#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y1p h LYS 3 N 0.00 -0.71 -6.00 0.00 1.57 -2.01 -3.38 116.57 106.05 1y1p h LYS 3 Ca 0.00 0.05 -0.50 0.00 -1.87 0.00 0.00 60.65 58.32 1y1p h LYS 3 Cb 0.00 0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1y1p h LYS 3 CO 0.00 -0.47 1.35 0.42 -0.57 0.00 0.00 179.45 180.18 1y1p s ILE 4 N -5.85 3.37 0.35 1.86 1.01 -1.26 -4.99 121.20 115.69 1y1p s ILE 4 Ca -0.17 0.23 -0.25 0.00 0.00 0.00 0.00 60.65 60.46 1y1p s ILE 4 Cb 0.07 -3.92 -0.10 0.00 0.01 0.00 0.00 42.46 38.52 1y1p s ILE 4 CO 0.62 -0.87 0.96 -1.81 0.00 0.00 0.00 174.94 173.85 1y1p s ASP 5 N 7.96 7.18 -1.90 3.58 1.01 -1.26 -3.54 116.67 129.71 1y1p s ASP 5 Ca 0.68 1.85 0.00 0.00 0.71 0.00 0.00 52.55 55.80 1y1p s ASP 5 Cb -0.13 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1y1p s ASP 5 CO 0.22 -0.18 0.00 0.59 0.21 0.00 0.00 175.17 176.01 1y1p n ASN 6 N 0.29 -5.79 -4.74 0.27 3.02 -1.26 -4.92 115.26 102.13 1y1p n ASN 6 Ca 0.03 0.13 -0.42 0.00 -0.03 0.00 0.00 54.58 54.29 1y1p n ASN 6 Cb 0.50 -4.89 -0.01 0.00 -0.61 0.00 0.00 39.78 34.78 1y1p n ASN 6 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y1p n ALA 7 N -1.07 1.93 0.20 5.41 0.00 -1.23 -4.39 120.51 121.36 1y1p n ALA 7 Ca -0.24 0.36 0.08 0.00 0.00 0.00 0.00 53.44 53.64 1y1p n ALA 7 Cb 0.69 -2.36 0.33 0.00 0.00 0.00 0.00 19.45 18.11 1y1p n ALA 7 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1y1p h VAL 8 N 2.85 0.64 -3.47 0.00 -1.51 -0.68 -3.41 116.25 110.68 1y1p h VAL 8 Ca -0.48 -1.41 -0.65 0.00 -1.23 0.00 0.00 66.70 62.93 1y1p h VAL 8 Cb 1.26 1.94 -0.24 0.00 -2.13 0.00 0.00 31.29 32.12 1y1p h VAL 8 CO 0.66 0.29 -0.66 -0.76 -1.23 0.00 0.00 177.57 175.87 1y1p s LEU 9 N -6.73 3.24 0.76 4.19 1.43 -1.26 -5.06 118.68 115.25 1y1p s LEU 9 Ca 0.02 -0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 52.73 1y1p s LEU 9 Cb 0.09 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.48 1y1p s LEU 9 CO 0.67 0.03 0.75 -2.65 0.23 0.00 0.00 176.35 175.38 1y1p n PRO 10 N 4.47 0.28 -1.67 1.29 -0.02 -1.26 -4.85 135.00 133.24 1y1p n PRO 10 Ca -0.17 0.15 -0.44 0.00 -2.02 0.00 0.00 63.50 61.01 1y1p n PRO 10 Cb 0.52 -2.04 -0.02 0.00 -0.02 0.00 0.00 33.50 31.93 1y1p n PRO 10 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1y1p n GLU 11 N -1.56 2.02 -0.96 -0.52 1.02 -1.26 -1.61 120.64 117.76 1y1p n GLU 11 Ca 0.11 0.72 0.00 0.00 -0.02 0.00 0.00 57.16 57.97 1y1p n GLU 11 Cb 0.50 -2.35 0.00 0.00 -0.02 0.00 0.00 31.44 29.57 1y1p n GLU 11 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y1p n GLY 12 N 1.92 0.69 3.64 0.62 0.00 -1.16 -5.00 105.19 105.89 1y1p n GLY 12 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1y1p n GLY 12 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1y1p n SER 13 N -0.05 0.80 -4.74 1.61 7.64 -0.63 -3.87 113.62 114.38 1y1p n SER 13 Ca 0.00 0.68 -0.38 0.00 1.01 0.00 0.00 58.87 60.18 1y1p n SER 13 Cb 0.03 -1.44 -0.06 0.00 -1.01 0.00 0.00 64.21 61.73 1y1p n SER 13 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1y1p s LEU 14 N -3.66 4.32 -0.09 -3.43 2.96 -1.26 -1.31 118.68 116.21 1y1p s LEU 14 Ca 0.75 0.95 0.04 0.00 -0.22 0.00 0.00 54.13 55.64 1y1p s LEU 14 Cb -0.34 -2.79 0.00 0.00 0.50 0.00 0.00 46.19 43.56 1y1p s LEU 14 CO 0.49 0.02 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.62 1y1p s VAL 15 N 0.40 1.95 -0.13 1.68 1.01 0.09 -0.71 120.40 124.69 1y1p s VAL 15 Ca 0.29 -0.96 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 1y1p s VAL 15 Cb -0.16 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 1y1p s VAL 15 CO 0.13 0.54 0.55 -0.22 0.00 0.00 0.00 175.10 176.10 1y1p s LEU 16 N 0.32 4.24 -0.20 3.92 2.96 -0.09 -1.93 118.68 127.91 1y1p s LEU 16 Ca -0.17 0.87 0.01 0.00 -0.22 0.00 0.00 54.13 54.63 1y1p s LEU 16 Cb -0.17 -2.81 0.04 0.00 0.50 0.00 0.00 46.19 43.75 1y1p s LEU 16 CO 0.08 -0.09 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.19 1y1p s VAL 17 N 1.02 1.84 0.14 1.68 1.01 -0.63 -0.21 120.40 125.25 1y1p s VAL 17 Ca 0.28 -1.04 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 1y1p s VAL 17 Cb -0.16 -1.82 -0.07 0.00 0.00 0.00 0.00 36.38 34.33 1y1p s VAL 17 CO 0.12 0.29 0.76 0.42 0.00 0.00 0.00 175.10 176.68 1y1p s THR 18 N 1.33 4.45 -0.87 3.92 -4.23 -0.61 -1.09 115.64 118.54 1y1p s THR 18 Ca 0.00 1.66 -0.05 0.00 -1.18 0.00 0.00 61.69 62.13 1y1p s THR 18 Cb -0.15 -4.12 0.01 0.00 1.34 0.00 0.00 72.50 69.57 1y1p s THR 18 CO -0.09 0.50 0.75 0.61 -0.54 0.00 0.00 174.62 175.85 1y1p n GLY 19 N 1.74 -0.05 0.19 3.99 0.00 -0.82 -2.83 105.19 107.41 1y1p n GLY 19 Ca -0.05 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.02 1y1p n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y1p h ALA 20 N 0.65 1.00 -0.00 4.61 0.00 -0.73 -1.47 119.26 123.32 1y1p h ALA 20 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1y1p h ALA 20 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1y1p h ALA 20 CO 0.36 0.00 -0.16 0.27 0.00 0.00 0.00 179.25 179.72 1y1p n ASN 21 N -2.38 0.26 -4.76 0.00 6.94 -1.26 -3.59 115.26 110.48 1y1p n ASN 21 Ca -0.01 -0.05 -0.30 0.00 -0.02 0.00 0.00 54.58 54.20 1y1p n ASN 21 Cb 0.05 -0.17 0.12 0.00 -2.36 0.00 0.00 39.78 37.42 1y1p n ASN 21 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1y1p s GLY 22 N -2.82 1.62 0.03 4.83 0.00 -0.55 -4.84 107.32 105.59 1y1p s GLY 22 Ca 0.19 -0.11 -0.27 0.00 0.00 0.00 0.00 44.72 44.53 1y1p s GLY 22 CO 0.55 0.35 1.29 -2.75 0.00 0.00 0.00 173.10 172.53 1y1p h PHE 23 N -1.34 -0.89 -0.46 1.90 3.57 -1.90 -0.56 116.94 117.27 1y1p h PHE 23 Ca -0.48 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.01 1y1p h PHE 23 Cb 1.28 0.29 -0.03 0.00 2.79 0.00 0.00 35.95 40.28 1y1p h PHE 23 CO 0.45 -0.55 0.29 0.28 -2.23 0.00 0.00 178.31 176.54 1y1p h VAL 24 N -1.04 1.08 -0.76 1.41 2.07 -1.94 -2.65 116.25 114.41 1y1p h VAL 24 Ca -0.10 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.28 1y1p h VAL 24 Cb 0.73 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.89 1y1p h VAL 24 CO 0.16 0.11 0.45 0.00 0.02 0.00 0.00 177.57 178.31 1y1p h ALA 25 N 1.19 1.04 0.00 1.67 0.00 -1.82 -1.45 119.26 119.89 1y1p h ALA 25 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1y1p h ALA 25 Cb -0.03 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1y1p h ALA 25 CO -0.06 0.16 -0.03 0.66 0.00 0.00 0.00 179.25 179.99 1y1p h SER 26 N 0.83 0.00 0.50 0.00 4.64 -0.73 0.83 113.55 119.61 1y1p h SER 26 Ca 0.34 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.42 1y1p h SER 26 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1y1p h SER 26 CO -0.18 0.03 -1.05 0.45 -0.87 0.00 0.00 176.83 175.21 1y1p h HIS 27 N 0.00 0.51 -0.54 4.77 3.86 -1.16 -1.23 115.15 121.35 1y1p h HIS 27 Ca -0.00 -0.31 -0.05 0.00 -1.16 0.00 0.00 60.37 58.84 1y1p h HIS 27 Cb 0.05 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 1y1p h HIS 27 CO 0.00 1.17 0.12 0.28 0.86 0.00 0.00 177.93 180.37 1y1p h VAL 28 N 0.15 1.25 0.01 2.45 2.07 -0.40 -1.45 116.25 120.32 1y1p h VAL 28 Ca -0.09 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.54 1y1p h VAL 28 Cb 1.72 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 1y1p h VAL 28 CO 0.17 0.32 -0.01 0.58 0.02 0.00 0.00 177.57 178.66 1y1p h VAL 29 N 0.76 1.09 -0.54 2.57 2.07 -0.85 -1.65 116.25 119.71 1y1p h VAL 29 Ca 0.17 -0.31 0.10 0.00 0.82 0.00 0.00 66.70 67.47 1y1p h VAL 29 Cb 0.35 1.30 -0.08 0.00 -1.52 0.00 0.00 31.29 31.34 1y1p h VAL 29 CO 0.00 0.08 0.09 -0.08 0.02 0.00 0.00 177.57 177.68 1y1p h GLU 30 N -0.15 0.21 -0.29 1.57 4.57 -1.04 0.50 114.58 119.95 1y1p h GLU 30 Ca -0.00 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.08 1y1p h GLU 30 Cb 0.15 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.67 1y1p h GLU 30 CO 0.00 0.14 -0.19 0.37 -1.18 0.00 0.00 179.01 178.16 1y1p h GLN 31 N 0.22 0.53 -0.27 1.92 5.75 -1.12 -0.58 115.11 121.56 1y1p h GLN 31 Ca 0.27 -0.18 -0.05 0.00 -0.15 0.00 0.00 58.65 58.54 1y1p h GLN 31 Cb 0.39 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.89 1y1p h GLN 31 CO -0.37 0.70 -0.04 -0.07 -2.65 0.00 0.00 178.83 176.39 1y1p h LEU 32 N 0.48 0.51 -0.80 -2.39 3.38 -0.25 -2.44 115.31 113.80 1y1p h LEU 32 Ca 0.08 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1y1p h LEU 32 Cb 0.60 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1y1p h LEU 32 CO 0.04 0.73 0.28 -0.07 0.09 0.00 0.00 178.44 179.52 1y1p h LEU 33 N 0.27 1.09 -1.77 1.67 3.38 -0.74 -1.72 115.31 117.50 1y1p h LEU 33 Ca 0.07 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1y1p h LEU 33 Cb 0.50 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1y1p h LEU 33 CO 0.02 0.98 0.08 -0.08 0.09 0.00 0.00 178.44 179.54 1y1p h GLU 34 N 1.14 0.23 -0.61 1.13 4.57 -1.00 -1.85 114.58 118.19 1y1p h GLU 34 Ca 0.26 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.42 1y1p h GLU 34 Cb 0.25 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 1y1p h GLU 34 CO -0.02 0.18 0.00 0.72 -1.18 0.00 0.00 179.01 178.72 1y1p n HIS 35 N -4.48 1.02 -0.78 0.92 8.25 -0.85 -4.93 115.22 114.38 1y1p n HIS 35 Ca -0.00 -0.40 0.00 0.00 -0.26 0.00 0.00 57.72 57.05 1y1p n HIS 35 Cb 0.10 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 31.02 1y1p n HIS 35 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1y1p n GLY 36 N 0.82 0.73 3.86 -1.41 0.00 -0.69 -4.84 105.19 103.64 1y1p n GLY 36 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1y1p n GLY 36 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y1p s TYR 37 N -2.65 3.47 0.18 1.61 2.02 -0.70 -3.01 117.35 118.26 1y1p s TYR 37 Ca 0.00 1.03 -0.13 0.00 -0.37 0.00 0.00 57.07 57.60 1y1p s TYR 37 Cb 0.00 -2.38 -0.07 0.00 -0.40 0.00 0.00 41.96 39.11 1y1p s TYR 37 CO 0.00 0.27 0.57 0.15 -1.57 0.00 0.00 175.55 174.96 1y1p s LYS 38 N -2.60 3.95 -0.02 -0.62 1.02 -0.43 -4.07 119.74 116.97 1y1p s LYS 38 Ca 0.47 0.46 0.03 0.00 0.02 0.00 0.00 55.97 56.95 1y1p s LYS 38 Cb -0.12 -2.83 -0.00 0.00 -0.52 0.00 0.00 37.83 34.36 1y1p s LYS 38 CO 0.20 0.42 -0.10 0.08 -0.92 0.00 0.00 175.35 175.02 1y1p s VAL 39 N -1.59 0.85 -0.27 3.17 1.01 -0.35 -0.73 120.40 122.50 1y1p s VAL 39 Ca 0.41 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1y1p s VAL 39 Cb -0.14 -0.73 0.05 0.00 0.00 0.00 0.00 36.38 35.56 1y1p s VAL 39 CO 0.20 0.25 -0.06 -0.60 0.00 0.00 0.00 175.10 174.89 1y1p s ARG 40 N -0.04 2.43 -0.14 2.72 3.52 -0.81 -0.57 118.95 126.06 1y1p s ARG 40 Ca 0.01 -1.24 -0.05 0.00 -0.13 0.00 0.00 55.73 54.32 1y1p s ARG 40 Cb -0.06 -3.03 -0.03 0.00 -1.56 0.00 0.00 34.95 30.26 1y1p s ARG 40 CO 0.00 -0.56 0.02 0.20 -0.81 0.00 0.00 175.30 174.15 1y1p s GLY 41 N 1.21 1.84 0.22 8.12 0.00 -0.12 -1.61 107.32 116.98 1y1p s GLY 41 Ca -0.06 -0.78 -0.02 0.00 0.00 0.00 0.00 44.72 43.86 1y1p s GLY 41 CO -0.03 -0.19 0.44 -0.51 0.00 0.00 0.00 173.10 172.80 1y1p s THR 42 N -0.08 5.14 0.06 0.90 -4.23 -0.25 -0.61 115.64 116.58 1y1p s THR 42 Ca 0.04 -0.19 -0.21 0.00 -1.18 0.00 0.00 61.69 60.15 1y1p s THR 42 Cb -0.13 -3.72 0.05 0.00 1.34 0.00 0.00 72.50 70.05 1y1p s THR 42 CO 0.02 -0.19 0.50 0.00 -0.54 0.00 0.00 174.62 174.41 1y1p s ALA 43 N -1.91 -1.27 -0.94 3.99 0.00 -0.82 -0.25 121.76 120.56 1y1p s ALA 43 Ca 0.40 0.49 0.13 0.00 0.00 0.00 0.00 51.96 52.99 1y1p s ALA 43 Cb -0.11 0.45 0.57 0.00 0.00 0.00 0.00 23.12 24.02 1y1p s ALA 43 CO 0.29 -0.53 1.42 0.54 0.00 0.00 0.00 175.76 177.47 1y1p n ARG 44 N 0.30 0.02 -3.59 0.00 1.74 -1.24 -1.35 116.66 112.54 1y1p n ARG 44 Ca -0.18 0.31 -0.16 0.00 -0.77 0.00 0.00 57.85 57.05 1y1p n ARG 44 Cb 0.61 -1.54 -0.06 0.00 -1.02 0.00 0.00 32.46 30.44 1y1p n ARG 44 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1y1p s SER 45 N -3.13 -0.50 0.29 0.55 1.04 -1.26 -4.21 113.70 106.48 1y1p s SER 45 Ca 0.05 0.44 0.07 0.00 0.48 0.00 0.00 55.95 56.99 1y1p s SER 45 Cb 0.08 0.48 0.45 0.00 0.10 0.00 0.00 66.02 67.13 1y1p s SER 45 CO 0.23 -0.60 1.70 0.00 0.98 0.00 0.00 173.24 175.55 1y1p h ALA 46 N 3.14 1.10 -0.70 5.32 0.00 -1.92 -2.95 119.26 