#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kst s VAL 41 N 0.00 5.13 -0.17 -3.33 1.01 -1.26 -1.90 120.40 119.87 3kst s VAL 41 Ca 0.00 1.07 -0.23 0.00 0.00 0.00 0.00 61.98 62.82 3kst s VAL 41 Cb 0.00 -3.88 -0.20 0.00 0.00 0.00 0.00 36.38 32.30 3kst s VAL 41 CO 0.00 0.26 0.39 -0.08 0.00 0.00 0.00 175.10 175.67 3kst h GLU 42 N 6.95 0.00 -3.04 2.72 4.81 -1.06 -3.47 114.58 121.49 3kst h GLU 42 Ca -0.38 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 58.72 3kst h GLU 42 Cb 1.17 0.00 -0.21 0.00 0.63 0.00 0.00 28.75 30.35 3kst h GLU 42 CO 0.75 0.90 -0.29 -0.08 -0.73 0.00 0.00 179.01 179.57 3kst s THR 43 N -2.27 0.05 -1.28 0.32 -1.32 -0.92 -5.01 115.64 105.21 3kst s THR 43 Ca -0.23 -0.42 0.02 0.00 -1.21 0.00 0.00 61.69 59.85 3kst s THR 43 Cb 0.02 -0.59 0.09 0.00 -1.51 0.00 0.00 72.50 70.52 3kst s THR 43 CO 0.58 -0.23 0.79 0.59 -2.21 0.00 0.00 174.62 174.14 3kst n ASN 44 N 1.49 1.20 -4.18 8.08 3.02 -1.26 -0.71 115.26 122.91 3kst n ASN 44 Ca -0.21 -2.07 -0.11 0.00 -0.03 0.00 0.00 54.58 52.16 3kst n ASN 44 Cb 0.56 -0.37 -0.10 0.00 -0.61 0.00 0.00 39.78 39.27 3kst n ASN 44 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3kst s TYR 45 N -1.44 1.02 -0.49 3.10 1.51 -1.21 -4.53 117.35 115.31 3kst s TYR 45 Ca 0.06 -1.30 -0.12 0.00 -1.01 0.00 0.00 57.07 54.70 3kst s TYR 45 Cb 0.04 -0.53 0.12 0.00 -0.11 0.00 0.00 41.96 41.48 3kst s TYR 45 CO 0.03 -0.57 0.40 -1.17 -1.11 0.00 0.00 175.55 173.13 3kst s LEU 46 N -3.11 5.83 -1.47 -1.29 2.96 -1.22 -3.53 118.68 116.86 3kst s LEU 46 Ca 0.31 -1.78 -0.09 0.00 -0.22 0.00 0.00 54.13 52.35 3kst s LEU 46 Cb 0.07 -2.10 -0.09 0.00 0.50 0.00 0.00 46.19 44.57 3kst s LEU 46 CO 0.07 -0.74 2.99 -0.81 -1.32 0.00 0.00 176.35 176.54 3kst n PRO 47 N 5.06 3.61 -4.16 0.98 -0.04 -1.26 -1.06 135.00 138.13 3kst n PRO 47 Ca -0.11 -2.17 -0.13 0.00 -0.04 0.00 0.00 63.50 61.05 3kst n PRO 47 Cb 0.41 -2.72 -0.10 0.00 -0.04 0.00 0.00 33.50 31.05 3kst n PRO 47 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3kst s ILE 48 N 1.85 0.80 0.44 0.52 -4.36 -1.25 -3.20 121.20 116.00 3kst s ILE 48 Ca 0.69 -1.71 0.07 0.00 -0.26 0.00 0.00 60.65 59.44 3kst s ILE 48 Cb 0.19 -1.42 -0.02 0.00 1.25 0.00 0.00 42.46 42.47 3kst s ILE 48 CO -0.06 -0.68 0.34 0.00 0.24 0.00 0.00 174.94 174.79 3kst s ALA 49 N -2.84 4.03 -1.59 2.27 0.00 -0.24 -3.07 121.76 120.33 3kst s ALA 49 Ca 0.07 -1.84 -0.10 0.00 0.00 0.00 0.00 51.96 50.09 3kst s ALA 49 Cb -0.00 -0.83 0.09 0.00 0.00 0.00 0.00 23.12 22.38 3kst s ALA 49 CO -0.02 -0.26 0.54 -0.25 0.00 0.00 0.00 175.76 175.77 3kst n ASP 50 N -1.53 -1.58 -4.75 0.00 8.00 -1.26 -0.01 116.55 115.43 3kst n ASP 50 Ca 0.02 -1.06 -0.37 0.00 0.71 0.00 0.00 54.79 54.09 3kst n ASP 50 Cb 0.63 -2.65 0.03 0.00 -0.02 0.00 0.00 41.12 39.11 3kst n ASP 50 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3kst s PRO 51 N -6.87 3.14 -0.01 -0.24 0.04 -1.18 -4.45 135.00 125.43 3kst s PRO 51 Ca 0.38 2.00 0.01 0.00 0.04 0.00 0.00 61.00 63.43 3kst s PRO 51 Cb -0.21 -2.14 0.01 0.00 0.04 0.00 0.00 34.50 32.20 3kst s PRO 51 CO 0.93 -1.12 -0.03 -0.47 0.04 0.00 0.00 177.00 176.35 3kst s TYR 52 N -1.45 0.37 0.18 0.56 5.04 -0.13 -3.78 117.35 118.15 3kst s TYR 52 Ca 0.73 -0.06 0.00 0.00 -2.44 0.00 0.00 57.07 55.30 3kst s TYR 52 Cb -0.35 -0.31 0.00 0.00 0.35 0.00 0.00 41.96 41.66 3kst s TYR 52 CO 0.40 -0.05 0.02 0.28 -1.34 0.00 0.00 175.55 174.86 3kst n VAL 53 N 3.37 0.00 -3.20 3.14 0.31 -1.26 -1.05 118.33 119.64 3kst n VAL 53 Ca -0.17 -0.82 0.01 0.00 -0.01 0.00 0.00 64.34 63.34 3kst n VAL 53 Cb 0.56 0.08 -0.03 0.00 -0.91 0.00 0.00 33.84 33.54 3kst n VAL 53 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 3kst s PHE 55 N -1.52 -1.43 -0.02 3.52 5.36 -1.26 -4.84 117.98 117.79 3kst s PHE 55 Ca 0.02 1.50 0.02 0.00 -0.96 0.00 0.00 56.93 57.51 3kst s PHE 55 Cb -0.00 0.44 0.01 0.00 -0.34 0.00 0.00 43.02 43.12 3kst s PHE 55 CO 0.01 -0.84 -0.06 -0.47 -1.46 0.00 0.00 175.22 172.40 3kst s TYR 56 N 2.78 0.68 -1.24 10.12 5.04 -0.54 -4.92 117.35 129.27 3kst s TYR 56 Ca 0.19 -0.16 -0.31 0.00 -2.44 0.00 0.00 57.07 54.35 3kst s TYR 56 Cb -0.15 -0.53 0.04 0.00 0.35 0.00 0.00 41.96 41.68 3kst s TYR 56 CO -0.20 -0.10 0.58 -1.71 -1.34 0.00 0.00 175.55 172.79 3kst n ASN 57 N 3.48 -3.40 -2.92 4.32 2.85 -1.26 -1.39 115.26 116.94 3kst n ASN 57 Ca -0.20 -1.29 -0.21 0.00 -0.11 0.00 0.00 54.58 52.77 3kst n ASN 57 Cb 0.54 -1.56 0.02 0.00 1.24 0.00 0.00 39.78 40.02 3kst n ASN 57 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 3kst n ASN 58 N -2.17 -5.39 -3.73 1.20 2.04 -1.26 -4.98 115.26 100.98 3kst n ASN 58 Ca -0.14 -0.21 -0.12 0.00 -0.44 0.00 0.00 54.58 53.68 3kst n ASN 58 Cb 0.57 -4.41 -0.11 0.00 -2.53 0.00 0.00 39.78 33.29 3kst n ASN 58 CO 0.00 0.00 0.00 -0.75 -0.44 0.00 0.00 177.26 176.07 3kst s LYS 59 N -5.58 0.34 0.07 -3.83 2.47 -0.49 -4.93 119.74 107.80 3kst s LYS 59 Ca 0.24 0.59 -0.23 0.00 -1.56 0.00 0.00 55.97 55.01 3kst s LYS 59 Cb -0.11 0.03 -0.06 0.00 -1.46 0.00 0.00 37.83 36.23 3kst s LYS 59 CO 0.29 -0.12 0.69 0.71 0.16 0.00 0.00 175.35 177.09 3kst s TYR 60 N 0.89 3.79 -0.11 4.03 2.02 -0.36 -1.47 117.35 126.13 3kst s TYR 60 Ca -0.06 1.42 -0.00 0.00 -0.37 0.00 0.00 57.07 58.06 3kst s TYR 60 Cb -0.07 -2.69 0.02 0.00 -0.40 0.00 0.00 41.96 38.82 3kst s TYR 60 CO -0.07 0.42 -0.09 0.71 -1.57 0.00 0.00 175.55 174.96 3kst s TYR 61 N -0.60 1.54 -0.10 2.71 2.02 -1.26 -1.50 117.35 120.16 3kst s TYR 61 Ca 0.34 -0.76 -0.01 0.00 -0.37 0.00 0.00 57.07 56.26 3kst s TYR 61 Cb -0.20 -1.25 -0.03 0.00 -0.40 0.00 0.00 41.96 40.07 3kst s TYR 61 CO 0.22 -0.51 -0.03 0.00 -1.57 0.00 0.00 175.55 173.66 3kst s ALA 62 N 1.60 3.10 -0.02 3.71 0.00 0.10 -4.16 121.76 126.09 3kst s ALA 62 Ca 0.03 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.17 3kst s ALA 62 Cb -0.13 -1.41 0.01 0.00 0.00 0.00 0.00 23.12 21.59 3kst s ALA 62 CO -0.07 0.48 -0.04 0.71 0.00 0.00 0.00 175.76 176.84 3kst s TYR 63 N -0.52 0.50 0.22 0.00 1.51 -0.21 -1.36 117.35 117.48 3kst s TYR 63 Ca 0.08 -0.10 -0.04 0.00 -1.01 0.00 0.00 57.07 56.01 3kst s TYR 63 Cb -0.12 -0.40 0.02 0.00 -0.11 0.00 0.00 41.96 41.35 3kst s TYR 63 CO 0.02 -0.07 0.35 0.41 -1.11 0.00 0.00 175.55 175.15 3kst n GLY 64 N 3.38 2.14 3.67 0.71 0.00 -1.26 -0.95 105.19 112.88 3kst n GLY 64 Ca -0.18 -1.39 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 3kst n GLY 64 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kst s THR 65 N -2.60 4.47 0.00 2.61 2.01 0.99 -4.59 115.64 118.53 3kst s THR 65 Ca 0.15 1.77 0.00 0.00 0.31 0.00 0.00 61.69 63.92 3kst s THR 65 Cb -0.01 -4.14 0.00 0.00 0.01 0.00 0.00 72.50 68.35 3kst s THR 65 CO 0.11 -0.08 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 3kst n GLY 66 N 3.37 -2.08 2.27 4.40 0.00 -1.26 -1.07 105.19 110.82 3kst n GLY 66 Ca 0.12 -1.53 -0.06 0.00 0.00 0.00 0.00 46.02 44.54 3kst n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kst n GLY 67 N -0.05 0.85 3.81 -0.02 0.00 -1.19 -4.59 105.19 104.00 3kst n GLY 67 Ca 0.00 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 3kst n GLY 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kst s THR 68 N -2.15 3.98 0.00 2.61 -4.23 -1.26 -4.81 115.64 109.77 3kst s THR 68 Ca 0.00 1.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.51 3kst s THR 68 Cb 0.00 -3.47 0.00 0.00 1.34 0.00 0.00 72.50 70.37 3kst s THR 68 CO 0.00 -0.49 0.10 0.35 -0.54 0.00 0.00 174.62 174.04 3kst n THR 69 N -1.69 0.00 -2.59 3.99 -2.24 -1.26 -4.82 114.28 105.68 3kst n THR 69 Ca 0.08 -0.48 -0.17 0.00 -2.27 0.00 0.00 64.05 61.21 3kst n THR 69 Cb 0.53 1.01 0.02 0.00 -2.10 0.00 0.00 70.33 69.78 3kst n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kst n ALA 70 N -0.76 4.11 0.00 6.98 0.00 -1.26 -5.11 120.51 124.47 3kst n ALA 70 Ca 0.00 -3.64 0.00 0.00 0.00 0.00 0.00 53.44 49.80 3kst n ALA 70 Cb 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3kst n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kst n GLY 71 N -0.24 -2.47 3.72 0.00 0.00 -1.26 -4.94 105.19 100.00 3kst n GLY 71 Ca 0.22 -1.87 -0.39 0.00 0.00 0.00 0.00 46.02 43.98 3kst n GLY 71 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kst n GLU 72 N -0.12 1.73 0.00 1.61 -0.58 -1.26 -4.78 120.64 117.24 3kst n GLU 72 Ca 0.00 0.63 0.00 0.00 -0.42 0.00 0.00 57.16 57.37 3kst n GLU 72 Cb 0.00 -2.49 0.00 0.00 -0.57 0.00 0.00 31.44 28.38 3kst n GLU 72 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3kst n GLY 73 N 0.80 0.31 2.97 0.62 0.00 -1.26 -1.89 105.19 106.74 3kst n GLY 73 Ca 0.09 -1.48 -0.15 0.00 0.00 0.00 0.00 46.02 44.48 3kst n GLY 73 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kst s PHE 74 N -2.28 0.49 0.56 1.61 0.08 -0.45 -4.63 117.98 113.36 3kst s PHE 74 Ca 0.00 -0.13 -0.02 0.00 0.12 0.00 0.00 56.93 56.90 3kst s PHE 74 Cb 0.00 -0.31 0.02 0.00 -0.57 0.00 0.00 43.02 42.16 3kst s PHE 74 CO 0.00 -0.02 0.82 0.00 -0.10 0.00 0.00 175.22 175.92 3kst s ALA 75 N -0.25 3.56 -0.09 5.36 0.00 -1.26 -0.47 121.76 128.62 3kst s ALA 75 Ca 0.01 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 50.99 3kst s ALA 75 Cb -0.03 -2.33 0.01 0.00 0.00 0.00 0.00 23.12 20.77 3kst s ALA 75 CO -0.00 -0.75 -0.16 0.00 0.00 0.00 0.00 175.76 174.85 3kst s PHE 77 N 0.67 2.48 0.23 0.00 0.40 -0.46 -0.83 117.98 120.47 3kst s PHE 77 Ca -0.13 -0.31 0.10 0.00 -0.60 0.00 0.00 56.93 55.98 3kst s PHE 77 Cb -0.16 -1.49 -0.05 0.00 0.51 0.00 0.00 43.02 41.83 3kst s PHE 77 CO 0.04 0.14 -0.17 -1.54 0.70 0.00 0.00 175.22 174.39 3kst s SER 78 N -1.06 3.04 -0.07 1.36 1.04 0.59 0.03 113.70 118.62 3kst s SER 78 Ca 0.12 -1.01 -0.26 0.00 0.48 0.00 0.00 55.95 55.28 3kst s SER 78 Cb -0.10 -0.21 0.06 0.00 0.10 0.00 0.00 66.02 65.86 3kst s SER 78 CO 0.02 -0.07 0.58 -0.55 0.98 0.00 0.00 173.24 174.20 3kst s SER 79 