#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k9m n GLN 2 N 0.00 -3.16 -2.10 -0.52 1.13 -1.26 -4.96 117.38 106.52 1k9m n GLN 2 Ca 0.00 2.54 -0.41 0.00 -1.94 0.00 0.00 57.00 57.19 1k9m n GLN 2 Cb 0.00 -3.87 -0.02 0.00 0.11 0.00 0.00 30.24 26.46 1k9m n GLN 2 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 1k9m s PRO 3 N -0.81 4.34 1.27 -1.09 0.02 -1.26 -5.02 135.00 132.46 1k9m s PRO 3 Ca -0.19 2.24 -0.16 0.00 0.02 0.00 0.00 61.00 62.91 1k9m s PRO 3 Cb 0.01 -3.07 0.32 0.00 0.02 0.00 0.00 34.50 31.79 1k9m s PRO 3 CO 0.56 -0.21 0.98 -1.12 -0.33 0.00 0.00 177.00 176.88 1k9m s SER 4 N -0.42 0.09 0.00 2.53 0.01 -1.26 -5.06 113.70 109.59 1k9m s SER 4 Ca 0.50 1.27 0.00 0.00 1.31 0.00 0.00 55.95 59.02 1k9m s SER 4 Cb -0.40 -1.93 0.00 0.00 0.21 0.00 0.00 66.02 63.90 1k9m s SER 4 CO 0.53 -4.72 0.00 -1.14 0.41 0.00 0.00 173.24 168.32 1k9m n ARG 5 N -5.24 0.00 -1.25 12.44 0.63 -1.26 -5.15 116.66 116.83 1k9m n ARG 5 Ca 0.06 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.64 1k9m n ARG 5 Cb 0.56 0.00 0.11 0.00 0.45 0.00 0.00 32.46 33.58 1k9m n ARG 5 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1k9m n PRO 6 N -0.06 0.37 -0.94 -0.14 -0.02 -1.26 -4.97 135.00 127.98 1k9m n PRO 6 Ca 0.00 0.19 -0.30 0.00 -2.02 0.00 0.00 63.50 61.37 1k9m n PRO 6 Cb 0.00 -2.33 0.15 0.00 -0.02 0.00 0.00 33.50 31.31 1k9m n PRO 6 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1k9m s ARG 7 N -3.70 1.07 -0.27 -0.52 1.04 -1.26 -4.96 118.95 110.36 1k9m s ARG 7 Ca 0.73 1.15 -0.23 0.00 -1.04 0.00 0.00 55.73 56.34 1k9m s ARG 7 Cb -0.32 -1.76 -0.01 0.00 -2.04 0.00 0.00 34.95 30.83 1k9m s ARG 7 CO 0.51 -2.47 0.78 0.15 -0.04 0.00 0.00 175.30 174.23 1k9m s LYS 8 N -4.76 4.08 0.05 3.89 -0.14 -1.26 -4.89 119.74 116.71 1k9m s LYS 8 Ca 0.65 0.73 0.00 0.00 -1.36 0.00 0.00 55.97 55.99 1k9m s LYS 8 Cb -0.20 -3.68 0.00 0.00 -1.68 0.00 0.00 37.83 32.27 1k9m s LYS 8 CO 0.58 -0.56 0.00 0.41 -0.76 0.00 0.00 175.35 175.02 1k9m n GLY 9 N 4.00 -2.67 3.83 -3.33 0.00 -1.16 -4.87 105.19 100.99 1k9m n GLY 9 Ca 0.04 -1.42 -0.35 0.00 0.00 0.00 0.00 46.02 44.29 1k9m n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1k9m s SER 10 N -4.27 6.91 -0.16 1.61 0.15 -1.26 -4.97 113.70 111.70 1k9m s SER 10 Ca 0.00 1.26 0.16 0.00 0.70 0.00 0.00 55.95 58.07 1k9m s SER 10 Cb 0.00 -2.36 0.73 0.00 -1.71 0.00 0.00 66.02 62.68 1k9m s SER 10 CO 0.00 0.00 1.64 0.18 1.20 0.00 0.00 173.24 176.26 1k9m n LEU 11 N 0.48 4.98 -0.52 3.45 4.32 -1.26 -4.42 117.00 124.03 1k9m n LEU 11 Ca -0.02 -2.67 0.11 0.00 -0.02 0.00 0.00 56.01 53.42 1k9m n LEU 11 Cb 0.52 -0.60 0.03 0.00 -1.62 0.00 0.00 43.42 41.74 1k9m n LEU 11 CO 0.43 0.73 0.35 0.61 -1.22 0.00 0.00 177.39 178.29 1k9m n GLY 12 N 0.76 0.08 1.91 -0.72 0.00 -1.26 -4.41 105.19 101.55 1k9m n GLY 12 Ca 0.26 -0.64 -0.22 0.00 0.00 0.00 0.00 46.02 45.42 1k9m n GLY 12 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1k9m n PHE 13 N 0.06 2.53 -4.61 1.61 3.01 -1.26 -5.05 117.46 113.74 1k9m n PHE 13 Ca 0.10 -2.24 -0.29 0.00 1.01 0.00 0.00 57.45 56.03 1k9m n PHE 13 Cb 0.47 -0.48 -0.08 0.00 -0.01 0.00 0.00 39.48 39.39 1k9m n PHE 13 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1k9m s GLY 14 N -3.31 2.79 0.80 1.37 0.00 -1.26 -4.21 107.32 103.50 1k9m s GLY 14 Ca 0.51 -0.88 -0.13 0.00 0.00 0.00 0.00 44.72 44.22 1k9m s GLY 14 CO 0.02 -1.97 1.19 2.56 0.00 0.00 0.00 173.10 174.91 1k9m s PRO 15 N -3.76 1.71 -1.52 2.90 0.04 -1.26 -5.04 135.00 128.07 1k9m s PRO 15 Ca 0.16 1.71 -0.09 0.00 0.04 0.00 0.00 61.00 62.83 1k9m s PRO 15 Cb 0.02 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.76 1k9m s PRO 15 CO 0.10 -2.15 2.74 0.54 0.04 0.00 0.00 177.00 178.27 1k9m n ARG 16 N -3.27 3.96 -3.27 4.56 3.00 -1.26 -4.94 116.66 115.44 1k9m n ARG 16 Ca 0.13 -2.64 -0.19 0.00 -0.01 0.00 0.00 57.85 55.14 1k9m n ARG 16 Cb 0.51 -2.77 0.00 0.00 0.00 0.00 0.00 32.46 30.20 1k9m n ARG 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1k9m s LYS 17 N 1.11 2.61 0.36 5.56 -2.85 -1.26 -4.30 119.74 120.97 1k9m s LYS 17 Ca 0.64 -1.46 -0.28 0.00 -1.00 0.00 0.00 55.97 53.87 1k9m s LYS 17 Cb 0.18 -2.56 -0.10 0.00 -2.06 0.00 0.00 37.83 33.29 1k9m s LYS 17 CO -0.07 -0.35 1.34 1.03 0.10 0.00 0.00 175.35 177.40 1k9m s ARG 18 N -4.31 4.23 0.40 1.78 0.52 -1.26 -4.69 118.95 115.62 1k9m s ARG 18 Ca 0.52 2.27 -0.26 0.00 -0.52 0.00 0.00 55.73 57.74 1k9m s ARG 18 Cb -0.06 -2.99 -0.09 0.00 0.52 0.00 0.00 34.95 32.34 1k9m s ARG 18 CO 0.31 -0.31 1.23 0.45 0.02 0.00 0.00 175.30 176.99 1k9m s SER 19 N -0.48 6.45 0.24 0.23 0.15 -0.54 -4.96 113.70 114.79 1k9m s SER 19 Ca 0.51 2.48 0.06 0.00 0.70 0.00 0.00 55.95 59.70 1k9m s SER 19 Cb -0.41 -2.63 0.25 0.00 -1.71 0.00 0.00 66.02 61.53 1k9m s SER 19 CO 0.54 -0.74 1.56 0.74 1.20 0.00 0.00 173.24 176.54 1k9m h THR 20 N 2.41 1.41 -3.65 6.45 2.02 -1.93 -3.43 112.91 116.18 1k9m h THR 20 Ca -0.49 -2.06 -0.46 0.00 0.77 0.00 0.00 66.41 64.16 1k9m h THR 20 Cb 1.24 2.07 -0.32 0.00 -1.74 0.00 0.00 68.15 69.40 1k9m h THR 20 CO 0.63 0.60 -0.80 -0.44 0.37 0.00 0.00 175.52 175.88 1k9m s SER 21 N -6.89 1.42 0.32 4.18 0.01 -1.26 -4.99 113.70 106.49 1k9m s SER 21 Ca -0.03 -0.23 0.26 0.00 1.31 0.00 0.00 55.95 57.26 1k9m s SER 21 Cb 0.12 -0.52 0.88 0.00 0.21 0.00 0.00 66.02 66.72 1k9m s SER 21 CO 0.79 0.05 1.76 -0.08 0.41 0.00 0.00 173.24 176.17 1k9m h GLU 22 N 6.66 0.00 -5.21 12.44 4.81 -2.01 -3.40 114.58 127.88 1k9m h GLU 22 Ca -0.33 0.00 -0.62 0.00 -0.13 0.00 0.00 59.36 58.28 1k9m h GLU 22 Cb 1.17 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.42 1k9m h GLU 22 CO 0.48 0.00 -0.34 0.99 -0.73 0.00 0.00 179.01 179.41 1k9m s THR 23 N -3.28 5.26 0.60 0.32 2.01 -1.26 -4.42 115.64 114.87 1k9m s THR 23 Ca 0.06 0.45 -0.19 0.00 0.31 0.00 0.00 61.69 62.32 1k9m s THR 23 Cb 0.10 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 1k9m s THR 23 CO 0.53 0.27 1.26 -2.84 -0.69 0.00 0.00 174.62 173.15 1k9m s PRO 24 N 1.37 2.90 -0.30 4.92 0.02 -1.26 -5.04 135.00 137.62 1k9m s PRO 24 Ca 0.13 1.96 0.00 0.00 0.02 0.00 0.00 61.00 63.11 1k9m s PRO 24 Cb -0.15 -1.97 0.09 0.00 0.02 0.00 0.00 34.50 32.49 1k9m s PRO 24 CO 0.07 -1.29 0.07 1.03 -0.33 0.00 0.00 177.00 176.55 1k9m s ARG 25 N -3.25 0.95 0.39 5.54 1.81 -1.26 -5.01 118.95 118.13 1k9m s ARG 25 Ca 0.78 -1.18 -0.27 0.00 -1.72 0.00 0.00 55.73 53.34 1k9m s ARG 25 Cb -0.34 -2.30 -0.11 0.00 -0.45 0.00 0.00 34.95 31.75 1k9m s ARG 25 CO 0.37 -0.91 1.33 1.19 -0.68 0.00 0.00 175.30 176.60 1k9m n PHE 26 N 4.72 2.39 -0.50 -0.53 3.01 -1.26 -4.88 117.46 120.42 1k9m n PHE 26 Ca -0.02 0.50 0.06 0.00 1.01 0.00 0.00 57.45 58.99 1k9m n PHE 26 Cb 0.43 -2.43 0.15 0.00 -0.01 0.00 0.00 39.48 37.62 1k9m n PHE 26 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 1k9m n ASN 27 N 0.36 2.93 -3.64 4.37 2.04 -1.26 -4.98 115.26 115.08 1k9m n ASN 27 Ca 0.05 -2.44 -0.15 0.00 -0.44 0.00 0.00 54.58 51.59 1k9m n ASN 27 Cb 0.39 -0.30 -0.08 0.00 -2.53 0.00 0.00 39.78 37.26 1k9m n ASN 27 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 1k9m s SER 28 N -1.53 -0.50 0.17 0.53 0.01 -1.26 -5.19 113.70 105.93 1k9m s SER 28 Ca 0.25 0.66 0.06 0.00 1.31 0.00 0.00 55.95 58.23 1k9m s SER 28 Cb 0.18 0.66 -0.04 0.00 0.21 0.00 0.00 66.02 67.03 1k9m s SER 28 CO 0.09 -0.43 -0.13 0.26 0.41 0.00 0.00 173.24 173.43 1k9m s TRP 29 N -0.77 1.52 1.23 2.43 0.52 -1.26 -5.08 118.94 117.53 1k9m s TRP 29 Ca -0.08 -0.62 -0.15 0.00 0.02 0.00 0.00 56.10 55.26 1k9m s TRP 29 Cb -0.03 -0.74 0.30 0.00 -1.15 0.00 0.00 33.47 31.86 1k9m s TRP 29 CO 0.05 0.23 1.01 -2.14 0.02 0.00 0.00 176.95 176.12 1k9m s PRO 30 N -3.44 -1.41 0.31 4.98 0.02 -1.26 -4.99 135.00 129.21 1k9m s PRO 30 Ca 0.18 0.57 -0.10 0.00 0.02 0.00 0.00 61.00 61.68 1k9m s PRO 30 Cb -0.01 -1.52 -0.07 0.00 0.02 0.00 0.00 34.50 32.93 1k9m s PRO 30 CO 0.04 -3.98 0.64 -1.54 -0.33 0.00 0.00 177.00 171.83 1k9m s SER 31 N -2.80 6.58 -1.17 2.53 1.04 -1.26 -4.98 113.70 113.64 1k9m s SER 31 Ca 0.68 0.99 -0.20 0.00 0.48 0.00 0.00 55.95 57.90 1k9m s SER 31 Cb -0.21 -2.26 -0.04 0.00 0.10 0.00 0.00 66.02 63.61 1k9m s SER 31 CO 0.62 -0.22 1.92 0.47 0.98 0.00 0.00 173.24 177.02 1k9m n ASP 32 N -0.70 3.59 0.00 7.02 8.00 -1.26 -4.74 116.55 128.46 1k9m n ASP 32 Ca 0.01 -2.78 0.00 0.00 0.71 0.00 0.00 54.79 52.73 1k9m n ASP 32 Cb 0.53 -1.60 0.00 0.00 -0.02 0.00 0.00 41.12 40.04 1k9m n ASP 32 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1k9m n ASP 33 N 10.03 0.00 -2.84 -2.24 -0.08 -1.26 -4.88 116.55 115.28 1k9m n ASP 33 Ca 0.48 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.76 1k9m n ASP 33 Cb 0.44 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.90 1k9m n ASP 33 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1k9m n GLY 34 N 3.02 -2.16 3.76 0.27 0.00 -1.26 -4.58 105.19 104.24 1k9m n GLY 34 Ca 0.00 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 44.99 1k9m n GLY 34 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k9m s GLN 35 N 0.00 2.08 0.39 1.61 -0.21 -1.26 -3.08 119.66 119.19 1k9m s GLN 35 Ca 0.00 1.01 -0.26 0.00 0.02 0.00 0.00 55.36 56.13 1k9m s GLN 35 Cb 0.00 -1.89 -0.11 0.00 1.00 0.00 0.00 33.01 32.01 1k9m s GLN 35 CO 0.00 -1.72 1.28 -2.30 -2.12 0.00 0.00 175.29 170.43 1k9m n PRO 36 N -3.56 2.01 -3.64 2.91 -0.02 -1.26 -4.48 135.00 126.97 1k9m n PRO 36 Ca 0.08 0.71 -0.02 0.00 -2.02 0.00 0.00 63.50 62.25 1k9m n PRO 36 Cb 0.54 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.62 1k9m n PRO 36 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1k9m s GLY 37 N -0.44 -0.04 0.25 -1.23 0.00 -0.19 -4.91 107.32 100.76 1k9m s GLY 37 Ca 0.59 2.43 -0.30 0.00 0.00 0.00 0.00 44.72 47.44 1k9m s GLY 37 CO 0.60 0.91 1.31 0.14 0.00 0.00 0.00 173.10 176.05 1k9m s VAL 38 N -1.47 3.02 -0.64 1.40 1.01 -1.26 -2.01 120.40 120.45 1k9m s VAL 38 Ca 0.10 0.90 -0.02 0.00 0.00 0.00 0.00 61.98 62.96 1k9m s VAL 38 Cb -0.01 -3.58 0.38 0.00 0.00 0.00 0.00 36.38 33.17 1k9m s VAL 38 CO -0.06 0.17 2.07 0.00 0.00 0.00 0.00 175.10 177.28 1k9m n GLN 39 N 1.94 2.56 0.00 2.72 6.02 0.97 -4.91 117.38 126.68 1k9m n GLN 39 Ca 0.04 -3.04 0.00 0.00 -0.01 0.00 0.00 57.00 53.99 1k9m n GLN 39 Cb 0.42 -2.18 0.00 0.00 1.02 0.00 0.00 30.24 29.50 1k9m n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1k9m n GLY 40 N -0.58 1.04 3.82 1.08 0.00 -1.26 -4.40 105.19 104.89 1k9m n GLY 40 Ca 0.56 -0.85 -0.06 0.00 0.00 0.00 0.00 46.02 45.67 1k9m n GLY 40 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1k9m s PHE 41 N -2.00 -0.17 0.20 1.61 5.36 -0.47 -4.97 117.98 117.54 1k9m s PHE 41 Ca 0.00 -0.24 -0.01 0.00 -0.96 0.00 0.00 56.93 55.72 1k9m s PHE 41 Cb 0.00 0.69 -0.04 0.00 -0.34 0.00 0.00 43.02 43.32 1k9m s PHE 41 CO 0.00 -1.09 0.12 0.00 -1.46 0.00 0.00 175.22 172.78 1k9m s ALA 42 N -3.68 1.20 0.02 11.12 0.00 -1.26 0.94 121.76 130.10 1k9m s ALA 42 Ca 0.12 -1.69 -0.02 0.00 0.00 0.00 0.00 51.96 50.36 1k9m s ALA 42 Cb -0.04 1.29 0.01 0.00 0.00 0.00 0.00 23.12 24.37 1k9m s ALA 42 CO 0.05 -0.56 0.10 0.41 0.00 0.00 0.00 175.76 175.76 1k9m n GLY 43 N -0.27 1.35 2.95 0.00 0.00 -0.75 -4.66 105.19 103.81 1k9m n GLY 43 Ca 0.01 -0.