1yq2 s LEU 935 Cb -0.14 -2.60 -0.04 0.00 0.03 0.00 0.00 46.19 43.45 1yq2 s LEU 935 CO -0.03 0.31 -0.11 -1.81 0.23 0.00 0.00 176.35 174.95 1yq2 s ASP 936 N -1.02 4.35 -0.43 2.29 1.01 -0.43 -0.16 116.67 122.28 1yq2 s ASP 936 Ca 0.24 -0.38 -0.02 0.00 0.71 0.00 0.00 52.55 53.09 1yq2 s ASP 936 Cb -0.17 -0.82 0.12 0.00 1.01 0.00 0.00 42.92 43.05 1yq2 s ASP 936 CO 0.13 0.19 0.22 -0.13 0.21 0.00 0.00 175.17 175.80 1yq2 s ARG 937 N -2.10 2.03 -1.31 8.23 0.52 0.94 -1.72 118.95 125.54 1yq2 s ARG 937 Ca 0.20 -1.91 -0.01 0.00 -0.52 0.00 0.00 55.73 53.49 1yq2 s ARG 937 Cb -0.11 -3.58 0.01 0.00 0.52 0.00 0.00 34.95 31.79 1yq2 s ARG 937 CO 0.13 -1.08 0.78 0.00 0.02 0.00 0.00 175.30 175.15 1yq2 n ALA 938 N 4.44 -1.94 0.00 2.13 0.00 -1.22 -2.59 120.51 121.33 1yq2 n ALA 938 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1yq2 n ALA 938 Cb 0.41 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 3.02 3.61 0.00 0.00 -1.26 -5.01 105.19 104.03 1yq2 n GLY 939 Ca -0.27 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.90 3.58 0.11 4.61 0.00 -1.07 -5.00 121.76 122.09 1yq2 s ALA 940 Ca 0.00 -0.67 -0.35 0.00 0.00 0.00 0.00 51.96 50.94 1yq2 s ALA 940 Cb 0.00 -2.86 -0.15 0.00 0.00 0.00 0.00 23.12 20.11 1yq2 s ALA 940 CO 0.00 -0.74 1.50 -2.30 0.00 0.00 0.00 175.76 174.22 1yq2 n PRO 941 N 5.51 1.73 0.03 0.00 -0.02 -1.26 -0.04 135.00 140.93 1yq2 n PRO 941 Ca -0.05 0.62 -0.02 0.00 -2.02 0.00 0.00 63.50 62.04 1yq2 n PRO 941 Cb 0.50 -2.34 -0.01 0.00 -0.02 0.00 0.00 33.50 31.63 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 3.25 0.00 -4.66 6.00 -0.00 0.78 -4.67 117.44 118.13 1yq2 n TRP 942 Ca 0.18 0.00 -0.24 0.00 -0.00 0.00 0.00 57.50 57.44 1yq2 n TRP 942 Cb 0.24 -0.08 -0.16 0.00 -0.00 0.00 0.00 31.31 31.31 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 -7.05 1.79 -0.08 5.87 2.96 -1.07 -1.33 118.68 119.77 1yq2 s LEU 943 Ca -0.04 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.58 1yq2 s LEU 943 Cb 0.01 -0.84 -0.03 0.00 0.50 0.00 0.00 46.19 45.83 1yq2 s LEU 943 CO 0.06 0.09 -0.10 -0.60 -1.32 0.00 0.00 176.35 174.49 1yq2 s ARG 944 N 0.31 2.83 -0.18 1.98 3.52 0.99 -0.92 118.95 127.48 1yq2 s ARG 944 Ca -0.08 -0.61 0.01 0.00 -0.13 0.00 0.00 55.73 54.92 1yq2 s ARG 944 Cb -0.13 -2.55 0.03 0.00 -1.56 0.00 0.00 34.95 30.74 1yq2 s ARG 944 CO 0.03 0.55 -0.17 0.42 -0.81 0.00 0.00 175.30 175.32 1yq2 s ILE 945 N -0.53 1.89 -0.10 4.11 1.01 0.14 -1.14 121.20 126.58 1yq2 s ILE 945 Ca 0.07 -0.90 -0.11 0.00 0.00 0.00 0.00 60.65 59.71 1yq2 s ILE 945 Cb -0.12 -1.76 -0.05 0.00 0.01 0.00 0.00 42.46 40.54 1yq2 s ILE 945 CO 0.02 0.45 0.26 -1.81 0.00 0.00 0.00 174.94 173.85 1yq2 s ASP 946 N 1.34 6.51 -0.09 3.58 1.01 0.18 -1.31 116.67 127.89 1yq2 s ASP 946 Ca 0.04 0.60 0.02 0.00 0.71 0.00 0.00 52.55 53.92 1yq2 s ASP 946 Cb -0.14 -2.15 -0.02 0.00 1.01 0.00 0.00 42.92 41.62 1yq2 s ASP 946 CO -0.11 0.28 -0.16 0.00 