#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g6e n GLN 2 N 0.00 -4.38 -1.65 -0.52 7.27 -1.26 -4.96 117.38 111.89 3g6e n GLN 2 Ca 0.00 3.26 -0.40 0.00 0.07 0.00 0.00 57.00 59.93 3g6e n GLN 2 Cb 0.00 -4.14 0.03 0.00 2.41 0.00 0.00 30.24 28.53 3g6e n GLN 2 CO 0.00 0.00 0.00 -2.30 0.07 0.00 0.00 177.06 174.83 3g6e n PRO 3 N 1.55 1.40 -1.65 3.69 -0.02 -1.26 -5.01 135.00 133.70 3g6e n PRO 3 Ca -0.04 0.51 -0.31 0.00 -2.02 0.00 0.00 63.50 61.64 3g6e n PRO 3 Cb 0.06 -2.21 0.04 0.00 -0.02 0.00 0.00 33.50 31.37 3g6e n PRO 3 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3g6e s SER 4 N -0.85 5.53 -0.28 2.55 0.01 -1.26 -5.08 113.70 114.31 3g6e s SER 4 Ca 0.67 1.54 -0.23 0.00 1.31 0.00 0.00 55.95 59.24 3g6e s SER 4 Cb -0.49 -2.45 0.13 0.00 0.21 0.00 0.00 66.02 63.42 3g6e s SER 4 CO 0.54 -1.34 1.01 -0.60 0.41 0.00 0.00 173.24 173.26 3g6e s ARG 5 N -5.09 0.48 0.62 12.44 3.52 -1.26 -5.16 118.95 124.50 3g6e s ARG 5 Ca 0.57 0.63 -0.18 0.00 -0.13 0.00 0.00 55.73 56.63 3g6e s ARG 5 Cb -0.13 0.20 -0.02 0.00 -1.56 0.00 0.00 34.95 33.44 3g6e s ARG 5 CO 0.55 -0.07 1.18 -2.14 -0.81 0.00 0.00 175.30 174.01 3g6e s PRO 6 N 0.51 2.85 0.88 5.12 0.02 -1.26 -4.98 135.00 138.14 3g6e s PRO 6 Ca 0.00 1.72 -0.10 0.00 0.02 0.00 0.00 61.00 62.63 3g6e s PRO 6 Cb -0.05 -1.93 0.12 0.00 0.02 0.00 0.00 34.50 32.67 3g6e s PRO 6 CO -0.09 -1.27 1.14 -0.98 -0.33 0.00 0.00 177.00 175.47 3g6e s ARG 7 N -3.55 1.30 -0.57 5.54 1.70 -1.26 -4.94 118.95 117.18 3g6e s ARG 7 Ca 0.75 1.50 -0.27 0.00 -0.47 0.00 0.00 55.73 57.23 3g6e s ARG 7 Cb -0.28 -1.76 0.03 0.00 -0.57 0.00 0.00 34.95 32.37 3g6e s ARG 7 CO 0.36 -2.41 1.13 0.15 -1.08 0.00 0.00 175.30 173.44 3g6e s LYS 8 N -4.65 3.47 0.00 3.89 -0.14 -1.26 -4.86 119.74 116.19 3g6e s LYS 8 Ca 0.66 0.12 0.00 0.00 -1.36 0.00 0.00 55.97 55.39 3g6e s LYS 8 Cb -0.22 -4.02 0.00 0.00 -1.68 0.00 0.00 37.83 31.90 3g6e s LYS 8 CO 0.57 -1.63 0.00 0.41 -0.76 0.00 0.00 175.35 173.94 3g6e n GLY 9 N 5.08 -2.20 3.87 -3.33 0.00 -1.14 -4.86 105.19 102.60 3g6e n GLY 9 Ca 0.07 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.27 3g6e n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3g6e s SER 10 N -4.28 6.67 0.00 1.61 0.15 -1.26 -5.00 113.70 111.59 3g6e s SER 10 Ca 0.00 0.90 0.25 0.00 0.70 0.00 0.00 55.95 57.81 3g6e s SER 10 Cb 0.00 -2.22 0.49 0.00 -1.71 0.00 0.00 66.02 62.58 3g6e s SER 10 CO 0.00 0.03 1.42 0.18 1.20 0.00 0.00 173.24 176.08 3g6e n LEU 11 N 0.34 2.29 -0.39 3.45 4.32 -1.26 -4.34 117.00 121.40 3g6e n LEU 11 Ca -0.03 -0.77 0.14 0.00 -0.02 0.00 0.00 56.01 55.33 3g6e n LEU 11 Cb 0.52 -0.01 0.53 0.00 -1.62 0.00 0.00 43.42 42.85 3g6e n LEU 11 CO 0.44 0.39 0.85 0.61 -1.22 0.00 0.00 177.39 178.46 3g6e n GLY 12 N 1.30 -0.21 1.03 -0.72 0.00 -1.26 -3.89 105.19 101.44 3g6e n GLY 12 Ca 0.15 -0.41 -0.02 0.00 0.00 0.00 0.00 46.02 45.73 3g6e n GLY 12 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3g6e n PHE 13 N -0.09 0.83 -3.96 1.61 3.01 -1.26 -5.05 117.46 112.55 3g6e n PHE 13 Ca 0.18 -1.64 -0.22 0.00 1.01 0.00 0.00 57.45 56.78 3g6e n PHE 13 Cb 0.33 -0.41 -0.05 0.00 -0.01 0.00 0.00 39.48 39.35 3g6e n PHE 13 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3g6e s GLY 14 N -2.86 1.78 0.24 1.37 0.00 -1.25 -4.17 107.32 102.43 3g6e s GLY 14 Ca 0.43 -1.68 -0.30 0.00 0.00 0.00 0.00 44.72 43.17 3g6e s GLY 14 CO -0.03 -1.63 1.07 2.56 0.00 0.00 0.00 173.10 175.08 3g6e s PRO 15 N -3.91 4.66 -0.71 2.90 0.04 -1.26 -5.05 135.00 131.67 3g6e s PRO 15 Ca 0.38 1.73 -0.16 0.00 0.04 0.00 0.00 61.00 62.99 3g6e s PRO 15 Cb -0.05 -3.23 -0.13 0.00 0.04 0.00 0.00 34.50 31.13 3g6e s PRO 15 CO 0.25 0.21 1.90 0.54 0.04 0.00 0.00 177.00 179.94 3g6e n ARG 16 N 1.63 1.47 -4.26 4.56 3.00 -1.26 -4.88 116.66 116.92 3g6e n ARG 16 Ca -0.00 -1.57 -0.26 0.00 -0.01 0.00 0.00 57.85 56.01 3g6e n ARG 16 Cb 0.46 -2.68 -0.07 0.00 0.00 0.00 0.00 32.46 30.17 3g6e n ARG 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 3g6e s LYS 17 N 4.65 2.18 0.31 5.56 -2.85 -1.26 -4.33 119.74 124.00 3g6e s LYS 17 Ca 0.49 -1.98 -0.29 0.00 -1.00 0.00 0.00 55.97 53.19 3g6e s LYS 17 Cb 0.12 -1.88 -0.10 0.00 -2.06 0.00 0.00 37.83 33.91 3g6e s LYS 17 CO 0.08 -0.19 1.35 1.03 0.10 0.00 0.00 175.35 177.72 3g6e s ARG 18 N -3.91 4.32 0.36 1.78 0.52 -1.26 -4.64 118.95 116.11 3g6e s ARG 18 Ca 0.35 2.26 -0.27 0.00 -0.52 0.00 0.00 55.73 57.55 3g6e s ARG 18 Cb 0.04 -3.08 -0.09 0.00 0.52 0.00 0.00 34.95 32.34 3g6e s ARG 18 CO 0.19 -0.27 1.23 0.45 0.02 0.00 0.00 175.30 176.92 3g6e s SER 19 N -0.23 6.66 0.06 0.23 0.15 -0.53 -4.97 113.70 115.07 3g6e s SER 19 Ca 0.52 2.50 -0.19 0.00 0.70 0.00 0.00 55.95 59.48 3g6e s SER 19 Cb -0.41 -2.63 -0.11 0.00 -1.71 0.00 0.00 66.02 61.16 3g6e s SER 19 CO 0.51 -0.59 1.41 0.74 1.20 0.00 0.00 173.24 176.51 3g6e h THR 20 N 2.67 1.31 -3.90 6.45 2.02 -1.93 -3.44 112.91 116.10 3g6e h THR 20 Ca -0.49 -1.22 -0.68 0.00 0.77 0.00 0.00 66.41 64.79 3g6e h THR 20 Cb 1.23 1.66 -0.26 0.00 -1.74 0.00 0.00 68.15 69.04 3g6e h THR 20 CO 0.64 0.37 -0.80 -0.44 0.37 0.00 0.00 175.52 175.66 3g6e s SER 21 N -6.15 3.77 0.41 4.18 0.01 -1.26 -4.99 113.70 109.68 3g6e s SER 21 Ca -0.14 -0.31 0.22 0.00 1.31 0.00 0.00 55.95 57.04 3g6e s SER 21 Cb 0.07 -0.99 0.44 0.00 0.21 0.00 0.00 66.02 65.75 3g6e s SER 21 CO 0.77 0.28 1.63 -0.08 0.41 0.00 0.00 173.24 176.25 3g6e h GLU 22 N 5.81 0.00 -5.83 12.44 4.81 -2.01 -3.41 114.58 126.39 3g6e h GLU 22 Ca -0.38 0.00 -0.60 0.00 -0.13 0.00 0.00 59.36 58.25 3g6e h GLU 22 Cb 1.17 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.46 3g6e h GLU 22 CO 0.51 0.14 0.48 0.99 -0.73 0.00 0.00 179.01 180.40 3g6e s THR 23 N -3.24 4.79 0.52 0.32 2.01 -1.26 -4.50 115.64 114.28 3g6e s THR 23 Ca 0.05 1.44 -0.22 0.00 0.31 0.00 0.00 61.69 63.27 3g6e s THR 23 Cb 0.07 -4.16 -0.06 0.00 0.01 0.00 0.00 72.50 68.36 3g6e s THR 23 CO 0.67 -0.18 1.29 -2.84 -0.69 0.00 0.00 174.62 172.87 3g6e s PRO 24 N 2.96 3.33 -0.21 4.92 0.02 -1.26 -5.03 135.00 139.72 3g6e s PRO 24 Ca 0.35 2.07 0.01 0.00 0.02 0.00 0.00 61.00 63.45 3g6e s PRO 24 Cb -0.15 -2.29 0.05 0.00 0.02 0.00 0.00 34.50 32.13 3g6e s PRO 24 CO 0.10 -0.99 -0.11 1.03 -0.33 0.00 0.00 177.00 176.71 3g6e s ARG 25 N -2.86 2.10 0.29 5.54 1.81 -1.26 -5.00 118.95 119.57 3g6e s ARG 25 Ca 0.69 -0.96 -0.29 0.00 -1.72 0.00 0.00 55.73 53.45 3g6e s ARG 25 Cb -0.36 -2.55 -0.10 0.00 -0.45 0.00 0.00 34.95 31.49 3g6e s ARG 25 CO 0.43 -0.46 1.36 -0.06 -0.68 0.00 0.00 175.30 175.89 3g6e s PHE 26 N 1.33 3.03 -1.81 -0.53 0.40 -1.26 -4.93 117.98 114.21 3g6e s PHE 26 Ca -0.03 1.25 0.21 0.00 -0.60 0.00 0.00 56.93 57.77 3g6e s PHE 26 Cb -0.17 -3.74 -0.04 0.00 0.51 0.00 0.00 43.02 39.58 3g6e s PHE 26 CO -0.08 -2.19 1.02 0.27 0.70 0.00 0.00 175.22 174.94 3g6e n ASN 27 N 1.48 1.83 -3.91 1.36 0.23 -1.26 -4.96 115.26 110.03 3g6e n ASN 27 Ca 0.03 -1.42 -0.10 0.00 -0.53 0.00 0.00 54.58 52.56 3g6e n ASN 27 Cb 0.41 0.55 -0.10 0.00 -2.08 0.00 0.00 39.78 38.56 3g6e n ASN 27 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 3g6e s SER 28 N -2.45 0.13 0.13 0.53 0.15 -1.26 -5.18 113.70 105.75 3g6e s SER 28 Ca 0.16 -0.40 0.05 0.00 0.70 0.00 0.00 55.95 56.47 3g6e s SER 28 Cb 0.17 0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.64 3g6e s SER 28 CO 0.58 -0.43 -0.13 0.26 1.20 0.00 0.00 173.24 174.73 3g6e s TRP 29 N -1.96 1.34 0.96 3.44 0.52 -1.26 -5.09 118.94 116.89 3g6e s TRP 29 Ca -0.10 -0.62 -0.11 0.00 0.02 0.00 0.00 56.10 55.28 3g6e s TRP 29 Cb -0.05 -0.69 0.17 0.00 -1.15 0.00 0.00 33.47 31.74 3g6e s TRP 29 CO -0.02 0.13 1.09 -2.14 0.02 0.00 0.00 176.95 176.03 3g6e s PRO 30 N -3.02 0.73 0.43 4.98 0.02 -1.26 -5.00 135.00 131.89 3g6e s PRO 30 Ca 0.11 1.00 -0.20 0.00 0.02 0.00 0.00 61.00 61.93 3g6e s PRO 30 Cb -0.02 -1.73 -0.11 0.00 0.02 0.00 0.00 34.50 32.65 3g6e s PRO 30 CO 0.02 -2.65 0.94 -1.54 -0.33 0.00 0.00 177.00 173.44 3g6e s SER 31 N -3.05 6.90 -0.45 2.53 1.04 -1.26 -4.98 113.70 114.43 3g6e s SER 31 Ca 0.65 1.66 -0.29 0.00 0.48 0.00 0.00 55.95 58.45 3g6e s SER 31 Cb -0.21 -2.53 0.02 0.00 0.10 0.00 0.00 66.02 63.40 3g6e s SER 31 CO 0.59 -0.38 1.28 -1.81 0.98 0.00 0.00 173.24 173.90 3g6e s ASP 32 N -2.27 6.48 0.00 7.02 1.01 -1.26 -4.73 116.67 122.91 3g6e s ASP 32 Ca 0.61 0.65 0.00 0.00 0.71 0.00 0.00 52.55 54.52 3g6e s ASP 32 Cb -0.09 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.29 3g6e s ASP 32 CO 0.15 -1.35 0.00 0.47 0.21 0.00 0.00 175.17 174.65 3g6e n ASP 33 N 8.36 0.00 0.00 0.27 9.92 -1.15 -4.82 116.55 129.13 3g6e n ASP 33 Ca 0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.40 3g6e n ASP 33 Cb 0.48 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 3g6e n ASP 33 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3g6e n GLY 34 N 4.68 1.20 3.81 0.44 0.00 -1.26 -4.53 105.19 109.53 3g6e n GLY 34 Ca 0.00 -0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3g6e n GLY 34 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g6e s GLN 35 N 0.00 4.16 0.62 1.61 -0.21 -1.26 -2.51 119.66 122.07 3g6e s GLN 35 Ca 0.00 1.21 -0.18 0.00 0.02 0.00 0.00 55.36 56.41 3g6e s GLN 35 Cb 0.00 -2.23 -0.02 0.00 1.00 0.00 0.00 33.01 31.75 3g6e s GLN 35 CO 0.00 -0.10 1.24 -2.14 -2.12 0.00 0.00 175.29 172.17 3g6e s PRO 36 N -3.06 2.80 0.00 2.91 0.02 -1.26 -4.32 135.00 132.09 3g6e s PRO 36 Ca 0.62 1.90 0.00 0.00 0.02 0.00 0.00 61.00 63.54 3g6e s PRO 36 Cb -0.12 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.50 3g6e s PRO 36 CO 0.16 -1.36 0.00 0.41 -0.33 0.00 0.00 177.00 175.88 3g6e n GLY 37 N 0.62 0.79 3.70 0.52 0.00 -0.54 -4.95 105.19 105.34 3g6e n GLY 37 Ca 0.14 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 3g6e n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g6e s VAL 38 N -2.00 3.53 -0.24 1.61 1.01 -1.26 -2.27 120.40 120.78 3g6e s VAL 38 Ca 0.00 1.03 -0.01 0.00 0.00 0.00 0.00 61.98 63.00 3g6e s VAL 38 Cb 0.00 -3.66 0.17 0.00 0.00 0.00 0.00 36.38 32.89 3g6e s VAL 38 CO 0.00 0.04 1.96 0.00 0.00 0.00 0.00 175.10 177.10 3g6e n GLN 39 N 4.59 1.60 0.00 2.72 6.02 0.15 -4.85 117.38 127.62 3g6e n GLN 39 Ca 0.12 -1.19 0.00 0.00 -0.01 0.00 0.00 57.00 55.92 3g6e n GLN 39 Cb 0.43 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.22 3g6e n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g6e n GLY 40 N 0.56 1.48 3.66 1.08 0.00 -1.26 -4.28 105.19 106.43 3g6e n GLY 40 Ca 0.23 -0.99 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 3g6e n GLY 40 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3g6e s PHE 41 N -2.00 0.58 0.00 1.61 5.36 -0.64 -4.97 117.98 117.93 3g6e s PHE 41 Ca 0.00 -1.05 -0.15 0.00 -0.96 0.00 0.00 56.93 54.77 3g6e s PHE 41 Cb 0.00 0.42 0.02 0.00 -0.34 0.00 0.00 43.02 43.12 3g6e s PHE 41 CO 0.00 -1.39 0.32 0.00 -1.46 0.00 0.00 175.22 172.69 3g6e s ALA 42 N -2.58 -0.78 0.00 11.12 0.00 -1.26 0.07 121.76 128.33 3g6e s ALA 42 Ca 0.23 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.43 3g6e s ALA 42 Cb -0.03 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.25 3g6e s ALA 42 CO 0.16 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.01 3g6e n GLY 43 N 1.03 4.01 2.98 0.00 0.00 -0.50 -4.68 105.19 108.03 3g6e n GLY 43 Ca -0.21 -1.47 -0.24 0.00 0.00 0.00 0.00 46.02 44.10 3g6e n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g6e s TYR 44 N -2.66 1.35 0.16 1.61 1.51 -0.28 -1.90 117.35 117.15 3g6e s TYR 44 Ca 0.00 -0.53 -0.31 0.00 -1.01 0.00 0.00 57.07 55.21 3g6e s TYR 44 Cb 0.00 -1.05 -0.10 0.00 -0.11 0.00 0.00 41.96 40.70 3g6e s TYR 44 CO 0.00 -0.32 1.61 0.21 -1.11 0.00 0.00 175.55 175.94 3g6e s LYS 45 N 0.96 