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.80 1k9m n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k9m s TYR 44 N -6.10 1.63 0.29 1.61 1.51 0.56 -1.27 117.35 115.58 1k9m s TYR 44 Ca 0.02 -0.81 -0.29 0.00 -1.01 0.00 0.00 57.07 54.99 1k9m s TYR 44 Cb -0.00 -1.29 -0.14 0.00 -0.11 0.00 0.00 41.96 40.42 1k9m s TYR 44 CO 0.01 -0.51 1.13 1.17 -1.11 0.00 0.00 175.55 176.23 1k9m n LYS 45 N 4.73 1.60 -0.02 -0.62 4.81 -0.66 -1.98 118.16 126.01 1k9m n LYS 45 Ca -0.15 0.56 -0.05 0.00 -0.87 0.00 0.00 58.31 57.80 1k9m n LYS 45 Cb 0.50 -2.02 -0.02 0.00 0.02 0.00 0.00 35.03 33.52 1k9m n LYS 45 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1k9m n ALA 46 N 0.47 2.55 0.00 3.14 0.00 -0.44 -0.94 120.51 125.29 1k9m n ALA 46 Ca 0.09 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1k9m n ALA 46 Cb 0.32 0.34 0.00 0.00 0.00 0.00 0.00 19.45 20.12 1k9m n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k9m n GLY 47 N 2.73 -0.52 3.07 0.00 0.00 -1.18 -4.79 105.19 104.50 1k9m n GLY 47 Ca -0.10 -0.89 -0.16 0.00 0.00 0.00 0.00 46.02 44.86 1k9m n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1k9m s MET 48 N -1.16 0.66 0.35 1.61 -1.94 -1.26 0.30 119.30 117.86 1k9m s MET 48 Ca 0.00 -0.64 -0.15 0.00 -1.71 0.00 0.00 55.69 53.19 1k9m s MET 48 Cb 0.00 -0.57 0.04 0.00 2.01 0.00 0.00 34.83 36.30 1k9m s MET 48 CO 0.00 0.14 0.72 0.95 -0.01 0.00 0.00 175.02 176.81 1k9m s THR 49 N -0.90 0.00 0.29 2.05 -4.23 -0.75 -5.00 115.64 107.10 1k9m s THR 49 Ca -0.03 -1.10 0.10 0.00 -1.18 0.00 0.00 61.69 59.49 1k9m s THR 49 Cb -0.07 -2.61 -0.05 0.00 1.34 0.00 0.00 72.50 71.11 1k9m s THR 49 CO 0.01 0.00 -0.09 -1.38 -0.54 0.00 0.00 174.62 172.62 1k9m s HIS 50 N -2.87 2.48 0.03 3.99 -3.43 -1.26 -0.19 115.29 114.03 1k9m s HIS 50 Ca 0.17 -0.33 0.02 0.00 -0.80 0.00 0.00 55.06 54.11 1k9m s HIS 50 Cb -0.04 -1.19 -0.02 0.00 -1.43 0.00 0.00 32.58 29.89 1k9m s HIS 50 CO 0.11 0.63 -0.07 0.54 -2.00 0.00 0.00 174.74 173.94 1k9m s VAL 51 N -2.46 0.52 -0.19 -5.38 0.11 -0.11 -1.65 120.40 111.24 1k9m s VAL 51 Ca 0.32 -0.94 -0.13 0.00 -2.93 0.00 0.00 61.98 58.30 1k9m s VAL 51 Cb -0.04 -0.57 -0.05 0.00 -1.53 0.00 0.00 36.38 34.20 1k9m s VAL 51 CO 0.18 -0.30 0.26 -0.69 -3.33 0.00 0.00 175.10 171.22 1k9m s VAL 52 N -1.17 5.32 0.27 2.04 1.01 0.32 -0.73 120.40 127.46 1k9m s VAL 52 Ca -0.08 0.45 0.08 0.00 0.00 0.00 0.00 61.98 62.43 1k9m s VAL 52 Cb -0.09 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 1k9m s VAL 52 CO 0.00 0.37 -0.10 -0.76 0.00 0.00 0.00 175.10 174.61 1k9m s LEU 53 N 0.67 2.56 -0.26 3.92 1.02 0.11 -1.01 118.68 125.68 1k9m s LEU 53 Ca 0.14 -1.13 -0.17 0.00 0.02 0.00 0.00 54.13 52.99 1k9m s LEU 53 Cb -0.13 -0.78 -0.03 0.00 0.02 0.00 0.00 46.19 45.28 1k9m s LEU 53 CO 0.03 -0.23 0.47 -0.69 0.02 0.00 0.00 176.35 175.96 1k9m s VAL 54 N -2.86 5.10 -0.42 -1.59 1.01 -0.96 -0.86 120.40 119.82 1k9m s VAL 54 Ca 0.29 0.79 -0.43 0.00 0.00 0.00 0.00 61.98 62.63 1k9m s VAL 54 Cb 0.01 -3.79 -0.17 0.00 0.00 0.00 0.00 36.38 32.43 1k9m s VAL 54 CO 0.12 0.11 1.87 -3.20 0.00 0.00 0.00 175.10 174.00 1k9m n ASN 55 N 5.45 1.54 0.00 3.32 2.85 0.22 -4.71 115.26 123.93 1k9m n ASN 55 Ca -0.05 0.92 0.02 0.00 -0.11 0.00 0.00 54.58 55.36 1k9m n ASN 55 Cb 0.50 -1.01 -0.11 0.00 1.24 0.00 0.00 39.78 40.40 1k9m n ASN 55 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1k9m n ASP 56 N 6.12 0.44 -4.61 1.20 -0.08 -1.26 -0.62 116.55 117.74 1k9m n ASP 56 Ca 0.38 0.19 -0.43 0.00 -1.51 0.00 0.00 54.79 53.41 1k9m n ASP 56 Cb 0.04 0.88 -0.03 0.00 2.34 0.00 0.00 41.12 44.35 1k9m n ASP 56 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 1k9m s GLU 57 N -3.06 3.30 0.59 -0.67 2.12 -1.26 -4.88 118.70 114.83 1k9m s GLU 57 Ca -0.05 2.02 0.32 0.00 0.36 0.00 0.00 54.97 57.62 1k9m s GLU 57 Cb 0.10 -4.32 1.84 0.00 0.26 0.00 0.00 34.13 32.01 1k9m s GLU 57 CO 0.84 -1.91 2.22 -1.00 -0.54 0.00 0.00 175.26 174.87 1k9m h PRO 58 N 14.13 0.00 -0.23 4.30 0.13 -1.99 -2.08 132.00 146.25 1k9m h PRO 58 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1k9m h PRO 58 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1k9m h PRO 58 CO 0.97 0.03 0.00 0.09 -0.23 0.00 0.00 178.00 178.86 1k9m n ASN 59 N -3.61 2.62 -4.75 1.44 3.02 -1.26 -4.91 115.26 107.81 1k9m n ASN 59 Ca -0.03 -1.86 -0.39 0.00 -0.03 0.00 0.00 54.58 52.28 1k9m n ASN 59 Cb 0.13 -0.14 -0.06 0.00 -0.61 0.00 0.00 39.78 39.10 1k9m n ASN 59 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1k9m s SER 60 N -1.63 6.87 0.00 6.41 0.15 -0.78 -4.91 113.70 119.81 1k9m s SER 60 Ca 0.35 1.03 0.07 0.00 0.70 0.00 0.00 55.95 58.10 1k9m s SER 60 Cb 0.20 -2.34 0.34 0.00 -1.71 0.00 0.00 66.02 62.51 1k9m s SER 60 CO 0.30 0.05 1.11 -2.65 1.20 0.00 0.00 173.24 173.25 1k9m n PRO 61 N 3.14 0.08 -0.08 5.44 -0.02 -1.26 -0.99 135.00 141.30 1k9m n PRO 61 Ca -0.07 0.26 0.06 0.00 -2.02 0.00 0.00 63.50 61.73 1k9m n PRO 61 Cb 0.51 -1.50 0.10 0.00 -0.02 0.00 0.00 33.50 32.59 1k9m n PRO 61 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1k9m n ARG 62 N -1.33 1.64 -1.64 -0.52 1.74 -1.26 -5.03 116.66 110.26 1k9m n ARG 62 Ca 0.03 -1.59 -0.53 0.00 -0.77 0.00 0.00 57.85 54.99 1k9m n ARG 62 Cb 0.06 -1.25 -0.06 0.00 -1.02 0.00 0.00 32.46 30.19 1k9m n ARG 62 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1k9m n GLU 63 N 0.60 1.24 0.00 5.56 0.28 -0.16 -0.78 120.64 127.38 1k9m n GLU 63 Ca 0.09 0.45 0.00 0.00 -0.16 0.00 0.00 57.16 57.54 1k9m n GLU 63 Cb 0.35 -2.12 0.00 0.00 1.43 0.00 0.00 31.44 31.10 1k9m n GLU 63 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1k9m n GLY 64 N 3.19 1.63 3.96 -1.84 0.00 0.21 -4.91 105.19 107.42 1k9m n GLY 64 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 1k9m n GLY 64 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1k9m s MET 65 N -0.85 2.59 0.85 1.61 -1.94 0.04 -4.51 119.30 117.09 1k9m s MET 65 Ca 0.00 -0.57 -0.10 0.00 -1.71 0.00 0.00 55.69 53.31 1k9m s MET 65 Cb 0.00 -2.42 0.11 0.00 2.01 0.00 0.00 34.83 34.53 1k9m s MET 65 CO 0.00 -0.74 1.12 -1.21 -0.01 0.00 0.00 175.02 174.18 1k9m s GLU 66 N -4.84 1.56 -0.30 2.03 0.41 -1.26 0.71 118.70 117.01 1k9m s GLU 66 Ca 0.56 1.38 -0.16 0.00 -0.41 0.00 0.00 54.97 56.34 1k9m s GLU 66 Cb -0.10 -1.80 0.17 0.00 -1.78 0.00 0.00 34.13 30.62 1k9m s GLU 66 CO 0.40 -2.20 1.07 -2.00 -0.49 0.00 0.00 175.26 172.04 1k9m s GLU 67 N -4.76 0.24 -0.02 1.61 2.12 -0.04 -4.67 118.70 113.18 1k9m s GLU 67 Ca 0.64 0.54 -0.25 0.00 0.36 0.00 0.00 54.97 56.26 1k9m s GLU 67 Cb -0.20 0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.40 1k9m s GLU 67 CO 0.57 -0.07 0.77 0.99 -0.54 0.00 0.00 175.26 176.98 1k9m s THR 68 N 2.00 4.92 -0.04 -1.70 2.01 -1.26 0.05 115.64 121.62 1k9m s THR 68 Ca -0.04 1.60 0.02 0.00 0.31 0.00 0.00 61.69 63.58 1k9m s THR 68 Cb -0.04 -4.11 0.02 0.00 0.01 0.00 0.00 72.50 68.38 1k9m s THR 68 CO -0.16 0.27 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.28 1k9m s VAL 69 N 0.58 0.70 0.39 3.82 1.01 0.09 -4.97 120.40 122.01 1k9m s VAL 69 Ca 0.40 -0.25 -0.25 0.00 0.00 0.00 0.00 61.98 61.88 1k9m s VAL 69 Cb -0.19 -0.68 -0.09 0.00 0.00 0.00 0.00 36.38 35.42 1k9m s VAL 69 CO 0.21 0.25 1.10 -2.84 0.00 0.00 0.00 175.10 173.82 1k9m s PRO 70 N 0.66 4.17 -0.04 2.72 0.02 -1.26 -0.94 135.00 140.34 1k9m s PRO 70 Ca -0.10 1.67 -0.04 0.00 0.02 0.00 0.00 61.00 62.55 1k9m s PRO 70 Cb -0.13 -2.67 0.01 0.00 0.02 0.00 0.00 34.50 31.73 1k9m s PRO 70 CO 0.01 -0.17 0.11 0.08 -0.33 0.00 0.00 177.00 176.69 1k9m s VAL 71 N -1.50 0.01 -0.24 3.83 1.01 0.73 -1.70 120.40 122.52 1k9m s VAL 71 Ca 0.56 -0.05 -0.09 0.00 0.00 0.00 0.00 61.98 62.40 1k9m s VAL 71 Cb -0.27 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 1k9m s VAL 71 CO 0.33 -0.03 0.13 -0.89 0.00 0.00 0.00 175.10 174.65 1k9m s THR 72 N -0.03 5.00 0.03 3.92 2.01 0.11 -1.82 115.64 124.85 1k9m s THR 72 Ca -0.01 0.06 -0.29 0.00 0.31 0.00 0.00 61.69 61.76 1k9m s THR 72 Cb -0.01 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.12 1k9m s THR 72 CO 0.00 0.34 0.91 -0.69 -0.69 0.00 0.00 174.62 174.49 1k9m s VAL 73 N 1.28 4.77 -0.07 3.82 1.01 0.15 -0.98 120.40 130.38 1k9m s VAL 73 Ca 0.06 1.93 -0.01 0.00 0.00 0.00 0.00 61.98 63.97 1k9m s VAL 73 Cb -0.14 -4.26 0.03 0.00 0.00 0.00 0.00 36.38 32.00 1k9m s VAL 73 CO 0.06 0.24 -0.01 -0.63 0.00 0.00 0.00 175.10 174.75 1k9m s ILE 74 N 0.56 0.46 -0.30 2.22 1.01 -0.24 -1.33 121.20 123.58 1k9m s ILE 74 Ca 0.47 0.04 -0.29 0.00 0.00 0.00 0.00 60.65 60.87 1k9m s ILE 74 Cb -0.21 -0.58 -0.00 0.00 0.01 0.00 0.00 42.46 41.68 1k9m s ILE 74 CO 0.27 0.26 1.34 -1.61 0.00 0.00 0.00 174.94 175.20 1k9m s GLU 75 N 1.75 3.88 -0.62 2.79 2.02 -0.84 -0.52 118.70 127.16 1k9m s GLU 75 Ca 0.02 1.27 0.05 0.00 0.02 0.00 0.00 54.97 56.33 1k9m s GLU 75 Cb -0.13 -3.90 0.31 0.00 0.10 0.00 0.00 34.13 30.51 1k9m s GLU 75 CO -0.05 -1.17 0.93 0.25 0.02 0.00 0.00 175.26 175.25 1k9m n THR 76 N 6.29 3.02 -0.91 3.63 -2.24 -0.85 -0.33 114.28 122.88 1k9m n THR 76 Ca 0.15 -5.50 -0.28 0.00 -2.27 0.00 0.00 64.05 56.15 1k9m n THR 76 Cb 0.47 -1.62 0.21 0.00 -2.10 0.00 0.00 70.33 67.28 1k9m n THR 76 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 1k9m s PRO 77 N -3.21 -0.20 0.69 -0.78 0.02 -1.26 -4.58 135.00 125.69 1k9m s PRO 77 Ca 0.46 0.62 -0.17 0.00 0.02 0.00 0.00 61.00 61.93 1k9m s PRO 77 Cb 0.23 -1.65 0.01 0.00 0.02 0.00 0.00 34.50 33.12 1k9m s PRO 77 CO -0.10 -3.18 1.25 -2.14 -0.33 0.00 0.00 177.00 172.50 1k9m s PRO 78 N -4.76 2.33 0.51 5.54 0.02 -1.26 -4.81 135.00 132.57 1k9m s PRO 78 Ca 0.67 1.92 0.01 0.00 0.02 0.00 0.00 61.00 63.62 1k9m s PRO 78 Cb -0.21 -1.84 0.01 0.00 0.02 0.00 0.00 34.50 32.48 1k9m s PRO 78 CO 0.61 -1.73 0.09 -1.33 -0.33 0.00 0.00 177.00 174.31 1k9m n MET 79 N -2.31 0.76 -3.60 5.54 2.81 -0.58 -4.40 117.12 115.34 1k9m n MET 79 Ca 0.15 -3.61 -0.22 0.00 -1.81 0.00 0.00 57.70 52.21 1k9m n MET 79 Cb 0.49 0.84 -0.16 0.00 -0.71 0.00 0.00 33.22 33.68 1k9m n MET 79 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1k9m s ARG 80 N -3.91 0.06 -0.71 0.03 0.52 -1.05 -1.88 118.95 112.00 1k9m s ARG 80 Ca 0.07 0.13 -0.27 0.00 -0.52 0.00 0.00 55.73 55.14 1k9m s ARG 80 Cb -0.01 -1.31 0.01 0.00 0.52 0.00 0.00 34.95 34.17 1k9m s ARG 80 CO 0.05 -0.57 1.49 0.00 0.02 0.00 0.00 175.30 176.28 1k9m s ALA 81 N 2.20 2.54 -1.58 2.13 0.00 -0.01 -2.94 121.76 124.11 1k9m s ALA 81 Ca 0.04 -1.17 0.29 0.00 0.00 0.00 0.00 51.96 51.11 1k9m s ALA 81 Cb -0.15 -4.29 1.24 0.00 0.00 0.00 0.00 23.12 19.92 1k9m s ALA 81 CO -0.08 -3.53 1.87 0.28 0.00 0.00 0.00 175.76 174.30 1k9m n VAL 82 N 6.69 0.00 -3.55 0.00 0.31 -0.23 -3.76 118.33 117.79 1k9m n VAL 82 Ca 0.10 -0.05 -0.08 0.00 -0.01 0.00 0.00 64.34 64.31 1k9m n VAL 82 Cb 0.50 -0.15 -0.03 0.00 -0.91 0.00 0.00 33.84 33.25 1k9m n VAL 82 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1k9m s ALA 83 N -2.52 -1.93 -0.28 3.52 0.00 -1.19 -3.44 121.76 115.92 1k9m s ALA 83 Ca 0.28 1.37 -0.03 0.00 0.00 0.00 0.00 51.96 53.59 1k9m s ALA 83 Cb 0.20 -0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.20 1k9m s ALA 83 CO 0.48 -0.53 -0.01 -1.17 0.00 0.00 0.00 175.76 174.53 1k9m s LEU 84 N -1.92 3.56 -0.11 0.00 1.98 -0.17 0.18 118.68 122.20 1k9m s LEU 84 Ca 0.04 -1.00 -0.11 0.00 -2.89 0.00 0.00 54.13 50.17 1k9m s LEU 84 Cb -0.01 -1.72 -0.05 0.00 0.66 0.00 0.00 46.19 45.08 1k9m s LEU 84 CO -0.05 -0.19 0.26 -0.60 -1.89 0.00 0.00 176.35 173.88 1k9m s ARG 85 N 1.33 3.88 -0.08 1.98 3.52 0.19 -1.15 118.95 128.61 1k9m s ARG 85 Ca -0.01 0.08 0.04 0.00 -0.13 0.00 0.00 55.73 55.70 1k9m s ARG 85 Cb -0.18 -3.29 -0.01 0.00 -1.56 0.00 0.00 34.95 29.91 1k9m s ARG 85 CO -0.02 0.55 -0.21 0.00 -0.81 0.00 0.00 175.30 174.81 1k9m s ALA 86 N -0.48 2.32 0.05 6.12 0.00 -0.78 -2.11 121.76 126.89 1k9m s ALA 86 Ca 0.17 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 51.17 1k9m s ALA 86 Cb -0.13 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.10 1k9m s ALA 86 CO 0.06 0.37 0.03 0.71 0.00 0.00 0.00 175.76 176.93 1k9m s TYR 87 N -0.02 3.10 -0.04 0.00 1.51 -1.21 0.24 117.35 120.92 1k9m s TYR 87 Ca -0.06 0.06 0.06 0.00 -1.01 0.00 0.00 57.07 56.12 1k9m s TYR 87 Cb -0.15 -1.62 -0.02 0.00 -0.11 0.00 0.00 41.96 40.07 1k9m s TYR 87 CO 0.05 0.49 -0.24 -1.83 -1.11 0.00 0.00 175.55 172.91 1k9m s GLU 88 N -2.07 2.38 0.07 -0.62 -1.05 0.12 0.33 118.70 117.85 1k9m s GLU 88 Ca 0.25 -0.89 -0.31 0.00 -0.15 0.00 0.00 54.97 53.87 1k9m s GLU 88 Cb -0.12 -2.15 -0.06 0.00 -0.44 0.00 0.00 34.13 31.36 1k9m s GLU 88 CO 0.17 0.48 1.25 -0.51 0.95 0.00 0.00 175.26 177.59 1k9m s ASP 89 N -0.40 7.01 0.17 0.83 1.01 0.92 -2.68 116.67 123.54 1k9m s ASP 89 Ca 0.04 2.08 -0.01 0.00 0.71 0.00 0.00 52.55 55.37 1k9m s ASP 89 Cb -0.12 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.19 1k9m s ASP 89 CO 0.01 -0.52 0.09 0.42 0.21 0.00 0.00 175.17 175.38 1k9m s THR 90 N 1.16 0.12 -0.64 -1.27 -4.23 -0.55 -4.95 115.64 105.29 1k9m s THR 90 Ca 0.60 -1.96 0.06 0.00 -1.18 0.00 0.00 61.69 59.21 1k9m s THR 90 Cb -0.31 -2.31 0.06 0.00 1.34 0.00 0.00 72.50 71.28 1k9m s THR 90 CO 0.29 -0.21 1.12 -2.65 -0.54 0.00 0.00 174.62 172.62 1k9m n PRO 91 N -0.21 0.04 -0.69 3.99 -0.02 -1.26 -1.36 135.00 135.49 1k9m n PRO 91 Ca -0.02 0.49 0.04 0.00 -2.02 0.00 0.00 63.50 61.99 1k9m n PRO 91 Cb 0.65 -1.70 0.20 0.00 -0.02 0.00 0.00 33.50 32.62 1k9m n PRO 91 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1k9m n TYR 92 N -1.66 0.20 -1.52 6.00 4.02 -1.26 -5.09 117.16 117.83 1k9m n TYR 92 Ca -0.00 -1.55 0.00 0.00 -0.01 0.00 0.00 57.90 56.34 1k9m n TYR 92 Cb 0.09 -0.26 0.00 0.00 -0.02 0.00 0.00 39.34 39.15 1k9m n TYR 92 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1k9m n GLY 93 N -1.09 -1.73 3.84 2.72 0.00 -0.46 -4.93 105.19 103.54 1k9m n GLY 93 Ca 0.21 -1.74 -0.36 0.00 0.00 0.00 0.00 46.02 44.13 1k9m n GLY 93 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k9m s GLN 94 N 0.00 4.03 0.01 1.61 -0.21 -1.26 -1.49 119.66 122.34 1k9m s GLN 94 Ca 0.00 0.54 0.01 0.00 0.02 0.00 0.00 55.36 55.93 1k9m s GLN 94 Cb 0.00 -3.04 -0.01 0.00 1.00 0.00 0.00 33.01 30.96 1k9m s GLN 94 CO 0.00 0.54 -0.03 1.03 -2.12 0.00 0.00 175.29 174.71 1k9m s ARG 95 N -1.66 0.27 0.19 2.91 0.52 -1.09 -4.95 118.95 115.15 1k9m s ARG 95 Ca 0.34 -0.30 -0.31 0.00 -0.52 0.00 0.00 55.73 54.94 1k9m s ARG 95 Cb -0.16 -0.14 -0.10 0.00 0.52 0.00 0.00 34.95 35.07 1k9m s ARG 95 CO 0.19 0.03 1.52 -2.14 0.02 0.00 0.00 175.30 174.91 1k9m s PRO 96 N -0.59 4.23 -0.12 3.54 0.02 -1.26 -0.70 135.00 140.12 1k9m s PRO 96 Ca -0.04 2.34 -0.09 0.00 0.02 0.00 0.00 61.00 63.22 1k9m s PRO 96 Cb -0.04 -3.14 -0.03 0.00 0.02 0.00 0.00 34.50 31.31 1k9m s PRO 96 CO -0.00 -0.54 -0.18 -0.11 -0.33 0.00 0.00 177.00 175.84 1k9m n LEU 97 N 3.37 1.45 0.00 -5.54 0.00 0.65 -4.85 117.00 112.08 1k9m n LEU 97 Ca 0.11 0.47 -0.05 0.00 0.00 0.00 0.00 56.01 56.54 1k9m n LEU 97 Cb 0.39 -0.76 0.01 0.00 0.00 0.00 0.00 43.42 43.06 1k9m n LEU 97 CO 0.61 -0.43 0.28 0.41 0.00 0.00 0.00 177.39 178.26 1k9m n THR 98 N -4.09 0.00 -3.84 1.96 -1.04 -1.19 -5.01 114.28 101.08 1k9m n THR 98 Ca -0.07 -0.61 -0.12 0.00 -2.04 0.00 0.00 64.05 61.21 1k9m n THR 98 Cb 0.27 0.56 -0.11 0.00 -1.82 0.00 0.00 70.33 69.24 1k9m n THR 98 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1k9m s GLU 99 N -2.09 0.41 -0.25 -2.82 2.02 -1.26 -1.87 118.70 112.84 1k9m s GLU 99 Ca 0.10 -0.14 -0.03 0.00 0.02 0.00 0.00 54.97 54.91 1k9m s GLU 99 Cb -0.03 0.18 0.01 0.00 0.10 0.00 0.00 34.13 34.40 1k9m s GLU 99 CO 0.07 -0.09 -0.03 0.08 0.02 0.00 0.00 175.26 175.31 1k9m s VAL 100 N -0.85 3.20 0.52 2.63 1.01 -0.30 -4.78 120.40 121.82 1k9m s VAL 100 Ca -0.09 -0.82 0.07 0.00 0.00 0.00 0.00 61.98 61.13 1k9m s VAL 100 Cb -0.05 -2.58 0.04 0.00 0.00 0.00 0.00 36.38 33.78 1k9m s VAL 100 CO 0.01 0.24 0.49 0.26 0.00 0.00 0.00 175.10 176.11 1k9m s TRP 101 N 1.40 1.82 0.00 5.22 0.52 -1.26 -1.00 118.94 125.64 1k9m s TRP 101 Ca 0.02 -0.73 0.00 0.00 0.02 0.00 0.00 56.10 55.41 1k9m s TRP 101 Cb -0.16 -2.05 0.00 0.00 -1.15 0.00 0.00 33.47 30.11 1k9m s TRP 101 CO -0.03 -0.56 0.00 0.25 0.02 0.00 0.00 176.95 176.63 1k9m n THR 102 N -1.83 0.00 0.00 2.01 -2.24 -1.22 -4.82 114.28 106.17 1k9m n THR 102 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1k9m n THR 102 Cb 0.63 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1k9m n THR 102 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1k9m n ASP 103 N -0.07 2.30 -4.55 3.42 8.00 -1.26 -4.98 116.55 119.41 1k9m n ASP 103 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1k9m n ASP 103 Cb 0.00 0.44 -0.05 0.00 -0.02 0.00 0.00 41.12 41.50 1k9m n ASP 103 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1k9m s GLU 104 N -0.97 3.45 0.09 -1.24 2.02 -1.26 -5.02 118.70 115.77 1k9m s GLU 104 Ca 0.00 -0.02 0.09 0.00 0.02 0.00 0.00 54.97 55.06 1k9m s GLU 104 Cb 0.00 -3.96 -0.04 0.00 0.10 0.00 0.00 34.13 30.24 1k9m s GLU 104 CO 0.00 -1.24 -0.19 -0.06 0.02 0.00 0.00 175.26 173.79 1k9m s PHE 105 N 3.63 2.51 0.26 1.61 0.40 -1.26 -4.95 117.98 120.19 1k9m s PHE 105 Ca 0.33 -0.28 -0.30 0.00 -0.60 0.00 0.00 56.93 56.09 1k9m s PHE 105 Cb -0.11 -1.37 -0.10 0.00 0.51 0.00 0.00 43.02 41.95 1k9m s PHE 105 CO 0.24 0.33 1.35 -1.58 0.70 0.00 0.00 175.22 176.26 1k9m s HIS 106 N -1.06 3.11 0.44 0.36 5.65 -1.26 -4.85 115.29 117.68 1k9m s HIS 106 Ca 0.16 1.21 0.37 0.00 0.25 0.00 0.00 55.06 57.06 1k9m s HIS 106 Cb -0.10 -3.70 1.42 0.00 -1.18 0.00 0.00 32.58 29.01 1k9m s HIS 106 CO 0.08 -2.14 1.36 -1.13 -0.65 0.00 0.00 174.74 172.26 1k9m n SER 107 N 1.96 0.08 -1.52 9.88 3.41 -1.26 -1.04 113.62 125.13 1k9m n SER 107 Ca 0.04 1.02 -0.11 0.00 -0.26 0.00 0.00 58.87 59.56 1k9m n SER 107 Cb 0.42 -0.51 0.09 0.00 -0.26 0.00 0.00 64.21 63.95 1k9m n SER 107 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1k9m n GLU 108 N -4.02 2.69 0.19 4.33 1.02 -1.26 -4.62 120.64 118.97 1k9m n GLU 108 Ca 0.37 -3.76 0.13 0.00 -0.02 0.00 0.00 57.16 53.88 1k9m n GLU 108 Cb 1.59 -1.94 0.32 0.00 -0.02 0.00 0.00 31.44 31.38 1k9m n GLU 108 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1k9m h LEU 109 N 1.73 0.00 0.00 -4.62 5.85 -1.45 -3.09 115.31 113.73 1k9m h LEU 109 Ca 0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1k9m h LEU 109 Cb 1.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.37 1k9m h LEU 109 CO 0.44 0.00 0.00 -0.90 -0.34 0.00 0.00 178.44 177.64 1k9m n ASP 110 N -2.83 0.00 -0.14 1.25 5.75 -1.26 -2.15 116.55 117.17 1k9m n ASP 110 Ca 0.04 -0.98 0.14 0.00 -0.01 0.00 0.00 54.79 53.98 1k9m n ASP 110 Cb 0.46 0.00 0.59 0.00 -1.03 0.00 0.00 41.12 41.14 1k9m n ASP 110 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1k9m n ARG 111 N -0.89 0.74 0.00 0.11 1.74 -1.17 -4.35 116.66 112.84 1k9m n ARG 111 Ca 0.15 -0.28 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 1k9m n ARG 111 Cb 0.07 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 1k9m n ARG 111 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1k9m n THR 112 N -0.89 0.00 -3.89 0.55 -1.04 -1.10 -4.93 114.28 102.98 1k9m n THR 112 Ca 0.15 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.94 1k9m n THR 112 Cb 0.28 -0.61 -0.04 0.00 -1.82 0.00 0.00 70.33 68.14 1k9m n THR 112 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1k9m s LEU 113 N -4.75 3.53 -0.83 -4.42 1.43 -0.91 -5.04 118.68 107.68 1k9m s LEU 113 Ca 0.00 -0.54 -0.15 0.00 -1.03 0.00 0.00 54.13 52.41 1k9m s LEU 113 Cb 0.00 -2.11 0.20 0.00 0.03 0.00 0.00 46.19 44.31 1k9m s LEU 113 CO 0.00 -0.32 0.82 -1.81 0.23 0.00 0.00 176.35 175.27 1k9m s ASP 114 N -3.95 6.72 0.22 2.29 1.01 -1.26 -4.31 116.67 117.39 1k9m s ASP 114 Ca 0.40 -2.53 -0.32 0.00 0.71 0.00 0.00 52.55 50.81 1k9m s ASP 114 Cb -0.05 -2.25 -0.14 0.00 1.01 0.00 0.00 42.92 41.49 1k9m s ASP 114 CO 0.26 -0.68 1.34 0.52 0.21 0.00 0.00 175.17 176.82 1k9m n VAL 115 N 4.30 0.95 -1.90 -1.27 0.31 -1.26 -4.90 118.33 114.56 1k9m n VAL 115 Ca 0.15 -0.24 -0.42 0.00 -0.01 0.00 0.00 64.34 63.82 1k9m n VAL 115 Cb 0.47 -1.31 -0.03 0.00 -0.91 0.00 0.00 33.84 32.06 1k9m n VAL 115 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1k9m s PRO 116 N -0.41 4.20 -0.03 5.55 0.02 -1.26 -4.90 135.00 138.16 1k9m s PRO 116 Ca 0.69 2.42 0.11 0.00 0.02 0.00 0.00 61.00 64.25 1k9m s PRO 116 Cb -0.70 -3.11 -0.17 0.00 0.02 0.00 0.00 34.50 30.54 1k9m s PRO 116 CO 0.50 -0.58 0.22 0.39 -0.33 0.00 0.00 177.00 177.20 1k9m n GLU 117 N 3.17 0.69 -3.50 5.54 1.02 -1.26 -4.92 120.64 121.37 1k9m n GLU 117 Ca 0.11 -0.09 -0.19 0.00 -0.02 0.00 0.00 57.16 56.97 1k9m n GLU 117 Cb 0.38 -1.28 -0.13 0.00 -0.02 0.00 0.00 31.44 30.39 1k9m n GLU 117 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1k9m s ASP 118 N -3.53 1.49 0.01 1.62 1.01 -1.26 -5.14 116.67 110.86 1k9m s ASP 118 Ca -0.04 -0.27 -0.01 0.00 0.71 0.00 0.00 52.55 52.93 1k9m s ASP 118 Cb 0.07 0.31 -0.01 0.00 1.01 0.00 0.00 42.92 44.30 1k9m s ASP 118 CO 0.48 -0.33 0.01 -2.28 0.21 0.00 0.00 175.17 173.26 1k9m s HIS 119 N 2.31 0.15 -0.78 4.23 5.65 -1.26 -5.11 115.29 120.47 1k9m s HIS 119 Ca 0.06 -0.30 -0.06 0.00 0.25 0.00 0.00 55.06 55.01 1k9m s HIS 119 Cb -0.16 -0.11 0.20 0.00 -1.18 0.00 0.00 32.58 31.33 1k9m s HIS 119 CO -0.12 -0.16 0.67 0.34 -0.65 0.00 0.00 174.74 174.82 1k9m s ASP 120 N -1.05 6.01 0.19 9.88 -1.08 -1.26 -4.95 116.67 124.42 1k9m s ASP 120 Ca -0.11 -3.06 -0.11 0.00 -0.52 0.00 0.00 52.55 48.74 1k9m s ASP 120 Cb -0.07 -2.00 0.22 0.00 -1.46 0.00 0.00 42.92 39.61 1k9m s ASP 120 CO -0.00 -0.38 1.74 -0.65 0.52 0.00 0.00 175.17 176.40 1k9m h PRO 121 N 6.99 0.35 -0.17 4.34 0.11 -1.91 -2.78 132.00 138.94 1k9m h PRO 121 Ca 0.07 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 1k9m h PRO 121 Cb 0.94 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 1k9m h PRO 121 CO 0.78 0.23 0.09 -0.44 -0.21 0.00 0.00 178.00 178.45 1k9m h ASP 122 N 0.36 0.22 -0.69 -2.05 5.19 -1.97 0.10 116.42 117.57 1k9m h ASP 122 Ca 0.27 -0.11 0.10 0.00 -0.62 0.00 0.00 57.03 56.67 1k9m h ASP 122 Cb 0.32 -0.06 -0.07 0.00 0.18 0.00 0.00 39.33 39.70 1k9m h ASP 122 CO -0.28 0.26 0.33 0.00 -3.12 0.00 0.00 179.24 176.43 1k9m h ALA 123 N 0.96 0.95 0.24 3.45 0.00 -1.96 1.04 119.26 123.95 1k9m h ALA 123 Ca 0.06 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1k9m h ALA 123 Cb 0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1k9m h ALA 123 CO -0.01 -0.08 -0.13 0.00 0.00 0.00 0.00 179.25 179.03 1k9m h ALA 124 N 1.43 -0.35 -0.85 0.00 0.00 -1.22 0.15 119.26 118.43 1k9m h ALA 124 Ca 0.34 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.28 1k9m h ALA 124 Cb 0.38 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1k9m h ALA 124 CO -0.28 -0.70 0.55 1.49 0.00 0.00 0.00 179.25 180.31 1k9m h GLU 125 N -0.35 0.79 0.31 0.00 4.81 0.60 -1.24 114.58 119.51 1k9m h GLU 125 Ca -0.03 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1k9m h GLU 125 Cb 0.28 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.49 1k9m h GLU 125 CO 0.04 0.53 -0.15 1.49 -0.73 0.00 0.00 179.01 180.18 1k9m h GLU 126 N 0.82 -0.41 -1.00 1.92 4.81 0.18 -2.11 114.58 118.79 1k9m h GLU 126 Ca 0.39 0.03 0.22 0.00 -0.13 0.00 0.00 59.36 59.87 1k9m h GLU 126 Cb 0.43 0.09 -0.11 0.00 0.63 0.00 0.00 28.75 29.78 1k9m h GLU 126 CO -0.16 -0.10 0.61 0.37 -0.73 0.00 0.00 179.01 178.99 1k9m h GLN 127 N -0.72 0.65 0.09 1.92 4.15 -0.06 0.11 115.11 121.25 1k9m h GLN 127 Ca -0.04 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.33 1k9m h GLN 127 Cb 0.49 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1k9m h GLN 127 CO 0.07 0.43 -0.04 0.82 -1.93 0.00 0.00 178.83 178.18 1k9m h ILE 128 N 0.67 1.12 -0.35 2.39 2.04 -1.16 -1.73 117.51 120.49 1k9m h ILE 128 Ca 0.61 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1k9m h ILE 128 Cb 1.06 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 1k9m h ILE 128 CO -0.42 0.20 0.17 0.03 0.00 0.00 0.00 178.15 178.13 1k9m h ARG 129 N -0.49 0.48 -0.50 2.37 3.08 -0.58 0.24 114.38 118.98 1k9m h ARG 129 Ca -0.01 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 1k9m h ARG 129 Cb 0.41 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 1k9m h ARG 129 CO 0.02 0.38 -0.01 -0.44 -1.07 0.00 0.00 179.97 178.84 1k9m h ASP 130 N 0.49 0.88 -0.55 7.04 3.32 -0.72 0.86 116.42 127.74 1k9m h ASP 130 Ca 0.13 -0.31 0.02 0.00 0.02 0.00 0.00 57.03 56.89 1k9m h ASP 130 Cb 0.05 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.33 1k9m h ASP 130 CO -0.02 0.98 0.33 0.00 -1.72 0.00 0.00 179.24 178.81 1k9m h ALA 131 N 0.93 0.70 -0.59 3.45 0.00 -0.08 -0.74 119.26 122.93 1k9m h ALA 131 Ca 0.14 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1k9m h ALA 131 Cb 0.53 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1k9m h ALA 131 CO 0.03 0.05 0.10 1.25 0.00 0.00 0.00 179.25 180.68 1k9m h HIS 132 N 0.66 1.01 -0.77 0.00 -0.00 -0.30 0.23 115.15 115.99 1k9m h HIS 132 Ca 0.22 -0.12 0.04 0.00 -0.00 0.00 0.00 60.37 60.50 1k9m h HIS 132 Cb 0.01 -0.28 -0.05 0.00 -0.00 0.00 0.00 27.41 27.09 1k9m h HIS 132 CO -0.06 0.86 0.48 0.93 -0.00 0.00 0.00 177.93 180.14 1k9m h GLU 133 N 0.90 0.89 0.00 5.26 5.08 0.27 -0.70 114.58 126.28 1k9m h GLU 133 Ca 0.19 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1k9m h GLU 133 Cb 0.39 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1k9m h GLU 133 CO 0.01 0.59 0.00 0.00 -1.00 0.00 0.00 179.01 178.61 1k9m h ALA 134 N 1.34 1.00 -0.65 3.43 0.00 -0.66 -3.47 119.26 120.25 1k9m h ALA 134 Ca 0.32 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 1k9m h ALA 134 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1k9m h ALA 134 CO -0.13 0.00 -0.07 0.41 0.00 0.00 0.00 179.25 179.46 1k9m n GLY 135 N 0.71 0.37 0.57 0.00 0.00 -0.00 -4.95 105.19 101.89 1k9m n GLY 135 Ca 0.04 -0.73 0.06 0.00 0.00 0.00 0.00 46.02 45.38 1k9m n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1k9m n ASP 136 N 1.36 2.51 -4.65 1.61 8.00 -0.75 -4.98 116.55 119.66 1k9m n ASP 136 Ca -0.02 -1.77 -0.43 0.00 0.71 0.00 0.00 54.79 53.28 1k9m n ASP 136 Cb 0.52 -0.13 -0.02 0.00 -0.02 0.00 0.00 41.12 41.46 1k9m n ASP 136 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1k9m s LEU 137 N -0.98 4.12 0.67 0.64 2.96 -1.24 -0.06 118.68 124.79 1k9m s LEU 137 Ca 0.19 1.70 -0.03 0.00 -0.22 0.00 0.00 54.13 55.78 1k9m s LEU 137 Cb 0.11 -3.54 0.07 0.00 0.50 0.00 0.00 46.19 43.34 1k9m s LEU 137 CO 0.15 -0.91 0.95 -0.83 -1.32 0.00 0.00 176.35 174.39 1k9m s GLY 138 N 2.66 1.76 0.81 7.98 0.00 0.98 -4.74 107.32 116.77 1k9m s GLY 138 Ca 0.61 -1.26 -0.20 0.00 0.00 0.00 0.00 44.72 43.87 1k9m s GLY 138 CO 0.21 -0.84 -1.07 2.09 0.00 0.00 0.00 173.10 173.48 1k9m n ASP 139 N -2.76 -3.25 -4.20 1.64 5.75 -1.26 -4.10 116.55 108.37 1k9m n ASP 139 Ca 0.10 0.05 -0.29 0.00 -0.01 0.00 0.00 54.79 54.63 1k9m n ASP 139 Cb 0.60 -0.47 -0.16 0.00 -1.03 0.00 0.00 41.12 40.05 1k9m n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1k9m s LEU 140 N 6.50 1.99 0.05 -2.12 1.43 -1.26 -3.33 118.68 121.94 1k9m s LEU 140 Ca 0.30 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 1k9m s LEU 140 Cb 0.01 -1.22 -0.03 0.00 0.03 0.00 0.00 46.19 44.99 1k9m s LEU 140 CO 0.58 0.19 -0.06 -0.13 0.23 0.00 0.00 176.35 177.15 1k9m s ARG 141 N 0.05 0.55 -0.15 1.70 0.52 -0.90 0.13 118.95 120.86 1k9m s ARG 141 Ca -0.07 -0.88 -0.05 0.00 -0.52 0.00 0.00 55.73 54.21 1k9m s ARG 141 Cb -0.14 -0.16 -0.04 0.00 0.52 0.00 0.00 34.95 35.14 1k9m s ARG 141 CO 0.04 0.00 0.03 -0.51 0.02 0.00 0.00 175.30 174.89 1k9m s LEU 142 N -1.95 3.68 -0.16 2.53 1.43 0.75 0.57 118.68 125.53 1k9m s LEU 142 Ca -0.06 0.08 -0.29 0.00 -1.03 0.00 0.00 54.13 52.84 1k9m s LEU 142 Cb -0.06 -1.90 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 1k9m s LEU 142 CO -0.02 0.25 1.17 -0.63 0.23 0.00 0.00 176.35 177.34 1k9m s ILE 143 N -0.07 4.44 0.15 -0.59 -1.09 0.13 -1.68 121.20 122.48 1k9m s ILE 143 Ca 0.05 1.74 0.09 0.00 -2.23 0.00 0.00 60.65 60.30 1k9m s ILE 143 Cb -0.12 -4.12 -0.04 0.00 -1.58 0.00 0.00 42.46 36.60 1k9m s ILE 143 CO 0.02 -0.12 -0.20 -0.89 -1.23 0.00 0.00 174.94 172.52 1k9m s THR 144 N 3.08 1.86 0.10 2.92 2.01 -0.04 -1.06 115.64 124.50 1k9m s THR 144 Ca 0.51 -1.82 -0.07 0.00 0.31 0.00 0.00 61.69 60.62 1k9m s THR 144 Cb -0.20 -1.79 -0.01 0.00 0.01 0.00 0.00 72.50 70.50 1k9m s THR 144 CO 0.14 -0.21 0.17 -1.38 -0.69 0.00 0.00 174.62 172.65 1k9m s HIS 145 N -1.72 0.31 0.39 4.92 -3.43 -1.15 0.04 115.29 114.64 1k9m s HIS 145 Ca 0.13 -0.74 0.07 0.00 -0.80 0.00 0.00 55.06 53.73 1k9m s HIS 145 Cb -0.07 -0.14 -0.00 0.00 -1.43 0.00 0.00 32.58 30.94 1k9m s HIS 145 CO 0.06 -0.56 0.50 0.95 -2.00 0.00 0.00 174.74 173.70 1k9m s THR 146 N -3.91 3.34 -0.63 -5.38 -4.23 -0.75 -2.54 115.64 101.53 1k9m s THR 146 Ca 0.09 -1.05 0.06 0.00 -1.18 0.00 0.00 61.69 59.61 1k9m s THR 146 Cb 0.05 -3.14 0.21 0.00 1.34 0.00 0.00 72.50 70.96 1k9m s THR 146 CO -0.08 -0.06 0.61 0.52 -0.54 0.00 0.00 174.62 175.07 1k9m n VAL 147 N -1.73 1.63 -0.03 2.29 0.31 -1.26 -4.35 118.33 115.20 1k9m n VAL 147 Ca 0.04 -4.88 0.24 0.00 -0.01 0.00 0.00 64.34 59.73 1k9m n VAL 147 Cb 0.59 -2.10 0.72 0.00 -0.91 0.00 0.00 33.84 32.14 1k9m n VAL 147 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1k9m h PRO 148 N 4.72 0.00 0.00 5.55 0.11 -1.81 0.21 132.00 140.78 1k9m h PRO 148 Ca 0.17 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 1k9m h PRO 148 Cb 0.73 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.83 1k9m h PRO 148 CO 0.73 0.00 -0.11 0.22 -0.21 0.00 0.00 178.00 178.63 1k9m h ASP 149 N 0.00 0.00 1.22 -2.05 3.58 -1.81 -0.25 116.42 117.11 1k9m h ASP 149 Ca 0.30 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.73 1k9m h ASP 149 Cb 1.44 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.49 1k9m h ASP 149 CO -0.00 0.11 -0.12 0.00 -2.88 0.00 0.00 179.24 176.35 1k9m h ALA 150 N 1.89 0.98 -2.82 -0.78 0.00 -0.95 -3.39 119.26 114.20 1k9m h ALA 150 Ca -0.00 -0.11 -0.72 0.00 0.00 0.00 0.00 54.91 54.08 1k9m h ALA 150 Cb 0.40 -0.02 -0.31 0.00 0.00 0.00 0.00 17.79 17.86 1k9m h ALA 150 CO 0.01 0.15 -0.40 0.08 0.00 0.00 0.00 179.25 179.08 1k9m s VAL 151 N -3.51 4.00 0.18 0.00 1.01 -0.11 -4.98 120.40 116.99 1k9m s VAL 151 Ca 0.02 -2.00 -0.13 0.00 0.00 0.00 0.00 61.98 59.87 1k9m s VAL 151 Cb 0.08 -3.65 0.07 0.00 0.00 0.00 0.00 36.38 32.89 1k9m s VAL 151 CO 0.62 -0.78 1.77 -0.65 0.00 0.00 0.00 175.10 176.06 1k9m h PRO 152 N 8.19 0.43 -0.03 2.72 0.11 -1.77 -2.35 132.00 139.30 1k9m h PRO 152 Ca -0.16 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.93 1k9m h PRO 152 Cb 1.05 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 1k9m h PRO 152 CO 0.80 0.29 0.12 0.77 -0.21 0.00 0.00 178.00 179.77 1k9m h SER 153 N 0.45 0.00 -3.67 -2.05 0.02 -1.85 -3.39 113.55 103.06 1k9m h SER 153 Ca 0.22 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.49 1k9m h SER 153 Cb 0.16 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 62.51 1k9m h SER 153 CO -0.17 0.00 -0.43 -0.69 -1.14 0.00 0.00 176.83 174.40 1k9m s VAL 154 N -4.25 5.26 0.30 2.27 1.01 -0.89 -4.85 120.40 119.25 1k9m s VAL 154 Ca -0.05 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 61.76 1k9m s VAL 154 Cb 0.12 -3.77 0.29 0.00 0.00 0.00 0.00 36.38 33.03 1k9m s VAL 154 CO 0.41 -0.07 1.75 -0.65 0.00 0.00 0.00 175.10 176.53 1k9m h PRO 155 N 8.51 0.63 -7.00 2.72 0.11 -1.83 -3.44 132.00 131.69 1k9m h PRO 155 Ca -0.30 -0.04 -0.51 0.00 0.11 0.00 0.00 66.00 65.26 1k9m h PRO 155 Cb 1.15 -0.14 0.07 0.00 0.11 0.00 0.00 31.00 32.19 1k9m h PRO 155 CO 0.66 0.41 0.49 -1.59 -0.21 0.00 0.00 178.00 177.77 1k9m s LYS 156 N -5.86 3.73 -0.03 1.05 -2.85 -1.26 -4.92 119.74 109.61 1k9m s LYS 156 Ca -0.11 1.81 0.03 0.00 -1.00 0.00 0.00 55.97 56.70 1k9m s LYS 156 Cb 0.25 -2.41 -0.04 0.00 -2.06 0.00 0.00 37.83 33.57 1k9m s LYS 156 CO 0.79 -0.58 0.02 1.63 0.10 0.00 0.00 175.35 177.31 1k9m n LYS 157 N -0.50 2.96 -1.64 1.78 5.02 -1.26 -4.08 118.16 120.44 1k9m n LYS 157 Ca 0.07 -0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.93 1k9m n LYS 157 Cb 0.48 -1.09 -0.03 0.00 -0.02 0.00 0.00 35.03 34.37 1k9m n LYS 157 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1k9m n LYS 158 N -2.05 2.59 -2.18 1.97 4.81 -1.26 -4.57 118.16 117.47 1k9m n LYS 158 Ca -0.05 0.89 -0.34 0.00 -0.87 0.00 0.00 58.31 57.94 1k9m n LYS 158 Cb 0.53 -3.09 0.01 0.00 0.02 0.00 0.00 35.03 32.50 1k9m n LYS 158 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1k9m s PRO 159 N 5.09 3.29 -0.18 1.64 0.02 -1.26 -4.84 135.00 138.77 1k9m s PRO 159 Ca 0.93 1.51 -0.13 0.00 0.02 0.00 0.00 61.00 63.33 1k9m s PRO 159 Cb -0.40 -2.01 -0.05 0.00 0.02 0.00 0.00 34.50 32.07 1k9m s PRO 159 CO 0.40 -0.88 0.24 -0.51 -0.33 0.00 0.00 177.00 175.93 1k9m s ASP 160 N -2.03 6.35 -0.12 2.53 1.01 -1.26 -4.87 116.67 118.28 1k9m s ASP 160 Ca 0.70 0.41 -0.03 0.00 0.71 0.00 0.00 52.55 54.34 1k9m s ASP 160 Cb -0.22 -2.15 -0.03 0.00 1.01 0.00 0.00 42.92 41.53 1k9m s ASP 160 CO 0.30 0.11 -0.01 -0.69 0.21 0.00 0.00 175.17 175.09 1k9m s VAL 161 N 0.51 4.15 -0.04 -1.27 1.01 -1.26 -1.82 120.40 121.68 1k9m s VAL 161 Ca 0.14 -0.29 -0.20 0.00 0.00 0.00 0.00 61.98 61.63 1k9m s VAL 161 Cb -0.12 -2.79 0.04 0.00 0.00 0.00 0.00 36.38 33.51 1k9m s VAL 161 CO 0.02 0.54 0.44 0.00 0.00 0.00 0.00 175.10 176.11 1k9m s MET 162 N -0.23 0.79 -0.07 2.72 0.23 0.11 -4.99 119.30 117.85 1k9m s MET 162 Ca 0.05 0.02 -0.16 0.00 -1.03 0.00 0.00 55.69 54.56 1k9m s MET 162 Cb -0.13 0.36 -0.05 0.00 -1.53 0.00 0.00 34.83 33.49 1k9m s MET 162 CO 0.02 -0.22 0.43 -2.00 -2.03 0.00 0.00 175.02 171.22 1k9m s GLU 163 N -1.17 4.17 -0.03 3.16 2.12 -1.26 -0.86 118.70 124.83 1k9m s GLU 163 Ca -0.12 0.40 0.04 0.00 0.36 0.00 0.00 54.97 55.65 1k9m s GLU 163 Cb -0.03 -3.35 -0.01 0.00 0.26 0.00 0.00 34.13 31.01 1k9m s GLU 163 CO 0.06 0.39 -0.14 0.99 -0.54 0.00 0.00 175.26 176.01 1k9m s THR 164 N -0.11 1.18 0.49 -1.70 2.01 -0.68 -4.94 115.64 111.89 1k9m s THR 164 Ca 0.24 -0.60 -0.20 0.00 0.31 0.00 0.00 61.69 61.43 1k9m s THR 164 Cb -0.16 -1.01 -0.08 0.00 0.01 0.00 0.00 72.50 71.27 1k9m s THR 164 CO 0.11 0.34 1.06 -0.60 -0.69 0.00 0.00 174.62 174.84 1k9m s ARG 165 N -0.09 3.74 -0.30 4.92 3.52 -1.26 -0.17 118.95 129.31 1k9m s ARG 165 Ca 0.00 1.44 -0.00 0.00 -0.13 0.00 0.00 55.73 57.04 1k9m s ARG 165 Cb -0.08 -2.12 0.06 0.00 -1.56 0.00 0.00 34.95 31.24 1k9m s ARG 165 CO 0.01 -0.49 -0.01 0.08 -0.81 0.00 0.00 175.30 174.07 1k9m s VAL 166 N -1.90 2.73 -0.12 7.11 1.01 0.12 -0.02 120.40 129.33 1k9m s VAL 166 Ca 0.67 -1.56 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 1k9m s VAL 166 Cb -0.19 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 1k9m s VAL 166 CO 0.22 -0.16 0.02 -0.83 0.00 0.00 0.00 175.10 174.36 1k9m s GLY 167 N 1.23 1.87 0.16 4.51 0.00 -0.85 -4.41 107.32 109.82 1k9m s GLY 167 Ca -0.04 -0.78 -0.04 0.00 0.00 0.00 0.00 44.72 43.86 1k9m s GLY 167 CO -0.03 -0.32 0.28 0.61 0.00 0.00 0.00 173.10 173.65 1k9m n GLY 168 N 2.70 1.97 0.00 0.20 0.00 -1.26 -1.02 105.19 107.78 1k9m n GLY 168 Ca -0.18 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1k9m n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k9m n GLY 169 N -0.23 -0.95 3.93 -0.02 0.00 -1.18 -4.73 105.19 102.01 1k9m n GLY 169 