0.21 0.00 0.00 175.17 175.39 1yq2 s ALA 947 N -0.52 2.53 -0.03 5.23 0.00 0.14 -0.93 121.76 128.18 1yq2 s ALA 947 Ca 0.17 -0.95 -0.09 0.00 0.00 0.00 0.00 51.96 51.10 1yq2 s ALA 947 Cb -0.14 -1.02 -0.05 0.00 0.00 0.00 0.00 23.12 21.91 1yq2 s ALA 947 CO 0.06 0.37 0.27 -1.21 0.00 0.00 0.00 175.76 175.25 1yq2 s GLU 948 N -0.06 3.62 0.69 0.00 2.02 0.16 -4.76 118.70 120.37 1yq2 s GLU 948 Ca -0.04 0.04 -0.16 0.00 0.02 0.00 0.00 54.97 54.83 1yq2 s GLU 948 Cb -0.14 -3.15 0.01 0.00 0.10 0.00 0.00 34.13 30.96 1yq2 s GLU 948 CO 0.04 0.70 1.19 -2.14 0.02 0.00 0.00 175.26 175.07 1yq2 s PRO 949 N -1.35 2.45 0.36 0.39 0.02 -1.26 -4.36 135.00 131.24 1yq2 s PRO 949 Ca 0.23 1.72 -0.06 0.00 0.02 0.00 0.00 61.00 62.90 1yq2 s PRO 949 Cb -0.14 -1.88 0.08 0.00 0.02 0.00 0.00 34.50 32.59 1yq2 s PRO 949 CO 0.11 -1.59 0.49 -0.40 -0.33 0.00 0.00 177.00 175.29 1yq2 n ASP 950 N -2.40 0.07 -0.29 2.53 5.68 -0.26 -4.80 116.55 117.08 1yq2 n ASP 950 Ca 0.13 -1.20 0.12 0.00 -0.50 0.00 0.00 54.79 53.34 1yq2 n ASP 950 Cb 0.50 -0.37 0.36 0.00 -1.14 0.00 0.00 41.12 40.47 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 -1.81 1.79 -0.02 2.12 0.00 -1.94 -0.66 119.26 118.72 1yq2 h ALA 951 Ca -0.16 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1yq2 h ALA 951 Cb 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1yq2 h ALA 951 CO 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1yq2 n ALA 952 N -2.42 2.62 -0.70 0.00 0.00 -1.26 -4.90 120.51 113.86 1yq2 n ALA 952 Ca 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1yq2 n ALA 952 Cb 0.47 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.58 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 0.97 0.70 3.77 0.00 0.00 -0.26 -5.04 105.19 105.34 1yq2 n GLY 953 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.30 4.62 0.05 1.61 0.52 -1.26 -4.68 118.95 119.50 1yq2 s ARG 954 Ca 0.00 1.22 0.03 0.00 -0.52 0.00 0.00 55.73 56.46 1yq2 s ARG 954 Cb 0.00 -3.26 -0.04 0.00 0.52 0.00 0.00 34.95 32.17 1yq2 s ARG 954 CO 0.00 0.56 0.02 1.03 0.02 0.00 0.00 175.30 176.93 1yq2 s ARG 955 N -1.15 2.72 0.93 3.54 0.52 -1.26 -1.11 118.95 123.14 1yq2 s ARG 955 Ca 0.37 -0.71 -0.14 0.00 -0.52 0.00 0.00 55.73 54.72 1yq2 s ARG 955 Cb -0.24 -2.64 0.16 0.00 0.52 0.00 0.00 34.95 32.76 1yq2 s ARG 955 CO 0.27 0.58 1.22 -1.25 0.02 0.00 0.00 175.30 176.14 1yq2 s PRO 956 N -2.01 0.97 0.48 3.54 0.04 -1.26 -4.43 135.00 132.32 1yq2 s PRO 956 Ca 0.24 -0.06 0.02 0.00 0.04 0.00 0.00 61.00 61.24 1yq2 s PRO 956 Cb -0.12 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.56 1yq2 s PRO 956 CO 0.16 -2.25 0.07 0.20 0.04 0.00 0.00 177.00 175.21 1yq2 s GLY 957 N -4.50 2.90 0.08 0.56 0.00 0.01 -0.64 107.32 105.73 1yq2 s GLY 957 Ca 0.68 -0.63 -0.05 0.00 0.00 0.00 0.00 44.72 44.72 1yq2 s GLY 957 CO 0.52 -2.04 0.09 -0.11 0.00 0.00 0.00 173.10 171.56 1yq2 s PHE 958 N -3.02 0.37 0.06 1.90 -0.12 -0.35 -0.69 