4.20 -0.23 -0.62 2.20 -0.20 -1.03 119.74 125.01 3g6e s LYS 45 Ca -0.09 2.40 -0.13 0.00 -0.36 0.00 0.00 55.97 57.78 3g6e s LYS 45 Cb -0.15 -3.21 -0.10 0.00 -1.51 0.00 0.00 37.83 32.86 3g6e s LYS 45 CO 0.00 -0.65 -0.32 0.00 -0.36 0.00 0.00 175.35 174.03 3g6e n ALA 46 N 4.23 1.35 0.00 3.13 0.00 -0.23 -0.50 120.51 128.49 3g6e n ALA 46 Ca 0.14 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.65 3g6e n ALA 46 Cb 0.38 0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.99 3g6e n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g6e n GLY 47 N 1.50 -0.87 3.27 0.00 0.00 -1.12 -4.76 105.19 103.21 3g6e n GLY 47 Ca -0.42 -1.16 -0.23 0.00 0.00 0.00 0.00 46.02 44.21 3g6e n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g6e s MET 48 N -1.98 1.08 0.35 1.61 -1.94 -1.26 0.19 119.30 117.36 3g6e s MET 48 Ca 0.00 -1.15 -0.04 0.00 -1.71 0.00 0.00 55.69 52.80 3g6e s MET 48 Cb 0.00 -1.30 0.01 0.00 2.01 0.00 0.00 34.83 35.55 3g6e s MET 48 CO 0.00 0.30 0.52 0.95 -0.01 0.00 0.00 175.02 176.77 3g6e s THR 49 N -1.24 0.00 0.20 2.05 -4.23 -0.68 -4.96 115.64 106.78 3g6e s THR 49 Ca 0.06 -1.53 0.10 0.00 -1.18 0.00 0.00 61.69 59.13 3g6e s THR 49 Cb -0.10 -2.68 -0.04 0.00 1.34 0.00 0.00 72.50 71.02 3g6e s THR 49 CO 0.04 0.00 -0.19 -1.38 -0.54 0.00 0.00 174.62 172.55 3g6e s HIS 50 N -2.93 2.01 -0.01 3.99 -3.43 -1.26 -0.89 115.29 112.77 3g6e s HIS 50 Ca 0.29 -0.43 0.04 0.00 -0.80 0.00 0.00 55.06 54.16 3g6e s HIS 50 Cb -0.01 -0.96 -0.01 0.00 -1.43 0.00 0.00 32.58 30.17 3g6e s HIS 50 CO 0.20 0.46 -0.13 0.54 -2.00 0.00 0.00 174.74 173.80 3g6e s VAL 51 N -2.21 1.03 -0.17 -5.38 0.11 -0.16 -1.32 120.40 112.30 3g6e s VAL 51 Ca 0.21 -0.55 -0.17 0.00 -2.93 0.00 0.00 61.98 58.54 3g6e s VAL 51 Cb -0.05 -0.86 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 3g6e s VAL 51 CO 0.09 0.29 0.42 -0.69 -3.33 0.00 0.00 175.10 171.89 3g6e s VAL 52 N -0.26 5.20 0.13 2.04 1.01 0.48 -0.46 120.40 128.54 3g6e s VAL 52 Ca 0.04 0.79 0.05 0.00 0.00 0.00 0.00 61.98 62.86 3g6e s VAL 52 Cb -0.06 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 3g6e s VAL 52 CO -0.00 0.28 -0.11 -0.22 0.00 0.00 0.00 175.10 175.05 3g6e s LEU 53 N 1.02 2.48 -0.18 3.92 2.96 0.11 -2.03 118.68 126.97 3g6e s LEU 53 Ca 0.21 -0.94 -0.13 0.00 -0.22 0.00 0.00 54.13 53.06 3g6e s LEU 53 Cb -0.15 -0.39 -0.05 0.00 0.50 0.00 0.00 46.19 46.11 3g6e s LEU 53 CO 0.08 -0.28 0.27 -0.69 -1.32 0.00 0.00 176.35 174.41 3g6e s VAL 54 N -2.92 5.31 0.02 1.68 1.01 -0.91 -0.39 120.40 124.21 3g6e s VAL 54 Ca 0.13 0.48 -0.30 0.00 0.00 0.00 0.00 61.98 62.29 3g6e s VAL 54 Cb -0.00 -3.61 -0.09 0.00 0.00 0.00 0.00 36.38 32.68 3g6e s VAL 54 CO 0.01 0.37 1.99 -3.20 0.00 0.00 0.00 175.10 174.28 3g6e n ASN 55 N 3.76 4.13 0.01 3.32 2.85 -0.93 -4.55 115.26 123.85 3g6e n ASN 55 Ca -0.12 0.86 -0.01 0.00 -0.11 0.00 0.00 54.58 55.20 3g6e n ASN 55 Cb 0.52 -1.53 -0.10 0.00 1.24 0.00 0.00 39.78 39.91 3g6e n ASN 55 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3g6e n ASP 56 N 7.76 0.67 -4.62 1.20 8.00 -1.26 -2.60 116.55 125.69 3g6e n ASP 56 Ca 0.21 0.29 -0.43 0.00 0.71 0.00 0.00 54.79 55.57 3g6e n ASP 56 Cb 0.41 0.43 -0.03 0.00 -0.02 0.00 0.00 41.12 41.91 3g6e n ASP 56 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3g6e s GLU 57 N -2.90 3.52 0.44 -1.24 2.12 -1.26 -4.90 118.70 114.47 3g6e s GLU 57 Ca -0.04 2.24 0.30 0.00 0.36 0.00 0.00 54.97 57.83 3g6e s GLU 57 Cb 0.09 -4.29 1.35 0.00 0.26 0.00 0.00 34.13 31.54 3g6e s GLU 57 CO 0.82 -1.66 1.90 -1.00 -0.54 0.00 0.00 175.26 174.78 3g6e h PRO 58 N 13.33 0.00 -0.02 4.30 0.13 -2.01 -2.95 132.00 144.78 3g6e h PRO 58 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3g6e h PRO 58 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3g6e h PRO 58 CO 0.95 0.00 -0.06 0.09 -0.23 0.00 0.00 178.00 178.76 3g6e n ASN 59 N -2.68 2.35 -4.81 1.44 3.02 -1.26 -4.94 115.26 108.38 3g6e n ASN 59 Ca 0.00 -1.75 -0.38 0.00 -0.03 0.00 0.00 54.58 52.43 3g6e n ASN 59 Cb 0.21 0.05 -0.06 0.00 -0.61 0.00 0.00 39.78 39.38 3g6e n ASN 59 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3g6e s SER 60 N -2.07 7.08 0.13 6.41 0.15 -1.11 -4.96 113.70 119.32 3g6e s SER 60 Ca 0.30 1.30 0.21 0.00 0.70 0.00 0.00 55.95 58.46 3g6e s SER 60 Cb 0.20 -2.37 0.85 0.00 -1.71 0.00 0.00 66.02 62.98 3g6e s SER 60 CO 0.35 0.23 1.64 -2.65 1.20 0.00 0.00 173.24 174.00 3g6e n PRO 61 N 1.51 0.11 -0.80 5.44 -0.02 -1.26 -2.75 135.00 137.22 3g6e n PRO 61 Ca -0.08 0.30 0.06 0.00 -2.02 0.00 0.00 63.50 61.75 3g6e n PRO 61 Cb 0.51 -1.69 0.35 0.00 -0.02 0.00 0.00 33.50 32.65 3g6e n PRO 61 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3g6e n ARG 62 N -1.88 4.20 -1.62 -0.52 1.74 -1.26 -5.00 116.66 112.31 3g6e n ARG 62 Ca 0.03 -3.08 -0.43 0.00 -0.77 0.00 0.00 57.85 53.60 3g6e n ARG 62 Cb 0.24 -2.15 -0.03 0.00 -1.02 0.00 0.00 32.46 29.50 3g6e n ARG 62 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3g6e n GLU 63 N 0.19 2.28 0.00 5.56 2.13 -1.11 -1.63 120.64 128.06 3g6e n GLU 63 Ca 0.28 0.72 0.00 0.00 0.66 0.00 0.00 57.16 58.82 3g6e n GLU 63 Cb 1.14 -3.12 0.00 0.00 0.27 0.00 0.00 31.44 29.73 3g6e n GLU 63 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3g6e n GLY 64 N 5.31 0.39 3.93 8.31 0.00 -1.07 -4.98 105.19 117.07 3g6e n GLY 64 Ca 0.26 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.03 3g6e n GLY 64 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g6e s MET 65 N -0.76 3.32 -0.09 1.61 -1.94 -0.65 -4.70 119.30 116.09 3g6e s MET 65 Ca 0.00 -0.11 -0.30 0.00 -1.71 0.00 0.00 55.69 53.57 3g6e s MET 65 Cb 0.00 -2.46 -0.02 0.00 2.01 0.00 0.00 34.83 34.36 3g6e s MET 65 CO 0.00 -0.22 1.08 -1.21 -0.01 0.00 0.00 175.02 174.66 3g6e s GLU 66 N -4.65 4.39 -0.03 2.03 2.02 -1.26 -2.19 118.70 119.01 3g6e s GLU 66 Ca 0.47 1.50 0.03 0.00 0.02 0.00 0.00 54.97 56.99 3g6e s GLU 66 Cb -0.10 -3.55 0.00 0.00 0.10 0.00 0.00 34.13 30.58 3g6e s GLU 66 CO 0.41 -0.37 -0.11 -2.00 0.02 0.00 0.00 175.26 173.21 3g6e s GLU 67 N 2.12 1.18 -0.18 1.61 2.12 0.47 -4.95 118.70 121.08 3g6e s GLU 67 Ca 0.51 -0.36 -0.20 0.00 0.36 0.00 0.00 54.97 55.28 3g6e s GLU 67 Cb -0.21 -1.07 -0.03 0.00 0.26 0.00 0.00 34.13 33.09 3g6e s GLU 67 CO 0.19 0.11 0.59 0.99 -0.54 0.00 0.00 175.26 176.60 3g6e s THR 68 N 0.27 5.07 -0.07 -1.70 2.01 -1.26 0.05 115.64 120.00 3g6e s THR 68 Ca -0.05 1.11 0.04 0.00 0.31 0.00 0.00 61.69 63.10 3g6e s THR 68 Cb -0.10 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.50 3g6e s THR 68 CO 0.01 0.16 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.22 3g6e s VAL 69 N 1.60 1.70 0.35 3.82 1.01 0.39 -4.99 120.40 124.29 3g6e s VAL 69 Ca 0.28 -0.83 -0.26 0.00 0.00 0.00 0.00 61.98 61.16 3g6e s VAL 69 Cb -0.16 -1.48 -0.09 0.00 0.00 0.00 0.00 36.38 34.65 3g6e s VAL 69 CO 0.11 0.48 1.09 -2.84 0.00 0.00 0.00 175.10 173.94 3g6e s PRO 70 N 0.27 4.33 -0.01 2.72 0.02 -1.26 -0.99 135.00 140.08 3g6e s PRO 70 Ca -0.12 1.69 0.00 0.00 0.02 0.00 0.00 61.00 62.60 3g6e s PRO 70 Cb -0.15 -2.83 0.01 0.00 0.02 0.00 0.00 34.50 31.54 3g6e s PRO 70 CO 0.05 -0.03 -0.00 0.54 -0.33 0.00 0.00 177.00 177.23 3g6e s VAL 71 N -1.41 0.05 -0.26 3.83 0.11 -0.07 -0.94 120.40 121.72 3g6e s VAL 71 Ca 0.52 0.02 -0.10 0.00 -2.93 0.00 0.00 61.98 59.49 3g6e s VAL 71 Cb -0.28 -0.08 -0.05 0.00 -1.53 0.00 0.00 36.38 34.44 3g6e s VAL 71 CO 0.35 0.04 0.16 -0.89 -3.33 0.00 0.00 175.10 171.43 3g6e s THR 72 N 0.26 5.19 -0.16 5.04 2.01 0.50 -1.69 115.64 126.79 3g6e s THR 72 Ca -0.02 0.13 -0.25 0.00 0.31 0.00 0.00 61.69 61.85 3g6e s THR 72 Cb -0.04 -3.44 -0.02 0.00 0.01 0.00 0.00 72.50 69.01 3g6e s THR 72 CO -0.01 0.30 0.83 -0.69 -0.69 0.00 0.00 174.62 174.36 3g6e s VAL 73 N 1.43 4.89 -0.09 3.82 1.01 0.13 -1.42 120.40 130.17 3g6e s VAL 73 Ca 0.07 1.63 0.02 0.00 0.00 0.00 0.00 61.98 63.69 3g6e s VAL 73 Cb -0.15 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.11 3g6e s VAL 73 CO 0.07 0.04 -0.13 -0.63 0.00 0.00 0.00 175.10 174.46 3g6e s ILE 74 N 2.05 1.26 -0.32 2.22 1.01 -0.56 -1.07 121.20 125.79 3g6e s ILE 74 Ca 0.38 -0.51 -0.29 0.00 0.00 0.00 0.00 60.65 60.23 3g6e s ILE 74 Cb -0.17 -1.16 0.02 0.00 0.01 0.00 0.00 42.46 41.16 3g6e s ILE 74 CO 0.13 0.39 1.06 -1.61 0.00 0.00 0.00 174.94 174.91 3g6e s GLU 75 N 0.93 4.06 -0.73 2.79 2.02 -0.20 -0.69 118.70 126.89 3g6e s GLU 75 Ca -0.09 1.06 0.04 0.00 0.02 0.00 0.00 54.97 56.00 3g6e s GLU 75 Cb -0.15 -3.74 0.23 0.00 0.10 0.00 0.00 34.13 30.57 3g6e s GLU 75 CO 0.00 -0.89 0.73 0.25 0.02 0.00 0.00 175.26 175.37 3g6e n THR 76 N 5.85 2.46 -1.54 3.63 -2.24 0.42 -1.12 114.28 121.74 3g6e n THR 76 Ca 0.12 -5.16 -0.30 0.00 -2.27 0.00 0.00 64.05 56.44 3g6e n THR 76 Cb 0.47 -2.16 0.10 0.00 -2.10 0.00 0.00 70.33 66.64 3g6e n THR 76 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 3g6e s PRO 77 N -2.05 1.90 0.40 -0.78 0.02 -1.25 -4.54 135.00 128.69 3g6e s PRO 77 Ca 0.33 0.59 -0.27 0.00 0.02 0.00 0.00 61.00 61.67 3g6e s PRO 77 Cb 0.05 -1.90 -0.10 0.00 0.02 0.00 0.00 34.50 32.58 3g6e s PRO 77 CO -0.07 -1.74 1.42 -2.14 -0.33 0.00 0.00 177.00 174.14 3g6e s PRO 78 N -5.17 3.98 0.42 5.54 0.02 -1.26 -4.84 135.00 133.70 3g6e s PRO 78 Ca 0.61 2.42 0.08 0.00 0.02 0.00 0.00 61.00 64.13 3g6e s PRO 78 Cb -0.15 -2.85 -0.01 0.00 0.02 0.00 0.00 34.50 31.51 3g6e s PRO 78 CO 0.54 -0.58 0.43 -1.64 -0.33 0.00 0.00 177.00 175.42 3g6e s MET 79 N -2.19 2.58 -0.20 5.54 -1.94 -0.88 -4.39 119.30 117.81 3g6e s MET 79 Ca 0.55 -1.50 0.01 0.00 -1.71 0.00 0.00 55.69 53.05 3g6e s MET 79 Cb -0.44 -2.45 0.04 0.00 2.01 0.00 0.00 34.83 33.99 3g6e s MET 79 CO 0.58 -0.24 -0.14 1.03 -0.01 0.00 0.00 175.02 176.24 3g6e s ARG 80 N -4.19 2.39 -1.10 2.03 1.81 -0.81 -2.50 118.95 116.58 3g6e s ARG 80 Ca 0.49 -0.92 -0.18 0.00 -1.72 0.00 0.00 55.73 53.41 3g6e s ARG 80 Cb -0.05 -2.53 0.12 0.00 -0.45 0.00 0.00 34.95 32.04 3g6e s ARG 80 CO 0.29 -0.37 1.39 0.00 -0.68 0.00 0.00 175.30 175.92 3g6e s ALA 81 N 1.31 3.44 -1.01 2.13 0.00 0.66 -2.13 121.76 126.16 3g6e s ALA 81 Ca -0.00 -2.89 0.17 0.00 0.00 0.00 0.00 51.96 49.24 3g6e s ALA 81 Cb -0.16 -4.26 0.75 0.00 0.00 0.00 0.00 23.12 19.45 3g6e s ALA 81 CO -0.09 -3.09 1.56 1.33 0.00 0.00 0.00 175.76 175.47 3g6e n VAL 82 N 5.63 0.79 -3.59 0.00 0.24 -0.76 -4.17 118.33 116.47 3g6e n VAL 82 Ca 0.34 0.20 -0.09 0.00 -2.04 0.00 0.00 64.34 62.74 3g6e n VAL 82 Cb 0.47 -0.90 -0.02 0.00 -1.47 0.00 0.00 33.84 31.92 3g6e n VAL 82 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3g6e s ALA 83 N -2.99 -1.53 -0.24 2.33 0.00 -1.15 -3.37 121.76 114.80 3g6e s ALA 83 Ca 0.09 0.31 0.01 0.00 0.00 0.00 0.00 51.96 52.36 3g6e s ALA 83 Cb 0.11 0.78 0.06 0.00 0.00 0.00 0.00 23.12 24.08 3g6e s ALA 83 CO 0.32 -0.86 -0.06 -1.17 0.00 0.00 0.00 175.76 173.99 3g6e s LEU 84 N -2.78 2.76 0.07 0.00 1.98 -0.66 -1.23 118.68 118.83 3g6e s LEU 84 Ca 0.06 -1.24 -0.08 0.00 -2.89 0.00 0.00 54.13 49.98 3g6e s LEU 84 Cb -0.02 -1.25 -0.05 0.00 0.66 0.00 0.00 46.19 45.52 3g6e s LEU 84 CO -0.05 -0.23 0.36 -0.60 -1.89 0.00 0.00 176.35 173.93 3g6e s ARG 85 N 1.34 3.68 0.00 1.98 3.52 0.43 -1.10 118.95 128.80 3g6e s ARG 85 Ca -0.06 0.05 0.06 0.00 -0.13 0.00 0.00 55.73 55.65 3g6e s ARG 85 Cb -0.19 -2.99 -0.02 0.00 -1.56 0.00 0.00 34.95 30.19 3g6e s ARG 85 CO -0.06 0.57 -0.17 0.00 -0.81 0.00 0.00 175.30 174.82 3g6e s ALA 86 N -1.42 1.44 0.07 6.12 0.00 -0.86 -2.14 121.76 124.98 3g6e s ALA 86 Ca 0.33 -0.80 0.05 0.00 0.00 0.00 0.00 51.96 51.55 3g6e s ALA 86 Cb -0.13 -0.33 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 3g6e s ALA 86 CO 0.19 0.34 -0.05 0.71 0.00 0.00 0.00 175.76 176.94 3g6e s TYR 87 