123.26 1y1p h ALA 46 Ca -0.29 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.20 1y1p h ALA 46 Cb 1.17 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1y1p h ALA 46 CO 0.40 0.60 0.41 0.66 0.00 0.00 0.00 179.25 181.32 1y1p h SER 47 N 0.19 0.83 0.04 0.00 4.64 -1.98 -1.51 113.55 115.76 1y1p h SER 47 Ca 0.02 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1y1p h SER 47 Cb 0.83 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1y1p h SER 47 CO 0.07 0.65 -0.01 0.11 -0.87 0.00 0.00 176.83 176.77 1y1p h LYS 48 N 0.96 0.00 -0.02 4.77 1.57 -1.93 -1.81 116.57 120.11 1y1p h LYS 48 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1y1p h LYS 48 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1y1p h LYS 48 CO -0.05 0.01 -0.16 1.28 -0.57 0.00 0.00 179.45 179.96 1y1p n LEU 49 N -3.69 2.16 -0.15 2.94 4.77 -0.63 -4.69 117.00 117.70 1y1p n LEU 49 Ca -0.03 -0.89 -0.03 0.00 -0.03 0.00 0.00 56.01 55.03 1y1p n LEU 49 Cb 0.09 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.23 1y1p n LEU 49 CO 0.26 0.39 0.81 0.00 -1.33 0.00 0.00 177.39 177.52 1y1p h ALA 50 N 3.34 0.38 -0.47 -1.18 0.00 -0.61 0.44 119.26 121.17 1y1p h ALA 50 Ca 0.00 0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 1y1p h ALA 50 Cb 0.69 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1y1p h ALA 50 CO 0.00 -0.42 -0.12 -0.91 0.00 0.00 0.00 179.25 177.80 1y1p h ASN 51 N 0.05 0.92 -0.21 0.00 -0.26 -1.84 -2.00 115.58 112.24 1y1p h ASN 51 Ca 0.24 -0.37 -0.11 0.00 -0.56 0.00 0.00 56.30 55.50 1y1p h ASN 51 Cb 0.36 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.35 1y1p h ASN 51 CO -0.44 1.07 -0.26 -0.07 -1.06 0.00 0.00 177.43 176.67 1y1p h LEU 52 N 0.76 0.71 -0.46 1.61 3.38 -1.75 -1.58 115.31 117.97 1y1p h LEU 52 Ca 0.12 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1y1p h LEU 52 Cb 0.68 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1y1p h LEU 52 CO 0.05 0.94 0.30 -0.61 0.09 0.00 0.00 178.44 179.21 1y1p h GLN 53 N 0.60 0.61 -0.80 1.13 5.75 0.02 0.10 115.11 122.52 1y1p h GLN 53 Ca 0.08 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.53 1y1p h GLN 53 Cb 0.75 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 29.13 1y1p h GLN 53 CO 0.06 0.41 0.45 -0.22 -2.65 0.00 0.00 178.83 176.88 1y1p h LYS 54 N 0.63 1.12 -0.07 1.69 3.64 -1.10 0.13 116.57 122.60 1y1p h LYS 54 Ca 0.17 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1y1p h LYS 54 Cb -0.07 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.53 1y1p h LYS 54 CO -0.04 0.82 0.04 -0.09 -2.27 0.00 0.00 179.45 177.91 1y1p h ARG 55 N 1.11 0.11 0.00 1.90 2.43 -0.72 -2.56 114.38 116.65 1y1p h ARG 55 Ca 0.28 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.35 1y1p h ARG 55 Cb 0.02 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1y1p h ARG 55 CO -0.05 0.17 -0.41 -1.49 -1.51 0.00 0.00 179.97 176.68 1y1p h TRP 56 N 0.01 0.00 -0.16 2.20 6.55 -0.70 -1.77 115.95 122.08 1y1p h TRP 56 Ca 0.03 0.00 -0.12 0.00 0.95 0.00 0.00 58.89 59.75 1y1p h TRP 56 Cb 0.10 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.39 1y1p h TRP 56 CO -0.04 0.41 -0.41 -0.44 -1.05 0.00 0.00 178.44 176.91 1y1p h ASP 57 N 0.00 0.40 0.11 -3.49 3.45 -0.62 0.52 116.42 116.80 1y1p h ASP 57 Ca -0.00 -0.17 -0.28 0.00 0.43 0.00 0.00 57.03 57.00 1y1p h ASP 57 Cb 0.86 -0.11 0.03 0.00 -0.56 0.00 0.00 39.33 39.54 1y1p h ASP 57 CO 0.05 0.77 -1.15 0.00 -1.57 0.00 0.00 179.24 177.35 1y1p h ALA 58 N 1.25 -0.01 0.13 3.45 0.00 -1.22 -2.95 119.26 119.91 1y1p h ALA 58 Ca 0.03 -0.75 -0.32 0.00 0.00 0.00 0.00 54.91 53.87 1y1p h ALA 58 Cb 0.86 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1y1p h ALA 58 CO 0.07 0.63 -1.60 -0.22 0.00 0.00 0.00 179.25 178.13 1y1p h LYS 59 N 0.19 0.28 -2.24 0.00 3.64 -1.30 -3.41 116.57 113.73 1y1p h LYS 59 Ca -0.18 -0.47 -0.58 0.00 -1.27 0.00 0.00 60.65 58.15 1y1p h LYS 59 Cb 1.84 0.18 -0.40 0.00 -0.41 0.00 0.00 32.23 33.44 1y1p h LYS 59 CO 0.22 1.15 -0.89 0.66 -2.27 0.00 0.00 179.45 178.31 1y1p n TYR 60 N -3.47 0.95 -1.71 1.91 4.01 0.18 -5.08 117.16 113.95 1y1p n TYR 60 Ca -0.19 -3.75 -0.60 0.00 -0.16 0.00 0.00 57.90 53.21 1y1p n TYR 60 Cb 1.05 -0.31 -0.08 0.00 -0.31 0.00 0.00 39.34 39.69 1y1p n TYR 60 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1y1p n PRO 61 N 1.62 0.83 -1.62 -0.72 -0.02 -1.11 -1.82 135.00 132.15 1y1p n PRO 61 Ca 0.25 0.30 -0.17 0.00 -2.02 0.00 0.00 63.50 61.86 1y1p n PRO 61 Cb 0.47 -1.93 -0.06 0.00 -0.02 0.00 0.00 33.50 31.95 1y1p n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y1p n GLY 62 N 4.02 1.37 0.06 -1.23 0.00 -1.26 -4.88 105.19 103.26 1y1p n GLY 62 Ca 0.27 -0.21 -0.03 0.00 0.00 0.00 0.00 46.02 46.05 1y1p n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y1p n ARG 63 N -2.53 0.84 -4.63 1.61 5.12 -0.76 -4.96 116.66 111.36 1y1p n ARG 63 Ca -0.17 -0.07 -0.34 0.00 -1.93 0.00 0.00 57.85 55.34 1y1p n ARG 63 Cb 0.57 -1.48 -0.12 0.00 -1.16 0.00 0.00 32.46 30.28 1y1p n ARG 63 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1y1p s PHE 64 N -2.77 2.93 -0.07 -1.55 5.36 -1.26 -1.21 117.98 119.42 1y1p s PHE 64 Ca -0.09 -0.04 0.02 0.00 -0.96 0.00 0.00 56.93 55.86 1y1p s PHE 64 Cb 0.08 -1.73 0.02 0.00 -0.34 0.00 0.00 43.02 41.04 1y1p s PHE 64 CO 0.79 0.27 -0.10 -2.00 -1.46 0.00 0.00 175.22 172.72 1y1p s GLU 65 N -0.66 1.52 0.20 10.12 2.12 0.27 -4.95 118.70 127.32 1y1p s GLU 65 Ca 0.10 -0.34 -0.30 0.00 0.36 0.00 0.00 54.97 54.79 1y1p s GLU 65 Cb -0.11 -1.32 -0.08 0.00 0.26 0.00 0.00 34.13 32.88 1y1p s GLU 65 CO 0.02 -0.02 1.02 0.99 -0.54 0.00 0.00 175.26 176.72 1y1p s THR 66 N 0.82 4.01 -0.04 -1.70 2.01 -1.26 -0.94 115.64 118.53 1y1p s THR 66 Ca -0.12 1.86 0.02 0.00 0.31 0.00 0.00 61.69 63.75 1y1p s THR 66 Cb -0.15 -4.18 0.02 0.00 0.01 0.00 0.00 72.50 68.19 1y1p s THR 66 CO 0.02 0.37 -0.07 0.00 -0.69 0.00 0.00 174.62 174.26 1y1p s ALA 67 N -0.66 0.80 -0.20 7.40 0.00 0.22 -4.87 121.76 124.44 1y1p s ALA 67 Ca 0.45 -0.16 -0.16 0.00 0.00 0.00 0.00 51.96 52.10 1y1p s ALA 67 Cb -0.27 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 1y1p s ALA 67 CO 0.34 0.05 0.38 0.08 0.00 0.00 0.00 175.76 176.61 1y1p s VAL 68 N 0.71 5.21 -0.35 0.00 1.01 -1.26 -1.94 120.40 123.77 1y1p s VAL 68 Ca -0.11 0.67 -0.00 0.00 0.00 0.00 0.00 61.98 62.54 1y1p s VAL 68 Cb -0.13 -3.71 0.13 0.00 0.00 0.00 0.00 36.38 32.66 1y1p s VAL 68 CO 0.01 0.26 0.18 -0.69 0.00 0.00 0.00 175.10 174.86 1y1p s VAL 69 N 1.30 0.46 0.31 2.92 1.01 -0.46 -4.92 120.40 121.01 1y1p s VAL 69 Ca 0.18 -1.65 0.12 0.00 0.00 0.00 0.00 61.98 60.64 1y1p s VAL 69 Cb -0.15 -1.34 0.04 0.00 0.00 0.00 0.00 36.38 34.93 1y1p s VAL 69 CO 0.08 -0.88 1.72 -0.33 0.00 0.00 0.00 175.10 175.69 1y1p h GLU 70 N 7.38 0.00 -3.60 2.72 5.08 -1.76 -3.30 114.58 121.11 1y1p h GLU 70 Ca -0.03 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.76 1y1p h GLU 70 Cb 0.98 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.83 1y1p h GLU 70 CO 0.37 0.49 -0.76 0.34 -1.00 0.00 0.00 179.01 178.45 1y1p s ASP 71 N -6.84 3.72 0.00 1.42 3.68 -1.26 -4.86 116.67 112.53 1y1p s ASP 71 Ca -0.02 -1.38 0.19 0.00 2.13 0.00 0.00 52.55 53.47 1y1p s ASP 71 Cb 0.13 -0.81 0.98 0.00 -1.45 0.00 0.00 42.92 41.77 1y1p s ASP 71 CO 0.74 -0.37 1.57 1.15 0.13 0.00 0.00 175.17 178.38 1y1p n MET 72 N 4.89 0.32 -0.01 4.34 0.00 -1.26 -2.38 117.12 123.02 1y1p n MET 72 Ca -0.05 0.09 0.10 0.00 0.00 0.00 0.00 57.70 57.85 1y1p n MET 72 Cb 0.43 -1.50 -0.15 0.00 0.00 0.00 0.00 33.22 32.01 1y1p n MET 72 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1y1p n LEU 73 N -1.24 0.35 -4.76 3.17 4.77 -1.26 -4.63 117.00 113.40 1y1p n LEU 73 Ca 0.10 -0.18 -0.41 0.00 -0.03 0.00 0.00 56.01 55.48 1y1p n LEU 73 Cb 0.14 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 1y1p n LEU 73 CO 0.14 0.09 1.18 -0.75 -1.33 0.00 0.00 177.39 176.72 1y1p s LYS 74 N -3.26 4.13 0.09 3.23 2.20 -1.00 -4.92 119.74 120.20 1y1p s LYS 74 Ca -0.02 2.55 -0.31 0.00 -0.36 0.00 0.00 55.97 57.83 1y1p s LYS 74 Cb 0.14 -3.01 -0.09 0.00 -1.51 0.00 0.00 37.83 33.37 1y1p s LYS 74 CO 0.86 -0.56 1.64 -1.14 -0.36 0.00 0.00 175.35 175.78 1y1p s GLN 75 N -1.21 4.20 0.00 4.03 0.74 -1.26 -1.81 119.66 124.35 1y1p s GLN 75 Ca 0.58 2.34 0.00 0.00 0.05 0.00 0.00 55.36 58.33 1y1p s GLN 75 Cb -0.47 -3.50 0.00 0.00 1.10 0.00 0.00 33.01 30.14 1y1p s GLN 75 CO 0.54 -0.71 0.00 0.41 -0.55 0.00 0.00 175.29 174.98 1y1p n GLY 76 N 3.95 0.71 0.43 2.59 0.00 -1.26 -4.94 105.19 106.67 1y1p n GLY 76 Ca 0.15 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.42 1y1p n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y1p h ALA 77 N 0.00 2.47 -0.16 4.61 0.00 -1.67 -1.91 119.26 122.60 1y1p h ALA 77 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1y1p h ALA 77 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1y1p h ALA 77 CO 0.00 -0.80 0.00 0.66 0.00 0.00 0.00 179.25 179.11 1y1p n TYR 78 N -4.46 0.18 -0.28 0.00 4.02 -1.26 -4.66 117.16 110.71 1y1p n TYR 78 Ca 0.22 -0.11 0.08 0.00 -0.01 0.00 0.00 57.90 58.08 1y1p n TYR 78 Cb 0.89 -0.00 0.21 0.00 -0.02 0.00 0.00 39.34 40.42 1y1p n TYR 78 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1y1p h ASP 79 N 3.71 -0.21 0.09 7.72 5.19 -1.75 -1.41 116.42 129.77 1y1p h ASP 79 Ca 0.00 0.20 -0.22 0.00 -0.62 0.00 0.00 57.03 56.39 1y1p h ASP 79 Cb 0.82 0.31 -0.00 0.00 0.18 0.00 0.00 39.33 40.65 1y1p h ASP 79 CO 0.00 -0.17 -1.10 -0.33 -3.12 0.00 0.00 179.24 174.52 1y1p h GLU 80 N 0.15 0.20 0.00 3.56 4.39 -1.83 -3.36 114.58 117.69 1y1p h GLU 80 Ca 0.47 -0.34 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 1y1p h GLU 80 Cb 0.89 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.66 1y1p h GLU 80 CO -0.67 1.16 -0.18 -0.39 -1.16 0.00 0.00 179.01 177.77 1y1p h VAL 81 N -0.48 0.56 0.00 3.13 -1.51 -1.81 -2.91 116.25 113.23 1y1p h VAL 81 Ca -0.24 -0.87 0.00 0.00 -1.23 0.00 0.00 66.70 64.36 1y1p h VAL 81 Cb 1.60 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 32.34 1y1p h VAL 81 CO 0.04 0.18 -0.30 0.00 -1.23 0.00 0.00 177.57 176.26 1y1p n ILE 82 N -3.49 0.06 -1.68 7.19 3.06 -0.54 -4.83 119.36 119.12 1y1p n ILE 82 Ca -0.01 -0.04 -0.48 0.00 -2.50 0.00 0.00 62.75 59.73 1y1p n ILE 82 Cb 0.35 -0.10 -0.04 0.00 0.54 0.00 0.00 39.64 40.38 1y1p n ILE 82 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22 1y1p n LYS 83 N -1.59 2.27 -0.06 9.51 4.81 -1.10 -1.29 118.16 130.71 1y1p n LYS 83 Ca 0.06 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.33 1y1p n LYS 83 Cb 0.35 -2.69 0.00 0.00 0.02 0.00 0.00 35.03 32.71 1y1p n LYS 83 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1y1p n GLY 84 N 4.42 1.90 3.77 3.14 0.00 -1.26 -5.03 105.19 112.13 1y1p n GLY 84 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 1y1p n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y1p s ALA 85 N -2.73 3.52 -0.07 4.61 0.00 -0.41 -4.65 121.76 122.03 1y1p s ALA 85 Ca 0.00 1.29 0.21 0.00 0.00 0.00 0.00 51.96 53.46 1y1p s ALA 85 Cb 0.00 -3.50 -0.32 0.00 0.00 0.00 0.00 23.12 19.31 1y1p s ALA 85 CO 0.00 -0.68 0.40 0.00 0.00 0.00 0.00 175.76 175.48 1y1p n ALA 86 N 0.94 2.52 -2.45 0.00 0.00 0.11 -2.63 120.51 119.00 1y1p n ALA 86 Ca 0.01 -0.69 -0.08 0.00 0.00 0.00 0.00 53.44 52.67 1y1p n ALA 86 Cb 0.41 -0.63 -0.10 0.00 0.00 0.00 0.00 19.45 19.13 1y1p n ALA 86 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1y1p s GLY 87 N -4.73 0.38 -0.02 0.00 0.00 -1.15 -0.70 107.32 101.10 1y1p s GLY 87 Ca -0.08 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 43.69 1y1p s GLY 87 CO 0.89 -1.05 -0.03 0.14 0.00 0.00 0.00 173.10 173.05 1y1p s VAL 88 N -2.93 0.30 -0.26 1.40 1.01 -0.52 -0.91 120.40 118.49 1y1p s VAL 88 Ca -0.02 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.91 1y1p s VAL 88 Cb 0.01 -0.31 0.07 0.00 0.00 0.00 0.00 36.38 36.14 1y1p s VAL 88 CO -0.06 0.13 -0.06 0.00 0.00 0.00 0.00 175.10 175.10 1y1p s ALA 89 N 0.44 2.39 -0.48 5.51 0.00 0.71 -0.65 121.76 129.68 1y1p s ALA 89 Ca -0.05 -1.74 -0.19 