117.98 116.13 1yq2 s PHE 958 Ca 0.12 -0.85 0.02 0.00 -0.05 0.00 0.00 56.93 56.17 1yq2 s PHE 958 Cb 0.01 -0.23 -0.03 0.00 -0.63 0.00 0.00 43.02 42.14 1yq2 s PHE 958 CO 0.08 -0.48 -0.08 -1.12 -0.05 0.00 0.00 175.22 173.57 1yq2 s SER 959 N -2.90 1.01 -0.08 1.98 0.01 -0.40 -0.72 113.70 112.60 1yq2 s SER 959 Ca 0.07 -0.70 0.02 0.00 1.31 0.00 0.00 55.95 56.65 1yq2 s SER 959 Cb 0.06 0.05 0.02 0.00 0.21 0.00 0.00 66.02 66.36 1yq2 s SER 959 CO -0.09 -0.27 -0.11 -0.22 0.41 0.00 0.00 173.24 172.95 1yq2 s LEU 960 N -2.04 1.54 0.10 2.44 2.96 -1.26 -0.97 118.68 121.44 1yq2 s LEU 960 Ca -0.03 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.59 1yq2 s LEU 960 Cb -0.05 -0.85 -0.04 0.00 0.50 0.00 0.00 46.19 45.75 1yq2 s LEU 960 CO -0.01 -0.01 -0.07 0.00 -1.32 0.00 0.00 176.35 174.95 1yq2 s ALA 961 N 0.94 0.99 -1.56 5.97 0.00 -0.12 -4.86 121.76 123.13 1yq2 s ALA 961 Ca -0.09 -1.32 0.27 0.00 0.00 0.00 0.00 51.96 50.81 1yq2 s ALA 961 Cb -0.15 0.14 0.85 0.00 0.00 0.00 0.00 23.12 23.96 1yq2 s ALA 961 CO 0.00 -0.21 1.63 0.54 0.00 0.00 0.00 175.76 177.72 1yq2 n ARG 962 N 0.05 0.61 -3.76 0.00 1.74 -1.26 -0.46 116.66 113.57 1yq2 n ARG 962 Ca -0.13 -0.32 -0.10 0.00 -0.77 0.00 0.00 57.85 56.54 1yq2 n ARG 962 Cb 0.60 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.49 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 -2.61 -0.02 0.71 -1.55 3.76 -1.26 -4.60 115.29 109.72 1yq2 s HIS 963 Ca 0.23 -0.32 -0.12 0.00 -0.15 0.00 0.00 55.06 54.69 1yq2 s HIS 963 Cb 0.19 0.08 0.02 0.00 1.11 0.00 0.00 32.58 33.98 1yq2 s HIS 963 CO 0.54 -0.59 1.09 0.95 -0.85 0.00 0.00 174.74 175.88 1yq2 s THR 964 N -3.60 3.51 0.47 1.30 -4.23 -1.26 -4.84 115.64 106.98 1yq2 s THR 964 Ca 0.02 0.56 0.22 0.00 -1.18 0.00 0.00 61.69 61.32 1yq2 s THR 964 Cb 0.03 -3.11 0.41 0.00 1.34 0.00 0.00 72.50 71.17 1yq2 s THR 964 CO -0.10 -0.57 1.90 0.00 -0.54 0.00 0.00 174.62 175.31 1yq2 h ALA 965 N -0.60 2.42 -0.17 3.99 0.00 -1.98 -0.70 119.26 122.22 1yq2 h ALA 965 Ca -0.45 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1yq2 h ALA 965 Cb 1.23 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1yq2 h ALA 965 CO 0.54 -0.66 -0.22 1.96 0.00 0.00 0.00 179.25 180.87 1yq2 h GLN 966 N 0.23 0.46 -0.65 0.00 7.50 -1.92 -1.80 115.11 118.92 1yq2 h GLN 966 Ca 0.41 -0.26 -0.08 0.00 0.50 0.00 0.00 58.65 59.22 1yq2 h GLN 966 Cb 1.25 0.02 -0.03 0.00 0.05 0.00 0.00 27.48 28.77 1yq2 h GLN 966 CO -0.09 0.84 0.09 0.93 -1.50 0.00 0.00 178.83 179.10 1yq2 h GLU 967 N 0.10 1.09 -0.44 1.46 5.08 -1.82 -2.77 114.58 117.27 1yq2 h GLU 967 Ca 0.02 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1yq2 h GLU 967 Cb 0.78 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1yq2 h GLU 967 CO 0.05 1.01 0.29 0.82 -1.00 0.00 0.00 179.01 180.19 1yq2 h ILE 968 N 1.01 1.12 -0.04 3.13 2.04 -1.14 -2.66 117.51 120.96 1yq2 h ILE 968 Ca 0.20 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 