N -0.52 2.87 0.03 0.00 1.51 -0.96 -0.10 117.35 120.18 3g6e s TYR 87 Ca 0.06 -0.08 0.07 0.00 -1.01 0.00 0.00 57.07 56.11 3g6e s TYR 87 Cb -0.07 -1.52 -0.03 0.00 -0.11 0.00 0.00 41.96 40.23 3g6e s TYR 87 CO -0.00 0.44 -0.19 -1.83 -1.11 0.00 0.00 175.55 172.85 3g6e s GLU 88 N -2.06 2.10 -0.71 -0.62 -1.05 -0.38 0.15 118.70 116.13 3g6e s GLU 88 Ca 0.22 -0.96 -0.26 0.00 -0.15 0.00 0.00 54.97 53.83 3g6e s GLU 88 Cb -0.11 -2.18 0.04 0.00 -0.44 0.00 0.00 34.13 31.44 3g6e s GLU 88 CO 0.14 0.55 1.19 -0.51 0.95 0.00 0.00 175.26 177.58 3g6e s ASP 89 N -1.27 6.18 0.25 0.83 1.01 0.15 -2.54 116.67 121.28 3g6e s ASP 89 Ca 0.14 -0.56 0.06 0.00 0.71 0.00 0.00 52.55 52.89 3g6e s ASP 89 Cb -0.10 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 3g6e s ASP 89 CO 0.04 -1.72 0.29 0.42 0.21 0.00 0.00 175.17 174.41 3g6e s THR 90 N 5.26 4.86 -1.88 -1.27 -4.23 -0.55 -4.96 115.64 112.87 3g6e s THR 90 Ca 0.32 -1.18 0.07 0.00 -1.18 0.00 0.00 61.69 59.72 3g6e s THR 90 Cb -0.10 -3.64 0.19 0.00 1.34 0.00 0.00 72.50 70.29 3g6e s THR 90 CO 0.14 -0.34 0.94 -2.65 -0.54 0.00 0.00 174.62 172.18 3g6e n PRO 91 N -1.31 0.20 -0.26 3.99 -0.02 -1.26 -1.59 135.00 134.75 3g6e n PRO 91 Ca -0.08 0.05 0.09 0.00 -2.02 0.00 0.00 63.50 61.53 3g6e n PRO 91 Cb 0.57 -1.50 0.20 0.00 -0.02 0.00 0.00 33.50 32.75 3g6e n PRO 91 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3g6e n TYR 92 N -1.06 0.50 0.00 6.00 4.02 -1.26 -5.10 117.16 120.26 3g6e n TYR 92 Ca 0.05 -0.91 0.00 0.00 -0.01 0.00 0.00 57.90 57.03 3g6e n TYR 92 Cb 0.03 -0.23 0.00 0.00 -0.02 0.00 0.00 39.34 39.12 3g6e n TYR 92 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3g6e n GLY 93 N -0.87 -0.98 3.63 2.72 0.00 -0.62 -4.94 105.19 104.14 3g6e n GLY 93 Ca 0.18 -1.98 -0.39 0.00 0.00 0.00 0.00 46.02 43.83 3g6e n GLY 93 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g6e s GLN 94 N 0.00 4.10 -0.03 1.61 -0.21 -1.26 -1.48 119.66 122.39 3g6e s GLN 94 Ca 0.00 0.27 0.07 0.00 0.02 0.00 0.00 55.36 55.71 3g6e s GLN 94 Cb 0.00 -3.61 -0.02 0.00 1.00 0.00 0.00 33.01 30.38 3g6e s GLN 94 CO 0.00 -0.24 -0.22 1.03 -2.12 0.00 0.00 175.29 173.74 3g6e s ARG 95 N 1.94 2.24 0.22 2.91 0.52 -1.05 -4.95 118.95 120.77 3g6e s ARG 95 Ca 0.20 -0.86 -0.31 0.00 -0.52 0.00 0.00 55.73 54.25 3g6e s ARG 95 Cb -0.15 -2.14 -0.10 0.00 0.52 0.00 0.00 34.95 33.07 3g6e s ARG 95 CO 0.09 0.58 1.53 -2.14 0.02 0.00 0.00 175.30 175.38 3g6e s PRO 96 N -0.64 4.22 0.00 3.54 0.02 -1.26 -1.25 135.00 139.63 3g6e s PRO 96 Ca 0.10 2.38 0.00 0.00 0.02 0.00 0.00 61.00 63.50 3g6e s PRO 96 Cb -0.10 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.30 3g6e s PRO 96 CO -0.00 -0.55 0.00 -0.11 -0.33 0.00 0.00 177.00 176.01 3g6e n LEU 97 N 3.12 0.28 -3.92 -5.54 0.00 0.86 -4.87 117.00 106.93 3g6e n LEU 97 Ca 0.11 0.14 -0.10 0.00 0.00 0.00 0.00 56.01 56.16 3g6e n LEU 97 Cb 0.39 -0.37 -0.06 0.00 0.00 0.00 0.00 43.42 43.37 3g6e n LEU 97 CO 0.62 -0.37 0.04 0.42 0.00 0.00 0.00 177.39 178.10 3g6e s THR 98 N -0.74 0.06 0.00 1.96 -4.23 -1.24 -5.02 115.64 106.42 3g6e s THR 98 Ca 0.00 -1.27 0.06 0.00 -1.18 0.00 0.00 61.69 59.30 3g6e s THR 98 Cb 0.00 -1.79 -0.02 0.00 1.34 0.00 0.00 72.50 72.03 3g6e s THR 98 CO 0.00 -0.26 -0.19 -1.61 -0.54 0.00 0.00 174.62 172.02 3g6e s GLU 99 N -3.95 1.46 -0.35 3.99 2.02 -1.26 -2.02 118.70 118.58 3g6e s GLU 99 Ca 0.16 -0.73 -0.04 0.00 0.02 0.00 0.00 54.97 54.37 3g6e s GLU 99 Cb 0.02 -1.45 0.07 0.00 0.10 0.00 0.00 34.13 32.87 3g6e s GLU 99 CO -0.00 0.39 0.12 0.08 0.02 0.00 0.00 175.26 175.86 3g6e s VAL 100 N -0.53 3.47 0.38 2.63 1.01 -0.26 -4.84 120.40 122.27 3g6e s VAL 100 Ca 0.07 -1.48 0.02 0.00 0.00 0.00 0.00 61.98 60.59 3g6e s VAL 100 Cb -0.08 -3.10 0.07 0.00 0.00 0.00 0.00 36.38 33.28 3g6e s VAL 100 CO -0.00 -0.33 0.53 0.79 0.00 0.00 0.00 175.10 176.09 3g6e n TRP 101 N 4.71 -2.94 -3.48 5.22 7.02 -1.26 -1.65 117.44 125.06 3g6e n TRP 101 Ca -0.10 -1.07 0.00 0.00 -1.02 0.00 0.00 57.50 55.31 3g6e n TRP 101 Cb 0.43 -0.38 0.00 0.00 -2.42 0.00 0.00 31.31 28.94 3g6e n TRP 101 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 3g6e n THR 102 N -2.04 0.00 -0.02 -0.99 -2.24 -1.22 -4.84 114.28 102.93 3g6e n THR 102 Ca 0.09 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.85 3g6e n THR 102 Cb 0.34 -0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.30 3g6e n THR 102 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3g6e n ASP 103 N -1.12 2.91 -4.61 3.42 8.00 -1.26 -4.99 116.55 118.90 3g6e n ASP 103 Ca 0.00 -0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 3g6e n ASP 103 Cb 0.00 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.01 3g6e n ASP 103 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3g6e s GLU 104 N -2.07 3.87 0.18 -1.24 2.02 -1.26 -5.03 118.70 115.16 3g6e s GLU 104 Ca -0.05 0.73 0.09 0.00 0.02 0.00 0.00 54.97 55.77 3g6e s GLU 104 Cb 0.01 -3.82 -0.04 0.00 0.10 0.00 0.00 34.13 30.38 3g6e s GLU 104 CO 0.08 -1.09 -0.19 -0.06 0.02 0.00 0.00 175.26 174.02 3g6e s PHE 105 N 3.88 1.91 0.22 1.61 0.40 -1.26 -4.91 117.98 119.83 3g6e s PHE 105 Ca 0.44 -0.45 -0.30 0.00 -0.60 0.00 0.00 56.93 56.02 3g6e s PHE 105 Cb -0.10 -0.94 -0.08 0.00 0.51 0.00 0.00 43.02 42.40 3g6e s PHE 105 CO 0.22 0.38 1.05 -1.58 0.70 0.00 0.00 175.22 175.99 3g6e s HIS 106 N -2.08 3.70 0.45 0.36 5.65 -1.26 -4.95 115.29 117.16 3g6e s HIS 106 Ca 0.18 1.72 0.26 0.00 0.25 0.00 0.00 55.06 57.47 3g6e s HIS 106 Cb -0.06 -3.19 1.29 0.00 -1.18 0.00 0.00 32.58 29.44 3g6e s HIS 106 CO 0.08 -0.27 1.75 0.66 -0.65 0.00 0.00 174.74 176.30 3g6e h SER 107 N 4.52 0.28 -0.44 9.88 4.64 -2.02 -2.24 113.55 128.17 3g6e h SER 107 Ca -0.45 0.07 -0.22 0.00 -0.47 0.00 0.00 61.79 60.72 3g6e h SER 107 Cb 1.21 0.03 -0.13 0.00 -0.31 0.00 0.00 62.40 63.20 3g6e h SER 107 CO 0.70 0.02 0.02 -0.62 -0.87 0.00 0.00 176.83 176.07 3g6e n GLU 108 N -4.51 1.93 0.16 4.77 1.02 -1.26 -4.53 120.64 118.22 3g6e n GLU 108 Ca 0.28 -3.16 0.10 0.00 -0.02 0.00 0.00 57.16 54.35 3g6e n GLU 108 Cb 1.09 -1.87 0.07 0.00 -0.02 0.00 0.00 31.44 30.72 3g6e n GLU 108 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3g6e h LEU 109 N 1.03 0.00 0.00 -4.62 5.85 -1.73 -3.30 115.31 112.54 3g6e h LEU 109 Ca 0.27 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.99 3g6e h LEU 109 Cb 1.82 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.85 3g6e h LEU 109 CO 0.48 0.10 0.00 -0.90 -0.34 0.00 0.00 178.44 177.78 3g6e n ASP 110 N -2.95 0.00 0.14 1.25 5.75 -1.26 -2.27 116.55 117.22 3g6e n ASP 110 Ca 0.01 -0.70 0.12 0.00 -0.01 0.00 0.00 54.79 54.22 3g6e n ASP 110 Cb 0.58 0.00 0.15 0.00 -1.03 0.00 0.00 41.12 40.82 3g6e n ASP 110 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 3g6e h ARG 111 N 0.00 0.00 0.00 0.11 3.08 -1.93 -3.40 114.38 112.25 3g6e h ARG 111 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 3g6e h ARG 111 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3g6e h ARG 111 CO 0.00 0.00 -1.11 2.41 -1.07 0.00 0.00 179.97 180.20 3g6e n THR 112 N -2.71 0.31 -3.43 2.04 -1.04 -0.96 -5.00 114.28 103.49 3g6e n THR 112 Ca 0.03 -0.01 -0.19 0.00 -2.04 0.00 0.00 64.05 61.84 3g6e n THR 112 Cb 0.51 -1.56 -0.01 0.00 -1.82 0.00 0.00 70.33 67.45 3g6e n THR 112 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3g6e s LEU 113 N -6.29 3.79 -0.90 -4.42 1.43 -0.98 -5.05 118.68 106.26 3g6e s LEU 113 Ca -0.05 -0.34 -0.09 0.00 -1.03 0.00 0.00 54.13 52.61 3g6e s LEU 113 Cb 0.02 -2.58 0.23 0.00 0.03 0.00 0.00 46.19 43.89 3g6e s LEU 113 CO 0.07 -0.51 0.83 -1.81 0.23 0.00 0.00 176.35 175.15 3g6e s ASP 114 N -4.18 6.64 0.09 2.29 1.01 -1.26 -4.43 116.67 116.82 3g6e s ASP 114 Ca 0.47 -3.12 -0.36 0.00 0.71 0.00 0.00 52.55 50.24 3g6e s ASP 114 Cb -0.08 -2.12 -0.16 0.00 1.01 0.00 0.00 42.92 41.56 3g6e s ASP 114 CO 0.30 -0.41 1.40 0.52 0.21 0.00 0.00 175.17 177.20 3g6e n VAL 115 N 3.31 0.01 -1.82 -1.27 0.31 -1.26 -4.92 118.33 112.69 3g6e n VAL 115 Ca 0.17 -0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.08 3g6e n VAL 115 Cb 0.42 -0.97 -0.03 0.00 -0.91 0.00 0.00 33.84 32.35 3g6e n VAL 115 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 3g6e s PRO 116 N 0.66 4.17 -0.23 5.55 0.02 -1.26 -4.92 135.00 139.00 3g6e s PRO 116 Ca 0.84 2.47 -0.01 0.00 0.02 0.00 0.00 61.00 64.32 3g6e s PRO 116 Cb -0.90 -3.52 -0.14 0.00 0.02 0.00 0.00 34.50 29.96 3g6e s PRO 116 CO 0.46 -0.77 -0.22 0.39 -0.33 0.00 0.00 177.00 176.52 3g6e n GLU 117 N 5.36 0.55 -3.94 5.54 1.02 -1.26 -4.92 120.64 122.99 3g6e n GLU 117 Ca 0.16 0.15 -0.30 0.00 -0.02 0.00 0.00 57.16 57.15 3g6e n GLU 117 Cb 0.39 -1.43 -0.15 0.00 -0.02 0.00 0.00 31.44 30.23 3g6e n GLU 117 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3g6e s ASP 118 N -6.35 3.94 0.03 1.62 1.01 -1.26 -5.11 116.67 110.55 3g6e s ASP 118 Ca -0.31 -1.27 -0.05 0.00 0.71 0.00 0.00 52.55 51.63 3g6e s ASP 118 Cb 0.09 -1.20 -0.01 0.00 1.01 0.00 0.00 42.92 42.80 3g6e s ASP 118 CO 0.49 -0.25 0.08 -2.28 0.21 0.00 0.00 175.17 173.43 3g6e s HIS 119 N 1.37 0.19 -0.46 4.23 2.46 -1.26 -5.13 115.29 116.69 3g6e s HIS 119 Ca -0.04 -0.47 0.01 0.00 0.47 0.00 0.00 55.06 55.03 3g6e s HIS 119 Cb -0.19 -0.14 0.12 0.00 -0.13 0.00 0.00 32.58 32.24 3g6e s HIS 119 CO -0.07 -0.34 0.22 0.34 -2.47 0.00 0.00 174.74 172.42 3g6e s ASP 120 N -1.97 4.80 0.08 9.88 -1.08 -1.26 -4.96 116.67 122.16 3g6e s ASP 120 Ca -0.07 -2.54 0.16 0.00 -0.52 0.00 0.00 52.55 49.58 3g6e s ASP 120 Cb -0.03 -1.71 0.70 0.00 -1.46 0.00 0.00 42.92 40.42 3g6e s ASP 120 CO -0.03 -0.36 1.51 -2.65 0.52 0.00 0.00 175.17 174.16 3g6e n PRO 121 N 3.80 0.06 -0.02 4.34 -0.02 -1.26 -3.05 135.00 138.85 3g6e n PRO 121 Ca 0.04 0.32 -0.18 0.00 -2.02 0.00 0.00 63.50 61.67 3g6e n PRO 121 Cb 0.38 -1.62 -0.14 0.00 -0.02 0.00 0.00 33.50 32.10 3g6e n PRO 121 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3g6e n ASP 122 N -1.73 1.74 0.13 2.55 9.92 -1.26 -3.11 116.55 124.79 3g6e n ASP 122 Ca 0.03 0.22 -0.02 0.00 -0.53 0.00 0.00 54.79 54.48 3g6e n ASP 122 Cb 0.17 -0.56 0.16 0.00 -0.64 0.00 0.00 41.12 40.25 3g6e n ASP 122 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3g6e h ALA 123 N 0.32 0.96 -0.13 2.24 0.00 -1.98 -0.94 119.26 119.72 3g6e h ALA 123 Ca -0.41 -0.56 -0.07 0.00 0.00 0.00 0.00 54.91 53.86 3g6e h ALA 123 Cb 2.03 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.72 3g6e h ALA 123 CO 0.07 0.77 -0.20 0.00 0.00 0.00 0.00 179.25 179.89 3g6e h ALA 124 N 1.35 0.19 -0.26 0.00 0.00 -1.71 -2.08 119.26 116.75 3g6e h ALA 124 Ca -0.01 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 3g6e h ALA 124 Cb 1.10 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3g6e h ALA 124 CO 0.08 0.13 -0.02 1.49 0.00 0.00 0.00 179.25 180.93 3g6e h GLU 125 N -0.05 0.40 -0.32 0.00 4.81 -1.46 -2.41 114.58 115.54 3g6e h GLU 125 Ca 0.01 -0.08 -0.16 0.00 -0.13 0.00 0.00 59.36 59.00 3g6e h GLU 125 Cb 0.76 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.08 3g6e h GLU 125 CO 0.05 0.45 -0.42 1.49 -0.73 0.00 0.00 179.01 179.85 3g6e h GLU 126 N 0.39 0.85 -0.42 1.92 4.81 -1.08 -2.44 114.58 118.61 3g6e h GLU 126 Ca 0.09 -0.48 -0.06 0.00 -0.13 0.00 0.00 59.36 58.77 3g6e h GLU 126 Cb 0.30 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 3g6e h GLU 126 CO 0.01 1.12 0.01 0.37 -0.73 0.00 0.00 179.01 179.80 3g6e h GLN 127 N 0.63 0.67 -0.23 1.92 4.15 -0.91 -1.42 115.11 119.91 3g6e h GLN 127 Ca 0.04 -0.16 -0.17 0.00 0.77 0.00 0.00 58.65 59.13 3g6e h GLN 127 Cb 1.01 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.61 3g6e h GLN 127 CO 0.10 0.68 -0.54 0.82 -1.93 0.00 0.00 178.83 177.96 3g6e