0.00 0.00 0.00 0.00 51.96 49.98 1y1p s ALA 89 Cb -0.08 -1.59 0.05 0.00 0.00 0.00 0.00 23.12 21.50 1y1p s ALA 89 CO -0.01 -1.28 0.61 -1.58 0.00 0.00 0.00 175.76 173.51 1y1p s HIS 90 N 1.18 3.06 -0.08 0.00 2.46 -0.35 -1.57 115.29 119.99 1y1p s HIS 90 Ca -0.05 -0.42 0.07 0.00 0.47 0.00 0.00 55.06 55.13 1y1p s HIS 90 Cb -0.19 -3.44 -0.10 0.00 -0.13 0.00 0.00 32.58 28.72 1y1p s HIS 90 CO -0.06 -0.97 0.02 -0.89 -2.47 0.00 0.00 174.74 170.36 1y1p n ILE 91 N 5.65 0.56 -1.78 0.89 5.41 -1.22 -1.71 119.36 127.16 1y1p n ILE 91 Ca -0.05 -0.33 -0.42 0.00 1.00 0.00 0.00 62.75 62.95 1y1p n ILE 91 Cb 0.46 -0.79 -0.02 0.00 -0.71 0.00 0.00 39.64 38.58 1y1p n ILE 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1y1p s ALA 92 N -2.20 3.75 0.16 -1.39 0.00 -1.13 -4.86 121.76 116.10 1y1p s ALA 92 Ca -0.05 1.56 -0.24 0.00 0.00 0.00 0.00 51.96 53.24 1y1p s ALA 92 Cb 0.03 -3.65 0.06 0.00 0.00 0.00 0.00 23.12 19.56 1y1p s ALA 92 CO 0.32 -0.97 0.69 0.45 0.00 0.00 0.00 175.76 176.26 1y1p s SER 93 N 0.54 -0.44 -0.14 0.00 0.15 -1.26 -4.91 113.70 107.64 1y1p s SER 93 Ca 0.64 -0.16 -0.29 0.00 0.70 0.00 0.00 55.95 56.83 1y1p s SER 93 Cb -0.48 0.59 -0.03 0.00 -1.71 0.00 0.00 66.02 64.39 1y1p s SER 93 CO 0.47 -1.00 1.53 -0.69 1.20 0.00 0.00 173.24 174.75 1y1p s VAL 94 N -3.66 3.82 -0.14 4.45 1.01 -1.26 -4.88 120.40 119.73 1y1p s VAL 94 Ca 0.05 0.97 0.16 0.00 0.00 0.00 0.00 61.98 63.15 1y1p s VAL 94 Cb -0.02 -3.69 0.42 0.00 0.00 0.00 0.00 36.38 33.09 1y1p s VAL 94 CO -0.07 -0.15 1.20 1.33 0.00 0.00 0.00 175.10 177.41 1y1p n VAL 95 N 5.72 1.51 0.49 2.92 0.24 -1.26 -4.74 118.33 123.21 1y1p n VAL 95 Ca 0.17 -2.53 0.13 0.00 -2.04 0.00 0.00 64.34 60.07 1y1p n VAL 95 Cb 0.44 0.15 0.40 0.00 -1.47 0.00 0.00 33.84 33.36 1y1p n VAL 95 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 1y1p h SER 96 N 0.99 0.00 -5.91 -1.34 0.87 -1.97 -3.47 113.55 102.72 1y1p h SER 96 Ca -0.07 0.00 -0.40 0.00 -1.23 0.00 0.00 61.79 60.08 1y1p h SER 96 Cb 1.28 0.00 0.11 0.00 -0.44 0.00 0.00 62.40 63.35 1y1p h SER 96 CO 0.03 0.00 -0.71 0.49 -0.53 0.00 0.00 176.83 176.11 1y1p n PHE 97 N -2.45 -2.66 -2.99 2.24 3.72 -1.26 -4.98 117.46 109.08 1y1p n PHE 97 Ca 0.04 0.98 -0.34 0.00 -0.05 0.00 0.00 57.45 58.09 1y1p n PHE 97 Cb 0.40 -4.84 -0.06 0.00 -0.94 0.00 0.00 39.48 34.03 1y1p n PHE 97 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1y1p s SER 98 N -3.50 6.95 0.00 4.37 0.15 -1.26 -4.79 113.70 115.61 1y1p s SER 98 Ca 0.50 1.50 0.10 0.00 0.70 0.00 0.00 55.95 58.74 1y1p s SER 98 Cb -0.23 -2.46 0.33 0.00 -1.71 0.00 0.00 66.02 61.96 1y1p s SER 98 CO 0.75 -0.18 1.26 -0.46 1.20 0.00 0.00 173.24 175.80 1y1p n ASN 99 N -0.11 1.32 -4.47 5.45 2.04 -1.26 -4.70 115.26 113.52 1y1p n ASN 99 Ca 0.03 -1.93 -0.43 0.00 -0.44 0.00 0.00 54.58 51.80 1y1p n ASN 99 Cb 0.53 -0.15 -0.05 0.00 -2.53 0.00 0.00 39.78 37.57 1y1p n ASN 99 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1y1p s LYS 100 N -1.70 3.19 0.29 -3.83 -0.14 -1.26 -4.90 119.74 111.39 1y1p s LYS 100 Ca 0.19 -0.69 0.03 0.00 -1.36 0.00 0.00 55.97 54.14 1y1p s LYS 100 Cb 0.10 -4.10 0.68 0.00 -1.68 0.00 0.00 37.83 32.84 1y1p s LYS 100 CO 0.14 -1.36 1.73 -0.92 -0.76 0.00 0.00 175.35 174.18 1y1p h TYR 101 N 9.15 0.80 -0.78 3.18 5.03 -1.85 -1.58 116.97 130.91 1y1p h TYR 101 Ca -0.27 0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.03 1y1p h TYR 101 Cb 1.09 -0.21 -0.03 0.00 1.55 0.00 0.00 36.73 39.12 1y1p h TYR 101 CO 0.82 0.09 0.32 0.22 -1.32 0.00 0.00 178.16 178.29 1y1p h ASP 102 N 0.55 1.06 0.18 -2.11 3.58 -1.97 -0.52 116.42 117.18 1y1p h ASP 102 Ca 0.54 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.84 1y1p h ASP 102 Cb 0.92 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.70 1y1p h ASP 102 CO -0.44 0.93 -0.06 -0.62 -2.88 0.00 0.00 179.24 176.17 1y1p n GLU 103 N -4.29 1.00 0.03 0.28 1.02 -0.63 -4.01 120.64 114.05 1y1p n GLU 103 Ca 0.07 -0.35 0.00 0.00 -0.02 0.00 0.00 57.16 56.86 1y1p n GLU 103 Cb 0.18 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 1y1p n GLU 103 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1y1p n VAL 104 N -0.70 0.62 0.28 2.62 0.31 -1.02 -4.75 118.33 115.68 1y1p n VAL 104 Ca 0.18 0.20 -0.15 0.00 -0.01 0.00 0.00 64.34 64.57 1y1p n VAL 104 Cb 0.25 -1.48 -0.08 0.00 -0.91 0.00 0.00 33.84 31.63 1y1p n VAL 104 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1y1p h VAL 105 N 0.00 0.34 -0.29 2.52 2.07 -1.32 -2.54 116.25 117.03 1y1p h VAL 105 Ca 0.00 -0.38 0.07 0.00 0.82 0.00 0.00 66.70 67.21 1y1p h VAL 105 Cb 0.44 0.46 -0.08 0.00 -1.52 0.00 0.00 31.29 30.59 1y1p h VAL 105 CO 0.00 0.05 -0.24 0.74 0.02 0.00 0.00 177.57 178.14 1y1p h THR 106 N -0.99 0.38 -0.43 2.57 2.02 -1.70 -1.58 112.91 113.18 1y1p h THR 106 Ca -0.07 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 1y1p h THR 106 Cb 0.63 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1y1p h THR 106 CO 0.12 0.00 0.08 -0.65 0.37 0.00 0.00 175.52 175.44 1y1p h PRO 107 N -0.22 0.65 -0.36 6.66 0.11 -1.76 0.16 132.00 137.23 1y1p h PRO 107 Ca 0.15 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1y1p h PRO 107 Cb 0.46 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.45 1y1p h PRO 107 CO -0.42 0.61 0.24 0.00 -0.21 0.00 0.00 178.00 178.21 1y1p h ALA 108 N 1.47 0.46 -0.17 -0.75 0.00 -0.87 0.32 119.26 119.72 1y1p h ALA 108 Ca 0.14 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1y1p h ALA 108 Cb 0.27 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1y1p h ALA 108 CO 0.00 -0.07 -0.08 0.82 0.00 0.00 0.00 179.25 179.92 1y1p h ILE 109 N 0.49 1.31 -0.68 0.00 2.04 -1.09 -2.46 117.51 117.12 1y1p h ILE 109 Ca 0.13 -1.12 0.04 0.00 1.00 0.00 0.00 64.86 64.91 1y1p h ILE 109 Cb -0.05 1.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 1y1p h ILE 109 CO -0.03 0.33 0.41 1.23 0.00 0.00 0.00 178.15 180.10 1y1p h GLY 110 N 0.02 0.99 1.30 5.37 0.00 -0.70 -0.04 103.07 110.01 1y1p h GLY 110 Ca 0.04 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 46.98 1y1p h GLY 110 CO 0.02 0.23 -0.05 -1.33 0.00 0.00 0.00 176.54 175.42 1y1p h GLY 111 N 0.79 0.91 0.79 4.60 0.00 -0.36 -0.61 103.07 109.17 1y1p h GLY 111 Ca 0.29 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 1y1p h GLY 111 CO -0.13 0.60 0.01 -0.84 0.00 0.00 0.00 176.54 176.18 1y1p h THR 112 N 0.77 1.24 -0.18 4.70 2.02 -0.89 -2.52 112.91 118.05 1y1p h THR 112 Ca 0.14 -0.78 -0.11 0.00 0.77 0.00 0.00 66.41 66.43 1y1p h THR 112 Cb 0.53 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1y1p h THR 112 CO 0.03 0.23 -0.38 -0.07 0.37 0.00 0.00 175.52 175.70 1y1p h LEU 113 N -0.02 0.42 -0.85 2.58 3.38 -0.92 -1.39 115.31 118.51 1y1p h LEU 113 Ca 0.04 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1y1p h LEU 113 Cb 0.34 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1y1p h LEU 113 CO 0.01 0.76 0.30 -1.13 0.09 0.00 0.00 178.44 178.47 1y1p h ASN 114 N 0.34 1.06 -0.25 -0.43 -1.24 -1.05 0.13 115.58 114.14 1y1p h ASN 114 Ca 0.03 -0.16 -0.19 0.00 0.71 0.00 0.00 56.30 56.69 1y1p h ASN 114 Cb 0.82 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.59 1y1p h ASN 114 CO 0.07 0.94 -0.58 0.00 -1.29 0.00 0.00 177.43 176.57 1y1p h ALA 115 N 1.21 0.41 -0.64 1.57 0.00 -1.24 -2.39 119.26 118.18 1y1p h ALA 115 Ca 0.26 -0.52 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1y1p h ALA 115 Cb 0.22 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1y1p h ALA 115 CO -0.02 0.64 0.06 -0.07 0.00 0.00 0.00 179.25 179.86 1y1p h LEU 116 N 0.60 1.04 -0.75 0.00 3.38 -0.91 -1.83 115.31 116.83 1y1p h LEU 116 Ca -0.00 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.61 1y1p h LEU 116 Cb 1.19 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1y1p h LEU 116 CO 0.13 1.06 -0.06 0.03 0.09 0.00 0.00 178.44 179.69 1y1p h ARG 117 N 1.00 0.89 -0.51 1.13 3.08 -0.74 -0.19 114.38 119.04 1y1p h ARG 117 Ca 0.19 -0.28 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1y1p h ARG 117 Cb 0.49 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1y1p h ARG 117 CO 0.02 0.92 0.24 0.00 -1.07 0.00 0.00 179.97 180.08 1y1p h ALA 118 N 1.12 0.66 -0.70 0.04 0.00 -1.18 -1.27 119.26 117.93 1y1p h ALA 118 Ca 0.14 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1y1p h ALA 118 Cb 0.56 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1y1p h ALA 118 CO 0.03 0.23 0.24 0.00 0.00 0.00 0.00 179.25 179.76 1y1p h ALA 119 N 1.08 0.91 -0.10 0.00 0.00 -0.99 -2.37 119.26 117.79 1y1p h ALA 119 Ca 0.17 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1y1p h ALA 119 Cb 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1y1p h ALA 119 CO -0.02 0.57 -0.10 0.00 0.00 0.00 0.00 179.25 179.70 1y1p h ALA 120 N 1.11 1.64 -0.01 0.00 0.00 -0.66 -2.03 119.26 119.31 1y1p h ALA 120 Ca 0.23 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1y1p h ALA 120 Cb 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1y1p h ALA 120 CO -0.01 0.27 -0.06 0.00 0.00 0.00 0.00 179.25 179.44 1y1p n ALA 121 N -2.50 2.71 -3.95 0.00 0.00 -0.51 -4.67 120.51 111.59 1y1p n ALA 121 Ca -0.01 -0.35 -0.32 0.00 0.00 0.00 0.00 53.44 52.76 1y1p n ALA 121 Cb 0.22 -1.26 -0.14 0.00 0.00 0.00 0.00 19.45 18.27 1y1p n ALA 121 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1y1p s THR 122 N -2.18 2.58 0.46 0.00 2.01 -0.76 -4.99 115.64 112.75 1y1p s THR 122 Ca 0.36 -2.57 0.28 0.00 0.31 0.00 0.00 61.69 60.07 1y1p s THR 122 Cb 0.21 -2.84 0.48 0.00 0.01 0.00 0.00 72.50 70.36 1y1p s THR 122 CO 0.40 -0.68 1.75 -0.65 -0.69 0.00 0.00 174.62 174.75 1y1p h PRO 123 N 7.38 0.19 0.00 4.92 0.11 -1.83 -0.78 132.00 141.99 1y1p h PRO 123 Ca -0.06 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 1y1p h PRO 123 Cb 0.99 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 1y1p h PRO 123 CO 0.60 0.12 -0.12 0.66 -0.21 0.00 0.00 178.00 179.05 1y1p h SER 124 N 0.19 0.00 -2.93 -2.05 4.64 -1.92 -3.42 113.55 108.07 1y1p h SER 124 Ca 0.64 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.39 1y1p h SER 124 Cb 2.04 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 64.09 1y1p h SER 124 CO -0.21 0.12 0.91 -0.69 -0.87 0.00 0.00 176.83 176.08 1y1p s VAL 125 N -4.17 4.28 -0.03 0.95 1.01 -0.30 -4.10 120.40 118.04 1y1p s VAL 125 Ca -0.03 1.54 0.06 0.00 0.00 0.00 0.00 61.98 63.56 1y1p s VAL 125 Cb 0.13 -4.02 -0.10 0.00 0.00 0.00 0.00 36.38 32.40 1y1p s VAL 125 CO 0.58 -0.16 0.15 0.29 0.00 0.00 0.00 175.10 175.96 1y1p n LYS 126 N 6.66 0.57 -4.10 2.72 4.76 0.12 -4.47 118.16 124.41 1y1p n LYS 126 Ca 0.14 -0.05 -0.15 0.00 -2.87 0.00 0.00 58.31 55.38 1y1p n LYS 126 Cb 0.45 -1.13 -0.14 0.00 -1.84 0.00 0.00 35.03 32.37 1y1p n LYS 126 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1y1p s ARG 127 N -2.38 0.34 -0.04 1.97 1.81 -1.12 -1.51 118.95 118.03 1y1p s ARG 127 Ca -0.02 -0.16 -0.00 0.00 -1.72 0.00 0.00 55.73 53.82 1y1p s ARG 127 Cb 0.04 -0.32 0.03 0.00 -0.45 0.00 0.00 34.95 34.24 1y1p s ARG 127 CO 0.27 0.09 0.00 0.12 -0.68 0.00 0.00 175.30 175.10 1y1p s PHE 128 N -0.13 0.39 -0.11 -0.53 2.19 -0.02 -1.43 117.98 118.34 1y1p s PHE 128 Ca 0.01 -0.02 0.04 0.00 0.33 0.00 0.00 56.93 57.29 1y1p s PHE 128 Cb -0.02 -0.51 0.00 0.00 -1.31 0.00 0.00 43.02 41.19 1y1p s PHE 128 CO -0.00 -0.17 -0.23 0.54 1.83 0.00 0.00 175.22 177.18 1y1p s VAL 129 N 1.27 2.03 -0.17 3.12 0.11 0.17 -1.88 120.40 125.05 1y1p s VAL 129 Ca -0.06 -0.99 -0.06 0.00 -2.93 0.00 0.00 61.98 57.94 1y1p s VAL 129 Cb -0.13 -1.76 -0.03 0.00 -1.53 0.00 0.00 36.38 32.92 1y1p s VAL 129 CO -0.02 0.55 0.02 -0.22 -3.33 0.00 0.00 175.10 172.10 1y1p s LEU 130 N 0.43 3.57 -0.50 2.54 2.96 -0.26 -1.21 118.68 126.22 1y1p s LEU 130 Ca -0.17 -0.00 -0.24 0.00 -0.22 0.00 0.00 54.13 53.50 1y1p s LEU 130 Cb -0.17 -1.88 0.03 0.00 0.50 0.00 0.00 46.19 44.67 1y1p s LEU 130 CO 0.07 0.18 0.86 -0.89 -1.32 0.00 0.00 176.35 175.25 1y1p s THR 131 N 0.32 4.53 0.00 3.68 2.01 -0.69 -1.22 115.64 124.27 1y1p s THR 131 Ca 0.00 0.35 0.00 0.00 0.31 0.00 0.00 61.69 