1yq2 h ILE 968 Cb 0.46 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1yq2 h ILE 968 CO 0.02 0.11 -0.00 0.00 0.00 0.00 0.00 178.15 178.28 1yq2 h ALA 969 N 1.16 1.93 0.00 1.87 0.00 -1.23 -2.43 119.26 120.57 1yq2 h ALA 969 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1yq2 h ALA 969 Cb -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1yq2 h ALA 969 CO -0.03 0.05 -0.11 0.00 0.00 0.00 0.00 179.25 179.16 1yq2 n ALA 970 N -2.53 2.45 -2.69 0.00 0.00 -1.01 -4.84 120.51 111.90 1yq2 n ALA 970 Ca -0.02 -0.09 -0.37 0.00 0.00 0.00 0.00 53.44 52.95 1yq2 n ALA 970 Cb 0.11 -1.41 -0.08 0.00 0.00 0.00 0.00 19.45 18.07 1yq2 n ALA 970 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yq2 s ALA 971 N -3.08 3.58 -0.23 0.00 0.00 -0.91 -4.98 121.76 116.15 1yq2 s ALA 971 Ca 0.11 -0.58 0.20 0.00 0.00 0.00 0.00 51.96 51.68 1yq2 s ALA 971 Cb 0.15 -2.48 0.32 0.00 0.00 0.00 0.00 23.12 21.11 1yq2 s ALA 971 CO 0.60 -0.14 1.57 0.78 0.00 0.00 0.00 175.76 178.57 1yq2 h GLY 972 N 7.28 0.00 -4.56 0.00 0.00 -1.88 -3.36 103.07 100.55 1yq2 h GLY 972 Ca -0.38 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.80 1yq2 h GLY 972 CO 0.72 0.00 -0.60 0.30 0.00 0.00 0.00 176.54 176.96 1yq2 s HIS 973 N -3.16 0.20 0.31 5.60 3.76 -1.26 -4.41 115.29 116.33 1yq2 s HIS 973 Ca 0.05 -0.45 0.07 0.00 -0.15 0.00 0.00 55.06 54.57 1yq2 s HIS 973 Cb 0.07 -0.15 0.79 0.00 1.11 0.00 0.00 32.58 34.40 1yq2 s HIS 973 CO 0.70 -0.27 1.75 -1.35 -0.85 0.00 0.00 174.74 174.71 1yq2 h PRO 974 N 4.19 0.62 0.00 8.40 0.11 -1.86 -1.45 132.00 142.02 1yq2 h PRO 974 Ca -0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1yq2 h PRO 974 Cb 1.19 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1yq2 h PRO 974 CO 0.45 0.41 0.00 -2.39 -0.21 0.00 0.00 178.00 176.26 1yq2 n HIS 975 N -4.85 0.14 1.33 0.65 1.44 -1.26 -2.36 115.22 110.30 1yq2 n HIS 975 Ca 0.25 0.06 0.14 0.00 -2.01 0.00 0.00 57.72 56.15 1yq2 n HIS 975 Cb 0.65 -0.59 0.52 0.00 0.12 0.00 0.00 29.99 30.69 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 -1.63 0.70 -2.56 -1.40 1.02 -0.55 -4.88 120.64 111.35 1yq2 n GLU 976 Ca 0.03 -0.31 -0.38 0.00 -0.02 0.00 0.00 57.16 56.48 1yq2 n GLU 976 Cb 0.18 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.06 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 -2.51 4.38 0.97 -4.62 1.43 -1.00 -4.94 118.68 112.39 1yq2 s LEU 977 Ca 0.26 2.11 -0.12 0.00 -1.03 0.00 0.00 54.13 55.35 1yq2 s LEU 977 Cb 0.20 -3.88 0.17 0.00 0.03 0.00 0.00 46.19 42.71 1yq2 s LEU 977 CO 0.50 -0.25 1.10 -2.16 0.23 0.00 0.00 176.35 175.77 1yq2 s PRO 978 N -1.89 0.66 0.16 1.29 0.04 -1.26 -4.96 135.00 129.04 1yq2 s PRO 978 Ca 0.50 0.49 -0.31 0.00 0.04 0.00 0.00 61.00 61.72 1yq2 s PRO 978 Cb -0.26 -1.77 -0.10 0.00 0.04 0.00 0.00 34.50 32.41 1yq2 s PRO 978 CO 0.33 -2.57 1.57 0.99 0.04 0.00 0.00 177.00 177.36 1yq2 s THR 979 N -3.03 2.67 0.46 