h ILE 128 N 0.63 1.30 0.00 2.39 2.04 -1.39 -2.87 117.51 119.62 3g6e h ILE 128 Ca 0.13 -1.75 -0.14 0.00 1.00 0.00 0.00 64.86 64.10 3g6e h ILE 128 Cb 0.38 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 3g6e h ILE 128 CO 0.01 0.56 -0.67 0.03 0.00 0.00 0.00 178.15 178.08 3g6e h ARG 129 N 0.53 0.00 0.00 2.37 3.08 -1.12 -2.33 114.38 116.92 3g6e h ARG 129 Ca 0.01 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.95 3g6e h ARG 129 Cb 1.10 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.14 3g6e h ARG 129 CO 0.11 0.67 -0.55 -0.44 -1.07 0.00 0.00 179.97 178.69 3g6e h ASP 130 N 0.00 0.00 0.77 7.04 3.32 -1.25 -2.22 116.42 124.08 3g6e h ASP 130 Ca -0.01 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 3g6e h ASP 130 Cb 1.36 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.89 3g6e h ASP 130 CO 0.09 0.55 -0.96 0.00 -1.72 0.00 0.00 179.24 177.20 3g6e h ALA 131 N 1.45 0.43 -0.12 3.45 0.00 -1.39 -2.50 119.26 120.57 3g6e h ALA 131 Ca -0.01 -0.81 -0.19 0.00 0.00 0.00 0.00 54.91 53.91 3g6e h ALA 131 Cb 1.09 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 3g6e h ALA 131 CO 0.07 1.05 -0.69 1.25 0.00 0.00 0.00 179.25 180.93 3g6e h HIS 132 N 0.04 0.69 -0.31 0.00 -0.00 -1.24 -0.38 115.15 113.96 3g6e h HIS 132 Ca -0.04 -0.29 -0.10 0.00 -0.00 0.00 0.00 60.37 59.94 3g6e h HIS 132 Cb 1.65 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 28.93 3g6e h HIS 132 CO 0.02 1.06 -0.24 0.93 -0.00 0.00 0.00 177.93 179.69 3g6e h GLU 133 N 0.37 0.60 0.00 5.26 5.08 -1.40 -2.76 114.58 121.73 3g6e h GLU 133 Ca -0.03 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 3g6e h GLU 133 Cb 1.27 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3g6e h GLU 133 CO 0.13 0.79 0.00 0.00 -1.00 0.00 0.00 179.01 178.93 3g6e h ALA 134 N 1.21 1.00 -0.73 3.43 0.00 -1.34 -3.47 119.26 119.35 3g6e h ALA 134 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3g6e h ALA 134 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3g6e h ALA 134 CO 0.05 0.00 -0.09 0.41 0.00 0.00 0.00 179.25 179.63 3g6e n GLY 135 N 1.04 0.34 0.13 0.00 0.00 -0.79 -4.96 105.19 100.95 3g6e n GLY 135 Ca 0.04 -0.71 0.05 0.00 0.00 0.00 0.00 46.02 45.41 3g6e n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3g6e n ASP 136 N 1.26 0.92 -4.70 1.61 8.00 -0.22 -4.98 116.55 118.44 3g6e n ASP 136 Ca -0.03 -0.96 -0.42 0.00 0.71 0.00 0.00 54.79 54.09 3g6e n ASP 136 Cb 0.52 0.73 -0.03 0.00 -0.02 0.00 0.00 41.12 42.33 3g6e n ASP 136 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3g6e s LEU 137 N -2.12 4.33 0.00 0.64 2.96 -1.14 0.30 118.68 123.65 3g6e s LEU 137 Ca 0.07 2.13 0.00 0.00 -0.22 0.00 0.00 54.13 56.11 3g6e s LEU 137 Cb 0.09 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.21 3g6e s LEU 137 CO 0.37 -0.67 0.00 0.61 -1.32 0.00 0.00 176.35 175.34 3g6e n GLY 138 N 3.55 1.42 3.43 7.98 0.00 0.12 -4.75 105.19 116.95 3g6e n GLY 138 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 3g6e n GLY 138 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3g6e s ASP 139 N -1.00 2.98 -0.23 1.61 -4.77 -1.26 -4.97 116.67 109.04 3g6e s ASP 139 Ca 0.00 -1.13 -0.02 0.00 -3.30 0.00 0.00 52.55 48.10 3g6e s ASP 139 Cb 0.00 -0.21 0.01 0.00 -1.09 0.00 0.00 42.92 41.64 3g6e s ASP 139 CO 0.00 -0.23 -0.07 -0.76 0.70 0.00 0.00 175.17 174.81 3g6e s LEU 140 N -3.45 2.96 0.16 2.11 1.43 -1.26 -2.26 118.68 118.36 3g6e s LEU 140 Ca 0.28 -0.66 0.09 0.00 -1.03 0.00 0.00 54.13 52.82 3g6e s LEU 140 Cb 0.01 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 3g6e s LEU 140 CO 0.12 -0.07 -0.20 -0.13 0.23 0.00 0.00 176.35 176.29 3g6e s ARG 141 N 1.38 1.29 -0.11 1.70 0.52 -0.91 -0.94 118.95 121.89 3g6e s ARG 141 Ca 0.03 -1.38 -0.01 0.00 -0.52 0.00 0.00 55.73 53.85 3g6e s ARG 141 Cb -0.15 -1.45 -0.03 0.00 0.52 0.00 0.00 34.95 33.84 3g6e s ARG 141 CO -0.05 0.31 -0.04 -0.51 0.02 0.00 0.00 175.30 175.02 3g6e s LEU 142 N -2.49 3.27 -0.23 2.53 1.43 0.18 -0.43 118.68 122.95 3g6e s LEU 142 Ca 0.15 -0.04 -0.27 0.00 -1.03 0.00 0.00 54.13 52.94 3g6e s LEU 142 Cb -0.07 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.40 3g6e s LEU 142 CO 0.07 0.28 0.93 -0.63 0.23 0.00 0.00 176.35 177.23 3g6e s ILE 143 N -0.33 4.77 0.05 -0.59 -1.09 -0.36 -0.86 121.20 122.79 3g6e s ILE 143 Ca 0.05 1.79 0.05 0.00 -2.23 0.00 0.00 60.65 60.32 3g6e s ILE 143 Cb -0.12 -4.21 -0.02 0.00 -1.58 0.00 0.00 42.46 36.52 3g6e s ILE 143 CO 0.02 -0.11 -0.14 -0.89 -1.23 0.00 0.00 174.94 172.59 3g6e s THR 144 N 2.94 1.14 0.18 2.92 2.01 0.14 -1.84 115.64 123.13 3g6e s THR 144 Ca 0.40 -1.09 0.03 0.00 0.31 0.00 0.00 61.69 61.34 3g6e s THR 144 Cb -0.15 -1.05 -0.05 0.00 0.01 0.00 0.00 72.50 71.26 3g6e s THR 144 CO 0.07 -0.04 -0.04 -1.38 -0.69 0.00 0.00 174.62 172.54 3g6e s HIS 145 N -0.95 1.32 0.36 4.92 -3.43 -0.91 0.06 115.29 116.67 3g6e s HIS 145 Ca 0.01 -0.89 0.07 0.00 -0.80 0.00 0.00 55.06 53.45 3g6e s HIS 145 Cb -0.08 -0.73 -0.01 0.00 -1.43 0.00 0.00 32.58 30.33 3g6e s HIS 145 CO 0.02 -0.05 0.47 0.95 -2.00 0.00 0.00 174.74 174.12 3g6e s THR 146 N -3.47 3.62 -0.65 -5.38 -4.23 -1.13 -1.93 115.64 102.46 3g6e s THR 146 Ca 0.22 -1.06 0.04 0.00 -1.18 0.00 0.00 61.69 59.71 3g6e s THR 146 Cb 0.05 -3.24 0.16 0.00 1.34 0.00 0.00 72.50 70.80 3g6e s THR 146 CO 0.04 -0.10 0.43 -0.69 -0.54 0.00 0.00 174.62 173.75 3g6e s VAL 147 N -2.26 2.86 -0.63 2.29 1.01 -1.26 -4.37 120.40 118.04 3g6e s VAL 147 Ca 0.48 -3.95 0.17 0.00 0.00 0.00 0.00 61.98 58.68 3g6e s VAL 147 Cb -0.09 -2.91 0.17 0.00 0.00 0.00 0.00 36.38 33.56 3g6e s VAL 147 CO 0.31 -0.94 1.54 -2.65 0.00 0.00 0.00 175.10 173.35 3g6e n PRO 148 N 2.37 0.11 0.15 2.72 -0.02 -1.26 -1.87 135.00 137.19 3g6e n PRO 148 Ca 0.15 0.43 0.01 0.00 -2.02 0.00 0.00 63.50 62.07 3g6e n PRO 148 Cb 0.34 -1.74 0.29 0.00 -0.02 0.00 0.00 33.50 32.37 3g6e n PRO 148 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3g6e h ASP 149 N 0.00 0.06 1.16 2.55 3.58 -1.83 -2.45 116.42 119.49 3g6e h ASP 149 Ca 0.00 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.43 3g6e h ASP 149 Cb 0.21 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.24 3g6e h ASP 149 CO 0.00 0.49 0.00 0.00 -2.88 0.00 0.00 179.24 176.85 3g6e h ALA 150 N 1.52 1.00 -2.65 -0.78 0.00 -1.76 -3.39 119.26 113.20 3g6e h ALA 150 Ca 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 54.91 54.19 3g6e h ALA 150 Cb 0.79 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 18.33 3g6e h ALA 150 CO 0.06 0.00 -0.45 0.08 0.00 0.00 0.00 179.25 178.94 3g6e s VAL 151 N -3.55 4.74 0.19 0.00 1.01 -0.92 -4.98 120.40 116.89 3g6e s VAL 151 Ca 0.03 -1.00 0.29 0.00 0.00 0.00 0.00 61.98 61.30 3g6e s VAL 151 Cb 0.08 -3.75 0.32 0.00 0.00 0.00 0.00 36.38 33.03 3g6e s VAL 151 CO 0.55 -0.39 1.95 -0.65 0.00 0.00 0.00 175.10 176.57 3g6e h PRO 152 N 8.53 0.00 0.00 2.72 0.11 -1.80 -3.22 132.00 138.34 3g6e h PRO 152 Ca -0.26 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.81 3g6e h PRO 152 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3g6e h PRO 152 CO 0.74 0.11 -0.41 0.77 -0.21 0.00 0.00 178.00 179.00 3g6e h SER 153 N 0.00 0.00 -3.47 -2.05 0.02 -1.86 -3.43 113.55 102.76 3g6e h SER 153 Ca -0.00 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 60.34 3g6e h SER 153 Cb 0.56 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 62.98 3g6e h SER 153 CO 0.01 0.17 0.19 -0.69 -1.14 0.00 0.00 176.83 175.38 3g6e s VAL 154 N -3.15 4.97 0.43 2.27 1.01 -1.22 -4.87 120.40 119.84 3g6e s VAL 154 Ca 0.04 1.14 0.09 0.00 0.00 0.00 0.00 61.98 63.25 3g6e s VAL 154 Cb 0.07 -3.96 0.25 0.00 0.00 0.00 0.00 36.38 32.75 3g6e s VAL 154 CO 0.72 -0.00 2.07 -0.65 0.00 0.00 0.00 175.10 177.24 3g6e h PRO 155 N 7.91 0.38 -7.12 2.72 0.11 -1.87 -3.45 132.00 130.68 3g6e h PRO 155 Ca -0.26 -0.03 -0.48 0.00 0.11 0.00 0.00 66.00 65.33 3g6e h PRO 155 Cb 1.12 -0.08 0.05 0.00 0.11 0.00 0.00 31.00 32.20 3g6e h PRO 155 CO 0.78 0.27 0.39 -1.59 -0.21 0.00 0.00 178.00 177.65 3g6e s LYS 156 N -5.31 3.53 0.00 1.05 -2.85 -1.26 -4.95 119.74 109.95 3g6e s LYS 156 Ca -0.07 1.37 0.00 0.00 -1.00 0.00 0.00 55.97 56.27 3g6e s LYS 156 Cb 0.17 -2.05 0.00 0.00 -2.06 0.00 0.00 37.83 33.89 3g6e s LYS 156 CO 0.72 -0.66 0.00 1.63 0.10 0.00 0.00 175.35 177.14 3g6e n LYS 157 N -1.39 0.55 -1.99 1.78 5.02 -1.26 -4.25 118.16 116.62 3g6e n LYS 157 Ca 0.10 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.96 3g6e n LYS 157 Cb 0.52 -0.99 -0.03 0.00 -0.02 0.00 0.00 35.03 34.52 3g6e n LYS 157 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3g6e s LYS 158 N -1.95 3.44 0.57 1.97 2.20 -1.26 -4.61 119.74 120.10 3g6e s LYS 158 Ca 0.00 1.55 -0.21 0.00 -0.36 0.00 0.00 55.97 56.95 3g6e s LYS 158 Cb 0.00 -4.17 -0.04 0.00 -1.51 0.00 0.00 37.83 32.11 3g6e s LYS 158 CO 0.00 -1.73 1.35 -2.14 -0.36 0.00 0.00 175.35 172.47 3g6e s PRO 159 N 5.47 3.00 -0.46 4.03 0.02 -1.26 -4.88 135.00 140.91 3g6e s PRO 159 Ca 0.80 2.21 -0.15 0.00 0.02 0.00 0.00 61.00 63.87 3g6e s PRO 159 Cb -0.24 -2.16 0.06 0.00 0.02 0.00 0.00 34.50 32.18 3g6e s PRO 159 CO 0.33 -1.29 0.38 -0.51 -0.33 0.00 0.00 177.00 175.58 3g6e s ASP 160 N -1.04 6.14 -0.00 2.53 1.01 -1.26 -4.89 116.67 119.16 3g6e s ASP 160 Ca 0.74 -1.24 -0.23 0.00 0.71 0.00 0.00 52.55 52.54 3g6e s ASP 160 Cb -0.40 -2.18 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 3g6e s ASP 160 CO 0.46 -0.61 0.68 -0.69 0.21 0.00 0.00 175.17 175.22 3g6e s VAL 161 N 1.66 4.88 -0.01 -1.27 1.01 -1.26 -2.86 120.40 122.55 3g6e s VAL 161 Ca 0.04 1.43 -0.19 0.00 0.00 0.00 0.00 61.98 63.26 3g6e s VAL 161 Cb -0.23 -4.02 0.04 0.00 0.00 0.00 0.00 36.38 32.16 3g6e s VAL 161 CO 0.07 0.36 0.42 0.00 0.00 0.00 0.00 175.10 175.95 3g6e s MET 162 N 0.10 0.82 -0.03 2.72 0.23 0.11 -5.00 119.30 118.24 3g6e s MET 162 Ca 0.35 -0.12 -0.16 0.00 -1.03 0.00 0.00 55.69 54.73 3g6e s MET 162 Cb -0.19 0.37 -0.05 0.00 -1.53 0.00 0.00 34.83 33.43 3g6e s MET 162 CO 0.19 -0.25 0.42 -2.00 -2.03 0.00 0.00 175.02 171.36 3g6e s GLU 163 N -1.55 4.05 -0.03 3.16 2.12 -1.26 -0.68 118.70 124.50 3g6e s GLU 163 Ca -0.11 0.42 0.01 0.00 0.36 0.00 0.00 54.97 55.65 3g6e s GLU 163 Cb -0.03 -3.28 0.01 0.00 0.26 0.00 0.00 34.13 31.09 3g6e s GLU 163 CO 0.04 0.54 -0.05 0.99 -0.54 0.00 0.00 175.26 176.25 3g6e s THR 164 N -0.61 0.52 0.51 -1.70 2.01 -0.04 -4.94 115.64 111.40 3g6e s THR 164 Ca 0.24 -0.16 -0.19 0.00 0.31 0.00 0.00 61.69 61.89 3g6e s THR 164 Cb -0.16 -0.52 -0.07 0.00 0.01 0.00 0.00 72.50 71.75 3g6e s THR 164 CO 0.12 0.20 1.03 -0.60 -0.69 0.00 0.00 174.62 174.69 3g6e s ARG 165 N 0.61 3.71 -0.20 4.92 3.52 -1.26 0.51 118.95 130.77 3g6e s ARG 165 Ca -0.08 1.27 -0.01 0.00 -0.13 0.00 0.00 55.73 56.78 3g6e s ARG 165 Cb -0.11 -2.09 0.01 0.00 -1.56 0.00 0.00 34.95 31.20 3g6e s ARG 165 CO 0.00 -0.49 -0.14 0.08 -0.81 0.00 0.00 175.30 173.94 3g6e s VAL 166 N -2.17 2.59 0.29 7.11 1.01 -0.11 0.33 120.40 129.44 3g6e s VAL 166 Ca 0.65 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.89 3g6e s VAL 166 Cb -0.15 -2.13 -0.05 0.00 0.00 0.00 0.00 36.38 34.05 3g6e s VAL 166 CO 0.25 0.49 0.09 -0.83 0.00 0.00 0.00 175.10 175.10 3g6e s GLY 167 N 1.36 1.90 0.00 4.51 0.00 -0.96 -4.48 107.32 109.65 3g6e s GLY 167 Ca 0.05 -1.89 0.00 0.00 0.00 0.00 0.00 44.72 42.88 3g6e s GLY 167 CO -0.09 -1.67 0.00 0.61 0.00 0.00 0.00 173.10 171.95 3g6e n GLY 168 N -0.56 0.47 0.00 0.20 0.00 -1.26 -1.46 105.19 102.58 3g6e n GLY 168 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3g6e n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g6e n GLY 169 N 0.00 0.93 3.89 -0.02 0.00 -1.04 -2.95 105.19 105.99 3g6e n GLY 169 Ca 0.00 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 3g6e n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g6e s SER 170 N -1.00 6.15 0.55 1.61 1.04 -1.26 -4.91 113.70 115.88 3g6e s SER 170 Ca 0.00 1.19 0.30 0.00 0.48 0.00 0.00 55.95 57.92 3g6e s SER 170 Cb 0.00 -2.31 1.62 0.00 0.10 0.00 0.00 66.02 65.43 3g6e s SER 170 CO 0.00 -0.81 2.13 -0.37 0.98 0.00 0.00 173.24 175.17 3g6e h VAL 171 N -0.14 0.46 0.06 5.02 -1.51 -1.98 -1.58 116.25 116.57 3g6e h VAL 171 Ca -0.45 -0.37 -0.15 0.00 -1.23 0.00 0.00 66.70 64.50 3g6e h VAL 171 Cb 1.20 1.25 0.01 0.00 -2.13 0.00 0.00 31.29 31.63 3g6e h VAL 171 CO 0.62 0.07 -0.61 0.28 -1.23 0.00 0.00 177.57 176.70 3g6e h SER 172 N 0.00 0.44 0.69 4.19 0.02 -2.00 -3.06 113.55 113.82 3g6e h SER 172 Ca -0.00 -0.85 -0.13 0.00 -0.84 0.00 0.00 61.79 59.96 3g6e h SER 172 Cb 0.25 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 3g6e h SER 172 CO 0.01 1.25 -0.63 0.44 -1.14 0.00 0.00 176.83 176.76 3g6e h ASP 173 N -0.31 0.00 0.92 3.07 3.32 -1.88 -3.06 116.42 118.49 3g6e h ASP 173 Ca -0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.96 3g6e h ASP 173 Cb 1.