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 1k9m n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k9m s SER 170 N -2.56 5.12 0.17 1.61 1.04 -1.26 -4.91 113.70 112.91 1k9m s SER 170 Ca 0.00 0.52 -0.08 0.00 0.48 0.00 0.00 55.95 56.87 1k9m s SER 170 Cb 0.00 -1.31 0.05 0.00 0.10 0.00 0.00 66.02 64.86 1k9m s SER 170 CO 0.00 -1.38 1.55 -0.37 0.98 0.00 0.00 173.24 174.02 1k9m h VAL 171 N -0.41 1.27 0.02 5.02 -1.51 -1.99 -1.55 116.25 117.11 1k9m h VAL 171 Ca -0.45 -1.45 -0.00 0.00 -1.23 0.00 0.00 66.70 63.57 1k9m h VAL 171 Cb 1.29 1.26 0.00 0.00 -2.13 0.00 0.00 31.29 31.72 1k9m h VAL 171 CO 0.60 0.49 -0.01 0.28 -1.23 0.00 0.00 177.57 177.70 1k9m h SER 172 N 0.75 -0.02 -0.34 4.19 0.02 -1.98 0.16 113.55 116.33 1k9m h SER 172 Ca 0.08 -0.20 0.02 0.00 -0.84 0.00 0.00 61.79 60.85 1k9m h SER 172 Cb 0.85 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.38 1k9m h SER 172 CO 0.08 0.19 0.19 0.44 -1.14 0.00 0.00 176.83 176.59 1k9m h ASP 173 N -0.24 0.30 1.23 3.07 3.32 -1.92 -1.84 116.42 120.34 1k9m h ASP 173 Ca -0.00 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1k9m h ASP 173 Cb 0.23 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1k9m h ASP 173 CO 0.00 0.22 -0.42 0.08 -1.72 0.00 0.00 179.24 177.41 1k9m h ARG 174 N 0.39 0.00 -0.18 3.56 0.11 -1.24 -0.28 114.38 116.74 1k9m h ARG 174 Ca 0.14 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.20 1k9m h ARG 174 Cb 0.01 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.09 1k9m h ARG 174 CO -0.07 0.42 0.07 1.25 0.10 0.00 0.00 179.97 181.74 1k9m h LEU 175 N 0.00 0.25 0.17 0.08 6.46 -0.40 0.17 115.31 122.04 1k9m h LEU 175 Ca -0.00 -0.17 -0.01 0.00 -0.12 0.00 0.00 57.88 57.58 1k9m h LEU 175 Cb 1.15 -0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 41.01 1k9m h LEU 175 CO 0.05 0.36 -0.09 0.44 -0.62 0.00 0.00 178.44 178.58 1k9m h ASP 176 N 0.13 -0.23 -1.00 1.25 3.32 -1.16 -1.58 116.42 117.14 1k9m h ASP 176 Ca 0.06 0.01 0.24 0.00 0.02 0.00 0.00 57.03 57.36 1k9m h ASP 176 Cb 0.19 0.07 -0.12 0.00 0.22 0.00 0.00 39.33 39.68 1k9m h ASP 176 CO -0.00 -0.16 0.60 -0.74 -1.72 0.00 0.00 179.24 177.22 1k9m h HIS 177 N -0.25 1.03 0.83 4.55 2.76 -0.68 0.30 115.15 123.69 1k9m h HIS 177 Ca -0.02 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.15 1k9m h HIS 177 Cb 0.20 -0.30 0.01 0.00 1.55 0.00 0.00 27.41 28.87 1k9m h HIS 177 CO -0.08 0.10 -0.40 0.00 -1.30 0.00 0.00 177.93 176.25 1k9m h ALA 178 N 1.72 -1.12 -0.89 5.26 0.00 0.06 -2.41 119.26 121.87 1k9m h ALA 178 Ca 0.63 -0.25 0.21 0.00 0.00 0.00 0.00 54.91 55.50 1k9m h ALA 178 Cb 1.17 0.43 -0.12 0.00 0.00 0.00 0.00 17.79 19.27 1k9m h ALA 178 CO -0.46 -1.07 0.41 -0.07 0.00 0.00 0.00 179.25 178.07 1k9m h LEU 179 N -1.24 0.39 0.01 0.00 3.38 -0.27 0.03 115.31 117.61 1k9m h LEU 179 Ca -0.11 0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1k9m h LEU 179 Cb 0.87 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1k9m h LEU 179 CO 0.19 0.05 -0.04 0.44 0.09 0.00 0.00 178.44 179.17 1k9m h ASP 180 N 0.46 -0.11 0.09 -0.43 3.32 -0.87 0.39 116.42 119.27 1k9m h ASP 180 Ca 0.54 0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.63 1k9m h ASP 180 Cb 0.98 0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.54 1k9m h ASP 180 CO -0.49 -0.06 -0.26 0.40 -1.72 0.00 0.00 179.24 177.11 1k9m h ILE 181 N -0.08 0.43 0.43 0.35 2.04 -0.52 -3.02 117.51 117.15 1k9m h ILE 181 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 1k9m h ILE 181 Cb 0.09 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1k9m h ILE 181 CO -0.03 0.00 -0.39 0.58 0.00 0.00 0.00 178.15 178.31 1k9m h VAL 182 N -0.45 0.00 -0.90 1.67 2.07 -1.07 -2.42 116.25 115.15 1k9m h VAL 182 Ca 0.04 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.76 1k9m h VAL 182 Cb 0.49 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.09 1k9m h VAL 182 CO -0.16 0.00 -0.13 -0.62 0.02 0.00 0.00 177.57 176.67 1k9m n GLU 183 N -4.79 -0.08 0.00 1.57 -0.58 0.11 -2.56 120.64 114.32 1k9m n GLU 183 Ca -0.10 1.39 0.00 0.00 -0.42 0.00 0.00 57.16 58.03 1k9m n GLU 183 Cb 0.36 -2.12 0.00 0.00 -0.57 0.00 0.00 31.44 29.12 1k9m n GLU 183 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1k9m n ASP 184 N -5.41 0.00 0.00 1.62 8.00 -1.14 -4.77 116.55 114.84 1k9m n ASP 184 Ca 0.17 0.44 0.00 0.00 0.71 0.00 0.00 54.79 56.11 1k9m n ASP 184 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 1k9m n ASP 184 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k9m n GLY 185 N -0.67 0.72 3.52 0.44 0.00 -1.06 -4.91 105.19 103.22 1k9m n GLY 185 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1k9m n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k9m n GLY 186 N 0.00 2.00 3.61 -0.02 0.00 -0.92 -4.51 105.19 105.36 1k9m n GLY 186 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1k9m n GLY 186 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1k9m n GLU 187 N -2.00 2.13 -3.99 1.61 2.13 -1.26 -0.83 120.64 118.44 1k9m n GLU 187 Ca 0.00 0.69 -0.08 0.00 0.66 0.00 0.00 57.16 58.43 1k9m n GLU 187 Cb 0.00 -2.96 -0.09 0.00 0.27 0.00 0.00 31.44 28.66 1k9m n GLU 187 CO 0.00 0.00 0.00 -3.38 -0.41 0.00 0.00 177.13 173.34 1k9m s HIS 188 N 6.31 0.34 0.25 4.31 -3.43 -0.79 -4.98 115.29 117.30 1k9m s HIS 188 Ca 0.97 -0.78 0.05 0.00 -0.80 0.00 0.00 55.06 54.50 1k9m s HIS 188 Cb -0.50 -0.24 -0.05 0.00 -1.43 0.00 0.00 32.58 30.35 1k9m s HIS 188 CO 0.42 -0.41 -0.03 0.00 -2.00 0.00 0.00 174.74 172.73 1k9m s ALA 189 N -3.45 2.07 0.40 -1.38 0.00 -1.26 -1.53 121.76 116.61 1k9m s ALA 189 Ca 0.02 -1.83 0.18 0.00 0.00 0.00 0.00 51.96 50.34 1k9m s ALA 189 Cb 0.04 0.34 1.10 0.00 0.00 0.00 0.00 23.12 24.60 1k9m s ALA 189 CO -0.08 -0.16 1.77 1.98 0.00 0.00 0.00 175.76 179.26 1k9m h MET 190 N 2.38 0.38 -0.56 0.00 4.05 -1.87 0.21 114.93 119.52 1k9m h MET 190 Ca -0.39 -0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.04 1k9m h MET 190 Cb 1.23 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.90 1k9m h MET 190 CO 0.66 0.25 0.33 -0.91 0.23 0.00 0.00 176.91 177.47 1k9m h ASN 191 N 0.39 0.52 0.05 1.39 2.35 -1.96 0.92 115.58 119.25 1k9m h ASN 191 Ca 0.59 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.35 1k9m h ASN 191 Cb 1.51 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.78 1k9m h ASN 191 CO -0.30 0.36 0.00 0.47 -1.65 0.00 0.00 177.43 176.32 1k9m n ASP 192 N -4.78 0.35 0.00 5.81 8.00 0.75 -3.62 116.55 123.05 1k9m n ASP 192 Ca 0.05 0.66 0.00 0.00 0.71 0.00 0.00 54.79 56.21 1k9m n ASP 192 Cb 0.10 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.49 1k9m n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1k9m n ILE 193 N -1.96 0.00 -4.29 0.53 5.41 -0.90 -4.92 119.36 113.23 1k9m n ILE 193 Ca -0.01 0.00 -0.25 0.00 1.00 0.00 0.00 62.75 63.50 1k9m n ILE 193 Cb 0.04 -0.71 -0.08 0.00 -0.71 0.00 0.00 39.64 38.17 1k9m n ILE 193 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1k9m s PHE 194 N -1.90 2.68 -0.05 1.39 0.40 0.27 -5.06 117.98 115.71 1k9m s PHE 194 Ca 0.00 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1k9m s PHE 194 Cb 0.00 -1.24 0.02 0.00 0.51 0.00 0.00 43.02 42.30 1k9m s PHE 194 CO 0.00 0.57 -0.08 0.50 0.70 0.00 0.00 175.22 176.91 1k9m s ARG 195 N -3.27 1.25 0.03 0.44 6.06 -1.26 -4.36 118.95 117.83 1k9m s ARG 195 Ca 0.29 -0.26 -0.38 0.00 -2.50 0.00 0.00 55.73 52.87 1k9m s ARG 195 Cb -0.08 -1.10 -0.17 0.00 0.06 0.00 0.00 34.95 33.66 1k9m s ARG 195 CO 0.18 -0.01 1.35 0.00 -2.50 0.00 0.00 175.30 174.32 1k9m n ALA 196 N 3.87 -1.26 0.00 6.12 0.00 -1.26 -1.75 120.51 126.22 1k9m n ALA 196 Ca -0.24 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1k9m n ALA 196 Cb 0.51 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.92 1k9m n ALA 196 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k9m n GLY 197 N 2.58 1.83 3.79 0.00 0.00 0.26 -0.35 105.19 113.32 1k9m n GLY 197 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1k9m n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k9m s GLU 198 N -0.14 1.93 -0.14 1.61 2.02 -0.72 -3.82 118.70 119.44 1k9m s GLU 198 Ca 0.00 0.63 -0.06 0.00 0.02 0.00 0.00 54.97 55.56 1k9m s GLU 198 Cb 0.00 -1.90 -0.04 0.00 0.10 0.00 0.00 34.13 32.29 1k9m s GLU 198 CO 0.00 -1.73 0.10 0.71 0.02 0.00 0.00 175.26 174.36 1k9m s TYR 199 N -3.14 3.42 0.06 1.61 1.51 -1.26 -0.86 117.35 118.69 1k9m s TYR 199 Ca 0.61 0.35 0.03 0.00 -1.01 0.00 0.00 57.07 57.04 1k9m s TYR 199 Cb -0.15 -1.97 -0.03 0.00 -0.11 0.00 0.00 41.96 39.70 1k9m s TYR 199 CO 0.54 0.51 -0.08 0.00 -1.11 0.00 0.00 175.55 175.41 1k9m s ALA 200 N -0.53 0.78 -0.27 3.71 0.00 0.25 -2.15 121.76 123.54 1k9m s ALA 200 Ca 0.11 -0.98 -0.12 0.00 0.00 0.00 0.00 51.96 50.98 1k9m s ALA 200 Cb -0.12 0.06 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 1k9m s ALA 200 CO 0.02 -0.06 0.24 -0.51 0.00 0.00 0.00 175.76 175.45 1k9m s ASP 201 N -2.05 6.10 -0.28 0.00 1.01 0.32 0.19 116.67 121.97 1k9m s ASP 201 Ca -0.02 0.10 -0.09 0.00 0.71 0.00 0.00 52.55 53.24 1k9m s ASP 201 Cb -0.05 -2.14 -0.03 0.00 1.01 0.00 0.00 42.92 41.70 1k9m s ASP 201 CO -0.01 -0.07 0.13 -0.69 0.21 0.00 0.00 175.17 174.75 1k9m s VAL 202 N 1.72 4.70 0.28 -1.27 1.01 -0.76 -2.02 120.40 124.06 1k9m s VAL 202 Ca 0.09 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 62.00 1k9m s VAL 202 Cb -0.16 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 1k9m s VAL 202 CO 0.10 0.24 0.32 0.00 0.00 0.00 0.00 175.10 175.75 1k9m s ALA 203 N 1.66 3.86 0.00 5.51 0.00 -0.61 -0.44 121.76 131.74 1k9m s ALA 203 Ca 0.06 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.60 1k9m s ALA 203 Cb -0.16 -1.47 0.00 0.00 0.00 0.00 0.00 23.12 21.50 1k9m s ALA 203 CO 0.07 0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.38 1k9m n GLY 204 N -1.37 1.71 3.53 0.00 0.00 -0.43 -1.95 105.19 106.67 1k9m n GLY 204 Ca -0.05 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 1k9m n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k9m s VAL 205 N -2.00 4.98 1.09 1.61 1.01 -1.26 -0.98 120.40 124.86 1k9m s VAL 205 Ca 0.00 0.11 -0.20 0.00 0.00 0.00 0.00 61.98 61.89 1k9m s VAL 205 Cb 0.00 -4.05 0.06 0.00 0.00 0.00 0.00 36.38 32.39 1k9m s VAL 205 CO 0.00 -0.37 -0.21 0.35 0.00 0.00 0.00 175.10 174.87 1k9m n THR 206 N 5.55 0.00 -2.15 3.92 -2.24 0.14 -3.82 114.28 115.68 1k9m n THR 206 Ca -0.04 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.06 1k9m n THR 206 Cb 0.48 -0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.17 1k9m n THR 206 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1k9m s LYS 207 N -3.23 4.31 0.36 -0.78 1.02 -1.26 -2.59 119.74 117.56 1k9m s LYS 207 Ca 0.53 2.09 -0.25 0.00 0.02 0.00 0.00 55.97 58.36 1k9m s LYS 207 Cb -0.09 -3.28 -0.10 0.00 -0.52 0.00 0.00 37.83 33.85 1k9m s LYS 207 CO 0.66 -0.47 0.99 0.20 -0.92 0.00 0.00 175.35 175.82 1k9m s GLY 208 N 1.20 2.75 -0.00 -3.33 0.00 -1.26 -2.89 107.32 103.78 1k9m s GLY 208 Ca 0.65 0.60 0.00 0.00 0.00 0.00 0.00 44.72 45.97 1k9m s GLY 208 CO 0.30 1.02 0.67 0.28 0.00 0.00 0.00 173.10 175.38 1k9m n LYS 209 N 0.23 0.88 0.00 2.90 5.02 -0.75 -4.85 118.16 121.60 1k9m n LYS 209 Ca 0.03 -0.84 0.00 0.00 -2.02 0.00 0.00 58.31 55.48 1k9m n LYS 209 Cb 0.50 -0.66 0.00 0.00 -0.02 0.00 0.00 35.03 34.85 1k9m n LYS 209 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k9m n GLY 210 N -0.17 0.29 3.78 0.72 0.00 -1.21 -4.65 105.19 103.95 1k9m n GLY 210 Ca 0.00 -0.87 -0.39 0.00 0.00 0.00 0.00 46.02 44.76 1k9m n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k9m s THR 211 N 0.00 4.33 0.09 2.61 -4.23 -1.26 -1.21 115.64 115.97 1k9m