1.26 2.01 -1.26 -4.93 115.64 112.82 1yq2 s THR 979 Ca 0.65 0.46 -0.25 0.00 0.31 0.00 0.00 61.69 62.86 1yq2 s THR 979 Cb -0.18 -3.30 -0.08 0.00 0.01 0.00 0.00 72.50 68.96 1yq2 s THR 979 CO 0.57 0.03 1.37 -2.84 -0.69 0.00 0.00 174.62 173.06 1yq2 s PRO 980 N 1.26 3.65 -0.00 4.92 0.02 -1.26 -4.93 135.00 138.66 1yq2 s PRO 980 Ca 0.70 2.30 0.05 0.00 0.02 0.00 0.00 61.00 64.07 1yq2 s PRO 980 Cb -0.43 -2.59 -0.06 0.00 0.02 0.00 0.00 34.50 31.43 1yq2 s PRO 980 CO 0.31 -0.80 0.15 -1.13 -0.33 0.00 0.00 177.00 175.21 1yq2 n SER 981 N -0.29 2.08 -4.03 2.53 3.41 -1.26 -5.03 113.62 111.04 1yq2 n SER 981 Ca 0.06 -0.30 -0.09 0.00 -0.26 0.00 0.00 58.87 58.28 1yq2 n SER 981 Cb 0.43 1.11 -0.09 0.00 -0.26 0.00 0.00 64.21 65.41 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 -1.90 0.53 0.05 7.33 3.76 -1.26 -4.54 115.29 119.26 1yq2 s HIS 982 Ca -0.00 -0.95 -0.02 0.00 -0.15 0.00 0.00 55.06 53.94 1yq2 s HIS 982 Cb 0.03 -0.26 -0.04 0.00 1.11 0.00 0.00 32.58 33.42 1yq2 s HIS 982 CO 0.20 -0.55 0.23 -1.12 -0.85 0.00 0.00 174.74 172.65 1yq2 s SER 983 N -2.97 6.39 -0.10 1.40 0.01 -0.48 -4.53 113.70 113.42 1yq2 s SER 983 Ca 0.15 0.36 0.03 0.00 1.31 0.00 0.00 55.95 57.80 1yq2 s SER 983 Cb 0.06 -2.00 0.01 0.00 0.21 0.00 0.00 66.02 64.30 1yq2 s SER 983 CO -0.03 0.19 -0.20 -0.31 0.41 0.00 0.00 173.24 173.29 1yq2 s TYR 984 N -1.46 2.30 -0.22 2.43 1.51 0.39 0.08 117.35 122.37 1yq2 s TYR 984 Ca 0.33 -1.00 -0.08 0.00 -1.01 0.00 0.00 57.07 55.31 1yq2 s TYR 984 Cb -0.13 -1.58 -0.04 0.00 -0.11 0.00 0.00 41.96 40.11 1yq2 s TYR 984 CO 0.24 -0.44 0.09 -1.17 -1.11 0.00 0.00 175.55 173.15 1yq2 s LEU 985 N 0.59 3.72 -0.22 -1.29 2.96 -0.43 -0.94 118.68 123.07 1yq2 s LEU 985 Ca -0.14 -0.03 -0.07 0.00 -0.22 0.00 0.00 54.13 53.66 1yq2 s LEU 985 Cb -0.17 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 1yq2 s LEU 985 CO 0.04 0.07 0.07 -0.31 -1.32 0.00 0.00 176.35 174.90 1yq2 s TYR 986 N 1.02 3.14 -0.34 5.38 1.51 -0.14 -0.53 117.35 127.39 1yq2 s TYR 986 Ca 0.05 -0.21 -0.11 0.00 -1.01 0.00 0.00 57.07 55.78 1yq2 s TYR 986 Cb -0.14 -2.17 -0.00 0.00 -0.11 0.00 0.00 41.96 39.54 1yq2 s TYR 986 CO 0.03 -0.15 0.20 0.08 -1.11 0.00 0.00 175.55 174.61 1yq2 s VAL 987 N 1.10 4.90 -0.21 0.71 1.01 -0.00 -1.27 120.40 126.63 1yq2 s VAL 987 Ca 0.04 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.52 1yq2 s VAL 987 Cb -0.14 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1yq2 s VAL 987 CO 0.03 -0.04 0.04 -1.81 0.00 0.00 0.00 175.10 173.32 1yq2 s ASP 988 N 1.65 5.13 0.24 3.32 1.01 0.13 -0.96 116.67 127.20 1yq2 s ASP 988 Ca 0.05 -0.13 -0.00 0.00 0.71 0.00 0.00 52.55 53.17 1yq2 s ASP 988 Cb -0.18 -1.89 0.29 0.00 1.01 0.00 0.00 42.92 42.15 1yq2 s ASP 988 CO 0.08 0.06 1.65 0.00 0.21 0.00 0.00 175.17 177.17 1yq2 h ALA 989 N 7.54 0.96 -2.66 5.23 0.00 -0.65 0.07 119.26 129.75 1yq2 h ALA 989 Ca -0.36 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.03 