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.94 3g6e h ASP 173 CO 0.12 0.63 -0.28 -2.11 -1.72 0.00 0.00 179.24 175.88 3g6e n ARG 174 N -3.73 0.12 0.01 3.56 1.85 -0.62 -1.66 116.66 116.19 3g6e n ARG 174 Ca -0.01 0.06 -0.18 0.00 -1.00 0.00 0.00 57.85 56.73 3g6e n ARG 174 Cb 0.64 -1.60 -0.12 0.00 -1.05 0.00 0.00 32.46 30.33 3g6e n ARG 174 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 3g6e h LEU 175 N 0.00 0.47 -0.70 2.89 6.46 -1.49 -2.29 115.31 120.65 3g6e h LEU 175 Ca 0.00 -0.80 -0.12 0.00 -0.12 0.00 0.00 57.88 56.84 3g6e h LEU 175 Cb 0.60 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 3g6e h LEU 175 CO 0.00 1.22 -0.26 0.44 -0.62 0.00 0.00 178.44 179.22 3g6e h ASP 176 N -0.22 0.74 -0.48 1.25 3.32 -1.52 -1.22 116.42 118.29 3g6e h ASP 176 Ca -0.08 -0.27 -0.12 0.00 0.02 0.00 0.00 57.03 56.57 3g6e h ASP 176 Cb 1.33 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.67 3g6e h ASP 176 CO 0.11 0.96 -0.16 -0.74 -1.72 0.00 0.00 179.24 177.70 3g6e h HIS 177 N 0.62 1.11 -0.34 4.55 2.76 -1.36 -2.41 115.15 120.08 3g6e h HIS 177 Ca 0.08 -0.24 -0.08 0.00 -2.20 0.00 0.00 60.37 57.93 3g6e h HIS 177 Cb 0.76 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.44 3g6e h HIS 177 CO 0.04 1.06 -0.09 0.00 -1.30 0.00 0.00 177.93 177.63 3g6e h ALA 178 N 0.94 0.47 0.00 5.26 0.00 -1.18 -2.93 119.26 121.83 3g6e h ALA 178 Ca 0.12 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 3g6e h ALA 178 Cb 0.72 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3g6e h ALA 178 CO 0.06 0.32 -0.27 -0.07 0.00 0.00 0.00 179.25 179.29 3g6e h LEU 179 N 0.45 0.00 -0.33 0.00 3.38 -1.17 -2.59 115.31 115.06 3g6e h LEU 179 Ca 0.09 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.87 3g6e h LEU 179 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3g6e h LEU 179 CO 0.03 0.27 -0.63 0.44 0.09 0.00 0.00 178.44 178.64 3g6e h ASP 180 N 0.00 0.82 -0.22 -0.43 3.32 -1.31 -1.48 116.42 117.13 3g6e h ASP 180 Ca -0.00 -0.48 -0.04 0.00 0.02 0.00 0.00 57.03 56.53 3g6e h ASP 180 Cb 0.51 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3g6e h ASP 180 CO 0.04 1.25 -0.02 0.40 -1.72 0.00 0.00 179.24 179.19 3g6e h ILE 181 N 0.53 1.26 0.73 0.35 2.04 -1.32 -3.22 117.51 117.87 3g6e h ILE 181 Ca -0.01 -0.93 -0.04 0.00 1.00 0.00 0.00 64.86 64.88 3g6e h ILE 181 Cb 1.23 1.45 0.01 0.00 -0.74 0.00 0.00 36.82 38.76 3g6e h ILE 181 CO 0.13 0.29 -0.35 0.58 0.00 0.00 0.00 178.15 178.80 3g6e h VAL 182 N 0.14 0.00 0.00 1.67 2.07 -1.48 -2.19 116.25 116.46 3g6e h VAL 182 Ca 0.06 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.43 3g6e h VAL 182 Cb 0.43 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 3g6e h VAL 182 CO 0.01 0.00 0.33 -0.33 0.02 0.00 0.00 177.57 177.60 3g6e h GLU 183 N -1.12 0.00 0.01 1.57 4.39 -1.37 -2.15 114.58 115.91 3g6e h GLU 183 Ca -0.10 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 3g6e h GLU 183 Cb 0.75 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.40 3g6e h GLU 183 CO 0.16 0.00 -0.01 -0.44 -1.16 0.00 0.00 179.01 177.57 3g6e h ASP 184 N 0.00 -0.02 0.00 1.42 3.32 -1.59 -3.47 116.42 116.08 3g6e h ASP 184 Ca 0.00 -0.77 0.00 0.00 0.02 0.00 0.00 57.03 56.28 3g6e h ASP 184 Cb 0.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.21 3g6e h ASP 184 CO 0.00 0.80 0.00 0.61 -1.72 0.00 0.00 179.24 178.93 3g6e n GLY 185 N 1.23 0.00 2.49 2.75 0.00 -0.82 -4.97 105.19 105.87 3g6e n GLY 185 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3g6e n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g6e n GLY 186 N 0.00 0.97 3.67 -0.02 0.00 -0.83 -4.61 105.19 104.37 3g6e n GLY 186 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3g6e n GLY 186 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3g6e s GLU 187 N -0.17 4.21 -0.01 1.61 2.12 -1.26 -0.25 118.70 124.96 3g6e s GLU 187 Ca 0.00 2.04 -0.05 0.00 0.36 0.00 0.00 54.97 57.32 3g6e s GLU 187 Cb 0.00 -3.83 0.00 0.00 0.26 0.00 0.00 34.13 30.56 3g6e s GLU 187 CO 0.00 -0.75 0.10 -3.38 -0.54 0.00 0.00 175.26 170.69 3g6e s HIS 188 N 3.49 0.04 0.46 5.30 -3.43 -1.04 -4.99 115.29 115.11 3g6e s HIS 188 Ca 0.68 -0.08 0.07 0.00 -0.80 0.00 0.00 55.06 54.92 3g6e s HIS 188 Cb -0.31 -0.05 -0.01 0.00 -1.43 0.00 0.00 32.58 30.78 3g6e s HIS 188 CO 0.26 -0.21 0.29 0.00 -2.00 0.00 0.00 174.74 173.09 3g6e s ALA 189 N -1.00 3.99 0.48 -1.38 0.00 -1.26 -2.08 121.76 120.51 3g6e s ALA 189 Ca -0.11 -1.72 0.13 0.00 0.00 0.00 0.00 51.96 50.26 3g6e s ALA 189 Cb -0.06 -0.64 1.12 0.00 0.00 0.00 0.00 23.12 23.54 3g6e s ALA 189 CO 0.01 -0.26 2.11 1.98 0.00 0.00 0.00 175.76 179.60 3g6e h MET 190 N 1.11 0.19 -0.34 0.00 4.05 -1.88 -2.39 114.93 115.66 3g6e h MET 190 Ca -0.41 -0.01 -0.05 0.00 -0.28 0.00 0.00 59.70 58.95 3g6e h MET 190 Cb 1.27 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 32.01 3g6e h MET 190 CO 0.63 0.13 0.01 -0.91 0.23 0.00 0.00 176.91 177.00 3g6e h ASN 191 N 0.19 0.49 0.22 1.39 2.35 -1.96 0.18 115.58 118.44 3g6e h ASN 191 Ca 0.05 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.68 3g6e h ASN 191 Cb -0.01 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.22 3g6e h ASN 191 CO -0.01 0.55 -0.16 0.44 -1.65 0.00 0.00 177.43 176.60 3g6e h ASP 192 N 0.51 0.00 0.00 5.81 5.19 -1.83 -3.33 116.42 122.77 3g6e h ASP 192 Ca 0.11 0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 56.26 3g6e h ASP 192 Cb 0.31 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.78 3g6e h ASP 192 CO 0.01 0.16 -1.90 -0.38 -3.12 0.00 0.00 179.24 174.02 3g6e n ILE 193 N -4.13 0.89 -4.17 0.35 -0.00 -1.09 -4.92 119.36 106.30 3g6e n ILE 193 Ca -0.02 -0.26 -0.30 0.00 -0.00 0.00 0.00 62.75 62.17 3g6e n ILE 193 Cb 0.24 -1.50 -0.09 0.00 -0.00 0.00 0.00 39.64 38.30 3g6e n ILE 193 CO 0.00 0.00 0.00 -0.36 -0.00 0.00 0.00 176.55 176.19 3g6e s PHE 194 N -2.30 2.88 -0.01 1.39 0.40 0.61 -5.06 117.98 115.89 3g6e s PHE 194 Ca -0.22 -0.09 0.06 0.00 -0.60 0.00 0.00 56.93 56.09 3g6e s PHE 194 Cb 0.08 -1.48 -0.02 0.00 0.51 0.00 0.00 43.02 42.11 3g6e s PHE 194 CO 0.31 0.47 -0.20 0.50 0.70 0.00 0.00 175.22 176.99 3g6e s ARG 195 N -2.35 1.58 0.21 0.44 6.06 -1.26 -4.16 118.95 119.47 3g6e s ARG 195 Ca 0.24 -0.74 -0.32 0.00 -2.50 0.00 0.00 55.73 52.42 3g6e s ARG 195 Cb -0.11 -1.55 -0.12 0.00 0.06 0.00 0.00 34.95 33.23 3g6e s ARG 195 CO 0.17 0.42 1.73 0.00 -2.50 0.00 0.00 175.30 175.12 3g6e n ALA 196 N 2.51 2.82 0.00 6.12 0.00 -1.26 -2.42 120.51 128.28 3g6e n ALA 196 Ca -0.15 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.69 3g6e n ALA 196 Cb 0.53 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.46 3g6e n ALA 196 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g6e n GLY 197 N 3.97 0.66 3.89 0.00 0.00 0.19 -0.58 105.19 113.32 3g6e n GLY 197 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3g6e n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g6e s GLU 198 N -0.57 3.65 -0.21 1.61 2.02 -1.02 -3.84 118.70 120.36 3g6e s GLU 198 Ca 0.00 0.38 -0.16 0.00 0.02 0.00 0.00 54.97 55.21 3g6e s GLU 198 Cb 0.00 -2.35 -0.04 0.00 0.10 0.00 0.00 34.13 31.84 3g6e s GLU 198 CO 0.00 -0.17 0.39 0.71 0.02 0.00 0.00 175.26 176.21 3g6e s TYR 199 N -2.62 3.37 0.25 1.61 1.51 -1.26 -1.81 117.35 118.39 3g6e s TYR 199 Ca 0.50 0.60 0.11 0.00 -1.01 0.00 0.00 57.07 57.27 3g6e s TYR 199 Cb -0.10 -2.52 -0.05 0.00 -0.11 0.00 0.00 41.96 39.18 3g6e s TYR 199 CO 0.40 -0.02 -0.19 0.00 -1.11 0.00 0.00 175.55 174.63 3g6e s ALA 200 N 1.34 2.72 -0.24 3.71 0.00 0.87 -1.37 121.76 128.79 3g6e s ALA 200 Ca 0.19 -1.77 -0.06 0.00 0.00 0.00 0.00 51.96 50.32 3g6e s ALA 200 Cb -0.15 -0.35 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 3g6e s ALA 200 CO 0.08 0.34 0.04 -0.51 0.00 0.00 0.00 175.76 175.70 3g6e s ASP 201 N -3.22 4.89 -0.23 0.00 1.01 0.94 0.38 116.67 120.43 3g6e s ASP 201 Ca 0.27 -0.26 -0.10 0.00 0.71 0.00 0.00 52.55 53.17 3g6e s ASP 201 Cb -0.06 -1.87 -0.05 0.00 1.01 0.00 0.00 42.92 41.95 3g6e s ASP 201 CO 0.14 -0.03 0.15 -0.69 0.21 0.00 0.00 175.17 174.95 3g6e s VAL 202 N 1.57 5.34 -0.05 -1.27 1.01 -0.56 -2.35 120.40 124.08 3g6e s VAL 202 Ca 0.06 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.23 3g6e s VAL 202 Cb -0.15 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 3g6e s VAL 202 CO 0.02 0.36 -0.08 0.00 0.00 0.00 0.00 175.10 175.40 3g6e s ALA 203 N 0.95 2.95 0.12 5.51 0.00 -0.34 -0.21 121.76 130.75 3g6e s ALA 203 Ca 0.07 -0.93 -0.25 0.00 0.00 0.00 0.00 51.96 50.86 3g6e s ALA 203 Cb -0.13 -1.17 0.07 0.00 0.00 0.00 0.00 23.12 21.88 3g6e s ALA 203 CO 0.03 0.58 0.62 0.20 0.00 0.00 0.00 175.76 177.19 3g6e s GLY 204 N -0.94 -0.61 -0.36 0.00 0.00 -0.27 -1.05 107.32 104.09 3g6e s GLY 204 Ca 0.13 0.65 -0.16 0.00 0.00 0.00 0.00 44.72 45.34 3g6e s GLY 204 CO 0.03 0.31 0.39 0.14 0.00 0.00 0.00 173.10 173.98 3g6e s VAL 205 N -3.25 5.13 1.12 1.40 1.01 -1.26 -0.82 120.40 123.73 3g6e s VAL 205 Ca -0.01 0.02 -0.18 0.00 0.00 0.00 0.00 61.98 61.80 3g6e s VAL 205 Cb -0.01 -3.88 0.12 0.00 0.00 0.00 0.00 36.38 32.62 3g6e s VAL 205 CO -0.09 -0.16 0.05 0.35 0.00 0.00 0.00 175.10 175.25 3g6e n THR 206 N 5.30 0.00 -2.26 3.92 -2.24 0.60 -3.92 114.28 115.67 3g6e n THR 206 Ca -0.08 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.02 3g6e n THR 206 Cb 0.49 -0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 68.10 3g6e n THR 206 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3g6e s LYS 207 N -3.48 4.26 0.11 -0.78 1.02 -1.26 -3.21 119.74 116.40 3g6e s LYS 207 Ca 0.53 1.90 -0.30 0.00 0.02 0.00 0.00 55.97 58.12 3g6e s LYS 207 Cb -0.10 -3.68 -0.06 0.00 -0.52 0.00 0.00 37.83 33.46 3g6e s LYS 207 CO 0.61 -0.63 1.16 0.20 -0.92 0.00 0.00 175.35 175.78 3g6e s GLY 208 N 2.09 2.58 0.00 -3.33 0.00 -1.26 -3.12 107.32 104.28 3g6e s GLY 208 Ca 0.62 0.84 0.01 0.00 0.00 0.00 0.00 44.72 46.20 3g6e s GLY 208 CO 0.24 1.90 0.95 0.28 0.00 0.00 0.00 173.10 176.47 3g6e n LYS 209 N 3.30 2.40 0.00 2.90 5.02 -0.53 -4.88 118.16 126.36 3g6e n LYS 209 Ca 0.06 -1.41 0.00 0.00 -2.02 0.00 0.00 58.31 54.94 3g6e n LYS 209 Cb 0.46 -1.03 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 3g6e n LYS 209 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g6e n GLY 210 N -0.31 2.13 3.73 0.72 0.00 -1.22 -4.62 105.19 105.61 3g6e n GLY 210 Ca 0.01 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.15 3g6e n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g6e s THR 211 N 0.00 5.34 0.15 