N -3.35 -0.54 -0.02 7.02 0.15 -0.56 -0.13 113.70 116.26 3kst s SER 79 Ca 0.25 0.64 0.18 0.00 0.70 0.00 0.00 55.95 57.72 3kst s SER 79 Cb -0.03 0.59 -0.21 0.00 -1.71 0.00 0.00 66.02 64.66 3kst s SER 79 CO 0.10 -0.51 0.55 0.47 1.20 0.00 0.00 173.24 175.05 3kst n ASP 80 N 1.27 0.44 0.00 5.45 8.00 -1.26 -1.23 116.55 129.22 3kst n ASP 80 Ca -0.19 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3kst n ASP 80 Cb 0.57 0.79 0.00 0.00 -0.02 0.00 0.00 41.12 42.46 3kst n ASP 80 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3kst n ASP 81 N -2.71 0.46 0.00 -2.24 5.68 -1.26 -4.92 116.55 111.56 3kst n ASP 81 Ca -0.14 -0.99 0.00 0.00 -0.50 0.00 0.00 54.79 53.15 3kst n ASP 81 Cb 0.86 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.84 3kst n ASP 81 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3kst n LEU 82 N -0.00 0.00 -0.12 -2.12 4.77 -1.26 -4.76 117.00 113.51 3kst n LEU 82 Ca 0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.74 3kst n LEU 82 Cb 0.13 -0.08 -0.10 0.00 -2.33 0.00 0.00 43.42 41.04 3kst n LEU 82 CO 0.00 0.00 -0.91 1.17 -1.33 0.00 0.00 177.39 176.32 3kst n LYS 83 N -1.93 0.57 -3.69 3.23 3.00 -1.26 -4.65 118.16 113.42 3kst n LYS 83 Ca 0.00 0.43 -0.37 0.00 -0.00 0.00 0.00 58.31 58.37 3kst n LYS 83 Cb 0.00 -1.63 -0.11 0.00 0.00 0.00 0.00 35.03 33.29 3kst n LYS 83 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 3kst s ASN 84 N -7.03 5.70 0.08 3.14 0.01 -1.26 -1.38 114.94 114.19 3kst s ASN 84 Ca -0.32 -0.05 0.08 0.00 -0.71 0.00 0.00 52.86 51.85 3kst s ASN 84 Cb 0.09 -2.04 -0.04 0.00 0.41 0.00 0.00 41.25 39.68 3kst s ASN 84 CO 0.52 -0.01 -0.16 0.26 -1.51 0.00 0.00 177.10 176.20 3kst s TRP 85 N 1.50 2.59 0.05 2.20 0.52 -0.53 -4.27 118.94 121.00 3kst s TRP 85 Ca 0.06 -0.23 0.07 0.00 0.02 0.00 0.00 56.10 56.03 3kst s TRP 85 Cb -0.15 -1.42 -0.03 0.00 -1.15 0.00 0.00 33.47 30.73 3kst s TRP 85 CO 0.07 0.34 -0.21 -1.59 0.02 0.00 0.00 176.95 175.59 3kst s LYS 86 N -1.86 1.32 0.17 4.98 -2.85 0.82 -1.14 119.74 121.18 3kst s LYS 86 Ca 0.17 -0.98 -0.30 0.00 -1.00 0.00 0.00 55.97 53.86 3kst s LYS 86 Cb -0.11 -1.46 -0.08 0.00 -2.06 0.00 0.00 37.83 34.12 3kst s LYS 86 CO 0.09 0.37 1.16 1.03 0.10 0.00 0.00 175.35 178.09 3kst s ARG 87 N -1.32 4.52 -0.02 1.78 0.52 -1.26 -0.30 118.95 122.87 3kst s ARG 87 Ca 0.07 1.80 0.21 0.00 -0.52 0.00 0.00 55.73 57.30 3kst s ARG 87 Cb -0.09 -3.26 -0.29 0.00 0.52 0.00 0.00 34.95 31.82 3kst s ARG 87 CO 0.02 -0.04 0.64 0.39 0.02 0.00 0.00 175.30 176.33 3kst n GLU 88 N 2.59 0.44 0.00 3.54 -0.58 -0.01 -4.88 120.64 121.73 3kst n GLU 88 Ca 0.04 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 3kst n GLU 88 Cb 0.45 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 3kst n GLU 88 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3kst n GLY 89 N 1.37 0.69 3.35 0.62 0.00 -1.24 -4.97 105.19 105.01 3kst n GLY 89 Ca -0.01 -2.10 -0.45 0.00 0.00 0.00 0.00 46.02 43.46 3kst n GLY 89 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3kst s GLN 90 N -0.96 3.16 0.23 1.61 2.00 -1.26 -1.76 119.66 122.68 3kst s GLN 90 Ca 0.00 -1.64 -0.07 0.00 -2.00 0.00 0.00 55.36 51.65 3kst s GLN 90 Cb 0.00 -4.35 0.37 0.00 0.80 0.00 0.00 33.01 29.83 3kst s GLN 90 CO 0.00 -1.46 1.71 0.00 -0.50 0.00 0.00 175.29 175.04 3kst h ALA 91 N 8.86 0.86 -3.48 1.58 0.00 -0.87 -3.42 119.26 122.79 3kst h ALA 91 Ca -0.20 0.13 -0.36 0.00 0.00 0.00 0.00 54.91 54.49 3kst h ALA 91 Cb 1.08 0.16 -0.34 0.00 0.00 0.00 0.00 17.79 18.68 3kst h ALA 91 CO 1.03 -0.28 -0.75 -1.17 0.00 0.00 0.00 179.25 178.08 3kst s LEU 92 N -10.51 1.18 -0.08 0.00 2.96 -0.81 0.04 118.68 111.46 3kst s LEU 92 Ca -0.13 -0.05 -0.03 0.00 -0.22 0.00 0.00 54.13 53.71 3kst s LEU 92 Cb 0.19 -0.27 -0.04 0.00 0.50 0.00 0.00 46.19 46.58 3kst s LEU 92 CO 0.75 -0.09 0.04 -0.44 -1.32 0.00 0.00 176.35 175.28 3kst s SER 93 N 1.03 5.50 0.31 3.68 0.01 -1.26 -1.33 113.70 121.64 3kst s SER 93 Ca -0.10 0.20 0.05 0.00 1.31 0.00 0.00 55.95 57.41 3kst s SER 93 Cb -0.14 -1.60 0.67 0.00 0.21 0.00 0.00 66.02 65.16 3kst s SER 93 CO -0.01 0.37 1.85 0.00 0.41 0.00 0.00 173.24 175.85 3kst h ALA 94 N 4.97 1.65 -0.12 1.44 0.00 -1.71 -1.40 119.26 124.10 3kst h ALA 94 Ca -0.51 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.45 3kst h ALA 94 Cb 1.20 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 3kst h ALA 94 CO 0.56 0.10 0.10 1.79 0.00 0.00 0.00 179.25 181.80 3kst h THR 95 N 0.87 0.77 -0.27 0.00 1.35 -1.88 -1.16 112.91 112.58 3kst h THR 95 Ca 0.48 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.34 3kst h THR 95 Cb 0.58 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 67.93 3kst h THR 95 CO -0.24 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.50 3kst n ASP 96 N -4.24 1.78 -4.05 5.36 8.00 -0.53 -4.93 116.55 117.95 3kst n ASP 96 Ca -0.00 -2.07 -0.09 0.00 0.71 0.00 0.00 54.79 53.33 3kst n ASP 96 Cb 0.21 -0.27 -0.09 0.00 -0.02 0.00 0.00 41.12 40.96 3kst n ASP 96 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3kst s SER 97 N -0.86 0.21 0.31 -2.24 0.15 -0.44 -1.66 113.70 109.17 3kst s SER 97 Ca 0.19 -1.01 -0.30 0.00 0.70 0.00 0.00 55.95 55.54 3kst s SER 97 Cb 0.11 0.34 -0.11 0.00 -1.71 0.00 0.00 66.02 64.65 3kst s SER 97 CO 0.11 -0.78 1.57 -0.47 1.20 0.00 0.00 173.24 174.88 3kst s TYR 98 N -3.99 2.72 0.00 3.44 5.04 -1.26 -4.88 117.35 118.42 3kst s TYR 98 Ca 0.18 0.86 0.00 0.00 -2.44 0.00 0.00 57.07 55.67 3kst s TYR 98 Cb 0.06 -4.06 0.00 0.00 0.35 0.00 0.00 41.96 38.31 3kst s TYR 98 CO -0.01 -3.46 0.00 0.41 -1.34 0.00 0.00 175.55 171.15 3kst n GLY 99 N 1.81 -0.85 0.00 8.97 0.00 -1.26 -4.88 105.19 108.98 3kst n GLY 99 Ca 0.07 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.46 3kst n GLY 99 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kst n THR 100 N -0.61 0.00 -3.93 2.61 -2.24 -1.26 -4.74 114.28 104.11 3kst n THR 100 Ca 0.00 -0.37 -0.09 0.00 -2.27 0.00 0.00 64.05 61.32 3kst n THR 100 Cb 0.00 1.17 -0.05 0.00 -2.10 0.00 0.00 70.33 69.35 3kst n THR 100 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3kst s TRP 101 N -0.25 0.26 -1.10 4.78 1.48 -1.26 -4.94 118.94 117.91 3kst s TRP 101 Ca 0.00 -0.62 -0.05 0.00 -1.06 0.00 0.00 56.10 54.38 3kst s TRP 101 Cb 0.00 0.18 0.01 0.00 -1.16 0.00 0.00 33.47 32.49 3kst s TRP 101 CO 0.00 -0.91 0.62 0.41 -4.06 0.00 0.00 176.95 173.01 3kst n GLY 102 N -0.33 -0.19 3.55 3.67 0.00 -1.26 -0.98 105.19 109.65 3kst n GLY 102 Ca -0.05 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 3kst n GLY 102 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kst s PHE 103 N -3.10 2.07 0.15 1.61 0.08 -1.26 -3.37 117.98 114.16 3kst s PHE 103 Ca 0.31 0.20 0.08 0.00 0.12 0.00 0.00 56.93 57.64 3kst s PHE 103 Cb -0.14 -4.42 -0.04 0.00 -0.57 0.00 0.00 43.02 37.85 3kst s PHE 103 CO 0.38 -2.12 -0.18 -1.58 -0.10 0.00 0.00 175.22 171.61 3kst s TRP 104 N 7.06 1.78 -1.22 0.36 0.51 -0.88 -4.43 118.94 122.12 3kst s TRP 104 Ca 0.49 -0.47 -0.10 0.00 -2.12 0.00 0.00 56.10 53.90 3kst s TRP 104 Cb -0.09 -0.90 -0.01 0.00 -0.81 0.00 0.00 33.47 31.66 3kst s TRP 104 CO 0.14 0.30 0.73 0.00 -0.51 0.00 0.00 176.95 177.60 3kst n ALA 105 N 0.41 -2.31 -1.78 0.98 0.00 -1.26 -1.70 120.51 114.85 3kst n ALA 105 Ca -0.14 -0.18 -0.36 0.00 0.00 0.00 0.00 53.44 52.76 3kst n ALA 105 Cb 0.57 -3.30 -0.03 0.00 0.00 0.00 0.00 19.45 16.68 3kst n ALA 105 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3kst s PRO 106 N -5.88 4.05 -0.00 0.00 0.04 -1.26 -4.53 135.00 127.42 3kst s PRO 106 Ca 0.27 1.54 0.02 0.00 0.04 0.00 0.00 61.00 62.87 3kst s PRO 106 Cb -0.08 -2.47 -0.01 0.00 0.04 0.00 0.00 34.50 31.98 3kst s PRO 106 CO 0.84 -0.25 -0.07 -1.21 0.04 0.00 0.00 177.00 176.35 3kst s GLU 107 N -2.61 0.58 -0.03 4.56 2.02 -0.28 -4.45 118.70 118.48 3kst s GLU 107 Ca 0.60 -0.27 0.05 0.00 0.02 0.00 0.00 54.97 55.37 3kst s GLU 107 Cb -0.23 -0.55 -0.01 0.00 0.10 0.00 0.00 34.13 33.44 3kst s GLU 107 CO 0.28 0.15 -0.20 0.08 0.02 0.00 0.00 175.26 175.59 3kst s VAL 108 N -0.21 1.59 -0.01 2.63 1.01 -1.26 -0.81 120.40 123.34 3kst s VAL 108 Ca 0.02 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 3kst s VAL 108 Cb -0.03 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 35.01 3kst s VAL 108 CO -0.00 0.45 0.03 -0.31 0.00 0.00 0.00 175.10 175.27 3kst s TYR 109 N -0.20 -0.03 -0.36 5.22 2.02 -0.36 -4.98 117.35 118.66 3kst s TYR 109 Ca 0.01 0.10 -0.22 0.00 -0.37 0.00 0.00 57.07 56.59 3kst s TYR 109 Cb -0.10 -0.03 0.01 0.00 -0.40 0.00 0.00 41.96 41.44 3kst s TYR 109 CO 0.01 -0.03 0.70 -0.47 -1.57 0.00 0.00 175.55 174.19 3kst s TYR 110 N 0.19 3.14 -0.49 2.71 5.04 -1.26 -0.60 117.35 126.08 3kst s TYR 110 Ca -0.01 0.45 -0.20 0.00 -2.44 0.00 0.00 57.07 54.86 3kst s TYR 110 Cb -0.02 -3.25 0.04 0.00 0.35 0.00 0.00 41.96 39.08 3kst s TYR 110 CO -0.01 -0.67 0.68 0.08 -1.34 0.00 0.00 175.55 174.29 3kst s VAL 111 N 2.88 4.78 0.23 3.14 1.01 -0.60 -4.96 120.40 126.89 3kst s VAL 111 Ca 0.28 -0.17 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 3kst s VAL 111 Cb -0.14 -4.30 0.19 0.00 0.00 0.00 0.00 36.38 32.13 3kst s VAL 111 CO 0.16 -0.78 1.80 -0.08 0.00 0.00 0.00 175.10 176.20 3kst h GLU 112 N 9.00 0.70 -0.82 2.72 4.57 -1.95 0.15 114.58 128.95 3kst h GLU 112 Ca -0.27 -0.04 0.16 0.00 -1.18 0.00 0.00 59.36 58.04 3kst h GLU 112 Cb 1.09 -0.16 -0.10 0.00 -0.16 0.00 0.00 28.75 29.42 3kst h GLU 112 CO 0.96 0.46 0.37 1.03 -1.18 0.00 0.00 179.01 180.65 3kst h SER 113 N 0.72 0.38 -0.00 1.04 0.87 -1.97 -3.10 113.55 111.49 3kst h SER 113 Ca 0.36 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 61.03 3kst h SER 113 Cb 0.31 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 3kst h SER 113 CO -0.23 0.12 -0.88 0.29 -0.53 0.00 0.00 176.83 175.59 3kst n LYS 114 N -4.97 0.61 -3.93 2.24 