1yq2 h ALA 989 Cb 1.18 -0.12 -0.21 0.00 0.00 0.00 0.00 17.79 18.63 1yq2 h ALA 989 CO 0.62 0.61 -0.31 0.00 0.00 0.00 0.00 179.25 180.17 1yq2 s ALA 990 N -4.42 -0.75 0.03 0.00 0.00 -0.79 -4.74 121.76 111.10 1yq2 s ALA 990 Ca -0.08 0.45 0.06 0.00 0.00 0.00 0.00 51.96 52.40 1yq2 s ALA 990 Cb 0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 23.14 1yq2 s ALA 990 CO 0.81 -0.23 -0.17 -0.65 0.00 0.00 0.00 175.76 175.52 1yq2 s GLN 991 N -0.91 1.19 0.58 0.00 -1.52 -1.26 -1.30 119.66 116.44 1yq2 s GLN 991 Ca -0.10 -0.82 -0.19 0.00 -1.95 0.00 0.00 55.36 52.31 1yq2 s GLN 991 Cb -0.05 -1.24 -0.04 0.00 -0.22 0.00 0.00 33.01 31.46 1yq2 s GLN 991 CO 0.03 0.32 1.19 -1.58 -0.25 0.00 0.00 175.29 174.99 1yq2 s HIS 992 N -0.76 2.46 1.15 0.91 5.65 -0.26 -4.65 115.29 119.79 1yq2 s HIS 992 Ca 0.05 1.52 -0.19 0.00 0.25 0.00 0.00 55.06 56.69 1yq2 s HIS 992 Cb -0.08 -3.43 0.28 0.00 -1.18 0.00 0.00 32.58 28.17 1yq2 s HIS 992 CO 0.01 -2.04 1.10 0.41 -0.65 0.00 0.00 174.74 173.57 1yq2 n GLY 993 N 0.41 -2.55 0.15 1.59 0.00 -0.64 -4.65 105.19 99.49 1yq2 n GLY 993 Ca 0.13 -1.53 -0.21 0.00 0.00 0.00 0.00 46.02 44.41 1yq2 n GLY 993 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yq2 n LEU 994 N 0.00 2.56 0.00 0.99 4.77 -1.26 -4.96 117.00 119.10 1yq2 n LEU 994 Ca 0.15 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1yq2 n LEU 994 Cb 0.57 -0.82 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1yq2 n LEU 994 CO 0.40 0.78 0.00 0.61 -1.33 0.00 0.00 177.39 177.84 1yq2 n GLY 995 N 1.98 1.02 2.42 -0.72 0.00 -1.26 -4.58 105.19 104.05 1yq2 n GLY 995 Ca -0.46 -0.60 -0.02 0.00 0.00 0.00 0.00 46.02 44.94 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 -3.11 -0.51 0.09 1.61 3.41 -0.21 -1.18 113.62 113.73 1yq2 n SER 996 Ca 0.00 -2.13 0.09 0.00 -0.26 0.00 0.00 58.87 56.58 1yq2 n SER 996 Cb 0.00 0.29 0.42 0.00 -0.26 0.00 0.00 64.21 64.65 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 -0.99 0.12 -0.04 4.33 0.63 -1.02 -1.36 116.66 118.33 1yq2 n ARG 997 Ca -0.12 0.41 0.10 0.00 -0.92 0.00 0.00 57.85 57.33 1yq2 n ARG 997 Cb 0.85 -1.75 0.50 0.00 0.45 0.00 0.00 32.46 32.51 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 2.27 1.96 -0.96 5.13 0.00 -1.76 -3.37 119.26 122.53 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 0.25 -0.09 -0.18 0.00 0.00 0.00 0.00 17.79 17.77 1yq2 h ALA 998 CO 0.00 -0.06 -0.44 0.00 0.00 0.00 0.00 179.25 178.75 1yq2 n GLY 1000N 3.97 0.60 3.73 0.00 0.00 -0.88 -4.37 105.19 108.24 1yq2 n GLY 1000Ca 0.13 -1.86 -0.39 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.14 1.62 -0.63 1.61 -0.02 -1.26 -3.84 135.00 131.34 1yq2 n PRO 1001Ca 0.00 0.60 -0.28 0.00 -2.02 0.00 0.00 63.50 61.79 1yq2 n PRO 1001Cb 0.00 -2.52 0.24 0.00 -0.02 0.00 0.00 33.50 31.20 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 -0.93 1.14 0.14 2.55 3.68 -1.26 -1.04 116.67 120.95 1yq2 