2.61 -4.23 -1.26 -1.62 115.64 116.63 3g6e s THR 211 Ca 0.00 0.41 0.04 0.00 -1.18 0.00 0.00 61.69 60.96 3g6e s THR 211 Cb 0.00 -3.57 -0.04 0.00 1.34 0.00 0.00 72.50 70.22 3g6e s THR 211 CO 0.00 0.40 -0.08 -1.10 -0.54 0.00 0.00 174.62 173.30 3g6e s GLN 212 N 0.46 1.05 0.92 3.99 -1.52 -0.57 -4.95 119.66 119.04 3g6e s GLN 212 Ca 0.13 -1.46 -0.15 0.00 -1.95 0.00 0.00 55.36 51.94 3g6e s GLN 212 Cb -0.12 -0.54 0.16 0.00 -0.22 0.00 0.00 33.01 32.30 3g6e s GLN 212 CO 0.02 0.03 1.28 0.20 -0.25 0.00 0.00 175.29 176.57 3g6e s GLY 213 N -3.16 1.72 0.40 3.09 0.00 -1.26 -2.47 107.32 105.64 3g6e s GLY 213 Ca 0.17 -1.03 0.12 0.00 0.00 0.00 0.00 44.72 43.99 3g6e s GLY 213 CO 0.01 -0.34 1.93 -2.55 0.00 0.00 0.00 173.10 172.14 3g6e h PRO 214 N -1.47 0.50 -0.16 2.90 0.11 -1.82 -0.54 132.00 131.51 3g6e h PRO 214 Ca -0.45 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 3g6e h PRO 214 Cb 1.26 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 3g6e h PRO 214 CO 0.47 0.33 0.08 0.28 -0.21 0.00 0.00 178.00 178.95 3g6e h VAL 215 N 0.52 1.12 0.07 3.15 2.07 -1.83 0.93 116.25 122.27 3g6e h VAL 215 Ca 0.36 -0.34 -0.12 0.00 0.82 0.00 0.00 66.70 67.42 3g6e h VAL 215 Cb 0.67 1.06 0.01 0.00 -1.52 0.00 0.00 31.29 31.51 3g6e h VAL 215 CO -0.12 0.11 -0.50 0.50 0.02 0.00 0.00 177.57 177.57 3g6e h LYS 216 N 0.13 0.23 -0.28 1.57 3.64 -1.82 -1.65 116.57 118.39 3g6e h LYS 216 Ca 0.05 -0.33 -0.12 0.00 -1.27 0.00 0.00 60.65 58.98 3g6e h LYS 216 Cb 0.11 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 3g6e h LYS 216 CO -0.01 1.11 -0.33 -0.09 -2.27 0.00 0.00 179.45 177.87 3g6e h ARG 217 N -0.50 0.59 0.00 1.90 2.43 -1.16 -3.35 114.38 114.30 3g6e h ARG 217 Ca -0.08 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 3g6e h ARG 217 Cb 1.34 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.88 3g6e h ARG 217 CO 0.10 0.84 0.00 0.91 -1.51 0.00 0.00 179.97 180.31 3g6e n TRP 218 N -4.07 0.00 -2.37 2.20 7.02 0.27 -5.01 117.44 115.49 3g6e n TRP 218 Ca -0.01 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.39 3g6e n TRP 218 Cb 0.47 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 29.37 3g6e n TRP 218 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3g6e n GLY 219 N 0.37 0.15 3.88 6.99 0.00 -0.62 -2.90 105.19 113.06 3g6e n GLY 219 Ca 0.00 -0.49 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 3g6e n GLY 219 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3g6e s VAL 220 N -2.60 4.74 0.78 1.61 -7.23 -1.16 -4.88 120.40 111.66 3g6e s VAL 220 Ca 0.06 0.75 -0.11 0.00 -1.81 0.00 0.00 61.98 60.87 3g6e s VAL 220 Cb -0.03 -3.85 0.06 0.00 0.56 0.00 0.00 36.38 33.12 3g6e s VAL 220 CO 0.08 -1.02 1.10 -1.10 -0.31 0.00 0.00 175.10 173.85 3g6e s GLN 221 N -4.94 2.17 0.52 4.82 -0.21 -1.26 -4.40 119.66 116.36 3g6e s GLN 221 Ca 0.53 1.24 -0.03 0.00 0.02 0.00 0.00 55.36 57.13 3g6e s GLN 221 Cb -0.11 -1.88 0.00 0.00 1.00 0.00 0.00 33.01 32.02 3g6e s GLN 221 CO 0.49 -1.72 0.78 0.15 -2.12 0.00 0.00 175.29 172.88 3g6e s LYS 222 N -4.77 2.97 0.14 2.91 1.02 -1.26 -4.84 119.74 115.91 3g6e s LYS 222 Ca 0.63 -0.27 -0.31 0.00 0.02 0.00 0.00 55.97 56.03 3g6e s LYS 222 Cb -0.18 -2.42 -0.08 0.00 -0.52 0.00 0.00 37.83 34.63 3g6e s LYS 222 CO 0.55 -0.50 1.35 1.03 -0.92 0.00 0.00 175.35 176.86 3g6e s ARG 223 N -4.77 4.35 0.08 1.68 1.81 0.24 -5.00 118.95 117.34 3g6e s ARG 223 Ca 0.51 2.06 -0.03 0.00 -1.72 0.00 0.00 55.73 56.55 3g6e s ARG 223 Cb -0.10 -3.23 -0.05 0.00 -0.45 0.00 0.00 34.95 31.12 3g6e s ARG 223 CO 0.41 -0.37 0.29 0.15 -0.68 0.00 0.00 175.30 175.10 3g6e s LYS 224 N 0.69 3.54 7.07 3.54 -0.14 -1.26 -4.15 119.74 129.03 3g6e s LYS 224 Ca 0.62 -0.22 0.00 0.00 -1.36 0.00 0.00 55.97 55.00 3g6e s LYS 224 Cb -0.36 -2.97 0.00 0.00 -1.68 0.00 0.00 37.83 32.82 3g6e s LYS 224 CO 0.33 0.56 0.00 0.41 -0.76 0.00 0.00 175.35 175.89 3g6e n GLY 225 N 0.39 3.89 0.25 -3.33 0.00 -1.26 -2.40 105.19 102.73 3g6e n GLY 225 Ca -0.05 0.08 0.02 0.00 0.00 0.00 0.00 46.02 46.07 3g6e n GLY 225 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3g6e h LYS 226 N 0.00 0.30 0.00 1.61 3.64 -2.02 -2.38 116.57 117.72 3g6e h LYS 226 Ca 0.00 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 3g6e h LYS 226 Cb 0.00 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3g6e h LYS 226 CO 0.00 0.39 -0.06 0.45 -2.27 0.00 0.00 179.45 177.96 3g6e h HIS 227 N 0.29 0.00 0.00 1.91 3.86 -1.82 -2.56 115.15 116.83 3g6e h HIS 227 Ca 0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 3g6e h HIS 227 Cb 0.31 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.78 3g6e h HIS 227 CO 0.01 0.06 0.00 0.00 0.86 0.00 0.00 177.93 178.86 3g6e h ALA 228 N 1.94 1.00 -0.01 2.45 0.00 -1.52 -3.27 119.26 119.85 3g6e h ALA 228 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g6e h ALA 228 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3g6e h ALA 228 CO 0.01 0.00 -0.46 0.54 0.00 0.00 0.00 179.25 179.33 3g6e n ARG 229 N -2.69 1.54 0.06 0.00 1.74 -0.96 -4.59 116.66 111.75 3g6e n ARG 229 Ca 0.04 -0.67 0.13 0.00 -0.77 0.00 0.00 57.85 56.58 3g6e n ARG 229 Cb 0.41 -1.32 0.50 0.00 -1.02 0.00 0.00 32.46 31.03 3g6e n ARG 229 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3g6e n GLN 230 N -0.38 0.14 0.00 5.56 1.13 -1.23 -4.86 117.38 117.74 3g6e n GLN 230 Ca 0.06 0.12 0.00 0.00 -1.94 0.00 0.00 57.00 55.24 3g6e n GLN 230 Cb 0.35 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 29.03 3g6e n GLN 230 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3g6e n GLY 231 N 1.38 0.46 2.96 1.08 0.00 -1.26 -5.10 105.19 104.71 3g6e n GLY 231 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 3g6e n GLY 231 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3g6e s TRP 232 N -1.16 2.04 -0.04 1.61 0.51 -1.26 -5.01 118.94 115.63 3g6e s TRP 232 Ca 0.00 -1.24 -0.04 0.00 -2.12 0.00 0.00 56.10 52.70 3g6e s TRP 232 Cb 0.00 -1.49 -0.03 0.00 -0.81 0.00 0.00 33.47 31.14 3g6e s TRP 232 CO 0.00 -0.66 -0.09 0.54 -0.51 0.00 0.00 176.95 176.23 3g6e n ARG 233 N 4.79 0.14 -1.80 4.98 1.74 -1.26 -4.15 116.66 121.09 3g6e n ARG 233 Ca -0.14 0.06 -0.20 0.00 -0.77 0.00 0.00 57.85 56.80 3g6e n ARG 233 Cb 0.48 -0.74 0.05 0.00 -1.02 0.00 0.00 32.46 31.23 3g6e n ARG 233 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3g6e n ARG 234 N -3.45 3.31 -5.21 5.56 1.74 -1.26 -0.59 116.66 116.76 3g6e n ARG 234 Ca -0.11 -4.03 -0.31 0.00 -0.77 0.00 0.00 57.85 52.63 3g6e n ARG 234 Cb 0.45 -2.19 -0.16 0.00 -1.02 0.00 0.00 32.46 29.55 3g6e n ARG 234 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3g6e s ARG 235 N -3.55 2.31 0.80 5.56 0.52 -1.26 -4.64 118.95 118.69 3g6e s ARG 235 Ca 0.50 -0.88 -0.10 0.00 -0.52 0.00 0.00 55.73 54.72 3g6e s ARG 235 Cb 0.41 -2.14 0.08 0.00 0.52 0.00 0.00 34.95 33.81 3g6e s ARG 235 CO 0.02 0.52 1.10 0.96 0.02 0.00 0.00 175.30 177.93 3g6e s ILE 236 N -0.51 3.08 0.09 1.52 -4.36 -1.26 -4.79 121.20 114.98 3g6e s ILE 236 Ca 0.07 0.35 -0.34 0.00 -0.26 0.00 0.00 60.65 60.47 3g6e s ILE 236 Cb -0.11 -2.75 -0.15 0.00 1.25 0.00 0.00 42.46 40.70 3g6e s ILE 236 CO 0.00 -0.46 1.58 1.23 0.24 0.00 0.00 174.94 177.53 3g6e h GLY 237 N -1.28 -1.10 -3.11 6.27 0.00 -2.00 -3.46 103.07 98.40 3g6e h GLY 237 Ca -0.44 0.54 -0.08 0.00 0.00 0.00 0.00 47.33 47.36 3g6e h GLY 237 CO 0.50 -0.34 -0.28 0.54 0.00 0.00 0.00 176.54 176.96 3g6e s ASN 238 N -4.49 0.02 0.00 0.19 4.22 -1.26 -5.04 114.94 108.58 3g6e s ASN 238 Ca -0.17 -0.57 0.22 0.00 -2.14 0.00 0.00 52.86 50.20 3g6e s ASN 238 Cb 0.05 0.38 0.87 0.00 1.28 0.00 0.00 41.25 43.83 3g6e s ASN 238 CO 0.62 -0.77 1.61 0.18 -2.04 0.00 0.00 177.10 176.70 3g6e n LEU 239 N -0.11 1.40 0.00 3.54 4.77 -1.26 -5.00 117.00 120.34 3g6e n LEU 239 Ca -0.15 -0.57 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 3g6e n LEU 239 Cb 0.63 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 3g6e n LEU 239 CO 0.21 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 3g6e n GLY 240 N 1.09 2.59 3.68 -0.72 0.00 -1.26 -4.40 105.19 106.18 3g6e n GLY 240 Ca 0.16 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.24 3g6e n GLY 240 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3g6e s PRO 241 N -1.85 -0.27 0.11 1.61 0.04 -1.26 -4.96 135.00 128.42 3g6e s PRO 241 Ca 0.00 0.10 -0.19 0.00 0.04 0.00 0.00 61.00 60.95 3g6e s PRO 241 Cb 0.00 -1.69 -0.06 0.00 0.04 0.00 0.00 34.50 32.79 3g6e s PRO 241 CO 0.00 -3.11 1.71 2.35 0.04 0.00 0.00 177.00 177.99 3g6e h TRP 242 N -2.15 0.34 -3.33 0.56 2.91 -2.01 -3.42 115.95 108.85 3g6e h TRP 242 Ca -0.48 -0.01 -0.63 0.00 1.13 0.00 0.00 58.89 58.89 3g6e h TRP 242 Cb 1.30 -0.11 -0.33 0.00 -0.51 0.00 0.00 29.16 29.51 3g6e h TRP 242 CO -1.02 0.30 -0.86 -0.80 -1.03 0.00 0.00 178.44 175.03 3g6e s ASN 243 N -5.54 2.73 0.17 2.65 0.01 -1.26 -3.04 114.94 110.67 3g6e s ASN 243 Ca -0.13 -0.49 -0.31 0.00 -0.71 0.00 0.00 52.86 51.21 3g6e s ASN 243 Cb 0.08 -1.25 -0.10 0.00 0.41 0.00 0.00 41.25 40.40 3g6e s ASN 243 CO 0.71 0.11 1.49 -2.16 -1.51 0.00 0.00 177.10 175.74 3g6e s PRO 244 N 0.53 4.25 -0.10 -0.60 0.04 -1.26 -5.07 135.00 132.79 3g6e s PRO 244 Ca -0.15 2.28 -0.03 0.00 0.04 0.00 0.00 61.00 63.13 3g6e s PRO 244 Cb -0.17 -3.17 -0.12 0.00 0.04 0.00 0.00 34.50 31.09 3g6e s PRO 244 CO 0.06 -0.52 2.00 0.43 0.04 0.00 0.00 177.00 179.01 3g6e n SER 245 N 3.56 2.74 -3.49 6.66 7.64 -1.17 -4.70 113.62 124.87 3g6e n SER 245 Ca 0.12 -2.01 -0.12 0.00 1.01 0.00 0.00 58.87 57.86 3g6e n SER 245 Cb 0.40 -0.72 -0.03 0.00 -1.01 0.00 0.00 64.21 62.84 3g6e n SER 245 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3g6e s ARG 246 N 2.24 1.20 -0.26 1.43 1.70 -1.26 -5.13 118.95 118.86 3g6e s ARG 246 Ca 0.32 -0.44 -0.18 0.00 -0.47 0.00 0.00 55.73 54.97 3g6e s ARG 246 Cb 0.15 0.55 -0.03 0.00 -0.57 0.00 0.00 34.95 35.05 3g6e s ARG 246 CO -0.00 -0.49 0.53 0.08 -1.08 0.00 0.00 175.30 174.33 3g6e s VAL 247 N -3.43 5.06 0.27 4.99 1.01 -1.26 -4.90 120.40 122.14 3g6e s VAL 247 Ca -0.00 0.92 -0.29 0.00 0.00 0.00 0.00 61.98 62.60 3g6e s VAL 247 Cb -0.00 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.44 3g6e s VAL 247 CO -0.10 0.08 1.12 -0.13 0.00 0.00 0.00 175.10 176.08 3g6e s ARG 248 N 2.30 4.61 0.17 2.72 0.52 -1.26 -4.93 118.95 123.07 3g6e s ARG 248 Ca 0.22 1.84 0.14 0.00 -0.52 0.00 0.00 55.73 57.41 3g6e s ARG 248 Cb -0.16 -3.19 0.70 0.00 0.52 0.00 0.00 34.95 32.83 3g6e s ARG 248 CO 0.09 0.16 1.45 -1.13 0.02 0.00 0.00 175.30 175.88 3g6e n SER 249 N 1.31 0.33 0.00 0.23 3.41 -1.26 -2.11 113.62 115.53 3g6e n SER 249 Ca -0.00 0.63 0.14 0.00 -0.26 0.00 0.00 58.87 59.37 3g6e n SER 249 Cb 0.45 -0.68 0.61 0.00 -0.26 0.00 0.00 64.21 64.33 3g6e n SER 249 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3g6e n THR 250 N -1.91 0.02 -2.67 6.66 -2.24 -1.26 -4.84 114.28 108.04 3g6e n THR 250 Ca 0.00 -0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 3g6e n THR 250 Cb 0.08 -0.51 -0.04 0.00 -2.10 0.00 0.00 70.33 67.77 3g6e n THR 250 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3g6e s VAL 251 N -3.00 4.48 -0.28 2.28 -7.23 -0.90 -4.97 120.40 110.79 3g6e s VAL 251 Ca 0.14 1.96 -0.28 0.00 -1.81 0.00 0.00 61.98 61.99 3g6e s VAL 251 Cb 0.19 -4.25 -0.05 0.00 0.56 0.00 0.00 36.38 32.83 3g6e s VAL 251 CO 0.53 0.25 2.18 -2.16 -0.31 0.00 0.00 175.10 175.59 3g6e s PRO 252 N 0.32 3.00 0.30 4.82 0.04 -1.26 -4.98 135.00 137.24 3g6e s PRO 252 Ca 0.50 1.83 0.06 0.00 0.04 0.00 0.00 61.00 63.43 3g6e s PRO 252 Cb -0.24 -4.38 -0.06 0.00 0.04 0.00 0.00 34.50 29.86 3g6e s PRO 252 CO 0.30 -2.25 -0.03 -0.65 0.04 0.00 0.00 177.00 174.40 3g6e s GLN 253 