62.36 1y1p s THR 131 Cb -0.13 -4.42 0.00 0.00 0.01 0.00 0.00 72.50 67.96 1y1p s THR 131 CO 0.01 -0.90 0.00 -0.24 -0.69 0.00 0.00 174.62 172.81 1y1p n SER 132 N 7.04 0.00 -3.52 3.53 2.88 0.54 -4.89 113.62 119.21 1y1p n SER 132 Ca 0.02 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.48 1y1p n SER 132 Cb 0.48 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.92 1y1p n SER 132 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1y1p s SER 133 N -0.76 -0.32 0.62 -3.46 0.15 -1.26 -4.33 113.70 104.34 1y1p s SER 133 Ca 0.00 0.01 0.40 0.00 0.70 0.00 0.00 55.95 57.06 1y1p s SER 133 Cb 0.00 0.34 2.02 0.00 -1.71 0.00 0.00 66.02 66.67 1y1p s SER 133 CO 0.00 -0.54 2.22 0.71 1.20 0.00 0.00 173.24 176.83 1y1p h THR 134 N 2.01 0.00 0.00 6.45 1.35 -1.45 -0.92 112.91 120.34 1y1p h THR 134 Ca -0.20 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1y1p h THR 134 Cb 1.23 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.82 1y1p h THR 134 CO 0.29 0.00 0.00 1.33 -0.25 0.00 0.00 175.52 176.89 1y1p n VAL 135 N -3.06 0.70 1.32 6.82 0.24 -1.25 -0.64 118.33 122.47 1y1p n VAL 135 Ca -0.02 0.18 0.14 0.00 -2.04 0.00 0.00 64.34 62.60 1y1p n VAL 135 Cb 0.16 -0.92 0.67 0.00 -1.47 0.00 0.00 33.84 32.28 1y1p n VAL 135 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1y1p n SER 136 N -1.36 0.15 -0.06 -1.34 7.64 -0.35 -3.70 113.62 114.60 1y1p n SER 136 Ca 0.06 -0.14 -0.10 0.00 1.01 0.00 0.00 58.87 59.70 1y1p n SER 136 Cb 0.14 -0.24 -0.05 0.00 -1.01 0.00 0.00 64.21 63.05 1y1p n SER 136 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y1p n ALA 137 N -1.25 1.88 -3.62 -0.43 0.00 0.19 -0.52 120.51 116.76 1y1p n ALA 137 Ca 0.13 -0.50 -0.04 0.00 0.00 0.00 0.00 53.44 53.03 1y1p n ALA 137 Cb 0.27 0.26 -0.01 0.00 0.00 0.00 0.00 19.45 19.97 1y1p n ALA 137 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1y1p s LEU 138 N -5.98 -0.20 -0.17 0.00 2.34 -0.40 -2.97 118.68 111.31 1y1p s LEU 138 Ca -0.16 -0.16 -0.06 0.00 0.06 0.00 0.00 54.13 53.81 1y1p s LEU 138 Cb 0.05 1.80 -0.04 0.00 -0.56 0.00 0.00 46.19 47.45 1y1p s LEU 138 CO 0.25 -0.56 0.03 -0.63 -1.06 0.00 0.00 176.35 174.38 1y1p s ILE 139 N -2.89 4.49 0.27 1.48 -1.09 -1.26 -3.74 121.20 118.46 1y1p s ILE 139 Ca 0.10 -0.14 -0.29 0.00 -2.23 0.00 0.00 60.65 58.09 1y1p s ILE 139 Cb 0.00 -3.00 -0.14 0.00 -1.58 0.00 0.00 42.46 37.73 1y1p s ILE 139 CO -0.04 0.48 0.99 -2.65 -1.23 0.00 0.00 174.94 172.49 1y1p n PRO 140 N 3.47 1.24 -3.78 2.79 -0.02 -1.26 -4.98 135.00 132.45 1y1p n PRO 140 Ca -0.17 0.43 -0.30 0.00 -2.02 0.00 0.00 63.50 61.45 1y1p n PRO 140 Cb 0.52 -1.79 -0.14 0.00 -0.02 0.00 0.00 33.50 32.08 1y1p n PRO 140 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1y1p s LYS 141 N -1.38 1.31 0.20 -0.52 1.02 -1.26 -4.98 119.74 114.13 1y1p s LYS 141 Ca 0.61 -1.93 -0.32 0.00 0.02 0.00 0.00 55.97 54.34 1y1p s LYS 141 Cb -0.73 -2.50 -0.14 0.00 -0.52 0.00 0.00 37.83 33.93 1y1p s LYS 141 CO 0.59 -1.11 1.36 -2.30 -0.92 0.00 0.00 175.35 172.97 1y1p n PRO 142 N 3.75 1.75 -0.90 -1.68 -0.02 -1.26 -2.40 135.00 134.24 1y1p n PRO 142 Ca 0.06 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1y1p n PRO 142 Cb 0.36 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1y1p n PRO 142 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1y1p n ASN 143 N 2.34 -3.70 -4.68 2.55 3.02 0.12 -4.88 115.26 110.03 1y1p n ASN 143 Ca 0.14 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.29 1y1p n ASN 143 Cb 0.28 -2.38 -0.05 0.00 -0.61 0.00 0.00 39.78 37.02 1y1p n ASN 143 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1y1p s VAL 144 N -1.46 5.02 0.50 2.41 1.01 -1.01 -4.98 120.40 121.90 1y1p s VAL 144 Ca 0.00 1.31 -0.03 0.00 0.00 0.00 0.00 61.98 63.25 1y1p s VAL 144 Cb 0.00 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 1y1p s VAL 144 CO 0.00 0.16 0.77 -1.61 0.00 0.00 0.00 175.10 174.42 1y1p s GLU 145 N 1.50 3.21 0.00 2.72 2.02 -1.26 -4.45 118.70 122.44 1y1p s GLU 145 Ca 0.32 -0.09 0.00 0.00 0.02 0.00 0.00 54.97 55.23 1y1p s GLU 145 Cb -0.16 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.65 1y1p s GLU 145 CO 0.13 -0.35 0.00 0.41 0.02 0.00 0.00 175.26 175.47 1y1p n GLY 146 N -2.28 0.50 3.52 -1.39 0.00 -1.26 -5.03 105.19 99.25 1y1p n GLY 146 Ca 0.02 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 1y1p n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y1p s ILE 147 N -2.00 5.26 -0.13 -0.61 1.01 -1.26 -5.04 121.20 118.43 1y1p s ILE 147 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 1y1p s ILE 147 Cb 0.00 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.78 1y1p s ILE 147 CO 0.00 -0.03 -0.06 -0.47 0.00 0.00 0.00 174.94 174.38 1y1p s TYR 148 N 1.72 1.49 -0.22 3.97 5.04 -1.26 -1.21 117.35 126.87 1y1p s TYR 148 Ca 0.06 -0.80 -0.10 0.00 -2.44 0.00 0.00 57.07 53.79 1y1p s TYR 148 Cb -0.18 -1.23 -0.05 0.00 0.35 0.00 0.00 41.96 40.86 1y1p s TYR 148 CO 0.10 -0.53 0.13 -0.51 -1.34 0.00 0.00 175.55 173.40 1y1p s LEU 149 N 1.71 4.09 0.00 6.97 2.01 0.31 -4.98 118.68 128.79 1y1p s LEU 149 Ca 0.04 0.14 0.00 0.00 0.01 0.00 0.00 54.13 54.32 1y1p s LEU 149 Cb -0.13 -2.08 -0.00 0.00 0.01 0.00 0.00 46.19 43.99 1y1p s LEU 149 CO -0.08 0.12 0.01 -0.90 1.01 0.00 0.00 176.35 176.51 1y1p n ASP 150 N 3.94 1.41 0.00 2.29 5.68 -1.26 -0.41 116.55 128.19 1y1p n ASP 150 Ca -0.16 -1.19 0.07 0.00 -0.50 0.00 0.00 54.79 53.02 1y1p n ASP 150 Cb 0.52 0.07 0.42 0.00 -1.14 0.00 0.00 41.12 40.98 1y1p n ASP 150 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1y1p n GLU 151 N -0.09 0.37 -0.10 0.11 1.02 -1.26 -1.72 120.64 118.97 1y1p n GLU 151 Ca -0.01 0.06 0.07 0.00 -0.02 0.00 0.00 57.16 57.26 1y1p n GLU 151 Cb 0.05 -1.50 0.12 0.00 -0.02 0.00 0.00 31.44 30.10 1y1p n GLU 151 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1y1p n LYS 152 N -1.11 1.82 -2.87 3.49 5.02 -1.26 -4.92 118.16 118.34 1y1p n LYS 152 Ca 0.10 -1.74 -0.42 0.00 -2.02 0.00 0.00 58.31 54.23 1y1p n LYS 152 Cb 0.07 -1.31 -0.04 0.00 -0.02 0.00 0.00 35.03 33.74 1y1p n LYS 152 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1y1p s SER 153 N -1.11 6.94 -0.01 4.39 0.01 -0.70 -5.05 113.70 118.18 1y1p s SER 153 Ca 0.23 1.16 0.05 0.00 1.31 0.00 0.00 55.95 58.70 1y1p s SER 153 Cb 0.14 -2.46 -0.01 0.00 0.21 0.00 0.00 66.02 63.90 1y1p s SER 153 CO 0.19 -0.45 -0.16 0.26 0.41 0.00 0.00 173.24 173.49 1y1p s TRP 154 N 2.40 1.45 -1.53 2.43 0.52 -1.26 -4.37 118.94 118.59 1y1p s TRP 154 Ca 0.38 -0.27 -0.11 0.00 0.02 0.00 0.00 56.10 56.12 1y1p s TRP 154 Cb -0.16 -0.94 -0.01 0.00 -1.15 0.00 0.00 33.47 31.21 1y1p s TRP 154 CO 0.11 -0.03 2.60 -1.71 0.02 0.00 0.00 176.95 177.94 1y1p n ASN 155 N 2.68 6.80 0.10 2.95 2.85 0.32 -4.68 115.26 126.29 1y1p n ASN 155 Ca -0.15 -2.74 0.03 0.00 -0.11 0.00 0.00 54.58 51.62 1y1p n ASN 155 Cb 0.54 -1.57 0.42 0.00 1.24 0.00 0.00 39.78 40.41 1y1p n ASN 155 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1y1p h LEU 156 N 7.98 0.27 -1.75 1.20 3.38 -1.87 -2.45 115.31 122.07 1y1p h LEU 156 Ca 0.73 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.63 1y1p h LEU 156 Cb 0.43 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1y1p h LEU 156 CO 1.79 0.34 -0.17 1.05 0.09 0.00 0.00 178.44 181.54 1y1p h GLU 157 N 0.29 0.00 -0.15 1.13 4.11 -1.96 -2.72 114.58 115.28 1y1p h GLU 157 Ca 0.07 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.42 1y1p h GLU 157 Cb 0.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1y1p h GLU 157 CO 0.01 0.17 -0.24 0.66 0.07 0.00 0.00 179.01 179.68 1y1p h SER 158 N 0.00 0.25 -0.61 3.06 4.64 -1.79 -1.91 113.55 117.20 1y1p h SER 158 Ca -0.00 -0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1y1p h SER 158 Cb 0.38 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.37 1y1p h SER 158 CO 0.02 0.50 0.36 0.40 -0.87 0.00 0.00 176.83 177.24 1y1p h ILE 159 N 0.23 1.18 -0.01 0.95 2.04 -1.60 0.11 117.51 120.42 1y1p h ILE 159 Ca 0.04 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1y1p h ILE 159 Cb 0.55 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1y1p h ILE 159 CO 0.04 0.19 -0.10 -0.78 0.00 0.00 0.00 178.15 177.50 1y1p h ASP 160 N 0.83 0.11 -0.40 1.72 3.58 -1.63 -3.30 116.42 117.33 1y1p h ASP 160 Ca 0.22 -0.71 -0.01 0.00 0.42 0.00 0.00 57.03 56.94 1y1p h ASP 160 Cb -0.01 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 1y1p h ASP 160 CO -0.04 0.81 0.22 0.11 -2.88 0.00 0.00 179.24 177.46 1y1p h LYS 161 N -0.58 0.59 0.00 0.28 1.57 -1.30 -1.46 116.57 115.67 1y1p h LYS 161 Ca -0.01 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1y1p h LYS 161 Cb 0.81 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1y1p h LYS 161 CO 0.02 0.45 0.00 0.00 -0.57 0.00 0.00 179.45 179.35 1y1p n ALA 162 N -2.47 1.00 -0.99 3.86 0.00 0.39 -1.87 120.51 120.43 1y1p n ALA 162 Ca 0.03 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1y1p n ALA 162 Cb 0.11 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1y1p n ALA 162 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1y1p n LYS 163 N -1.63 0.02 -0.04 0.00 2.85 -0.82 -4.72 118.16 113.82 1y1p n LYS 163 Ca -0.00 -0.33 -0.04 0.00 -1.05 0.00 0.00 58.31 56.89 1y1p n LYS 163 Cb 0.01 -0.51 -0.05 0.00 -0.65 0.00 0.00 35.03 33.83 1y1p n LYS 163 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1y1p n THR 164 N -0.00 0.49 -2.07 0.58 -2.24 -0.61 -5.01 114.28 105.42 1y1p n THR 164 Ca 0.00 -0.28 -0.41 0.00 -2.27 0.00 0.00 64.05 61.09 1y1p n THR 164 Cb 0.41 -0.81 -0.02 0.00 -2.10 0.00 0.00 70.33 67.80 1y1p n THR 164 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1y1p s LEU 165 N -4.69 4.41 0.70 3.22 1.43 -0.78 -4.98 118.68 117.98 1y1p s LEU 165 Ca -0.05 2.70 -0.14 0.00 -1.03 0.00 0.00 54.13 55.62 1y1p s LEU 165 Cb 0.02 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.62 1y1p s LEU 165 CO 0.28 -0.60 1.12 -2.16 0.23 0.00 0.00 176.35 175.21 1y1p s PRO 166 N -1.41 2.53 0.14 1.29 0.04 -1.26 -4.88 135.00 131.45 1y1p s PRO 166 Ca 0.52 1.37 0.16 0.00 0.04 0.00 0.00 61.00 63.09 1y1p s PRO 166 Cb -0.41 -1.92 0.72 0.00 0.04 0.00 0.00 34.50 32.94 1y1p s PRO 166 CO 0.51 -1.46 1.49 0.39 0.04 0.00 0.00 177.00 177.97 1y1p n GLU 167 N -2.80 0.09 0.23 4.56 1.02 -1.26 -2.08 120.64 120.40 1y1p n GLU 167 Ca 0.10 0.43 0.12 0.00 -0.02 0.00 0.00 57.16 57.80 1y1p n GLU 167 Cb 0.52 -1.71 0.31 0.00 -0.02 0.00 0.00 31.44 30.55 1y1p n GLU 167 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1y1p h SER 168 N 0.00 0.00 -2.63 1.62 4.64 -2.03 -3.44 113.55 111.72 1y1p h SER 168 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 1y1p h SER 168 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1y1p h SER 168 CO 0.00 0.06 1.10 -0.62 -0.87 0.00 0.00 176.83 176.50 1y1p s ASP 169 N -6.10 6.61 0.23 4.97 3.68 -0.88 -4.85 116.67 120.33 1y1p s ASP 169 Ca 0.05 2.11 0.15 0.00 2.13 0.00 0.00 52.55 56.99 1y1p s ASP 169 Cb 0.07 -2.53 0.79 0.00 -1.45 0.00 0.00 42.92 39.80 1y1p s ASP 169 CO 0.64 -0.99 1.42 -0.81 0.13 0.00 0.00 175.17 175.56 1y1p n PRO 170 N 7.23 0.09 -0.07 4.34 -0.04 -1.26 -0.61 135.00 144.68 1y1p n PRO 170 Ca 0.18 0.58 0.12 0.00 -0.04 0.00 0.00 63.50 64.34 1y1p n PRO 170 Cb 0.43 -1.86 0.21 0.00 -0.04 0.00 0.00 33.50 32.24 1y1p n PRO 170 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1y1p n GLN 171 N -2.01 2.27 -0.08 0.54 1.13 -1.26 -4.59 117.38 113.38 1y1p n GLN 171 Ca -0.01 -1.88 -0.12 0.00 -1.94 0.00 0.00 57.00 53.05 1y1p n GLN 171 Cb 0.07 -1.48 -0.07 0.00 0.11 0.00 0.00 30.24 28.87 1y1p n GLN 171 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1y1p h LYS 172 N 4.17 -0.42 -0.01 -1.09 1.63 -1.17 0.08 116.57 119.75 1y1p h LYS 172 Ca 0.00 0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.81 1y1p h LYS 172 Cb 0.90 0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.62 1y1p h LYS 172 CO 0.00 -0.28 -0.09 0.66 -3.45 0.00 0.00 179.45 176.29 1y1p h SER 173 N -0.43 0.02 -0.38 4.20 4.64 -1.82 -1.14 113.55 118.64 1y1p h SER 173 Ca 0.09 -0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.26 1y1p h SER 173 Cb 0.62 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1y1p h SER 173 CO -0.52 0.11 -0.35 0.25 -0.87 0.00 0.00 176.83 175.46 1y1p h LEU 174 N 0.02 0.97 -0.74 5.97 5.85 -1.50 -1.08 115.31 124.79 1y1p h LEU 174 Ca 0.00 -0.46 -0.13 0.00 0.84 0.00 0.00 57.88 58.14 1y1p h LEU 174 Cb 0.18 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1y1p h LEU 174 CO 0.01 1.23 -0.42 -0.50 -0.34 0.00 0.00 178.44 178.42 1y1p h TRP 175 N 0.72 0.54 -0.46 1.25 4.06 -0.37 0.29 115.95 121.98 1y1p h TRP 175 Ca 0.06 -0.16 -0.08 0.00 2.06 0.00 0.00 58.89 60.77 1y1p h TRP 175 Cb 0.94 -0.12 -0.02 0.00 -1.00 0.00 0.00 29.16 28.97 1y1p h TRP 175 CO 0.06 0.80 -0.04 0.28 -3.56 0.00 0.00 178.44 175.99 1y1p h VAL 176 N 0.37 1.27 -0.41 1.49 2.07 -1.12 0.47 116.25 120.39 1y1p h VAL 176 Ca 0.03 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 1y1p h VAL 176 Cb 0.90 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 1y1p h VAL 176 CO 0.08 0.38 0.14 0.22 0.02 0.00 0.00 177.57 178.41 1y1p h TYR 177 N 0.68 0.65 -0.74 1.57 5.03 -0.97 -0.98 116.97 122.21 1y1p h TYR 177 Ca 0.13 -0.06 0.01 0.00 2.58 0.00 0.00 58.73 61.38 1y1p h TYR 177 Cb 0.55 -0.19 -0.04 0.00 1.55 0.00 0.00 36.73 38.61 1y1p h TYR 177 CO 0.04 0.60 0.49 0.00 -1.32 0.00 0.00 178.16 177.96 1y1p h ALA 178 N 0.98 0.94 -0.74 1.82 0.00 -0.70 -1.16 119.26 120.39 1y1p h ALA 178 Ca 0.13 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1y1p h ALA 178 Cb 0.25 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1y1p h ALA 178 CO -0.01 0.36 0.32 0.00 0.00 0.00 0.00 179.25 179.93 1y1p h ALA 179 N 1.27 1.16 -0.44 0.00 0.00 -0.60 0.30 119.26 120.95 1y1p h ALA 179 Ca 0.27 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1y1p h ALA 179 Cb -0.11 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.37 1y1p h ALA 179 CO -0.06 0.62 0.19 0.66 0.00 0.00 0.00 179.25 180.66 1y1p h SER 180 N 1.07 0.59 -0.25 0.00 4.64 -0.29 0.12 113.55 119.43 1y1p h SER 180 Ca 0.25 -0.15 -0.06 0.00 -0.47 0.00 0.00 61.79 61.36 1y1p h SER 180 Cb 0.17 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1y1p h SER 180 CO -0.03 0.58 -0.08 0.11 -0.87 0.00 0.00 176.83 176.54 1y1p h LYS 181 N 0.57 0.50 0.30 4.77 1.79 -0.96 -1.24 116.57 122.30 1y1p h LYS 181 Ca 0.15 -0.20 -0.01 0.00 -2.18 0.00 0.00 60.65 58.40 1y1p h LYS 181 Cb 0.16 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 1y1p h LYS 181 CO -0.02 0.74 -0.14 1.15 -1.08 0.00 0.00 179.45 180.10 1y1p h THR 182 N 0.24 0.71 -0.37 -0.16 2.02 -0.77 -1.04 112.91 113.54 1y1p h THR 182 Ca 0.06 -0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.17 1y1p h THR 182 Cb 0.56 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1y1p h THR 182 CO 0.03 0.00 -0.07 -0.33 0.37 0.00 0.00 175.52 175.52 1y1p h GLU 183 N -0.40 0.61 -0.35 6.66 5.08 -0.81 -1.25 114.58 124.12 1y1p h GLU 183 Ca -0.04 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.11 1y1p h GLU 183 Cb 0.31 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1y1p h GLU 183 CO 0.07 0.68 0.07 0.00 -1.00 0.00 0.00 179.01 178.82 1y1p h ALA 184 N 1.36 0.46 -0.47 3.43 0.00 -1.03 -0.86 119.26 122.15 1y1p h ALA 184 Ca 0.11 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1y1p h ALA 184 Cb 0.46 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1y1p h ALA 184 CO 0.02 0.15 -0.19 1.49 0.00 0.00 0.00 179.25 180.73 1y1p h GLU 185 N 0.41 0.96 -0.70 0.00 4.81 -0.99 -1.91 114.58 117.17 1y1p h GLU 185 Ca 0.11 -0.41 0.02 0.00 -0.13 0.00 0.00 59.36 58.95 1y1p h GLU 185 Cb 0.34 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 1y1p h GLU 185 CO 0.00 1.07 0.45 -0.07 -0.73 0.00 0.00 179.01 179.74 1y1p h LEU 186 N 0.81 0.75 -1.22 1.64 3.38 -1.13 -1.77 115.31 117.77 1y1p h LEU 186 Ca 0.11 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1y1p h LEU 186 Cb 0.77 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1y1p h LEU 186 CO 0.06 0.53 0.34 0.00 0.09 0.00 0.00 178.44 179.47 1y1p h ALA 187 N 1.28 1.41 -0.05 1.53 0.00 -0.92 -0.93 119.26 121.59 1y1p h ALA 187 Ca 0.27 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1y1p h ALA 187 Cb -0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1y1p h ALA 187 CO -0.09 0.49 0.02 0.00 0.00 0.00 0.00 179.25 179.67 1y1p h ALA 188 N 1.49 0.07 -0.33 0.00 0.00 -0.53 -0.18 119.26 119.78 1y1p h ALA 188 Ca 0.23 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1y1p h ALA 188 Cb 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1y1p h ALA 188 CO -0.04 -0.33 -0.11 -1.49 0.00 0.00 0.00 179.25 177.28 1y1p h TRP 189 N -0.10 0.60 -0.65 0.00 4.06 -1.14 -1.83 115.95 116.89 1y1p h TRP 189 Ca 0.02 -0.09 -0.07 0.00 2.06 0.00 0.00 58.89 60.81 1y1p h TRP 189 Cb 0.19 -0.16 -0.03 0.00 -1.00 0.00 0.00 29.16 28.16 1y1p h TRP 189 CO -0.01 0.65 0.15 -0.22 -3.56 0.00 0.00 178.44 175.45 1y1p h LYS 190 N 0.52 1.05 -0.77 0.49 3.64 -0.99 -1.32 116.57 119.18 1y1p h LYS 190 Ca 0.10 -0.26 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 1y1p h LYS 190 Cb 0.50 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.15 1y1p h LYS 190 CO 0.03 0.94 0.42 0.35 -2.27 0.00 0.00 179.45 178.92 1y1p h PHE 191 N 0.97 1.05 -0.43 1.91 3.04 -0.54 -0.65 116.94 122.29 1y1p h PHE 191 Ca 0.20 -0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.11 1y1p h PHE 191 Cb 0.37 -0.34 -0.02 0.00 2.56 0.00 0.00 35.95 38.53 1y1p h PHE 191 CO 0.03 0.73 0.17 0.52 -2.02 0.00 0.00 178.31 177.75 1y1p h MET 192 N 1.06 0.63 -0.14 1.11 2.86 -0.90 -0.04 114.93 119.51 1y1p h MET 192 Ca 0.27 -0.11 -0.13 0.00 -2.06 0.00 0.00 59.70 57.66 1y1p h MET 192 Cb 0.03 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1y1p h MET 192 CO -0.04 0.58 -0.49 -0.44 1.06 0.00 0.00 176.91 177.58 1y1p h ASP 193 N 0.55 0.40 0.15 1.22 3.32 -0.96 0.68 116.42 121.77 1y1p h ASP 193 Ca 0.14 -0.19 -0.21 0.00 0.02 0.00 0.00 57.03 56.79 1y1p h ASP 193 Cb 0.18 -0.11 0.02 0.00 0.22 0.00 0.00 39.33 39.64 1y1p h ASP 193 CO -0.01 0.83 -0.93 -0.33 -1.72 0.00 0.00 179.24 177.07 1y1p h GLU 194 N 0.30 0.33 0.00 3.56 5.08 -1.02 -3.38 114.58 119.44 1y1p h GLU 194 Ca 0.01 -0.56 -0.14 0.00 -1.00 0.00 0.00 59.36 57.68 1y1p h GLU 194 Cb 0.97 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 1y1p h GLU 194 CO 0.08 1.27 -1.44 0.09 -1.00 0.00 0.00 179.01 178.01 1y1p n ASN 195 N -4.06 0.74 -3.79 1.42 3.02 -0.04 -5.01 115.26 107.53 1y1p n ASN 195 Ca -0.15 0.32 -0.34 0.00 -0.03 0.00 0.00 54.58 54.38 1y1p n ASN 195 Cb 0.86 0.41 0.03 0.00 -0.61 0.00 0.00 39.78 40.47 1y1p n ASN 195 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1y1p n LYS 196 N -2.79 -1.22 -1.16 3.52 5.02 0.23 -4.94 118.16 116.82 1y1p n LYS 196 Ca -0.09 0.37 -0.30 0.00 -2.02 0.00 0.00 58.31 56.27 1y1p n LYS 196 Cb 0.78 -3.83 0.14 0.00 -0.02 0.00 0.00 35.03 32.11 1y1p n LYS 196 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1y1p s PRO 197 N -6.35 1.14 -0.21 1.97 0.04 -1.26 -4.92 135.00 125.41 1y1p s PRO 197 Ca 0.43 0.84 -0.03 0.00 0.04 0.00 0.00 61.00 62.28 1y1p s PRO 197 Cb -0.17 -1.79 0.01 0.00 0.04 0.00 0.00 34.50 32.58 1y1p s PRO 197 CO 0.89 -2.33 2.63 0.72 0.04 0.00 0.00 177.00 178.95 1y1p n HIS 198 N -3.95 0.85 -3.78 0.56 8.25 -1.26 -4.82 115.22 111.07 1y1p n HIS 198 Ca 0.07 -1.64 -0.11 0.00 -0.26 0.00 0.00 57.72 55.77 1y1p n HIS 198 Cb 0.55 -1.14 -0.08 0.00 1.12 0.00 0.00 29.99 30.44 1y1p n HIS 198 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 1y1p s PHE 199 N -0.70 -0.05 -0.09 4.41 -0.12 -1.26 -4.59 117.98 115.57 1y1p s PHE 199 Ca 0.41 -0.11 -0.12 0.00 -0.05 0.00 0.00 56.93 57.06 1y1p s PHE 199 Cb 0.25 0.06 -0.05 0.00 -0.63 0.00 0.00 43.02 42.65 1y1p s PHE 199 CO -0.06 -0.48 0.29 0.99 -0.05 0.00 0.00 175.22 175.91 1y1p s THR 200 N -2.59 5.26 -0.07 -4.49 2.01 -0.57 -4.95 115.64 110.24 1y1p s THR 200 Ca -0.05 0.56 0.00 0.00 0.31 0.00 0.00 61.69 62.51 1y1p s THR 200 Cb -0.01 -3.60 -0.03 0.00 0.01 0.00 0.00 72.50 68.87 1y1p s THR 200 CO -0.04 0.52 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.15 1y1p s LEU 201 N -0.49 3.31 0.03 4.42 2.96 -1.26 -0.84 118.68 126.81 1y1p s LEU 201 Ca 0.19 0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 54.11 1y1p s LEU 201 Cb -0.14 -1.75 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 1y1p s LEU 201 CO 0.07 0.36 0.01 0.20 -1.32 0.00 0.00 176.35 175.67 1y1p s ASN 202 N -0.88 0.25 0.01 3.68 0.01 -0.79 -1.62 114.94 115.60 1y1p s ASN 202 Ca 0.13 -0.55 0.05 0.00 -0.71 0.00 0.00 52.86 51.78 1y1p s ASN 202 Cb -0.11 0.15 -0.02 0.00 0.41 0.00 0.00 41.25 41.68 1y1p s ASN 202 CO 0.02 -0.39 -0.16 0.00 -1.51 0.00 0.00 177.10 175.06 1y1p s ALA 203 N -2.04 1.36 -0.16 0.60 0.00 -0.08 -1.11 121.76 120.33 1y1p s ALA 203 Ca -0.10 -0.79 -0.03 0.00 0.00 0.00 0.00 51.96 51.03 1y1p s ALA 203 Cb -0.05 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 1y1p s ALA 203 CO -0.03 0.31 -0.04 0.08 0.00 0.00 0.00 175.76 176.08 1y1p s VAL 204 N -0.58 3.79 -0.67 0.00 1.01 -0.35 -0.17 120.40 123.43 1y1p s VAL 204 Ca 0.05 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 61.65 1y1p s VAL 204 Cb -0.07 -2.66 0.17 0.00 0.00 0.00 0.00 36.38 33.82 1y1p s VAL 204 CO 0.00 0.49 0.47 -0.76 0.00 0.00 0.00 175.10 175.30 1y1p s LEU 205 N 0.46 4.93 0.59 3.92 1.02 0.15 -0.34 118.68 129.43 1y1p s LEU 205 Ca -0.04 -3.34 -0.15 0.00 0.02 0.00 0.00 54.13 50.63 1y1p s LEU 205 Cb -0.14 -1.75 -0.04 0.00 0.02 0.00 0.00 46.19 44.28 1y1p s LEU 205 CO 0.03 -0.22 1.04 -2.84 0.02 0.00 0.00 176.35 174.38 1y1p s PRO 206 N -0.75 3.42 0.00 1.29 0.02 -1.26 -0.26 135.00 137.46 1y1p s PRO 206 Ca 0.21 1.06 0.00 0.00 0.02 0.00 0.00 61.00 62.30 1y1p s PRO 206 Cb -0.15 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.31 1y1p s PRO 206 CO -0.08 -0.71 0.00 -1.71 -0.33 0.00 0.00 177.00 174.17 1y1p n ASN 207 N -2.17 0.00 -4.57 2.53 4.05 -0.60 -1.63 115.26 112.87 1y1p n ASN 207 Ca 0.08 0.00 -0.41 0.00 0.45 0.00 0.00 54.58 54.70 1y1p n ASN 207 Cb 0.53 0.00 -0.03 0.00 1.23 0.00 0.00 39.78 41.52 1y1p n ASN 207 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1y1p s TYR 208 N 4.39 2.00 -0.26 1.20 5.04 -0.37 -4.84 117.35 124.51 1y1p s TYR 208 Ca 0.00 0.57 -0.26 0.00 -2.44 0.00 0.00 57.07 54.94 1y1p s TYR 208 Cb 0.00 -4.26 0.00 0.00 0.35 0.00 0.00 41.96 38.05 1y1p s TYR 208 CO 0.00 -2.24 0.92 0.99 -1.34 0.00 0.00 175.55 173.88 1y1p s THR 209 N 7.18 4.73 -0.17 4.34 2.01 -1.26 -1.05 115.64 131.42 1y1p s THR 209 Ca 0.61 1.65 -0.01 0.00 0.31 0.00 0.00 61.69 64.24 1y1p s THR 209 Cb -0.13 -4.23 -0.01 0.00 0.01 0.00 0.00 72.50 68.15 1y1p s THR 209 CO 0.24 -0.20 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.23 1y1p s ILE 210 N 3.10 3.04 -0.03 1.82 1.01 -0.03 -3.74 121.20 126.36 1y1p s ILE 210 Ca 0.39 -0.63 -0.25 0.00 0.00 0.00 0.00 60.65 60.16 1y1p s ILE 210 Cb -0.14 -2.32 0.08 0.00 0.01 0.00 0.00 42.46 40.08 1y1p s ILE 210 CO 0.09 0.49 1.10 0.61 0.00 0.00 0.00 174.94 177.23 1y1p n GLY 211 N 4.18 0.24 3.74 6.18 0.00 -1.26 -1.03 105.19 117.24 1y1p n GLY 211 Ca -0.19 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.41 1y1p n GLY 211 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y1p s THR 212 N -2.03 2.30 -0.59 2.61 2.01 -1.21 -4.16 115.64 114.57 1y1p s THR 212 Ca 0.26 0.24 -0.19 0.00 0.31 0.00 0.00 61.69 62.32 1y1p s THR 212 Cb -0.00 -3.16 0.10 0.00 0.01 0.00 0.00 72.50 69.45 1y1p s THR 212 CO -0.01 0.04 0.69 -0.63 -0.69 0.00 0.00 174.62 174.02 1y1p s ILE 213 N 0.17 4.84 0.24 1.82 1.01 -1.26 -4.92 121.20 123.10 1y1p s ILE 213 Ca 0.63 -1.