s THR 211 Ca 0.00 1.72 -0.01 0.00 -1.18 0.00 0.00 61.69 62.22 1k9m s THR 211 Cb 0.00 -4.12 -0.04 0.00 1.34 0.00 0.00 72.50 69.68 1k9m s THR 211 CO 0.00 0.44 0.02 -1.10 -0.54 0.00 0.00 174.62 173.44 1k9m s GLN 212 N -1.36 0.79 0.68 3.99 -1.52 -0.50 -4.92 119.66 116.81 1k9m s GLN 212 Ca 0.39 -1.34 -0.10 0.00 -1.95 0.00 0.00 55.36 52.36 1k9m s GLN 212 Cb -0.22 0.22 0.01 0.00 -0.22 0.00 0.00 33.01 32.80 1k9m s GLN 212 CO 0.26 -0.19 1.05 0.20 -0.25 0.00 0.00 175.29 176.36 1k9m s GLY 213 N -2.99 1.62 0.19 3.09 0.00 -1.26 -2.52 107.32 105.46 1k9m s GLY 213 Ca 0.16 -0.43 -0.13 0.00 0.00 0.00 0.00 44.72 44.33 1k9m s GLY 213 CO -0.04 -0.08 1.68 -2.55 0.00 0.00 0.00 173.10 172.12 1k9m h PRO 214 N -0.53 0.13 -0.43 2.90 0.11 -1.84 0.73 132.00 133.06 1k9m h PRO 214 Ca -0.45 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.72 1k9m h PRO 214 Cb 1.25 -0.03 -0.09 0.00 0.11 0.00 0.00 31.00 32.24 1k9m h PRO 214 CO 0.63 0.08 -0.45 0.28 -0.21 0.00 0.00 178.00 178.33 1k9m h VAL 215 N 0.13 0.09 0.04 3.15 2.07 -1.82 1.14 116.25 121.04 1k9m h VAL 215 Ca 0.27 0.00 -0.26 0.00 0.82 0.00 0.00 66.70 67.53 1k9m h VAL 215 Cb 0.40 0.09 0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1k9m h VAL 215 CO -0.43 0.00 -1.07 0.50 0.02 0.00 0.00 177.57 176.59 1k9m h LYS 216 N -0.33 0.53 -0.10 1.57 3.64 -1.74 0.13 116.57 120.27 1k9m h LYS 216 Ca 0.13 -0.62 -0.21 0.00 -1.27 0.00 0.00 60.65 58.68 1k9m h LYS 216 Cb 0.58 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1k9m h LYS 216 CO -0.60 1.24 -0.80 -0.09 -2.27 0.00 0.00 179.45 176.94 1k9m h ARG 217 N 0.27 0.60 0.00 1.90 2.43 0.97 -3.37 114.38 117.18 1k9m h ARG 217 Ca -0.12 -0.51 0.00 0.00 -0.81 0.00 0.00 59.98 58.53 1k9m h ARG 217 Cb 1.73 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 31.39 1k9m h ARG 217 CO 0.20 1.14 0.00 0.91 -1.51 0.00 0.00 179.97 180.70 1k9m n TRP 218 N -3.87 0.00 -1.73 2.20 7.02 0.38 -5.01 117.44 116.43 1k9m n TRP 218 Ca -0.06 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.38 1k9m n TRP 218 Cb 0.75 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 29.63 1k9m n TRP 218 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1k9m n GLY 219 N 0.63 0.38 3.79 6.99 0.00 0.44 -3.01 105.19 114.42 1k9m n GLY 219 Ca 0.00 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 44.91 1k9m n GLY 219 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1k9m s VAL 220 N -2.16 3.63 0.96 1.61 -7.23 -1.24 -4.90 120.40 111.06 1k9m s VAL 220 Ca 0.00 0.53 -0.12 0.00 -1.81 0.00 0.00 61.98 60.58 1k9m s VAL 220 Cb 0.00 -3.16 0.16 0.00 0.56 0.00 0.00 36.38 33.94 1k9m s VAL 220 CO 0.00 -0.69 1.10 -1.10 -0.31 0.00 0.00 175.10 174.10 1k9m s GLN 221 N -4.99 0.78 0.36 4.82 -0.21 -1.26 -4.43 119.66 114.72 1k9m s GLN 221 Ca 0.60 0.50 0.04 0.00 0.02 0.00 0.00 55.36 56.52 1k9m s GLN 221 Cb -0.15 -1.78 -0.01 0.00 1.00 0.00 0.00 33.01 32.07 1k9m s GLN 221 CO 0.55 -2.49 0.52 0.15 -2.12 0.00 0.00 175.29 171.90 1k9m s LYS 222 N -5.05 3.16 0.35 2.91 1.02 -1.26 -4.83 119.74 116.03 1k9m s LYS 222 Ca 0.64 -0.81 -0.29 0.00 0.02 0.00 0.00 55.97 55.54 1k9m s LYS 222 Cb -0.17 -2.75 -0.11 0.00 -0.52 0.00 0.00 37.83 34.28 1k9m s LYS 222 CO 0.56 0.02 1.48 1.03 -0.92 0.00 0.00 175.35 177.52 1k9m s ARG 223 N -4.26 4.15 0.28 1.68 1.81 -0.67 -4.97 118.95 116.96 1k9m s ARG 223 Ca 0.44 2.51 0.07 0.00 -1.72 0.00 0.00 55.73 57.04 1k9m s ARG 223 Cb -0.10 -3.00 -0.03 0.00 -0.45 0.00 0.00 34.95 31.37 1k9m s ARG 223 CO 0.33 -0.50 0.25 0.15 -0.68 0.00 0.00 175.30 174.85 1k9m s LYS 224 N -1.70 2.92 1.31 3.54 -0.14 -1.26 -4.32 119.74 120.10 1k9m s LYS 224 Ca 0.54 -1.10 0.00 0.00 -1.36 0.00 0.00 55.97 54.06 1k9m s LYS 224 Cb -0.46 -2.58 0.00 0.00 -1.68 0.00 0.00 37.83 33.12 1k9m s LYS 224 CO 0.58 0.31 0.00 0.41 -0.76 0.00 0.00 175.35 175.89 1k9m n GLY 225 N -1.27 1.87 0.37 -3.33 0.00 -1.26 -1.73 105.19 99.84 1k9m n GLY 225 Ca -0.06 -0.23 0.17 0.00 0.00 0.00 0.00 46.02 45.90 1k9m n GLY 225 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1k9m h LYS 226 N 0.00 0.13 -0.23 1.61 3.64 -2.01 0.40 116.57 120.11 1k9m h LYS 226 Ca 0.00 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1k9m h LYS 226 Cb 0.00 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1k9m h LYS 226 CO 0.00 0.09 0.14 0.45 -2.27 0.00 0.00 179.45 177.86 1k9m h HIS 227 N 0.13 0.29 0.00 1.91 3.86 -1.70 -1.30 115.15 118.35 1k9m h HIS 227 Ca 0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.48 1k9m h HIS 227 Cb 0.86 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.23 1k9m h HIS 227 CO -0.00 0.20 0.00 0.00 0.86 0.00 0.00 177.93 178.99 1k9m h ALA 228 N 1.84 1.00 -0.02 2.45 0.00 -0.80 -2.88 119.26 120.86 1k9m h ALA 228 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1k9m h ALA 228 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1k9m h ALA 228 CO -0.02 0.00 -0.17 0.54 0.00 0.00 0.00 179.25 179.60 1k9m n ARG 229 N -2.41 1.55 0.15 0.00 1.74 -0.50 -4.60 116.66 112.59 1k9m n ARG 229 Ca 0.01 -1.20 0.13 0.00 -0.77 0.00 0.00 57.85 56.02 1k9m n ARG 229 Cb 0.20 -1.32 0.36 0.00 -1.02 0.00 0.00 32.46 30.69 1k9m n ARG 229 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1k9m h GLN 230 N 2.69 0.00 0.00 5.56 1.08 -1.48 -3.45 115.11 119.51 1k9m h GLN 230 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1k9m h GLN 230 Cb 0.66 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 1k9m h GLN 230 CO 0.00 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.29 1k9m n GLY 231 N 1.07 0.05 2.97 3.46 0.00 -1.26 -5.11 105.19 106.37 1k9m n GLY 231 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 1k9m n GLY 231 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1k9m s TRP 232 N -0.76 1.91 -0.00 1.61 0.51 -1.26 -5.00 118.94 115.95 1k9m s TRP 232 Ca 0.00 -1.05 -0.00 0.00 -2.12 0.00 0.00 56.10 52.93 1k9m s TRP 232 Cb 0.00 -1.46 -0.00 0.00 -0.81 0.00 0.00 33.47 31.20 1k9m s TRP 232 CO 0.00 -0.61 -0.00 0.54 -0.51 0.00 0.00 176.95 176.36 1k9m n ARG 233 N 4.84 0.01 -2.42 4.98 1.74 -1.26 -4.13 116.66 120.41 1k9m n ARG 233 Ca -0.15 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.77 1k9m n ARG 233 Cb 0.50 -0.80 0.03 0.00 -1.02 0.00 0.00 32.46 31.17 1k9m n ARG 233 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1k9m n ARG 234 N -2.72 2.73 -4.97 5.56 1.74 -1.26 -1.67 116.66 116.07 1k9m n ARG 234 Ca -0.00 -3.92 -0.29 0.00 -0.77 0.00 0.00 57.85 52.86 1k9m n ARG 234 Cb 0.50 -1.95 -0.15 0.00 -1.02 0.00 0.00 32.46 29.84 1k9m n ARG 234 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1k9m s ARG 235 N -3.59 1.80 0.70 5.56 0.52 -1.26 -4.63 118.95 118.05 1k9m s ARG 235 Ca 0.40 -1.01 -0.11 0.00 -0.52 0.00 0.00 55.73 54.49 1k9m s ARG 235 Cb 0.39 -1.89 0.01 0.00 0.52 0.00 0.00 34.95 33.98 1k9m s ARG 235 CO -0.02 0.50 1.06 0.96 0.02 0.00 0.00 175.30 177.82 1k9m s ILE 236 N -0.73 3.98 0.20 1.52 -4.36 -1.26 -4.74 121.20 115.81 1k9m s ILE 236 Ca 0.10 0.64 -0.10 0.00 -0.26 0.00 0.00 60.65 61.04 1k9m s ILE 236 Cb -0.10 -3.39 0.13 0.00 1.25 0.00 0.00 42.46 40.36 1k9m s ILE 236 CO 0.01 -0.84 1.82 1.23 0.24 0.00 0.00 174.94 177.40 1k9m h GLY 237 N -0.74 0.96 -3.74 6.27 0.00 -2.00 -3.45 103.07 100.36 1k9m h GLY 237 Ca -0.44 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 1k9m h GLY 237 CO 0.57 0.19 0.27 0.54 0.00 0.00 0.00 176.54 178.11 1k9m s ASN 238 N -5.63 -0.57 0.00 0.19 4.22 -1.26 -5.01 114.94 106.88 1k9m s ASN 238 Ca -0.13 0.42 0.20 0.00 -2.14 0.00 0.00 52.86 51.21 1k9m s ASN 238 Cb 0.16 0.51 1.07 0.00 1.28 0.00 0.00 41.25 44.26 1k9m s ASN 238 CO 0.76 -0.67 1.71 0.18 -2.04 0.00 0.00 177.10 177.04 1k9m n LEU 239 N 0.44 0.44 0.00 3.54 4.77 -1.26 -4.98 117.00 119.95 1k9m n LEU 239 Ca -0.16 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 1k9m n LEU 239 Cb 0.60 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1k9m n LEU 239 CO 0.18 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1k9m n GLY 240 N 0.89 -0.37 3.71 -0.72 0.00 -1.26 -4.39 105.19 103.05 1k9m n GLY 240 Ca 0.15 -1.69 -0.27 0.00 0.00 0.00 0.00 46.02 44.21 1k9m n GLY 240 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1k9m n PRO 241 N -1.19 -0.94 0.03 1.61 -0.04 -1.26 -5.00 135.00 128.21 1k9m n PRO 241 Ca 0.00 -2.14 -0.13 0.00 -0.04 0.00 0.00 63.50 61.19 1k9m n PRO 241 Cb 0.00 -1.13 -0.09 0.00 -0.04 0.00 0.00 33.50 32.24 1k9m n PRO 241 CO 0.00 0.00 0.00 2.35 -0.04 0.00 0.00 175.50 177.81 1k9m h TRP 242 N -1.44 -0.06 -4.27 0.54 2.91 -2.01 -3.42 115.95 108.20 1k9m h TRP 242 Ca -0.39 -0.00 -0.65 0.00 1.13 0.00 0.00 58.89 58.98 1k9m h TRP 242 Cb 1.15 0.02 -0.30 0.00 -0.51 0.00 0.00 29.16 29.51 1k9m h TRP 242 CO 0.00 0.27 -0.87 -0.80 -1.03 0.00 0.00 178.44 176.01 1k9m s ASN 243 N -5.46 2.74 0.40 2.65 0.01 -1.26 -2.82 114.94 111.20 1k9m s ASN 243 Ca -0.15 -0.44 -0.25 0.00 -0.71 0.00 0.00 52.86 51.31 1k9m s ASN 243 Cb 0.03 -0.51 -0.08 0.00 0.41 0.00 0.00 41.25 41.10 1k9m s ASN 243 CO 0.65 0.25 1.18 -2.16 -1.51 0.00 0.00 177.10 175.51 1k9m s PRO 244 N -0.34 4.06 -1.40 -0.60 0.04 -1.26 -5.06 135.00 130.44 1k9m s PRO 244 Ca 0.03 1.86 -0.13 0.00 0.04 0.00 0.00 61.00 62.81 1k9m s PRO 244 Cb -0.11 -2.69 0.08 0.00 0.04 0.00 0.00 34.50 31.82 1k9m s PRO 244 CO 0.01 -0.32 2.11 -1.13 0.04 0.00 0.00 177.00 177.71 1k9m n SER 245 N 0.10 4.27 -3.58 6.66 3.41 -1.13 -4.66 113.62 118.69 1k9m n SER 245 Ca 0.04 -2.93 -0.08 0.00 -0.26 0.00 0.00 58.87 55.64 1k9m n SER 245 Cb 0.46 -1.60 -0.04 0.00 -0.26 0.00 0.00 64.21 62.77 1k9m n SER 245 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k9m s ARG 246 N 2.31 0.50 -0.33 4.33 1.70 -1.26 -5.13 118.95 121.07 1k9m s ARG 246 Ca 0.45 0.06 -0.20 0.00 -0.47 0.00 0.00 55.73 55.56 1k9m s ARG 246 Cb 0.13 0.23 -0.00 0.00 -0.57 0.00 0.00 34.95 34.74 1k9m s ARG 246 CO -0.06 -0.17 0.62 0.08 -1.08 0.00 0.00 175.30 174.70 1k9m s VAL 247 N -1.40 4.92 0.39 4.99 1.01 -1.26 -4.88 120.40 124.16 1k9m s VAL 247 Ca 0.02 0.68 -0.26 0.00 0.00 0.00 0.00 61.98 62.42 1k9m s VAL 247 Cb -0.01 -4.04 -0.09 0.00 0.00 0.00 0.00 36.38 32.25 1k9m s VAL 247 CO -0.02 -0.23 1.22 -0.60 0.00 0.00 0.00 175.10 175.47 1k9m s ARG 248 N 2.65 4.09 0.33 2.72 3.52 -1.26 -4.93 118.95 126.06 1k9m s ARG 248 Ca 0.24 1.96 0.24 0.00 -0.13 0.00 0.00 55.73 58.04 1k9m s ARG 248 Cb -0.15 -2.76 1.18 0.00 -1.56 0.00 0.00 34.95 31.66 1k9m s ARG 248 CO 0.13 -0.33 1.73 0.66 -0.81 0.00 0.00 175.30 176.69 1k9m h SER 249 N 2.78 0.00 0.41 -2.12 4.64 -1.97 -2.63 113.55 114.66 1k9m h SER 249 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1k9m h SER 249 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1k9m h SER 249 CO 0.63 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.94 1k9m n THR 250 N -2.33 0.01 -3.15 2.95 -2.24 -1.26 -4.76 114.28 103.50 1k9m n THR 250 Ca -0.00 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.39 1k9m n THR 250 Cb 0.12 -0.51 -0.05 0.00 -2.10 0.00 0.00 70.33 67.78 1k9m n THR 250 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1k9m s VAL 251 N -2.41 4.93 -0.01 2.28 0.11 -0.99 -5.00 120.40 119.30 1k9m s VAL 251 Ca 0.33 1.31 -0.30 0.00 -2.93 0.00 0.00 61.98 60.40 1k9m s VAL 251 Cb 0.20 -3.97 -0.07 0.00 -1.53 0.00 0.00 36.38 31.01 1k9m s VAL 251 CO 0.43 0.37 1.88 -2.16 -3.33 0.00 0.00 175.10 172.29 1k9m s PRO 252 N 0.08 4.08 0.08 1.54 0.04 -1.26 -4.99 135.00 134.56 1k9m s PRO 252 Ca 0.33 2.42 0.01 0.00 0.04 0.00 0.00 61.00 63.80 1k9m s PRO 252 Cb -0.18 -4.12 -0.04 0.00 0.04 0.00 0.00 34.50 30.20 1k9m s PRO 252 CO 0.18 -1.01 -0.05 -0.65 0.04 0.00 0.00 177.00 175.51 1k9m s GLN 253 N 4.46 0.73 