s ASP 1002Ca 0.72 1.46 -0.34 0.00 2.13 0.00 0.00 52.55 56.52 1yq2 s ASP 1002Cb -0.42 -2.24 -0.14 0.00 -1.45 0.00 0.00 42.92 38.67 1yq2 s ASP 1002CO 0.49 -4.09 1.53 0.52 0.13 0.00 0.00 175.17 173.75 1yq2 n VAL 1003N -4.84 0.01 -2.05 1.11 0.31 -1.26 -4.54 118.33 107.06 1yq2 n VAL 1003Ca 0.03 -0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.95 1yq2 n VAL 1003Cb 0.55 -1.39 -0.02 0.00 -0.91 0.00 0.00 33.84 32.07 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 0.87 2.97 0.45 3.52 -0.11 -1.26 -4.74 118.94 120.64 1yq2 s TRP 1004Ca 0.80 1.31 0.21 0.00 1.22 0.00 0.00 56.10 59.63 1yq2 s TRP 1004Cb -0.74 -3.76 1.18 0.00 -1.50 0.00 0.00 33.47 28.66 1yq2 s TRP 1004CO 0.40 -2.18 1.87 -1.35 -4.62 0.00 0.00 176.95 171.07 1yq2 h PRO 1005N 3.64 0.29 -0.00 5.86 0.11 -1.92 0.35 132.00 140.34 1yq2 h PRO 1005Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1yq2 h PRO 1005Cb 1.23 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1yq2 h PRO 1005CO 0.68 0.19 0.06 -0.44 -0.21 0.00 0.00 178.00 178.28 1yq2 h ASP 1006N 0.30 0.00 -0.05 -2.05 5.19 -2.02 -2.70 116.42 115.08 1yq2 h ASP 1006Ca 0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.86 1yq2 h ASP 1006Cb 1.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.79 1yq2 h ASP 1006CO -0.14 0.00 0.00 0.49 -3.12 0.00 0.00 179.24 176.47 1yq2 n PHE 1007N -3.11 0.06 -3.27 4.55 3.01 0.11 -5.01 117.46 113.80 1yq2 n PHE 1007Ca -0.03 -0.31 -0.39 0.00 1.01 0.00 0.00 57.45 57.74 1yq2 n PHE 1007Cb 0.13 -0.03 -0.06 0.00 -0.01 0.00 0.00 39.48 39.51 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 -0.70 3.55 -0.34 4.37 0.00 -1.02 -1.62 121.76 126.00 1yq2 s ALA 1008Ca 0.04 -0.02 -0.20 0.00 0.00 0.00 0.00 51.96 51.79 1yq2 s ALA 1008Cb 0.02 -2.66 -0.00 0.00 0.00 0.00 0.00 23.12 20.49 1yq2 s ALA 1008CO 0.03 0.27 0.61 -1.17 0.00 0.00 0.00 175.76 175.50 1yq2 s LEU 1009N -0.53 4.23 0.19 0.00 2.96 -1.26 -4.94 118.68 119.32 1yq2 s LEU 1009Ca 0.29 0.22 0.07 0.00 -0.22 0.00 0.00 54.13 54.49 1yq2 s LEU 1009Cb -0.18 -2.76 -0.04 0.00 0.50 0.00 0.00 46.19 43.71 1yq2 s LEU 1009CO 0.17 -0.53 0.03 -0.13 -1.32 0.00 0.00 176.35 174.57 1yq2 s ARG 1010N 2.62 2.49 0.04 1.98 1.81 -1.26 -1.37 118.95 125.26 1yq2 s ARG 1010Ca 0.24 -1.10 -0.37 0.00 -1.72 0.00 0.00 55.73 52.77 1yq2 s ARG 1010Cb -0.15 -2.39 -0.17 0.00 -0.45 0.00 0.00 34.95 31.80 1yq2 s ARG 1010CO 0.13 0.45 1.37 -2.30 -0.68 0.00 0.00 175.30 174.27 1yq2 n PRO 1011N -0.30 1.09 -3.72 3.54 -0.02 -1.26 -4.85 135.00 129.48 1yq2 n PRO 1011Ca -0.09 0.39 -0.10 0.00 -2.02 0.00 0.00 63.50 61.68 1yq2 n PRO 1011Cb 0.56 -2.03 -0.05 0.00 -0.02 0.00 0.00 33.50 31.95 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 0.78 1.00 0.19 -0.52 -1.05 -1.26 -5.13 118.70 112.71 1yq2 s GLU 1012Ca 0.86 -0.81 -0.21 0.00 -0.15 0.00 0.00 54.97 54.67 1yq2 s GLU 1012Cb -0.98 0.43 -0.08 0.00 -0.44 0.00 0.00 34.13 33.05 1yq2 s GLU 1012CO 