4.76 -0.73 -5.02 118.16 111.12 3kst n LYS 114 Ca 0.17 -0.08 -0.27 0.00 -2.87 0.00 0.00 58.31 55.26 3kst n LYS 114 Cb 0.48 -1.42 -0.01 0.00 -1.84 0.00 0.00 35.03 32.23 3kst n LYS 114 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3kst n LYS 115 N -1.34 -2.75 -3.48 1.97 5.02 0.45 -4.97 118.16 113.06 3kst n LYS 115 Ca 0.04 0.38 -0.14 0.00 -2.02 0.00 0.00 58.31 56.58 3kst n LYS 115 Cb 0.32 -4.34 -0.04 0.00 -0.02 0.00 0.00 35.03 30.95 3kst n LYS 115 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3kst s LYS 116 N -6.54 1.10 0.03 1.97 2.20 -1.23 -5.02 119.74 112.25 3kst s LYS 116 Ca 0.09 -0.12 -0.20 0.00 -0.36 0.00 0.00 55.97 55.38 3kst s LYS 116 Cb -0.04 0.51 -0.06 0.00 -1.51 0.00 0.00 37.83 36.73 3kst s LYS 116 CO 0.89 -0.42 0.58 -0.06 -0.36 0.00 0.00 175.35 175.98 3kst s PHE 117 N -2.49 3.74 -0.13 4.03 0.40 -0.20 -1.56 117.98 121.78 3kst s PHE 117 Ca -0.03 1.23 0.02 0.00 -0.60 0.00 0.00 56.93 57.55 3kst s PHE 117 Cb -0.01 -2.55 0.00 0.00 0.51 0.00 0.00 43.02 40.97 3kst s PHE 117 CO -0.03 0.47 -0.20 0.71 0.70 0.00 0.00 175.22 176.87 3kst s TYR 118 N -0.63 2.67 -0.28 0.36 1.51 0.23 -1.62 117.35 119.58 3kst s TYR 118 Ca 0.30 -1.13 -0.08 0.00 -1.01 0.00 0.00 57.07 55.15 3kst s TYR 118 Cb -0.19 -1.80 -0.01 0.00 -0.11 0.00 0.00 41.96 39.85 3kst s TYR 118 CO 0.18 -0.49 0.10 -1.17 -1.11 0.00 0.00 175.55 173.07 3kst s LEU 119 N 0.62 3.80 -0.14 -1.29 2.96 -0.07 -1.23 118.68 123.33 3kst s LEU 119 Ca -0.11 -0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 53.30 3kst s LEU 119 Cb -0.16 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 3kst s LEU 119 CO 0.03 -0.13 0.04 -0.36 -1.32 0.00 0.00 176.35 174.60 3kst s PHE 120 N 1.59 3.24 0.31 5.38 0.40 0.01 -1.12 117.98 127.79 3kst s PHE 120 Ca 0.05 0.13 -0.19 0.00 -0.60 0.00 0.00 56.93 56.32 3kst s PHE 120 Cb -0.16 -1.95 0.04 0.00 0.51 0.00 0.00 43.02 41.46 3kst s PHE 120 CO 0.04 0.32 0.78 1.52 0.70 0.00 0.00 175.22 178.58 3kst s TYR 121 N -0.25 -0.04 0.03 0.36 1.13 -0.18 -1.12 117.35 117.28 3kst s TYR 121 Ca 0.07 -0.50 0.04 0.00 -1.41 0.00 0.00 57.07 55.27 3kst s TYR 121 Cb -0.12 0.76 -0.04 0.00 -1.10 0.00 0.00 41.96 41.47 3kst s TYR 121 CO 0.02 -1.35 -0.06 -1.12 -2.51 0.00 0.00 175.55 170.53 3kst s SER 122 N -3.01 4.67 -0.19 -0.18 0.01 -0.69 -0.58 113.70 113.73 3kst s SER 122 Ca 0.13 -0.18 -0.09 0.00 1.31 0.00 0.00 55.95 57.13 3kst s SER 122 Cb -0.05 -1.07 0.07 0.00 0.21 0.00 0.00 66.02 65.18 3kst s SER 122 CO 0.09 0.25 0.44 0.00 0.41 0.00 0.00 173.24 174.43 3kst s ALA 123 N -1.07 -1.18 -1.63 1.44 0.00 -0.09 -2.07 121.76 117.16 3kst s ALA 123 Ca 0.19 1.62 -0.17 0.00 0.00 0.00 0.00 51.96 53.60 3kst s ALA 123 Cb -0.11 -1.11 0.13 0.00 0.00 0.00 0.00 23.12 22.03 3kst s ALA 123 CO 0.10 -0.44 0.84 0.39 0.00 0.00 0.00 175.76 176.65 3kst n GLU 124 N 4.64 -3.89 -2.46 0.00 1.02 -0.15 -1.50 120.64 118.29 3kst n GLU 124 Ca -0.18 0.44 -0.19 0.00 -0.02 0.00 0.00 57.16 57.21 3kst n GLU 124 Cb 0.54 -5.23 -0.00 0.00 -0.02 0.00 0.00 31.44 26.72 3kst n GLU 124 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3kst n GLU 125 N -4.44 -2.04 -4.24 3.49 1.02 -1.26 -4.98 120.64 108.19 3kst n GLU 125 Ca 0.07 0.90 -0.19 0.00 -0.02 0.00 0.00 57.16 57.92 3kst n GLU 125 Cb 0.50 -5.48 -0.11 0.00 -0.02 0.00 0.00 31.44 26.33 3kst n GLU 125 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3kst s HIS 126 N -2.98 1.44 -0.04 -0.32 3.76 -0.57 0.00 115.29 116.60 3kst s HIS 126 Ca 0.05 -0.53 -0.12 0.00 -0.15 0.00 0.00 55.06 54.31 3kst s HIS 126 Cb -0.02 -0.76 -0.05 0.00 1.11 0.00 0.00 32.58 32.86 3kst s HIS 126 CO 0.06 0.15 0.33 0.96 -0.85 0.00 0.00 174.74 175.39 3kst s ILE 127 N -1.96 5.17 0.08 0.60 -4.36 -1.16 -0.91 121.20 118.66 3kst s ILE 127 Ca 0.08 0.65 -0.03 0.00 -0.26 0.00 0.00 60.65 61.09 3kst s ILE 127 Cb -0.06 -3.62 -0.03 0.00 1.25 0.00 0.00 42.46 40.00 3kst s ILE 127 CO 0.03 0.59 0.06 0.00 0.24 0.00 0.00 174.94 175.86 3kst s VAL 129 N -3.93 -0.01 0.22 0.00 0.11 -1.26 -1.01 120.40 114.52 3kst s VAL 129 Ca 0.10 0.09 0.06 0.00 -2.93 0.00 0.00 61.98 59.31 3kst s VAL 129 Cb 0.07 -0.06 -0.05 0.00 -1.53 0.00 0.00 36.38 34.81 3kst s VAL 129 CO -0.07 0.05 -0.08 0.00 -3.33 0.00 0.00 175.10 171.66 3kst s ALA 130 N 0.50 1.97 0.18 1.54 0.00 -0.28 -4.74 121.76 120.94 3kst s ALA 130 Ca -0.04 -1.73 0.06 0.00 0.00 0.00 0.00 51.96 50.25 3kst s ALA 130 Cb -0.06 0.15 -0.05 0.00 0.00 0.00 0.00 23.12 23.16 3kst s ALA 130 CO -0.01 -0.07 -0.10 0.95 0.00 0.00 0.00 175.76 176.52 3kst s THR 131 N -3.15 1.38 -0.01 0.00 -4.23 -0.69 -0.89 115.64 108.05 3kst s THR 131 Ca 0.25 -2.12 -0.15 0.00 -1.18 0.00 0.00 61.69 58.49 3kst s THR 131 Cb 0.03 -2.00 0.02 0.00 1.34 0.00 0.00 72.50 71.89 3kst s THR 131 CO 0.08 -0.63 0.32 -0.55 -0.54 0.00 0.00 174.62 173.30 3kst s SER 132 N -3.25 -0.20 0.16 3.99 0.15 -0.64 -1.27 113.70 112.65 3kst s SER 132 Ca 0.21 0.08 0.26 0.00 0.70 0.00 0.00 55.95 57.19 3kst s SER 132 Cb 0.02 0.32 0.70 0.00 -1.71 0.00 0.00 66.02 65.35 3kst s SER 132 CO 0.04 -0.47 1.65 0.35 1.20 0.00 0.00 173.24 176.01 3kst n THR 133 N 1.20 0.47 -4.34 6.45 -2.24 -1.26 -1.03 114.28 113.52 3kst n THR 133 Ca -0.21 -0.25 -0.18 0.00 -2.27 0.00 0.00 64.05 61.13 3kst n THR 133 Cb 0.56 -0.43 -0.10 0.00 -2.10 0.00 0.00 70.33 68.27 3kst n THR 133 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3kst s THR 134 N -3.11 1.70 0.34 4.28 -4.23 -1.26 -4.76 115.64 108.60 3kst s THR 134 Ca 0.10 -2.20 0.02 0.00 -1.18 0.00 0.00 61.69 58.42 3kst s THR 134 Cb 0.13 -2.03 0.24 0.00 1.34 0.00 0.00 72.50 72.19 3kst s THR 134 CO 0.63 -0.60 1.98 -0.65 -0.54 0.00 0.00 174.62 175.43 3kst h PRO 135 N 2.58 0.84 0.00 3.99 0.11 -2.00 -3.13 132.00 134.39 3kst h PRO 135 Ca -0.38 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3kst h PRO 135 Cb 1.22 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3kst h PRO 135 CO 0.62 0.59 -0.19 -0.85 -0.21 0.00 0.00 178.00 177.97 3kst n GLU 136 N -4.41 0.24 0.00 1.05 0.00 -1.26 -5.04 120.64 111.22 3kst n GLU 136 Ca 0.06 0.15 0.00 0.00 0.00 0.00 0.00 57.16 57.38 3kst n GLU 136 Cb 0.07 -1.74 0.00 0.00 0.00 0.00 0.00 31.44 29.78 3kst n GLU 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3kst n GLY 137 N 1.34 -1.43 3.70 -1.84 0.00 -1.19 -3.83 105.19 101.94 3kst n GLY 137 Ca 0.05 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 3kst n GLY 137 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kst s PRO 138 N 0.00 4.34 -0.01 1.61 0.04 -1.26 -4.68 135.00 135.04 3kst s PRO 138 Ca 0.00 1.92 -0.28 0.00 0.04 0.00 0.00 61.00 62.68 3kst s PRO 138 Cb 0.00 -3.42 -0.03 0.00 0.04 0.00 0.00 34.50 31.08 3kst s PRO 138 CO 0.00 -0.44 0.90 -0.06 0.04 0.00 0.00 177.00 177.44 3kst s PHE 139 N 1.67 3.65 0.05 0.56 0.40 0.11 -4.52 117.98 119.91 3kst s PHE 139 Ca 0.62 1.58 0.01 0.00 -0.60 0.00 0.00 56.93 58.54 3kst s PHE 139 Cb -0.32 -3.02 -0.03 0.00 0.51 0.00 0.00 43.02 40.16 3kst s PHE 139 CO 0.28 0.04 -0.05 1.03 0.70 0.00 0.00 175.22 177.22 3kst s ARG 140 N 0.83 0.57 -0.15 0.44 0.52 -0.40 -4.56 118.95 116.21 3kst s ARG 140 Ca 0.47 -1.00 -0.08 0.00 -0.52 0.00 0.00 55.73 54.61 3kst s ARG 140 Cb -0.20 -0.03 -0.04 0.00 0.52 0.00 0.00 34.95 35.20 3kst s ARG 140 CO 0.25 -0.04 0.11 -0.65 0.02 0.00 0.00 175.30 175.00 3kst s GLN 141 N -2.78 3.73 0.05 3.54 -0.21 -0.67 -1.70 119.66 121.62 3kst s GLN 141 Ca -0.01 -0.22 -0.20 0.00 0.02 0.00 0.00 55.36 54.94 3kst s GLN 141 Cb -0.01 -3.23 -0.13 0.00 1.00 0.00 0.00 33.01 30.64 3kst s GLN 141 CO -0.04 0.53 1.40 0.93 -2.12 0.00 0.00 175.29 175.99 3kst h GLU 142 N 5.83 0.35 -5.31 2.91 5.08 -1.92 -3.42 114.58 118.10 3kst h GLU 142 Ca -0.47 -0.16 -0.67 0.00 -1.00 0.00 0.00 59.36 57.06 3kst h GLU 142 Cb 1.19 -0.01 -0.32 0.00 0.50 0.00 0.00 28.75 30.11 3kst h GLU 142 CO 0.66 0.68 -0.85 0.08 -1.00 0.00 0.00 179.01 178.57 3kst s VAL 143 N -4.52 2.28 -1.32 3.13 1.01 -1.26 -5.05 120.40 114.66 3kst s VAL 143 Ca -0.14 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 60.79 3kst s VAL 143 Cb 0.06 -1.90 0.13 0.00 0.00 0.00 0.00 36.38 34.66 3kst s VAL 143 CO 0.75 0.55 1.92 0.29 0.00 0.00 0.00 175.10 178.61 3kst n LYS 144 N 3.62 3.36 -4.08 2.72 4.01 -1.26 -4.89 118.16 121.63 3kst n LYS 144 Ca -0.19 -3.29 -0.10 0.00 -0.51 0.00 0.00 58.31 54.23 3kst n LYS 144 Cb 0.53 -3.07 -0.10 0.00 -0.51 0.00 0.00 35.03 31.87 3kst n LYS 144 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 3kst s GLN 145 N 1.50 0.59 0.94 1.97 -1.52 -1.26 -4.28 119.66 117.59 3kst s GLN 145 Ca 0.43 -1.03 -0.15 0.00 -1.95 0.00 0.00 55.36 52.66 3kst s GLN 145 Cb 0.09 -0.02 0.17 0.00 -0.22 0.00 0.00 33.01 33.03 3kst s GLN 145 CO -0.02 -0.04 1.24 -1.25 -0.25 0.00 0.00 175.29 174.97 3kst s PRO 146 N -2.89 0.88 0.13 2.91 0.04 -1.26 -4.74 135.00 130.06 3kst s PRO 146 Ca -0.00 -0.13 -0.15 0.00 0.04 0.00 0.00 61.00 60.76 3kst s PRO 146 Cb -0.00 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 3kst s PRO 146 CO -0.05 -2.30 1.62 0.82 0.04 0.00 0.00 177.00 177.14 3kst h ILE 147 N -1.56 1.24 -4.06 0.56 2.04 -1.27 -3.46 117.51 111.00 3kst h ILE 147 Ca -0.46 -0.85 -0.15 0.00 1.00 0.00 0.00 64.86 64.41 3kst h ILE 147 Cb 1.28 0.98 -0.11 0.00 -0.74 0.00 0.00 36.82 38.23 3kst h ILE 147 CO 0.49 0.29 -0.32 -1.66 0.00 0.00 0.00 178.15 176.95 3kst s TRP 148 N -5.23 0.73 -0.14 1.37 1.48 -1.26 -4.61 118.94 111.28 3kst s TRP 148 Ca -0.13 -1.03 0.15 0.00 -1.06 0.00 0.00 56.10 54.03 3kst s TRP 148 Cb 0.10 -0.12 0.03 0.00 -1.16 0.00 0.00 33.47 32.31 3kst s TRP 148 CO 0.78 -0.87 1.37 0.66 -4.06 0.00 0.00 176.95 174.83 3kst h SER 149 N 2.38 0.00 -3.73 -2.66 4.64 -1.96 -3.44 113.55 108.78 3kst h SER 149 Ca -0.30 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.51 3kst h SER 149 Cb 1.25 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.36 3kst