N 6.54 1.62 0.99 4.56 -0.21 -1.26 -4.81 119.66 127.09 3g6e s GLN 253 Ca 0.97 -1.85 -0.11 0.00 0.02 0.00 0.00 55.36 54.39 3g6e s GLN 253 Cb -0.29 -1.17 0.18 0.00 1.00 0.00 0.00 33.01 32.73 3g6e s GLN 253 CO 0.33 -0.01 1.09 -1.14 -2.12 0.00 0.00 175.29 173.45 3g6e s GLN 254 N -3.75 0.50 0.00 2.91 -0.44 -1.26 -4.53 119.66 113.08 3g6e s GLN 254 Ca 0.31 1.11 0.00 0.00 -2.50 0.00 0.00 55.36 54.29 3g6e s GLN 254 Cb 0.05 -1.70 0.00 0.00 -1.64 0.00 0.00 33.01 29.72 3g6e s GLN 254 CO 0.13 -2.85 0.00 0.41 0.50 0.00 0.00 175.29 173.49 3g6e n GLY 255 N -0.01 0.56 3.69 2.59 0.00 -1.03 -5.01 105.19 105.97 3g6e n GLY 255 Ca 0.08 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 3g6e n GLY 255 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g6e s GLN 256 N -2.00 4.21 -0.06 1.61 -1.52 -1.26 -1.52 119.66 119.12 3g6e s GLN 256 Ca 0.00 2.25 0.02 0.00 -1.95 0.00 0.00 55.36 55.69 3g6e s GLN 256 Cb 0.00 -3.62 0.01 0.00 -0.22 0.00 0.00 33.01 29.18 3g6e s GLN 256 CO 0.00 -0.71 -0.12 0.95 -0.25 0.00 0.00 175.29 175.16 3g6e s THR 257 N 2.70 1.11 0.00 -0.19 -4.23 -0.64 -4.63 115.64 109.76 3g6e s THR 257 Ca 0.72 -0.48 0.00 0.00 -1.18 0.00 0.00 61.69 60.75 3g6e s THR 257 Cb -0.38 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.45 3g6e s THR 257 CO 0.31 0.35 0.00 0.61 -0.54 0.00 0.00 174.62 175.35 3g6e n GLY 258 N 3.71 -0.10 3.53 3.99 0.00 -1.26 -1.45 105.19 113.62 3g6e n GLY 258 Ca -0.22 -1.79 -0.21 0.00 0.00 0.00 0.00 46.02 43.80 3g6e n GLY 258 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3g6e n TYR 259 N 0.02 -2.53 -4.43 1.61 9.36 -1.18 -4.65 117.16 115.37 3g6e n TYR 259 Ca 0.00 0.97 -0.27 0.00 3.32 0.00 0.00 57.90 61.93 3g6e n TYR 259 Cb 0.00 -5.02 -0.12 0.00 -0.63 0.00 0.00 39.34 33.58 3g6e n TYR 259 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 3g6e s HIS 260 N -3.35 2.30 -0.07 2.98 3.76 -1.26 -1.46 115.29 118.19 3g6e s HIS 260 Ca 0.30 -0.36 -0.24 0.00 -0.15 0.00 0.00 55.06 54.62 3g6e s HIS 260 Cb -0.13 -1.13 -0.03 0.00 1.11 0.00 0.00 32.58 32.39 3g6e s HIS 260 CO 0.74 0.52 0.73 -1.14 -0.85 0.00 0.00 174.74 174.74 3g6e s GLN 261 N -2.75 4.44 0.03 1.40 0.74 -1.26 -0.29 119.66 121.97 3g6e s GLN 261 Ca 0.22 0.93 0.05 0.00 0.05 0.00 0.00 55.36 56.61 3g6e s GLN 261 Cb -0.08 -3.46 -0.02 0.00 1.10 0.00 0.00 33.01 30.56 3g6e s GLN 261 CO 0.10 0.03 -0.16 1.03 -0.55 0.00 0.00 175.29 175.74 3g6e s ARG 262 N 0.90 1.13 -0.45 1.67 1.81 0.00 -4.97 118.95 119.04 3g6e s ARG 262 Ca 0.39 -0.76 0.03 0.00 -1.72 0.00 0.00 55.73 53.67 3g6e s ARG 262 Cb -0.18 -1.16 0.12 0.00 -0.45 0.00 0.00 34.95 33.28 3g6e s ARG 262 CO 0.19 0.30 0.18 0.99 -0.68 0.00 0.00 175.30 176.28 3g6e s THR 263 N -0.72 2.61 -0.32 0.02 2.01 -1.26 -1.12 115.64 116.86 3g6e s THR 263 Ca 0.04 -2.80 -0.29 0.00 0.31 0.00 0.00 61.69 58.96 3g6e s THR 263 Cb -0.08 -2.84 0.00 0.00 0.01 0.00 0.00 72.50 69.60 3g6e s THR 263 CO 0.01 -0.72 1.30 -0.70 -0.69 0.00 0.00 174.62 173.83 3g6e s GLU 264 N 0.33 3.87 0.54 4.92 2.56 0.71 -4.92 118.70 126.71 3g6e s GLU 264 Ca 0.14 1.18 -0.15 0.00 0.00 0.00 0.00 54.97 56.14 3g6e s GLU 264 Cb -0.22 -3.89 -0.07 0.00 2.00 0.00 0.00 34.13 31.94 3g6e s GLU 264 CO -0.04 -1.18 0.99 -0.51 -0.56 0.00 0.00 175.26 173.97 3g6e s LEU 265 N 4.48 3.53 -0.85 2.70 1.02 -1.26 -1.50 118.68 126.80 3g6e s LEU 265 Ca 0.56 1.52 -0.03 0.00 0.02 0.00 0.00 54.13 56.20 3g6e s LEU 265 Cb -0.16 -4.49 0.00 0.00 0.02 0.00 0.00 46.19 41.57 3g6e s LEU 265 CO 0.24 -0.65 0.62 0.59 0.02 0.00 0.00 176.35 177.17 3g6e n ASN 266 N -1.87 -5.15 -4.51 2.29 3.02 -1.23 -4.94 115.26 102.87 3g6e n ASN 266 Ca 0.06 -0.89 -0.36 0.00 -0.03 0.00 0.00 54.58 53.36 3g6e n ASN 266 Cb 0.54 -2.13 -0.12 0.00 -0.61 0.00 0.00 39.78 37.46 3g6e n ASN 266 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3g6e s LYS 267 N -4.93 3.76 0.05 3.52 -0.14 0.16 -4.88 119.74 117.28 3g6e s LYS 267 Ca 0.05 -0.43 -0.30 0.00 -1.36 0.00 0.00 55.97 53.92 3g6e s LYS 267 Cb -0.02 -3.31 -0.04 0.00 -1.68 0.00 0.00 37.83 32.77 3g6e s LYS 267 CO 0.88 -0.06 1.03 0.50 -0.76 0.00 0.00 175.35 176.95 3g6e s ARG 268 N 1.28 4.56 -0.54 1.68 3.52 -1.26 -0.09 118.95 128.10 3g6e s ARG 268 Ca 0.05 1.53 -0.22 0.00 -0.13 0.00 0.00 55.73 56.95 3g6e s ARG 268 Cb -0.15 -3.40 0.05 0.00 -1.56 0.00 0.00 34.95 29.89 3g6e s ARG 268 CO 0.04 -0.03 0.82 -0.51 -0.81 0.00 0.00 175.30 174.81 3g6e s LEU 269 N 0.71 4.47 0.11 -0.88 1.43 -0.75 -0.49 118.68 123.28 3g6e s LEU 269 Ca 0.52 -0.63 -0.15 0.00 -1.03 0.00 0.00 54.13 52.85 3g6e s LEU 269 Cb -0.24 -2.65 -0.06 0.00 0.03 0.00 0.00 46.19 43.28 3g6e s LEU 269 CO 0.29 -1.12 1.48 0.40 0.23 0.00 0.00 176.35 177.64 3g6e h ILE 270 N 5.96 1.29 -1.99 -0.59 1.08 -1.14 0.53 117.51 122.65 3g6e h ILE 270 Ca -0.27 -1.27 -0.05 0.00 -0.39 0.00 0.00 64.86 62.88 3g6e h ILE 270 Cb 1.08 1.39 -0.19 0.00 -3.07 0.00 0.00 36.82 36.03 3g6e h ILE 270 CO 1.05 0.41 0.19 -0.62 -0.69 0.00 0.00 178.15 178.49 3g6e s ASP 271 N -6.39 -0.67 -0.14 1.72 2.15 -1.23 -4.45 116.67 107.66 3g6e s ASP 271 Ca -0.13 0.84 -0.00 0.00 0.43 0.00 0.00 52.55 53.69 3g6e s ASP 271 Cb 0.09 0.70 0.02 0.00 -0.30 0.00 0.00 42.92 43.43 3g6e s ASP 271 CO 0.81 -0.54 -0.11 -0.63 -0.17 0.00 0.00 175.17 174.53 3g6e s ILE 272 N -0.92 1.33 0.00 4.11 1.01 -1.26 -0.66 121.20 124.82 3g6e s ILE 272 Ca -0.09 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.07 3g6e s ILE 272 Cb -0.01 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.17 3g6e s ILE 272 CO 0.08 0.41 0.00 0.61 0.00 0.00 0.00 174.94 176.04 3g6e n GLY 273 N 4.85 4.15 3.21 6.18 0.00 -0.64 -4.99 105.19 117.95 3g6e n GLY 273 Ca -0.15 -1.24 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 3g6e n GLY 273 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3g6e s GLU 274 N 0.29 0.48 0.00 1.61 2.12 -1.26 -1.08 118.70 120.86 3g6e s GLU 274 Ca 0.00 0.16 0.00 0.00 0.36 0.00 0.00 54.97 55.49 3g6e s GLU 274 Cb 0.00 0.22 0.00 0.00 0.26 0.00 0.00 34.13 34.61 3g6e s GLU 274 CO 0.00 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 3g6e n GLY 275 N 2.25 0.51 0.77 -1.50 0.00 -0.53 -4.78 105.19 101.91 3g6e n GLY 275 Ca -0.17 -2.23 0.05 0.00 0.00 0.00 0.00 46.02 43.67 3g6e n GLY 275 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3g6e n ASP 276 N 0.00 2.89 0.06 1.61 5.75 -1.26 -2.11 116.55 123.49 3g6e n ASP 276 Ca 0.00 -3.36 0.03 0.00 -0.01 0.00 0.00 54.79 51.44 3g6e n ASP 276 Cb 0.00 -0.55 0.40 0.00 -1.03 0.00 0.00 41.12 39.94 3g6e n ASP 276 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3g6e h GLU 277 N 1.07 0.40 -0.02 0.11 3.07 -1.86 -3.10 114.58 114.24 3g6e h GLU 277 Ca 0.07 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 3g6e h GLU 277 Cb 1.38 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.22 3g6e h GLU 277 CO 0.21 0.39 -0.35 -0.35 -1.40 0.00 0.00 179.01 177.51 3g6e n PRO 278 N -4.36 1.33 -1.78 2.33 -0.04 -1.26 -4.88 135.00 126.34 3g6e n PRO 278 Ca 0.01 -1.04 -0.41 0.00 -0.04 0.00 0.00 63.50 62.01 3g6e n PRO 278 Cb 0.18 -1.48 -0.01 0.00 -0.04 0.00 0.00 33.50 32.15 3g6e n PRO 278 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3g6e s THR 279 N -2.39 2.05 0.33 0.52 2.01 -1.18 -4.83 115.64 112.15 3g6e s THR 279 Ca 0.22 0.05 -0.16 0.00 0.31 0.00 0.00 61.69 62.11 3g6e s THR 279 Cb 0.19 -3.03 -0.09 0.00 0.01 0.00 0.00 72.50 69.58 3g6e s THR 279 CO 0.51 0.01 0.75 -0.69 -0.69 0.00 0.00 174.62 174.51 3g6e s VAL 280 N -0.16 4.66 0.08 3.82 1.01 -1.26 -4.59 120.40 123.94 3g6e s VAL 280 Ca 0.62 0.99 -0.31 0.00 0.00 0.00 0.00 61.98 63.29 3g6e s VAL 280 Cb -0.48 -3.62 -0.08 0.00 0.00 0.00 0.00 36.38 32.21 3g6e s VAL 280 CO 0.50 -0.18 1.48 -1.81 0.00 0.00 0.00 175.10 175.09 3g6e s ASP 281 N -2.25 6.75 0.00 3.32 1.01 0.34 -1.78 116.67 124.07 3g6e s ASP 281 Ca 0.54 2.34 0.00 0.00 0.71 0.00 0.00 52.55 56.14 3g6e s ASP 281 Cb -0.10 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.25 3g6e s ASP 281 CO 0.17 -0.75 0.00 0.61 0.21 0.00 0.00 175.17 175.41 3g6e n GLY 282 N 3.69 0.97 0.00 0.21 0.00 -1.26 -4.15 105.19 104.65 3g6e n GLY 282 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3g6e n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g6e n GLY 283 N -2.00 -1.34 3.71 -0.02 0.00 -0.73 -4.89 105.19 99.91 3g6e n GLY 283 Ca 0.00 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 3g6e n GLY 283 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g6e s PHE 284 N -3.22 2.98 0.13 1.61 0.40 0.73 -4.76 117.98 115.85 3g6e s PHE 284 Ca 0.00 0.71 -0.32 0.00 -0.60 0.00 0.00 56.93 56.72 3g6e s PHE 284 Cb 0.00 -3.81 -0.12 0.00 0.51 0.00 0.00 43.02 39.60 3g6e s PHE 284 CO 0.00 -3.01 1.76 0.28 0.70 0.00 0.00 175.22 174.95 3g6e n VAL 285 N 4.20 0.22 -1.11 -0.44 0.31 -1.26 -1.72 118.33 118.54 3g6e n VAL 285 Ca 0.13 -0.04 -0.04 0.00 -0.01 0.00 0.00 64.34 64.39 3g6e n VAL 285 Cb 0.41 -1.93 -0.02 0.00 -0.91 0.00 0.00 33.84 31.39 3g6e n VAL 285 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3g6e n ASN 286 N 4.86 -4.90 0.00 4.52 3.02 -1.26 -4.80 115.26 116.71 3g6e n ASN 286 Ca 0.18 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 3g6e n ASN 286 Cb 0.34 -2.72 0.00 0.00 -0.61 0.00 0.00 39.78 36.79 3g6e n ASN 286 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g6e n TYR 287 N -2.41 0.00 0.00 3.10 9.36 -0.70 -4.88 117.16 121.64 3g6e n TYR 287 Ca -0.04 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.18 3g6e n TYR 287 Cb 0.36 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.07 3g6e n TYR 287 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3g6e n GLY 288 N 3.45 -0.15 3.70 2.98 0.00 -0.72 -4.77 105.19 109.68 3g6e n GLY 288 Ca 0.00 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.71 3g6e n GLY 288 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g6e s GLU 289 N -2.00 3.19 -0.23 1.61 2.02 -1.26 -0.19 118.70 121.83 3g6e s GLU 289 Ca 0.00 -0.36 -0.09 0.00 0.02 0.00 0.00 54.97 54.54 3g6e s GLU 289 Cb 0.00 -2.90 -0.04 0.00 0.10 0.00 0.00 34.13 31.29 3g6e s GLU 289 CO 0.00 0.65 0.11 0.08 0.02 0.00 0.00 175.26 176.12 3g6e s VAL 290 N -0.72 4.93 -0.50 2.63 1.01 -1.26 -4.76 120.40 121.74 3g6e s VAL 290 Ca 0.12 0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.19 3g6e s VAL 290 Cb -0.12 -3.29 0.19 0.00 0.00 0.00 0.00 36.38 33.17 3g6e s VAL 290 CO 0.02 0.36 0.67 -0.67 0.00 0.00 0.00 175.10 175.49 3g6e n ASP 291 N 4.33 -2.82 0.00 3.32 2.03 -1.24 -4.26 116.55 117.91 3g6e n ASP 291 Ca -0.16 -2.85 0.00 0.00 0.52 0.00 0.00 54.79 52.30 3g6e n ASP 291 Cb 0.52 1.31 0.00 0.00 -0.72 0.00 0.00 41.12 42.23 3g6e n ASP 291 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3g6e n GLY 292 N 2.78 -0.80 3.67 0.27 0.00 -0.89 -4.83 105.19 105.39 3g6e n GLY 292 Ca 0.19 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 3g6e n GLY 292 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3g6e s PRO 293 N -0.64 4.19 0.29 1.61 0.02 -1.26 -1.46 135.00 137.76 3g6e s PRO 293 Ca 0.00 2.25 0.03 0.00 0.02 0.00 0.00 61.00 63.30 3g6e s PRO 293 Cb 0.00 -3.81 -0.06 0.00 0.02 0.00 0.00 34.50 30.65 3g6e s PRO 293 CO 0.00 -0.78 0.06 1.52 -0.33 0.00 0.00 177.00 177.46 3g6e s TYR 294 N 3.38 1.77 0.01 6.54 -0.85 -0.24 -0.44 117.35 127.52 3g6e s TYR 294 Ca 0.74 -1.01 0.00 0.00 -0.52 0.00 0.00 57.07 56.28 3g6e s TYR 294 Cb -0.36 -1.10 -0.01 0.00 0.38 0.00 0.00 41.96 40.87 3g6e s TYR 294 CO 0.31 -0.10 -0.02 0.99 -1.52 0.00 0.00 175.55 175.21 3g6e s THR 295 N -3.45 0.13 -0.31 -3.49 2.01 0.14 -1.62 115.64 109.05 3g6e s THR 295 Ca 0.35 -0.30 -0.02 0.00 0.31 0.00 0.00 61.69 62.04 3g6e s THR 295 Cb 0.08 -0.16 0.05 0.00 0.01 0.00 