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.21 1y1p s ILE 213 Cb -0.46 -4.48 0.20 0.00 0.01 0.00 0.00 42.46 37.73 1y1p s ILE 213 CO 0.44 -1.11 1.77 -0.26 0.00 0.00 0.00 174.94 175.78 1y1p h PHE 214 N 9.17 0.65 -2.81 3.97 0.05 -1.96 -3.32 116.94 122.69 1y1p h PHE 214 Ca -0.29 0.03 -0.61 0.00 3.82 0.00 0.00 57.97 60.92 1y1p h PHE 214 Cb 1.09 -0.18 -0.41 0.00 2.00 0.00 0.00 35.95 38.45 1y1p h PHE 214 CO 0.83 0.20 -0.64 -3.47 -0.18 0.00 0.00 178.31 175.05 1y1p n ASP 215 N -4.88 2.66 0.07 2.17 4.64 -1.26 -4.92 116.55 115.02 1y1p n ASP 215 Ca 0.13 -3.14 0.09 0.00 -1.38 0.00 0.00 54.79 50.49 1y1p n ASP 215 Cb 0.33 -0.72 0.54 0.00 -1.04 0.00 0.00 41.12 40.23 1y1p n ASP 215 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1y1p h PRO 216 N 5.16 0.28 -0.07 -0.67 0.11 -1.79 0.28 132.00 135.31 1y1p h PRO 216 Ca 0.17 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.30 1y1p h PRO 216 Cb 0.76 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.75 1y1p h PRO 216 CO 0.69 0.18 -0.29 0.93 -0.21 0.00 0.00 178.00 179.30 1y1p h GLU 217 N 0.29 -0.39 0.00 1.05 5.08 -1.94 -3.28 114.58 115.39 1y1p h GLU 217 Ca 0.14 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1y1p h GLU 217 Cb 0.19 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1y1p h GLU 217 CO -0.03 -0.26 -0.03 0.25 -1.00 0.00 0.00 179.01 177.94 1y1p n THR 218 N -5.40 1.76 -4.07 1.13 -2.24 -1.07 -4.96 114.28 99.43 1y1p n THR 218 Ca -0.04 -2.11 -0.32 0.00 -2.27 0.00 0.00 64.05 59.31 1y1p n THR 218 Cb 0.31 -0.18 -0.16 0.00 -2.10 0.00 0.00 70.33 68.20 1y1p n THR 218 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1y1p s GLN 219 N -2.67 2.66 0.41 -0.78 -0.21 0.98 -4.99 119.66 115.06 1y1p s GLN 219 Ca 0.29 -0.73 0.17 0.00 0.02 0.00 0.00 55.36 55.11 1y1p s GLN 219 Cb 0.26 -2.38 0.88 0.00 1.00 0.00 0.00 33.01 32.77 1y1p s GLN 219 CO 0.03 -0.23 1.87 0.66 -2.12 0.00 0.00 175.29 175.49 1y1p h SER 220 N 7.98 0.00 0.00 5.90 4.64 -1.84 -3.40 113.55 126.83 1y1p h SER 220 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1y1p h SER 220 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1y1p h SER 220 CO 0.59 0.31 0.00 0.61 -0.87 0.00 0.00 176.83 177.47 1y1p n GLY 221 N -0.43 0.93 7.00 -0.77 0.00 -1.26 -4.14 105.19 106.51 1y1p n GLY 221 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1y1p n GLY 221 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1y1p n SER 222 N 0.00 0.00 -0.34 1.61 2.88 -1.26 -1.65 113.62 114.86 1y1p n SER 222 Ca 0.00 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 1y1p n SER 222 Cb 0.00 0.00 0.33 0.00 -0.75 0.00 0.00 64.21 63.79 1y1p n SER 222 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1y1p h THR 223 N 0.00 0.02 0.00 2.46 1.35 -1.94 0.35 112.91 115.14 1y1p h THR 223 Ca 0.00 -0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 65.75 1y1p h THR 223 Cb 0.00 0.01 -0.02 0.00 -1.73 0.00 0.00 68.15 66.41 1y1p h THR 223 CO 0.00 0.00 -0.52 0.28 -0.25 0.00 0.00 175.52 175.03 1y1p h SER 224 N 0.01 0.00 -0.60 5.36 0.02 -1.40 -2.37 113.55 114.57 1y1p h SER 224 Ca 0.63 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.49 1y1p h SER 224 Cb 1.37 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.89 1y1p h SER 224 CO -0.90 0.52 0.01 1.23 -1.14 0.00 0.00 176.83 176.55 1y1p h GLY 225 N 1.64 1.14 1.24 -3.77 0.00 0.37 0.35 103.07 104.04 1y1p h GLY 225 Ca -0.01 -0.83 -0.07 0.00 0.00 0.00 0.00 47.33 46.42 1y1p h GLY 225 CO 0.07 0.76 0.06 1.49 0.00 0.00 0.00 176.54 178.92 1y1p h TRP 226 N 0.96 0.98 -0.36 5.60 6.55 -1.09 -1.46 115.95 127.12 1y1p h TRP 226 Ca 0.17 -0.13 -0.12 0.00 0.95 0.00 0.00 58.89 59.76 1y1p h TRP 226 Cb 0.54 -0.27 -0.01 0.00 -0.86 0.00 0.00 29.16 28.56 1y1p h TRP 226 CO 0.04 0.86 -0.27 1.98 -1.05 0.00 0.00 178.44 180.00 1y1p h MET 227 N 0.87 0.74 -0.52 0.49 4.05 -1.05 -2.69 114.93 116.81 1y1p h MET 227 Ca 0.17 -0.32 -0.06 0.00 -0.28 0.00 0.00 59.70 59.22 1y1p h MET 227 Cb 0.43 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.18 1y1p h MET 227 CO 0.01 0.93 0.09 1.98 0.23 0.00 0.00 176.91 180.15 1y1p h MET 228 N 0.64 0.81 -0.50 0.39 1.85 -0.53 -1.30 114.93 116.30 1y1p h MET 228 Ca 0.08 -0.18 -0.03 0.00 -0.61 0.00 0.00 59.70 58.96 1y1p h MET 228 Cb 0.78 -0.11 -0.02 0.00 0.43 0.00 0.00 31.60 32.67 1y1p h MET 228 CO 0.06 0.76 0.17 0.66 -0.40 0.00 0.00 176.91 178.16 1y1p h SER 229 N 0.78 0.66 -0.21 1.39 4.64 -0.96 -0.68 113.55 119.17 1y1p h SER 229 Ca 0.17 -0.09 -0.16 0.00 -0.47 0.00 0.00 61.79 61.24 1y1p h SER 229 Cb 0.34 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 1y1p h SER 229 CO 0.00 0.62 -0.43 0.25 -0.87 0.00 0.00 176.83 176.40 1y1p h LEU 230 N 0.71 0.83 -1.03 5.97 5.85 -1.18 0.55 115.31 127.02 1y1p h LEU 230 Ca 0.17 -0.39 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1y1p h LEU 230 Cb 0.19 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.92 1y1p h LEU 230 CO -0.01 1.14 0.65 0.15 -0.34 0.00 0.00 178.44 180.03 1y1p h PHE 231 N 0.62 1.21 -0.08 1.25 3.57 -0.35 0.64 116.94 123.81 1y1p h PHE 231 Ca 0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1y1p h PHE 231 Cb 1.00 -0.40 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1y1p h PHE 231 CO 0.05 0.66 0.00 0.09 -2.23 0.00 0.00 178.31 176.89 1y1p n ASN 232 N -4.47 0.50 0.00 0.41 3.02 -0.35 -4.88 115.26 109.50 1y1p n ASN 232 Ca 0.14 -2.01 0.00 0.00 -0.03 0.00 0.00 54.58 52.69 1y1p n ASN 232 Cb 0.14 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 1y1p n ASN 232 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y1p n GLY 233 N 0.58 0.75 3.70 7.41 0.00 0.22 -5.05 105.19 112.80 1y1p n GLY 233 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1y1p n GLY 233 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y1p s GLU 234 N -0.49 4.38 -0.53 1.61 2.02 0.16 -4.87 118.70 120.97 1y1p s GLU 234 Ca 0.00 0.90 0.00 0.00 0.02 0.00 0.00 54.97 55.89 1y1p s GLU 234 Cb 0.00 -3.49 0.14 0.00 0.10 0.00 0.00 34.13 30.88 1y1p s GLU 234 CO 0.00 -0.06 0.31 0.08 0.02 0.00 0.00 175.26 175.60 1y1p s VAL 235 N 1.24 3.12 0.09 2.63 1.01 -1.26 -3.61 120.40 123.63 1y1p s VAL 235 Ca 0.37 -2.92 -0.16 0.00 0.00 0.00 0.00 61.98 59.27 1y1p s VAL 235 Cb -0.17 -3.11 -0.07 0.00 0.00 0.00 0.00 36.38 33.03 1y1p s VAL 235 CO 0.16 -0.80 0.52 -0.94 0.00 0.00 0.00 175.10 174.05 1y1p s SER 236 N 0.50 6.90 0.49 3.32 1.04 -1.26 -4.97 113.70 119.72 1y1p s SER 236 Ca 0.15 1.11 0.21 0.00 0.48 0.00 0.00 55.95 57.91 1y1p s SER 236 Cb -0.22 -2.30 1.25 0.00 0.10 0.00 0.00 66.02 64.84 1y1p s SER 236 CO -0.03 0.21 1.96 -0.65 0.98 0.00 0.00 173.24 175.71 1y1p h PRO 237 N 4.13 0.18 -0.05 4.02 0.11 -2.00 0.24 132.00 138.63 1y1p h PRO 237 Ca -0.50 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.62 1y1p h PRO 237 Cb 1.21 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1y1p h PRO 237 CO 0.64 0.12 0.03 0.00 -0.21 0.00 0.00 178.00 178.58 1y1p h ALA 238 N 1.69 2.04 -0.09 -0.75 0.00 -2.00 0.24 119.26 120.38 1y1p h ALA 238 Ca 0.31 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.15 1y1p h ALA 238 Cb 0.97 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1y1p h ALA 238 CO -0.05 -0.06 -0.25 1.25 0.00 0.00 0.00 179.25 180.14 1y1p h LEU 239 N 0.00 0.16 -0.27 0.00 5.85 -0.91 -1.70 115.31 118.43 1y1p h LEU 239 Ca 0.02 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1y1p h LEU 239 Cb 0.09 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1y1p h LEU 239 CO -0.00 0.41 0.00 0.00 -0.34 0.00 0.00 178.44 178.51 1y1p n ALA 240 N -2.48 1.99 1.70 1.25 0.00 0.81 -2.49 120.51 121.28 1y1p n ALA 240 Ca -0.01 0.01 0.14 0.00 0.00 0.00 0.00 53.44 53.57 1y1p n ALA 240 Cb 0.34 -1.42 0.66 0.00 0.00 0.00 0.00 19.45 19.03 1y1p n ALA 240 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1y1p n LEU 241 N -2.10 0.82 -4.25 0.00 7.99 -0.64 -4.66 117.00 114.15 1y1p n LEU 241 Ca 0.04 -0.29 -0.38 0.00 -0.01 0.00 0.00 56.01 55.37 1y1p n LEU 241 Cb 0.32 -0.01 -0.12 0.00 -0.11 0.00 0.00 43.42 43.49 1y1p n LEU 241 CO 0.24 0.15 -0.23 -0.04 -1.51 0.00 0.00 177.39 176.00 1y1p s MET 242 N -1.97 2.55 0.86 3.23 -1.94 -1.04 -5.05 119.30 115.95 1y1p s MET 242 Ca 0.40 -1.28 -0.13 0.00 -1.71 0.00 0.00 55.69 52.96 1y1p s MET 242 Cb 0.20 -3.50 0.11 0.00 2.01 0.00 0.00 34.83 33.65 1y1p s MET 242 CO 0.32 -0.74 1.20 -1.25 -0.01 0.00 0.00 175.02 174.54 1y1p s PRO 243 N 1.37 1.55 0.40 2.03 0.04 -1.26 -4.94 135.00 134.20 1y1p s PRO 243 Ca -0.00 0.03 -0.27 0.00 0.04 0.00 0.00 61.00 60.80 1y1p s PRO 243 Cb -0.20 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.33 1y1p s PRO 243 CO 0.02 -1.87 1.48 -2.30 0.04 0.00 0.00 177.00 174.37 1y1p n PRO 244 N -3.49 2.55 0.00 0.56 -0.02 -1.26 -4.93 135.00 128.41 1y1p n PRO 244 Ca 0.09 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1y1p n PRO 244 Cb 0.60 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1y1p n PRO 244 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y1p n GLN 245 N 0.21 0.00 -3.92 -0.52 10.64 -0.96 -4.55 117.38 118.29 1y1p n GLN 245 Ca 0.02 0.00 -0.33 0.00 -1.83 0.00 0.00 57.00 54.86 1y1p n GLN 245 Cb 0.40 0.00 -0.05 0.00 -0.86 0.00 0.00 30.24 29.73 1y1p n GLN 245 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1y1p s TYR 246 N -2.31 3.52 0.38 2.61 1.51 -1.26 -0.88 117.35 120.92 1y1p s TYR 246 Ca 0.00 0.35 0.08 0.00 -1.01 0.00 0.00 57.07 56.48 1y1p s TYR 246 Cb 0.00 -1.82 -0.02 0.00 -0.11 0.00 0.00 41.96 40.00 1y1p s TYR 246 CO 0.00 0.64 0.33 1.52 -1.11 0.00 0.00 175.55 176.93 1y1p s TYR 247 N -1.30 2.80 -0.26 2.71 1.13 -0.13 -1.23 117.35 121.06 1y1p s TYR 247 Ca 0.26 -0.40 -0.23 0.00 -1.41 0.00 0.00 57.07 55.30 1y1p s TYR 247 Cb -0.13 -1.98 0.07 0.00 -1.10 0.00 0.00 41.96 38.82 1y1p s TYR 247 CO 0.18 0.03 0.69 0.54 -2.51 0.00 0.00 175.55 174.48 1y1p s VAL 248 N -2.39 -0.00 0.36 -3.49 0.11 -0.22 -1.04 120.40 113.73 1y1p s VAL 248 Ca 0.44 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 59.22 1y1p s VAL 248 Cb -0.04 -0.97 -0.10 0.00 -1.53 0.00 0.00 36.38 33.74 1y1p s VAL 248 CO 0.27 0.00 1.29 -0.55 -3.33 0.00 0.00 175.10 172.78 1y1p s SER 249 N 0.57 6.62 0.39 3.54 0.15 -1.26 -0.85 113.70 122.86 1y1p s SER 249 Ca -0.02 2.64 0.09 0.00 0.70 0.00 0.00 55.95 59.36 1y1p s SER 249 Cb -0.05 -2.64 0.79 0.00 -1.71 0.00 0.00 66.02 62.41 1y1p s SER 249 CO -0.02 -0.63 1.93 0.00 1.20 0.00 0.00 173.24 175.72 1y1p h ALA 250 N 3.11 1.53 -0.21 5.45 0.00 -1.41 -1.07 119.26 126.67 1y1p h ALA 250 Ca -0.49 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.23 1y1p h ALA 250 Cb 1.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1y1p h ALA 250 CO 0.64 0.34 0.09 0.28 0.00 0.00 0.00 179.25 180.60 1y1p h VAL 251 N 0.27 1.15 -0.45 0.00 2.07 -1.91 -1.45 116.25 115.93 1y1p h VAL 251 Ca 0.06 -0.44 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 1y1p h VAL 251 Cb 0.32 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1y1p h VAL 251 CO 0.02 0.15 0.06 0.44 0.02 0.00 0.00 177.57 178.25 1y1p h ASP 252 N 0.20 0.66 -0.40 0.57 3.32 -1.78 -1.21 116.42 117.78 1y1p h ASP 252 Ca 0.07 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 1y1p h ASP 252 Cb 0.14 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 1y1p h ASP 252 CO -0.01 0.69 0.00 0.40 -1.72 0.00 0.00 179.24 178.60 1y1p h ILE 253 N 0.67 1.24 -0.55 0.35 1.08 -0.89 0.13 117.51 119.55 1y1p h ILE 253 Ca 0.14 -1.00 -0.03 0.00 -0.39 0.00 0.00 64.86 63.58 1y1p h ILE 253 Cb 0.33 0.87 -0.02 0.00 -3.07 0.00 0.00 36.82 34.93 1y1p h ILE 253 CO 0.01 0.35 0.22 1.23 -0.69 0.00 0.00 178.15 179.26 1y1p h GLY 254 N 0.97 0.88 1.39 5.37 0.00 -0.63 -2.03 103.07 109.02 1y1p h GLY 254 Ca 0.15 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 1y1p h GLY 254 CO 0.02 0.45 0.02 1.41 0.00 0.00 0.00 176.54 178.44 1y1p h LEU 255 N 0.75 0.72 -0.70 3.11 3.38 -0.57 -1.47 115.31 120.52 1y1p h LEU 255 Ca 0.18 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1y1p h LEU 255 Cb 0.21 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1y1p h LEU 255 CO -0.01 0.78 -0.02 -0.07 0.09 0.00 0.00 178.44 179.20 1y1p h LEU 256 N 0.71 0.96 -0.49 1.67 3.38 -0.41 -0.06 115.31 121.07 1y1p h LEU 256 Ca 0.14 -0.27 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 1y1p h LEU 256 Cb 0.41 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1y1p h LEU 256 CO 0.01 1.03 0.01 0.45 0.09 0.00 0.00 178.44 180.03 1y1p h HIS 257 N 0.90 0.94 -0.37 1.13 