h SER 149 CO 0.42 0.54 0.52 -0.70 -0.87 0.00 0.00 176.83 176.74 3kst s GLU 150 N -2.94 4.56 0.21 4.77 2.12 -1.26 -4.97 118.70 121.19 3kst s GLU 150 Ca 0.03 1.88 -0.32 0.00 0.36 0.00 0.00 54.97 56.92 3kst s GLU 150 Cb 0.08 -3.19 -0.14 0.00 0.26 0.00 0.00 34.13 31.14 3kst s GLU 150 CO 0.76 0.07 1.37 1.63 -0.54 0.00 0.00 175.26 178.55 3kst n LYS 151 N 1.50 1.84 -3.56 4.30 5.02 -1.26 -4.73 118.16 121.27 3kst n LYS 151 Ca 0.01 0.66 -0.09 0.00 -2.02 0.00 0.00 58.31 56.86 3kst n LYS 151 Cb 0.44 -2.29 -0.04 0.00 -0.02 0.00 0.00 35.03 33.12 3kst n LYS 151 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3kst s SER 152 N 0.29 -0.34 0.31 4.39 1.04 0.10 -4.48 113.70 115.01 3kst s SER 152 Ca 0.71 0.26 -0.00 0.00 0.48 0.00 0.00 55.95 57.39 3kst s SER 152 Cb -0.70 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 65.70 3kst s SER 152 CO 0.49 -0.39 0.36 0.27 0.98 0.00 0.00 173.24 174.95 3kst s ILE 153 N -1.71 0.00 -1.10 -1.02 -4.36 -1.02 -2.69 121.20 109.30 3kst s ILE 153 Ca 0.01 -1.78 -0.05 0.00 -0.26 0.00 0.00 60.65 58.57 3kst s ILE 153 Cb -0.01 -2.53 0.01 0.00 1.25 0.00 0.00 42.46 41.18 3kst s ILE 153 CO -0.02 0.00 0.95 0.47 0.24 0.00 0.00 174.94 176.58 3kst n ASP 154 N -1.17 -4.67 -4.63 4.36 9.92 -1.26 -0.55 116.55 118.55 3kst n ASP 154 Ca 0.03 -0.47 -0.45 0.00 -0.53 0.00 0.00 54.79 53.37 3kst n ASP 154 Cb 0.63 -4.31 -0.02 0.00 -0.64 0.00 0.00 41.12 36.78 3kst n ASP 154 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 3kst n THR 155 N -4.33 1.41 -3.68 -3.53 -2.24 -1.26 -4.33 114.28 96.33 3kst n THR 155 Ca -0.06 -0.35 -0.12 0.00 -2.27 0.00 0.00 64.05 61.24 3kst n THR 155 Cb 0.58 -1.19 -0.13 0.00 -2.10 0.00 0.00 70.33 67.49 3kst n THR 155 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3kst s SER 156 N -0.13 0.11 0.09 3.42 0.15 0.25 -4.72 113.70 112.87 3kst s SER 156 Ca 0.65 0.65 -0.13 0.00 0.70 0.00 0.00 55.95 57.81 3kst s SER 156 Cb -0.70 0.73 -0.06 0.00 -1.71 0.00 0.00 66.02 64.27 3kst s SER 156 CO 0.55 -0.22 0.47 -0.22 1.20 0.00 0.00 173.24 175.03 3kst s LEU 157 N 2.15 4.38 -0.03 3.45 2.96 -1.26 -0.48 118.68 129.85 3kst s LEU 157 Ca -0.02 0.97 -0.01 0.00 -0.22 0.00 0.00 54.13 54.85 3kst s LEU 157 Cb -0.11 -3.03 0.03 0.00 0.50 0.00 0.00 46.19 43.58 3kst s LEU 157 CO -0.09 0.18 0.03 0.12 -1.32 0.00 0.00 176.35 175.27 3kst s PHE 158 N -1.35 0.15 -0.25 5.38 5.36 0.45 -4.86 117.98 122.84 3kst s PHE 158 Ca 0.33 0.12 -0.04 0.00 -0.96 0.00 0.00 56.93 56.39 3kst s PHE 158 Cb -0.15 -0.40 0.01 0.00 -0.34 0.00 0.00 43.02 42.14 3kst s PHE 158 CO 0.18 -0.15 -0.01 0.42 -1.46 0.00 0.00 175.22 174.20 3kst s ILE 159 N 1.50 3.38 0.85 3.12 1.01 -1.26 0.35 121.20 130.14 3kst s ILE 159 Ca -0.03 -0.74 -0.12 0.00 0.00 0.00 0.00 60.65 59.76 3kst s ILE 159 Cb -0.13 -2.67 0.10 0.00 0.01 0.00 0.00 42.46 39.78 3kst s ILE 159 CO -0.03 0.24 1.16 -0.62 0.00 0.00 0.00 174.94 175.69 3kst s ASP 160 N 1.43 4.11 0.52 3.58 -1.08 -0.71 -4.88 116.67 119.65 3kst s ASP 160 Ca 0.03 0.86 0.23 0.00 -0.52 0.00 0.00 52.55 53.14 3kst s ASP 160 Cb -0.16 -1.39 1.35 0.00 -1.46 0.00 0.00 42.92 41.26 3kst s ASP 160 CO -0.02 -2.16 2.02 0.44 0.52 0.00 0.00 175.17 175.97 3kst h ASP 161 N -1.23 0.03 0.53 -0.34 3.32 -1.99 -0.59 116.42 116.15 3kst h ASP 161 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 3kst h ASP 161 Cb 1.33 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 3kst h ASP 161 CO 0.64 0.02 0.00 -0.90 -1.72 0.00 0.00 179.24 177.28 3kst n ASP 162 N -4.42 0.00 0.00 6.45 3.85 -1.26 -4.92 116.55 116.26 3kst n ASP 162 Ca 0.07 -0.07 0.00 0.00 -0.71 0.00 0.00 54.79 54.08 3kst n ASP 162 Cb 0.49 -0.30 0.00 0.00 -1.35 0.00 0.00 41.12 39.96 3kst n ASP 162 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3kst n GLY 163 N 1.05 0.73 3.68 6.12 0.00 -0.23 -5.06 105.19 111.48 3kst n GLY 163 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3kst n GLY 163 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kst s THR 164 N -2.56 4.78 0.11 2.61 2.01 -1.26 -4.76 115.64 116.56 3kst s THR 164 Ca 0.00 1.99 -0.26 0.00 0.31 0.00 0.00 61.69 63.73 3kst s THR 164 Cb 0.00 -4.29 -0.07 0.00 0.01 0.00 0.00 72.50 68.15 3kst s THR 164 CO 0.00 -0.03 0.82 -2.16 -0.69 0.00 0.00 174.62 172.56 3kst s PRO 165 N 2.25 4.58 -0.03 4.92 0.04 -1.26 -1.73 135.00 143.76 3kst s PRO 165 Ca 0.46 1.19 0.05 0.00 0.04 0.00 0.00 61.00 62.75 3kst s PRO 165 Cb -0.17 -3.33 -0.01 0.00 0.04 0.00 0.00 34.50 31.03 3kst s PRO 165 CO 0.15 0.37 -0.19 0.71 0.04 0.00 0.00 177.00 178.09 3kst s TYR 166 N -0.45 1.76 -0.16 0.56 2.02 0.15 -4.47 117.35 116.75 3kst s TYR 166 Ca 0.39 -0.41 -0.00 0.00 -0.37 0.00 0.00 57.07 56.68 3kst s TYR 166 Cb -0.22 -1.15 -0.00 0.00 -0.40 0.00 0.00 41.96 40.18 3kst s TYR 166 CO 0.26 -0.09 -0.14 -1.17 -1.57 0.00 0.00 175.55 172.83 3kst s LEU 167 N -0.25 2.50 -0.11 -1.29 2.96 -0.57 -0.41 118.68 121.51 3kst s LEU 167 Ca 0.02 -0.47 -0.09 0.00 -0.22 0.00 0.00 54.13 53.38 3kst s LEU 167 Cb -0.09 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 44.97 3kst s LEU 167 CO 0.01 0.07 0.18 -0.31 -1.32 0.00 0.00 176.35 174.97 3kst s TYR 168 N 0.93 3.59 0.11 5.38 1.51 0.37 -1.89 117.35 127.35 3kst s TYR 168 Ca -0.03 0.57 -0.26 0.00 -1.01 0.00 0.00 57.07 56.35 3kst s TYR 168 Cb -0.15 -2.03 0.07 0.00 -0.11 0.00 0.00 41.96 39.75 3kst s TYR 168 CO -0.02 0.66 0.86 -0.59 -1.11 0.00 0.00 175.55 175.35 3kst s PHE 169 N -0.82 -0.28 -0.19 2.71 -0.71 -0.76 -0.59 117.98 117.35 3kst s PHE 169 Ca 0.15 0.03 -0.12 0.00 -1.04 0.00 0.00 56.93 55.96 3kst s PHE 169 Cb -0.13 0.60 -0.05 0.00 -1.21 0.00 0.00 43.02 42.23 3kst s PHE 169 CO 0.05 -0.77 0.21 0.08 -1.34 0.00 0.00 175.22 173.45 3kst s VAL 170 N -3.36 5.35 0.13 -2.49 1.01 0.29 0.12 120.40 121.46 3kst s VAL 170 Ca 0.08 0.36 0.07 0.00 0.00 0.00 0.00 61.98 62.49 3kst s VAL 170 Cb -0.02 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 3kst s VAL 170 CO -0.04 0.40 -0.06 -0.13 0.00 0.00 0.00 175.10 175.27 3kst s ARG 171 N 0.52 2.23 -1.21 2.72 0.52 0.24 -2.44 118.95 121.53 3kst s ARG 171 Ca 0.12 -1.06 -0.06 0.00 -0.52 0.00 0.00 55.73 54.21 3kst s ARG 171 Cb -0.12 -2.32 0.21 0.00 0.52 0.00 0.00 34.95 33.24 3kst s ARG 171 CO 0.01 0.49 1.89 1.19 0.02 0.00 0.00 175.30 178.90 3kst n PHE 172 N 0.38 2.64 -0.07 -0.53 3.72 -1.26 -1.18 117.46 121.16 3kst n PHE 172 Ca -0.12 -2.71 -0.04 0.00 -0.05 0.00 0.00 57.45 54.54 3kst n PHE 172 Cb 0.53 -1.65 -0.16 0.00 -0.94 0.00 0.00 39.48 37.27 3kst n PHE 172 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3kst n THR 173 N 2.01 0.94 -2.72 4.37 -2.24 -1.26 -4.78 114.28 110.59 3kst n THR 173 Ca 0.42 -0.72 -0.06 0.00 -2.27 0.00 0.00 64.05 61.42 3kst n THR 173 Cb 0.31 -0.33 0.05 0.00 -2.10 0.00 0.00 70.33 68.26 3kst n THR 173 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3kst n ASP 174 N -2.57 -2.40 -0.06 3.42 -0.08 -1.26 -5.07 116.55 108.51 3kst n ASP 174 Ca -0.23 -2.52 0.00 0.00 -1.51 0.00 0.00 54.79 50.53 3kst n ASP 174 Cb 0.96 1.38 0.00 0.00 2.34 0.00 0.00 41.12 45.80 3kst n ASP 174 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3kst n GLY 175 N 1.99 -1.26 3.65 0.27 0.00 -1.26 -4.58 105.19 104.00 3kst n GLY 175 Ca 0.09 -1.25 -0.43 0.00 0.00 0.00 0.00 46.02 44.43 3kst n GLY 175 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kst s ASN 176 N -4.00 6.92 -0.06 1.61 -0.87 -0.39 -4.26 114.94 113.89 3kst s ASN 176 Ca 0.00 1.45 0.05 0.00 -1.57 0.00 0.00 52.86 52.79 3kst s ASN 176 Cb 0.00 -2.54 -0.01 0.00 -0.02 0.00 0.00 41.25 38.68 3kst s ASN 176 CO 0.00 -0.82 -0.23 -0.69 -2.57 0.00 0.00 177.10 172.79 3kst s VAL 177 N 3.64 1.88 -0.22 1.60 1.01 -0.33 -1.07 120.40 126.92 3kst s VAL 177 Ca 0.52 -0.96 -0.28 0.00 0.00 0.00 0.00 61.98 61.26 3kst s VAL 177 Cb -0.18 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.60 3kst s VAL 177 CO 0.15 0.52 0.99 -0.63 0.00 0.00 0.00 175.10 176.13 3kst s ILE 178 N 0.02 4.72 0.36 2.22 1.01 -0.48 -0.59 121.20 128.46 3kst s ILE 178 Ca -0.07 1.93 0.08 0.00 0.00 0.00 0.00 60.65 62.59 3kst s ILE 178 Cb -0.14 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.01 3kst s ILE 178 CO 0.04 -0.14 0.15 0.26 0.00 0.00 0.00 174.94 175.25 3kst s TRP 179 N 3.00 2.66 0.03 3.97 0.52 0.12 -0.59 118.94 128.64 3kst s TRP 179 Ca 0.42 -0.44 0.00 0.00 0.02 0.00 0.00 56.10 56.11 3kst s TRP 179 Cb -0.15 -1.72 -0.02 0.00 -1.15 0.00 0.00 33.47 30.42 3kst s TRP 179 CO 0.07 0.30 -0.04 0.54 0.02 0.00 0.00 176.95 177.84 3kst s VAL 180 N -2.48 0.20 -0.02 4.03 0.11 -0.19 -1.82 120.40 120.23 3kst s VAL 180 Ca 0.39 -1.07 -0.16 0.00 -2.93 0.00 0.00 61.98 58.20 3kst s VAL 180 Cb -0.01 -0.51 0.03 0.00 -1.53 0.00 0.00 36.38 34.36 3kst s VAL 180 CO 0.22 -0.55 0.34 0.00 -3.33 0.00 0.00 175.10 171.78 3kst s ALA 181 N -1.81 -0.87 1.00 1.54 0.00 -0.79 -1.03 121.76 119.80 3kst s ALA 181 Ca -0.12 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.26 3kst s ALA 181 Cb -0.07 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.11 3kst s ALA 181 CO -0.02 -0.27 0.00 0.94 0.00 0.00 0.00 175.76 176.41 3kst n GLN 182 N 1.26 0.83 -3.17 0.00 7.27 -1.26 -1.52 117.38 120.79 3kst n GLN 182 Ca -0.21 0.00 -0.19 0.00 0.07 0.00 0.00 57.00 56.67 3kst n GLN 182 Cb 0.56 0.00 0.01 0.00 2.41 0.00 0.00 30.24 33.22 3kst n GLN 182 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 3kst s THR 184 N -0.09 2.69 0.36 1.69 -4.23 0.20 -0.00 115.64 116.26 3kst s THR 184 Ca 0.00 -1.10 0.04 0.00 -1.18 0.00 0.00 61.69 59.46 3kst s THR 184 Cb 0.00 -2.78 0.22 0.00 1.34 0.00 0.00 72.50 71.28 3kst s THR 184 CO 0.00 0.00 1.97 0.44 -0.54 0.00 0.00 174.62 176.49 3kst h ASP 185 N 0.63 0.58 0.20 3.99 3.32 -1.99 -2.26 116.42 120.89 3kst h ASP 185 Ca -0.38 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.62 3kst h ASP 185 Cb 1.28 