1.00 4.56 -0.21 -1.26 -4.89 119.66 124.05 1k9m s GLN 253 Ca 0.84 -1.24 -0.12 0.00 0.02 0.00 0.00 55.36 54.86 1k9m s GLN 253 Cb -0.39 -0.06 0.13 0.00 1.00 0.00 0.00 33.01 33.70 1k9m s GLN 253 CO 0.37 -0.05 0.74 0.94 -2.12 0.00 0.00 175.29 175.18 1k9m n GLN 254 N 0.14 -0.93 -2.01 2.91 0.00 -1.26 -4.69 117.38 111.54 1k9m n GLN 254 Ca -0.14 -0.23 0.00 0.00 -0.00 0.00 0.00 57.00 56.64 1k9m n GLN 254 Cb 0.60 -2.09 0.00 0.00 0.00 0.00 0.00 30.24 28.75 1k9m n GLN 254 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1k9m n GLY 255 N 1.02 -0.20 3.71 1.69 0.00 -1.05 -4.99 105.19 105.37 1k9m n GLY 255 Ca 0.07 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 1k9m n GLY 255 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1k9m n GLN 256 N 0.00 2.74 -3.97 1.61 1.13 -1.26 -1.42 117.38 116.22 1k9m n GLN 256 Ca 0.00 0.99 -0.19 0.00 -1.94 0.00 0.00 57.00 55.87 1k9m n GLN 256 Cb 0.00 -2.85 -0.16 0.00 0.11 0.00 0.00 30.24 27.33 1k9m n GLN 256 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1k9m s THR 257 N 1.73 0.29 0.00 5.09 -4.23 -0.35 -4.65 115.64 113.52 1k9m s THR 257 Ca 0.78 0.04 0.00 0.00 -1.18 0.00 0.00 61.69 61.33 1k9m s THR 257 Cb -0.51 -0.38 0.00 0.00 1.34 0.00 0.00 72.50 72.95 1k9m s THR 257 CO 0.34 0.18 0.00 0.61 -0.54 0.00 0.00 174.62 175.22 1k9m n GLY 258 N 4.27 1.16 3.66 3.99 0.00 -1.26 -1.81 105.19 115.20 1k9m n GLY 258 Ca -0.23 -2.01 -0.22 0.00 0.00 0.00 0.00 46.02 43.56 1k9m n GLY 258 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1k9m n TYR 259 N 1.66 -2.10 -4.39 1.61 9.36 -1.07 -4.70 117.16 117.53 1k9m n TYR 259 Ca 0.00 0.89 -0.24 0.00 3.32 0.00 0.00 57.90 61.86 1k9m n TYR 259 Cb 0.00 -4.56 -0.11 0.00 -0.63 0.00 0.00 39.34 34.04 1k9m n TYR 259 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 1k9m s HIS 260 N -3.53 2.10 0.23 2.98 3.76 -1.26 -1.47 115.29 118.11 1k9m s HIS 260 Ca 0.13 -0.40 -0.22 0.00 -0.15 0.00 0.00 55.06 54.41 1k9m s HIS 260 Cb -0.06 -1.03 -0.09 0.00 1.11 0.00 0.00 32.58 32.51 1k9m s HIS 260 CO 0.79 0.45 0.79 -1.14 -0.85 0.00 0.00 174.74 174.77 1k9m s GLN 261 N -2.79 4.40 -0.08 1.40 0.74 -1.26 0.26 119.66 122.34 1k9m s GLN 261 Ca 0.19 1.04 -0.06 0.00 0.05 0.00 0.00 55.36 56.59 1k9m s GLN 261 Cb -0.07 -2.94 0.03 0.00 1.10 0.00 0.00 33.01 31.12 1k9m s GLN 261 CO 0.09 0.41 0.19 1.03 -0.55 0.00 0.00 175.29 176.46 1k9m s ARG 262 N -1.81 0.20 -0.49 1.67 1.81 -0.15 -4.92 118.95 115.26 1k9m s ARG 262 Ca 0.43 0.33 -0.03 0.00 -1.72 0.00 0.00 55.73 54.74 1k9m s ARG 262 Cb -0.19 0.02 0.13 0.00 -0.45 0.00 0.00 34.95 34.47 1k9m s ARG 262 CO 0.23 -0.07 0.29 0.99 -0.68 0.00 0.00 175.30 176.06 1k9m s THR 263 N 0.47 3.47 -0.38 0.02 2.01 -1.26 -1.31 115.64 118.67 1k9m s THR 263 Ca -0.03 -2.37 -0.29 0.00 0.31 0.00 0.00 61.69 59.31 1k9m s THR 263 Cb -0.04 -3.33 0.02 0.00 0.01 0.00 0.00 72.50 69.15 1k9m s THR 263 CO -0.02 -0.76 1.18 -0.70 -0.69 0.00 0.00 174.62 173.63 1k9m s GLU 264 N 0.71 3.87 0.60 4.92 2.12 0.42 -4.89 118.70 126.46 1k9m s GLU 264 Ca 0.11 0.94 -0.14 0.00 0.36 0.00 0.00 54.97 56.24 1k9m s GLU 264 Cb -0.22 -3.85 -0.04 0.00 0.26 0.00 0.00 34.13 30.28 1k9m s GLU 264 CO -0.04 -1.17 1.04 -0.51 -0.54 0.00 0.00 175.26 174.04 1k9m s LEU 265 N 4.25 3.40 -0.95 2.70 1.02 -1.26 -1.83 118.68 126.01 1k9m s LEU 265 Ca 0.50 1.65 -0.11 0.00 0.02 0.00 0.00 54.13 56.20 1k9m s LEU 265 Cb -0.12 -4.51 0.01 0.00 0.02 0.00 0.00 46.19 41.60 1k9m s LEU 265 CO 0.24 -1.05 0.65 0.59 0.02 0.00 0.00 176.35 176.80 1k9m n ASN 266 N -2.30 -5.00 -4.69 2.29 3.02 -1.25 -4.95 115.26 102.37 1k9m n ASN 266 Ca 0.08 -0.97 -0.36 0.00 -0.03 0.00 0.00 54.58 53.29 1k9m n ASN 266 Cb 0.53 -2.18 -0.09 0.00 -0.61 0.00 0.00 39.78 37.44 1k9m n ASN 266 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1k9m s LYS 267 N -5.48 4.13 0.08 3.52 -0.14 0.13 -4.84 119.74 117.13 1k9m s LYS 267 Ca 0.17 -0.22 -0.29 0.00 -1.36 0.00 0.00 55.97 54.27 1k9m s LYS 267 Cb -0.08 -3.49 -0.05 0.00 -1.68 0.00 0.00 37.83 32.53 1k9m s LYS 267 CO 0.90 0.16 0.93 0.50 -0.76 0.00 0.00 175.35 177.09 1k9m s ARG 268 N 0.76 4.64 -0.77 1.68 3.52 -1.26 0.84 118.95 128.35 1k9m s ARG 268 Ca 0.08 1.38 -0.19 0.00 -0.13 0.00 0.00 55.73 56.88 1k9m s ARG 268 Cb -0.12 -3.39 0.12 0.00 -1.56 0.00 0.00 34.95 29.99 1k9m s ARG 268 CO 0.02 0.16 0.94 -0.51 -0.81 0.00 0.00 175.30 175.10 1k9m s LEU 269 N 0.22 5.19 0.38 -0.88 1.43 -0.04 -1.57 118.68 123.41 1k9m s LEU 269 Ca 0.47 -1.72 0.05 0.00 -1.03 0.00 0.00 54.13 51.89 1k9m s LEU 269 Cb -0.22 -2.36 0.75 0.00 0.03 0.00 0.00 46.19 44.39 1k9m s LEU 269 CO 0.28 -1.11 2.03 0.40 0.23 0.00 0.00 176.35 178.18 1k9m h ILE 270 N 5.77 1.14 -1.36 -0.59 1.08 -1.60 0.76 117.51 122.70 1k9m h ILE 270 Ca -0.07 -0.28 0.13 0.00 -0.39 0.00 0.00 64.86 64.25 1k9m h ILE 270 Cb 1.05 0.42 -0.27 0.00 -3.07 0.00 0.00 36.82 34.96 1k9m h ILE 270 CO 1.08 0.14 0.67 -0.62 -0.69 0.00 0.00 178.15 178.73 1k9m s ASP 271 N -6.60 -0.26 -0.24 1.72 2.15 -1.22 -4.58 116.67 107.64 1k9m s ASP 271 Ca -0.09 0.40 0.02 0.00 0.43 0.00 0.00 52.55 53.31 1k9m s ASP 271 Cb 0.17 0.37 0.06 0.00 -0.30 0.00 0.00 42.92 43.23 1k9m s ASP 271 CO 0.75 -0.15 -0.08 -0.63 -0.17 0.00 0.00 175.17 174.89 1k9m s ILE 272 N -0.44 1.79 0.00 4.11 1.01 -1.26 -0.00 121.20 126.41 1k9m s ILE 272 Ca 0.04 -1.39 0.00 0.00 0.00 0.00 0.00 60.65 59.30 1k9m s ILE 272 Cb -0.03 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.45 1k9m s ILE 272 CO -0.06 -0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.42 1k9m n GLY 273 N 4.57 5.62 3.58 6.18 0.00 -0.88 -4.99 105.19 119.28 1k9m n GLY 273 Ca -0.13 -1.52 -0.13 0.00 0.00 0.00 0.00 46.02 44.24 1k9m n GLY 273 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1k9m s GLU 274 N 1.68 0.77 0.00 1.61 2.12 -1.26 -2.04 118.70 121.58 1k9m s GLU 274 Ca 0.00 0.45 0.00 0.00 0.36 0.00 0.00 54.97 55.78 1k9m s GLU 274 Cb 0.00 0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.76 1k9m s GLU 274 CO 0.00 -0.19 0.00 0.41 -0.54 0.00 0.00 175.26 174.94 1k9m n GLY 275 N 1.50 0.43 0.21 -1.50 0.00 0.43 -4.76 105.19 101.50 1k9m n GLY 275 Ca -0.14 -2.16 0.02 0.00 0.00 0.00 0.00 46.02 43.74 1k9m n GLY 275 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1k9m n ASP 276 N 0.00 2.33 -0.30 1.61 5.75 -1.25 -1.09 116.55 123.59 1k9m n ASP 276 Ca 0.00 -2.07 0.17 0.00 -0.01 0.00 0.00 54.79 52.88 1k9m n ASP 276 Cb 0.00 -0.10 0.43 0.00 -1.03 0.00 0.00 41.12 40.42 1k9m n ASP 276 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1k9m h GLU 277 N 0.64 0.54 0.00 0.11 5.08 -1.86 -1.97 114.58 117.12 1k9m h GLU 277 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1k9m h GLU 277 Cb 0.61 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1k9m h GLU 277 CO 0.00 0.36 -0.38 -1.00 -1.00 0.00 0.00 179.01 177.00 1k9m h PRO 278 N 0.56 0.00 -7.00 2.33 0.13 -1.89 -3.46 132.00 122.66 1k9m h PRO 278 Ca 0.53 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 65.10 1k9m h PRO 278 Cb 1.10 0.00 0.15 0.00 0.13 0.00 0.00 31.00 32.38 1k9m h PRO 278 CO -0.27 0.00 0.49 2.41 -0.23 0.00 0.00 178.00 180.40 1k9m n THR 279 N -2.67 3.98 -3.70 1.56 -1.04 -0.74 -4.84 114.28 106.82 1k9m n THR 279 Ca 0.03 -0.50 -0.23 0.00 -2.04 0.00 0.00 64.05 61.32 1k9m n THR 279 Cb 0.50 -1.53 -0.02 0.00 -1.82 0.00 0.00 70.33 67.47 1k9m n THR 279 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1k9m s VAL 280 N -1.34 5.19 0.15 12.58 1.01 -1.26 -4.60 120.40 132.14 1k9m s VAL 280 Ca 0.74 -0.73 -0.31 0.00 0.00 0.00 0.00 61.98 61.69 1k9m s VAL 280 Cb -0.42 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.03 1k9m s VAL 280 CO 0.47 -0.42 1.33 -1.81 0.00 0.00 0.00 175.10 174.67 1k9m s ASP 281 N -3.96 6.89 0.00 3.32 1.01 0.09 -2.06 116.67 121.95 1k9m s ASP 281 Ca 0.37 2.33 0.00 0.00 0.71 0.00 0.00 52.55 55.96 1k9m s ASP 281 Cb -0.09 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.24 1k9m s ASP 281 CO 0.32 -0.57 0.00 0.61 0.21 0.00 0.00 175.17 175.74 1k9m n GLY 282 N 2.88 3.24 0.00 0.21 0.00 -1.26 -3.86 105.19 106.39 1k9m n GLY 282 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1k9m n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k9m n GLY 283 N -1.53 2.30 3.69 -0.02 0.00 -0.88 -4.92 105.19 103.83 1k9m n GLY 283 Ca 0.00 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.77 1k9m n GLY 283 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k9m s PHE 284 N -2.51 2.75 -0.03 1.61 0.40 0.17 -4.71 117.98 115.66 1k9m s PHE 284 Ca 0.00 0.72 -0.36 0.00 -0.60 0.00 0.00 56.93 56.69 1k9m s PHE 284 Cb 0.00 -3.72 -0.14 0.00 0.51 0.00 0.00 43.02 39.67 1k9m s PHE 284 CO 0.00 -2.71 1.67 0.28 0.70 0.00 0.00 175.22 175.16 1k9m n VAL 285 N 4.72 0.27 -1.44 -0.44 0.31 -1.26 -0.66 118.33 119.83 1k9m n VAL 285 Ca 0.14 -0.05 -0.15 0.00 -0.01 0.00 0.00 64.34 64.27 1k9m n VAL 285 Cb 0.43 -1.45 -0.06 0.00 -0.91 0.00 0.00 33.84 31.84 1k9m n VAL 285 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1k9m n ASN 286 N 4.78 -4.83 0.00 4.52 3.02 -1.26 -4.80 115.26 116.69 1k9m n ASN 286 Ca 0.21 0.37 0.00 0.00 -0.03 0.00 0.00 54.58 55.14 1k9m n ASN 286 Cb 0.24 -3.66 0.00 0.00 -0.61 0.00 0.00 39.78 35.75 1k9m n ASN 286 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k9m n TYR 287 N -2.56 0.00 -1.51 3.10 9.36 0.17 -4.92 117.16 120.80 1k9m n TYR 287 Ca -0.15 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.07 1k9m n TYR 287 Cb 0.50 0.13 0.00 0.00 -0.63 0.00 0.00 39.34 39.34 1k9m n TYR 287 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1k9m n GLY 288 N 2.08 0.09 3.77 2.98 0.00 -0.43 -4.71 105.19 108.97 1k9m n GLY 288 Ca 0.00 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 1k9m n GLY 288 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k9m s GLU 289 N -2.00 3.16 -0.14 1.61 2.02 -1.26 0.45 118.70 122.54 1k9m s GLU 289 Ca 0.00 -0.34 -0.05 0.00 0.02 0.00 0.00 54.97 54.60 1k9m s GLU 289 Cb 0.00 -2.94 -0.04 0.00 0.10 0.00 0.00 34.13 31.25 1k9m s GLU 289 CO 0.00 0.71 0.04 0.08 0.02 0.00 0.00 175.26 176.12 1k9m s VAL 290 N -1.01 4.63 -0.45 2.63 1.01 -1.26 -4.74 120.40 121.21 1k9m s VAL 290 Ca 0.16 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1k9m s VAL 290 Cb -0.12 -3.03 0.23 0.00 0.00 0.00 0.00 36.38 33.46 1k9m s VAL 290 CO 0.06 0.53 0.94 -0.67 0.00 0.00 0.00 175.10 175.96 1k9m n ASP 291 N 2.94 -2.57 0.00 3.32 2.03 -1.14 -3.96 116.55 117.18 1k9m n ASP 291 Ca -0.18 -2.68 0.00 0.00 0.52 0.00 0.00 54.79 52.46 1k9m n ASP 291 Cb 0.53 1.48 0.00 0.00 -0.72 0.00 0.00 41.12 42.41 1k9m n ASP 291 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k9m n GLY 292 N 2.02 -0.61 3.72 0.27 0.00 -0.25 -4.67 105.19 105.66 1k9m n GLY 292 Ca 0.10 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 1k9m n GLY 292 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1k9m s PRO 293 N -0.03 4.23 0.12 1.61 0.02 -1.26 -0.43 135.00 139.26 1k9m s PRO 293 Ca 0.00 2.32 -0.04 0.00 0.02 0.00 0.00 61.00 63.30 1k9m s PRO 293 Cb 0.00 -3.16 -0.03 0.00 0.02 0.00 0.00 34.50 31.33 1k9m s PRO 293 CO 0.00 -0.57 0.11 1.52 -0.33 0.00 0.00 177.00 177.73 1k9m s TYR 294 N 1.08 0.60 -0.00 6.54 -0.85 -0.87 -2.01 117.35 121.83 1k9m s TYR 294 Ca 0.69 -1.01 0.02 0.00 -0.52 0.00 0.00 57.07 56.25 1k9m s TYR 294 Cb -0.43 -0.31 -0.01 0.00 0.38 0.00 0.00 41.96 41.60 1k9m s TYR 294 CO 0.32 -0.55 -0.07 0.99 -1.52 0.00 0.00 175.55 174.72 1k9m s THR 295 N -3.98 0.53 -0.34 -3.49 2.01 0.32 -2.07 115.64 108.62 1k9m s THR 295 Ca 0.17 -0.33 -0.09 0.00 0.31 0.00 0.00 61.69 61.75 1k9m s THR 295 Cb 0.06 -0.46 0.02 0.00 0.01 0.00 0.00 72.50 72.13 1k9m s THR 295 CO -0.02 0.12 