0.49 -0.37 0.71 0.00 0.95 0.00 0.00 175.26 177.04 1yq2 s ALA 1013N -3.83 3.45 0.02 -0.84 0.00 -1.26 -4.70 121.76 114.61 1yq2 s ALA 1013Ca 0.04 0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.16 1yq2 s ALA 1013Cb 0.03 -2.82 -0.02 0.00 0.00 0.00 0.00 23.12 20.31 1yq2 s ALA 1013CO -0.11 0.33 0.03 1.03 0.00 0.00 0.00 175.76 177.04 1yq2 s ARG 1014N -1.68 0.44 -0.06 0.00 1.81 -0.75 -5.00 118.95 113.70 1yq2 s ARG 1014Ca 0.39 -0.68 0.04 0.00 -1.72 0.00 0.00 55.73 53.76 1yq2 s ARG 1014Cb -0.18 0.17 -0.00 0.00 -0.45 0.00 0.00 34.95 34.48 1yq2 s ARG 1014CO 0.22 -0.09 -0.19 0.99 -0.68 0.00 0.00 175.30 175.55 1yq2 s THR 1015N -2.02 1.62 -0.14 0.02 2.01 -1.26 -0.69 115.64 115.17 1yq2 s THR 1015Ca -0.10 -0.80 -0.06 0.00 0.31 0.00 0.00 61.69 61.04 1yq2 s THR 1015Cb -0.05 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 1yq2 s THR 1015CO -0.02 0.46 0.07 -0.76 -0.69 0.00 0.00 174.62 173.68 1yq2 s LEU 1016N 0.18 3.94 -0.29 4.42 1.43 0.11 -4.81 118.68 123.67 1yq2 s LEU 1016Ca -0.09 0.21 0.03 0.00 -1.03 0.00 0.00 54.13 53.25 1yq2 s LEU 1016Cb -0.14 -1.97 0.08 0.00 0.03 0.00 0.00 46.19 44.19 1yq2 s LEU 1016CO 0.04 0.29 -0.04 -0.54 0.23 0.00 0.00 176.35 176.33 1yq2 s LYS 1017N -0.30 1.82 0.11 1.70 1.02 -1.26 -0.70 119.74 122.13 1yq2 s LYS 1017Ca 0.09 -1.49 0.10 0.00 0.02 0.00 0.00 55.97 54.69 1yq2 s LYS 1017Cb -0.12 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.22 1yq2 s LYS 1017CO 0.01 -0.73 -0.26 -0.51 -0.92 0.00 0.00 175.35 172.95 1yq2 s LEU 1018N 1.08 2.28 -0.11 3.17 1.43 -0.05 -0.66 118.68 125.83 1yq2 s LEU 1018Ca -0.01 -0.71 0.03 0.00 -1.03 0.00 0.00 54.13 52.41 1yq2 s LEU 1018Cb -0.19 -1.21 -0.01 0.00 0.03 0.00 0.00 46.19 44.81 1yq2 s LEU 1018CO -0.07 0.19 -0.20 -0.13 0.23 0.00 0.00 176.35 176.36 1yq2 s ARG 1019N -1.87 3.12 -0.12 1.70 0.52 -0.10 -0.26 118.95 121.94 1yq2 s ARG 1019Ca 0.13 -0.82 0.02 0.00 -0.52 0.00 0.00 55.73 54.55 1yq2 s ARG 1019Cb -0.10 -2.40 -0.00 0.00 0.52 0.00 0.00 34.95 32.97 1yq2 s ARG 1019CO 0.05 0.21 -0.20 0.42 0.02 0.00 0.00 175.30 175.80 1yq2 s ILE 1020N 0.30 2.38 0.06 1.52 1.01 -0.48 -0.65 121.20 125.34 1yq2 s ILE 1020Ca -0.15 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 59.54 1yq2 s ILE 1020Cb -0.17 -1.96 -0.01 0.00 0.01 0.00 0.00 42.46 40.33 1yq2 s ILE 1020CO 0.08 0.54 0.12 -0.94 0.00 0.00 0.00 174.94 174.74 1yq2 s SER 1021N 0.51 0.20 0.44 3.58 1.04 -0.29 -4.15 113.70 115.02 1yq2 s SER 1021Ca -0.13 -0.65 -0.25 0.00 0.48 0.00 0.00 55.95 55.41 1yq2 s SER 1021Cb -0.17 0.28 -0.08 0.00 0.10 0.00 0.00 66.02 66.15 1yq2 s SER 1021CO 0.05 -0.62 1.25 -2.16 0.98 0.00 0.00 173.24 172.74 1yq2 s PRO 1022N -3.37 3.82 0.00 4.02 0.04 -1.26 -0.01 135.00 138.24 1yq2 s PRO 1022Ca 0.01 2.01 0.32 0.00 0.04 0.00 0.00 61.00 63.38 1yq2 s PRO 1022Cb 0.03 -2.59 1.90 0.00 0.04 0.00 0.00 34.50 33.88 1yq2 s PRO 1022CO -0.08 -0.57 2.22 0.00 0.04 0.00 0.00 177.00 178.62