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.68 3kst h ASP 185 CO 0.47 0.50 -0.00 -0.90 -1.72 0.00 0.00 179.24 177.58 3kst n ASP 186 N -4.39 0.06 -2.95 6.45 5.68 -1.26 -5.09 116.55 115.05 3kst n ASP 186 Ca 0.04 -0.71 -0.08 0.00 -0.50 0.00 0.00 54.79 53.53 3kst n ASP 186 Cb 0.12 -0.10 0.04 0.00 -1.14 0.00 0.00 41.12 40.04 3kst n ASP 186 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3kst n LEU 187 N -1.06 -5.50 -1.59 -2.12 4.77 -0.85 -5.20 117.00 105.45 3kst n LEU 187 Ca 0.20 -0.42 -0.14 0.00 -0.03 0.00 0.00 56.01 55.62 3kst n LEU 187 Cb 0.17 -2.89 0.01 0.00 -2.33 0.00 0.00 43.42 38.38 3kst n LEU 187 CO 0.20 -0.29 -0.43 -1.20 -1.33 0.00 0.00 177.39 174.34 3kst n SER 189 N -2.52 -2.04 -4.92 -1.43 7.64 -1.26 -4.95 113.62 104.14 3kst n SER 189 Ca -0.04 0.13 -0.30 0.00 1.01 0.00 0.00 58.87 59.68 3kst n SER 189 Cb 0.57 -0.31 -0.04 0.00 -1.01 0.00 0.00 64.21 63.42 3kst n SER 189 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 3kst s ILE 190 N -0.78 5.34 -0.66 0.44 -4.36 -1.26 -0.62 121.20 119.30 3kst s ILE 190 Ca 0.18 -0.48 -0.20 0.00 -0.26 0.00 0.00 60.65 59.88 3kst s ILE 190 Cb -0.11 -3.65 0.10 0.00 1.25 0.00 0.00 42.46 40.05 3kst s ILE 190 CO 0.30 0.08 0.85 -0.54 0.24 0.00 0.00 174.94 175.87 3kst s LYS 191 N -2.71 3.14 0.56 0.37 1.02 1.00 -4.82 119.74 118.30 3kst s LYS 191 Ca 0.35 -1.20 0.23 0.00 0.02 0.00 0.00 55.97 55.36 3kst s LYS 191 Cb -0.12 -4.32 1.54 0.00 -0.52 0.00 0.00 37.83 34.41 3kst s LYS 191 CO 0.28 -1.67 2.19 1.79 -0.92 0.00 0.00 175.35 177.02 3kst h THR 192 N 5.91 0.76 0.00 2.17 1.35 -1.97 -0.81 112.91 120.32 3kst h THR 192 Ca -0.24 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 3kst h THR 192 Cb 1.07 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 3kst h THR 192 CO 1.13 0.00 0.00 1.05 -0.25 0.00 0.00 175.52 177.45 3kst h GLU 193 N 0.00 0.00 -0.15 4.72 9.09 -1.97 -2.46 114.58 123.82 3kst h GLU 193 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.42 3kst h GLU 193 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.14 3kst h GLU 193 CO -0.00 0.00 0.00 0.25 0.05 0.00 0.00 179.01 179.31 3kst n THR 194 N -2.47 0.17 -1.61 -1.06 -2.24 -0.31 -4.98 114.28 101.78 3kst n THR 194 Ca 0.00 -0.45 -0.51 0.00 -2.27 0.00 0.00 64.05 60.82 3kst n THR 194 Cb 0.15 0.81 -0.06 0.00 -2.10 0.00 0.00 70.33 69.14 3kst n THR 194 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3kst n LEU 195 N 0.80 2.00 -3.89 3.22 4.77 -0.93 -4.52 117.00 118.44 3kst n LEU 195 Ca 0.17 1.11 -0.12 0.00 -0.03 0.00 0.00 56.01 57.14 3kst n LEU 195 Cb 0.46 -1.25 -0.14 0.00 -2.33 0.00 0.00 43.42 40.17 3kst n LEU 195 CO 0.15 -0.86 -0.36 0.20 -1.33 0.00 0.00 177.39 175.19 3kst s ASN 196 N 0.64 0.06 -0.13 -1.43 0.01 -0.19 -5.01 114.94 108.88 3kst s ASN 196 Ca 0.83 -0.07 -0.21 0.00 -0.71 0.00 0.00 52.86 52.71 3kst s ASN 196 Cb -0.89 0.01 -0.03 0.00 0.41 0.00 0.00 41.25 40.74 3kst s ASN 196 CO 0.45 -0.04 0.60 -1.58 -1.51 0.00 0.00 177.10 175.02 3kst s GLN 197 N -0.20 4.32 -0.08 -0.60 0.74 -1.26 -1.02 119.66 121.55 3kst s GLN 197 Ca -0.02 0.64 -0.08 0.00 0.05 0.00 0.00 55.36 55.95 3kst s GLN 197 Cb -0.01 -3.49 -0.03 0.00 1.10 0.00 0.00 33.01 30.57 3kst s GLN 197 CO -0.00 -0.02 -0.16 0.00 -0.55 0.00 0.00 175.29 174.56 3kst s ILE 199 N -1.87 -0.05 0.23 0.00 -1.09 -1.03 -4.72 121.20 112.66 3kst s ILE 199 Ca -0.13 0.17 0.09 0.00 -2.23 0.00 0.00 60.65 58.56 3kst s ILE 199 Cb 0.02 -0.18 -0.05 0.00 -1.58 0.00 0.00 42.46 40.67 3kst s ILE 199 CO 0.20 0.07 -0.17 -1.59 -1.23 0.00 0.00 174.94 172.22 3kst s LYS 200 N 1.03 1.44 -0.19 2.79 -2.85 -1.26 -1.38 119.74 119.32 3kst s LYS 200 Ca -0.08 -1.63 -0.29 0.00 -1.00 0.00 0.00 55.97 52.96 3kst s LYS 200 Cb -0.11 -1.37 -0.03 0.00 -2.06 0.00 0.00 37.83 34.27 3kst s LYS 200 CO -0.04 0.24 1.55 0.00 0.10 0.00 0.00 175.35 177.20 3kst s ALA 201 N -2.72 3.40 0.00 0.59 0.00 -1.26 -4.83 121.76 116.93 3kst s ALA 201 Ca 0.24 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.73 3kst s ALA 201 Cb -0.03 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.30 3kst s ALA 201 CO 0.10 -1.73 0.00 0.39 0.00 0.00 0.00 175.76 174.52 3kst n GLU 202 N 7.39 0.29 -2.69 0.00 1.02 -1.26 -4.89 120.64 120.50 3kst n GLU 202 Ca 0.17 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 57.09 3kst n GLU 202 Cb 0.45 -0.61 0.03 0.00 -0.02 0.00 0.00 31.44 31.29 3kst n GLU 202 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3kst s VAL 203 N -1.22 3.07 0.15 2.62 -7.23 -1.26 -4.95 120.40 111.57 3kst s VAL 203 Ca 0.00 -0.56 -0.22 0.00 -1.81 0.00 0.00 61.98 59.39 3kst s VAL 203 Cb 0.00 -3.16 0.03 0.00 0.56 0.00 0.00 36.38 33.81 3kst s VAL 203 CO 0.00 -0.12 1.63 -1.28 -0.31 0.00 0.00 175.10 175.02 3kst h SER 204 N 0.10 -0.76 0.06 4.85 0.87 -2.00 -1.66 113.55 115.01 3kst h SER 204 Ca -0.44 0.14 -0.01 0.00 -1.23 0.00 0.00 61.79 60.26 3kst h SER 204 Cb 1.28 0.36 -0.00 0.00 -0.44 0.00 0.00 62.40 63.60 3kst h SER 204 CO 0.55 -0.27 -0.03 4.11 -0.53 0.00 0.00 176.83 180.65 3kst h TRP 205 N -0.24 0.00 -0.00 2.24 5.08 -1.95 -1.27 115.95 119.80 3kst h TRP 205 Ca 0.14 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.11 3kst h TRP 205 Cb 0.45 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.61 3kst h TRP 205 CO -0.39 0.03 -0.12 0.39 -1.28 0.00 0.00 178.44 177.07 3kst n GLU 206 N -4.03 0.63 -2.38 0.12 1.02 -0.65 -4.18 120.64 111.18 3kst n GLU 206 Ca -0.03 -0.21 -0.17 0.00 -0.02 0.00 0.00 57.16 56.73 3kst n GLU 206 Cb 0.12 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.06 3kst n GLU 206 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3kst n LEU 207 N -1.00 3.68 0.05 -4.62 4.77 -0.48 -4.06 117.00 115.35 3kst n LEU 207 Ca 0.14 -4.29 -0.16 0.00 -0.03 0.00 0.00 56.01 51.67 3kst n LEU 207 Cb 0.28 -0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 41.23 3kst n LEU 207 CO 0.24 1.80 0.17 -0.07 -1.33 0.00 0.00 177.39 178.21 3kst h LEU 208 N 2.44 0.71 -7.16 2.23 3.38 -1.72 -3.46 115.31 111.72 3kst h LEU 208 Ca 0.18 -0.54 -0.11 0.00 0.09 0.00 0.00 57.88 57.50 3kst h LEU 208 Cb 1.32 -0.21 -0.27 0.00 0.09 0.00 0.00 40.66 41.59 3kst h LEU 208 CO 0.60 1.34 -0.34 -1.58 0.09 0.00 0.00 178.44 178.55 3kst s GLN 209 N -3.37 0.35 2.02 1.13 0.74 -1.26 -5.06 119.66 114.21 3kst s GLN 209 Ca -0.08 0.92 0.00 0.00 0.05 0.00 0.00 55.36 56.26 3kst s GLN 209 Cb 0.08 0.17 0.00 0.00 1.10 0.00 0.00 33.01 34.36 3kst s GLN 209 CO 0.89 -0.21 0.00 0.41 -0.55 0.00 0.00 175.29 175.82 3kst n GLY 210 N 4.91 -0.81 2.69 2.59 0.00 -1.26 -2.11 105.19 111.20 3kst n GLY 210 Ca -0.15 -1.10 -0.30 0.00 0.00 0.00 0.00 46.02 44.48 3kst n GLY 210 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3kst s LYS 211 N 0.00 0.88 -0.09 1.61 2.20 -1.26 -4.73 119.74 118.35 3kst s LYS 211 Ca 0.00 -1.43 -0.04 0.00 -0.36 0.00 0.00 55.97 54.14 3kst s LYS 211 Cb 0.00 -2.01 0.05 0.00 -1.51 0.00 0.00 37.83 34.36 3kst s LYS 211 CO 0.00 -1.08 0.20 0.54 -0.36 0.00 0.00 175.35 174.65 3kst s VAL 212 N 1.11 -0.10 -0.08 4.02 0.11 -1.26 -1.26 120.40 122.93 3kst s VAL 212 Ca 0.14 0.20 0.01 0.00 -2.93 0.00 0.00 61.98 59.39 3kst s VAL 212 Cb -0.21 -0.32 0.02 0.00 -1.53 0.00 0.00 36.38 34.34 3kst s VAL 212 CO -0.13 0.08 -0.09 0.00 -3.33 0.00 0.00 175.10 171.63 3kst s ALA 213 N 1.44 1.23 0.10 1.54 0.00 -0.23 -1.75 121.76 124.08 3kst s ALA 213 Ca -0.07 -0.43 -0.05 0.00 0.00 0.00 0.00 51.96 51.41 3kst s ALA 213 Cb -0.11 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.32 3kst s ALA 213 CO -0.07 -0.13 0.25 -0.85 0.00 0.00 0.00 175.76 174.96 3kst n GLU 214 N 4.34 0.29 -3.81 0.00 0.28 0.54 -3.84 120.64 118.44 3kst n GLU 214 Ca -0.18 -0.58 -0.24 0.00 -0.16 0.00 0.00 57.16 56.00 3kst n GLU 214 Cb 0.51 0.74 0.01 0.00 1.43 0.00 0.00 31.44 34.13 3kst n GLU 214 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3kst n GLY 215 N -0.17 -0.32 3.73 -1.84 0.00 -1.26 -0.20 105.19 105.12 3kst n GLY 215 Ca -0.02 0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 3kst n GLY 215 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kst s PRO 216 N -6.22 2.39 -0.08 1.61 0.04 -1.26 -4.16 135.00 127.32 3kst s PRO 216 Ca 0.04 1.93 -0.06 0.00 0.04 0.00 0.00 61.00 62.95 3kst s PRO 216 Cb -0.01 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.71 3kst s PRO 216 CO 0.85 -1.69 0.21 -1.12 0.04 0.00 0.00 177.00 175.29 3kst s SER 217 N -1.66 -0.21 -0.08 6.66 0.01 0.75 -4.67 113.70 114.49 3kst s SER 217 Ca 0.79 0.43 0.05 0.00 1.31 0.00 0.00 55.95 58.52 3kst s SER 217 Cb -0.34 0.38 -0.01 0.00 0.21 0.00 0.00 66.02 66.27 3kst s SER 217 CO 0.42 -0.11 -0.24 -0.22 0.41 0.00 0.00 173.24 173.50 3kst s LEU 218 N 0.54 2.09 0.02 2.44 1.98 -1.26 -0.32 118.68 124.16 3kst s LEU 218 Ca -0.04 -0.53 0.02 0.00 -2.89 0.00 0.00 54.13 50.69 3kst s LEU 218 Cb -0.05 -1.40 -0.01 0.00 0.66 0.00 0.00 46.19 45.39 3kst s LEU 218 CO -0.03 0.20 -0.06 -0.76 -1.89 0.00 0.00 176.35 173.81 3kst s LEU 219 N 0.10 2.11 -0.07 -0.68 1.43 -0.56 -4.98 118.68 116.03 3kst s LEU 219 Ca -0.11 -0.28 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 3kst s LEU 219 Cb -0.16 -0.23 -0.02 0.00 0.03 0.00 0.00 46.19 45.81 3kst s LEU 219 CO 0.06 -0.05 -0.18 -0.75 0.23 0.00 0.00 176.35 175.67 3kst s LYS 220 N -0.73 2.71 -0.16 1.70 2.20 -1.26 -0.33 119.74 123.87 3kst s LYS 220 Ca -0.03 -0.77 -0.08 0.00 -0.36 0.00 0.00 55.97 54.73 3kst s LYS 220 Cb -0.05 -2.36 0.06 0.00 -1.51 0.00 0.00 37.83 33.97 3kst s LYS 220 CO 0.00 0.45 0.38 0.21 -0.36 0.00 0.00 175.35 176.03 3kst s LYS 221 N -0.30 0.34 -1.51 4.03 2.20 -0.54 -4.96 119.74 119.01 3kst s LYS 221 Ca 0.02 0.79 -0.09 0.00 -0.36 0.00 0.00 55.97 56.33 3kst s LYS 221 Cb -0.13 0.02 0.07 0.00 -1.51 0.00 0.00 37.83 36.28 3kst s LYS 221 CO 0.03 -0.18 0.74 0.09 -0.36 0.00 0.00 175.35 175.67 3kst n ASN 222 N 4.52 -2.66 0.00 