0.16 -0.76 -0.69 0.00 0.00 174.62 173.43 1k9m s LEU 296 N -0.23 4.38 -0.15 4.42 1.43 1.00 -1.07 118.68 128.46 1k9m s LEU 296 Ca 0.02 -0.84 -0.07 0.00 -1.03 0.00 0.00 54.13 52.21 1k9m s LEU 296 Cb -0.03 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 1k9m s LEU 296 CO -0.00 -0.30 0.10 -0.69 0.23 0.00 0.00 176.35 175.69 1k9m s VAL 297 N 1.54 5.15 0.22 -1.59 1.01 -0.15 -1.56 120.40 125.01 1k9m s VAL 297 Ca 0.02 0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 1k9m s VAL 297 Cb -0.18 -3.27 -0.10 0.00 0.00 0.00 0.00 36.38 32.83 1k9m s VAL 297 CO 0.05 0.54 1.43 -0.75 0.00 0.00 0.00 175.10 176.37 1k9m s LYS 298 N -0.39 4.29 3.82 2.72 2.20 -0.61 0.04 119.74 131.81 1k9m s LYS 298 Ca 0.11 2.24 0.00 0.00 -0.36 0.00 0.00 55.97 57.96 1k9m s LYS 298 Cb -0.12 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.06 1k9m s LYS 298 CO 0.02 -0.41 0.00 0.41 -0.36 0.00 0.00 175.35 175.00 1k9m n GLY 299 N 2.53 0.43 3.85 5.54 0.00 -0.69 -4.64 105.19 112.21 1k9m n GLY 299 Ca 0.08 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.98 1k9m n GLY 299 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k9m s SER 300 N -4.00 5.03 -0.01 1.61 1.04 -1.26 -3.29 113.70 112.83 1k9m s SER 300 Ca 0.00 -0.72 0.00 0.00 0.48 0.00 0.00 55.95 55.72 1k9m s SER 300 Cb 0.00 -0.66 0.00 0.00 0.10 0.00 0.00 66.02 65.46 1k9m s SER 300 CO 0.00 -0.56 -0.01 -0.69 0.98 0.00 0.00 173.24 172.96 1k9m s VAL 301 N -2.44 0.12 0.79 5.02 1.01 -1.26 -5.02 120.40 118.61 1k9m s VAL 301 Ca 0.45 -0.03 -0.14 0.00 0.00 0.00 0.00 61.98 62.26 1k9m s VAL 301 Cb -0.03 -0.13 0.06 0.00 0.00 0.00 0.00 36.38 36.28 1k9m s VAL 301 CO 0.27 0.05 1.12 -0.81 0.00 0.00 0.00 175.10 175.73 1k9m n PRO 302 N 3.23 0.26 0.00 2.72 -0.04 -1.26 -4.85 135.00 135.06 1k9m n PRO 302 Ca -0.15 0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1k9m n PRO 302 Cb 0.58 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.67 1k9m n PRO 302 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1k9m n GLY 303 N 0.72 0.33 3.98 0.55 0.00 -1.25 -4.77 105.19 104.75 1k9m n GLY 303 Ca 0.13 -1.79 -0.18 0.00 0.00 0.00 0.00 46.02 44.18 1k9m n GLY 303 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1k9m s PRO 304 N -2.38 2.92 0.24 1.61 0.04 -1.26 -4.63 135.00 131.53 1k9m s PRO 304 Ca 0.00 -1.17 -0.31 0.00 0.04 0.00 0.00 61.00 59.56 1k9m s PRO 304 Cb 0.00 -2.74 -0.13 0.00 0.04 0.00 0.00 34.50 31.67 1k9m s PRO 304 CO 0.00 -0.11 1.47 -0.25 0.04 0.00 0.00 177.00 178.15 1k9m n ASP 305 N -1.71 3.02 0.00 6.66 8.00 -1.26 -1.38 116.55 129.88 1k9m n ASP 305 Ca 0.04 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.67 1k9m n ASP 305 Cb 0.59 -1.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.23 1k9m n ASP 305 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1k9m n LYS 306 N 2.22 0.00 -2.77 -1.24 5.02 -0.11 -4.98 118.16 116.30 1k9m n LYS 306 Ca 0.12 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 56.05 1k9m n LYS 306 Cb 0.32 -0.41 -0.06 0.00 -0.02 0.00 0.00 35.03 34.86 1k9m n LYS 306 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1k9m s ARG 307 N -0.71 4.41 0.10 1.97 3.52 -0.48 -4.66 118.95 123.11 1k9m s ARG 307 Ca 0.00 1.27 -0.31 0.00 -0.13 0.00 0.00 55.73 56.57 1k9m s ARG 307 Cb 0.00 -2.55 -0.07 0.00 -1.56 0.00 0.00 34.95 30.77 1k9m s ARG 307 CO 0.00 0.12 1.28 -1.17 -0.81 0.00 0.00 175.30 174.72 1k9m s LEU 308 N -2.53 4.38 0.12 -0.88 2.96 -1.26 -1.66 118.68 119.81 1k9m s LEU 308 Ca 0.55 2.19 0.09 0.00 -0.22 0.00 0.00 54.13 56.74 1k9m s LEU 308 Cb -0.16 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.91 1k9m s LEU 308 CO 0.20 -0.53 -0.23 0.68 -1.32 0.00 0.00 176.35 175.15 1k9m s VAL 309 N 0.89 1.94 -0.03 1.68 -7.23 -0.40 -4.64 120.40 112.61 1k9m s VAL 309 Ca 0.60 -1.66 0.06 0.00 -1.81 0.00 0.00 61.98 59.17 1k9m s VAL 309 Cb -0.33 -1.75 -0.02 0.00 0.56 0.00 0.00 36.38 34.83 1k9m s VAL 309 CO 0.31 -0.02 -0.19 -0.13 -0.31 0.00 0.00 175.10 174.76 1k9m s ARG 310 N -2.03 2.32 0.05 4.82 0.52 -0.82 -1.81 118.95 122.00 1k9m s ARG 310 Ca 0.10 -0.80 0.04 0.00 -0.52 0.00 0.00 55.73 54.54 1k9m s ARG 310 Cb -0.10 -2.23 -0.04 0.00 0.52 0.00 0.00 34.95 33.10 1k9m s ARG 310 CO 0.05 0.59 -0.01 -0.06 0.02 0.00 0.00 175.30 175.90 1k9m s PHE 311 N -0.69 3.00 -0.12 -0.53 0.40 0.27 -1.58 117.98 118.72 1k9m s PHE 311 Ca 0.11 0.00 -0.18 0.00 -0.60 0.00 0.00 56.93 56.26 1k9m s PHE 311 Cb -0.10 -1.58 0.04 0.00 0.51 0.00 0.00 43.02 41.89 1k9m s PHE 311 CO 0.00 0.46 0.46 0.50 0.70 0.00 0.00 175.22 177.34 1k9m s ARG 312 N -1.99 0.64 0.16 0.44 3.52 -0.86 -1.37 118.95 119.50 1k9m s ARG 312 Ca 0.23 0.41 -0.32 0.00 -0.13 0.00 0.00 55.73 55.92 1k9m s ARG 312 Cb -0.12 0.30 -0.10 0.00 -1.56 0.00 0.00 34.95 33.47 1k9m s ARG 312 CO 0.15 -0.13 1.67 -2.14 -0.81 0.00 0.00 175.30 174.04 1k9m s PRO 313 N -0.30 4.17 0.16 5.12 0.02 -1.26 0.12 135.00 143.03 1k9m s PRO 313 Ca -0.05 2.48 -0.32 0.00 0.02 0.00 0.00 61.00 63.13 1k9m s PRO 313 Cb -0.03 -3.25 -0.17 0.00 0.02 0.00 0.00 34.50 31.06 1k9m s PRO 313 CO 0.03 -0.71 0.87 0.00 -0.33 0.00 0.00 177.00 176.86 1k9m n ALA 314 N 4.45 -2.16 1.04 -1.55 0.00 -0.92 -4.60 120.51 116.79 1k9m n ALA 314 Ca 0.15 0.47 0.11 0.00 0.00 0.00 0.00 53.44 54.18 1k9m n ALA 314 Cb 0.38 -1.81 0.07 0.00 0.00 0.00 0.00 19.45 18.09 1k9m n ALA 314 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1k9m n VAL 315 N 0.76 0.00 -2.85 0.00 0.24 -1.26 -4.60 118.33 110.62 1k9m n VAL 315 Ca 0.17 -0.10 -0.10 0.00 -2.04 0.00 0.00 64.34 62.27 1k9m n VAL 315 Cb 0.22 0.83 0.01 0.00 -1.47 0.00 0.00 33.84 33.44 1k9m n VAL 315 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1k9m n ARG 316 N -0.91 0.63 -2.81 7.34 1.85 -1.26 -4.97 116.66 116.54 1k9m n ARG 316 Ca 0.07 -2.11 -0.33 0.00 -1.00 0.00 0.00 57.85 54.48 1k9m n ARG 316 Cb 0.38 -1.46 -0.07 0.00 -1.05 0.00 0.00 32.46 30.26 1k9m n ARG 316 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 1k9m s PRO 317 N 0.52 4.22 -0.21 2.89 0.02 -1.26 -4.83 135.00 136.36 1k9m s PRO 317 Ca 0.32 1.14 0.12 0.00 0.02 0.00 0.00 61.00 62.59 1k9m s PRO 317 Cb 0.12 -2.19 -0.21 0.00 0.02 0.00 0.00 34.50 32.24 1k9m s PRO 317 CO -0.16 -0.04 -0.03 0.09 -0.33 0.00 0.00 177.00 176.53 1k9m n ASN 318 N -0.62 0.87 -4.77 2.53 3.02 -1.26 -5.01 115.26 110.02 1k9m n ASN 318 Ca 0.07 -0.05 -0.22 0.00 -0.03 0.00 0.00 54.58 54.35 1k9m n ASN 318 Cb 0.54 0.51 -0.05 0.00 -0.61 0.00 0.00 39.78 40.17 1k9m n ASN 318 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1k9m s ASP 319 N -5.72 5.03 0.34 6.41 1.01 -1.26 -5.12 116.67 117.36 1k9m s ASP 319 Ca -0.18 -0.54 -0.17 0.00 0.71 0.00 0.00 52.55 52.37 1k9m s ASP 319 Cb 0.07 -0.98 -0.09 0.00 1.01 0.00 0.00 42.92 42.92 1k9m s ASP 319 CO 0.71 -0.19 0.79 -1.58 0.21 0.00 0.00 175.17 175.12 1k9m s GLN 320 N -3.85 4.10 0.30 8.23 2.00 -1.26 -5.02 119.66 124.15 1k9m s GLN 320 Ca 0.36 0.81 -0.30 0.00 -2.00 0.00 0.00 55.36 54.24 1k9m s GLN 320 Cb -0.05 -2.43 -0.11 0.00 0.80 0.00 0.00 33.01 31.22 1k9m s GLN 320 CO 0.24 0.14 1.49 -2.14 -0.50 0.00 0.00 175.29 174.51 1k9m s PRO 321 N -2.91 4.20 -0.63 1.67 0.02 -1.26 -4.97 135.00 131.12 1k9m s PRO 321 Ca 0.55 2.44 0.05 0.00 0.02 0.00 0.00 61.00 64.05 1k9m s PRO 321 Cb -0.11 -3.05 0.17 0.00 0.02 0.00 0.00 34.50 31.53 1k9m s PRO 321 CO 0.17 -0.49 0.46 1.03 -0.33 0.00 0.00 177.00 177.84 1k9m s ARG 322 N -0.87 2.08 0.75 5.54 0.52 -1.25 -5.04 118.95 120.68 1k9m s ARG 322 Ca 0.58 -3.05 -0.16 0.00 -0.52 0.00 0.00 55.73 52.58 1k9m s ARG 322 Cb -0.44 -2.93 -0.08 0.00 0.52 0.00 0.00 34.95 32.02 1k9m s ARG 322 CO 0.49 -1.31 0.08 1.28 0.02 0.00 0.00 175.30 175.86 1k9m n LEU 323 N 2.17 -1.79 -2.05 2.53 4.77 -1.26 -4.28 117.00 117.09 1k9m n LEU 323 Ca 0.22 0.50 -0.15 0.00 -0.03 0.00 0.00 56.01 56.55 1k9m n LEU 323 Cb 0.38 -1.03 0.01 0.00 -2.33 0.00 0.00 43.42 40.45 1k9m n LEU 323 CO 0.22 -4.18 -0.11 0.47 -1.33 0.00 0.00 177.39 172.47 1k9m n ASP 324 N 1.09 -2.05 -4.77 -1.43 9.92 0.53 -4.88 116.55 114.97 1k9m n ASP 324 Ca 0.07 -0.09 -0.38 0.00 -0.53 0.00 0.00 54.79 53.86 1k9m n ASP 324 Cb 0.51 -0.60 -0.00 0.00 -0.64 0.00 0.00 41.12 40.38 1k9m n ASP 324 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 1k9m s PRO 325 N -1.13 3.75 -0.18 -0.24 0.02 -1.26 -4.96 135.00 131.00 1k9m s PRO 325 Ca 0.13 1.89 -0.29 0.00 0.02 0.00 0.00 61.00 62.75 1k9m s PRO 325 Cb -0.01 -2.47 0.00 0.00 0.02 0.00 0.00 34.50 32.04 1k9m s PRO 325 CO 0.33 -0.59 1.03 -2.00 -0.33 0.00 0.00 177.00 175.45 1k9m s GLU 326 N -2.61 4.32 -0.34 5.54 2.12 -1.26 -5.00 118.70 121.47 1k9m s GLU 326 Ca 0.63 1.38 -0.11 0.00 0.36 0.00 0.00 54.97 57.23 1k9m s GLU 326 Cb -0.31 -3.60 -0.00 0.00 0.26 0.00 0.00 34.13 30.47 1k9m s GLU 326 CO 0.39 -0.51 0.20 0.08 -0.54 0.00 0.00 175.26 174.87 1k9m s VAL 327 N 2.74 4.84 -0.17 3.70 1.01 -1.26 -2.28 120.40 128.98 1k9m s VAL 327 Ca 0.46 -0.45 0.21 0.00 0.00 0.00 0.00 61.98 62.19 1k9m s VAL 327 Cb -0.17 -3.53 -0.09 0.00 0.00 0.00 0.00 36.38 32.60 1k9m s VAL 327 CO 0.11 -0.03 0.88 0.54 0.00 0.00 0.00 175.10 176.59 1k9m n ARG 328 N 5.03 0.62 -3.64 2.72 1.74 -0.18 -4.95 116.66 118.00 1k9m n ARG 328 Ca -0.13 0.11 -0.10 0.00 -0.77 0.00 0.00 57.85 56.96 1k9m n ARG 328 Cb 0.49 -1.78 -0.07 0.00 -1.02 0.00 0.00 32.46 30.08 1k9m n ARG 328 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1k9m s TYR 329 N -3.22 -0.92 -0.16 -1.55 5.04 -1.16 -4.94 117.35 110.44 1k9m s TYR 329 Ca -0.02 2.00 0.02 0.00 -2.44 0.00 0.00 57.07 56.62 1k9m s TYR 329 Cb 0.10 0.46 0.02 0.00 0.35 0.00 0.00 41.96 42.88 1k9m s TYR 329 CO 0.81 -0.45 -0.20 0.08 -1.34 0.00 0.00 175.55 174.45 1k9m s VAL 330 N 1.02 2.02 -0.04 3.14 1.01 -1.26 0.12 120.40 126.40 1k9m s VAL 330 Ca -0.05 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 60.70 1k9m s VAL 330 Cb -0.05 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 1k9m s VAL 330 CO -0.10 0.54 1.21 -0.55 0.00 0.00 0.00 175.10 176.20 1k9m s SER 331 N 1.10 7.05 -0.13 3.32 0.15 -0.66 -4.89 113.70 119.65 1k9m s SER 331 Ca -0.00 1.84 0.15 0.00 0.70 0.00 0.00 55.95 58.64 1k9m s SER 331 Cb -0.14 -2.56 0.46 0.00 -1.71 0.00 0.00 66.02 62.07 1k9m s SER 331 CO -0.08 -0.58 1.37 0.59 1.20 0.00 0.00 173.24 175.74 1k9m n ASN 332 N 5.11 3.58 -4.73 5.45 3.02 -1.26 -4.65 115.26 121.78 1k9m n ASN 332 Ca 0.11 -2.72 -0.42 0.00 -0.03 0.00 0.00 54.58 51.53 1k9m n ASN 332 Cb 0.46 -0.45 -0.03 0.00 -0.61 0.00 0.00 39.78 39.15 1k9m n ASN 332 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1k9m s GLU 333 N -2.28 4.31 0.29 3.52 2.12 -1.26 -0.73 118.70 124.66 1k9m s GLU 333 Ca 0.36 2.17 -0.27 0.00 0.36 0.00 0.00 54.97 57.60 1k9m s GLU 333 Cb 0.27 -3.18 -0.14 0.00 0.26 0.00 0.00 34.13 31.34 1k9m s GLU 333 CO 0.11 -0.42 0.80 0.45 -0.54 0.00 0.00 175.26 175.66 1k9m n SER 334 N 3.23 0.24 -0.72 -1.70 2.88 -1.25 -4.38 113.62 111.92 1k9m n SER 334 Ca 0.09 1.11 0.07 0.00 -1.33 0.00 0.00 58.87 58.82 1k9m n SER 334 Cb 0.41 -1.17 0.19 0.00 -0.75 0.00 0.00 64.21 62.90 1k9m n SER 334 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1k9m n ASN 335 N 1.41 2.08 -4.22 -3.46 3.02 -1.26 -4.68 115.26 108.16 1k9m n ASN 335 Ca 0.12 -1.97 -0.36 0.00 -0.03 0.00 0.00 54.58 52.34 1k9m n ASN 335 Cb 0.32 -0.25 -0.13 0.00 -0.61 0.00 0.00 39.78 39.11 1k9m n ASN 335 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1k9m s GLN 336 N -1.50 2.64 0.00 3.52 -0.21 -1.26 -4.97 119.66 117.88 1k9m s GLN 336 Ca 0.27 -1.13 0.00 0.00 0.02 0.00 0.00 55.36 54.52 1k9m s GLN 336 Cb 0.14 -3.23 0.00 0.00 1.00 0.00 0.00 33.01 30.92 1k9m s GLN 336 CO 0.19 -0.56 0.00 0.41 -2.12 0.00 0.00 175.29 173.21