3.86 -1.11 -1.17 115.15 119.33 1y1p h HIS 257 Ca 0.16 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1y1p h HIS 257 Cb 0.55 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.75 1y1p h HIS 257 CO 0.04 0.88 0.24 1.25 0.86 0.00 0.00 177.93 181.20 1y1p h LEU 258 N 0.73 0.43 -0.79 2.43 5.85 -0.97 -1.43 115.31 121.56 1y1p h LEU 258 Ca 0.14 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.86 1y1p h LEU 258 Cb 0.50 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 1y1p h LEU 258 CO 0.02 0.32 0.52 1.23 -0.34 0.00 0.00 178.44 180.19 1y1p h GLY 259 N 0.50 1.12 2.00 3.75 0.00 -0.81 -1.17 103.07 108.45 1y1p h GLY 259 Ca 0.13 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 47.02 1y1p h GLY 259 CO -0.03 0.38 -0.21 0.00 0.00 0.00 0.00 176.54 176.68 1y1p h LEU 261 N 0.00 0.00 0.00 0.00 3.38 -0.27 -3.43 115.31 114.99 1y1p h LEU 261 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1y1p h LEU 261 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1y1p h LEU 261 CO 0.03 0.78 -0.40 1.33 0.09 0.00 0.00 178.44 180.27 1y1p n VAL 262 N -3.17 0.00 -2.70 1.22 0.24 -0.54 -4.54 118.33 108.84 1y1p n VAL 262 Ca -0.04 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.34 61.67 1y1p n VAL 262 Cb 0.89 0.64 -0.03 0.00 -1.47 0.00 0.00 33.84 33.87 1y1p n VAL 262 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1y1p s LEU 263 N -1.82 4.24 0.46 1.34 1.43 -0.24 0.05 118.68 124.14 1y1p s LEU 263 Ca 0.00 1.51 0.14 0.00 -1.03 0.00 0.00 54.13 54.76 1y1p s LEU 263 Cb 0.00 -3.54 1.05 0.00 0.03 0.00 0.00 46.19 43.72 1y1p s LEU 263 CO 0.00 -0.45 2.03 1.55 0.23 0.00 0.00 176.35 179.70 1y1p h PRO 264 N 7.11 0.03 -0.01 1.29 0.13 -1.88 -2.86 132.00 135.80 1y1p h PRO 264 Ca -0.31 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1y1p h PRO 264 Cb 1.14 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1y1p h PRO 264 CO 0.86 0.16 0.00 0.00 -0.23 0.00 0.00 178.00 178.79 1y1p n GLN 265 N -4.37 1.06 -3.90 0.86 0.00 -1.26 -4.63 117.38 105.14 1y1p n GLN 265 Ca -0.02 -0.10 -0.34 0.00 0.00 0.00 0.00 57.00 56.54 1y1p n GLN 265 Cb 0.21 -1.30 -0.13 0.00 0.00 0.00 0.00 30.24 29.01 1y1p n GLN 265 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1y1p s ILE 266 N -1.98 2.88 -0.02 -0.39 -1.09 -1.08 -5.08 121.20 114.43 1y1p s ILE 266 Ca 0.28 -1.85 -0.01 0.00 -2.23 0.00 0.00 60.65 56.85 1y1p s ILE 266 Cb 0.13 -2.87 0.02 0.00 -1.58 0.00 0.00 42.46 38.17 1y1p s ILE 266 CO 0.22 -0.41 0.04 -1.61 -1.23 0.00 0.00 174.94 171.95 1y1p s GLU 267 N 1.13 0.00 -1.39 2.79 2.02 -1.26 -4.88 118.70 117.10 1y1p s GLU 267 Ca 0.03 0.15 -0.05 0.00 0.02 0.00 0.00 54.97 55.12 1y1p s GLU 267 Cb -0.21 -0.14 0.03 0.00 0.10 0.00 0.00 34.13 33.91 1y1p s GLU 267 CO -0.04 -0.11 0.82 -2.13 0.02 0.00 0.00 175.26 173.82 1y1p n ARG 268 N 3.78 -5.25 -4.24 1.61 0.63 -0.64 -4.99 116.66 107.55 1y1p n ARG 268 Ca -0.22 0.62 -0.27 0.00 -0.92 0.00 0.00 57.85 57.07 1y1p n ARG 268 Cb 0.54 -5.32 -0.08 0.00 0.45 0.00 0.00 32.46 28.05 1y1p n ARG 268 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1y1p s ARG 269 N -6.22 2.26 -0.33 -0.14 1.81 -1.26 -5.02 118.95 110.06 1y1p s ARG 269 Ca 0.26 -1.18 -0.00 0.00 -1.72 0.00 0.00 55.73 53.09 1y1p s ARG 269 Cb -0.13 -2.27 0.08 0.00 -0.45 0.00 0.00 34.95 32.18 1y1p s ARG 269 CO 0.82 0.44 0.04 1.03 -0.68 0.00 0.00 175.30 176.95 1y1p s ARG 270 N -2.91 2.10 -0.45 3.54 0.52 -1.26 -0.90 118.95 119.59 1y1p s ARG 270 Ca 0.26 -1.53 -0.18 0.00 -0.52 0.00 0.00 55.73 53.76 1y1p s ARG 270 Cb -0.09 -3.23 0.04 0.00 0.52 0.00 0.00 34.95 32.19 1y1p s ARG 270 CO 0.17 -0.78 0.48 0.08 0.02 0.00 0.00 175.30 175.27 1y1p s VAL 271 N 1.13 5.05 0.03 3.52 1.01 0.76 -4.79 120.40 127.11 1y1p s VAL 271 Ca 0.01 -0.49 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 1y1p s VAL 271 Cb -0.20 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.00 1y1p s VAL 271 CO -0.04 -0.55 1.25 -0.31 0.00 0.00 0.00 175.10 175.46 1y1p s TYR 272 N 2.20 3.25 -1.09 5.22 2.02 -1.26 0.33 117.35 128.02 1y1p s TYR 272 Ca 0.12 1.16 -0.07 0.00 -0.37 0.00 0.00 57.07 57.90 1y1p s TYR 272 Cb -0.19 -3.49 0.28 0.00 -0.40 0.00 0.00 41.96 38.17 1y1p s TYR 272 CO 0.12 -1.61 1.18 0.41 -1.57 0.00 0.00 175.55 174.09 1y1p n GLY 273 N 3.36 4.46 2.63 0.71 0.00 0.65 -4.76 105.19 112.23 1y1p n GLY 273 Ca 0.10 -2.61 -0.29 0.00 0.00 0.00 0.00 46.02 43.22 1y1p n GLY 273 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1y1p s THR 274 N -1.70 0.67 -0.11 2.61 -4.23 -1.26 -1.56 115.64 110.06 1y1p s THR 274 Ca 0.31 -1.66 -0.23 0.00 -1.18 0.00 0.00 61.69 58.93 1y1p s THR 274 Cb -0.06 -1.50 -0.20 0.00 1.34 0.00 0.00 72.50 72.09 1y1p s THR 274 CO -0.04 -0.82 0.70 0.00 -0.54 0.00 0.00 174.62 173.92 1y1p h ALA 275 N 7.54 -0.03 -2.61 3.99 0.00 -1.44 -3.49 119.26 123.22 1y1p h ALA 275 Ca -0.07 -0.35 0.13 0.00 0.00 0.00 0.00 54.91 54.62 1y1p h ALA 275 Cb 0.98 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 1y1p h ALA 275 CO 0.42 -0.06 0.39 0.20 0.00 0.00 0.00 179.25 180.19 1y1p s GLY 276 N -3.88 -0.14 0.48 0.00 0.00 -1.22 -5.00 107.32 97.56 1y1p s GLY 276 Ca -0.15 -0.09 -0.04 0.00 0.00 0.00 0.00 44.72 44.44 1y1p s GLY 276 CO 0.54 0.05 0.77 -0.51 0.00 0.00 0.00 173.10 173.95 1y1p s THR 277 N -3.43 4.72 0.18 0.90 -4.23 -1.26 -0.96 115.64 111.57 1y1p s THR 277 Ca 0.12 0.08 -0.24 0.00 -1.18 0.00 0.00 61.69 60.47 1y1p s THR 277 Cb -0.03 -3.79 0.06 0.00 1.34 0.00 0.00 72.50 70.07 1y1p s THR 277 CO 0.05 -0.75 0.92 0.72 -0.54 0.00 0.00 174.62 175.02 1y1p s PHE 278 N -2.72 -0.12 0.28 3.99 -0.12 -0.06 -4.83 117.98 114.40 1y1p s PHE 278 Ca 0.48 -0.23 -0.06 0.00 -0.05 0.00 0.00 56.93 57.07 1y1p s PHE 278 Cb -0.10 0.66 -0.01 0.00 -0.63 0.00 0.00 43.02 42.94 1y1p s PHE 278 CO 0.44 -0.93 0.41 0.16 -0.05 0.00 0.00 175.22 175.25 1y1p s ASP 279 N -2.97 0.45 0.59 1.98 3.84 -1.26 -2.25 116.67 117.04 1y1p s ASP 279 Ca 0.13 -1.28 0.31 0.00 -0.00 0.00 0.00 52.55 51.71 1y1p s ASP 279 Cb -0.02 0.58 1.83 0.00 -1.38 0.00 0.00 42.92 43.93 1y1p s ASP 279 CO 0.04 -1.16 2.24 -0.50 -0.00 0.00 0.00 175.17 175.79 1y1p h TRP 280 N 2.25 0.00 0.01 2.11 4.06 -1.94 -2.00 115.95 120.44 1y1p h TRP 280 Ca -0.29 0.00 -0.19 0.00 2.06 0.00 0.00 58.89 60.47 1y1p h TRP 280 Cb 1.25 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.38 1y1p h TRP 280 CO 0.91 0.02 -0.90 -0.91 -3.56 0.00 0.00 178.44 174.01 1y1p h ASN 281 N 0.00 0.04 0.68 -3.49 2.35 -1.95 -0.67 115.58 112.54 1y1p h ASN 281 Ca -0.00 -0.04 -0.14 0.00 -0.55 0.00 0.00 56.30 55.57 1y1p h ASN 281 Cb 0.07 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1y1p h ASN 281 CO 0.00 0.91 -0.67 0.71 -1.65 0.00 0.00 177.43 176.74 1y1p h THR 282 N 0.01 1.47 -0.05 2.81 1.35 -1.78 -0.41 112.91 116.32 1y1p h THR 282 Ca -0.02 -2.29 -0.01 0.00 -0.55 0.00 0.00 66.41 63.54 1y1p h THR 282 Cb 1.57 2.24 -0.00 0.00 -1.73 0.00 0.00 68.15 70.23 1y1p h THR 282 CO 0.12 0.65 -0.01 0.58 -0.25 0.00 0.00 175.52 176.61 1y1p h VAL 283 N 0.00 1.28 -0.97 6.82 2.07 -1.27 -1.33 116.25 122.85 1y1p h VAL 283 Ca -0.01 -0.87 0.01 0.00 0.82 0.00 0.00 66.70 66.65 1y1p h VAL 283 Cb 1.18 1.76 -0.05 0.00 -1.52 0.00 0.00 31.29 32.67 1y1p h VAL 283 CO 0.09 0.24 0.64 -0.07 0.02 0.00 0.00 177.57 178.48 1y1p h LEU 284 N -0.24 1.12 -0.70 2.57 3.38 -1.00 -0.41 115.31 120.04 1y1p h LEU 284 Ca 0.01 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1y1p h LEU 284 Cb 0.38 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1y1p h LEU 284 CO 0.00 0.82 0.46 0.00 0.09 0.00 0.00 178.44 179.82 1y1p h ALA 285 N 1.35 0.89 -0.60 1.53 0.00 -0.93 -1.17 119.26 120.33 1y1p h ALA 285 Ca 0.35 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 1y1p h ALA 285 Cb -0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.34 1y1p h ALA 285 CO -0.08 0.32 0.11 1.15 0.00 0.00 0.00 179.25 180.75 1y1p h THR 286 N 0.95 1.26 -0.40 0.00 2.02 -0.51 -1.84 112.91 114.38 1y1p h THR 286 Ca 0.26 -0.98 0.05 0.00 0.77 0.00 0.00 66.41 66.51 1y1p h THR 286 Cb -0.10 0.73 -0.05 0.00 -1.74 0.00 0.00 68.15 66.99 1y1p h THR 286 CO -0.05 0.36 0.14 -0.26 0.37 0.00 0.00 175.52 176.08 1y1p h PHE 287 N 0.89 0.25 -0.17 3.16 0.04 -0.52 -0.69 116.94 119.90 1y1p h PHE 287 Ca 0.18 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.93 1y1p h PHE 287 Cb 0.41 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 1y1p h PHE 287 CO 0.03 0.09 -0.10 0.00 -0.60 0.00 0.00 178.31 177.73 1y1p h ARG 288 N 0.30 0.27 -0.14 1.51 3.08 -0.99 0.06 114.38 118.47 1y1p h ARG 288 Ca 0.19 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 59.96 1y1p h ARG 288 Cb 0.17 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.19 1y1p h ARG 288 CO -0.19 0.38 -0.75 -0.22 -1.07 0.00 0.00 179.97 178.12 1y1p h LYS 289 N 0.26 0.76 -0.06 0.04 3.64 -0.58 -2.26 116.57 118.36 1y1p h LYS 289 Ca 0.05 -0.62 -0.16 0.00 -1.27 0.00 0.00 60.65 58.65 1y1p h LYS 289 Cb 0.34 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1y1p h LYS 289 CO 0.02 1.23 -0.68 -0.07 -2.27 0.00 0.00 179.45 177.68 1y1p h LEU 290 N 0.47 0.33 -6.31 5.20 3.38 -0.87 -3.36 115.31 114.14 1y1p h LEU 290 Ca -0.05 -0.21 -0.59 0.00 0.09 0.00 0.00 57.88 57.12 1y1p h LEU 290 Cb 1.38 -0.10 -0.40 0.00 0.09 0.00 0.00 40.66 41.63 1y1p h LEU 290 CO 0.15 0.91 -0.81 -1.22 0.09 0.00 0.00 178.44 177.56 1y1p n TYR 291 N -3.83 1.58 0.26 1.13 4.01 -0.02 -0.87 117.16 119.43 1y1p n TYR 291 Ca -0.03 -3.86 0.18 0.00 -0.16 0.00 0.00 57.90 54.03 1y1p n TYR 291 Cb 0.67 -0.37 0.92 0.00 -0.31 0.00 0.00 39.34 40.25 1y1p n TYR 291 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1y1p h PRO 292 N 4.56 0.00 0.00 -0.72 0.13 -1.57 -2.16 132.00 132.23 1y1p h PRO 292 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1y1p h PRO 292 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1y1p h PRO 292 CO 0.62 0.00 -0.75 0.43 -0.23 0.00 0.00 178.00 178.07 1y1p n SER 293 N -3.53 0.67 -4.85 1.44 7.64 -1.26 -4.94 113.62 108.79 1y1p n SER 293 Ca -0.01 0.03 -0.33 0.00 1.01 0.00 0.00 58.87 59.58 1y1p n SER 293 Cb 0.24 0.35 -0.06 0.00 -1.01 0.00 0.00 64.21 63.73 1y1p n SER 293 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1y1p s LYS 294 N -3.18 3.99 -0.05 1.43 2.20 -0.81 -5.06 119.74 118.25 1y1p s LYS 294 Ca 0.05 0.62 -0.18 0.00 -0.36 0.00 0.00 55.97 56.10 1y1p s LYS 294 Cb 0.14 -2.50 -0.05 0.00 -1.51 0.00 0.00 37.83 33.91 1y1p s LYS 294 CO 0.74 0.20 0.51 0.99 -0.36 0.00 0.00 175.35 177.43 1y1p s THR 295 N -1.92 5.05 0.14 3.43 2.01 -1.26 -4.99 115.64 118.09 1y1p s THR 295 Ca 0.52 1.04 0.04 0.00 0.31 0.00 0.00 61.69 63.60 1y1p s THR 295 Cb -0.11 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.52 1y1p s THR 295 CO 0.18 0.41 -0.09 -0.36 -0.69 0.00 0.00 174.62 174.08 1y1p s PHE 296 N -0.03 1.18 0.83 4.92 0.08 -1.26 -4.89 117.98 118.81 1y1p s PHE 296 Ca 0.27 -0.81 -0.13 0.00 0.12 0.00 0.00 56.93 56.38 1y1p s PHE 296 Cb -0.17 -0.62 0.09 0.00 -0.57 0.00 0.00 43.02 41.75 1y1p s PHE 296 CO 0.14 0.01 1.13 -2.30 -0.10 0.00 0.00 175.22 174.10 1y1p n PRO 297 N -0.17 0.05 -1.46 0.24 -0.02 -1.26 -4.98 135.00 127.40 1y1p n PRO 297 Ca -0.10 0.09 -0.29 0.00 -2.02 0.00 0.00 63.50 61.18 1y1p n PRO 297 Cb 0.61 -2.38 0.16 0.00 -0.02 0.00 0.00 33.50 31.87 1y1p n PRO 297 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y1p s ALA 298 N -2.22 1.55 0.65 3.55 0.00 -1.26 -4.99 121.76 119.05 1y1p s ALA 298 Ca 0.71 -0.60 -0.18 0.00 0.00 0.00 0.00 51.96 51.89 1y1p s ALA 298 Cb -0.28 -3.01 -0.01 0.00 0.00 0.00 0.00 23.12 19.83 1y1p s ALA 298 CO 0.53 -2.53 1.26 -0.51 0.00 0.00 0.00 175.76 174.51 1y1p s ASP 299 N -4.00 4.63 0.70 0.00 1.11 -1.26 -5.02 116.67 112.84 1y1p s ASP 299 Ca 0.66 2.54 -0.11 0.00 0.18 0.00 0.00 52.55 55.81 1y1p s ASP 299 Cb -0.14 -2.61 0.01 0.00 1.07 0.00 0.00 42.92 41.25 1y1p s ASP 299 CO 0.54 -1.98 1.09 -0.36 1.18 0.00 0.00 175.17 175.64 1y1p s PHE 300 N -1.53 3.33 0.78 4.23 0.08 -1.26 -5.02 117.98 118.58 1y1p s PHE 300 Ca 0.80 1.07 -0.12 0.00 0.12 0.00 0.00 56.93 58.81 1y1p s PHE 300 Cb -0.35 -3.04 0.06 0.00 -0.57 0.00 0.00 43.02 39.12 1y1p s PHE 300 CO 0.39 -1.16 1.12 -2.14 -0.10 0.00 0.00 175.22 173.33 1y1p s PRO 301 N -5.34 2.09 0.15 0.24 0.02 -1.26 -4.87 135.00 126.03 1y1p s PRO 301 Ca 0.58 1.34 -0.33 0.00 0.02 0.00 0.00 61.00 62.61 1y1p s PRO 301 Cb -0.11 -1.87 -0.13 0.00 0.02 0.00 0.00 34.50 32.42 1y1p s PRO 301 CO 0.52 -1.80 1.70 -3.47 -0.33 0.00 0.00 177.00 173.62 1y1p n ASP 302 N -3.40 3.58 -0.61 2.53 2.03 -1.26 -4.86 116.55 114.56 1y1p n ASP 302 Ca 0.10 1.05 0.06 0.00 0.52 0.00 0.00 54.79 56.52 1y1p n ASP 302 Cb 0.52 -1.49 0.16 0.00 -0.72 0.00 0.00 41.12 39.59 1y1p n ASP 302 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1y1p n GLN 303 N 4.29 2.86 0.00 -0.67 6.02 -1.26 -5.10 117.38 123.52 1y1p n GLN 303 Ca 0.17 -2.16 0.00 0.00 -0.01 0.00 0.00 57.00 55.00 1y1p n GLN 303 Cb 0.32 -1.36 0.00 0.00 1.02 0.00 0.00 30.24 30.22 1y1p n GLN 303 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1y1p n GLY 304 N 0.17 -1.82 3.14 1.08 0.00 -1.26 -4.66 105.19 101.84 1y1p n GLY 304 Ca 0.12 -1.54 -0.08 0.00 0.00 0.00 0.00 46.02 44.53 1y1p n GLY 304 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1y1p s GLN 305 N 0.00 0.71 -0.30 1.61 -2.07 -1.26 -4.84 119.66 113.50 1y1p s GLN 305 Ca 0.00 -1.10 -0.25 0.00 -1.82 0.00 0.00 55.36 52.20 1y1p s GLN 305 Cb 0.00 0.27 0.00 0.00 -1.09 0.00 0.00 33.01 32.19 1y1p s GLN 305 CO 0.00 -0.18 0.85 0.34 -1.32 0.00 0.00 175.29 174.99 1y1p s ASP 306 N -2.87 6.74 0.00 12.60 -1.08 -1.26 -0.70 116.67 130.09 1y1p s ASP 306 Ca 0.06 0.78 0.17 0.00 -0.52 0.00 0.00 52.55 53.03 1y1p s ASP 306 Cb 0.06 -2.44 0.46 0.00 -1.46 0.00 0.00 42.92 39.55 1y1p s ASP 306 CO -0.10 -0.66 1.38 0.18 0.52 0.00 0.00 175.17 176.49 1y1p n LEU 307 N 6.32 3.40 -4.87 -1.34 4.77 -1.26 -4.97 117.00 119.05 1y1p n LEU 307 Ca 0.06 -1.93 -0.31 0.00 -0.03 0.00 0.00 56.01 53.80 1y1p n LEU 307 Cb 0.48 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1y1p n LEU 307 CO 0.52 0.84 0.70 -0.94 -1.33 0.00 0.00 177.39 177.17 1y1p s SER 308 N -1.03 6.24 0.03 -1.43 1.04 -1.26 -4.70 113.70 112.59 1y1p s SER 308 Ca 0.36 1.38 0.04 0.00 0.48 0.00 0.00 55.95 58.21 1y1p s SER 308 Cb 0.19 -2.45 -0.02 0.00 0.10 0.00 0.00 66.02 63.84 1y1p s SER 308 CO 0.25 -0.84 -0.12 -0.54 0.98 0.00 0.00 173.24 172.96 1y1p s LYS 309 N -5.12 0.85 0.06 4.02 -0.14 -0.35 -5.02 119.74 114.04 1y1p s LYS 309 Ca 0.54 -0.68 0.08 0.00 -1.36 0.00 0.00 55.97 54.56 1y1p s LYS 309 Cb -0.11 -0.82 -0.03 0.00 -1.68 0.00 0.00 37.83 35.19 1y1p s LYS 309 CO 0.53 0.20 -0.20 -0.06 -0.76 0.00 0.00 175.35 175.06 1y1p s PHE 310 N -0.80 2.49 -0.73 3.18 0.08 -1.26 -0.53 117.98 120.41 1y1p s PHE 310 Ca 0.01 -0.30 -0.26 0.00 0.12 0.00 0.00 56.93 56.50 1y1p s PHE 310 Cb -0.07 -1.41 0.04 0.00 -0.57 0.00 0.00 43.02 41.01 1y1p s PHE 310 CO 0.01 0.26 1.21 0.34 -0.10 0.00 0.00 175.22 176.94 1y1p s ASP 311 N -1.59 6.17 -0.24 1.36 -1.08 0.45 -4.83 116.67 116.91 1y1p s ASP 311 Ca 0.15 -0.61 0.14 0.00 -0.52 0.00 0.00 52.55 51.71 1y1p s ASP 311 Cb -0.10 -2.53 0.81 0.00 -1.46 0.00 0.00 42.92 39.64 1y1p s ASP 311 CO 0.06 -1.73 1.75 0.35 0.52 0.00 0.00 175.17 176.11 1y1p n THR 312 N 6.28 2.78 0.04 1.71 -2.24 -1.26 -4.61 114.28 116.97 1y1p n THR 312 Ca 0.02 -1.45 -0.11 0.00 -2.27 0.00 0.00 64.05 60.24 1y1p n THR 312 Cb 0.48 -0.28 -0.05 0.00 -2.10 0.00 0.00 70.33 68.38 1y1p n THR 312 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y1p h ALA 313 N 3.85 -0.42 -0.15 6.98 0.00 -1.96 0.15 119.26 127.71 1y1p h ALA 313 Ca 0.02 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1y1p h ALA 313 Cb 2.00 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 20.35 1y1p h ALA 313 CO 0.50 -0.82 -0.09 -1.00 0.00 0.00 0.00 179.25 177.85 1y1p h PRO 314 N -0.44 0.22 -0.09 0.00 0.13 -1.93 -0.43 132.00 129.46 1y1p h PRO 314 Ca 0.07 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.16 1y1p h PRO 314 Cb 0.55 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.64 1y1p h PRO 314 CO -0.30 0.33 0.04 0.77 -0.23 0.00 0.00 178.00 178.60 1y1p h SER 315 N 0.22 0.13 -0.26 1.44 0.02 -1.65 -0.22 113.55 113.23 1y1p h SER 315 Ca 0.05 -0.17 -0.06 0.00 -0.84 0.00 0.00 61.79 60.77 1y1p h SER 315 Cb 0.30 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 1y1p h SER 315 CO 0.02 0.27 -0.03 -0.07 -1.14 0.00 0.00 176.83 175.87 1y1p h LEU 316 N -0.01 0.56 -0.32 5.07 3.38 -0.61 -1.04 115.31 122.34 1y1p h LEU 316 Ca 0.03 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1y1p h LEU 316 Cb 0.18 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1y1p h LEU 316 CO -0.00 0.66 0.05 -0.33 0.09 0.00 0.00 178.44 178.91 1y1p h GLU 317 N 0.56 0.53 -0.13 1.13 5.08 -0.84 -1.85 114.58 119.06 1y1p h GLU 317 Ca 0.11 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1y1p h GLU 317 Cb 0.40 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1y1p h GLU 317 CO 0.02 0.62 0.07 0.82 -1.00 0.00 0.00 179.01 179.53 1y1p h ILE 318 N 0.36 1.10 -0.69 3.13 2.04 -0.69 -0.63 117.51 122.13 1y1p h ILE 318 Ca 0.10 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.69 1y1p h ILE 318 Cb 0.35 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 1y1p h ILE 318 CO 0.01 0.09 0.44 -0.07 0.00 0.00 0.00 178.15 178.62 1y1p h LEU 319 N 0.10 0.74 -0.36 1.44 3.38 -1.14 -1.46 115.31 118.01 1y1p h LEU 319 Ca 0.05 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1y1p h LEU 319 Cb 0.09 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1y1p h LEU 319 CO -0.01 0.53 -0.08 0.50 0.09 0.00 0.00 178.44 179.47 1y1p h LYS 320 N 0.88 0.69 -0.47 1.13 3.64 -1.18 -1.07 116.57 120.19 1y1p h LYS 320 Ca 0.27 -0.26 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1y1p h LYS 320 Cb -0.04 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1y1p h LYS 320 CO -0.08 0.84 0.31 0.77 -2.27 0.00 0.00 179.45 179.02 1y1p h SER 321 N 0.49 0.50 -0.07 4.20 0.02 -0.73 -1.53 113.55 116.43 1y1p h SER 321 Ca 0.09 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1y1p h SER 321 Cb 0.58 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.00 1y1p h SER 321 CO 0.03 0.36 0.00 0.18 -1.14 0.00 0.00 176.83 176.26 1y1p n LEU 322 N -4.47 0.76 0.00 5.07 4.77 -0.58 -4.90 117.00 117.64 1y1p n LEU 322 Ca 0.04 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 1y1p n LEU 322 Cb 0.09 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1y1p n LEU 322 CO 0.35 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1y1p n GLY 323 N 0.96 0.45 2.59 -0.72 0.00 -0.57 -4.95 105.19 102.95 1y1p n GLY 323 Ca 0.15 -0.47 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 1y1p n GLY 323 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y1p n ARG 324 N -3.00 2.20 -1.71 1.61 5.12 -0.42 -5.03 116.66 115.43 1y1p n ARG 324 Ca 0.00 -4.18 -0.38 0.00 -1.93 0.00 0.00 57.85 51.36 1y1p n ARG 324 Cb 0.00 -1.99 0.05 0.00 -1.16 0.00 0.00 32.46 29.36 1y1p n ARG 324 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1y1p n PRO 325 N -0.01 1.39 -0.36 5.56 -0.04 -1.15 -4.43 135.00 135.97 1y1p n PRO 325 Ca 0.28 0.52 0.04 0.00 -0.04 0.00 0.00 63.50 64.31 1y1p n PRO 325 Cb 0.52 -2.46 -0.02 0.00 -0.04 0.00 0.00 33.50 31.49 1y1p n PRO 325 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1y1p n GLY 326 N 0.92 -2.82 3.80 0.55 0.00 -1.26 -4.92 105.19 101.45 1y1p n GLY 326 Ca 0.12 -1.35 -0.38 0.00 0.00 0.00 0.00 46.02 44.42 1y1p n GLY 326 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1y1p s TRP 327 N -3.34 3.79 0.29 1.61 0.52 -1.26 -5.00 118.94 115.55 1y1p s TRP 327 Ca 0.00 1.50 -0.29 0.00 0.02 0.00 0.00 56.10 57.33 1y1p s TRP 327 Cb 0.00 -2.68 -0.10 0.00 -1.15 0.00 0.00 33.47 29.54 1y1p s TRP 327 CO 0.00 0.45 1.35 0.50 0.02 0.00 0.00 176.95 179.26 1y1p s ARG 328 N -1.49 4.33 0.87 4.98 3.52 -1.26 -4.96 118.95 124.94 1y1p s ARG 328 Ca 0.38 2.22 -0.10 0.00 -0.13 0.00 0.00 55.73 58.10 1y1p s ARG 328 Cb -0.20 -3.10 0.11 0.00 -1.56 0.00 0.00 34.95 30.21 1y1p s ARG 328 CO 0.23 -0.26 1.12 -1.54 -0.81 0.00 0.00 175.30 174.03 1y1p s SER 329 N -0.15 3.51 0.31 -2.12 1.04 -1.26 -4.64 113.70 110.39 1y1p s SER 329 Ca 0.53 1.97 0.08 0.00 0.48 0.00 0.00 55.95 59.00 1y1p s SER 329 Cb -0.40 -2.51 0.50 0.00 0.10 0.00 0.00 66.02 63.71 1y1p s SER 329 CO 0.49 -2.69 1.72 -0.29 0.98 0.00 0.00 173.24 173.45 1y1p h ILE 330 N -1.58 1.30 -0.25 -1.02 2.10 -1.98 -0.22 117.51 115.86 1y1p h ILE 330 Ca -0.44 -1.48 -0.03 0.00 1.08 0.00 0.00 64.86 63.99 1y1p h ILE 330 Cb 1.26 1.68 -0.01 0.00 -1.09 0.00 0.00 36.82 38.66 1y1p h ILE 330 CO 0.47 0.44 0.05 -0.08 -1.08 0.00 0.00 178.15 177.94 1y1p h GLU 331 N 0.17 0.40 -0.27 2.19 4.81 -1.99 0.35 114.58 120.25 1y1p h GLU 331 Ca 0.02 -0.10 -0.12 0.00 -0.13 0.00 0.00 59.36 59.03 1y1p h GLU 331 Cb 0.79 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 1y1p h GLU 331 CO 0.06 0.52 -0.32 0.93 -0.73 0.00 0.00 179.01 179.47 1y1p h GLU 332 N 0.22 0.56 -0.22 1.92 4.39 -1.89 -0.52 114.58 119.04 1y1p h GLU 332 Ca 0.08 -0.25 -0.02 0.00 0.34 0.00 0.00 59.36 59.51 1y1p h GLU 332 Cb 0.31 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1y1p h GLU 332 CO 0.00 0.81 0.07 0.77 -1.16 0.00 0.00 179.01 179.50 1y1p h SER 333 N 0.48 0.33 -0.19 1.42 0.02 -0.82 -0.30 113.55 114.49 1y1p h SER 333 Ca 0.06 -0.20 -0.10 0.00 -0.84 0.00 0.00 61.79 60.71 1y1p h SER 333 Cb 0.79 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 1y1p h SER 333 CO 0.06 0.44 -0.19 0.40 -1.14 0.00 0.00 176.83 176.40 1y1p h ILE 334 N 0.19 1.26 -0.39 3.27 2.04 -0.83 -2.16 117.51 120.90 1y1p h ILE 334 Ca 0.07 -1.23 -0.05 0.00 1.00 0.00 0.00 64.86 64.66 1y1p h ILE 334 Cb 0.23 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1y1p h ILE 334 CO -0.00 0.40 0.05 0.50 0.00 0.00 0.00 178.15 179.10 1y1p h LYS 335 N 0.56 0.59 -0.35 2.37 3.64 -0.78 0.76 116.57 123.36 1y1p h LYS 335 Ca 0.09 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1y1p h LYS 335 Cb 0.64 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 1y1p h LYS 335 CO 0.05 0.58 0.17 -0.44 -2.27 0.00 0.00 179.45 177.54 1y1p h ASP 336 N 0.57 0.42 0.00 4.20 3.32 -0.40 0.35 116.42 124.88 1y1p h ASP 336 Ca 0.13 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1y1p h ASP 336 Cb 0.29 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 1y1p h ASP 336 CO 0.00 0.36 -0.02 0.25 -1.72 0.00 0.00 179.24 178.11 1y1p h LEU 337 N 0.48 0.00 -0.97 1.55 5.85 -0.88 -3.21 115.31 118.13 1y1p h LEU 337 Ca 0.12 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 58.38 1y1p h LEU 337 Cb 0.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1y1p h LEU 337 CO -0.02 0.74 -0.45 1.33 -0.34 0.00 0.00 178.44 179.70 1y1p n VAL 338 N -4.70 0.00 -4.25 1.05 0.24 0.12 -4.74 118.33 106.06 1y1p n VAL 338 Ca -0.05 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 1y1p n VAL 338 Cb 0.23 1.24 0.00 0.00 -1.47 0.00 0.00 33.84 33.84 1y1p n VAL 338 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1y1p n GLY 339 N 1.36 -0.40 3.38 7.63 0.00 0.12 -4.96 105.19 112.32 1y1p n GLY 339 Ca 0.09 -1.07 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 1y1p n GLY 339 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y1p s SER 340 N -4.00 -0.21 -0.71 1.61 1.04 -1.26 -4.55 113.70 105.62 1y1p s SER 340 Ca 0.00 -0.43 -0.27 0.00 0.48 0.00 0.00 55.95 55.73 1y1p s SER 340 Cb 0.00 0.50 0.01 0.00 0.10 0.00 0.00 66.02 66.63 1y1p s SER 340 CO 0.00 -0.92 1.48 -0.70 0.98 0.00 0.00 173.24 174.08 1y1p s GLU 341 N -3.84 3.01 0.18 4.02 2.12 -0.05 -4.91 118.70 119.22 1y1p s GLU 341 Ca 0.06 0.02 -0.19 0.00 0.36 0.00 0.00 54.97 55.22 1y1p s GLU 341 Cb 0.01 -4.28 0.04 0.00 0.26 0.00 0.00 34.13 30.16 1y1p s GLU 341 CO -0.08 -2.36 0.54 -0.08 -0.54 0.00 0.00 175.26 172.74 1y1p s THR 342 N 6.87 0.02 0.00 -1.70 -1.32 -1.26 -4.98 115.64 113.27 1y1p s THR 342 Ca 0.46 -0.55 0.00 0.00 -1.21 0.00 0.00 61.69 60.39 1y1p s THR 342 Cb -0.09 -1.39 0.00 0.00 -1.51 0.00 0.00 72.50 69.51 1y1p s THR 342 CO 0.16 -0.11 0.00 0.00 -2.21 0.00 0.00 174.62 172.46