0.00 72.50 72.48 3g6e s THR 295 CO 0.14 -0.11 0.02 -0.76 -0.69 0.00 0.00 174.62 173.22 3g6e s LEU 296 N -0.43 4.04 -0.12 4.42 1.43 0.17 -1.50 118.68 126.70 3g6e s LEU 296 Ca -0.04 -1.34 -0.13 0.00 -1.03 0.00 0.00 54.13 51.59 3g6e s LEU 296 Cb -0.03 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 3g6e s LEU 296 CO -0.00 -0.29 0.31 -0.69 0.23 0.00 0.00 176.35 175.91 3g6e s VAL 297 N 1.25 5.27 0.05 -1.59 1.01 -0.51 -0.51 120.40 125.37 3g6e s VAL 297 Ca -0.04 0.59 -0.31 0.00 0.00 0.00 0.00 61.98 62.22 3g6e s VAL 297 Cb -0.20 -3.63 -0.08 0.00 0.00 0.00 0.00 36.38 32.47 3g6e s VAL 297 CO -0.01 0.46 1.62 -0.75 0.00 0.00 0.00 175.10 176.42 3g6e s LYS 298 N -0.04 4.21 2.90 2.72 2.20 0.36 -0.37 119.74 131.71 3g6e s LYS 298 Ca 0.18 2.28 0.00 0.00 -0.36 0.00 0.00 55.97 58.07 3g6e s LYS 298 Cb -0.14 -3.63 0.00 0.00 -1.51 0.00 0.00 37.83 32.56 3g6e s LYS 298 CO 0.06 -0.72 0.00 0.41 -0.36 0.00 0.00 175.35 174.74 3g6e n GLY 299 N 3.96 -0.47 3.89 5.54 0.00 -0.11 -4.62 105.19 113.37 3g6e n GLY 299 Ca 0.16 -1.11 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 3g6e n GLY 299 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g6e s SER 300 N -4.00 6.39 -0.02 1.61 1.04 -1.26 -3.08 113.70 114.38 3g6e s SER 300 Ca 0.00 1.08 0.01 0.00 0.48 0.00 0.00 55.95 57.51 3g6e s SER 300 Cb 0.00 -2.31 0.01 0.00 0.10 0.00 0.00 66.02 63.83 3g6e s SER 300 CO 0.00 -0.52 -0.01 -0.69 0.98 0.00 0.00 173.24 173.00 3g6e s VAL 301 N -2.60 0.22 0.54 5.02 1.01 -1.26 -5.02 120.40 118.31 3g6e s VAL 301 Ca 0.50 -0.01 -0.22 0.00 0.00 0.00 0.00 61.98 62.25 3g6e s VAL 301 Cb -0.10 -0.26 -0.06 0.00 0.00 0.00 0.00 36.38 35.96 3g6e s VAL 301 CO 0.39 0.12 1.26 -0.81 0.00 0.00 0.00 175.10 176.06 3g6e n PRO 302 N 3.67 1.55 0.00 2.72 -0.04 -1.26 -4.86 135.00 136.77 3g6e n PRO 302 Ca -0.21 0.57 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 3g6e n PRO 302 Cb 0.54 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 3g6e n PRO 302 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g6e n GLY 303 N 0.88 0.80 3.83 0.55 0.00 -1.25 -4.68 105.19 105.31 3g6e n GLY 303 Ca 0.11 -1.79 -0.25 0.00 0.00 0.00 0.00 46.02 44.09 3g6e n GLY 303 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3g6e n PRO 304 N 0.85 -0.55 -2.21 1.61 -0.04 -1.26 -4.74 135.00 128.65 3g6e n PRO 304 Ca 0.00 -2.44 -0.39 0.00 -0.04 0.00 0.00 63.50 60.63 3g6e n PRO 304 Cb 0.00 -0.92 -0.02 0.00 -0.04 0.00 0.00 33.50 32.52 3g6e n PRO 304 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3g6e s ASP 305 N -5.32 6.63 0.00 3.54 1.01 -1.26 -2.41 116.67 118.86 3g6e s ASP 305 Ca 0.69 2.51 0.00 0.00 0.71 0.00 0.00 52.55 56.46 3g6e s ASP 305 Cb -0.03 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.27 3g6e s ASP 305 CO 0.47 -0.61 0.00 0.29 0.21 0.00 0.00 175.17 175.53 3g6e n LYS 306 N 0.43 0.00 -2.83 8.23 5.02 0.34 -4.98 118.16 124.37 3g6e n LYS 306 Ca 0.02 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.95 3g6e n LYS 306 Cb 0.44 -0.79 -0.06 0.00 -0.02 0.00 0.00 35.03 34.60 3g6e n LYS 306 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3g6e s ARG 307 N -0.45 4.47 -0.24 1.97 3.52 -1.01 -4.66 118.95 122.54 3g6e s ARG 307 Ca 0.00 1.22 -0.29 0.00 -0.13 0.00 0.00 55.73 56.53 3g6e s ARG 307 Cb 0.00 -2.69 -0.01 0.00 -1.56 0.00 0.00 34.95 30.69 3g6e s ARG 307 CO 0.00 0.24 1.31 -1.17 -0.81 0.00 0.00 175.30 174.86 3g6e s LEU 308 N -2.27 4.00 0.07 -0.88 2.96 -1.26 -1.04 118.68 120.26 3g6e s LEU 308 Ca 0.52 1.42 0.04 0.00 -0.22 0.00 0.00 54.13 55.89 3g6e s LEU 308 Cb -0.16 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 3g6e s LEU 308 CO 0.21 -0.97 -0.01 0.68 -1.32 0.00 0.00 176.35 174.94 3g6e s VAL 309 N 4.09 3.96 0.04 1.68 -7.23 -0.80 -4.63 120.40 117.52 3g6e s VAL 309 Ca 0.57 -0.93 0.06 0.00 -1.81 0.00 0.00 61.98 59.87 3g6e s VAL 309 Cb -0.19 -2.85 -0.03 0.00 0.56 0.00 0.00 36.38 33.86 3g6e s VAL 309 CO 0.20 0.18 -0.14 -0.13 -0.31 0.00 0.00 175.10 174.90 3g6e s ARG 310 N -2.11 2.21 0.13 4.82 0.52 -0.22 -1.41 118.95 122.90 3g6e s ARG 310 Ca 0.24 -0.92 0.09 0.00 -0.52 0.00 0.00 55.73 54.62 3g6e s ARG 310 Cb -0.12 -2.29 -0.04 0.00 0.52 0.00 0.00 34.95 33.03 3g6e s ARG 310 CO 0.16 0.55 -0.18 -0.06 0.02 0.00 0.00 175.30 175.79 3g6e s PHE 311 N -0.98 2.52 -0.24 -0.53 0.40 0.11 -1.20 117.98 118.07 3g6e s PHE 311 Ca 0.16 -0.27 -0.25 0.00 -0.60 0.00 0.00 56.93 55.98 3g6e s PHE 311 Cb -0.11 -1.32 0.07 0.00 0.51 0.00 0.00 43.02 42.17 3g6e s PHE 311 CO 0.07 0.41 0.69 0.50 0.70 0.00 0.00 175.22 177.58 3g6e s ARG 312 N -2.26 0.83 0.23 0.44 3.00 -0.99 -1.61 118.95 118.59 3g6e s ARG 312 Ca 0.19 0.89 -0.31 0.00 -1.00 0.00 0.00 55.73 55.50 3g6e s ARG 312 Cb -0.10 0.40 -0.10 0.00 0.00 0.00 0.00 34.95 35.15 3g6e s ARG 312 CO 0.11 -0.12 1.53 -2.14 0.00 0.00 0.00 175.30 174.67 3g6e s PRO 313 N 0.20 4.21 -0.34 5.12 0.02 -1.26 -0.04 135.00 142.92 3g6e s PRO 313 Ca -0.01 2.40 -0.42 0.00 0.02 0.00 0.00 61.00 62.99 3g6e s PRO 313 Cb -0.04 -3.10 -0.17 0.00 0.02 0.00 0.00 34.50 31.21 3g6e s PRO 313 CO 0.02 -0.54 1.70 0.00 -0.33 0.00 0.00 177.00 177.85 3g6e n ALA 314 N 2.83 -0.54 0.22 -1.55 0.00 -0.47 -4.66 120.51 116.33 3g6e n ALA 314 Ca 0.09 0.42 0.11 0.00 0.00 0.00 0.00 53.44 54.06 3g6e n ALA 314 Cb 0.39 -2.14 0.30 0.00 0.00 0.00 0.00 19.45 18.00 3g6e n ALA 314 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 3g6e h VAL 315 N 5.14 0.25 -1.92 0.00 -1.51 -1.91 -3.39 116.25 112.92 3g6e h VAL 315 Ca -0.46 -1.14 -0.49 0.00 -1.23 0.00 0.00 66.70 63.38 3g6e h VAL 315 Cb 1.33 1.93 -0.33 0.00 -2.13 0.00 0.00 31.29 32.09 3g6e h VAL 315 CO 0.96 0.13 -0.90 -2.11 -1.23 0.00 0.00 177.57 174.42 3g6e n ARG 316 N -3.17 0.39 -2.91 5.19 1.85 -1.26 -4.97 116.66 111.78 3g6e n ARG 316 Ca 0.02 -2.91 -0.33 0.00 -1.00 0.00 0.00 57.85 53.63 3g6e n ARG 316 Cb 0.50 -1.52 -0.07 0.00 -1.05 0.00 0.00 32.46 30.32 3g6e n ARG 316 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 3g6e s PRO 317 N -0.04 4.20 -0.22 2.89 0.02 -1.26 -4.82 135.00 135.77 3g6e s PRO 317 Ca 0.33 1.01 0.05 0.00 0.02 0.00 0.00 61.00 62.40 3g6e s PRO 317 Cb 0.07 -2.33 -0.20 0.00 0.02 0.00 0.00 34.50 32.07 3g6e s PRO 317 CO -0.16 0.06 -0.05 0.09 -0.33 0.00 0.00 177.00 176.62 3g6e n ASN 318 N -0.41 1.54 -4.86 2.53 3.02 -1.26 -5.00 115.26 110.82 3g6e n ASN 318 Ca 0.05 -0.04 -0.22 0.00 -0.03 0.00 0.00 54.58 54.34 3g6e n ASN 318 Cb 0.53 -0.16 -0.04 0.00 -0.61 0.00 0.00 39.78 39.50 3g6e n ASN 318 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3g6e s ASP 319 N -6.36 5.72 0.26 6.41 1.01 -1.26 -5.11 116.67 117.34 3g6e s ASP 319 Ca -0.27 -0.15 -0.26 0.00 0.71 0.00 0.00 52.55 52.58 3g6e s ASP 319 Cb 0.08 -1.52 -0.09 0.00 1.01 0.00 0.00 42.92 42.39 3g6e s ASP 319 CO 0.68 -0.03 0.88 -1.58 0.21 0.00 0.00 175.17 175.33 3g6e s GLN 320 N -3.76 4.59 0.14 8.23 2.00 -1.26 -5.00 119.66 124.59 3g6e s GLN 320 Ca 0.33 1.26 -0.31 0.00 -2.00 0.00 0.00 55.36 54.64 3g6e s GLN 320 Cb -0.08 -3.01 -0.10 0.00 0.80 0.00 0.00 33.01 30.62 3g6e s GLN 320 CO 0.26 0.41 1.67 -2.14 -0.50 0.00 0.00 175.29 174.98 3g6e s PRO 321 N -1.68 4.18 -0.62 1.67 0.02 -1.26 -4.96 135.00 132.35 3g6e s PRO 321 Ca 0.44 2.44 -0.01 0.00 0.02 0.00 0.00 61.00 63.90 3g6e s PRO 321 Cb -0.21 -3.36 0.16 0.00 0.02 0.00 0.00 34.50 31.11 3g6e s PRO 321 CO 0.26 -0.72 0.42 1.03 -0.33 0.00 0.00 177.00 177.66 3g6e s ARG 322 N 1.90 2.46 0.56 5.54 0.52 -1.25 -5.08 118.95 123.60 3g6e s ARG 322 Ca 0.74 -2.63 -0.21 0.00 -0.52 0.00 0.00 55.73 53.11 3g6e s ARG 322 Cb -0.44 -3.63 -0.04 0.00 0.52 0.00 0.00 34.95 31.35 3g6e s ARG 322 CO 0.33 -1.17 1.29 -0.51 0.02 0.00 0.00 175.30 175.26 3g6e s LEU 323 N -0.26 3.79 -0.52 2.53 1.43 -1.26 -4.48 118.68 119.91 3g6e s LEU 323 Ca 0.18 2.61 -0.32 0.00 -1.03 0.00 0.00 54.13 55.57 3g6e s LEU 323 Cb -0.21 -4.39 0.05 0.00 0.03 0.00 0.00 46.19 41.67 3g6e s LEU 323 CO -0.03 -1.56 0.66 0.47 0.23 0.00 0.00 176.35 176.11 3g6e n ASP 324 N -1.21 -5.46 -4.77 2.29 9.92 0.26 -4.93 116.55 112.66 3g6e n ASP 324 Ca 0.11 -0.28 -0.41 0.00 -0.53 0.00 0.00 54.79 53.68 3g6e n ASP 324 Cb 0.47 -1.77 -0.02 0.00 -0.64 0.00 0.00 41.12 39.16 3g6e n ASP 324 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 3g6e s PRO 325 N -2.90 4.36 -0.36 -0.24 0.02 -1.26 -4.95 135.00 129.67 3g6e s PRO 325 Ca 0.31 2.21 -0.29 0.00 0.02 0.00 0.00 61.00 63.25 3g6e s PRO 325 Cb -0.03 -3.08 0.01 0.00 0.02 0.00 0.00 34.50 31.41 3g6e s PRO 325 CO 0.88 -0.20 1.36 -2.00 -0.33 0.00 0.00 177.00 176.71 3g6e s GLU 326 N -1.63 3.74 -0.51 5.54 2.12 -1.26 -4.97 118.70 121.73 3g6e s GLU 326 Ca 0.50 1.09 -0.20 0.00 0.36 0.00 0.00 54.97 56.71 3g6e s GLU 326 Cb -0.40 -3.96 0.05 0.00 0.26 0.00 0.00 34.13 30.09 3g6e s GLU 326 CO 0.51 -1.35 0.68 0.08 -0.54 0.00 0.00 175.26 174.64 3g6e s VAL 327 N 4.92 4.79 0.06 3.70 1.01 -1.26 -2.14 120.40 131.48 3g6e s VAL 327 Ca 0.59 -0.34 -0.13 0.00 0.00 0.00 0.00 61.98 62.10 3g6e s VAL 327 Cb -0.15 -4.33 -0.28 0.00 0.00 0.00 0.00 36.38 31.62 3g6e s VAL 327 CO 0.28 -0.85 1.13 0.03 0.00 0.00 0.00 175.10 175.69 3g6e h ARG 328 N 9.04 0.60 -2.48 2.72 2.47 -1.77 -3.48 114.38 121.49 3g6e h ARG 328 Ca -0.27 -0.79 -0.09 0.00 -1.26 0.00 0.00 59.98 57.58 3g6e h ARG 328 Cb 1.09 0.26 -0.20 0.00 -1.65 0.00 0.00 29.97 29.46 3g6e h ARG 328 CO 0.98 1.35 -0.05 -0.47 0.56 0.00 0.00 179.97 182.34 3g6e s TYR 329 N -3.02 -0.48 -0.08 3.04 5.04 -1.12 -4.98 117.35 115.75 3g6e s TYR 329 Ca -0.09 0.94 0.02 0.00 -2.44 0.00 0.00 57.07 55.50 3g6e s TYR 329 Cb 0.06 0.24 0.01 0.00 0.35 0.00 0.00 41.96 42.62 3g6e s TYR 329 CO 0.93 -0.44 -0.14 0.08 -1.34 0.00 0.00 175.55 174.64 3g6e s VAL 330 N -0.79 1.30 0.10 3.14 1.01 -1.26 -0.39 120.40 123.51 3g6e s VAL 330 Ca -0.09 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.04 3g6e s VAL 330 Cb -0.03 -1.19 -0.06 0.00 0.00 0.00 0.00 36.38 35.11 3g6e s VAL 330 CO 0.05 0.40 1.02 -0.55 0.00 0.00 0.00 175.10 176.02 3g6e s SER 331 N 0.77 7.38 0.00 3.32 0.15 -0.43 -4.92 113.70 119.96 3g6e s SER 331 Ca -0.12 1.86 0.02 0.00 0.70 0.00 0.00 55.95 58.41 3g6e s SER 331 Cb -0.16 -2.59 0.06 0.00 -1.71 0.00 0.00 66.02 61.62 3g6e s SER 331 CO 0.02 -0.18 0.92 0.59 1.20 0.00 0.00 173.24 175.79 3g6e n ASN 332 N 3.04 1.93 -4.78 5.45 3.02 -1.26 -4.67 115.26 117.99 3g6e n ASN 332 Ca 0.04 -1.75 -0.41 0.00 -0.03 0.00 0.00 54.58 52.44 3g6e n ASN 332 Cb 0.49 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.62 3g6e n ASN 332 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3g6e s GLU 333 N -0.78 4.04 0.23 3.52 2.12 -1.26 -0.50 118.70 126.08 3g6e s GLU 333 Ca 0.05 2.50 -0.31 0.00 0.36 0.00 0.00 54.97 57.56 3g6e s GLU 333 Cb 0.03 -2.91 -0.14 0.00 0.26 0.00 0.00 34.13 31.37 3g6e s GLU 333 CO 0.03 -0.56 1.31 0.45 -0.54 0.00 0.00 175.26 175.96 3g6e n SER 334 N 0.35 2.32 0.00 -1.70 2.88 -1.26 -4.21 113.62 112.00 3g6e n SER 334 Ca 0.02 1.15 0.15 0.00 -1.33 0.00 0.00 58.87 58.86 3g6e n SER 334 Cb 0.40 -1.37 0.80 0.00 -0.75 0.00 0.00 64.21 63.29 3g6e n SER 334 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3g6e n ASN 335 N 1.96 0.00 -4.57 -3.46 3.02 -1.26 -4.63 115.26 106.33 3g6e n ASN 335 Ca 0.12 -0.38 -0.36 0.00 -0.03 0.00 0.00 54.58 53.93 3g6e n ASN 335 Cb 0.30 -0.20 -0.11 0.00 -0.61 0.00 0.00 39.78 39.16 3g6e n ASN 335 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3g6e s GLN 336 N -2.41 3.88 0.00 3.52 -0.21 -1.26 -5.03 119.66 118.15 3g6e s GLN 336 Ca 0.34 -0.38 0.00 0.00 0.02 0.00 0.00 55.36 55.34 3g6e s GLN 336 Cb 0.20 -3.35 0.00 0.00 1.00 0.00 0.00 33.01 30.87 3g6e s GLN 336 CO 0.43 0.03 0.00 0.41 -2.12 0.00 0.00 175.29 174.04