1.43 3.02 -1.26 -2.14 115.26 118.17 3kst n ASN 222 Ca -0.20 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.45 3kst n ASN 222 Cb 0.54 -3.42 0.00 0.00 -0.61 0.00 0.00 39.78 36.28 3kst n ASN 222 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kst n GLY 223 N -1.68 0.74 3.40 7.41 0.00 -1.26 -5.02 105.19 108.78 3kst n GLY 223 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 3kst n GLY 223 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kst s VAL 224 N -3.00 2.85 -0.25 1.61 1.01 -0.91 -4.74 120.40 116.97 3kst s VAL 224 Ca 0.00 -0.77 -0.11 0.00 0.00 0.00 0.00 61.98 61.10 3kst s VAL 224 Cb 0.00 -2.13 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 3kst s VAL 224 CO 0.00 0.56 0.18 -0.31 0.00 0.00 0.00 175.10 175.54 3kst s TYR 225 N -0.25 3.30 -0.25 5.22 1.51 0.20 -1.47 117.35 125.60 3kst s TYR 225 Ca 0.01 0.22 -0.06 0.00 -1.01 0.00 0.00 57.07 56.23 3kst s TYR 225 Cb -0.13 -2.31 -0.02 0.00 -0.11 0.00 0.00 41.96 39.39 3kst s TYR 225 CO 0.03 0.01 0.04 0.71 -1.11 0.00 0.00 175.55 175.23 3kst s TYR 226 N 1.24 3.06 -0.39 2.71 1.51 0.55 -1.15 117.35 124.89 3kst s TYR 226 Ca 0.08 -0.67 -0.11 0.00 -1.01 0.00 0.00 57.07 55.36 3kst s TYR 226 Cb -0.14 -2.21 0.04 0.00 -0.11 0.00 0.00 41.96 39.54 3kst s TYR 226 CO 0.06 -0.45 0.23 -1.17 -1.11 0.00 0.00 175.55 173.10 3kst s LEU 227 N 1.56 4.84 -0.23 -1.29 2.96 0.94 -1.49 118.68 125.96 3kst s LEU 227 Ca 0.05 -1.08 -0.09 0.00 -0.22 0.00 0.00 54.13 52.80 3kst s LEU 227 Cb -0.15 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 3kst s LEU 227 CO 0.02 -0.42 0.11 -0.63 -1.32 0.00 0.00 176.35 174.11 3kst s ILE 228 N 1.54 4.93 0.17 6.68 1.01 0.56 -0.78 121.20 135.31 3kst s ILE 228 Ca 0.02 0.03 -0.02 0.00 0.00 0.00 0.00 60.65 60.68 3kst s ILE 228 Cb -0.20 -3.29 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 3kst s ILE 228 CO 0.06 0.36 0.13 -0.72 0.00 0.00 0.00 174.94 174.77 3kst s TYR 229 N 1.09 0.90 0.05 3.97 1.13 0.35 -0.18 117.35 124.67 3kst s TYR 229 Ca 0.06 -1.22 0.05 0.00 -1.41 0.00 0.00 57.07 54.55 3kst s TYR 229 Cb -0.14 -0.44 -0.04 0.00 -1.10 0.00 0.00 41.96 40.25 3kst s TYR 229 CO 0.04 -0.61 -0.07 -1.12 -2.51 0.00 0.00 175.55 171.29 3kst s SER 230 N -3.08 4.62 0.13 -0.18 0.01 0.72 -0.38 113.70 115.55 3kst s SER 230 Ca 0.29 -0.22 0.06 0.00 1.31 0.00 0.00 55.95 57.39 3kst s SER 230 Cb 0.06 -1.02 -0.04 0.00 0.21 0.00 0.00 66.02 65.23 3kst s SER 230 CO 0.06 0.23 -0.15 0.00 0.41 0.00 0.00 173.24 173.79 3kst s ALA 231 N -1.12 1.61 0.00 1.44 0.00 -0.39 -0.34 121.76 122.97 3kst s ALA 231 Ca 0.20 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3kst s ALA 231 Cb -0.11 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.91 3kst s ALA 231 CO 0.11 0.13 0.00 0.09 0.00 0.00 0.00 175.76 176.09 3kst n ASN 232 N 0.47 0.00 -4.69 0.00 3.02 -0.72 -2.68 115.26 110.65 3kst n ASN 232 Ca -0.15 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 53.96 3kst n ASN 232 Cb 0.57 0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 39.98 3kst n ASN 232 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 3kst n HIS 233 N -0.40 2.39 0.09 3.10 -0.00 -0.89 -4.82 115.22 114.69 3kst n HIS 233 Ca 0.00 0.35 0.18 0.00 0.46 0.00 0.00 57.72 58.71 3kst n HIS 233 Cb 0.00 -2.51 0.72 0.00 -0.12 0.00 0.00 29.99 28.08 3kst n HIS 233 CO 0.00 0.00 0.00 0.10 0.46 0.00 0.00 176.34 176.90 3kst h TYR 234 N 4.61 0.00 0.00 1.57 -0.00 -1.93 -1.05 116.97 120.17 3kst h TYR 234 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.28 3kst h TYR 234 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.99 3kst h TYR 234 CO 0.58 0.00 0.00 0.93 -0.00 0.00 0.00 178.16 179.67 3kst h GLU 235 N 0.00 0.00 -6.75 0.10 5.08 -1.96 -3.45 114.58 107.61 3kst h GLU 235 Ca 0.18 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 58.03 3kst h GLU 235 Cb 0.79 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.05 3kst h GLU 235 CO -0.00 0.00 0.46 1.21 -1.00 0.00 0.00 179.01 179.68 3kst s ASN 236 N -5.10 7.31 0.62 1.42 3.84 -0.40 -4.93 114.94 117.71 3kst s ASN 236 Ca -0.00 2.17 0.36 0.00 0.21 0.00 0.00 52.86 55.59 3kst s ASN 236 Cb 0.10 -2.62 2.06 0.00 -0.55 0.00 0.00 41.25 40.24 3kst s ASN 236 CO 0.44 -0.14 2.30 0.11 -2.79 0.00 0.00 177.10 177.03 3kst h LYS 237 N 4.33 0.00 -0.33 0.43 1.57 -1.89 -1.77 116.57 118.91 3kst h LYS 237 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3kst h LYS 237 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 3kst h LYS 237 CO 0.69 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.98 3kst n GLY 238 N -1.20 0.53 3.59 3.86 0.00 -1.26 -1.19 105.19 109.52 3kst n GLY 238 Ca -0.03 -0.35 -0.49 0.00 0.00 0.00 0.00 46.02 45.15 3kst n GLY 238 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3kst n TYR 239 N 0.43 1.44 -3.78 1.61 9.36 -0.66 -4.88 117.16 120.67 3kst n TYR 239 Ca 0.11 0.64 -0.09 0.00 3.32 0.00 0.00 57.90 61.87 3kst n TYR 239 Cb 0.28 -2.31 -0.04 0.00 -0.63 0.00 0.00 39.34 36.64 3kst n TYR 239 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 3kst s GLY 240 N 0.15 -0.03 -0.09 2.98 0.00 -1.09 -3.29 107.32 105.95 3kst s GLY 240 Ca 0.75 -0.30 -0.01 0.00 0.00 0.00 0.00 44.72 45.17 3kst s GLY 240 CO 0.50 -0.28 -0.05 0.14 0.00 0.00 0.00 173.10 173.42 3kst s VAL 241 N -3.89 3.88 0.32 1.40 1.01 0.43 -1.26 120.40 122.28 3kst s VAL 241 Ca 0.11 -0.40 0.05 0.00 0.00 0.00 0.00 61.98 61.73 3kst s VAL 241 Cb -0.02 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 3kst s VAL 241 CO -0.00 0.58 0.30 -0.83 0.00 0.00 0.00 175.10 175.14 3kst s GLY 242 N -0.57 2.07 0.19 4.51 0.00 0.49 0.44 107.32 114.45 3kst s GLY 242 Ca 0.09 -1.93 -0.00 0.00 0.00 0.00 0.00 44.72 42.88 3kst s GLY 242 CO 0.02 -1.38 0.09 -2.52 0.00 0.00 0.00 173.10 169.32 3kst s TYR 243 N -3.46 1.16 0.02 1.90 1.13 -1.26 -0.49 117.35 116.34 3kst s TYR 243 Ca 0.39 -1.28 -0.03 0.00 -1.41 0.00 0.00 57.07 54.74 3kst s TYR 243 Cb 0.02 -0.62 -0.01 0.00 -1.10 0.00 0.00 41.96 40.26 3kst s TYR 243 CO 0.24 -0.52 0.05 0.00 -2.51 0.00 0.00 175.55 172.82 3kst s ALA 244 N -4.01 -0.04 0.31 9.51 0.00 0.04 -1.77 121.76 125.80 3kst s ALA 244 Ca 0.34 -0.47 0.11 0.00 0.00 0.00 0.00 51.96 51.94 3kst s ALA 244 Cb 0.07 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 3kst s ALA 244 CO 0.09 -0.22 -0.13 0.95 0.00 0.00 0.00 175.76 176.46 3kst s THR 245 N -1.78 2.50 0.01 0.00 -4.23 -0.22 -0.04 115.64 111.88 3kst s THR 245 Ca -0.12 -2.25 -0.28 0.00 -1.18 0.00 0.00 61.69 57.85 3kst s THR 245 Cb -0.07 -2.52 0.08 0.00 1.34 0.00 0.00 72.50 71.33 3kst s THR 245 CO -0.01 -0.31 0.69 -0.55 -0.54 0.00 0.00 174.62 173.90 3kst s SER 246 N -3.58 -0.59 0.00 3.99 0.15 -0.30 -1.61 113.70 111.76 3kst s SER 246 Ca 0.31 0.41 0.28 0.00 0.70 0.00 0.00 55.95 57.65 3kst s SER 246 Cb -0.02 0.53 1.09 0.00 -1.71 0.00 0.00 66.02 65.92 3kst s SER 246 CO 0.16 -0.71 1.80 0.47 1.20 0.00 0.00 173.24 176.16 3kst n ASP 247 N 0.39 0.28 -4.28 5.45 8.00 -1.26 -0.63 116.55 124.50 3kst n ASP 247 Ca -0.17 -0.10 -0.18 0.00 0.71 0.00 0.00 54.79 55.05 3kst n ASP 247 Cb 0.60 -0.16 -0.11 0.00 -0.02 0.00 0.00 41.12 41.43 3kst n ASP 247 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3kst s THR 248 N -2.78 1.45 0.00 -3.53 -4.23 -1.26 -4.85 115.64 100.43 3kst s THR 248 Ca 0.20 -1.90 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 3kst s THR 248 Cb 0.19 -1.73 0.00 0.00 1.34 0.00 0.00 72.50 72.30 3kst s THR 248 CO 0.54 -0.50 0.39 -2.65 -0.54 0.00 0.00 174.62 171.87 3kst n PRO 249 N 0.19 0.27 -0.91 3.99 -0.02 -1.26 -4.79 135.00 132.47 3kst n PRO 249 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 3kst n PRO 249 Cb 0.58 -1.37 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 3kst n PRO 249 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kst n GLY 251 N 1.31 2.47 3.76 -1.23 0.00 -1.26 -5.04 105.19 105.20 3kst n GLY 251 Ca 0.00 -2.12 -0.31 0.00 0.00 0.00 0.00 46.02 43.59 3kst n GLY 251 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kst s PRO 252 N -0.93 2.16 -0.10 1.61 0.04 -1.26 -4.75 135.00 131.77 3kst s PRO 252 Ca 0.00 1.22 0.01 0.00 0.04 0.00 0.00 61.00 62.27 3kst s PRO 252 Cb 0.00 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 3kst s PRO 252 CO 0.00 -1.72 -0.13 -1.58 0.04 0.00 0.00 177.00 173.61 3kst s TRP 253 N -2.85 2.79 -0.22 0.56 0.52 -1.26 -4.47 118.94 114.01 3kst s TRP 253 Ca 0.62 -0.40 -0.04 0.00 0.02 0.00 0.00 56.10 56.30 3kst s TRP 253 Cb -0.18 -1.76 -0.01 0.00 -1.15 0.00 0.00 33.47 30.37 3kst s TRP 253 CO 0.55 -0.02 -0.05 0.08 0.02 0.00 0.00 176.95 177.54 3kst s VAL 254 N -0.13 3.36 0.25 4.03 1.01 -0.63 -4.93 120.40 123.36 3kst s VAL 254 Ca -0.01 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 3kst s VAL 254 Cb -0.14 -2.52 -0.09 0.00 0.00 0.00 0.00 36.38 33.63 3kst s VAL 254 CO 0.03 0.43 1.06 -0.54 0.00 0.00 0.00 175.10 176.08 3kst s LYS 255 N 1.42 4.69 0.19 2.72 1.02 -1.26 -1.06 119.74 127.47 3kst s LYS 255 Ca 0.05 1.71 -0.33 0.00 0.02 0.00 0.00 55.97 57.42 3kst s LYS 255 Cb -0.14 -3.23 -0.13 0.00 -0.52 0.00 0.00 37.83 33.81 3kst s LYS 255 CO -0.03 0.27 1.56 0.98 -0.92 0.00 0.00 175.35 177.21 3kst n TYR 256 N 1.44 2.35 0.23 3.18 9.36 -0.73 -4.90 117.16 128.08 3kst n TYR 256 Ca -0.01 0.28 0.08 0.00 3.32 0.00 0.00 57.90 61.57 3kst n TYR 256 Cb 0.46 -2.54 0.55 0.00 -0.63 0.00 0.00 39.34 37.17 3kst n TYR 256 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 3kst h SER 257 N 5.57 0.00 -0.63 2.98 4.64 -1.94 -2.80 113.55 121.37 3kst h SER 257 Ca -0.45 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.80 3kst h SER 257 Cb 1.25 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.30 3kst h SER 257 CO 0.86 0.22 0.09 0.29 -0.87 0.00 0.00 176.83 177.42 3kst n LYS 258 N -3.84 4.56 -1.75 4.77 4.76 -1.26 -4.98 118.16 120.42 3kst n LYS 258 Ca -0.02 -3.14 -0.36 0.00 -2.87 0.00 0.00 58.31 51.92 3kst n LYS 258 Cb 0.32 -2.26 0.07 0.00 -1.84 0.00 0.00 35.03 31.31 3kst n LYS 258 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3kst s ASN 259 N -0.84 4.65 0.45 4.39 0.01 -1.06 -4.50 114.94 118.04 3kst s ASN 259 Ca 0.55 2.55 -0.13 0.00 -0.71 0.00 0.00 52.86 55.13 3kst s ASN 259 Cb 0.43 -2.61 -0.07 0.00 0.41 0.00 0.00 41.25 39.40 3kst s ASN 259 CO 0.15 -1.97 0.85 -2.16 -1.51 0.00 0.00 177.10 172.47 3kst s PRO 260 N -3.43 3.84 0.20 -0.60 0.04 -1.26 -5.01 135.00 128.78 3kst s PRO 260 Ca 0.81 0.65 0.08 0.00 0.04 0.00 0.00 61.00 62.58 3kst s PRO 260 Cb -0.35 -2.29 0.10 0.00 0.04 0.00 0.00 34.50 32.00 3kst s PRO 260 CO 0.39 -0.13 1.46 -0.07 0.04 0.00 0.00 177.00 178.69 3kst h LEU 261 N 1.10 0.06 -7.10 -3.56 4.07 -0.24 -3.45 115.31 106.18 3kst h LEU 261 Ca -0.47 -0.05 -0.12 0.00 0.08 0.00 0.00 57.88 57.33 3kst h LEU 261 Cb 1.19 -0.02 -0.28 0.00 1.08 0.00 0.00 40.66 42.62 3kst h LEU 261 CO 0.63 0.82 -0.40 -0.22 -1.08 0.00 0.00 178.44 178.19 3kst s LEU 262 N -7.31 -0.59 -0.45 1.67 2.96 -1.09 -4.57 118.68 109.30 3kst s LEU 262 Ca -0.01 0.89 0.07 0.00 -0.22 0.00 0.00 54.13 54.85 3kst s LEU 262 Cb 0.11 1.23 0.23 0.00 0.50 0.00 0.00 46.19 48.26 3kst s LEU 262 CO 0.79 -0.24 0.69 1.67 -1.32 0.00 0.00 176.35 177.95 3kst n GLN 263 N 5.38 0.65 0.00 1.98 7.27 -1.26 -0.43 117.38 130.98 3kst n GLN 263 Ca -0.08 -2.40 0.00 0.00 0.07 0.00 0.00 57.00 54.59 3kst n GLN 263 Cb 0.49 -1.41 0.00 0.00 2.41 0.00 0.00 30.24 31.73 3kst n GLN 263 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3kst n GLY 264 N 1.90 -0.72 3.65 1.69 0.00 -1.26 -4.99 105.19 105.46 3kst n GLY 264 Ca 0.16 -1.26 -0.39 0.00 0.00 0.00 0.00 46.02 44.54 3kst n GLY 264 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kst s ASP 265 N -0.76 6.41 0.05 1.61 2.15 -0.68 -4.98 116.67 120.47 3kst s ASP 265 Ca 0.00 0.49 -0.22 0.00 0.43 0.00 0.00 52.55 53.25 3kst s ASP 265 Cb 0.00 -2.24 -0.14 0.00 -0.30 0.00 0.00 42.92 40.24 3kst s ASP 265 CO 0.00 -0.14 1.49 0.00 -0.17 0.00 0.00 175.17 176.35 3kst h ALA 266 N 7.65 0.15 -0.65 3.66 0.00 -1.94 0.62 119.26 128.75 3kst h ALA 266 Ca -0.34 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 3kst h ALA 266 Cb 1.16 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 3kst h ALA 266 CO 0.70 -0.18 0.40 0.00 0.00 0.00 0.00 179.25 180.18 3kst h ALA 267 N 0.76 0.82 0.00 0.00 0.00 -1.98 -3.10 119.26 115.76 3kst h ALA 267 Ca 0.03 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3kst h ALA 267 Cb 0.33 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3kst h ALA 267 CO 0.00 0.29 -1.12 1.79 0.00 0.00 0.00 179.25 180.22 3kst h THR 268 N 0.88 0.23 -0.25 0.00 1.35 -2.01 -3.48 112.91 109.63 3kst h THR 268 Ca 0.23 -1.45 -0.11 0.00 -0.55 0.00 0.00 66.41 64.54 3kst h THR 268 Cb -0.05 1.77 -0.04 0.00 -1.73 0.00 0.00 68.15 68.10 3kst h THR 268 CO -0.05 0.13 -0.10 0.61 -0.25 0.00 0.00 175.52 175.87 3kst n GLY 269 N 1.27 0.79 3.75 5.82 0.00 0.20 -5.00 105.19 112.01 3kst n GLY 269 Ca -0.04 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 3kst n GLY 269 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kst s LEU 270 N -1.20 4.44 0.35 0.99 1.43 -1.14 -4.81 118.68 118.75 3kst s LEU 270 Ca 0.00 2.48 0.04 0.00 -1.03 0.00 0.00 54.13 55.62 3kst s LEU 270 Cb 0.00 -3.63 -0.06 0.00 0.03 0.00 0.00 46.19 42.54 3kst s LEU 270 CO 0.00 -0.47 0.06 0.68 0.23 0.00 0.00 176.35 176.85 3kst s VAL 271 N -0.49 1.14 -1.38 -1.59 -7.23 -1.26 -1.69 120.40 107.90 3kst s VAL 271 Ca 0.52 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.64 3kst s VAL 271 Cb -0.37 -2.70 0.01 0.00 0.56 0.00 0.00 36.38 33.87 3kst s VAL 271 CO 0.43 0.00 0.68 0.61 -0.31 0.00 0.00 175.10 176.51 3kst n GLY 272 N -0.77 -0.42 3.61 2.32 0.00 -0.33 -0.92 105.19 108.68 3kst n GLY 272 Ca -0.04 0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 3kst n GLY 272 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kst s THR 273 N -3.17 4.35 0.00 2.61 -4.23 -1.21 -3.94 115.64 110.06 3kst s THR 273 Ca 0.34 1.41 0.00 0.00 -1.18 0.00 0.00 61.69 62.26 3kst s THR 273 Cb -0.15 -4.52 0.00 0.00 1.34 0.00 0.00 72.50 69.18 3kst s THR 273 CO 0.42 -0.78 0.00 0.61 -0.54 0.00 0.00 174.62 174.33 3kst n GLY 274 N 4.45 0.67 3.62 3.99 0.00 -0.81 -3.25 105.19 113.86 3kst n GLY 274 Ca 0.12 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 45.04 3kst n GLY 274 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3kst n HIS 275 N 0.00 -2.42 -3.58 1.61 -0.00 -1.26 -1.93 115.22 107.64 3kst n HIS 275 Ca 0.00 1.01 0.00 0.00 -0.00 0.00 0.00 57.72 58.73 3kst n HIS 275 Cb 0.00 -2.29 0.00 0.00 -0.00 0.00 0.00 29.99 27.70 3kst n HIS 275 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3kst n GLY 276 N -0.86 5.28 3.47 1.57 0.00 -1.26 -3.10 105.19 110.28 3kst n GLY 276 Ca -0.19 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.56 3kst n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kst s ALA 277 N -2.00 -1.42 0.33 4.61 0.00 -0.37 -4.84 121.76 118.07 3kst s ALA 277 Ca 0.00 1.69 -0.17 0.00 0.00 0.00 0.00 51.96 53.48 3kst s ALA 277 Cb 0.00 -0.99 -0.09 0.00 0.00 0.00 0.00 23.12 22.04 3kst s ALA 277 CO 0.00 -0.28 0.79 -1.25 0.00 0.00 0.00 175.76 175.02 3kst s PRO 278 N 0.57 4.10 -0.02 0.00 0.05 -1.26 -1.33 135.00 137.11 3kst s PRO 278 Ca -0.02 0.81 -0.25 0.00 0.05 0.00 0.00 61.00 61.59 3kst s PRO 278 Cb -0.05 -2.44 0.05 0.00 0.05 0.00 0.00 34.50 32.12 3kst s PRO 278 CO -0.03 0.15 0.54 -0.59 0.05 0.00 0.00 177.00 177.12 3kst s PHE 279 N -1.96 -0.48 0.30 0.56 -0.71 -0.22 -4.92 117.98 110.55 3kst s PHE 279 Ca 0.54 0.74 -0.10 0.00 -1.04 0.00 0.00 56.93 57.08 3kst s PHE 279 Cb -0.11 0.31 -0.07 0.00 -1.21 0.00 0.00 43.02 41.94 3kst s PHE 279 CO 0.17 -0.56 0.64 -1.14 -1.34 0.00 0.00 175.22 173.00 3kst s GLN 280 N -1.52 3.81 0.44 1.99 0.74 -1.26 -1.19 119.66 122.67 3kst s GLN 280 Ca -0.10 0.37 0.07 0.00 0.05 0.00 0.00 55.36 55.74 3kst s GLN 280 Cb -0.02 -2.54 -0.02 0.00 1.10 0.00 0.00 33.01 31.54 3kst s GLN 280 CO 0.06 0.18 0.31 0.00 -0.55 0.00 0.00 175.29 175.29 3kst h LYS 282 N 1.13 0.46 -0.00 0.00 1.57 -1.98 -0.98 116.57 116.77 3kst h LYS 282 Ca -0.41 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3kst h LYS 282 Cb 1.27 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3kst h LYS 282 CO 0.62 0.30 -0.07 -0.40 -0.57 0.00 0.00 179.45 179.33 3kst n ASP 283 N -4.98 0.34 0.00 0.86 5.75 -1.26 -4.94 116.55 112.31 3kst n ASP 283 Ca 0.23 -0.54 0.00 0.00 -0.01 0.00 0.00 54.79 54.47 3kst n ASP 283 Cb 0.66 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 3kst n ASP 283 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3kst n GLY 284 N 1.25 0.68 3.97 6.12 0.00 -0.37 -5.08 105.19 111.75 3kst n GLY 284 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 3kst n GLY 284 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kst s SER 285 N -2.82 4.82 0.22 1.61 1.04 -1.26 -4.79 113.70 112.53 3kst s SER 285 Ca 0.00 0.02 0.11 0.00 0.48 0.00 0.00 55.95 56.56 3kst s SER 285 Cb 0.00 -0.68 -0.05 0.00 0.10 0.00 0.00 66.02 65.40 3kst s SER 285 CO 0.00 -1.51 -0.21 0.26 0.98 0.00 0.00 173.24 172.76 3kst s TRP 286 N -3.03 2.34 0.09 5.02 0.52 -1.25 -0.69 118.94 121.94 3kst s TRP 286 Ca 0.61 -0.33 0.00 0.00 0.02 0.00 0.00 56.10 56.40 3kst s TRP 286 Cb -0.09 -1.11 -0.04 0.00 -1.15 0.00 0.00 33.47 31.08 3kst s TRP 286 CO 0.42 0.57 -0.02 0.15 0.02 0.00 0.00 176.95 178.10 3kst s LYS 287 N -2.98 0.80 -0.17 4.98 -0.14 -0.33 -1.66 119.74 120.24 3kst s LYS 287 Ca 0.24 -1.33 -0.01 0.00 -1.36 0.00 0.00 55.97 53.51 3kst s LYS 287 Cb -0.07 0.05 0.04 0.00 -1.68 0.00 0.00 37.83 36.17 3kst s LYS 287 CO 0.12 -0.12 -0.05 -0.47 -0.76 0.00 0.00 175.35 174.08 3kst s TYR 288 N -3.83 1.71 0.11 3.18 5.04 0.05 -1.06 117.35 122.55 3kst s TYR 288 Ca 0.14 -1.11 -0.16 0.00 -2.44 0.00 0.00 57.07 53.49 3kst s TYR 288 Cb 0.07 -1.32 -0.07 0.00 0.35 0.00 0.00 41.96 41.00 3kst s TYR 288 CO -0.04 -0.62 0.55 -1.50 -1.34 0.00 0.00 175.55 172.59 3kst s ILE 289 N 1.63 4.82 0.18 3.14 2.07 -0.44 -1.86 121.20 130.74 3kst s ILE 289 Ca 0.00 0.99 -0.20 0.00 -1.41 0.00 0.00 60.65 60.04 3kst s ILE 289 Cb -0.16 -3.80 0.05 0.00 0.13 0.00 0.00 42.46 38.68 3kst s ILE 289 CO -0.08 0.39 0.56 0.72 -1.91 0.00 0.00 174.94 174.63 3kst s PHE 290 N -1.30 -0.32 0.41 3.50 -0.71 -0.20 -1.24 117.98 118.14 3kst s PHE 290 Ca 0.33 0.02 0.08 0.00 -1.04 0.00 0.00 56.93 56.32 3kst s PHE 290 Cb -0.17 0.49 0.01 0.00 -1.21 0.00 0.00 43.02 42.13 3kst s PHE 290 CO 0.19 -0.90 0.56 -3.38 -1.34 0.00 0.00 175.22 170.35 3kst s HIS 291 N -3.82 2.85 0.14 3.49 -3.43 -0.81 0.02 115.29 113.73 3kst s HIS 291 Ca 0.05 -0.37 -0.13 0.00 -0.80 0.00 0.00 55.06 53.81 3kst s HIS 291 Cb -0.01 -2.35 0.01 0.00 -1.43 0.00 0.00 32.58 28.81 3kst s HIS 291 CO -0.07 -0.38 0.35 0.00 -2.00 0.00 0.00 174.74 172.64 3kst s ALA 292 N -2.34 -0.54 0.82 -1.38 0.00 -0.44 -1.92 121.76 115.96 3kst s ALA 292 Ca 0.54 -0.43 -0.13 0.00 0.00 0.00 0.00 51.96 51.94 3kst s ALA 292 Cb -0.10 0.73 0.07 0.00 0.00 0.00 0.00 23.12 23.82 3kst s ALA 292 CO 0.33 -0.65 1.06 0.72 0.00 0.00 0.00 175.76 177.21 3kst n HIS 293 N -0.21 0.78 -0.33 0.00 8.25 -0.10 -2.63 115.22 120.97 3kst n HIS 293 Ca -0.12 0.38 0.10 0.00 -0.26 0.00 0.00 57.72 57.83 3kst n HIS 293 Cb 0.63 -2.05 0.28 0.00 1.12 0.00 0.00 29.99 29.97 3kst n HIS 293 CO 0.00 0.00 0.00 2.35 0.64 0.00 0.00 176.34 179.33 3kst h TRP 294 N -0.99 0.95 -2.40 4.41 2.91 -0.95 -3.44 115.95 116.44 3kst h TRP 294 Ca -0.46 0.03 0.21 0.00 1.13 0.00 0.00 58.89 59.81 3kst h TRP 294 Cb 1.30 -0.28 -0.05 0.00 -0.51 0.00 0.00 29.16 29.63 3kst h TRP 294 CO 0.45 0.22 0.67 -1.54 -1.03 0.00 0.00 178.44 177.20 3kst s SER 295 N -5.43 -0.00 0.52 2.65 1.04 -0.84 -4.99 113.70 106.64 3kst s SER 295 Ca -0.12 -0.54 0.20 0.00 0.48 0.00 0.00 55.95 55.98 3kst s SER 295 Cb 0.24 0.40 1.37 0.00 0.10 0.00 0.00 66.02 68.13 3kst s SER 295 CO 0.79 -0.80 2.13 0.00 0.98 0.00 0.00 173.24 176.34 3kst h ALA 296 N 2.00 1.72 0.02 5.32 0.00 -1.90 -3.17 119.26 123.25 3kst h ALA 296 Ca -0.26 -0.05 -0.27 0.00 0.00 0.00 0.00 54.91 54.33 3kst h ALA 296 Cb 1.21 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 3kst h ALA 296 CO 0.34 0.08 -1.45 0.00 0.00 0.00 0.00 179.25 178.22 3kst h ALA 297 N 1.94 0.56 -3.60 0.00 0.00 -2.00 -3.47 119.26 112.69 3kst h ALA 297 Ca -0.00 -1.23 -0.39 0.00 0.00 0.00 0.00 54.91 53.29 3kst h ALA 297 Cb 0.12 0.24 -0.32 0.00 0.00 0.00 0.00 17.79 17.83 3kst h ALA 297 CO 0.01 1.41 -0.77 -2.00 0.00 0.00 0.00 179.25 177.90 3kst s GLU 298 N -2.64 0.72 -0.08 0.00 2.56 -1.20 -5.05 118.70 113.02 3kst s GLU 298 Ca -0.04 -0.13 -0.27 0.00 0.00 0.00 0.00 54.97 54.53 3kst s GLU 298 Cb 0.09 -0.73 -0.23 0.00 2.00 0.00 0.00 34.13 35.26 3kst s GLU 298 CO 0.83 -0.02 1.03 0.82 -0.56 0.00 0.00 175.26 177.36 3kst h ILE 299 N 5.85 1.58 -3.29 -3.70 2.04 -1.92 -2.20 117.51 115.87 3kst h ILE 299 Ca -0.36 -1.71 -0.56 0.00 1.00 0.00 0.00 64.86 63.22 3kst h ILE 299 Cb 1.16 2.75 -0.04 0.00 -0.74 0.00 0.00 36.82 39.95 3kst h ILE 299 CO 0.48 0.44 0.00 -1.10 0.00 0.00 0.00 178.15 177.98 3kst s GLN 300 N -3.30 4.26 0.04 2.37 -0.21 -1.26 -1.08 119.66 120.48 3kst s GLN 300 Ca -0.17 0.80 -0.19 0.00 0.02 0.00 0.00 55.36 55.82 3kst s GLN 300 Cb -0.01 -3.23 -0.06 0.00 1.00 0.00 0.00 33.01 30.71 3kst s GLN 300 CO 0.68 0.62 0.56 -1.25 -2.12 0.00 0.00 175.29 173.79 3kst s PRO 301 N -1.15 4.22 0.53 2.91 0.04 -1.26 -4.77 135.00 135.51 3kst s PRO 301 Ca 0.30 0.71 -0.21 0.00 0.04 0.00 0.00 61.00 61.84 3kst s PRO 301 Cb -0.20 -3.27 -0.05 0.00 0.04 0.00 0.00 34.50 31.02 3kst s PRO 301 CO 0.20 0.56 1.24 1.03 0.04 0.00 0.00 177.00 180.08 3kst s ARG 302 N -0.83 3.33 0.15 4.56 0.52 -1.20 -3.55 118.95 121.93 3kst s ARG 302 Ca 0.29 1.94 0.01 0.00 -0.52 0.00 0.00 55.73 57.46 3kst s ARG 302 Cb -0.19 -2.22 -0.04 0.00 0.52 0.00 0.00 34.95 33.01 3kst s ARG 302 CO 0.18 -0.95 -0.00 0.95 0.02 0.00 0.00 175.30 175.50 3kst s THR 303 N -1.48 0.60 0.16 0.02 -4.23 -1.08 -3.77 115.64 105.87 3kst s THR 303 Ca 0.70 -1.96 0.07 0.00 -1.18 0.00 0.00 61.69 59.32 3kst s THR 303 Cb -0.33 -2.04 -0.04 0.00 1.34 0.00 0.00 72.50 71.43 3kst s THR 303 CO 0.39 -0.54 -0.02 -0.44 -0.54 0.00 0.00 174.62 173.46 3kst s SER 304 N -3.13 4.70 0.11 3.99 0.01 -0.23 -1.33 113.70 117.82 3kst s SER 304 Ca 0.22 -0.40 -0.03 0.00 1.31 0.00 0.00 55.95 57.05 3kst s SER 304 Cb 0.06 -0.98 -0.03 0.00 0.21 0.00 0.00 66.02 65.28 3kst s SER 304 CO 0.02 0.10 0.09 -0.31 0.41 0.00 0.00 173.24 173.56 3kst s TYR 305 N -1.65 0.61 -0.04 2.43 2.02 0.10 -4.26 117.35 116.57 3kst s TYR 305 Ca 0.26 -1.03 0.02 0.00 -0.37 0.00 0.00 57.07 55.96 3kst s TYR 305 Cb -0.10 -0.33 0.01 0.00 -0.40 0.00 0.00 41.96 41.14 3kst s TYR 305 CO 0.18 -0.53 -0.10 0.42 -1.57 0.00 0.00 175.55 173.95 3kst s ILE 306 N -3.98 0.89 0.41 2.71 1.01 -1.00 -1.03 121.20 120.21 3kst s ILE 306 Ca 0.16 -0.38 0.04 0.00 0.00 0.00 0.00 60.65 60.47 3kst s ILE 306 Cb 0.06 -0.81 -0.04 0.00 0.01 0.00 0.00 42.46 41.68 3kst s ILE 306 CO -0.03 0.29 0.05 -0.54 0.00 0.00 0.00 174.94 174.71 3kst s LYS 307 N 0.43 1.92 0.54 2.79 1.02 -0.78 -0.71 119.74 124.96 3kst s LYS 307 Ca -0.08 -2.14 -0.16 0.00 0.02 0.00 0.00 55.97 53.61 3kst s LYS 307 Cb -0.12 -1.13 -0.07 0.00 -0.52 0.00 0.00 37.83 36.00 3kst s LYS 307 CO 0.01 -0.27 1.00 -0.51 -0.92 0.00 0.00 175.35 174.67 3kst s ASP 308 N -3.66 6.41 -0.00 2.83 1.01 0.20 -0.77 116.67 122.68 3kst s ASP 308 Ca 0.25 1.61 -0.00 0.00 0.71 0.00 0.00 52.55 55.12 3kst s ASP 308 Cb 0.06 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 41.48 3kst s ASP 308 CO 0.13 -0.74 0.00 0.12 0.21 0.00 0.00 175.17 174.89 3kst s PHE 309 N -2.65 0.00 0.01 4.23 5.36 -0.66 -1.69 117.98 122.59 3kst s PHE 309 Ca 0.59 0.02 -0.28 0.00 -0.96 0.00 0.00 56.93 56.30 3kst s PHE 309 Cb -0.11 -0.03 0.08 0.00 -0.34 0.00 0.00 43.02 42.62 3kst s PHE 309 CO 0.35 -0.01 0.70 0.00 -1.46 0.00 0.00 175.22 174.80 3kst s ALA 310 N 0.14 -1.73 -0.22 11.12 0.00 -0.70 -3.90 121.76 126.46 3kst s ALA 310 Ca -0.01 1.05 0.01 0.00 0.00 0.00 0.00 51.96 53.01 3kst s ALA 310 Cb -0.02 0.26 0.03 0.00 0.00 0.00 0.00 23.12 23.39 3kst s ALA 310 CO -0.00 -0.52 -0.14 0.42 0.00 0.00 0.00 175.76 175.51 3kst s ILE 311 N -2.18 2.25 1.06 0.00 1.01 -1.26 -0.80 121.20 121.28 3kst s ILE 311 Ca -0.05 -1.18 -0.14 0.00 0.00 0.00 0.00 60.65 59.28 3kst s ILE 311 Cb -0.00 -2.11 0.22 0.00 0.01 0.00 0.00 42.46 40.58 3kst s ILE 311 CO 0.00 0.29 1.09 -0.94 0.00 0.00 0.00 174.94 175.38 3kst s SER 312 N 1.23 2.04 0.49 3.58 1.04 -0.42 -4.88 113.70 116.80 3kst s SER 312 Ca -0.00 1.09 0.22 0.00 0.48 0.00 0.00 55.95 57.73 3kst s SER 312 Cb -0.16 -1.69 1.27 0.00 0.10 0.00 0.00 66.02 65.54 3kst s SER 312 CO -0.09 -3.48 2.04 -2.24 0.98 0.00 0.00 173.24 170.46 3kst h ASP 313 N -2.13 0.00 -0.33 7.02 3.04 -2.01 -1.98 116.42 120.03 3kst h ASP 313 Ca -0.54 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.25 3kst h ASP 313 Cb 1.33 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.62 3kst h ASP 313 CO 0.53 0.15 0.01 1.67 -2.04 0.00 0.00 179.24 179.55 3kst n GLN 314 N -3.95 3.20 -2.87 4.15 7.27 -1.26 -4.93 117.38 119.00 3kst n GLN 314 Ca -0.02 -1.79 -0.19 0.00 0.07 0.00 0.00 57.00 55.07 3kst n GLN 314 Cb 0.24 -1.94 0.03 0.00 2.41 0.00 0.00 30.24 30.98 3kst n GLN 314 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3kst n GLY 315 N 0.34 -0.33 3.43 1.69 0.00 -0.74 -5.02 105.19 104.56 3kst n GLY 315 Ca 0.16 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 3kst n GLY 315 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kst s VAL 316 N -3.07 3.52 0.12 1.61 1.01 -1.26 -4.86 120.40 117.48 3kst s VAL 316 Ca 0.24 -0.49 -0.16 0.00 0.00 0.00 0.00 61.98 61.57 3kst s VAL 316 Cb -0.11 -2.53 -0.07 0.00 0.00 0.00 0.00 36.38 33.68 3kst s VAL 316 CO 0.30 0.50 0.56 -0.69 0.00 0.00 0.00 175.10 175.77 3kst s VAL 317 N 0.43 4.81 -0.00 2.92 1.01 -1.26 -1.30 120.40 127.01 3kst s VAL 317 Ca -0.06 0.97 0.02 0.00 0.00 0.00 0.00 61.98 62.91 3kst s VAL 317 Cb -0.15 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 3kst s VAL 317 CO 0.04 0.34 -0.06 0.42 0.00 0.00 0.00 175.10 175.84 3kst s THR 318 N -1.35 0.47 -0.16 3.92 -4.23 0.02 -5.00 115.64 109.30 3kst s THR 318 Ca 0.35 -0.29 0.01 0.00 -1.18 0.00 0.00 61.69 60.58 3kst s THR 318 Cb -0.16 -0.40 0.02 0.00 1.34 0.00 0.00 72.50 73.29 3kst s THR 318 CO 0.19 0.11 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.56 3kst s ILE 319 N -0.20 1.89 0.30 2.99 1.01 -1.26 -1.73 121.20 124.21 3kst s ILE 319 Ca 0.02 -0.84 -0.10 0.00 0.00 0.00 0.00 60.65 59.72 3kst s ILE 319 Cb -0.03 -1.72 0.04 0.00 0.01 0.00 0.00 42.46 40.76 3kst s ILE 319 CO -0.00 0.51 0.58 -1.54 0.00 0.00 0.00 174.94 174.49 3kst n SER 320 N 4.57 -1.68 0.00 3.58 3.41 -0.68 -4.87 113.62 117.95 3kst n SER 320 Ca -0.20 -2.26 0.00 0.00 -0.26 0.00 0.00 58.87 56.15 3kst n SER 320 Cb 0.50 2.83 0.00 0.00 -0.26 0.00 0.00 64.21 67.28 3kst n SER 320 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kst n GLY 321 N -0.42 -0.13 3.72 5.00 0.00 -1.26 0.59 105.19 112.68 3kst n GLY 321 Ca -0.06 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 3kst n GLY 321 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kst s THR 322 N -2.27 2.71 0.12 2.61 2.01 -1.26 -4.76 115.64 114.81 3kst s THR 322 Ca 0.00 0.49 -0.31 0.00 0.31 0.00 0.00 61.69 62.18 3kst s THR 322 Cb 0.00 -3.32 -0.10 0.00 0.01 0.00 0.00 72.50 69.09 3kst s THR 322 CO 0.00 0.04 1.75 -0.69 -0.69 0.00 0.00 174.62 175.02 3kst s VAL 323 N 1.24 2.62 -0.14 3.82 1.01 -1.26 -4.77 120.40 122.91 3kst s VAL 323 Ca 0.70 0.19 -0.27 0.00 0.00 0.00 0.00 61.98 62.60 3kst s VAL 323 Cb -0.43 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.81 3kst s VAL 323 CO 0.31 0.00 0.91 -0.63 0.00 0.00 0.00 175.10 175.70 3kst s ILE 324 N 2.40 4.83 -0.70 2.22 1.01 0.11 -4.95 121.20 126.12 3kst s ILE 324 Ca 0.77 1.83 -0.15 0.00 0.00 0.00 0.00 60.65 63.10 3kst s ILE 324 Cb -0.45 -4.22 0.18 0.00 0.01 0.00 0.00 42.46 37.98 3kst s ILE 324 CO 0.34 0.01 0.66 -0.54 0.00 0.00 0.00 174.94 175.41 3kst s LYS 325 N 2.11 3.34 0.76 2.79 1.02 -1.26 -2.36 119.74 126.13 3kst s LYS 325 Ca 0.43 -2.13 -0.11 0.00 0.02 0.00 0.00 55.97 54.18 3kst s LYS 325 Cb -0.17 -4.38 0.05 0.00 -0.52 0.00 0.00 37.83 32.81 3kst s LYS 325 CO 0.14 -1.31 1.08 -1.25 -0.92 0.00 0.00 175.35 173.09 3kst s PRO 326 N 0.81 2.40 0.12 -1.68 0.04 -1.26 -4.98 135.00 130.46 3kst s PRO 326 Ca 0.12 1.05 -0.01 0.00 0.04 0.00 0.00 61.00 62.20 3kst s PRO 326 Cb -0.19 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 3kst s PRO 326 CO -0.04 -1.51 0.04 -0.98 0.04 0.00 0.00 177.00 174.56 3kst s ARG 327 N -4.96 0.89 -0.12 4.56 1.70 -0.48 -3.31 118.95 117.23 3kst s ARG 327 Ca 0.60 -1.42 0.01 0.00 -0.47 0.00 0.00 55.73 54.46 3kst s ARG 327 Cb -0.16 0.21 -0.01 0.00 -0.57 0.00 0.00 34.95 34.42 3kst s ARG 327 CO 0.56 -0.23 -0.17 0.08 -1.08 0.00 0.00 175.30 174.46 3kst s VAL 328 N -4.01 2.74 0.25 4.99 1.01 0.12 -1.46 120.40 124.03 3kst s VAL 328 Ca 0.22 -0.78 0.10 0.00 0.00 0.00 0.00 61.98 61.52 3kst s VAL 328 Cb 0.07 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 3kst s VAL 328 CO 0.00 0.54 -0.05 -0.76 0.00 0.00 0.00 175.10 174.83 3kst s LEU 329 N 0.28 3.07 0.00 3.92 1.43 -0.29 -0.44 118.68 126.64 3kst s LEU 329 Ca -0.12 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.31 3kst s LEU 329 Cb -0.16 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.43 3kst s LEU 329 CO 0.06 0.03 0.17 2.29 0.23 0.00 0.00 176.35 179.13